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PHIPA_C2_apo_sites.pdb
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PHIPA_C2_apo_sites.pdb
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HEADER ---- 16-APR-15 xxxx
COMPND ---
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : REFMAC 5.8.0158
REMARK 3 AUTHORS : MURSHUDOV,SKUBAK,LEBEDEV,PANNU,
REMARK 3 STEINER,NICHOLLS,WINN,LONG,VAGIN
REMARK 3
REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD
REMARK 3
REMARK 3 DATA USED IN REFINEMENT.
REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.07
REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 14.51
REMARK 3 DATA CUTOFF (SIGMA(F)) : NONE
REMARK 3 COMPLETENESS FOR RANGE (%) : 76.29
REMARK 3 NUMBER OF REFLECTIONS : 38409
REMARK 3
REMARK 3 FIT TO DATA USED IN REFINEMENT.
REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT
REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM
REMARK 3 R VALUE (WORKING + TEST SET) : 0.12397
REMARK 3 R VALUE (WORKING SET) : 0.12319
REMARK 3 FREE R VALUE : 0.13928
REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.9
REMARK 3 FREE R VALUE TEST SET COUNT : 1990
REMARK 3
REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN.
REMARK 3 TOTAL NUMBER OF BINS USED : 20
REMARK 3 BIN RESOLUTION RANGE HIGH : 1.072
REMARK 3 BIN RESOLUTION RANGE LOW : 1.100
REMARK 3 REFLECTION IN BIN (WORKING SET) : 322
REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 8.77
REMARK 3 BIN R VALUE (WORKING SET) : 0.204
REMARK 3 BIN FREE R VALUE SET COUNT : 14
REMARK 3 BIN FREE R VALUE : 0.274
REMARK 3
REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.
REMARK 3 ALL ATOMS : 1287
REMARK 3
REMARK 3 B VALUES.
REMARK 3 FROM WILSON PLOT (A**2) : NULL
REMARK 3 MEAN B VALUE (OVERALL, A**2) : 15.570
REMARK 3 OVERALL ANISOTROPIC B VALUE.
REMARK 3 B11 (A**2) : 0.40
REMARK 3 B22 (A**2) : 0.68
REMARK 3 B33 (A**2) : -1.02
REMARK 3 B12 (A**2) : -0.00
REMARK 3 B13 (A**2) : 0.04
REMARK 3 B23 (A**2) : 0.00
REMARK 3
REMARK 3 ESTIMATED OVERALL COORDINATE ERROR.
REMARK 3 ESU BASED ON R VALUE (A): 0.032
REMARK 3 ESU BASED ON FREE R VALUE (A): 0.030
REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.017
REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 0.802
REMARK 3
REMARK 3 CORRELATION COEFFICIENTS.
REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.980
REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.977
REMARK 3
REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT
REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1112 ; 0.013 ; 0.019
REMARK 3 BOND LENGTHS OTHERS (A): 992 ; 0.003 ; 0.020
REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 1509 ; 1.652 ; 1.973
REMARK 3 BOND ANGLES OTHERS (DEGREES): 2315 ; 1.053 ; 3.000
REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 138 ; 5.543 ; 5.000
REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 56 ;26.695 ;23.571
REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 194 ;11.847 ;15.000
REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 9 ;12.753 ;15.000
REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 157 ; 0.102 ; 0.200
REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1269 ; 0.009 ; 0.021
REMARK 3 GENERAL PLANES OTHERS (A): 244 ; 0.002 ; 0.020
REMARK 3
REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT
REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 528 ; 1.042 ; 1.227
REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): 527 ; 1.039 ; 1.224
REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 674 ; 1.439 ; 1.854
REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2) : 675 ; 1.438 ; 1.857
REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 584 ; 5.369 ; 1.566
REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2) : 584 ; 5.369 ; 1.566
REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2) : 836 ; 6.063 ; 2.247
REMARK 3 LONG RANGE B REFINED ATOMS (A**2) : 1392 ; 5.282 ;16.792
REMARK 3 LONG RANGE B OTHER ATOMS (A**2) : 1393 ; 5.281 ;16.803
REMARK 3
REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT
REMARK 3 RIGID-BOND RESTRAINTS (A**2): 2104 ; 1.974 ; 3.000
REMARK 3 SPHERICITY; FREE ATOMS (A**2): 135 ;27.197 ; 5.000
REMARK 3 SPHERICITY; BONDED ATOMS (A**2): 2144 ;11.286 ; 5.000
REMARK 3
REMARK 3 NCS RESTRAINTS STATISTICS
REMARK 3 NUMBER OF NCS GROUPS : NULL
REMARK 3
REMARK 3 TWIN DETAILS
REMARK 3 NUMBER OF TWIN DOMAINS : NULL
REMARK 3
REMARK 3
REMARK 3 TLS DETAILS
REMARK 3 NUMBER OF TLS GROUPS : NULL
REMARK 3
REMARK 3
REMARK 3 BULK SOLVENT MODELLING.
REMARK 3 METHOD USED : MASK
REMARK 3 PARAMETERS FOR MASK CALCULATION
REMARK 3 VDW PROBE RADIUS : 1.20
REMARK 3 ION PROBE RADIUS : 0.80
REMARK 3 SHRINKAGE RADIUS : 0.80
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS:
REMARK 3 HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
REMARK 3 U VALUES : REFINED INDIVIDUALLY
REMARK 3
CRYST1 81.490 27.020 55.940 90.00 100.50 90.00 C 1 2 1
SCALE1 0.012271 0.000000 0.002274 0.00000
SCALE2 -0.000000 0.037010 0.000000 0.00000
SCALE3 0.000000 -0.000000 0.018181 0.00000
ATOM 1 N SER A1315 -11.816 11.644 -11.006 1.00 31.19 N
ANISOU 1 N SER A1315 2960 5018 3871 -399 -419 34 N
ATOM 2 CA SER A1315 -10.763 12.089 -10.062 1.00 27.08 C
ANISOU 2 CA SER A1315 3050 4119 3118 -262 -152 172 C
ATOM 3 CB SER A1315 -11.234 11.869 -8.627 1.00 27.42 C
ANISOU 3 CB SER A1315 2889 4518 3009 372 -69 151 C
ATOM 4 OG SER A1315 -10.181 11.443 -7.817 1.00 35.22 O
ANISOU 4 OG SER A1315 2697 5708 4977 -345 -1359 -563 O
ATOM 5 C SER A1315 -9.469 11.331 -10.279 1.00 22.31 C
ANISOU 5 C SER A1315 2378 3510 2589 -775 -221 459 C
ATOM 6 O SER A1315 -9.457 10.107 -10.319 1.00 24.70 O
ANISOU 6 O SER A1315 2525 3689 3169 -727 -900 840 O
ATOM 7 N ATYR A1316 -8.378 12.089 -10.399 0.70 16.33 N
ANISOU 7 N ATYR A1316 1760 2505 1938 -98 -414 -87 N
ATOM 8 N BTYR A1316 -8.325 11.955 -10.432 0.30 17.12 N
ANISOU 8 N BTYR A1316 1914 2470 2119 -159 -481 35 N
ATOM 9 CA ATYR A1316 -7.083 11.478 -10.632 0.70 14.61 C
ANISOU 9 CA ATYR A1316 1818 2418 1316 -26 -253 -198 C
ATOM 10 CA BTYR A1316 -7.181 11.064 -10.292 0.30 15.35 C
ANISOU 10 CA BTYR A1316 1751 2537 1541 -129 -390 -15 C
ATOM 11 CB ATYR A1316 -6.532 11.971 -11.968 0.70 16.26 C
ANISOU 11 CB ATYR A1316 2126 2482 1566 -221 -361 219 C
ATOM 12 CB BTYR A1316 -6.776 10.370 -11.629 0.30 15.15 C
ANISOU 12 CB BTYR A1316 1701 2381 1671 -192 -411 -143 C
ATOM 13 CG ATYR A1316 -7.442 11.644 -13.092 0.70 17.55 C
ANISOU 13 CG ATYR A1316 2150 2798 1718 -288 -335 126 C
ATOM 14 CG BTYR A1316 -7.897 9.728 -12.481 0.30 15.86 C
ANISOU 14 CG BTYR A1316 1792 2405 1829 -157 -621 -54 C
ATOM 15 CD1ATYR A1316 -7.474 10.350 -13.655 0.70 19.33 C
ANISOU 15 CD1ATYR A1316 2488 2963 1892 280 -643 -54 C
