USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 973 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 87 LYS NZ :NH3+ -160:sc= 0.584 (180deg=0.326) USER MOD Set 1.2: A 143 ASN : amide:sc= -0.117 K(o=0.47,f=-2.8) USER MOD Set 2.1: A 31 LYS NZ :NH3+ -177:sc= 0.123 (180deg=0) USER MOD Set 2.2: A 32 SER OG : rot 140:sc= -1.22 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 CYS SG : rot -90:sc= -0.22 USER MOD Single : A 22 THR OG1 : rot 79:sc= 0.383 USER MOD Single : A 25 ASN : amide:sc= -0.0874 X(o=-0.087,f=-0.35) USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 110:sc= -1.13 USER MOD Single : A 37 MET CE :methyl -159:sc= -0.804 (180deg=-1.62) USER MOD Single : A 38 HIS : no HD1:sc= -2.6 K(o=-2.6,f=-1.2) USER MOD Single : A 42 GLN : amide:sc= -0.176 K(o=-0.18,f=-1.1) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot -12:sc= 0.984 USER MOD Single : A 56 ASN : amide:sc= -0.032 X(o=-0.032,f=0) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.0037) USER MOD Single : A 66 LYS NZ :NH3+ -152:sc= -0.0297 (180deg=-0.633) USER MOD Single : A 67 ASN : amide:sc= -1.6! C(o=-1.6!,f=-5.4!) USER MOD Single : A 70 CYS SG : rot 4:sc= 0.824 USER MOD Single : A 71 TYR OH : rot -98:sc= -2.38 USER MOD Single : A 92 SER OG : rot 170:sc= -0.0333 USER MOD Single : A 94 ASN : amide:sc= -5.97! C(o=-6!,f=-8.2!) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -173:sc= 0.883 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl 145:sc= -0.0712 (180deg=-0.196) USER MOD Single : A 106 TYR OH : rot 180:sc= -0.206 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 170:sc= -0.415 USER MOD Single : A 109 SER OG : rot -49:sc= 0.385 USER MOD Single : A 117 THR OG1 : rot 118:sc= 2.28 USER MOD Single : A 118 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 121 GLN : amide:sc= -0.23 X(o=-0.23,f=0.13) USER MOD Single : A 124 GLN : amide:sc= -0.0185 X(o=-0.019,f=-0.12) USER MOD Single : A 126 ASN : amide:sc= -0.322 X(o=-0.32,f=-0.54) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot -95:sc= 1.2 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 63 N VAL A 14 -5.408 6.925 -3.481 1.00 4.34 N ATOM 64 CA VAL A 14 -5.771 7.610 -2.246 1.00 21.35 C ATOM 65 C VAL A 14 -4.662 8.552 -1.793 1.00 5.33 C ATOM 66 O VAL A 14 -3.525 8.131 -1.576 1.00 13.41 O ATOM 67 CB VAL A 14 -6.071 6.607 -1.115 1.00 44.04 C ATOM 68 CG1 VAL A 14 -4.903 5.650 -0.927 1.00 14.11 C ATOM 69 CG2 VAL A 14 -6.383 7.342 0.179 1.00 22.14 C ATOM 0 HA VAL A 14 -6.671 8.188 -2.458 1.00 21.35 H new ATOM 0 HB VAL A 14 -6.947 6.022 -1.394 1.00 44.04 H new ATOM 0 HG11 VAL A 14 -5.132 4.949 -0.124 1.00 14.11 H new ATOM 0 HG12 VAL A 14 -4.731 5.099 -1.852 1.00 14.11 H new ATOM 0 HG13 VAL A 14 -4.007 6.215 -0.670 1.00 14.11 H new ATOM 0 HG21 VAL A 14 -6.592 6.619 0.967 1.00 22.14 H new ATOM 0 HG22 VAL A 14 -5.527 7.953 0.466 1.00 22.14 H new ATOM 0 HG23 VAL A 14 -7.253 7.982 0.033 1.00 22.14 H new ATOM 79 N SER A 15 -4.999 9.830 -1.651 1.00 52.14 N ATOM 80 CA SER A 15 -4.031 10.834 -1.227 1.00 44.33 C ATOM 81 C SER A 15 -4.685 11.870 -0.318 1.00 41.33 C ATOM 82 O SER A 15 -5.852 12.221 -0.496 1.00 23.41 O ATOM 83 CB SER A 15 -3.414 11.525 -2.445 1.00 63.21 C ATOM 84 OG SER A 15 -4.383 11.736 -3.457 1.00 61.21 O ATOM 0 H SER A 15 -5.936 10.194 -1.824 1.00 52.14 H new ATOM 0 HA SER A 15 -3.244 10.330 -0.667 1.00 44.33 H new ATOM 0 HB2 SER A 15 -2.983 12.480 -2.145 1.00 63.21 H new ATOM 0 HB3 SER A 15 -2.599 10.917 -2.838 1.00 63.21 H new ATOM 0 HG SER A 15 -3.964 12.180 -4.224 1.00 61.21 H new ATOM 90 N VAL A 16 -3.924 12.357 0.657 1.00 12.21 N ATOM 91 CA VAL A 16 -4.428 13.354 1.594 1.00 30.03 C ATOM 92 C VAL A 16 -4.554 14.720 0.929 1.00 72.21 C ATOM 93 O VAL A 16 -3.605 15.217 0.324 1.00 62.10 O ATOM 94 CB VAL A 16 -3.513 13.478 2.827 1.00 0.31 C ATOM 95 CG1 VAL A 16 -3.491 12.174 3.609 1.00 25.13 C ATOM 96 CG2 VAL A 16 -2.108 13.883 2.408 1.00 24.42 C ATOM 0 H VAL A 16 -2.956 12.077 0.819 1.00 12.21 H new ATOM 0 HA VAL A 16 -5.414 13.017 1.914 1.00 30.03 H new ATOM 0 HB VAL A 16 -3.912 14.256 3.478 1.00 0.31 H new ATOM 0 HG11 VAL A 16 -2.839 12.281 4.476 1.00 25.13 H new ATOM 0 HG12 VAL A 16 -4.501 11.932 3.941 1.00 25.13 H new ATOM 0 HG13 VAL A 16 -3.117 11.373 2.971 1.00 25.13 H new ATOM 0 HG21 VAL A 16 -1.475 13.966 3.291 1.00 24.42 H new ATOM 0 HG22 VAL A 16 -1.697 13.129 1.736 1.00 24.42 H new ATOM 0 HG23 VAL A 16 -2.144 14.844 1.896 1.00 24.42 H new ATOM 106 N ALA A 17 -5.733 15.322 1.046 1.00 51.05 N ATOM 107 CA ALA A 17 -5.983 16.632 0.457 1.00 12.15 C ATOM 108 C ALA A 17 -5.389 17.742 1.318 1.00 51.44 C ATOM 109 O ALA A 17 -5.163 17.560 2.514 1.00 44.01 O ATOM 110 CB ALA A 17 -7.477 16.850 0.269 1.00 33.34 C ATOM 0 H ALA A 17 -6.530 14.924 1.543 1.00 51.05 H new ATOM 0 HA ALA A 17 -5.497 16.664 -0.518 1.00 12.15 H new ATOM 0 HB1 ALA A 17 -7.649 17.832 -0.172 1.00 33.34 H new ATOM 0 HB2 ALA A 17 -7.877 16.081 -0.392 1.00 33.34 H new ATOM 0 HB3 ALA A 17 -7.977 16.793 1.236 1.00 33.34 H new ATOM 116 N ASP A 18 -5.138 18.892 0.701 1.00 74.11 N ATOM 117 CA ASP A 18 -4.571 20.032 1.411 1.00 45.34 C ATOM 118 C ASP A 18 -5.396 20.368 2.649 1.00 61.41 C ATOM 119 O ASP A 18 -4.853 20.765 3.679 1.00 23.10 O ATOM 120 CB ASP A 18 -4.496 21.249 0.487 1.00 12.32 C ATOM 121 CG ASP A 18 -3.101 21.838 0.417 1.00 50.50 C ATOM 122 OD1 ASP A 18 -2.638 22.390 1.437 1.00 3.51 O ATOM 123 OD2 ASP A 18 -2.472 21.747 -0.658 1.00 31.33 O ATOM 0 H ASP A 18 -5.318 19.059 -0.289 1.00 74.11 H new ATOM 0 HA ASP A 18 -3.564 19.765 1.730 1.00 45.34 H new ATOM 0 HB2 ASP A 18 -4.816 20.961 -0.514 1.00 12.32 H new ATOM 0 HB3 ASP A 18 -5.192 22.011 0.838 1.00 12.32 H new ATOM 128 N GLU A 19 -6.711 20.205 2.539 1.00 2.43 N ATOM 129 CA GLU A 19 -7.611 20.493 3.650 1.00 4.01 C ATOM 130 C GLU A 19 -7.325 19.573 4.834 1.00 43.41 C ATOM 131 O GLU A 19 -7.461 19.973 5.991 1.00 74.10 O ATOM 132 CB GLU A 19 -9.067 20.337 3.209 1.00 34.11 C ATOM 133 CG GLU A 19 -9.481 18.894 2.974 1.00 62.21 C ATOM 134 CD GLU A 19 -10.950 18.757 2.624 1.00 41.51 C ATOM 135 OE1 GLU A 19 -11.716 19.704 2.900 1.00 75.31 O ATOM 136 OE2 GLU A 19 -11.333 17.704 2.073 1.00 24.34 O ATOM 0 H GLU A 19 -7.176 19.876 1.693 1.00 2.43 H new ATOM 0 HA GLU A 19 -7.442 21.523 3.963 1.00 4.01 H new ATOM 0 HB2 GLU A 19 -9.716 20.773 3.968 1.00 34.11 H new ATOM 0 HB3 GLU A 19 -9.223 20.905 2.292 1.00 34.11 H new ATOM 0 HG2 GLU A 19 -8.879 18.474 2.168 1.00 62.21 H new ATOM 0 HG3 GLU A 19 -9.269 18.309 3.869 1.00 62.21 H new ATOM 143 N CYS A 20 -6.928 18.341 4.536 1.00 53.32 N ATOM 144 CA CYS A 20 -6.624 17.363 5.575 1.00 52.54 C ATOM 145 C CYS A 20 -5.331 17.723 6.298 1.00 3.31 C ATOM 146 O CYS A 20 -5.260 17.676 7.526 1.00 20.03 O ATOM 147 CB CYS A 20 -6.512 15.964 4.969 1.00 22.53 C ATOM 148 SG CYS A 20 -7.903 15.504 3.910 1.00 70.51 S ATOM 0 H CYS A 20 -6.809 17.995 3.584 1.00 53.32 H new ATOM 0 HA CYS A 20 -7.438 17.373 6.299 1.00 52.54 H new ATOM 0 HB2 CYS A 20 -5.592 15.904 4.388 1.00 22.53 H new ATOM 0 HB3 CYS A 20 -6.427 15.236 5.776 1.00 22.53 H new ATOM 0 HG CYS A 20 -8.820 14.924 4.626 1.00 70.51 H new ATOM 154 N VAL A 21 -4.308 18.082 5.528 1.00 30.42 N ATOM 155 CA VAL A 21 -3.016 18.449 6.095 1.00 30.13 C ATOM 156 C VAL A 21 -3.136 19.683 6.982 1.00 10.21 C ATOM 157 O VAL A 21 -2.598 19.721 8.089 1.00 13.34 O ATOM 158 CB VAL A 21 -1.976 18.722 4.992 1.00 31.24 C ATOM 159 CG1 VAL A 21 -0.592 18.906 5.597 1.00 55.43 C ATOM 160 CG2 VAL A 21 -1.975 17.594 3.971 1.00 2.22 C ATOM 0 H VAL A 21 -4.349 18.126 4.510 1.00 30.42 H new ATOM 0 HA VAL A 21 -2.683 17.604 6.697 1.00 30.13 H new ATOM 0 HB VAL A 21 -2.248 19.645 4.480 1.00 31.24 H new ATOM 0 HG11 VAL A 21 0.130 19.098 4.803 1.00 55.43 H new ATOM 0 HG12 VAL A 21 -0.606 19.750 6.287 1.00 55.43 H new ATOM 0 HG13 VAL A 21 -0.307 18.002 6.135 1.00 55.43 H new ATOM 0 HG21 VAL A 21 -1.235 17.803 3.199 1.00 2.22 H new ATOM 0 HG22 VAL A 21 -1.728 16.655 4.466 1.00 2.22 H new ATOM 0 HG23 VAL A 21 -2.962 17.515 3.515 1.00 2.22 H new ATOM 170 N THR A 22 -3.846 20.693 6.489 1.00 40.15 N ATOM 171 CA THR A 22 -4.037 21.930 7.235 1.00 3.12 C ATOM 172 C THR A 22 -4.864 21.691 8.493 1.00 54.22 C ATOM 173 O THR A 22 -4.513 22.157 9.576 1.00 23.53 O ATOM 174 CB THR A 22 -4.729 23.004 6.375 1.00 2.42 C ATOM 175 OG1 THR A 22 -3.982 23.226 5.174 1.00 72.15 O ATOM 176 CG2 THR A 22 -4.861 24.310 7.144 1.00 54.31 C ATOM 0 H THR A 22 -4.299 20.678 5.575 1.00 40.15 H new ATOM 0 HA THR A 22 -3.046 22.285 7.517 1.00 3.12 H new ATOM 0 HB THR A 22 -5.727 22.647 6.121 1.00 2.42 H new ATOM 0 HG1 THR A 22 -4.172 22.509 4.533 1.00 72.15 H new ATOM 0 HG21 THR A 22 -5.353 25.054 6.517 1.00 54.31 H new ATOM 0 HG22 THR A 22 -5.454 24.144 8.043 1.00 54.31 H new ATOM 0 HG23 THR A 22 -3.871 24.669 7.424 1.00 54.31 H new ATOM 184 N ALA A 23 -5.965 20.962 8.341 1.00 13.33 N ATOM 185 CA ALA A 23 -6.842 20.659 9.466 1.00 4.41 C ATOM 186 C ALA A 23 -6.084 19.931 10.571 1.00 13.44 C ATOM 187 O ALA A 23 -6.277 20.208 11.756 1.00 2.12 O ATOM 188 CB ALA A 23 -8.029 19.829 9.001 1.00 23.34 C ATOM 0 H ALA A 23 -6.271 20.570 7.450 1.00 13.33 H new ATOM 0 HA ALA A 23 -7.210 21.601 9.873 1.00 4.41 H new ATOM 0 HB1 ALA A 23 -8.675 19.610 9.851 1.00 23.34 H new ATOM 0 HB2 ALA A 23 -8.591 20.386 8.252 1.00 23.34 H new ATOM 0 HB3 ALA A 23 -7.672 18.895 8.567 1.00 23.34 H new ATOM 194 N LEU A 24 -5.223 19.000 10.178 1.00 75.55 N ATOM 195 CA LEU A 24 -4.437 18.230 