ATOM 16 CD1BTYR A1316 -8.774 8.740 -11.990 0.30 16.55 C
ANISOU 16 CD1BTYR A1316 1994 2180 2114 -116 -760 8 C
ATOM 17 CE1ATYR A1316 -8.329 10.055 -14.695 0.70 21.91 C
ANISOU 17 CE1ATYR A1316 2835 3561 1926 451 -790 -369 C
ATOM 18 CE1BTYR A1316 -9.782 8.202 -12.787 0.30 18.48 C
ANISOU 18 CE1BTYR A1316 2370 2463 2188 -212 -913 -164 C
ATOM 19 CZ ATYR A1316 -9.140 11.052 -15.181 0.70 21.61 C
ANISOU 19 CZ ATYR A1316 2456 3685 2070 286 -891 -140 C
ATOM 20 CZ BTYR A1316 -9.884 8.616 -14.087 0.30 17.38 C
ANISOU 20 CZ BTYR A1316 1807 2593 2202 -74 -1293 -209 C
ATOM 21 OH ATYR A1316 -9.974 10.751 -16.222 0.70 27.94 O
ANISOU 21 OH ATYR A1316 2991 5025 2599 -327 -1259 -321 O
ATOM 22 OH BTYR A1316 -10.855 8.094 -14.926 0.30 17.21 O
ANISOU 22 OH BTYR A1316 2646 1807 2085 -707 -1140 -346 O
ATOM 23 CE2BTYR A1316 -9.018 9.557 -14.595 0.30 18.82 C
ANISOU 23 CE2BTYR A1316 2237 2612 2303 -69 -818 -235 C
ATOM 24 CE2ATYR A1316 -9.139 12.333 -14.649 0.70 22.77 C
ANISOU 24 CE2ATYR A1316 2842 3364 2443 11 -1007 276 C
ATOM 25 CD2BTYR A1316 -8.032 10.097 -13.800 0.30 16.55 C
ANISOU 25 CD2BTYR A1316 2083 2275 1929 3 -652 -18 C
ATOM 26 CD2ATYR A1316 -8.291 12.623 -13.602 0.70 20.94 C
ANISOU 26 CD2ATYR A1316 2983 2926 2048 -52 -685 244 C
ATOM 27 C ATYR A1316 -6.052 11.730 -9.528 0.70 13.23 C
ANISOU 27 C ATYR A1316 1176 2410 1440 -32 -124 -42 C
ATOM 28 C BTYR A1316 -6.020 11.673 -9.490 0.30 13.57 C
ANISOU 28 C BTYR A1316 1328 2430 1395 6 -184 20 C
ATOM 29 O ATYR A1316 -5.067 11.042 -9.467 0.70 13.79 O
ANISOU 29 O ATYR A1316 1321 2285 1630 77 -249 -299 O
ATOM 30 O BTYR A1316 -4.930 11.132 -9.531 0.30 14.08 O
ANISOU 30 O BTYR A1316 1388 2267 1692 45 -217 -190 O
ATOM 31 N ASP A1317 -6.263 12.738 -8.718 1.00 12.88 N
ANISOU 31 N ASP A1317 1111 2485 1297 13 -186 56 N
ATOM 32 CA ASP A1317 -5.226 13.256 -7.811 1.00 12.32 C
ANISOU 32 CA ASP A1317 1068 2359 1252 -24 -69 86 C
ATOM 33 CB ASP A1317 -5.442 14.752 -7.593 1.00 13.23 C
ANISOU 33 CB ASP A1317 1317 2271 1437 263 -123 112 C
ATOM 34 CG ASP A1317 -4.408 15.401 -6.712 1.00 13.14 C
ANISOU 34 CG ASP A1317 1272 2337 1384 72 62 142 C
ATOM 35 OD1 ASP A1317 -3.761 14.724 -5.929 1.00 13.22 O
ANISOU 35 OD1 ASP A1317 1521 2043 1457 -212 -109 202 O
ATOM 36 OD2 ASP A1317 -4.232 16.648 -6.811 1.00 16.87 O
ANISOU 36 OD2 ASP A1317 1678 2403 2326 34 -213 229 O
ATOM 37 C ASP A1317 -5.295 12.474 -6.494 1.00 11.52 C
ANISOU 37 C ASP A1317 930 2240 1204 -213 -54 37 C
ATOM 38 O ASP A1317 -6.244 12.625 -5.720 1.00 12.78 O
ANISOU 38 O ASP A1317 1091 2483 1279 -23 50 128 O
ATOM 39 N AILE A1318 -4.281 11.619 -6.288 0.50 11.08 N
ANISOU 39 N AILE A1318 1048 1934 1226 -200 -45 2 N
ATOM 40 N BILE A1318 -4.307 11.633 -6.228 0.50 10.82 N
ANISOU 40 N BILE A1318 1033 1907 1169 -210 -46 40 N
ATOM 41 CA AILE A1318 -4.133 10.702 -5.130 0.50 11.49 C
ANISOU 41 CA AILE A1318 1224 1881 1260 -281 -81 -19 C
ATOM 42 CA BILE A1318 -4.372 10.794 -5.026 0.50 10.58 C
ANISOU 42 CA BILE A1318 1128 1583 1308 -149 -138 25 C
ATOM 43 CB AILE A1318 -2.913 9.753 -5.337 0.50 13.06 C
ANISOU 43 CB AILE A1318 1927 1547 1488 -43 -78 -167 C
ATOM 44 CB BILE A1318 -3.669 9.477 -5.238 0.50 11.16 C
ANISOU 44 CB BILE A1318 1408 1491 1340 -53 -392 67 C
ATOM 45 CG1AILE A1318 -3.049 8.870 -6.588 0.50 11.70 C
ANISOU 45 CG1AILE A1318 1322 1819 1302 -78 18 -139 C
ATOM 46 CG1BILE A1318 -2.206 9.694 -5.580 0.50 11.70 C
ANISOU 46 CG1BILE A1318 1381 1523 1541 238 -224 -74 C
ATOM 47 CD1AILE A1318 -1.757 8.237 -7.052 0.50 12.85 C
ANISOU 47 CD1AILE A1318 1468 2009 1403 79 173 11 C
ATOM 48 CD1BILE A1318 -1.410 8.428 -5.709 0.50 11.25 C
ANISOU 48 CD1BILE A1318 1176 1504 1594 162 -190 -89 C
ATOM 49 CG2AILE A1318 -2.691 8.891 -4.123 0.50 13.89 C
ANISOU 49 CG2AILE A1318 1857 1825 1592 -18 136 -67 C
ATOM 50 CG2BILE A1318 -4.392 8.761 -6.355 0.50 11.45 C
ANISOU 50 CG2BILE A1318 1458 1367 1526 -161 -257 -114 C
ATOM 51 C AILE A1318 -3.915 11.483 -3.822 0.50 10.75 C
ANISOU 51 C AILE A1318 1110 1741 1231 -64 -39 -16 C
ATOM 52 C BILE A1318 -3.910 11.494 -3.777 0.50 10.63 C
ANISOU 52 C BILE A1318 1089 1732 1214 -70 -84 0 C
ATOM 53 O AILE A1318 -4.143 10.936 -2.762 0.50 12.73 O
ANISOU 53 O AILE A1318 1865 1685 1286 78 44 5 O
ATOM 54 O BILE A1318 -3.992 10.925 -2.710 0.50 12.76 O
ANISOU 54 O BILE A1318 1904 1613 1327 65 -1 34 O
ATOM 55 N GLN A1319 -3.489 12.758 -3.899 1.00 10.17 N
ANISOU 55 N GLN A1319 867 1776 1220 -96 -104 -21 N
ATOM 56 CA GLN A1319 -3.210 13.581 -2.714 1.00 10.56 C
ANISOU 56 CA GLN A1319 1044 1768 1199 -64 -132 -35 C
ATOM 57 CB GLN A1319 -1.909 14.402 -2.889 1.00 11.64 C
ANISOU 57 CB GLN A1319 925 2074 1422 -86 -131 -80 C
ATOM 58 CG GLN A1319 -0.614 13.596 -2.727 1.00 12.14 C
ANISOU 58 CG GLN A1319 989 2236 1386 16 -205 -53 C
ATOM 59 CD GLN A1319 -0.103 12.975 -4.001 1.00 11.58 C
ANISOU 59 CD GLN A1319 944 2068 1387 15 -198 69 C
ATOM 60 OE1 GLN A1319 0.025 13.640 -5.034 1.00 12.19 O
ANISOU 60 OE1 GLN A1319 1127 2081 1421 70 -64 115 O
ATOM 61 NE2 GLN A1319 0.260 11.708 -3.934 1.00 12.32 N
ANISOU 61 NE2 GLN A1319 1093 2068 1520 106 -6 89 N
ATOM 62 C GLN A1319 -4.341 14.533 -2.328 1.00 10.30 C
ANISOU 62 C GLN A1319 847 1817 1249 -146 -72 12 C
ATOM 63 O GLN A1319 -4.281 15.090 -1.241 1.00 10.72 O
ANISOU 63 O GLN A1319 1118 1658 1296 -112 -127 -1 O
ATOM 64 N ALA A1320 -5.350 14.706 -3.181 1.00 10.75 N
ANISOU 64 N ALA A1320 930 1927 1224 -9 -65 110 N
ATOM 65 CA ALA A1320 -6.346 15.752 -3.007 1.00 11.37 C
ANISOU 65 CA ALA A1320 1025 1946 1346 27 -11 242 C
ATOM 66 CB ALA A1320 -7.255 15.802 -4.234 1.00 12.93 C
ANISOU 66 CB ALA A1320 1243 2199 1468 336 -100 245 C
ATOM 67 C ALA A1320 -7.171 15.617 -1.737 1.00 10.51 C
ANISOU 67 C ALA A1320 960 1663 1369 8 24 132 C
ATOM 68 O ALA A1320 -7.683 16.604 -1.208 1.00 11.46 O
ANISOU 68 O ALA A1320 1177 1698 1477 90 34 106 O
ATOM 69 N TRP A1321 -7.324 14.371 -1.252 1.00 9.78 N
ANISOU 69 N TRP A1321 921 1511 1282 -30 -31 38 N
ATOM 70 CA TRP A1321 -8.114 14.120 -0.062 1.00 9.84 C
ANISOU 70 CA TRP A1321 966 1540 1233 -31 -63 47 C
ATOM 71 CB TRP A1321 -8.090 12.636 0.295 1.00 9.87 C
ANISOU 71 CB TRP A1321 1031 1437 1280 -59 -43 -89 C
ATOM 72 CG TRP A1321 -6.715 12.158 0.681 1.00 9.85 C
ANISOU 72 CG TRP A1321 996 1443 1301 -172 -110 38 C
ATOM 73 CD1 TRP A1321 -5.733 11.741 -0.159 1.00 11.07 C
ANISOU 73 CD1 TRP A1321 1157 1757 1293 -4 -120 8 C
ATOM 74 NE1 TRP A1321 -4.594 11.429 0.548 1.00 11.47 N
ANISOU 74 NE1 TRP A1321 1144 1848 1364 178 -88 -58 N
ATOM 75 CE2 TRP A1321 -4.833 11.637 1.887 1.00 10.79 C
ANISOU 75 CE2 TRP A1321 1045 1766 1287 -5 -143 2 C
ATOM 76 CD2 TRP A1321 -6.163 12.098 2.014 1.00 9.77 C
ANISOU 76 CD2 TRP A1321 1045 1432 1234 -117 -96 1 C
ATOM 77 CE3 TRP A1321 -6.655 12.377 3.287 1.00 10.08 C
ANISOU 77 CE3 TRP A1321 1071 1415 1341 -59 -32 -37 C