11.136 1.00 41.43 C ATOM 196 C LEU A 24 -3.396 19.112 11.819 1.00 55.45 C ATOM 197 O LEU A 24 -3.196 19.029 13.029 1.00 30.34 O ATOM 198 CB LEU A 24 -3.748 17.058 10.435 1.00 2.03 C ATOM 199 CG LEU A 24 -4.554 15.762 10.346 1.00 71.12 C ATOM 200 CD1 LEU A 24 -3.819 14.733 9.501 1.00 25.14 C ATOM 201 CD2 LEU A 24 -4.835 15.211 11.736 1.00 4.23 C ATOM 0 H LEU A 24 -5.051 18.759 9.202 1.00 75.55 H new ATOM 0 HA LEU A 24 -5.114 17.843 11.897 1.00 41.43 H new ATOM 0 HB2 LEU A 24 -3.485 17.369 9.424 1.00 2.03 H new ATOM 0 HB3 LEU A 24 -2.814 16.847 10.956 1.00 2.03 H new ATOM 0 HG LEU A 24 -5.507 15.982 9.866 1.00 71.12 H new ATOM 0 HD11 LEU A 24 -4.408 13.817 9.449 1.00 25.14 H new ATOM 0 HD12 LEU A 24 -3.671 15.127 8.495 1.00 25.14 H new ATOM 0 HD13 LEU A 24 -2.851 14.517 9.952 1.00 25.14 H new ATOM 0 HD21 LEU A 24 -5.410 14.289 11.652 1.00 4.23 H new ATOM 0 HD22 LEU A 24 -3.892 15.007 12.244 1.00 4.23 H new ATOM 0 HD23 LEU A 24 -5.405 15.943 12.309 1.00 4.23 H new ATOM 213 N ASN A 25 -2.739 19.959 11.033 1.00 4.01 N ATOM 214 CA ASN A 25 -1.720 20.858 11.562 1.00 3.24 C ATOM 215 C ASN A 25 -2.300 21.759 12.648 1.00 13.21 C ATOM 216 O ASN A 25 -1.701 21.936 13.709 1.00 44.13 O ATOM 217 CB ASN A 25 -1.129 21.711 10.438 1.00 2.31 C ATOM 218 CG ASN A 25 0.245 21.233 10.011 1.00 43.05 C ATOM 219 OD1 ASN A 25 1.098 20.932 10.846 1.00 12.12 O ATOM 220 ND2 ASN A 25 0.466 21.161 8.703 1.00 2.11 N ATOM 0 H ASN A 25 -2.894 20.041 10.028 1.00 4.01 H new ATOM 0 HA ASN A 25 -0.929 20.251 12.002 1.00 3.24 H new ATOM 0 HB2 ASN A 25 -1.800 21.692 9.580 1.00 2.31 H new ATOM 0 HB3 ASN A 25 -1.064 22.748 10.768 1.00 2.31 H new ATOM 0 HD21 ASN A 25 1.372 20.846 8.355 1.00 2.11 H new ATOM 0 HD22 ASN A 25 -0.270 21.420 8.046 1.00 2.11 H new ATOM 227 N ASP A 26 -3.471 22.326 12.376 1.00 64.43 N ATOM 228 CA ASP A 26 -4.134 23.207 13.329 1.00 1.15 C ATOM 229 C ASP A 26 -4.630 22.423 14.540 1.00 21.13 C ATOM 230 O ASP A 26 -4.497 22.870 15.680 1.00 10.42 O ATOM 231 CB ASP A 26 -5.304 23.930 12.660 1.00 21.22 C ATOM 232 CG ASP A 26 -4.882 24.683 11.414 1.00 55.21 C ATOM 233 OD1 ASP A 26 -3.662 24.799 11.174 1.00 31.14 O ATOM 234 OD2 ASP A 26 -5.773 25.156 10.678 1.00 41.44 O ATOM 0 H ASP A 26 -3.980 22.191 11.503 1.00 64.43 H new ATOM 0 HA ASP A 26 -3.408 23.945 13.669 1.00 1.15 H new ATOM 0 HB2 ASP A 26 -6.075 23.204 12.399 1.00 21.22 H new ATOM 0 HB3 ASP A 26 -5.750 24.627 13.369 1.00 21.22 H new ATOM 239 N LEU A 27 -5.203 21.252 14.286 1.00 64.42 N ATOM 240 CA LEU A 27 -5.720 20.405 15.355 1.00 70.41 C ATOM 241 C LEU A 27 -4.619 20.047 16.348 1.00 64.03 C ATOM 242 O LEU A 27 -4.865 19.930 17.548 1.00 12.52 O ATOM 243 CB LEU A 27 -6.330 19.129 14.772 1.00 74.04 C ATOM 244 CG LEU A 27 -6.606 18.001 15.767 1.00 51.05 C ATOM 245 CD1 LEU A 27 -8.064 17.573 15.698 1.00 42.12 C ATOM 246 CD2 LEU A 27 -5.688 16.818 15.499 1.00 63.51 C ATOM 0 H LEU A 27 -5.321 20.867 13.349 1.00 64.42 H new ATOM 0 HA LEU A 27 -6.493 20.962 15.884 1.00 70.41 H new ATOM 0 HB2 LEU A 27 -7.267 19.390 14.280 1.00 74.04 H new ATOM 0 HB3 LEU A 27 -5.660 18.750 14.000 1.00 74.04 H new ATOM 0 HG LEU A 27 -6.405 18.371 16.772 1.00 51.05 H new ATOM 0 HD11 LEU A 27 -8.242 16.770 16.413 1.00 42.12 H new ATOM 0 HD12 LEU A 27 -8.704 18.422 15.939 1.00 42.12 H new ATOM 0 HD13 LEU A 27 -8.293 17.221 14.692 1.00 42.12 H new ATOM 0 HD21 LEU A 27 -5.898 16.025 16.216 1.00 63.51 H new ATOM 0 HD22 LEU A 27 -5.858 16.448 14.488 1.00 63.51 H new ATOM 0 HD23 LEU A 27 -4.649 17.133 15.600 1.00 63.51 H new ATOM 258 N ARG A 28 -3.403 19.876 15.839 1.00 41.24 N ATOM 259 CA ARG A 28 -2.263 19.533 16.681 1.00 53.03 C ATOM 260 C ARG A 28 -1.971 20.648 17.681 1.00 71.22 C ATOM 261 O ARG A 28 -1.399 20.408 18.744 1.00 23.24 O ATOM 262 CB ARG A 28 -1.027 19.269 15.819 1.00 2.14 C ATOM 263 CG ARG A 28 0.279 19.653 16.495 1.00 24.33 C ATOM 264 CD ARG A 28 1.479 19.096 15.745 1.00 3.20 C ATOM 265 NE ARG A 28 2.723 19.755 16.135 1.00 12.24 N ATOM 266 CZ ARG A 28 3.366 19.499 17.269 1.00 14.23 C ATOM 267 NH1 ARG A 28 2.885 18.603 18.120 1.00 61.22 N ATOM 268 NH2 ARG A 28 4.492 20.140 17.554 1.00 10.22 N ATOM 0 H ARG A 28 -3.182 19.969 14.848 1.00 41.24 H new ATOM 0 HA ARG A 28 -2.511 18.628 17.235 1.00 53.03 H new ATOM 0 HB2 ARG A 28 -0.995 18.211 15.559 1.00 2.14 H new ATOM 0 HB3 ARG A 28 -1.120 19.824 14.885 1.00 2.14 H new ATOM 0 HG2 ARG A 28 0.355 20.739 16.551 1.00 24.33 H new ATOM 0 HG3 ARG A 28 0.283 19.280 17.519 1.00 24.33 H new ATOM 0 HD2 ARG A 28 1.561 18.026 15.936 1.00 3.20 H new ATOM 0 HD3 ARG A 28 1.325 19.218 14.673 1.00 3.20 H new ATOM 0 HE ARG A 28 3.120 20.450 15.502 1.00 12.24 H new ATOM 0 HH11 ARG A 28 2.019 18.108 17.905 1.00 61.22 H new ATOM 0 HH12 ARG A 28 3.381 18.408 18.990 1.00 61.22 H new ATOM 0 HH21 ARG A 28 4.865 20.830 16.902 1.00 10.22 H new ATOM 0 HH22 ARG A 28 4.985 19.943 18.425 1.00 10.22 H new ATOM 282 N HIS A 29 -2.368 21.868 17.332 1.00 23.31 N ATOM 283 CA HIS A 29 -2.149 23.020 18.199 1.00 25.12 C ATOM 284 C HIS A 29 -3.363 23.270 19.088 1.00 32.20 C ATOM 285 O HIS A 29 -3.514 24.348 19.663 1.00 40.11 O ATOM 286 CB HIS A 29 -1.849 24.264 17.363 1.00 11.50 C ATOM 287 CG HIS A 29 -0.701 25.074 17.883 1.00 31.41 C ATOM 288 ND1 HIS A 29 0.330 25.518 17.083 1.00 51.43 N ATOM 289 CD2 HIS A 29 -0.426 25.519 19.131 1.00 2.52 C ATOM 290 CE1 HIS A 29 1.191 26.201 17.816 1.00 14.32 C ATOM 291 NE2 HIS A 29 0.755 26.217 19.063 1.00 10.30 N ATOM 0 H HIS A 29 -2.843 22.084 16.455 1.00 23.31 H new ATOM 0 HA HIS A 29 -1.292 22.805 18.837 1.00 25.12 H new ATOM 0 HB2 HIS A 29 -1.634 23.960 16.339 1.00 11.50 H new ATOM 0 HB3 HIS A 29 -2.739 24.892 17.329 1.00 11.50 H new ATOM 0 HD2 HIS A 29 -1.024 25.356 20.016 1.00 2.52 H new ATOM 0 HE1 HIS A 29 2.097 26.667 17.457 1.00 14.32 H new ATOM 0 HE2 HIS A 29 1.220 26.674 19.848 1.00 10.30 H new ATOM 299 N LYS A 30 -4.228 22.267 19.196 1.00 62.32 N ATOM 300 CA LYS A 30 -5.429 22.376 20.014 1.00 13.24 C ATOM 301 C LYS A 30 -6.342 23.483 19.496 1.00 71.21 C ATOM 302 O LYS A 30 -6.839 24.304 20.267 1.00 42.44 O ATOM 303 CB LYS A 30 -5.055 22.651 21.473 1.00 44.05 C ATOM 304 CG LYS A 30 -3.968 21.733 22.005 1.00 43.14 C ATOM 305 CD LYS A 30 -3.899 21.771 23.522 1.00 11.21 C ATOM 306 CE LYS A 30 -2.548 22.274 24.006 1.00 1.54 C ATOM 307 NZ LYS A 30 -2.243 21.805 25.386 1.00 33.13 N ATOM 0 H LYS A 30 -4.119 21.368 18.726 1.00 62.32 H new ATOM 0 HA LYS A 30 -5.965 21.429 19.955 1.00 13.24 H new ATOM 0 HB2 LYS A 30 -4.723 23.685 21.566 1.00 44.05 H new ATOM 0 HB3 LYS A 30 -5.945 22.545 22.094 1.00 44.05 H new ATOM 0 HG2 LYS A 30 -4.159 20.712 21.674 1.00 43.14 H new ATOM 0 HG3 LYS A 30 -3.005 22.029 21.589 1.00 43.14 H new ATOM 0 HD2 LYS A 30 -4.688 22.417 23.907 1.00 11.21 H new ATOM 0 HD3 LYS A 30 -4.081 20.773 23.921 1.00 11.21 H new ATOM 0 HE2 LYS A 30 -1.768 21.932 23.326 1.00 1.54 H new ATOM 0 HE3 LYS A 30 -2.536 23.364 23.982 1.00 1.54 H new ATOM 0 HZ1 LYS A 30 -1.314 22.169 25.679 1.00 33.13 H new ATOM 0 HZ2 LYS A 30 -2.973 22.153 26.040 1.00 33.13 H new ATOM 0 HZ3 LYS A 30 -2.229 20.765 25.404 1.00 33.13 H new ATOM 321 N LYS A 31 -6.560 23.498 18.185 1.00 33.13 N ATOM 322 CA LYS A 31 -7.416 24.502 17.563 1.00 24.51 C ATOM 323 C LYS A 31 -8.889 24.161 17.764 1.00 2.00 C ATOM 324 O LYS A 31 -9.755 25.031 17.670 1.00 20.44 O ATOM 325 CB LYS A 31 -7.106 24.610 16.068 1.00 25.24 C ATOM 326 CG LYS A 31 -7.737 23.508 15.235 1.00 53.42 C ATOM 327 CD LYS A 31 -8.959 24.009 14.482 1.00 3.44 C ATOM 328 CE LYS A 31 -9.274 23.130 13.282 1.00 24.32 C ATOM 329 NZ LYS A 31 -10.735 22.873 13.151 1.00 44.22 N ATOM 0 H LYS A 31 -6.156 22.826 17.533 1.00 33.13 H new ATOM 0 HA LYS A 31 -7.215 25.461 18.040 1.00 24.51 H new ATOM 0 HB2 LYS A 31 -7.455 25.576 15.702 1.00 25.24 H new ATOM 0 HB3 LYS A 31 -6.025 24.587 15.927 1.00 25.24 H new ATOM 0 HG2 LYS A 31 -7.005 23.122 14.526 1.00 53.42 H new ATOM 0 HG3 LYS A 31 -8.022 22.679 15.883 1.00 53.42 H new ATOM 0 HD2 LYS A 31 -9.817 24.031 15.153 1.00 3.44 H new ATOM 0 HD3 LYS A 31 -8.788 25.033 14.149 1.00 3.44 H new ATOM 0 HE2 LYS A 31 -8.907 23.609 12.374 1.00 24.32 H new ATOM 0 HE3 LYS A 31 -8.746 22.181 13.378 1.00 24.32 H new ATOM 0 HZ1 LYS A 31 -10.904 22.229 12.352 1.00 44.22 H new ATOM 0 HZ2 LYS A 31 -11.091 22.439 14.027 1.00 44.22 H new ATOM 0 HZ3 LYS A 31 -11.232 23.771 12.983 1.00 44.22 H new ATOM 343 N SER A 32 -9.165 22.891 18.042 1.00 75.01 N ATOM 344 CA SER A 32 -10.534 22.436 18.254 1.00 74.51 C ATOM 345 C SER A 32 -10.576 21.289 19.260 1.00 1.52 C ATOM 346 O SER A 32 -10.881 21.492 20.436 1.00 60.34 O ATOM 347 CB SER A 32 -11.157 21.989 16.930 1.00 42.35 C ATOM 348 OG SER A 32 -10.165 21.818 15.932 1.00 41.10 O ATOM 0 H SER A 32 -8.459 22.159 18.126 1.00 75.01 H new ATOM 0 HA SER A 32 -11.109 23.271 18.655 1.00 74.51 H new ATOM 0 HB2 SER A 32 -11.696 21.053 17.076 1.00 42.35 H new ATOM 0 HB3 SER A 32 -11.886 22.729 16.599 1.00 42.35 H new ATOM 0 HG SER A 32 -10.370 21.021 15.400 1.00 41.10 H new ATOM 354 N ARG A 33 -10.267 20.086 18.789 1.00 20.34 N ATOM 355 CA ARG A 33 -10.270 18.906 19.646 1.00 1.35 C ATOM 356 C ARG A 33 -9.943 17.650 18.844 1.00 2.31 C ATOM 357 O ARG A 33 -8.905 17.021 19.052 1.00 41.42 O ATOM 358 CB ARG A 33 -11.630 18.749 20.329 1.00 70.23 C ATOM 359 CG ARG A 33 -11.594 19.009 21.826 1.00 72.42 C ATOM 360 CD ARG A 33 -11.114 17.786 22.592 1.00 34.11 C ATOM 361 NE ARG A 33 -11.043 18.034 24.030 1.00 52.04 N ATOM 362 CZ ARG A 33 -12.096 17.981 24.838 1.00 53.25 C ATOM 363 NH1 ARG A 33 -13.295 17.690 24.351 1.00 0.24 N ATOM 364 NH2 ARG A 33 -11.951 18.219 26.135 1.00 53.22 N ATOM 0 H ARG A 33 -10.011 19.902 17.819 1.00 20.34 H new ATOM 0 HA ARG A 33 -9.502 19.039 20.408 1.00 1.35 H new ATOM 0 HB2 ARG A 33 -12.340 19.435 19.867 1.00 70.23 H new ATOM 0 HB3 ARG A 33 -12.001 17.739 20.153 1.00 70.23 H new ATOM 0 HG2 ARG A 33 -10.935 19.852 22.034 1.00 72.42 H new ATOM 0 HG3 ARG A 33 -12.589 19.289 22.172 1.00 72.42 H new ATOM 0 HD2 ARG A 33 -11.788 16.951 22.401 1.00 34.11 H new ATOM 0 HD3 ARG A 33 -10.130 17.492 22.226 1.00 34.11 H new ATOM 0 HE ARG A 33 -10.135 18.260 24.436 1.00 52.04 H new ATOM 0 HH11 ARG A 33 -13.410 17.506 23.354 1.00 0.24 H new ATOM 0 HH12 ARG A 33 -14.102 17.650 24.973 1.00 0.24 H new ATOM 0 HH21 ARG A 33 -11.030 18.443 26.513 1.00 53.22 H new ATOM 0 HH22 ARG A 33 -12.760 18.178 26.755 1.00 53.22 H new ATOM 378 N TYR A 34 -10.835 17.291 17.928 1.00 60.00 N ATOM 379 CA TYR A 34 -10.643 16.109 17.096 1.00 20.35 C ATOM 380 C TYR A 34 -11.203 16.332 15.695 1.00 71.50 C ATOM 381 O TYR A 34 -12.097 17.154 15.494 1.00 31.33 O ATOM 382 CB TYR A 34 -11.314 14.893 17.739 1.00 41.34 C ATOM 383 CG TYR A 34 -12.805 14.828 17.500 1.00 55.44 C ATOM 384 CD1 TYR A 34 -13.322 14.183 16.383 1.00 53.12 C ATOM 385 CD2 TYR A 34 -13.698 15.413 18.390 1.00 61.03 C ATOM 386 CE1 TYR A 34 -14.684 14.122 16.160 1.00 73.23 C ATOM 387 CE2 TYR A 34 -15.061 15.355 18.176 1.00 53.35 C ATOM 388 CZ TYR A 34 -15.550 14.709 17.059 1.00 23.12 C ATOM 389 OH TYR A 34 -16.907 14.650 16.842 1.00 52.55 O ATOM 0 H TYR A 34 -11.698 17.802 17.743 1.00 60.00 H new ATOM 0 HA TYR A 34 -9.572 15.924 17.014 1.00 20.35 H new ATOM 0 HB2 TYR A 34 -10.852 13.986 17.350 1.00 41.34 H new ATOM 0 HB3 TYR A 34 -11.127 14.911 18.813 1.00 41.34 H new ATOM 0 HD1 TYR A 34 -12.647 13.721 15.677 1.00 53.12 H new ATOM 0 HD2 TYR A 34 -13.319 15.922 19.264 1.00 61.03 H new ATOM 0 HE1 TYR A 34 -15.069 13.617 15.286 1.00 73.23 H new ATOM 0 HE2 TYR A 34 -15.741 15.813 18.879 1.00 53.35 H new ATOM 0 HH TYR A 34 -17.318 14.055 17.503 1.00 52.55 H new ATOM 399 N VAL A 35 -10.670 15.592 14.727 1.00 34.24 N ATOM 400 CA VAL A 35 -11.117 15.706 13.344 1.00 21.11 C ATOM 401 C VAL A 35 -11.136 14.344 12.659 1.00 53.11 C ATOM 402 O VAL A 35 -10.110 13.670 12.567 1.00 32.42 O ATOM 403 CB VAL A 35 -10.214 16.660 12.540 1.00 53.21 C ATOM 404 CG1 VAL A 35 -8.760 16.223 12.629 1.00 33.53 C ATOM 405 CG2 VAL A 35 -10.671 16.729 11.090 1.00 3.43 C ATOM 0 H VAL A 35 -9.928 14.908 14.876 1.00 34.24 H new ATOM 0 HA VAL A 35 -12.129 16.111 13.370 1.00 21.11 H new ATOM 0 HB VAL A 35 -10.294 17.658 12.971 1.00 53.21 H new ATOM 0 HG11 VAL A 35 -8.138 16.909 12.055 1.00 33.53 H new ATOM 0 HG12 VAL A 35 -8.441 16.230 13.671 1.00 33.53 H new ATOM 0 HG13 VAL A 35 -8.657 15.216 12.225 1.00 33.53 H new ATOM 0 HG21 VAL A 35 -10.022 17.407 10.536 1.00 3.43 H new ATOM 0 HG22 VAL A 35 -10.621 15.735 10.645 1.00 3.43 H new ATOM 0 HG23 VAL A 35 -11.697 17.094 11.049 1.00 3.43 H new ATOM 415 N ILE A 36 -12.310 13.946 12.179 1.00 44.21 N ATOM 416 CA ILE A 36 -12.462 12.665 11.500 1.00 11.32 C ATOM 417 C ILE A 36 -12.521 12.848 9.987 1.00 0.25 C ATOM 418 O ILE A 36 -13.254 13.698 9.483 1.00 34.11 O ATOM 419 CB ILE A 36 -13.732 11.929 11.967 1.00 65.43 C ATOM 420 CG1 ILE A 36 -13.833 11.958 13.493 1.00 3.02 C ATOM 421 CG2 ILE A 36 -13.729 10.495 11.458 1.00 22.32 C ATOM 422 CD1 ILE A 36 -15.062 11.259 14.031 1.00 63.02 C ATOM 0 H ILE A 36 -13.169 14.492 12.248 1.00 44.21 H new ATOM 0 HA ILE A 36 -11.589 12.066 11.757 1.00 11.32 H new ATOM 0 HB ILE A 36 -14.603 12.439 11.555 1.00 65.43 H new ATOM 0 HG12 ILE A 36 -12.944 11.490 13.917 1.00 3.02 H new ATOM 0 HG13 ILE A 36 -13.838 12.995 13.829 1.00 3.02 H new ATOM 0 HG21 ILE A 36 -14.632 9.987 11.796 1.00 22.32 H new ATOM 0 HG22 ILE A 36 -13.699 10.496 10.368 1.00 22.32 H new ATOM 0 HG23 ILE A 36 -12.853 9.973 11.845 1.00 22.32 H new ATOM 0 HD11 ILE A 36 -15.068 11.319 15.119 1.00 63.02 H new ATOM 0 HD12 ILE A 36 -15.957 11.741 13.636 1.00 63.02 H new ATOM 0 HD13 ILE A 36 -15.049 10.213 13.726 1.00 63.02 H new ATOM 434 N MET A 37 -11.745 12.044 9.269 1.00 65.30 N ATOM 435 CA MET A 37 -11.711 12.115 7.813 1.00 62.12 C ATOM 436 C MET A 37 -11.876 10.729 7.197 1.00 51.32 C ATOM 437 O MET A 37 -11.552 9.719 7.821 1.00 22.32 O ATOM 438 CB MET A 37 -10.397 12.742 7.342 1.00 72.12 C ATOM 439 CG MET A 37 -10.101 14.087 7.985 1.00 23.21 C ATOM 440 SD MET A 37 -8.791 13.992 9.221 1.00 42.15 S ATOM 441 CE MET A 37 -7.393 14.598 8.279 1.00 62.02 C ATOM 0 H MET A 37 -11.131 11.336 9.671 1.00 65.30 H new ATOM 0 HA MET A 37 -12.542 12.740 7.485 1.00 62.12 H new ATOM 0 HB2 MET A 37 -9.578 12.056 7.560 1.00 72.12 H new ATOM 0 HB3 MET A 37 -10.430 12.865 6.260 1.00 72.12 H new ATOM 0 HG2 MET A 37 -9.815 14.800 7.212 1.00 23.21 H new ATOM 0 HG3 MET A 37 -11.009 14.470 8.452 1.00 23.21 H new ATOM 0 HE1 MET A 37 -6.467 14.263 8.746 1.00 62.02 H new ATOM 0 HE2 MET A 37 -7.446 14.212 7.261 1.00 62.02 H new ATOM 0 HE3 MET A 37 -7.415 15.688 8.256 1.00 62.02 H new ATOM 451 N HIS A 38 -12.383 10.689 5.968 1.00 2.15 N ATOM 452 CA HIS A 38 -12.591 9.427 5.268 1.00 22.42 C ATOM 453 C HIS A 38 -12.078 9.510 3.834 1.00 52.34 C ATOM 454 O HIS A 38 -11.867 10.601 3.303 1.00 50.14 O ATOM 455 CB HIS A 38 -14.074 9.056 5.271 1.00 31.33 C ATOM 456 CG HIS A 38 -14.922 9.971 4.443 1.00 71.34 C ATOM 457 ND1 HIS A 38 -15.787 9.519 3.468 1.00 22.32 N ATOM 458 CD2 HIS A 38 -15.036 11.319 4.448 1.00 0.54 C ATOM 459 CE1 HIS A 38 -16.395 10.550 2.909 1.00 25.13 C ATOM 460 NE2 HIS A 38 -15.957 11.654 3.487 1.00 40.55 N ATOM 0 H HIS A 38 -12.657 11.516 5.437 1.00 2.15 H new ATOM 0 HA HIS A 38 -12.030 8.653 5.792 1.00 22.42 H new ATOM 0 HB2 HIS A 38 -14.186 8.037 4.901 1.00 31.33 H new ATOM 0 HB3 HIS A 38 -14.440 9.065 6.298 1.00 31.33 H new ATOM 0 HD2 HIS A 38 -14.502 12.004 5.089 1.00 0.54 H new ATOM 0 HE1 HIS A 38 -17.125 10.499 2.115 1.00 25.13 H new ATOM 0 HE2 HIS A 38 -16.255 12.602 3.257 1.00 40.55 H new ATOM 468 N ILE A 39 -11.880 8.352 3.213 1.00 42.41 N ATOM 469 CA ILE A 39 -11.392 8.296 1.840 1.00 35.33 C ATOM 470 C ILE A 39 -12.542 8.404 0.844 1.00 43.20 C ATOM 471 O ILE A 39 -13.471 7.597 0.861 1.00 12.24 O ATOM 472 CB ILE A 39 -10.617 6.993 1.572 1.00 65.31 C ATOM 473 CG1 ILE A 39 -9.614 6.729 2.697 1.00 1.33 C ATOM 474 CG2 ILE A 39 -9.906 7.067 0.229 1.00 61.44 C ATOM 475 CD1 ILE A 39 -8.854 5.431 2.538 1.00 44.42 C ATOM 0 H ILE A 39 -12.050 7.441 3.638 1.00 42.41 H new ATOM 0 HA ILE A 39 -10.719 9.143 1.708 1.00 35.33 H new ATOM 0 HB ILE A 39 -11.326 6.166 1.542 1.00 65.31 H new ATOM 0 HG12 ILE A 39 -8.903 7.554 2.739 1.00 1.33 H new ATOM 0 HG13 ILE A 39 -10.144 6.716 3.649 1.00 1.33 H new ATOM 0 HG21 ILE A 39 -9.362 6.139 0.053 1.00 61.44 H new ATOM 0 HG22 ILE A 39 -10.640 7.213 -0.564 1.00 61.44 H new ATOM 0 HG23 ILE A 39 -9.206 7.902 0.234 1.00 61.44 H new ATOM 0 HD11 ILE A 39 -8.162 5.310 3.371 1.00 44.42 H new ATOM 0 HD12 ILE A 39 -9.556 4.597 2.526 1.00 44.42 H new ATOM 0 HD13 ILE A 39 -8.296 5.449 1.602 1.00 44.42 H new ATOM 487 N VAL A 40 -12.471 9.407 -0.026 1.00 21.20 N ATOM 488 CA VAL A 40 -13.504 9.620 -1.033 1.00 23.13 C ATOM 489 C VAL A 40 -13.023 9.188 -2.413 1.00 61.44 C ATOM 490 O VAL A 40 -11.946 9.585 -2.860 1.00 34.34 O ATOM 491 CB VAL A 40 -13.935 11.097 -1.091 1.00 3.53 C ATOM 492 CG1 VAL A 40 -14.973 11.309 -2.182 1.00 70.40 C ATOM 493 CG2 VAL A 40 -14.469 11.550 0.260 1.00 72.51 C ATOM 0 H VAL A 40 -11.709 10.085 -0.054 1.00 21.20 H new ATOM 0 HA VAL A 40 -14.360 9.011 -0.742 1.00 23.13 H new ATOM 0 HB VAL A 40 -13.061 11.702 -1.332 1.00 3.53 H new ATOM 0 HG11 VAL A 40 -15.265 12.359 -2.207 1.00 70.40 H new ATOM 0 HG12 VAL A 40 -14.550 11.027 -3.146 1.00 70.40 H new ATOM 0 HG13 VAL A 40 -15.849 10.694 -1.976 1.00 70.40 H new ATOM 0 HG21 VAL A 40 -14.769 12.596 0.200 1.00 72.51 H new ATOM 0 HG22 VAL A 40 -15.330 10.941 0.534 1.00 72.51 H new ATOM 0 HG23 VAL A 40 -13.691 11.438 1.015 1.00 72.51 H new ATOM 503 N ASP A 41 -13.828 8.372 -3.085 1.00 41.14 N ATOM 504 CA ASP A 41 -13.486 7.886 -4.417 1.00 43.32 C ATOM 505 C ASP A 41 -12.218 7.038 -4.377 1.00 52.32 C ATOM 506 O ASP A 41 -11.603 6.776 -5.411 1.00 13.45 O ATOM 507 CB ASP A 41 -13.299 9.061 -5.379 1.00 64.51 C ATOM 508 CG ASP A 41 -13.862 8.775 -6.757 1.00 54.53 C ATOM 509 OD1 ASP A 41 -15.103 8.750 -6.897 1.00 53.15 O ATOM 510 OD2 ASP A 41 -13.063 8.579 -7.696 1.00 22.42 O ATOM 0 H ASP A 41 -14.722 8.033 -2.729 1.00 41.14 H new ATOM 0 HA ASP A 41 -14.307 7.263 -4.772 1.00 43.32 H new ATOM 0 HB2 ASP A 41 -13.785 9.945 -4.967 1.00 64.51 H new ATOM 0 HB3 ASP A 41 -12.237 9.292 -5.464 1.00 64.51 H new ATOM 515 N GLN A 42 -11.834 6.614 -3.178 1.00 22.12 N ATOM 516 CA GLN A 42 -10.638 5.797 -3.004 1.00 14.30 C ATOM 517 C GLN A 42 -9.450 6.408 -3.740 1.00 33.12 C ATOM 518 O GLN A 42 -8.573 5.693 -4.226 1.00 13.42 O ATOM 519 CB GLN A 42 -10.889 4.375 -3.508 1.00 32.23 C ATOM 520 CG GLN A 42 -12.201 3.780 -3.022 1.00 21.33 C ATOM 521 CD GLN A 42 -13.294 3.844 -4.070 1.00 35.44 C ATOM 522 OE1 GLN A 42 -14.112 4.765 -4.075 1.00 65.25 O ATOM 523 NE2 GLN A 42 -13.316 2.862 -4.964 1.00 43.41 N ATOM 0 H GLN A 42 -12.333 6.822 -2.313 1.00 22.12 H new ATOM 0 HA GLN A 42 -10.404 5.762 -1.940 1.00 14.30 H new ATOM 0 HB2 GLN A 42 -10.883 4.378 -4.598 1.00 32.23 H new ATOM 0 HB3 GLN A 