ATOM 78 CZ3 TRP A1321 -5.832 12.188 4.386 1.00 10.94 C
ANISOU 78 CZ3 TRP A1321 1396 1532 1226 -230 -124 -78 C
ATOM 79 CH2 TRP A1321 -4.511 11.750 4.223 1.00 11.93 C
ANISOU 79 CH2 TRP A1321 1422 1774 1335 -119 -315 91 C
ATOM 80 CZ2 TRP A1321 -4.004 11.460 2.990 1.00 11.86 C
ANISOU 80 CZ2 TRP A1321 1273 1822 1410 38 -273 91 C
ATOM 81 C TRP A1321 -7.661 14.939 1.134 1.00 10.43 C
ANISOU 81 C TRP A1321 1048 1655 1257 -66 -55 -15 C
ATOM 82 O TRP A1321 -8.481 15.237 2.014 1.00 10.58 O
ANISOU 82 O TRP A1321 1090 1523 1407 -129 115 -44 O
ATOM 83 N LYS A1322 -6.366 15.246 1.232 1.00 10.07 N
ANISOU 83 N LYS A1322 1052 1537 1234 -129 -12 20 N
ATOM 84 CA LYS A1322 -5.869 15.829 2.469 1.00 10.01 C
ANISOU 84 CA LYS A1322 1072 1405 1325 -169 -111 1 C
ATOM 85 CB LYS A1322 -4.344 15.817 2.473 1.00 10.31 C
ANISOU 85 CB LYS A1322 1050 1470 1398 -142 -154 36 C
ATOM 86 CG LYS A1322 -3.741 16.438 3.724 1.00 11.03 C
ANISOU 86 CG LYS A1322 1262 1500 1429 -99 -121 -60 C
ATOM 87 CD LYS A1322 -2.254 16.160 3.840 1.00 12.03 C
ANISOU 87 CD LYS A1322 1225 1930 1414 -103 -90 -64 C
ATOM 88 CE LYS A1322 -1.645 16.736 5.099 1.00 12.16 C
ANISOU 88 CE LYS A1322 1313 1807 1500 -137 -193 -53 C
ATOM 89 NZ LYS A1322 -0.171 16.439 5.087 1.00 13.10 N
ANISOU 89 NZ LYS A1322 1358 1820 1799 -116 -276 -180 N
ATOM 90 C LYS A1322 -6.456 17.234 2.648 1.00 10.63 C
ANISOU 90 C LYS A1322 1164 1494 1378 -86 -5 25 C
ATOM 91 O LYS A1322 -7.020 17.548 3.699 1.00 11.17 O
ANISOU 91 O LYS A1322 1293 1554 1395 -83 71 0 O
ATOM 92 N LYS A1323 -6.352 18.077 1.618 1.00 11.10 N
ANISOU 92 N LYS A1323 1305 1440 1473 -139 132 16 N
ATOM 93 CA LYS A1323 -6.954 19.419 1.716 1.00 11.78 C
ANISOU 93 CA LYS A1323 1364 1483 1628 -142 87 71 C
ATOM 94 CB LYS A1323 -6.581 20.256 0.487 1.00 14.24 C
ANISOU 94 CB LYS A1323 1642 1862 1907 -316 279 305 C
ATOM 95 CG LYS A1323 -6.940 21.724 0.610 1.00 21.23 C
ANISOU 95 CG LYS A1323 2728 2240 3097 127 507 320 C
ATOM 96 CD LYS A1323 -6.540 22.541 -0.610 1.00 27.72 C
ANISOU 96 CD LYS A1323 3815 2816 3900 -119 387 1191 C
ATOM 97 C LYS A1323 -8.463 19.328 1.854 1.00 11.32 C
ANISOU 97 C LYS A1323 1252 1508 1539 -93 77 40 C
ATOM 98 O LYS A1323 -9.063 20.158 2.537 1.00 12.27 O
ANISOU 98 O LYS A1323 1505 1470 1684 -13 198 106 O
ATOM 99 N GLN A1324 -9.083 18.366 1.158 1.00 11.04 N
ANISOU 99 N GLN A1324 1268 1515 1411 -82 97 106 N
ATOM 100 CA GLN A1324 -10.522 18.205 1.313 1.00 11.28 C
ANISOU 100 CA GLN A1324 1279 1527 1477 21 23 182 C
ATOM 101 CB GLN A1324 -11.007 17.111 0.408 1.00 11.23 C
ANISOU 101 CB GLN A1324 1260 1583 1424 31 3 194 C
ATOM 102 CG GLN A1324 -10.908 17.502 -1.070 1.00 11.98 C
ANISOU 102 CG GLN A1324 1311 1795 1444 150 46 159 C
ATOM 103 CD GLN A1324 -10.961 16.334 -2.031 1.00 12.76 C
ANISOU 103 CD GLN A1324 1399 1989 1458 8 -171 89 C
ATOM 104 OE1 GLN A1324 -11.084 15.176 -1.647 1.00 14.62 O
ANISOU 104 OE1 GLN A1324 2009 1866 1679 -33 2 -32 O
ATOM 105 NE2 GLN A1324 -10.836 16.641 -3.327 1.00 15.54 N
ANISOU 105 NE2 GLN A1324 1843 2543 1516 108 -6 171 N
ATOM 106 C GLN A1324 -10.900 17.895 2.765 1.00 10.77 C
ANISOU 106 C GLN A1324 1270 1387 1434 35 -35 103 C
ATOM 107 O GLN A1324 -11.900 18.425 3.279 1.00 11.66 O
ANISOU 107 O GLN A1324 1224 1619 1586 155 24 250 O
ATOM 108 N CYS A1325 -10.118 17.047 3.411 1.00 10.27 N
ANISOU 108 N CYS A1325 1097 1420 1385 59 49 139 N
ATOM 109 CA CYS A1325 -10.347 16.755 4.824 1.00 9.86 C
ANISOU 109 CA CYS A1325 1071 1318 1357 -22 102 40 C
ATOM 110 CB CYS A1325 -9.557 15.526 5.248 1.00 10.34 C
ANISOU 110 CB CYS A1325 1215 1338 1374 25 14 33 C
ATOM 111 SG CYS A1325 -10.170 13.947 4.600 1.00 10.91 S
ANISOU 111 SG CYS A1325 1285 1461 1397 -141 29 44 S
ATOM 112 C CYS A1325 -10.056 17.931 5.724 1.00 10.35 C
ANISOU 112 C CYS A1325 1195 1298 1438 -39 27 16 C
ATOM 113 O CYS A1325 -10.776 18.144 6.707 1.00 10.92 O
ANISOU 113 O CYS A1325 1298 1439 1412 83 103 86 O
ATOM 114 N GLU A1326 -9.020 18.698 5.429 1.00 10.86 N
ANISOU 114 N GLU A1326 1142 1500 1484 -82 92 28 N
ATOM 115 CA GLU A1326 -8.768 19.936 6.168 1.00 11.89 C
ANISOU 115 CA GLU A1326 1395 1586 1535 -201 22 -29 C
ATOM 116 CB GLU A1326 -7.534 20.642 5.618 1.00 12.82 C
ANISOU 116 CB GLU A1326 1661 1513 1694 -297 282 -224 C
ATOM 117 CG GLU A1326 -6.224 19.941 5.938 1.00 14.61 C
ANISOU 117 CG GLU A1326 1868 1816 1865 -262 -9 24 C
ATOM 118 CD GLU A1326 -5.011 20.468 5.189 1.00 17.30 C
ANISOU 118 CD GLU A1326 2109 2512 1949 -530 48 172 C
ATOM 119 OE1 GLU A1326 -5.153 21.162 4.167 1.00 21.78 O
ANISOU 119 OE1 GLU A1326 2426 3532 2317 -762 -82 760 O
ATOM 120 OE2 GLU A1326 -3.878 20.114 5.589 1.00 21.29 O
ANISOU 120 OE2 GLU A1326 1913 3454 2722 -365 139 156 O
ATOM 121 C GLU A1326 -9.977 20.866 6.113 1.00 12.15 C
ANISOU 121 C GLU A1326 1465 1441 1710 -188 165 -55 C
ATOM 122 O GLU A1326 -10.416 21.423 7.140 1.00 13.55 O
ANISOU 122 O GLU A1326 1849 1513 1783 -130 356 -89 O
ATOM 123 N GLU A1327 -10.525 21.036 4.917 1.00 12.47 N
ANISOU 123 N GLU A1327 1571 1404 1761 -55 230 24 N
ATOM 124 CA GLU A1327 -11.675 21.924 4.764 1.00 13.38 C
ANISOU 124 CA GLU A1327 1889 1347 1845 31 251 285 C
ATOM 125 CB GLU A1327 -11.921 22.122 3.272 1.00 16.58 C
ANISOU 125 CB GLU A1327 2446 1869 1983 613 275 457 C
ATOM 126 CG GLU A1327 -10.755 22.927 2.628 1.00 24.99 C
ANISOU 126 CG GLU A1327 3538 2394 3562 419 887 1201 C
ATOM 127 CD GLU A1327 -10.743 22.988 1.084 1.00 44.07 C
ANISOU 127 CD GLU A1327 6789 6162 3791 2442 503 1081 C
ATOM 128 OE1 GLU A1327 -11.639 22.386 0.445 1.00 54.12 O
ANISOU 128 OE1 GLU A1327 6999 8475 5090 569 259 2746 O
ATOM 129 OE2 GLU A1327 -9.817 23.628 0.489 1.00141.65 O
ANISOU 129 OE2 GLU A1327 18851 13385 21583 11510 17426 15638 O
ATOM 130 C GLU A1327 -12.899 21.402 5.514 1.00 12.72 C
ANISOU 130 C GLU A1327 1804 1336 1691 260 271 265 C
ATOM 131 O GLU A1327 -13.637 22.172 6.145 1.00 13.82 O
ANISOU 131 O GLU A1327 1900 1590 1760 372 205 192 O
ATOM 132 N LEU A1328 -13.113 20.088 5.456 1.00 11.88 N
ANISOU 132 N LEU A1328 1543 1380 1589 236 117 201 N
ATOM 133 CA LEU A1328 -14.224 19.511 6.187 1.00 11.53 C
ANISOU 133 CA LEU A1328 1359 1486 1533 241 25 137 C
ATOM 134 CB LEU A1328 -14.410 18.069 5.786 1.00 10.91 C
ANISOU 134 CB LEU A1328 1194 1615 1335 263 -63 120 C
ATOM 135 CG LEU A1328 -15.528 17.307 6.465 1.00 12.28 C
ANISOU 135 CG LEU A1328 1461 1686 1516 189 89 228 C
ATOM 136 CD1 LEU A1328 -16.877 18.030 6.385 1.00 13.53 C
ANISOU 136 CD1 LEU A1328 1462 1879 1798 204 147 -66 C
ATOM 137 CD2 LEU A1328 -15.632 15.920 5.876 1.00 12.48 C
ANISOU 137 CD2 LEU A1328 1532 1745 1463 139 82 180 C
ATOM 138 C LEU A1328 -14.055 19.660 7.694 1.00 11.04 C
ANISOU 138 C LEU A1328 1362 1339 1493 154 50 124 C
ATOM 139 O LEU A1328 -15.025 20.011 8.407 1.00 11.79 O
ANISOU 139 O LEU A1328 1392 1554 1532 216 125 71 O
ATOM 140 N LEU A1329 -12.836 19.447 8.201 1.00 11.19 N
ANISOU 140 N LEU A1329 1319 1574 1358 112 97 -17 N
ATOM 141 CA LEU A1329 -12.619 19.699 9.611 1.00 11.36 C
ANISOU 141 CA LEU A1329 1388 1519 1408 1 78 -79 C
ATOM 142 CB LEU A1329 -11.210 19.274 10.006 1.00 12.61 C
ANISOU 142 CB LEU A1329 1383 1866 1541 -22 -4 -129 C
ATOM 143 CG LEU A1329 -10.960 17.762 10.035 1.00 12.95 C
ANISOU 143 CG LEU A1329 1414 1911 1596 94 41 67 C
ATOM 144 CD1 LEU A1329 -9.480 17.476 10.190 1.00 14.75 C
ANISOU 144 CD1 LEU A1329 1450 2177 1975 228 119 5 C
ATOM 145 CD2 LEU A1329 -11.733 17.088 11.153 1.00 14.95 C
ANISOU 145 CD2 LEU A1329 1554 2126 1999 299 247 352 C
ATOM 146 C LEU A1329 -12.865 21.157 9.959 1.00 12.40 C
ANISOU 146 C LEU A1329 1546 1466 1699 11 90 -119 C
ATOM 147 O LEU A1329 -13.420 21.433 11.038 1.00 14.06 O
ANISOU 147 O LEU A1329 1650 1886 1806 -144 270 -283 O
ATOM 148 N ASN A1330 -12.474 22.097 9.100 1.00 13.68 N
ANISOU 148 N ASN A1330 1659 1687 1852 -159 259 -187 N
ATOM 149 CA ASN A1330 -12.771 23.499 9.390 1.00 15.17 C
ANISOU 149 CA ASN A1330 2057 1642 2063 -236 264 -227 C
ATOM 150 CB ASN A1330 -12.144 24.390 8.315 1.00 18.32 C
ANISOU 150 CB ASN A1330 2599 1713 2649 -278 886 -227 C
ATOM 151 CG ASN A1330 -10.627 24.463 8.409 1.00 23.09 C
ANISOU 151 CG ASN A1330 2694 2621 3458 -1046 880 -493 C
ATOM 152 OD1 ASN A1330 -10.042 24.128 9.438 1.00 31.17 O
ANISOU 152 OD1 ASN A1330 3155 4785 3900 -1595 374 -479 O
ATOM 153 ND2 ASN A1330 -9.981 24.876 7.310 1.00 26.89 N
ANISOU 153 ND2 ASN A1330 3572 2480 4163 -785 1689 -475 N
ATOM 154 C ASN A1330 -14.272 23.731 9.514 1.00 14.29 C
ANISOU 154 C ASN A1330 2181 1307 1939 -136 334 55 C
ATOM 155 O ASN A1330 -14.726 24.447 10.435 1.00 15.79 O
ANISOU 155 O ASN A1330 2218 1522 2260 16 404 -224 O
ATOM 156 N LEU A1331 -15.051 23.137 8.616 1.00 13.26 N
ANISOU 156 N LEU A1331 1910 1354 1774 28 365 120 N
ATOM 157 CA LEU A1331 -16.510 23.260 8.731 1.00 13.55 C
ANISOU 157 CA LEU A1331 1894 1429 1824 324 261 252 C
ATOM 158 CB LEU A1331 -17.222 22.592 7.565 1.00 13.58 C
ANISOU 158 CB LEU A1331 1742 1437 1979 199 225 283 C
ATOM 159 CG LEU A1331 -16.990 23.211 6.188 1.00 15.16 C
ANISOU 159 CG LEU A1331 1819 1771 2168 171 141 555 C
ATOM 160 CD1 LEU A1331 -17.611 22.318 5.127 1.00 17.37 C
ANISOU 160 CD1 LEU A1331 2335 2018 2246 -117 -44 514 C
ATOM 161 CD2 LEU A1331 -17.580 24.616 6.112 1.00 18.12 C
ANISOU 161 CD2 LEU A1331 2894 1740 2250 294 -196 498 C
ATOM 162 C LEU A1331 -17.028 22.666 10.030 1.00 13.11 C
ANISOU 162 C LEU A1331 1955 1259 1767 346 285 115 C
ATOM 163 O LEU A1331 -17.929 23.233 10.678 1.00 14.93 O
ANISOU 163 O LEU A1331 2085 1462 2126 639 478 303 O
ATOM 164 N ILE A1332 -16.488 21.505 10.410 1.00 11.70 N
ANISOU 164 N ILE A1332 1587 1235 1623 245 252 145 N
ATOM 165 CA ILE A1332 -16.916 20.851 11.631 1.00 11.45 C
ANISOU 165 CA ILE A1332 1440 1262 1646 180 187 161 C
ATOM 166 CB ILE A1332 -16.272 19.464 11.730 1.00 11.02 C
ANISOU 166 CB ILE A1332 1483 1217 1485 152 158 4 C
ATOM 167 CG1 ILE A1332 -16.956 18.548 10.717 1.00 13.06 C
ANISOU 167 CG1 ILE A1332 1850 1502 1609 43 -41 92 C
ATOM 168 CD1 ILE A1332 -16.323 17.221 10.490 1.00 14.40 C
ANISOU 168 CD1 ILE A1332 2013 1626 1833 111 67 -72 C
ATOM 169 CG2 ILE A1332 -16.348 18.905 13.144 1.00 11.52 C
ANISOU 169 CG2 ILE A1332 1482 1337 1558 157 112 161 C
ATOM 170 C ILE A1332 -16.618 21.711 12.861 1.00 12.17 C
ANISOU 170 C ILE A1332 1656 1208 1758 241 252 8 C
ATOM 171 O ILE A1332 -17.465 21.867 13.713 1.00 12.58 O
ANISOU 171 O ILE A1332 1787 1347 1645 220 265 51 O
ATOM 172 N PHE A1333 -15.431 22.314 12.920 1.00 13.19 N
ANISOU 172 N PHE A1333 1930 1552 1528 -46 275 -100 N
ATOM 173 CA PHE A1333 -15.066 23.189 14.039 1.00 14.94 C
ANISOU 173 CA PHE A1333 2308 1565 1801 -95 327 -274 C
ATOM 174 CB PHE A1333 -13.573 23.553 13.995 1.00 16.59 C
ANISOU 174 CB PHE A1333 2371 1842 2090 -451 120 -129 C
ATOM 175 CG PHE A1333 -12.673 22.542 14.665 1.00 15.59 C
ANISOU 175 CG PHE A1333 2096 1763 2063 -504 272 -150 C
ATOM 176 CD1 PHE A1333 -12.389 22.640 16.026 1.00 19.35 C
ANISOU 176 CD1 PHE A1333 2624 2626 2103 -180 176 -133 C
ATOM 177 CE1 PHE A1333 -11.545 21.736 16.662 1.00 20.13 C
ANISOU 177 CE1 PHE A1333 2546 2490 2611 -383 130 9 C
ATOM 178 CZ PHE A1333 -11.014 20.687 15.943 1.00 17.63 C
ANISOU 178 CZ PHE A1333 2539 1470 2689 -616 -192 320 C
ATOM 179 CE2 PHE A1333 -11.261 20.592 14.594 1.00 17.14 C
ANISOU 179 CE2 PHE A1333 2398 1449 2661 -457 -121 -344 C
ATOM 180 CD2 PHE A1333 -12.088 21.507 13.958 1.00 17.11 C
ANISOU 180 CD2 PHE A1333 2544 1817 2139 -331 147 -55 C
ATOM 181 C PHE A1333 -15.945 24.451 14.118 1.00 17.49 C
ANISOU 181 C PHE A1333 2985 1326 2332 24 483 -516 C
ATOM 182 O PHE A1333 -16.181 24.932 15.204 1.00 24.56 O
ANISOU 182 O PHE A1333 4104 2535 2690 355 606 -1117 O
ATOM 183 N GLN A1334 -16.508 24.901 12.998 1.00 17.92 N
ANISOU 183 N GLN A1334 2867 1381 2561 186 811 -204 N
ATOM 184 CA GLN A1334 -17.446 26.034 13.007 1.00 20.60 C
ANISOU 184 CA GLN A1334 3378 1510 2939 489 793 -166 C
ATOM 185 CB GLN A1334 -17.545 26.628 11.591 1.00 23.65 C
ANISOU 185 CB GLN A1334 3898 1433 3655 604 992 594 C
ATOM 186 C GLN A1334 -18.827 25.636 13.438 1.00 19.06 C
ANISOU 186 C GLN A1334 3296 1809 2137 696 730 99 C
ATOM 187 O GLN A1334 -19.619 26.504 13.792 1.00 26.98 O
ANISOU 187 O GLN A1334 4202 2342 3704 1460 647 -248 O
ATOM 188 N ACYS A1335 -19.210 24.350 13.259 0.50 18.28 N
ANISOU 188 N ACYS A1335 2688 1688 2568 668 853 647 N
ATOM 189 N BCYS A1335 -19.106 24.372 13.471 0.50 18.79 N
ANISOU 189 N BCYS A1335 2878 1872 2389 604 864 509 N
ATOM 190 CA ACYS A1335 -20.549 23.808 13.634 0.50 16.08 C
ANISOU 190 CA ACYS A1335 2316 1686 2106 765 448 452 C
ATOM 191 CA BCYS A1335 -20.416 23.970 13.682 0.50 17.88 C
ANISOU 191 CA BCYS A1335 2486 2242 2062 761 311 489 C
ATOM 192 CB ACYS A1335 -20.778 22.340 13.151 0.50 18.11 C
ANISOU 192 CB ACYS A1335 2672 1883 2326 935 931 -69 C
ATOM 193 CB BCYS A1335 -20.546 22.699 12.930 0.50 18.15 C
ANISOU 193 CB BCYS A1335 2262 2777 1856 341 -15 254 C
ATOM 194 SG ACYS A1335 -20.972 21.938 11.398 0.50 20.22 S
ANISOU 194 SG ACYS A1335 2518 2491 2672 -154 199 20 S
ATOM 195 SG BCYS A1335 -22.182 22.202 13.198 0.50 20.14 S
ANISOU 195 SG BCYS A1335 2261 3384 2008 110 -507 676 S
ATOM 196 C ACYS A1335 -20.665 23.800 15.160 0.50 14.40 C
ANISOU 196 C ACYS A1335 1983 1433 2056 507 367 339 C
ATOM 197 C BCYS A1335 -20.648 23.804 15.183 0.50 14.60 C
ANISOU 197 C BCYS A1335 1981 1561 2002 542 292 264 C
ATOM 198 O ACYS A1335 -19.831 23.191 15.833 0.50 13.04 O
ANISOU 198 O ACYS A1335 1657 1347 1950 200 54 23 O
ATOM 199 O BCYS A1335 -19.859 23.141 15.859 0.50 12.96 O
ANISOU 199 O BCYS A1335 1677 1326 1922 222 9 28 O
ATOM 200 N GLU A1336 -21.729 24.360 15.708 1.00 14.82 N
ANISOU 200 N GLU A1336 2048 1516 2066 687 234 229 N