42 -10.068 3.734 -3.187 1.00 32.23 H new ATOM 0 HG2 GLN A 42 -12.040 2.741 -2.734 1.00 21.33 H new ATOM 0 HG3 GLN A 42 -12.528 4.312 -2.129 1.00 21.33 H new ATOM 0 HE21 GLN A 42 -12.619 2.119 -4.922 1.00 43.41 H new ATOM 0 HE22 GLN A 42 -14.030 2.851 -5.692 1.00 43.41 H new ATOM 532 N LYS A 43 -9.428 7.734 -3.819 1.00 4.03 N ATOM 533 CA LYS A 43 -8.347 8.442 -4.494 1.00 51.44 C ATOM 534 C LYS A 43 -8.042 9.764 -3.796 1.00 30.55 C ATOM 535 O LYS A 43 -6.880 10.137 -3.632 1.00 74.54 O ATOM 536 CB LYS A 43 -8.715 8.700 -5.957 1.00 40.23 C ATOM 537 CG LYS A 43 -7.535 8.599 -6.908 1.00 42.51 C ATOM 538 CD LYS A 43 -7.709 9.511 -8.111 1.00 62.14 C ATOM 539 CE LYS A 43 -7.564 8.744 -9.417 1.00 1.20 C ATOM 540 NZ LYS A 43 -6.851 9.542 -10.453 1.00 0.14 N ATOM 0 H LYS A 43 -10.147 8.340 -3.424 1.00 4.03 H new ATOM 0 HA LYS A 43 -7.456 7.816 -4.454 1.00 51.44 H new ATOM 0 HB2 LYS A 43 -9.479 7.985 -6.262 1.00 40.23 H new ATOM 0 HB3 LYS A 43 -9.156 9.693 -6.042 1.00 40.23 H new ATOM 0 HG2 LYS A 43 -6.618 8.862 -6.381 1.00 42.51 H new ATOM 0 HG3 LYS A 43 -7.425 7.568 -7.245 1.00 42.51 H new ATOM 0 HD2 LYS A 43 -8.691 9.983 -8.072 1.00 62.14 H new ATOM 0 HD3 LYS A 43 -6.969 10.310 -8.073 1.00 62.14 H new ATOM 0 HE2 LYS A 43 -7.021 7.817 -9.235 1.00 1.20 H new ATOM 0 HE3 LYS A 43 -8.551 8.468 -9.787 1.00 1.20 H new ATOM 0 HZ1 LYS A 43 -6.773 8.985 -11.327 1.00 0.14 H new ATOM 0 HZ2 LYS A 43 -7.382 10.415 -10.645 1.00 0.14 H new ATOM 0 HZ3 LYS A 43 -5.899 9.784 -10.110 1.00 0.14 H new ATOM 554 N SER A 44 -9.092 10.466 -3.384 1.00 14.33 N ATOM 555 CA SER A 44 -8.936 11.747 -2.704 1.00 53.12 C ATOM 556 C SER A 44 -9.586 11.713 -1.324 1.00 61.42 C ATOM 557 O SER A 44 -10.759 11.363 -1.187 1.00 24.21 O ATOM 558 CB SER A 44 -9.550 12.871 -3.541 1.00 73.34 C ATOM 559 OG SER A 44 -8.590 13.870 -3.836 1.00 41.14 O ATOM 0 H SER A 44 -10.060 10.170 -3.509 1.00 14.33 H new ATOM 0 HA SER A 44 -7.870 11.936 -2.580 1.00 53.12 H new ATOM 0 HB2 SER A 44 -9.950 12.461 -4.469 1.00 73.34 H new ATOM 0 HB3 SER A 44 -10.387 13.315 -3.002 1.00 73.34 H new ATOM 0 HG SER A 44 -9.007 14.576 -4.373 1.00 41.14 H new ATOM 565 N ILE A 45 -8.815 12.078 -0.305 1.00 73.23 N ATOM 566 CA ILE A 45 -9.315 12.090 1.064 1.00 71.01 C ATOM 567 C ILE A 45 -10.121 13.354 1.344 1.00 61.02 C ATOM 568 O ILE A 45 -9.679 14.463 1.044 1.00 34.20 O ATOM 569 CB ILE A 45 -8.165 11.991 2.084 1.00 53.32 C ATOM 570 CG1 ILE A 45 -7.385 10.691 1.881 1.00 43.11 C ATOM 571 CG2 ILE A 45 -8.708 12.074 3.503 1.00 64.01 C ATOM 572 CD1 ILE A 45 -6.130 10.602 2.721 1.00 1.20 C ATOM 0 H ILE A 45 -7.842 12.369 -0.402 1.00 73.23 H new ATOM 0 HA ILE A 45 -9.961 11.219 1.172 1.00 71.01 H new ATOM 0 HB ILE A 45 -7.485 12.828 1.926 1.00 53.32 H new ATOM 0 HG12 ILE A 45 -8.033 9.847 2.119 1.00 43.11 H new ATOM 0 HG13 ILE A 45 -7.116 10.599 0.829 1.00 43.11 H new ATOM 0 HG21 ILE A 45 -7.884 12.003 4.213 1.00 64.01 H new ATOM 0 HG22 ILE A 45 -9.224 13.024 3.640 1.00 64.01 H new ATOM 0 HG23 ILE A 45 -9.406 11.254 3.674 1.00 64.01 H new ATOM 0 HD11 ILE A 45 -5.628 9.654 2.526 1.00 1.20 H new ATOM 0 HD12 ILE A 45 -5.463 11.425 2.466 1.00 1.20 H new ATOM 0 HD13 ILE A 45 -6.394 10.662 3.777 1.00 1.20 H new ATOM 584 N ALA A 46 -11.305 13.179 1.922 1.00 25.41 N ATOM 585 CA ALA A 46 -12.171 14.305 2.247 1.00 43.25 C ATOM 586 C ALA A 46 -12.667 14.220 3.686 1.00 62.41 C ATOM 587 O ALA A 46 -12.671 13.146 4.289 1.00 4.41 O ATOM 588 CB ALA A 46 -13.347 14.361 1.283 1.00 10.01 C ATOM 0 H ALA A 46 -11.686 12.267 2.175 1.00 25.41 H new ATOM 0 HA ALA A 46 -11.588 15.221 2.146 1.00 43.25 H new ATOM 0 HB1 ALA A 46 -13.986 15.207 1.537 1.00 10.01 H new ATOM 0 HB2 ALA A 46 -12.977 14.479 0.264 1.00 10.01 H new ATOM 0 HB3 ALA A 46 -13.922 13.438 1.356 1.00 10.01 H new ATOM 594 N VAL A 47 -13.085 15.357 4.232 1.00 44.43 N ATOM 595 CA VAL A 47 -13.583 15.411 5.601 1.00 74.33 C ATOM 596 C VAL A 47 -15.011 14.883 5.686 1.00 11.13 C ATOM 597 O VAL A 47 -15.846 15.175 4.830 1.00 44.44 O ATOM 598 CB VAL A 47 -13.544 16.847 6.157 1.00 71.52 C ATOM 599 CG1 VAL A 47 -14.379 17.778 5.291 1.00 32.42 C ATOM 600 CG2 VAL A 47 -14.025 16.872 7.600 1.00 73.13 C ATOM 0 H VAL A 47 -13.089 16.254 3.747 1.00 44.43 H new ATOM 0 HA VAL A 47 -12.928 14.780 6.202 1.00 74.33 H new ATOM 0 HB VAL A 47 -12.513 17.199 6.136 1.00 71.52 H new ATOM 0 HG11 VAL A 47 -14.339 18.788 5.699 1.00 32.42 H new ATOM 0 HG12 VAL A 47 -13.984 17.782 4.275 1.00 32.42 H new ATOM 0 HG13 VAL A 47 -15.413 17.433 5.277 1.00 32.42 H new ATOM 0 HG21 VAL A 47 -13.991 17.894 7.977 1.00 73.13 H new ATOM 0 HG22 VAL A 47 -15.049 16.501 7.649 1.00 73.13 H new ATOM 0 HG23 VAL A 47 -13.380 16.239 8.209 1.00 73.13 H new ATOM 610 N LYS A 48 -15.287 14.104 6.727 1.00 64.23 N ATOM 611 CA LYS A 48 -16.614 13.535 6.927 1.00 13.52 C ATOM 612 C LYS A 48 -17.348 14.251 8.057 1.00 5.40 C ATOM 613 O LYS A 48 -18.497 14.664 7.902 1.00 54.21 O ATOM 614 CB LYS A 48 -16.510 12.041 7.239 1.00 20.12 C ATOM 615 CG LYS A 48 -17.520 11.191 6.488 1.00 60.20 C ATOM 616 CD LYS A 48 -18.898 11.270 7.123 1.00 0.33 C ATOM 617 CE LYS A 48 -19.659 9.962 6.970 1.00 42.22 C ATOM 618 NZ LYS A 48 -20.470 9.936 5.721 1.00 31.33 N ATOM 0 H LYS A 48 -14.608 13.852 7.446 1.00 64.23 H new ATOM 0 HA LYS A 48 -17.181 13.669 6.006 1.00 13.52 H new ATOM 0 HB2 LYS A 48 -15.505 11.697 6.995 1.00 20.12 H new ATOM 0 HB3 LYS A 48 -16.647 11.892 8.310 1.00 20.12 H new ATOM 0 HG2 LYS A 48 -17.577 11.523 5.451 1.00 60.20 H new ATOM 0 HG3 LYS A 48 -17.184 10.154 6.473 1.00 60.20 H new ATOM 0 HD2 LYS A 48 -18.799 11.513 8.181 1.00 0.33 H new ATOM 0 HD3 LYS A 48 -19.466 12.078 6.663 1.00 0.33 H new ATOM 0 HE2 LYS A 48 -18.954 9.130 6.963 1.00 42.22 H new ATOM 0 HE3 LYS A 48 -20.312 9.819 7.831 1.00 42.22 H new ATOM 0 HZ1 LYS A 48 -20.974 9.029 5.653 1.00 31.33 H new ATOM 0 HZ2 LYS A 48 -21.160 10.714 5.739 1.00 31.33 H new ATOM 0 HZ3 LYS A 48 -19.844 10.047 4.898 1.00 31.33 H new ATOM 632 N THR A 49 -16.675 14.397 9.194 1.00 2.05 N ATOM 633 CA THR A 49 -17.262 15.063 10.350 1.00 52.31 C ATOM 634 C THR A 49 -16.186 15.505 11.336 1.00 55.15 C ATOM 635 O THR A 49 -15.631 14.688 12.070 1.00 31.50 O ATOM 636 CB THR A 49 -18.264 14.147 11.078 1.00 51.15 C ATOM 637 OG1 THR A 49 -19.347 13.813 10.203 1.00 72.05 O ATOM 638 CG2 THR A 49 -18.806 14.823 12.328 1.00 23.12 C ATOM 0 H THR A 49 -15.722 14.063 9.339 1.00 2.05 H new ATOM 0 HA THR A 49 -17.789 15.940 9.975 1.00 52.31 H new ATOM 0 HB THR A 49 -17.742 13.237 11.374 1.00 51.15 H new ATOM 0 HG1 THR A 49 -19.317 14.389 9.411 1.00 72.05 H new ATOM 0 HG21 THR A 49 -19.511 14.157 12.825 1.00 23.12 H new ATOM 0 HG22 THR A 49 -17.982 15.050 13.005 1.00 23.12 H new ATOM 0 HG23 THR A 49 -19.313 15.747 12.051 1.00 23.12 H new ATOM 646 N ILE A 50 -15.898 16.802 11.347 1.00 64.11 N ATOM 647 CA ILE A 50 -14.889 17.352 12.244 1.00 32.44 C ATOM 648 C ILE A 50 -15.529 17.927 13.503 1.00 1.14 C ATOM 649 O ILE A 50 -16.648 18.437 13.466 1.00 4.43 O ATOM 650 CB ILE A 50 -14.061 18.451 11.554 1.00 2.53 C ATOM 651 CG1 ILE A 50 -12.925 18.915 12.469 1.00 32.32 C ATOM 652 CG2 ILE A 50 -14.952 19.624 11.171 1.00 24.15 C ATOM 653 CD1 ILE A 50 -11.858 19.710 11.752 1.00 44.45 C ATOM 0 H ILE A 50 -16.349 17.491 10.745 1.00 64.11 H new ATOM 0 HA ILE A 50 -14.228 16.530 12.518 1.00 32.44 H new ATOM 0 HB ILE A 50 -13.624 18.039 10.644 1.00 2.53 H new ATOM 0 HG12 ILE A 50 -13.342 19.523 13.272 1.00 32.32 H new ATOM 0 HG13 ILE A 50 -12.466 18.043 12.935 1.00 32.32 H new ATOM 0 HG21 ILE A 50 -14.352 20.393 10.684 1.00 24.15 H new ATOM 0 HG22 ILE A 50 -15.729 19.283 10.487 1.00 24.15 H new ATOM 0 HG23 ILE A 50 -15.414 20.038 12.067 1.00 24.15 H new ATOM 0 HD11 ILE A 50 -11.086 20.005 12.462 1.00 44.45 H new ATOM 0 HD12 ILE A 50 -11.414 19.098 10.967 1.00 44.45 H new ATOM 0 HD13 ILE A 50 -12.304 20.601 11.309 1.00 44.45 H new ATOM 665 N GLY A 51 -14.809 17.842 14.618 1.00 10.52 N ATOM 666 CA GLY A 51 -15.322 18.360 15.873 1.00 4.32 C ATOM 667 C GLY A 51 -14.677 19.675 16.264 1.00 2.15 C ATOM 668 O GLY A 51 -13.884 20.234 15.507 1.00 30.12 O ATOM 0 H GLY A 51 -13.880 17.424 14.674 1.00 10.52 H new ATOM 0 HA2 GLY A 51 -16.400 18.498 15.792 1.00 4.32 H new ATOM 0 HA3 GLY A 51 -15.152 17.627 16.662 1.00 4.32 H new ATOM 672 N GLU A 52 -15.019 20.171 17.450 1.00 61.24 N ATOM 673 CA GLU A 52 -14.469 21.430 17.938 1.00 61.02 C ATOM 674 C GLU A 52 -15.033 21.773 19.313 1.00 12.25 C ATOM 675 O GLU A 52 -15.770 22.747 19.468 1.00 2.35 O ATOM 676 CB GLU A 52 -14.773 22.561 16.953 1.00 31.10 C ATOM 677 CG GLU A 52 -16.220 22.593 16.491 1.00 71.43 C ATOM 678 CD GLU A 52 -16.707 23.998 16.194 1.00 70.43 C ATOM 679 OE1 GLU A 52 -16.447 24.493 15.077 1.00 30.33 O ATOM 680 OE2 GLU A 52 -17.349 24.602 17.079 1.00 62.24 O ATOM 0 H GLU A 52 -15.674 19.720 18.089 1.00 61.24 H new ATOM 0 HA GLU A 52 -13.389 21.315 18.026 1.00 61.02 H new ATOM 0 HB2 GLU A 52 -14.529 23.515 17.421 1.00 31.10 H new ATOM 0 HB3 GLU A 52 -14.125 22.458 16.083 1.00 31.10 H new ATOM 0 HG2 GLU A 52 -16.325 21.979 15.596 1.00 71.43 H new ATOM 0 HG3 GLU A 52 -16.853 22.148 17.259 1.00 71.43 H new ATOM 687 N ARG A 53 -14.682 20.965 20.309 1.00 54.33 N ATOM 688 CA ARG A 53 -15.155 21.182 21.671 1.00 63.41 C ATOM 689 C ARG A 53 -16.673 21.335 21.702 1.00 24.22 C ATOM 690 O ARG A 53 -17.193 22.448 21.763 1.00 33.32 O ATOM 691 CB ARG A 53 -14.494 22.424 22.272 1.00 64.45 C ATOM 692 CG ARG A 53 -12.994 22.279 22.471 