ATOM 201 CA GLU A1336 -21.985 24.292 17.143 1.00 13.43 C
ANISOU 201 CA GLU A1336 1853 1152 2095 207 124 -45 C
ATOM 202 CB GLU A1336 -23.257 25.060 17.474 1.00 15.30 C
ANISOU 202 CB GLU A1336 2055 1414 2343 393 73 -54 C
ATOM 203 CG GLU A1336 -23.075 26.550 17.340 1.00 16.78 C
ANISOU 203 CG GLU A1336 2154 1356 2866 332 391 -216 C
ATOM 204 CD GLU A1336 -24.354 27.340 17.435 1.00 17.53 C
ANISOU 204 CD GLU A1336 1994 1290 3375 190 270 -113 C
ATOM 205 OE1 GLU A1336 -25.397 26.823 17.915 1.00 22.34 O
ANISOU 205 OE1 GLU A1336 2236 1882 4369 366 788 446 O
ATOM 206 OE2 GLU A1336 -24.313 28.512 17.043 1.00 19.64 O
ANISOU 206 OE2 GLU A1336 2002 1249 4209 122 48 0 O
ATOM 207 C GLU A1336 -22.089 22.887 17.672 1.00 13.16 C
ANISOU 207 C GLU A1336 1706 1378 1914 94 178 109 C
ATOM 208 O GLU A1336 -21.712 22.620 18.820 1.00 13.54 O
ANISOU 208 O GLU A1336 1926 1412 1805 401 158 -111 O
ATOM 209 N ASP A1337 -22.604 21.973 16.863 1.00 12.03 N
ANISOU 209 N ASP A1337 1329 1509 1733 320 -27 106 N
ATOM 210 CA ASP A1337 -22.746 20.608 17.300 1.00 12.03 C
ANISOU 210 CA ASP A1337 1595 1485 1491 296 236 116 C
ATOM 211 CB ASP A1337 -23.553 19.781 16.282 1.00 11.99 C
ANISOU 211 CB ASP A1337 1464 1513 1578 123 187 103 C
ATOM 212 CG ASP A1337 -25.054 20.029 16.352 1.00 12.77 C
ANISOU 212 CG ASP A1337 1494 1659 1698 165 150 291 C
ATOM 213 OD1 ASP A1337 -25.536 20.442 17.428 1.00 14.56 O
ANISOU 213 OD1 ASP A1337 1451 2018 2062 289 136 -184 O
ATOM 214 OD2 ASP A1337 -25.728 19.709 15.338 1.00 13.49 O
ANISOU 214 OD2 ASP A1337 1492 1611 2019 283 -13 90 O
ATOM 215 C ASP A1337 -21.405 19.907 17.570 1.00 11.15 C
ANISOU 215 C ASP A1337 1405 1329 1499 66 87 41 C
ATOM 216 O ASP A1337 -21.436 18.849 18.181 1.00 11.77 O
ANISOU 216 O ASP A1337 1309 1496 1665 63 103 186 O
ATOM 217 N SER A1338 -20.267 20.469 17.097 1.00 10.64 N
ANISOU 217 N SER A1338 1333 1269 1437 186 62 120 N
ATOM 218 CA SER A1338 -19.020 19.823 17.408 1.00 10.28 C
ANISOU 218 CA SER A1338 1313 1211 1382 145 53 7 C
ATOM 219 CB SER A1338 -17.974 20.112 16.346 1.00 10.54 C
ANISOU 219 CB SER A1338 1381 1128 1495 -30 114 27 C
ATOM 220 OG SER A1338 -17.508 21.452 16.388 1.00 11.49 O
ANISOU 220 OG SER A1338 1546 1156 1661 -115 56 -49 O
ATOM 221 C SER A1338 -18.426 20.173 18.750 1.00 10.39 C
ANISOU 221 C SER A1338 1484 1057 1404 90 70 -14 C
ATOM 222 O SER A1338 -17.449 19.507 19.157 1.00 10.87 O
ANISOU 222 O SER A1338 1447 1168 1515 94 -43 -8 O
ATOM 223 N GLU A1339 -18.975 21.151 19.453 1.00 11.39 N
ANISOU 223 N GLU A1339 1713 1136 1477 191 -20 -65 N
ATOM 224 CA GLU A1339 -18.249 21.652 20.620 1.00 13.71 C
ANISOU 224 CA GLU A1339 2317 1243 1646 325 -300 -174 C
ATOM 225 CB GLU A1339 -18.914 22.867 21.186 1.00 17.98 C
ANISOU 225 CB GLU A1339 3093 1745 1992 790 -382 -485 C
ATOM 226 CG GLU A1339 -17.993 23.726 22.062 1.00 20.25 C
ANISOU 226 CG GLU A1339 3049 2227 2417 379 -315 -600 C
ATOM 227 CD GLU A1339 -17.761 23.138 23.439 1.00 18.12 C
ANISOU 227 CD GLU A1339 2666 1586 2632 -72 -27 -365 C
ATOM 228 OE1 GLU A1339 -18.639 22.385 23.878 1.00 20.40 O
ANISOU 228 OE1 GLU A1339 2844 2041 2863 -326 820 -767 O
ATOM 229 OE2 GLU A1339 -16.717 23.437 24.086 1.00 21.30 O
ANISOU 229 OE2 GLU A1339 2819 2782 2490 -82 -70 -372 O
ATOM 230 C GLU A1339 -17.898 20.584 21.666 1.00 12.85 C
ANISOU 230 C GLU A1339 2005 1107 1770 458 -147 -246 C
ATOM 231 O GLU A1339 -16.773 20.590 22.157 1.00 13.81 O
ANISOU 231 O GLU A1339 2132 1230 1884 121 -423 -235 O
ATOM 232 N PRO A1340 -18.795 19.590 21.931 1.00 11.49 N
ANISOU 232 N PRO A1340 1606 1459 1299 500 -54 -209 N
ATOM 233 CA PRO A1340 -18.453 18.566 22.939 1.00 11.09 C
ANISOU 233 CA PRO A1340 1564 1401 1246 341 144 -161 C
ATOM 234 CB PRO A1340 -19.732 17.728 23.058 1.00 12.46 C
ANISOU 234 CB PRO A1340 1473 1767 1493 418 192 -130 C
ATOM 235 CG PRO A1340 -20.818 18.691 22.666 1.00 14.29 C
ANISOU 235 CG PRO A1340 1540 2270 1616 549 67 55 C
ATOM 236 CD PRO A1340 -20.223 19.499 21.540 1.00 13.55 C
ANISOU 236 CD PRO A1340 1561 2137 1451 591 159 -23 C
ATOM 237 C PRO A1340 -17.326 17.632 22.523 1.00 10.26 C
ANISOU 237 C PRO A1340 1321 1257 1319 186 49 -85 C
ATOM 238 O PRO A1340 -16.830 16.869 23.345 1.00 11.68 O
ANISOU 238 O PRO A1340 1603 1497 1338 451 170 20 O
ATOM 239 N PHE A1341 -16.965 17.659 21.235 1.00 9.97 N
ANISOU 239 N PHE A1341 1343 1159 1284 167 30 -95 N
ATOM 240 CA PHE A1341 -16.079 16.715 20.593 1.00 10.23 C
ANISOU 240 CA PHE A1341 1221 1318 1345 129 96 -155 C
ATOM 241 CB PHE A1341 -16.812 16.060 19.411 1.00 9.53 C
ANISOU 241 CB PHE A1341 1096 1125 1398 82 82 -67 C
ATOM 242 CG PHE A1341 -18.173 15.558 19.769 1.00 9.95 C
ANISOU 242 CG PHE A1341 1210 1219 1351 98 198 -152 C
ATOM 243 CD1 PHE A1341 -18.330 14.495 20.646 1.00 10.98 C
ANISOU 243 CD1 PHE A1341 1441 1087 1641 12 228 -138 C
ATOM 244 CE1 PHE A1341 -19.600 14.100 21.058 1.00 12.34 C
ANISOU 244 CE1 PHE A1341 1653 1350 1684 -187 366 -80 C
ATOM 245 CZ PHE A1341 -20.702 14.763 20.575 1.00 12.24 C
ANISOU 245 CZ PHE A1341 1390 1504 1753 -274 328 -269 C
ATOM 246 CE2 PHE A1341 -20.552 15.793 19.696 1.00 12.04 C
ANISOU 246 CE2 PHE A1341 1266 1621 1687 -1 61 -128 C
ATOM 247 CD2 PHE A1341 -19.295 16.164 19.301 1.00 11.35 C
ANISOU 247 CD2 PHE A1341 1276 1369 1666 117 44 -23 C
ATOM 248 C PHE A1341 -14.782 17.335 20.098 1.00 9.96 C
ANISOU 248 C PHE A1341 1206 1210 1367 72 -24 -212 C
ATOM 249 O PHE A1341 -13.991 16.652 19.460 1.00 11.59 O
ANISOU 249 O PHE A1341 1289 1626 1488 61 88 -387 O
ATOM 250 N ARG A1342 -14.554 18.608 20.393 1.00 11.04 N
ANISOU 250 N ARG A1342 1394 1298 1502 -131 161 -213 N
ATOM 251 CA ARG A1342 -13.400 19.317 19.876 1.00 12.08 C
ANISOU 251 CA ARG A1342 1433 1637 1518 -275 210 -112 C
ATOM 252 CB ARG A1342 -13.612 20.830 19.921 1.00 13.44 C
ANISOU 252 CB ARG A1342 1812 1559 1733 -522 17 -116 C
ATOM 253 CG ARG A1342 -14.632 21.311 18.925 1.00 14.45 C
ANISOU 253 CG ARG A1342 2192 1429 1869 -425 -164 -121 C
ATOM 254 CD ARG A1342 -14.899 22.784 19.026 1.00 15.76 C
ANISOU 254 CD ARG A1342 2401 1475 2112 -173 -277 -97 C
ATOM 255 NE ARG A1342 -16.115 23.107 18.273 1.00 16.48 N
ANISOU 255 NE ARG A1342 2627 1389 2244 -284 -437 55 N
ATOM 256 CZ ARG A1342 -16.798 24.230 18.391 1.00 18.27 C
ANISOU 256 CZ ARG A1342 2986 1550 2405 -113 -620 -57 C
ATOM 257 NH1 ARG A1342 -16.361 25.219 19.175 1.00 23.16 N
ANISOU 257 NH1 ARG A1342 4071 1330 3396 -139 -1021 -260 N
ATOM 258 NH2 ARG A1342 -17.925 24.378 17.717 1.00 18.64 N
ANISOU 258 NH2 ARG A1342 2869 1446 2767 52 -615 186 N
ATOM 259 C ARG A1342 -12.090 18.994 20.569 1.00 14.17 C
ANISOU 259 C ARG A1342 1511 2172 1699 -226 89 -212 C
ATOM 260 O ARG A1342 -11.050 19.164 19.979 1.00 22.70 O
ANISOU 260 O ARG A1342 1568 5042 2015 -94 243 398 O
ATOM 261 N AGLN A1343 -12.148 18.580 21.822 0.50 12.09 N
ANISOU 261 N AGLN A1343 1344 1519 1729 -99 146 -216 N
ATOM 262 N BGLN A1343 -12.169 18.568 21.816 0.50 12.13 N
ANISOU 262 N BGLN A1343 1349 1526 1732 -97 148 -212 N
ATOM 263 CA AGLN A1343 -10.984 18.267 22.628 0.50 13.06 C
ANISOU 263 CA AGLN A1343 1427 1770 1763 -190 49 -252 C
ATOM 264 CA BGLN A1343 -11.039 18.294 22.681 0.50 13.27 C
ANISOU 264 CA BGLN A1343 1455 1797 1789 -175 49 -227 C
ATOM 265 CB AGLN A1343 -10.706 19.409 23.627 0.50 15.33 C
ANISOU 265 CB AGLN A1343 1775 1860 2190 -272 -241 -436 C
ATOM 266 CB BGLN A1343 -10.960 19.411 23.732 0.50 16.40 C
ANISOU 266 CB BGLN A1343 2044 2009 2178 -450 -274 -460 C
ATOM 267 CG AGLN A1343 -10.463 20.777 23.003 0.50 19.15 C
ANISOU 267 CG AGLN A1343 2500 1971 2801 -947 -415 -392 C
ATOM 268 CG BGLN A1343 -11.790 20.676 23.398 0.50 23.38 C
ANISOU 268 CG BGLN A1343 3401 2407 3076 -127 -360 -160 C
ATOM 269 CD AGLN A1343 -9.134 20.842 22.255 0.50 27.65 C
ANISOU 269 CD AGLN A1343 3501 3025 3978 -1417 638 -850 C
ATOM 270 CD BGLN A1343 -13.365 20.662 23.594 0.50 26.27 C
ANISOU 270 CD BGLN A1343 3481 3760 2740 -999 96 -1351 C
ATOM 271 OE1AGLN A1343 -8.149 20.224 22.673 0.50 33.32 O
ANISOU 271 OE1AGLN A1343 4796 4061 3800 -1530 -1214 -807 O
ATOM 272 OE1BGLN A1343 -14.128 19.553 23.582 0.50 24.57 O
ANISOU 272 OE1BGLN A1343 4903 3179 1251 -1253 -311 -21 O
ATOM 273 NE2AGLN A1343 -9.104 21.578 21.136 0.50 27.38 N
ANISOU 273 NE2AGLN A1343 4259 2334 3811 -1497 1897 -1339 N
ATOM 274 NE2BGLN A1343 -13.885 21.949 23.676 0.50 27.56 N
ANISOU 274 NE2BGLN A1343 4852 2566 3050 -1751 293 48 N
ATOM 275 C AGLN A1343 -11.312 16.965 23.343 0.50 12.47 C
ANISOU 275 C AGLN A1343 1373 1728 1634 -115 62 -302 C
ATOM 276 C BGLN A1343 -11.328 16.966 23.365 0.50 12.55 C
ANISOU 276 C BGLN A1343 1376 1737 1653 -120 55 -295 C
ATOM 277 O AGLN A1343 -12.475 16.586 23.436 0.50 12.52 O
ANISOU 277 O AGLN A1343 1399 1600 1756 -184 151 -345 O
ATOM 278 O BGLN A1343 -12.476 16.573 23.453 0.50 12.52 O
ANISOU 278 O BGLN A1343 1399 1600 1756 -181 152 -345 O
ATOM 279 N PRO A1344 -10.298 16.286 23.880 1.00 13.97 N
ANISOU 279 N PRO A1344 1445 2016 1845 -112 -79 -215 N
ATOM 280 CA PRO A1344 -10.543 15.044 24.622 1.00 14.54 C
ANISOU 280 CA PRO A1344 1578 1922 2024 119 -28 -174 C
ATOM 281 CB PRO A1344 -9.169 14.687 25.189 1.00 16.62 C
ANISOU 281 CB PRO A1344 1803 2279 2232 180 -246 -59 C
ATOM 282 CG PRO A1344 -8.202 15.322 24.239 1.00 16.42 C
ANISOU 282 CG PRO A1344 1574 2325 2339 91 -114 -358 C
ATOM 283 CD PRO A1344 -8.866 16.609 23.791 1.00 15.41 C
ANISOU 283 CD PRO A1344 1476 2400 1979 -121 -37 -265 C
ATOM 284 C PRO A1344 -11.606 15.240 25.726 1.00 14.24 C
ANISOU 284 C PRO A1344 1961 1659 1787 171 72 -58 C
ATOM 285 O PRO A1344 -11.682 16.306 26.380 1.00 14.77 O
ANISOU 285 O PRO A1344 2056 1804 1750 -9 10 -238 O
ATOM 286 N VAL A1345 -12.416 14.201 25.921 1.00 14.00 N
ANISOU 286 N VAL A1345 1954 1640 1726 68 55 -48 N
ATOM 287 CA VAL A1345 -13.388 14.184 27.002 1.00 14.07 C
ANISOU 287 CA VAL A1345 2162 1463 1720 173 167 -40 C
ATOM 288 CB VAL A1345 -14.172 12.867 27.063 1.00 14.23 C
ANISOU 288 CB VAL A1345 2253 1433 1721 122 181 -25 C
ATOM 289 CG1 VAL A1345 -15.041 12.788 28.303 1.00 16.31 C
ANISOU 289 CG1 VAL A1345 2783 1567 1846 -80 380 5 C
ATOM 290 CG2 VAL A1345 -15.057 12.743 25.833 1.00 14.34 C
ANISOU 290 CG2 VAL A1345 2055 1464 1930 208 121 83 C
ATOM 291 C VAL A1345 -12.682 14.462 28.339 1.00 15.00 C
ANISOU 291 C VAL A1345 2515 1336 1846 212 -8 -29 C
ATOM 292 O VAL A1345 -11.608 13.905 28.608 1.00 17.75 O
ANISOU 292 O VAL A1345 2704 2102 1937 531 -334 -181 O
ATOM 293 N ASP A1346 -13.293 15.337 29.153 1.00 15.76 N
ANISOU 293 N ASP A1346 2710 1498 1778 -2 143 -132 N
ATOM 294 CA ASP A1346 -12.747 15.744 30.437 1.00 16.53 C
ANISOU 294 CA ASP A1346 2648 1629 2001 -316 -13 -141 C
ATOM 295 CB ASP A1346 -13.283 17.157 30.758 1.00 18.93 C
ANISOU 295 CB ASP A1346 3459 1689 2045 -117 258 -120 C
ATOM 296 CG ASP A1346 -12.629 17.805 31.968 1.00 25.11 C
ANISOU 296 CG ASP A1346 5379 1923 2238 -447 -4 -321 C
ATOM 297 OD1 ASP A1346 -12.031 17.123 32.800 1.00 32.02 O
ANISOU 297 OD1 ASP A1346 7435 1821 2909 -950 -1195 -52 O
ATOM 298 OD2 ASP A1346 -12.723 19.038 32.122 1.00 32.63 O
ANISOU 298 OD2 ASP A1346 7293 1922 3179 -914 -127 -290 O
ATOM 299 C ASP A1346 -13.147 14.745 31.540 1.00 14.26 C
ANISOU 299 C ASP A1346 2095 1312 2008 -126 -211 -159 C
ATOM 300 O ASP A1346 -14.326 14.601 31.855 1.00 15.37 O
ANISOU 300 O ASP A1346 2174 1831 1832 -9 -44 24 O
ATOM 301 N LEU A1347 -12.163 14.091 32.109 1.00 18.33 N
ANISOU 301 N LEU A1347 2447 1696 2818 137 -604 -328 N
ATOM 302 CA LEU A1347 -12.399 13.102 33.145 1.00 18.93 C
ANISOU 302 CA LEU A1347 2583 1556 3053 344 -959 -92 C
ATOM 303 CB LEU A1347 -11.135 12.286 33.422 1.00 23.70 C
ANISOU 303 CB LEU A1347 2312 2702 3988 662 -634 74 C
ATOM 304 CG LEU A1347 -10.669 11.466 32.211 1.00 27.11 C
ANISOU 304 CG LEU A1347 2458 3430 4413 598 -196 -351 C
ATOM 305 CD1 LEU A1347 -9.536 10.547 32.651 1.00 31.98 C
ANISOU 305 CD1 LEU A1347 2767 4318 5064 905 -459 -117 C
ATOM 306 CD2 LEU A1347 -11.738 10.639 31.509 1.00 29.19 C
ANISOU 306 CD2 LEU A1347 3475 3254 4362 571 -593 -609 C
ATOM 307 C LEU A1347 -12.905 13.706 34.448 1.00 19.13 C
ANISOU 307 C LEU A1347 2731 1708 2828 -119 -1078 29 C
ATOM 308 O LEU A1347 -13.514 12.991 35.232 1.00 25.84 O
ANISOU 308 O LEU A1347 5149 1901 2764 -705 -1105 405 O
ATOM 309 N LEU A1348 -12.672 15.000 34.673 1.00 20.27 N
ANISOU 309 N LEU A1348 3305 1952 2444 -579 -1007 -72 N
ATOM 310 CA LEU A1348 -13.234 15.615 35.853 1.00 21.88 C
ANISOU 310 CA LEU A1348 3710 2299 2302 -214 -1101 -97 C
ATOM 311 CB LEU A1348 -12.577 16.960 36.113 1.00 25.03 C
ANISOU 311 CB LEU A1348 4184 2468 2858 -338 -918 -570 C
ATOM 312 CG LEU A1348 -11.137 16.871 36.615 1.00 32.24 C
ANISOU 312 CG LEU A1348 4154 3497 4596 -970 -1130 -417 C
ATOM 313 CD1 LEU A1348 -10.528 18.269 36.683 1.00 34.86 C
ANISOU 313 CD1 LEU A1348 5248 3075 4919 -665 -983 -386 C
ATOM 314 CD2 LEU A1348 -11.070 16.206 37.987 1.00 37.35 C
ANISOU 314 CD2 LEU A1348 5223 4323 4645 -207 -1409 -164 C
ATOM 315 C LEU A1348 -14.741 15.799 35.698 1.00 19.80 C
ANISOU 315 C LEU A1348 3562 1959 2001 -437 -446 -327 C
ATOM 316 O LEU A1348 -15.486 15.772 36.679 1.00 29.60 O
ANISOU 316 O LEU A1348 5251 4303 1692 -152 -51 -276 O
ATOM 317 N GLU A1349 -15.183 15.989 34.469 1.00 17.09 N
ANISOU 317 N GLU A1349 2940 1722 1830 -29 2 -140 N
ATOM 318 CA GLU A1349 -16.631 16.083 34.142 1.00 18.44 C
ANISOU 318 CA GLU A1349 2747 1709 2549 107 506 -287 C
ATOM 319 CB GLU A1349 -16.817 16.806 32.780 1.00 18.68 C
ANISOU 319 CB GLU A1349 2585 1644 2867 193 139 -19 C
ATOM 320 CG GLU A1349 -16.372 18.269 32.715 1.00 20.48 C
ANISOU 320 CG GLU A1349 3173 1674 2933 83 -7 -4 C
ATOM 321 CD GLU A1349 -16.579 18.922 31.338 1.00 20.54 C