1.00 62.10 C ATOM 693 CD ARG A 53 -12.532 22.972 23.743 1.00 24.02 C ATOM 694 NE ARG A 53 -12.515 24.425 23.600 1.00 40.23 N ATOM 695 CZ ARG A 53 -11.621 25.081 22.868 1.00 12.30 C ATOM 696 NH1 ARG A 53 -10.677 24.417 22.216 1.00 22.15 N ATOM 697 NH2 ARG A 53 -11.672 26.405 22.787 1.00 65.35 N ATOM 0 H ARG A 53 -14.072 20.155 20.198 1.00 54.33 H new ATOM 0 HA ARG A 53 -14.883 20.310 22.266 1.00 63.41 H new ATOM 0 HB2 ARG A 53 -14.685 23.278 21.622 1.00 64.45 H new ATOM 0 HB3 ARG A 53 -14.960 22.645 23.232 1.00 64.45 H new ATOM 0 HG2 ARG A 53 -12.732 21.222 22.516 1.00 62.10 H new ATOM 0 HG3 ARG A 53 -12.470 22.701 21.614 1.00 62.10 H new ATOM 0 HD2 ARG A 53 -13.192 22.697 24.566 1.00 24.02 H new ATOM 0 HD3 ARG A 53 -11.533 22.622 24.004 1.00 24.02 H new ATOM 0 HE ARG A 53 -13.228 24.966 24.089 1.00 40.23 H new ATOM 0 HH11 ARG A 53 -10.635 23.400 22.275 1.00 22.15 H new ATOM 0 HH12 ARG A 53 -9.992 24.923 21.655 1.00 22.15 H new ATOM 0 HH21 ARG A 53 -12.398 26.919 23.287 1.00 65.35 H new ATOM 0 HH22 ARG A 53 -10.986 26.908 22.225 1.00 65.35 H new ATOM 711 N GLY A 54 -17.377 20.208 21.659 1.00 32.13 N ATOM 712 CA GLY A 54 -18.828 20.239 21.683 1.00 61.21 C ATOM 713 C GLY A 54 -19.445 19.025 21.016 1.00 45.42 C ATOM 714 O GLY A 54 -20.614 18.714 21.238 1.00 20.44 O ATOM 0 H GLY A 54 -16.969 19.275 21.608 1.00 32.13 H new ATOM 0 HA2 GLY A 54 -19.170 20.295 22.716 1.00 61.21 H new ATOM 0 HA3 GLY A 54 -19.177 21.142 21.182 1.00 61.21 H new ATOM 718 N ALA A 55 -18.657 18.340 20.194 1.00 62.32 N ATOM 719 CA ALA A 55 -19.132 17.154 19.492 1.00 32.34 C ATOM 720 C ALA A 55 -19.391 16.008 20.464 1.00 24.45 C ATOM 721 O ALA A 55 -18.487 15.566 21.173 1.00 43.43 O ATOM 722 CB ALA A 55 -18.128 16.731 18.430 1.00 54.11 C ATOM 0 H ALA A 55 -17.687 18.586 19.998 1.00 62.32 H new ATOM 0 HA ALA A 55 -20.075 17.404 19.005 1.00 32.34 H new ATOM 0 HB1 ALA A 55 -18.496 15.844 17.914 1.00 54.11 H new ATOM 0 HB2 ALA A 55 -17.996 17.540 17.712 1.00 54.11 H new ATOM 0 HB3 ALA A 55 -17.172 16.505 18.902 1.00 54.11 H new ATOM 728 N ASN A 56 -20.631 15.530 20.493 1.00 2.43 N ATOM 729 CA ASN A 56 -21.008 14.436 21.380 1.00 31.11 C ATOM 730 C ASN A 56 -20.597 13.091 20.789 1.00 34.42 C ATOM 731 O ASN A 56 -20.112 13.019 19.660 1.00 70.40 O ATOM 732 CB ASN A 56 -22.517 14.455 21.634 1.00 22.32 C ATOM 733 CG ASN A 56 -22.878 15.176 22.919 1.00 61.34 C ATOM 734 OD1 ASN A 56 -23.524 16.223 22.895 1.00 43.51 O ATOM 735 ND2 ASN A 56 -22.461 14.616 24.048 1.00 21.03 N ATOM 0 H ASN A 56 -21.392 15.883 19.912 1.00 2.43 H new ATOM 0 HA ASN A 56 -20.485 14.572 22.327 1.00 31.11 H new ATOM 0 HB2 ASN A 56 -23.018 14.939 20.796 1.00 22.32 H new ATOM 0 HB3 ASN A 56 -22.888 13.431 21.678 1.00 22.32 H new ATOM 0 HD21 ASN A 56 -22.674 15.055 24.944 1.00 21.03 H new ATOM 0 HD22 ASN A 56 -21.928 13.747 24.020 1.00 21.03 H new ATOM 742 N PHE A 57 -20.796 12.027 21.560 1.00 31.50 N ATOM 743 CA PHE A 57 -20.446 10.683 21.114 1.00 53.14 C ATOM 744 C PHE A 57 -21.362 10.231 19.979 1.00 3.35 C ATOM 745 O PHE A 57 -20.926 9.554 19.048 1.00 12.01 O ATOM 746 CB PHE A 57 -20.535 9.696 22.279 1.00 3.15 C ATOM 747 CG PHE A 57 -21.922 9.547 22.835 1.00 52.12 C ATOM 748 CD1 PHE A 57 -22.368 10.374 23.853 1.00 4.33 C ATOM 749 CD2 PHE A 57 -22.781 8.580 22.338 1.00 14.21 C ATOM 750 CE1 PHE A 57 -23.644 10.239 24.367 1.00 64.35 C ATOM 751 CE2 PHE A 57 -24.059 8.440 22.847 1.00 2.12 C ATOM 752 CZ PHE A 57 -24.491 9.271 23.862 1.00 3.31 C ATOM 0 H PHE A 57 -21.198 12.069 22.497 1.00 31.50 H new ATOM 0 HA PHE A 57 -19.421 10.706 20.744 1.00 53.14 H new ATOM 0 HB2 PHE A 57 -20.179 8.721 21.946 1.00 3.15 H new ATOM 0 HB3 PHE A 57 -19.867 10.025 23.075 1.00 3.15 H new ATOM 0 HD1 PHE A 57 -21.711 11.133 24.250 1.00 4.33 H new ATOM 0 HD2 PHE A 57 -22.448 7.928 21.544 1.00 14.21 H new ATOM 0 HE1 PHE A 57 -23.978 10.889 25.162 1.00 64.35 H new ATOM 0 HE2 PHE A 57 -24.719 7.682 22.451 1.00 2.12 H new ATOM 0 HZ PHE A 57 -25.489 9.164 24.260 1.00 3.31 H new ATOM 762 N ASP A 58 -22.632 10.611 20.066 1.00 61.50 N ATOM 763 CA ASP A 58 -23.610 10.246 19.048 1.00 61.53 C ATOM 764 C ASP A 58 -23.155 10.707 17.667 1.00 42.42 C ATOM 765 O ASP A 58 -23.208 9.948 16.700 1.00 64.01 O ATOM 766 CB ASP A 58 -24.974 10.854 19.379 1.00 63.43 C ATOM 767 CG ASP A 58 -26.123 9.956 18.966 1.00 35.43 C ATOM 768 OD1 ASP A 58 -25.986 9.247 17.948 1.00 73.14 O ATOM 769 OD2 ASP A 58 -27.161 9.962 19.662 1.00 41.10 O ATOM 0 H ASP A 58 -23.008 11.171 20.831 1.00 61.50 H new ATOM 0 HA ASP A 58 -23.698 9.160 19.037 1.00 61.53 H new ATOM 0 HB2 ASP A 58 -25.033 11.045 20.450 1.00 63.43 H new ATOM 0 HB3 ASP A 58 -25.071 11.817 18.878 1.00 63.43 H new ATOM 774 N GLN A 59 -22.709 11.957 17.583 1.00 34.14 N ATOM 775 CA GLN A 59 -22.247 12.520 16.320 1.00 30.23 C ATOM 776 C GLN A 59 -21.058 11.734 15.777 1.00 74.13 C ATOM 777 O GLN A 59 -20.971 11.471 14.577 1.00 12.01 O ATOM 778 CB GLN A 59 -21.862 13.989 16.503 1.00 23.21 C ATOM 779 CG GLN A 59 -23.050 14.936 16.487 1.00 14.20 C ATOM 780 CD GLN A 59 -22.716 16.282 15.875 1.00 42.12 C ATOM 781 OE1 GLN A 59 -22.404 16.377 14.687 1.00 22.44 O ATOM 782 NE2 GLN A 59 -22.779 17.333 16.684 1.00 53.10 N ATOM 0 H GLN A 59 -22.658 12.598 18.375 1.00 34.14 H new ATOM 0 HA GLN A 59 -23.063 12.453 15.600 1.00 30.23 H new ATOM 0 HB2 GLN A 59 -21.331 14.102 17.448 1.00 23.21 H new ATOM 0 HB3 GLN A 59 -21.169 14.276 15.712 1.00 23.21 H new ATOM 0 HG2 GLN A 59 -23.866 14.479 15.927 1.00 14.20 H new ATOM 0 HG3 GLN A 59 -23.406 15.083 17.507 1.00 14.20 H new ATOM 0 HE21 GLN A 59 -23.042 17.209 17.662 1.00 53.10 H new ATOM 0 HE22 GLN A 59 -22.565 18.264 16.328 1.00 53.10 H new ATOM 791 N PHE A 60 -20.145 11.362 16.667 1.00 64.42 N ATOM 792 CA PHE A 60 -18.960 10.607 16.276 1.00 22.41 C ATOM 793 C PHE A 60 -19.348 9.272 15.647 1.00 75.12 C ATOM 794 O PHE A 60 -18.893 8.933 14.554 1.00 22.23 O ATOM 795 CB PHE A 60 -18.058 10.368 17.489 1.00 50.10 C ATOM 796 CG PHE A 60 -16.642 10.025 17.125 1.00 61.02 C ATOM 797 CD1 PHE A 60 -16.353 8.857 16.437 1.00 50.42 C ATOM 798 CD2 PHE A 60 -15.600 10.870 17.470 1.00 44.12 C ATOM 799 CE1 PHE A 60 -15.051 8.539 16.101 1.00 23.03 C ATOM 800 CE2 PHE A 60 -14.295 10.557 17.137 1.00 51.15 C ATOM 801 CZ PHE A 60 -14.021 9.390 16.450 1.00 4.44 C ATOM 0 H PHE A 60 -20.202 11.571 17.664 1.00 64.42 H new ATOM 0 HA PHE A 60 -18.415 11.193 15.536 1.00 22.41 H new ATOM 0 HB2 PHE A 60 -18.058 11.262 18.113 1.00 50.10 H new ATOM 0 HB3 PHE A 60 -18.476 9.560 18.089 1.00 50.10 H new ATOM 0 HD1 PHE A 60 -17.154 8.188 16.160 1.00 50.42 H new ATOM 0 HD2 PHE A 60 -15.809 11.784 18.005 1.00 44.12 H new ATOM 0 HE1 PHE A 60 -14.839 7.625 15.566 1.00 23.03 H new ATOM 0 HE2 PHE A 60 -13.491 11.223 17.413 1.00 51.15 H new ATOM 0 HZ PHE A 60 -13.003 9.144 16.186 1.00 4.44 H new ATOM 811 N ILE A 61 -20.192 8.519 16.345 1.00 54.35 N ATOM 812 CA ILE A 61 -20.643 7.222 15.855 1.00 42.54 C ATOM 813 C ILE A 61 -21.336 7.356 14.503 1.00 71.00 C ATOM 814 O ILE A 61 -21.077 6.581 13.583 1.00 41.32 O ATOM 815 CB ILE A 61 -21.607 6.549 16.849 1.00 22.21 C ATOM 816 CG1 ILE A 61 -20.929 6.370 18.209 1.00 44.21 C ATOM 817 CG2 ILE A 61 -22.077 5.208 16.305 1.00 22.13 C ATOM 818 CD1 ILE A 61 -19.736 5.440 18.172 1.00 13.01 C ATOM 0 H ILE A 61 -20.577 8.785 17.251 1.00 54.35 H new ATOM 0 HA ILE A 61 -19.755 6.600 15.745 1.00 42.54 H new ATOM 0 HB ILE A 61 -22.478 7.192 16.980 1.00 22.21 H new ATOM 0 HG12 ILE A 61 -20.608 7.345 18.577 1.00 44.21 H new ATOM 0 HG13 ILE A 61 -21.658 5.984 18.921 1.00 44.21 H new ATOM 0 HG21 ILE A 61 -22.758 4.744 17.019 1.00 22.13 H new ATOM 0 HG22 ILE A 61 -22.594 5.361 15.357 1.00 22.13 H new ATOM 0 HG23 ILE A 61 -21.217 4.557 16.149 1.00 22.13 H new ATOM 0 HD11 ILE A 61 -19.306 5.361 19.170 1.00 13.01 H new ATOM 0 HD12 ILE A 61 -20.054 4.454 17.834 1.00 13.01 H new ATOM 0 HD13 ILE A 61 -18.988 5.835 17.485 1.00 13.01 H new ATOM 830 N GLU A 62 -22.217 8.345 14.391 1.00 12.11 N ATOM 831 CA GLU A 62 -22.947 8.580 13.151 1.00 40.43 C ATOM 832 C GLU A 62 -21.986 8.859 11.999 1.00 60.25 C ATOM 833 O GLU A 62 -22.191 8.391 10.879 1.00 41.53 O ATOM 834 CB GLU A 62 -23.915 9.754 13.317 1.00 23.11 C ATOM 835 CG GLU A 62 -25.374 9.335 13.386 1.00 25.45 C ATOM 836 CD GLU A 62 -25.947 8.992 12.025 1.00 34.14 C ATOM 837 OE1 GLU A 62 -26.258 9.929 11.260 1.00 32.13 O ATOM 838 OE2 GLU A 62 -26.086 7.788 11.725 1.00 22.23 O ATOM 0 H GLU A 62 -22.442 8.996 15.143 1.00 12.11 H new ATOM 0 HA GLU A 62 -23.516 7.680 12.918 1.00 40.43 H new ATOM 0 HB2 GLU A 62 -23.659 10.299 14.225 1.00 23.11 H new ATOM 0 HB3 GLU A 62 -23.783 10.444 12.483 1.00 23.11 H new ATOM 0 HG2 GLU A 62 -25.469 8.472 14.044 1.00 25.45 H new ATOM 0 HG3 GLU A 62 -25.959 10.141 13.830 1.00 25.45 H new ATOM 845 N ALA A 63 -20.937 9.624 12.282 1.00 11.14 N ATOM 846 CA ALA A 63 -19.944 9.964 11.271 1.00 3.14 C ATOM 847 C ALA A 63 -19.204 8.721 10.788 1.00 34.13 C ATOM 848 O ALA A 63 -19.120 8.465 9.587 1.00 51.43 O ATOM 849 CB ALA A 63 -18.959 10.986 11.821 1.00 32.55 C ATOM 0 H ALA A 63 -20.753 10.020 13.204 1.00 11.14 H new ATOM 0 HA ALA A 63 -20.465 10.399 10.418 1.00 3.14 H new ATOM 0 HB1 ALA A 63 -18.223 11.231 11.055 1.00 32.55 H new ATOM 0 HB2 ALA A 63 -19.496 11.889 12.110 1.00 32.55 H new ATOM 0 HB3 ALA A 63 -18.452 10.571 12.692 1.00 32.55 H new ATOM 855 N ILE A 64 -18.670 7.952 11.731 1.00 11.22 N ATOM 856 CA ILE A 64 -17.938 6.736 11.401 1.00 73.34 C ATOM 857 C ILE A 64 -18.862 5.688 10.788 1.00 23.02 C ATOM 858 O ILE A 64 -20.016 5.550 11.193 1.00 11.14 O ATOM 859 CB ILE A 64 -17.252 6.136 12.642 1.00 14.34 C ATOM 860 CG1 ILE A 64 -18.291 5.808 13.717 1.00 61.41 C ATOM 861 CG2 ILE A 64 -16.206 7.098 13.186 1.00 53.14 C ATOM 862 CD1 ILE A 64 -17.694 5.208 14.971 1.00 40.40 C ATOM 0 H ILE A 64 -18.731 8.150 12.730 1.00 11.22 H new ATOM 0 HA ILE A 64 -17.175 7.015 10.674 1.00 73.34 H new ATOM 0 HB ILE A 64 -16.752 5.212 12.352 1.00 14.34 H new ATOM 0 HG12 ILE A 64 -18.829 6.718 13.980 1.00 61.41 H new ATOM 0 HG13 ILE A 64 -19.022 5.113 13.304 1.00 61.41 H new ATOM 0 HG21 ILE A 64 -15.730 6.660 14.063 1.00 53.14 H new ATOM 0 HG22 ILE A 64 -15.453 7.287 12.421 1.00 53.14 H new ATOM 0 HG23 ILE A 64 -16.685 8.037 13.464 1.00 53.14 H new ATOM 0 HD11 ILE A 64 -18.488 5.001 15.689 1.00 40.40 H new ATOM 0 HD12 ILE A 64 -17.180 4.280 14.721 1.00 40.40 H new ATOM 0 HD13 ILE A 64 -16.984 5.910 15.408 1.00 40.40 H new ATOM 874 N ASP A 65 -18.345 4.951 9.811 1.00 31.34 N ATOM 875 CA ASP A 65 -19.122 3.912 9.144 1.00 10.44 C ATOM 876 C ASP A 65 -18.368 2.587 9.142 1.00 64.55 C ATOM 877 O ASP A 65 -17.222 2.512 8.697 1.00 41.42 O ATOM 878 CB ASP A 65 -19.448 4.331 7.710 1.00 45.31 C ATOM 879 CG ASP A 65 -20.808 3.839 7.258 1.00 54.43 C ATOM 880 OD1 ASP A 65 -21.049 2.616 7.326 1.00 15.24 O ATOM 881 OD2 ASP A 65 -21.632 4.677 6.834 1.00 10.52 O ATOM 0 H ASP A 65 -17.392 5.054 9.463 1.00 31.34 H new ATOM 0 HA ASP A 65 -20.053 3.778 9.695 1.00 10.44 H new ATOM 0 HB2 ASP A 65 -19.415 5.418 7.636 1.00 45.31 H new ATOM 0 HB3 ASP A 65 -18.683 3.942 7.038 1.00 45.31 H new ATOM 886 N LYS A 66 -19.017 1.541 9.642 1.00 72.02 N ATOM 887 CA LYS A 66 -18.409 0.217 9.697 1.00 32.15 C ATOM 888 C LYS A 66 -18.343 -0.410 8.309 1.00 72.34 C ATOM 889 O LYS A 66 -19.140 -1.286 7.974 1.00 11.24 O ATOM 890 CB LYS A 66 -19.201 -0.691 10.642 1.00 64.04 C ATOM 891 CG LYS A 66 -18.719 -0.639 12.081 1.00 21.21 C ATOM 892 CD LYS A 66 -18.935 -1.966 12.790 1.00 53.23 C ATOM 893 CE LYS A 66 -17.971 -3.029 12.288 1.00 25.42 C ATOM 894 NZ LYS A 66 -18.662 -4.318 12.007 1.00 15.23 N ATOM 0 H LYS A 66 -19.965 1.585 10.015 1.00 72.02 H new ATOM 0 HA LYS A 66 -17.392 0.327 10.075 1.00 32.15 H new ATOM 0 HB2 LYS A 66 -20.253 -0.406 10.609 1.00 64.04 H new ATOM 0 HB3 LYS A 66 -19.138 -1.718 10.283 1.00 64.04 H new ATOM 0 HG2 LYS A 66 -17.660 -0.383 12.102 1.00 21.21 H new ATOM 0 HG3 LYS A 66 -19.249 0.150 12.615 1.00 21.21 H new ATOM 0 HD2 LYS A 66 -18.803 -1.832 13.864 1.00 53.23 H new ATOM 0 HD3 LYS A 66 -19.961 -2.300 12.634 1.00 53.23 H new ATOM 0 HE2 LYS A 66 -17.480 -2.675 11.381 1.00 25.42 H new ATOM 0 HE3 LYS A 66 -17.190 -3.190 13.031 1.00 25.42 H new ATOM 0 HZ1 LYS A 66 -17.994 -5.105 12.132 1.00 15.23 H new ATOM 0 HZ2 LYS A 66 -19.460 -4.434 12.663 1.00 15.23 H new ATOM 0 HZ3 LYS A 66 -19.015 -4.316 11.029 1.00 15.23 H new ATOM 908 N ASN A 67 -17.387 0.043 7.504 1.00 21.25 N ATOM 909 CA ASN A 67 -17.217 -0.475 6.152 1.00 64.22 C ATOM 910 C ASN A 67 -16.042 0.203 5.453 1.00 13.42 C ATOM 911 O ASN A 67 -15.024 -0.429 5.171 1.00 12.21 O ATOM 912 CB ASN A 67 -18.496 -0.268 5.339 1.00 35.43 C ATOM 913 CG ASN A 67 -18.278 -0.476 3.853 1.00 4.30 C ATOM 914 OD1 ASN A 67 -17.990 0.470 3.119 1.00 75.12 O ATOM 915 ND2 ASN A 67 -18.413 -1.718 3.403 1.00 40.42 N ATOM 0 H ASN A 67 -16.718 0.768 7.765 1.00 21.25 H new ATOM 0 HA ASN A 67 -17.008 -1.542 6.223 1.00 64.22 H new ATOM 0 HB2 ASN A 67 -19.262 -0.959 5.691 1.00 35.43 H new ATOM 0 HB3 ASN A 67 -18.873 0.740 5.510 1.00 35.43 H new ATOM 0 HD21 ASN A 67 -18.277 -1.919 2.412 1.00 40.42 H new ATOM 0 HD22 ASN A 67 -18.653 -2.471 4.048 1.00 40.42 H new ATOM 922 N VAL A 68 -16.191 1.495 5.177 1.00 11.23 N ATOM 923 CA VAL A 68 -15.143 2.261 4.513 1.00 22.25 C ATOM 924 C VAL A 68 -14.053 2.669 5.498 1.00 11.44 C ATOM 925 O VAL A 68 -14.282 2.788 6.702 1.00 34.32 O ATOM 926 CB VAL A 68 -15.711 3.524 3.840 1.00 11.35 C ATOM 927 CG1 VAL A 68 -16.574 3.150 2.645 1.00 43.43 C ATOM 928 CG2 VAL A 68 -16.503 4.351 4.842 1.00 35.53 C ATOM 0 H VAL A 68 -17.028 2.033 5.403 1.00 11.23 H new ATOM 0 HA VAL A 68 -14.714 1.614 3.748 1.00 22.25 H new ATOM 0 HB VAL A 68 -14.878 4.129 3.481 1.00 11.35 H new ATOM 0 HG11 VAL A 68 -16.967 4.055 2.182 1.00 43.43 H new ATOM 0 HG12 VAL A 68 -15.973 2.603 1.919 1.00 43.43 H new ATOM 0 HG13 VAL A 68 -17.402 2.523 2.976 1.00 43.43 H new ATOM 0 HG21 VAL A 68 -16.897 5.240 4.349 1.00 35.53 H new ATOM 0 HG22 VAL A 68 -17.329 3.756 5.233 1.00 35.53 H new ATOM 0 HG23 VAL A 68 -15.851 4.650 5.663 1.00 35.53 H new ATOM 938 N PRO A 69 -12.837 2.891 4.977 1.00 14.31 N ATOM 939 CA PRO A 69 -11.687 3.291 5.793 1.00 12.41 C ATOM 940 C PRO A 69 -11.824 4.712 6.330 1.00 23.14 C ATOM 941 O PRO A 69 -11.920 5.670 5.562 1.00 22.41 O ATOM 942 CB PRO A 69 -10.511 3.199 4.818 1.00 51.33 C ATOM 943 CG PRO A 69 -11.121 3.381 3.471 1.00 41.33 C ATOM 944 CD PRO A 69 -12.492 2.769 3.551 1.00 51.12 C ATOM 0 HA PRO A 69 -11.576 2.663 6.677 1.00 12.41 H new ATOM 0 HB2 PRO A 69 -9.766 3.968 5.022 1.00 51.33 H new ATOM 0 HB3 PRO A 69 -10.006 2.237 4.897 1.00 51.33 H new ATOM 0 HG2 PRO A 69 -11.180 4.437 3.209 1.00 41.33 H new ATOM 0 HG3 PRO A 69 -10.521 2.895 2.702 1.00 41.33 H new ATOM 0 HD2 PRO A 69 -13.205 3.297 2.918 1.00 51.12 H new ATOM 0 HD3 PRO A 69 -12.487 1.729 3.226 1.00 51.12 H new ATOM 952 N CYS A 70 -11.831 4.841 7.652 1.00 11.14 N ATOM 953 CA CYS A 70 -11.956 6.146 8.292 1.00 32.24 C ATOM 954 C CYS A 70 -10.919 6.311 9.398 1.00 23.31 C ATOM 955 O CYS A 70 -10.632 5.371 10.140 1.00 61.54 O ATOM 956 CB CYS A 70 -13.363 6.323 8.866 1.00 61.12 C ATOM 957 SG CYS A 70 -13.890 8.047 9.008 1.00 33.44 S ATOM 0 H CYS A 70 -11.752 4.058 8.301 1.00 11.14 H new ATOM 0 HA CYS A 70 -11.780 6.912 7.536 1.00 32.24 H new ATOM 0 HB2 CYS A 70 -14.072 5.788 8.234 1.00 61.12 H new ATOM 0 HB3 CYS A 70 -13.403 5.860 9.852 1.00 61.12 H new ATOM 0 HG CYS A 70 -12.972 8.823 8.514 1.00 33.44 H new ATOM 963 N TYR A 71 -10.358 7.510 9.502 1.00 51.52 N ATOM 964 CA TYR A 71 -9.349 7.798 10.514 1.00 21.43 C ATOM 965 C TYR A 71 -9.703 9.060 11.294 1.00 15.02 C ATOM 966 O TYR A 71 -10.005 10.100 10.710 1.00 43.15 O ATOM 967 CB TYR A 71 -7.974 7.956 9.863 1.00 1.33 C ATOM 968 CG TYR A 71 -8.036 8.332 8.400 1.00 74.51 C ATOM 969 CD1 TYR A 71 -8.151 9.660 8.008 1.00 61.44 C ATOM 970 CD2 TYR A 71 -7.982 7.358 7.410 1.00 40.52 C ATOM 971 CE1 TYR A 71 -8.209 10.007 6.672 1.00 51.32 C ATOM 972 CE2 TYR A 71 -8.038 7.697 6.072 1.00 40.03 C ATOM 973 CZ TYR A 71 -8.152 9.023 5.708 1.00 63.43 C ATOM 974 OH TYR A 71 -8.209 9.364 4.376 1.00 73.21 O ATOM 0 H TYR A 71 -10.585 8.299 8.897 1.00 51.52 H new ATOM 0 HA TYR A 71 -9.320 6.960 11.210 1.00 21.43 H new ATOM 0 HB2 TYR A 71 -7.412 8.719 10.402 1.00 1.33 H new ATOM 0 HB3 TYR A 71 -7.423 7.021 9.966 1.00 1.33 H new ATOM 0 HD1 TYR A 71 -8.196 10.434 8.760 1.00 61.44 H new ATOM 0 HD2 TYR A 71 -7.895 6.319 7.691 1.00 40.52 H new ATOM 0 HE1 TYR A 71 -8.299 11.044 6.384 1.00 51.32 H new ATOM 0 HE2 TYR A 71 -7.993 6.928 5.315 1.00 40.03 H new ATOM 0 HH TYR A 71 -9.125 9.247 4.047 1.00 73.21 H new ATOM 984 N ALA A 72 -9.664 8.960 12.619 1.00 74.22 N ATOM 985 CA ALA A 72 -9.978 10.093 13.480 1.00 35.12 C ATOM 986 C ALA A 72 -8.751 10.542 14.266 1.00 33.44 C ATOM 987 O ALA A 72 -8.080 9.731 14.903 1.00 22.53 O ATOM 988 CB ALA A 72 -11.114 9.736 14.428 1.00 3.34 C ATOM 0 H ALA A 72 -9.418 8.106 13.119 1.00 74.22 H new ATOM 0 HA ALA A 72 -10.294 10.922 12.847 1.00 35.12 H new ATOM 0 HB1 ALA A 72 -11.338 10.591 15.065 1.00 3.34 H new ATOM 0 HB2 ALA A 72 -12.000 9.471 13.851 1.00 3.34 H new ATOM 0 HB3 ALA A 72 -10.818 8.889 15.048 1.00 3.34 H new ATOM 994 N ALA A 73 -8.464 11.838 14.216 1.00 1.25 N ATOM 995 CA ALA A 73 -7.318 12.394 14.925 1.00 10.52 C ATOM 996 C ALA A 73 -7.762 13.192 16.147 1.00 73.13 C ATOM 997 O ALA A 73 -8.411 14.230 16.020 1.00 14.42 O ATOM 998 CB ALA A 73 -6.494 13.270 13.992 1.00 34.31 C ATOM 0 H ALA A 73 -9.009 12.523 13.692 1.00 1.25 H new ATOM 0 HA ALA A 73 -6.699 11.566 15.270 1.00 10.52 H new ATOM 0 HB1 ALA A 73 -5.642 13.679 14.535 1.00 34.31 H new ATOM 0 HB2 ALA A 73 -6.137 12.673 13.153 1.00 34.31 H new ATOM 0 HB3 ALA A 73 -7.112 14.087 13.619 1.00 34.31 H new ATOM 1004 N PHE A 74 -7.409 12.699 17.329 1.00 14.35 N ATOM 1005 CA PHE A 74 -7.774 13.366 18.575 1.00 64.55 C ATOM 1006 C PHE A 74 -6.537 13.916 19.279 1.00 61.03 C ATOM 1007 O PHE A 74 -5.520 13.231 19.397 1.00 54.51 O ATOM 1008 CB PHE A 74 -8.512 12.396 19.500 1.00 62.34 C ATOM 1009 CG PHE A 74 -9.253 13.077 20.614 1.00 55.33 C ATOM 1010 CD1 PHE A 74 -8.566 13.665 21.663 1.00 32.05 C ATOM 1011 CD2 PHE A 74 -10.638 13.130 20.611 1.00 31.25 C ATOM 1012 CE1 PHE A 74 -9.246 14.293 22.690 1.00 3.32 C ATOM 1013 CE2 PHE A 74 -11.323 13.757 21.635 1.00 2.11 C ATOM 1014 CZ PHE A 74 -10.626 14.338 22.676 1.00 1.53 C ATOM 0 H PHE A 74 -6.871 11.841 17.451 1.00 14.35 H new ATOM 0 HA PHE A 74 -8.434 14.199 18.333 1.00 64.55 H new ATOM 0 HB2 PHE A 74 -9.217 11.810 18.911 1.00 62.34 H new ATOM 0 HB3 PHE A 74 -7.794 11.696 19.927 1.00 62.34 H new ATOM 0 HD1 PHE A 74 -7.487 13.633 21.679 1.00 32.05 H new ATOM 0 HD2 PHE A 74 -11.188 12.676 19.800 1.00 31.25 H new ATOM 0 HE1 PHE A 74 -8.698 14.748 23.502 1.00 3.32 H new ATOM 0 HE2 PHE A 74 -12.402 13.792 21.621 1.00 2.11 H new ATOM 0 HZ PHE A 74 -11.159 14.827 23.478 1.00 1.53 H new ATOM 