ANISOU 321 CD GLU A1349 3505 1531 2767 411 43 -137 C
ATOM 322 OE1 GLU A1349 -16.814 18.243 30.288 1.00 19.85 O
ANISOU 322 OE1 GLU A1349 2847 1730 2962 617 -361 -233 O
ATOM 323 OE2 GLU A1349 -16.504 20.182 31.286 1.00 27.03 O
ANISOU 323 OE2 GLU A1349 5013 1531 3726 459 394 -4 O
ATOM 324 C GLU A1349 -17.296 14.686 34.107 1.00 19.23 C
ANISOU 324 C GLU A1349 3272 1451 2584 99 804 -269 C
ATOM 325 O GLU A1349 -18.457 14.557 34.491 1.00 20.02 O
ANISOU 325 O GLU A1349 3013 2211 2383 223 467 -334 O
ATOM 326 N TYR A1350 -16.567 13.669 33.639 1.00 14.76 N
ANISOU 326 N TYR A1350 2252 1535 1819 133 -61 -176 N
ATOM 327 CA TYR A1350 -17.128 12.331 33.392 1.00 14.41 C
ANISOU 327 CA TYR A1350 2343 1530 1598 43 33 22 C
ATOM 328 CB TYR A1350 -17.356 12.123 31.882 1.00 14.64 C
ANISOU 328 CB TYR A1350 2343 1547 1671 374 -77 40 C
ATOM 329 CG TYR A1350 -18.263 13.188 31.316 1.00 13.76 C
ANISOU 329 CG TYR A1350 2218 1294 1715 364 89 12 C
ATOM 330 CD1 TYR A1350 -19.627 13.180 31.571 1.00 15.01 C
ANISOU 330 CD1 TYR A1350 2112 1802 1789 502 -12 -83 C
ATOM 331 CE1 TYR A1350 -20.468 14.192 31.091 1.00 14.73 C
ANISOU 331 CE1 TYR A1350 2017 1624 1953 368 -11 47 C
ATOM 332 CZ TYR A1350 -19.930 15.225 30.320 1.00 15.18 C
ANISOU 332 CZ TYR A1350 2059 1902 1806 603 -25 149 C
ATOM 333 OH TYR A1350 -20.736 16.242 29.869 1.00 15.84 O
ANISOU 333 OH TYR A1350 2193 1773 2053 581 -2 191 O
ATOM 334 CE2 TYR A1350 -18.572 15.262 30.072 1.00 14.84 C
ANISOU 334 CE2 TYR A1350 2145 1469 2022 632 351 246 C
ATOM 335 CD2 TYR A1350 -17.754 14.235 30.515 1.00 14.31 C
ANISOU 335 CD2 TYR A1350 1902 1597 1937 577 249 230 C
ATOM 336 C TYR A1350 -16.139 11.326 33.977 1.00 15.33 C
ANISOU 336 C TYR A1350 2805 1540 1478 6 -90 142 C
ATOM 337 O TYR A1350 -15.350 10.706 33.254 1.00 14.59 O
ANISOU 337 O TYR A1350 2633 1272 1636 -61 -60 199 O
ATOM 338 N PRO A1351 -16.160 11.153 35.306 1.00 17.93 N
ANISOU 338 N PRO A1351 3577 1772 1463 90 -74 158 N
ATOM 339 CA PRO A1351 -15.041 10.457 35.963 1.00 18.43 C
ANISOU 339 CA PRO A1351 3982 1615 1404 130 -441 -80 C
ATOM 340 CB PRO A1351 -15.336 10.679 37.467 1.00 20.66 C
ANISOU 340 CB PRO A1351 4952 1444 1453 127 -301 5 C
ATOM 341 CG PRO A1351 -16.326 11.765 37.580 1.00 23.49 C
ANISOU 341 CG PRO A1351 3554 3052 2318 57 -206 40 C
ATOM 342 CD PRO A1351 -17.057 11.827 36.284 1.00 19.65 C
ANISOU 342 CD PRO A1351 3950 1904 1610 -9 243 185 C
ATOM 343 C PRO A1351 -14.865 8.973 35.605 1.00 18.93 C
ANISOU 343 C PRO A1351 4387 1529 1275 -320 -515 87 C
ATOM 344 O PRO A1351 -13.760 8.438 35.744 1.00 19.60 O
ANISOU 344 O PRO A1351 4165 1519 1761 -656 -740 219 O
ATOM 345 N AASP A1352 -15.899 8.275 35.165 0.50 14.15 N
ANISOU 345 N AASP A1352 3489 1028 857 126 -154 73 N
ATOM 346 N BASP A1352 -16.013 8.389 35.270 0.50 19.24 N
ANISOU 346 N BASP A1352 3616 1810 1881 201 -159 170 N
ATOM 347 CA AASP A1352 -15.716 6.877 34.807 0.50 11.30 C
ANISOU 347 CA AASP A1352 2525 875 892 -183 -212 189 C
ATOM 348 CA BASP A1352 -16.280 7.089 34.686 0.50 22.10 C
ANISOU 348 CA BASP A1352 3944 2366 2086 -21 -94 -348 C
ATOM 349 CB AASP A1352 -16.797 5.972 35.365 0.50 15.10 C
ANISOU 349 CB AASP A1352 2918 1416 1403 -462 462 -5 C
ATOM 350 CB BASP A1352 -17.767 7.152 34.333 0.50 31.45 C
ANISOU 350 CB BASP A1352 4123 3913 3914 196 -190 -528 C
ATOM 351 CG AASP A1352 -18.152 6.230 34.816 0.50 15.51 C
ANISOU 351 CG AASP A1352 2760 1846 1286 -435 924 197 C
ATOM 352 CG BASP A1352 -18.630 6.404 35.263 0.50 34.12 C
ANISOU 352 CG BASP A1352 5516 3276 4170 -250 -75 -691 C
ATOM 353 OD1AASP A1352 -18.467 7.237 34.176 0.50 14.10 O
ANISOU 353 OD1AASP A1352 2107 1812 1437 -11 495 12 O
ATOM 354 OD1BASP A1352 -18.120 5.538 36.004 0.50 40.49 O
ANISOU 354 OD1BASP A1352 6018 3354 6010 1615 -742 -1473 O
ATOM 355 OD2AASP A1352 -19.012 5.382 35.035 0.50 21.77 O
ANISOU 355 OD2AASP A1352 3453 2266 2551 -1158 696 173 O
ATOM 356 OD2BASP A1352 -19.849 6.679 35.202 0.50 35.78 O
ANISOU 356 OD2BASP A1352 5936 1408 6248 590 -1124 -247 O
ATOM 357 C AASP A1352 -15.657 6.722 33.288 0.50 12.49 C
ANISOU 357 C AASP A1352 2463 1336 944 -207 -159 31 C
ATOM 358 C BASP A1352 -15.715 6.768 33.314 0.50 14.11 C
ANISOU 358 C BASP A1352 2309 1301 1749 -241 -336 273 C
ATOM 359 O AASP A1352 -15.888 5.626 32.748 0.50 12.60 O
ANISOU 359 O AASP A1352 2337 1307 1143 -213 -59 16 O
ATOM 360 O BASP A1352 -15.759 5.616 32.880 0.50 14.02 O
ANISOU 360 O BASP A1352 2253 1418 1653 -148 -57 163 O
ATOM 361 N TYR A1353 -15.315 7.786 32.559 1.00 13.44 N
ANISOU 361 N TYR A1353 2607 1277 1221 -29 -154 159 N
ATOM 362 CA TYR A1353 -15.252 7.668 31.105 1.00 12.23 C
ANISOU 362 CA TYR A1353 2175 1257 1212 -242 -219 74 C
ATOM 363 CB TYR A1353 -14.758 8.985 30.505 1.00 12.84 C
ANISOU 363 CB TYR A1353 2313 1156 1409 -122 -232 162 C
ATOM 364 CG TYR A1353 -14.952 9.059 28.995 1.00 11.98 C
ANISOU 364 CG TYR A1353 1812 1379 1360 -49 -50 151 C
ATOM 365 CD1 TYR A1353 -16.220 9.182 28.455 1.00 10.96 C
ANISOU 365 CD1 TYR A1353 1645 1165 1354 -29 83 30 C
ATOM 366 CE1 TYR A1353 -16.415 9.253 27.114 1.00 11.26 C
ANISOU 366 CE1 TYR A1353 1618 1302 1354 111 46 140 C
ATOM 367 CZ TYR A1353 -15.301 9.208 26.238 1.00 10.63 C
ANISOU 367 CZ TYR A1353 1501 1219 1319 58 8 177 C
ATOM 368 OH TYR A1353 -15.482 9.236 24.894 1.00 11.54 O
ANISOU 368 OH TYR A1353 1475 1676 1231 164 125 185 O
ATOM 369 CE2 TYR A1353 -14.026 9.085 26.765 1.00 11.75 C
ANISOU 369 CE2 TYR A1353 1500 1539 1425 274 33 116 C
ATOM 370 CD2 TYR A1353 -13.848 9.020 28.117 1.00 12.17 C
ANISOU 370 CD2 TYR A1353 1632 1541 1449 76 -109 103 C
ATOM 371 C TYR A1353 -14.406 6.488 30.619 1.00 12.64 C
ANISOU 371 C TYR A1353 2305 1251 1246 -102 -303 201 C
ATOM 372 O TYR A1353 -14.814 5.752 29.725 1.00 11.96 O
ANISOU 372 O TYR A1353 1859 1367 1315 -92 -196 71 O
ATOM 373 N ARG A1354 -13.215 6.329 31.194 1.00 12.80 N
ANISOU 373 N ARG A1354 2117 1437 1307 -55 -298 41 N
ATOM 374 CA ARG A1354 -12.339 5.277 30.752 1.00 13.87 C
ANISOU 374 CA ARG A1354 1836 1778 1655 62 -236 20 C
ATOM 375 CB ARG A1354 -10.899 5.607 31.118 1.00 15.38 C
ANISOU 375 CB ARG A1354 1684 2246 1912 93 -111 177 C
ATOM 376 CG ARG A1354 -10.389 6.878 30.451 1.00 17.47 C
ANISOU 376 CG ARG A1354 2047 2355 2235 -477 26 -37 C
ATOM 377 CD ARG A1354 -10.513 6.888 28.933 1.00 19.70 C
ANISOU 377 CD ARG A1354 2539 2630 2314 -408 -103 189 C
ATOM 378 NE ARG A1354 -9.731 5.797 28.360 1.00 20.87 N
ANISOU 378 NE ARG A1354 2554 3344 2029 -294 -70 29 N
ATOM 379 CZ ARG A1354 -8.404 5.823 28.200 1.00 26.20 C
ANISOU 379 CZ ARG A1354 2751 4362 2841 -416 64 -574 C
ATOM 380 NH1 ARG A1354 -7.680 6.901 28.498 1.00 29.05 N
ANISOU 380 NH1 ARG A1354 3055 4999 2981 -933 129 -511 N
ATOM 381 NH2 ARG A1354 -7.810 4.769 27.696 1.00 32.35 N
ANISOU 381 NH2 ARG A1354 3500 4317 4475 268 109 -457 N
ATOM 382 C ARG A1354 -12.675 3.879 31.247 1.00 13.42 C