1024 N ASP A 75 -6.632 15.157 19.744 1.00 64.33 N ATOM 1025 CA ASP A 75 -5.522 15.800 20.437 1.00 44.32 C ATOM 1026 C ASP A 75 -5.516 15.429 21.916 1.00 20.34 C ATOM 1027 O ASP A 75 -6.541 15.514 22.592 1.00 35.34 O ATOM 1028 CB ASP A 75 -5.606 17.319 20.280 1.00 15.31 C ATOM 1029 CG ASP A 75 -6.596 17.946 21.243 1.00 43.33 C ATOM 1030 OD1 ASP A 75 -7.736 17.445 21.331 1.00 22.02 O ATOM 1031 OD2 ASP A 75 -6.230 18.939 21.907 1.00 31.10 O ATOM 0 H ASP A 75 -7.466 15.737 19.654 1.00 64.33 H new ATOM 0 HA ASP A 75 -4.593 15.447 19.989 1.00 44.32 H new ATOM 0 HB2 ASP A 75 -4.620 17.753 20.443 1.00 15.31 H new ATOM 0 HB3 ASP A 75 -5.895 17.560 19.257 1.00 15.31 H new ATOM 1036 N PHE A 76 -4.355 15.015 22.413 1.00 3.40 N ATOM 1037 CA PHE A 76 -4.216 14.628 23.812 1.00 1.41 C ATOM 1038 C PHE A 76 -2.922 15.180 24.403 1.00 23.21 C ATOM 1039 O PHE A 76 -2.069 15.697 23.682 1.00 54.02 O ATOM 1040 CB PHE A 76 -4.243 13.105 23.947 1.00 62.51 C ATOM 1041 CG PHE A 76 -5.259 12.608 24.936 1.00 44.03 C ATOM 1042 CD1 PHE A 76 -6.610 12.838 24.735 1.00 31.30 C ATOM 1043 CD2 PHE A 76 -4.862 11.912 26.066 1.00 3.12 C ATOM 1044 CE1 PHE A 76 -7.548 12.382 25.643 1.00 65.22 C ATOM 1045 CE2 PHE A 76 -5.794 11.453 26.977 1.00 15.51 C ATOM 1046 CZ PHE A 76 -7.139 11.690 26.766 1.00 61.32 C ATOM 0 H PHE A 76 -3.497 14.939 21.867 1.00 3.40 H new ATOM 0 HA PHE A 76 -5.056 15.049 24.365 1.00 1.41 H new ATOM 0 HB2 PHE A 76 -4.452 12.666 22.972 1.00 62.51 H new ATOM 0 HB3 PHE A 76 -3.255 12.757 24.248 1.00 62.51 H new ATOM 0 HD1 PHE A 76 -6.935 13.380 23.859 1.00 31.30 H new ATOM 0 HD2 PHE A 76 -3.812 11.726 26.237 1.00 3.12 H new ATOM 0 HE1 PHE A 76 -8.599 12.567 25.474 1.00 65.22 H new ATOM 0 HE2 PHE A 76 -5.472 10.910 27.853 1.00 15.51 H new ATOM 0 HZ PHE A 76 -7.869 11.335 27.478 1.00 61.32 H new ATOM 1056 N GLU A 77 -2.784 15.065 25.720 1.00 4.33 N ATOM 1057 CA GLU A 77 -1.594 15.554 26.408 1.00 33.44 C ATOM 1058 C GLU A 77 -0.874 14.415 27.125 1.00 72.11 C ATOM 1059 O GLU A 77 -1.504 13.469 27.599 1.00 24.03 O ATOM 1060 CB GLU A 77 -1.971 16.645 27.412 1.00 1.23 C ATOM 1061 CG GLU A 77 -3.238 16.342 28.195 1.00 63.05 C ATOM 1062 CD GLU A 77 -3.342 17.151 29.473 1.00 64.20 C ATOM 1063 OE1 GLU A 77 -3.798 18.311 29.405 1.00 55.24 O ATOM 1064 OE2 GLU A 77 -2.966 16.624 30.541 1.00 11.21 O ATOM 0 H GLU A 77 -3.480 14.638 26.331 1.00 4.33 H new ATOM 0 HA GLU A 77 -0.920 15.974 25.661 1.00 33.44 H new ATOM 0 HB2 GLU A 77 -1.146 16.784 28.111 1.00 1.23 H new ATOM 0 HB3 GLU A 77 -2.100 17.588 26.880 1.00 1.23 H new ATOM 0 HG2 GLU A 77 -4.106 16.547 27.568 1.00 63.05 H new ATOM 0 HG3 GLU A 77 -3.265 15.280 28.439 1.00 63.05 H new ATOM 1167 N ARG A 85 3.392 18.308 27.720 1.00 1.23 N ATOM 1168 CA ARG A 85 3.660 17.931 26.338 1.00 73.52 C ATOM 1169 C ARG A 85 2.359 17.680 25.581 1.00 34.42 C ATOM 1170 O ARG A 85 1.321 17.404 26.184 1.00 23.14 O ATOM 1171 CB ARG A 85 4.540 16.680 26.290 1.00 75.05 C ATOM 1172 CG ARG A 85 5.631 16.744 25.234 1.00 71.44 C ATOM 1173 CD ARG A 85 5.325 15.826 24.060 1.00 12.21 C ATOM 1174 NE ARG A 85 6.516 15.536 23.267 1.00 41.02 N ATOM 1175 CZ ARG A 85 7.039 16.385 22.389 1.00 23.20 C ATOM 1176 NH1 ARG A 85 6.479 17.571 22.194 1.00 61.55 N ATOM 1177 NH2 ARG A 85 8.125 16.048 21.705 1.00 3.30 N ATOM 0 HA ARG A 85 4.186 18.756 25.858 1.00 73.52 H new ATOM 0 HB2 ARG A 85 5.000 16.532 27.267 1.00 75.05 H new ATOM 0 HB3 ARG A 85 3.911 15.811 26.098 1.00 75.05 H new ATOM 0 HG2 ARG A 85 5.735 17.769 24.878 1.00 71.44 H new ATOM 0 HG3 ARG A 85 6.586 16.462 25.678 1.00 71.44 H new ATOM 0 HD2 ARG A 85 4.900 14.893 24.431 1.00 12.21 H new ATOM 0 HD3 ARG A 85 4.570 16.290 23.425 1.00 12.21 H new ATOM 0 HE ARG A 85 6.971 14.632 23.394 1.00 41.02 H new ATOM 0 HH11 ARG A 85 5.645 17.833 22.719 1.00 61.55 H new ATOM 0 HH12 ARG A 85 6.883 18.221 21.519 1.00 61.55 H new ATOM 0 HH21 ARG A 85 8.559 15.137 21.853 1.00 3.30 H new ATOM 0 HH22 ARG A 85 8.526 16.700 21.031 1.00 3.30 H new ATOM 1191 N ASP A 86 2.422 17.778 24.258 1.00 74.41 N ATOM 1192 CA ASP A 86 1.249 17.561 23.419 1.00 71.25 C ATOM 1193 C ASP A 86 1.506 16.453 22.402 1.00 73.21 C ATOM 1194 O ASP A 86 2.555 16.416 21.759 1.00 50.12 O ATOM 1195 CB ASP A 86 0.866 18.854 22.697 1.00 61.34 C ATOM 1196 CG ASP A 86 2.048 19.501 22.003 1.00 4.41 C ATOM 1197 OD1 ASP A 86 2.493 18.968 20.965 1.00 60.11 O ATOM 1198 OD2 ASP A 86 2.528 20.542 22.498 1.00 45.41 O ATOM 0 H ASP A 86 3.272 18.006 23.743 1.00 74.41 H new ATOM 0 HA ASP A 86 0.424 17.255 24.062 1.00 71.25 H new ATOM 0 HB2 ASP A 86 0.089 18.640 21.963 1.00 61.34 H new ATOM 0 HB3 ASP A 86 0.441 19.556 23.415 1.00 61.34 H new ATOM 1203 N LYS A 87 0.541 15.550 22.262 1.00 21.23 N ATOM 1204 CA LYS A 87 0.661 14.440 21.324 1.00 21.03 C ATOM 1205 C LYS A 87 -0.664 14.181 20.616 1.00 75.24 C ATOM 1206 O LYS A 87 -1.735 14.309 21.212 1.00 44.20 O ATOM 1207 CB LYS A 87 1.117 13.175 22.055 1.00 71.21 C ATOM 1208 CG LYS A 87 1.980 12.259 21.205 1.00 45.24 C ATOM 1209 CD LYS A 87 3.460 12.498 21.455 1.00 62.34 C ATOM 1210 CE LYS A 87 4.298 11.304 21.023 1.00 32.54 C ATOM 1211 NZ LYS A 87 5.005 11.557 19.737 1.00 14.14 N ATOM 0 H LYS A 87 -0.334 15.565 22.787 1.00 21.23 H new ATOM 0 HA LYS A 87 1.406 14.708 20.575 1.00 21.03 H new ATOM 0 HB2 LYS A 87 1.675 13.462 22.946 1.00 71.21 H new ATOM 0 HB3 LYS A 87 0.239 12.624 22.392 1.00 71.21 H new ATOM 0 HG2 LYS A 87 1.736 11.220 21.425 1.00 45.24 H new ATOM 0 HG3 LYS A 87 1.757 12.422 20.151 1.00 45.24 H new ATOM 0 HD2 LYS A 87 3.783 13.386 20.912 1.00 62.34 H new ATOM 0 HD3 LYS A 87 3.624 12.695 22.514 1.00 62.34 H new ATOM 0 HE2 LYS A 87 5.028 11.073 21.799 1.00 32.54 H new ATOM 0 HE3 LYS A 87 3.656 10.429 20.918 1.00 32.54 H new ATOM 0 HZ1 LYS A 87 5.278 10.650 19.307 1.00 14.14 H new ATOM 0 HZ2 LYS A 87 4.374 12.071 19.089 1.00 14.14 H new ATOM 0 HZ3 LYS A 87 5.857 12.126 19.915 1.00 14.14 H new ATOM 1225 N LEU A 88 -0.587 13.814 19.341 1.00 2.21 N ATOM 1226 CA LEU A 88 -1.781 13.535 18.551 1.00 30.01 C ATOM 1227 C LEU A 88 -1.956 12.034 18.341 1.00 15.42 C ATOM 1228 O LEU A 88 -0.996 11.323 18.044 1.00 54.02 O ATOM 1229 CB LEU A 88 -1.699 14.245 17.199 1.00 71.35 C ATOM 1230 CG LEU A 88 -2.014 15.741 17.205 1.00 3.05 C ATOM 1231 CD1 LEU A 88 -0.773 16.546 17.559 1.00 64.22 C ATOM 1232 CD2 LEU A 88 -2.567 16.176 15.856 1.00 34.14 C ATOM 0 H LEU A 88 0.290 13.703 18.832 1.00 2.21 H new ATOM 0 HA LEU A 88 -2.646 13.910 19.099 1.00 30.01 H new ATOM 0 HB2 LEU A 88 -0.694 14.108 16.800 1.00 71.35 H new ATOM 0 HB3 LEU A 88 -2.386 13.752 16.511 1.00 71.35 H new ATOM 0 HG LEU A 88 -2.774 15.929 17.964 1.00 3.05 H new ATOM 0 HD11 LEU A 88 -1.016 17.609 17.558 1.00 64.22 H new ATOM 0 HD12 LEU A 88 -0.421 16.255 18.549 1.00 64.22 H new ATOM 0 HD13 LEU A 88 0.008 16.352 16.824 1.00 64.22 H new ATOM 0 HD21 LEU A 88 -2.785 17.244 15.879 1.00 34.14 H new ATOM 0 HD22 LEU A 88 -1.831 15.973 15.078 1.00 34.14 H new ATOM 0 HD23 LEU A 88 -3.482 15.623 15.642 1.00 34.14 H new ATOM 1244 N ILE A 89 -3.188 11.561 18.496 1.00 72.32 N ATOM 1245 CA ILE A 89 -3.490 10.146 18.320 1.00 64.53 C ATOM 1246 C ILE A 89 -4.418 9.925 17.130 1.00 24.10 C ATOM 1247 O ILE A 89 -5.250 10.775 16.812 1.00 41.33 O ATOM 1248 CB ILE A 89 -4.139 9.547 19.581 1.00 15.13 C ATOM 1249 CG1 ILE A 89 -3.395 10.013 20.835 1.00 74.44 C ATOM 1250 CG2 ILE A 89 -4.153 8.028 19.500 1.00 31.03 C ATOM 1251 CD1 ILE A 89 -3.982 9.474 22.121 1.00 62.34 C ATOM 0 H ILE A 89 -3.993 12.137 18.743 1.00 72.32 H new ATOM 0 HA ILE A 89 -2.541 9.642 18.136 1.00 64.53 H new ATOM 0 HB ILE A 89 -5.170 9.897 19.642 1.00 15.13 H new ATOM 0 HG12 ILE A 89 -2.352 9.705 20.764 1.00 74.44 H new ATOM 0 HG13 ILE A 89 -3.404 11.102 20.869 1.00 74.44 H new ATOM 0 HG21 ILE A 89 -4.615 7.620 20.399 1.00 31.03 H new ATOM 0 HG22 ILE A 89 -4.723 7.716 18.625 1.00 31.03 H new ATOM 0 HG23 ILE A 89 -3.131 7.659 19.418 1.00 31.03 H new ATOM 0 HD11 ILE A 89 -3.405 9.845 22.968 1.00 62.34 H new ATOM 0 HD12 ILE A 89 -5.017 9.804 22.215 1.00 62.34 H new ATOM 0 HD13 ILE A 89 -3.948 8.385 22.108 1.00 62.34 H new ATOM 1263 N LEU A 90 -4.270 8.778 16.477 1.00 75.50 N ATOM 1264 CA LEU A 90 -5.097 8.443 15.322 1.00 20.14 C ATOM 1265 C LEU A 90 -5.713 7.056 15.477 1.00 13.34 C ATOM 1266 O LEU A 90 -5.001 6.062 15.615 1.00 24.45 O ATOM 1267 CB LEU A 90 -4.265 8.503 14.040 1.00 10.31 C ATOM 1268 CG LEU A 90 -4.976 8.070 12.758 1.00 60.33 C ATOM 1269 CD1 LEU A 90 -4.700 9.057 11.634 1.00 12.25 C ATOM 1270 CD2 LEU A 90 -4.543 6.667 12.356 1.00 43.43 C ATOM 0 H LEU A 90 -3.586 8.064 16.727 1.00 75.50 H new ATOM 0 HA LEU A 90 -5.903 9.174 15.260 1.00 20.14 H new ATOM 0 HB2 LEU A 90 -3.911 9.525 13.908 1.00 10.31 H new ATOM 0 HB3 LEU A 90 -3.384 7.875 14.173 1.00 10.31 H new ATOM 0 HG LEU A 90 -6.049 8.058 12.947 1.00 60.33 H new ATOM 0 HD11 LEU A 90 -5.214 8.732 10.730 1.00 12.25 H new ATOM 0 HD12 LEU A 90 -5.060 10.045 11.921 1.00 12.25 H new ATOM 0 HD13 LEU A 90 -3.628 9.102 11.445 1.00 12.25 H new ATOM 0 HD21 LEU A 90 -5.059 6.375 11.441 1.00 43.43 H new ATOM 0 HD22 LEU A 90 -3.467 6.653 12.185 1.00 43.43 H new ATOM 0 HD23 LEU A 90 -4.793 5.967 13.153 1.00 43.43 H new ATOM 1282 N ILE A 91 -7.040 6.998 15.451 1.00 14.15 N ATOM 1283 CA ILE A 91 -7.752 5.733 15.586 1.00 41.13 C ATOM 1284 C ILE A 91 -8.558 5.420 14.330 1.00 73.11 C ATOM 1285 O ILE A 91 -9.315 6.258 13.840 1.00 1.55 O ATOM 1286 CB ILE A 91 -8.699 5.746 16.800 1.00 22.13 C ATOM 