ANISOU 382 C ARG A1354 1923 1682 1495 114 -270 35 C
ATOM 383 O ARG A1354 -12.120 2.902 30.757 1.00 15.90 O
ANISOU 383 O ARG A1354 2224 1980 1836 472 -17 150 O
ATOM 384 N ASP A1355 -13.645 3.782 32.146 1.00 13.50 N
ANISOU 384 N ASP A1355 2260 1515 1353 99 -146 68 N
ATOM 385 CA ASP A1355 -14.218 2.476 32.479 1.00 14.80 C
ANISOU 385 CA ASP A1355 2641 1495 1487 75 -347 301 C
ATOM 386 CB ASP A1355 -15.089 2.550 33.727 1.00 15.22 C
ANISOU 386 CB ASP A1355 2542 1649 1591 141 -296 193 C
ATOM 387 CG ASP A1355 -14.342 2.989 34.945 1.00 16.83 C
ANISOU 387 CG ASP A1355 2316 2597 1480 -35 -173 260 C
ATOM 388 OD1 ASP A1355 -13.104 2.861 34.988 1.00 24.43 O
ANISOU 388 OD1 ASP A1355 2305 5131 1843 -341 -422 215 O
ATOM 389 OD2 ASP A1355 -14.974 3.462 35.906 1.00 21.33 O
ANISOU 389 OD2 ASP A1355 2645 3737 1721 -99 -44 -94 O
ATOM 390 C ASP A1355 -15.063 1.927 31.335 1.00 16.47 C
ANISOU 390 C ASP A1355 3535 1181 1540 243 -492 69 C
ATOM 391 O ASP A1355 -15.266 0.745 31.275 1.00 21.27 O
ANISOU 391 O ASP A1355 4865 1206 2010 147 -1175 121 O
ATOM 392 N ILE A1356 -15.561 2.809 30.475 1.00 13.69 N
ANISOU 392 N ILE A1356 2458 1312 1430 5 -362 217 N
ATOM 393 CA ILE A1356 -16.494 2.473 29.398 1.00 13.96 C
ANISOU 393 CA ILE A1356 2481 1268 1552 -111 -310 155 C
ATOM 394 CB ILE A1356 -17.703 3.423 29.467 1.00 14.42 C
ANISOU 394 CB ILE A1356 2106 1653 1720 -269 -140 71 C
ATOM 395 CG1 ILE A1356 -18.307 3.273 30.849 1.00 20.67 C
ANISOU 395 CG1 ILE A1356 2918 3028 1905 -964 83 175 C
ATOM 396 CD1 ILE A1356 -19.353 4.255 31.244 1.00 28.62 C
ANISOU 396 CD1 ILE A1356 3430 3787 3657 -465 80 147 C
ATOM 397 CG2 ILE A1356 -18.716 3.160 28.365 1.00 15.26 C
ANISOU 397 CG2 ILE A1356 2143 1735 1920 -138 -275 137 C
ATOM 398 C ILE A1356 -15.814 2.565 28.042 1.00 13.82 C
ANISOU 398 C ILE A1356 2653 1134 1464 218 -340 -22 C
ATOM 399 O ILE A1356 -16.031 1.721 27.179 1.00 16.43 O
ANISOU 399 O ILE A1356 3233 1312 1696 17 -406 -154 O
ATOM 400 N ILE A1357 -14.983 3.586 27.856 1.00 12.75 N
ANISOU 400 N ILE A1357 2273 1264 1305 142 -273 47 N
ATOM 401 CA ILE A1357 -14.387 3.928 26.569 1.00 12.87 C
ANISOU 401 CA ILE A1357 2032 1405 1450 392 -54 30 C
ATOM 402 CB ILE A1357 -14.608 5.412 26.245 1.00 12.06 C
ANISOU 402 CB ILE A1357 1893 1469 1220 368 -140 78 C
ATOM 403 CG1 ILE A1357 -16.112 5.708 26.163 1.00 13.10 C
ANISOU 403 CG1 ILE A1357 1923 1538 1516 334 -138 103 C
ATOM 404 CD1 ILE A1357 -16.889 4.885 25.157 1.00 13.58 C
ANISOU 404 CD1 ILE A1357 2009 1621 1529 291 -197 147 C
ATOM 405 CG2 ILE A1357 -13.871 5.811 24.993 1.00 13.25 C
ANISOU 405 CG2 ILE A1357 2032 1622 1379 484 1 163 C
ATOM 406 C ILE A1357 -12.903 3.581 26.598 1.00 13.93 C
ANISOU 406 C ILE A1357 2134 1690 1465 638 154 286 C
ATOM 407 O ILE A1357 -12.141 4.160 27.383 1.00 17.13 O
ANISOU 407 O ILE A1357 2325 2341 1839 687 -196 119 O
ATOM 408 N ASP A1358 -12.532 2.611 25.761 1.00 16.60 N
ANISOU 408 N ASP A1358 2731 1686 1889 922 188 301 N
ATOM 409 CA ASP A1358 -11.153 2.171 25.623 1.00 19.58 C
ANISOU 409 CA ASP A1358 2970 2189 2278 1418 218 667 C
ATOM 410 CB ASP A1358 -11.107 0.770 24.969 1.00 27.63 C
ANISOU 410 CB ASP A1358 4019 2495 3983 1656 884 15 C
ATOM 411 CG ASP A1358 -11.570 -0.308 25.891 1.00 35.42 C
ANISOU 411 CG ASP A1358 5337 3583 4536 1732 1134 877 C
ATOM 412 OD1 ASP A1358 -11.669 -0.064 27.115 1.00 42.77 O
ANISOU 412 OD1 ASP A1358 7898 3835 4518 1946 643 1088 O
ATOM 413 OD2 ASP A1358 -11.830 -1.418 25.393 1.00 44.47 O
ANISOU 413 OD2 ASP A1358 8113 3797 4986 1651 1041 641 O
ATOM 414 C ASP A1358 -10.230 3.055 24.825 1.00 17.44 C
ANISOU 414 C ASP A1358 2525 2161 1939 1148 -70 317 C
ATOM 415 O ASP A1358 -9.024 3.131 25.111 1.00 21.55 O
ANISOU 415 O ASP A1358 2718 2928 2540 1398 -392 619 O
ATOM 416 N THR A1359 -10.787 3.700 23.803 1.00 15.39 N
ANISOU 416 N THR A1359 2101 1870 1876 946 37 293 N
ATOM 417 CA THR A1359 -9.963 4.486 22.879 1.00 15.35 C
ANISOU 417 CA THR A1359 1819 2064 1949 801 8 196 C
ATOM 418 CB THR A1359 -9.746 3.774 21.529 1.00 17.59 C
ANISOU 418 CB THR A1359 2286 2306 2092 1006 143 19 C
ATOM 419 OG1 THR A1359 -9.243 2.458 21.771 1.00 22.86 O
ANISOU 419 OG1 THR A1359 3349 2326 3010 1409 58 -166 O
ATOM 420 CG2 THR A1359 -8.738 4.541 20.677 1.00 19.67 C
ANISOU 420 CG2 THR A1359 2101 3165 2207 1067 85 190 C
ATOM 421 C THR A1359 -10.629 5.836 22.669 1.00 14.26 C
ANISOU 421 C THR A1359 1778 2071 1570 751 3 224 C
ATOM 422 O THR A1359 -11.414 6.009 21.743 1.00 14.09 O
ANISOU 422 O THR A1359 1705 1998 1650 656 -93 64 O
ATOM 423 N PRO A1360 -10.277 6.823 23.491 1.00 14.03 N
ANISOU 423 N PRO A1360 1677 1993 1660 708 -115 199 N
ATOM 424 CA PRO A1360 -10.790 8.148 23.295 1.00 13.07 C
ANISOU 424 CA PRO A1360 1534 1861 1571 450 -84 200 C
ATOM 425 CB PRO A1360 -10.162 8.939 24.446 1.00 15.44 C
ANISOU 425 CB PRO A1360 1949 2271 1643 435 -291 144 C
ATOM 426 CG PRO A1360 -9.880 7.939 25.513 1.00 19.69 C
ANISOU 426 CG PRO A1360 2894 2454 2131 523 -593 310 C
ATOM 427 CD PRO A1360 -9.451 6.734 24.725 1.00 17.01 C
ANISOU 427 CD PRO A1360 2156 2468 1838 492 -345 312 C
ATOM 428 C PRO A1360 -10.397 8.723 21.943 1.00 12.37 C
ANISOU 428 C PRO A1360 1482 1849 1367 414 -56 69 C
ATOM 429 O PRO A1360 -9.324 8.411 21.426 1.00 15.12 O
ANISOU 429 O PRO A1360 1602 2420 1721 776 48 321 O
ATOM 430 N MET A1361 -11.250 9.595 21.406 1.00 10.91 N
ANISOU 430 N MET A1361 1274 1552 1317 266 19 0 N
ATOM 431 CA MET A1361 -10.889 10.305 20.193 1.00 10.42 C
ANISOU 431 CA MET A1361 1211 1524 1223 199 118 -104 C
ATOM 432 CB MET A1361 -11.233 9.457 18.976 1.00 10.28 C
ANISOU 432 CB MET A1361 1171 1368 1364 231 -61 -107 C
ATOM 433 CG MET A1361 -10.722 9.993 17.670 1.00 10.38 C
ANISOU 433 CG MET A1361 1129 1453 1359 214 -40 -112 C
ATOM 434 SD MET A1361 -8.989 10.459 17.547 1.00 11.76 S
ANISOU 434 SD MET A1361 1175 1809 1482 187 1 -78 S
ATOM 435 CE MET A1361 -8.214 8.915 17.969 1.00 13.97 C
ANISOU 435 CE MET A1361 1281 2097 1929 400 30 -24 C
ATOM 436 C MET A1361 -11.655 11.627 20.182 1.00 10.30 C
ANISOU 436 C MET A1361 1152 1479 1282 114 56 -30 C
ATOM 437 O MET A1361 -12.734 11.729 20.759 1.00 10.94 O
ANISOU 437 O MET A1361 1259 1430 1465 188 186 102 O
ATOM 438 N ASP A1362 -11.100 12.621 19.498 1.00 10.42 N
ANISOU 438 N ASP A1362 1150 1487 1321 110 144 -77 N
ATOM 439 CA ASP A1362 -11.719 13.947 19.442 1.00 10.71 C
ANISOU 439 CA ASP A1362 1269 1505 1295 165 157 -105 C
ATOM 440 CB ASP A1362 -11.326 14.766 20.670 1.00 11.85 C
ANISOU 440 CB ASP A1362 1613 1656 1233 130 61 -101 C
ATOM 441 CG ASP A1362 -9.847 15.046 20.684 1.00 12.96 C
ANISOU 441 CG ASP A1362 1679 1847 1398 -85 -60 -278 C
ATOM 442 OD1 ASP A1362 -9.099 14.148 21.124 1.00 14.25 O
ANISOU 442 OD1 ASP A1362 1704 2171 1537 -132 -73 -38 O
ATOM 443 OD2 ASP A1362 -9.439 16.100 20.152 1.00 15.02 O