1287 CG1 ILE A 91 -7.911 6.002 18.086 1.00 5.44 C ATOM 1288 CG2 ILE A 91 -9.460 4.432 16.892 1.00 20.24 C ATOM 1289 CD1 ILE A 91 -7.835 7.464 18.467 1.00 2.42 C ATOM 0 H ILE A 91 -7.644 7.812 15.338 1.00 14.15 H new ATOM 0 HA ILE A 91 -6.997 4.960 15.733 1.00 41.13 H new ATOM 0 HB ILE A 91 -9.420 6.553 16.671 1.00 22.13 H new ATOM 0 HG12 ILE A 91 -8.372 5.446 18.902 1.00 5.44 H new ATOM 0 HG13 ILE A 91 -6.900 5.613 17.967 1.00 5.44 H new ATOM 0 HG21 ILE A 91 -10.125 4.456 17.755 1.00 20.24 H new ATOM 0 HG22 ILE A 91 -10.047 4.287 15.985 1.00 20.24 H new ATOM 0 HG23 ILE A 91 -8.753 3.609 17.002 1.00 20.24 H new ATOM 0 HD11 ILE A 91 -7.262 7.571 19.388 1.00 2.42 H new ATOM 0 HD12 ILE A 91 -7.347 8.023 17.669 1.00 2.42 H new ATOM 0 HD13 ILE A 91 -8.842 7.853 18.619 1.00 2.42 H new ATOM 1301 N SER A 92 -8.392 4.206 13.814 1.00 14.21 N ATOM 1302 CA SER A 92 -9.103 3.782 12.614 1.00 54.13 C ATOM 1303 C SER A 92 -10.293 2.897 12.971 1.00 35.04 C ATOM 1304 O SER A 92 -10.157 1.926 13.716 1.00 51.20 O ATOM 1305 CB SER A 92 -8.158 3.030 11.674 1.00 13.24 C ATOM 1306 OG SER A 92 -8.795 1.897 11.110 1.00 11.01 O ATOM 0 H SER A 92 -7.771 3.499 14.208 1.00 14.21 H new ATOM 0 HA SER A 92 -9.474 4.673 12.108 1.00 54.13 H new ATOM 0 HB2 SER A 92 -7.824 3.697 10.879 1.00 13.24 H new ATOM 0 HB3 SER A 92 -7.269 2.716 12.221 1.00 13.24 H new ATOM 0 HG SER A 92 -8.234 1.527 10.397 1.00 11.01 H new ATOM 1312 N TRP A 93 -11.459 3.240 12.436 1.00 73.34 N ATOM 1313 CA TRP A 93 -12.674 2.477 12.698 1.00 75.21 C ATOM 1314 C TRP A 93 -13.130 1.732 11.448 1.00 22.30 C ATOM 1315 O TRP A 93 -13.504 2.346 10.450 1.00 15.13 O ATOM 1316 CB TRP A 93 -13.788 3.404 13.188 1.00 43.34 C ATOM 1317 CG TRP A 93 -13.332 4.381 14.229 1.00 42.54 C ATOM 1318 CD1 TRP A 93 -12.974 5.684 14.029 1.00 11.31 C ATOM 1319 CD2 TRP A 93 -13.183 4.133 15.631 1.00 61.33 C ATOM 1320 NE1 TRP A 93 -12.612 6.260 15.223 1.00 42.42 N ATOM 1321 CE2 TRP A 93 -12.732 5.330 16.221 1.00 71.24 C ATOM 1322 CE3 TRP A 93 -13.388 3.016 16.446 1.00 55.25 C ATOM 1323 CZ2 TRP A 93 -12.483 5.439 17.586 1.00 31.32 C ATOM 1324 CZ3 TRP A 93 -13.141 3.126 17.801 1.00 64.25 C ATOM 1325 CH2 TRP A 93 -12.693 4.330 18.360 1.00 23.22 C ATOM 0 H TRP A 93 -11.589 4.041 11.818 1.00 73.34 H new ATOM 0 HA TRP A 93 -12.452 1.745 13.474 1.00 75.21 H new ATOM 0 HB2 TRP A 93 -14.195 3.953 12.338 1.00 43.34 H new ATOM 0 HB3 TRP A 93 -14.599 2.801 13.596 1.00 43.34 H new ATOM 0 HD1 TRP A 93 -12.975 6.187 13.073 1.00 11.31 H new ATOM 0 HE1 TRP A 93 -12.304 7.224 15.346 1.00 42.42 H new ATOM 0 HE3 TRP A 93 -13.733 2.084 16.024 1.00 55.25 H new ATOM 0 HZ2 TRP A 93 -12.136 6.366 18.019 1.00 31.32 H new ATOM 0 HZ3 TRP A 93 -13.296 2.269 18.440 1.00 64.25 H new ATOM 0 HH2 TRP A 93 -12.510 4.384 19.423 1.00 23.22 H new ATOM 1336 N ASN A 94 -13.095 0.405 11.510 1.00 62.52 N ATOM 1337 CA ASN A 94 -13.504 -0.424 10.382 1.00 70.24 C ATOM 1338 C ASN A 94 -13.310 -1.905 10.695 1.00 0.43 C ATOM 1339 O ASN A 94 -12.327 -2.309 11.316 1.00 30.35 O ATOM 1340 CB ASN A 94 -12.708 -0.048 9.130 1.00 1.13 C ATOM 1341 CG ASN A 94 -12.716 -1.148 8.087 1.00 75.40 C ATOM 1342 OD1 ASN A 94 -13.560 -1.162 7.190 1.00 45.01 O ATOM 1343 ND2 ASN A 94 -11.775 -2.078 8.200 1.00 33.44 N ATOM 0 H ASN A 94 -12.788 -0.119 12.329 1.00 62.52 H new ATOM 0 HA ASN A 94 -14.564 -0.245 10.199 1.00 70.24 H new ATOM 0 HB2 ASN A 94 -13.125 0.862 8.698 1.00 1.13 H new ATOM 0 HB3 ASN A 94 -11.679 0.175 9.411 1.00 1.13 H new ATOM 0 HD21 ASN A 94 -11.731 -2.844 7.527 1.00 33.44 H new ATOM 0 HD22 ASN A 94 -11.096 -2.027 8.959 1.00 33.44 H new ATOM 1350 N PRO A 95 -14.269 -2.733 10.256 1.00 63.23 N ATOM 1351 CA PRO A 95 -14.226 -4.182 10.477 1.00 44.32 C ATOM 1352 C PRO A 95 -13.129 -4.860 9.662 1.00 14.03 C ATOM 1353 O PRO A 95 -12.989 -4.611 8.465 1.00 65.12 O ATOM 1354 CB PRO A 95 -15.606 -4.653 10.012 1.00 10.42 C ATOM 1355 CG PRO A 95 -16.047 -3.623 9.030 1.00 1.22 C ATOM 1356 CD PRO A 95 -15.468 -2.320 9.509 1.00 54.14 C ATOM 0 HA PRO A 95 -14.004 -4.430 11.515 1.00 44.32 H new ATOM 0 HB2 PRO A 95 -15.553 -5.640 9.553 1.00 10.42 H new ATOM 0 HB3 PRO A 95 -16.302 -4.726 10.848 1.00 10.42 H new ATOM 0 HG2 PRO A 95 -15.693 -3.863 8.027 1.00 1.22 H new ATOM 0 HG3 PRO A 95 -17.135 -3.572 8.980 1.00 1.22 H new ATOM 0 HD2 PRO A 95 -15.216 -1.662 8.677 1.00 54.14 H new ATOM 0 HD3 PRO A 95 -16.169 -1.778 10.143 1.00 54.14 H new ATOM 1364 N ASP A 96 -12.356 -5.718 10.319 1.00 50.33 N ATOM 1365 CA ASP A 96 -11.273 -6.433 9.655 1.00 62.54 C ATOM 1366 C ASP A 96 -11.806 -7.278 8.502 1.00 72.23 C ATOM 1367 O ASP A 96 -11.066 -7.633 7.585 1.00 42.14 O ATOM 1368 CB ASP A 96 -10.532 -7.323 10.655 1.00 50.45 C ATOM 1369 CG ASP A 96 -11.369 -8.501 11.112 1.00 64.43 C ATOM 1370 OD1 ASP A 96 -11.405 -9.520 10.389 1.00 4.42 O ATOM 1371 OD2 ASP A 96 -11.987 -8.406 12.192 1.00 23.13 O ATOM 0 H ASP A 96 -12.459 -5.935 11.310 1.00 50.33 H new ATOM 0 HA ASP A 96 -10.578 -5.696 9.251 1.00 62.54 H new ATOM 0 HB2 ASP A 96 -9.612 -7.690 10.199 1.00 50.45 H new ATOM 0 HB3 ASP A 96 -10.243 -6.728 11.522 1.00 50.45 H new ATOM 1376 N SER A 97 -13.095 -7.598 8.556 1.00 53.31 N ATOM 1377 CA SER A 97 -13.727 -8.405 7.519 1.00 60.11 C ATOM 1378 C SER A 97 -14.621 -7.546 6.630 1.00 11.44 C ATOM 1379 O SER A 97 -15.432 -8.061 5.862 1.00 21.32 O ATOM 1380 CB SER A 97 -14.547 -9.532 8.149 1.00 33.22 C ATOM 1381 OG SER A 97 -13.979 -10.798 7.863 1.00 60.32 O ATOM 0 H SER A 97 -13.722 -7.311 9.307 1.00 53.31 H new ATOM 0 HA SER A 97 -12.940 -8.839 6.902 1.00 60.11 H new ATOM 0 HB2 SER A 97 -14.599 -9.389 9.228 1.00 33.22 H new ATOM 0 HB3 SER A 97 -15.570 -9.496 7.773 1.00 33.22 H new ATOM 0 HG SER A 97 -14.521 -11.501 8.278 1.00 60.32 H new ATOM 1387 N GLY A 98 -14.466 -6.230 6.742 1.00 14.41 N ATOM 1388 CA GLY A 98 -15.266 -5.318 5.944 1.00 23.41 C ATOM 1389 C GLY A 98 -15.106 -5.558 4.456 1.00 43.11 C ATOM 1390 O GLY A 98 -15.770 -6.422 3.884 1.00 14.55 O ATOM 0 H GLY A 98 -13.801 -5.779 7.371 1.00 14.41 H new ATOM 0 HA2 GLY A 98 -16.316 -5.427 6.216 1.00 23.41 H new ATOM 0 HA3 GLY A 98 -14.982 -4.292 6.176 1.00 23.41 H new ATOM 1394 N ALA A 99 -14.222 -4.790 3.826 1.00 34.13 N ATOM 1395 CA ALA A 99 -13.977 -4.923 2.396 1.00 70.34 C ATOM 1396 C ALA A 99 -12.484 -4.884 2.089 1.00 42.13 C ATOM 1397 O ALA A 99 -11.675 -4.404 2.883 1.00 63.10 O ATOM 1398 CB ALA A 99 -14.704 -3.827 1.631 1.00 31.01 C ATOM 0 H ALA A 99 -13.664 -4.070 4.284 1.00 34.13 H new ATOM 0 HA ALA A 99 -14.362 -5.891 2.075 1.00 70.34 H new ATOM 0 HB1 ALA A 99 -14.512 -3.939 0.564 1.00 31.01 H new ATOM 0 HB2 ALA A 99 -15.775 -3.903 1.817 1.00 31.01 H new ATOM 0 HB3 ALA A 99 -14.346 -2.853 1.964 1.00 31.01 H new ATOM 1404 N PRO A 100 -12.107 -5.401 0.910 1.00 55.35 N ATOM 1405 CA PRO A 100 -10.709 -5.436 0.471 1.00 72.20 C ATOM 1406 C PRO A 100 -10.168 -4.048 0.146 1.00 20.14 C ATOM 1407 O PRO A 100 -9.013 -3.738 0.440 1.00 53.44 O ATOM 1408 CB PRO A 100 -10.755 -6.301 -0.791 1.00 52.13 C ATOM 1409 CG PRO A 100 -12.147 -6.153 -1.301 1.00 50.34 C ATOM 1410 CD PRO A 100 -13.018 -5.990 -0.087 1.00 11.44 C ATOM 0 HA PRO A 100 -10.048 -5.824 1.246 1.00 72.20 H new ATOM 0 HB2 PRO A 100 -10.026 -5.965 -1.528 1.00 52.13 H new ATOM 0 HB3 PRO A 100 -10.524 -7.342 -0.566 1.00 52.13 H new ATOM 0 HG2 PRO A 100 -12.231 -5.289 -1.960 1.00 50.34 H new ATOM 0 HG3 PRO A 100 -12.445 -7.027 -1.881 1.00 50.34 H new ATOM 0 HD2 PRO A 100 -13.869 -5.339 -0.288 1.00 11.44 H new ATOM 0 HD3 PRO A 100 -13.420 -6.945 0.251 1.00 11.44 H new ATOM 1418 N ARG A 101 -11.009 -3.217 -0.460 1.00 13.11 N ATOM 1419 CA ARG A 101 -10.614 -1.862 -0.825 1.00 13.33 C ATOM 1420 C ARG A 101 -10.368 -1.014 0.420 1.00 41.44 C ATOM 1421 O ARG A 101 -9.496 -0.144 0.429 1.00 0.05 O ATOM 1422 CB ARG A 101 -11.692 -1.210 -1.694 1.00 24.32 C ATOM 1423 CG ARG A 101 -12.074 -2.036 -2.911 1.00 61.31 C ATOM 1424 CD ARG A 101 -12.325 -1.156 -4.125 1.00 52.22 C ATOM 1425 NE ARG A 101 -11.993 -1.837 -5.374 1.00 34.24 N ATOM 1426 CZ ARG A 101 -12.725 -2.816 -5.893 1.00 71.53 C ATOM 1427 NH1 ARG A 101 -13.824 -3.227 -5.276 1.00 14.51 N ATOM 1428 NH2 ARG A 101 -12.358 -3.387 -7.033 1.00 61.45 N ATOM 0 H ARG A 101 -11.968 -3.458 -0.709 1.00 13.11 H new ATOM 0 HA ARG A 101 -9.686 -1.921 -1.393 1.00 13.33 H new ATOM 0 HB2 ARG A 101 -12.581 -1.039 -1.088 1.00 24.32 H new ATOM 0 HB3 ARG A 101 -11.339 -0.233 -2.024 1.00 24.32 H new ATOM 0 HG2 ARG A 101 -11.278 -2.747 -3.134 1.00 61.31 H new ATOM 0 HG3 ARG A 101 -12.969 -2.618 -2.691 1.00 61.31 H new ATOM 0 HD2 ARG A 101 -13.372 -0.855 -4.144 1.00 52.22 H new ATOM 0 HD3 ARG A 101 -11.733 -0.245 -4.041 1.00 52.22 H new ATOM 0 HE ARG A 101 -11.154 -1.545 -5.874 1.00 34.24 H new ATOM 0 HH11 ARG A 101 -14.110 -2.791 -4.399 1.00 14.51 H new ATOM 0 HH12 ARG A 101 -14.384 -3.979 -5.678 1.00 14.51 H new ATOM 0 HH21 ARG A 101 -11.513 -3.074 -7.511 1.00 61.45 H new ATOM 0 HH22 ARG A 101 -12.921 -4.139 -7.431 1.00 61.45 H new ATOM 1442 N THR A 102 -11.143 -1.272 1.469 1.00 65.12 N ATOM 1443 CA THR A 102 -11.010 -0.532 2.717 1.00 30.34 C ATOM 1444 C THR A 102 -9.690 -0.852 3.409 1.00 63.42 C ATOM 1445 O THR A 102 -8.982 0.046 3.866 1.00 73.41 O ATOM 1446 CB THR A 102 -12.170 -0.845 3.681 1.00 12.43 C ATOM 1447 OG1 THR A 102 -13.417 -0.465 3.087 1.00 25.01 O ATOM 1448 CG2 THR A 102 -11.988 -0.112 5.002 1.00 34.32 C ATOM 0 H THR A 102 -11.869 -1.988 1.479 1.00 65.12 H new ATOM 0 HA THR A 102 -11.035 0.527 2.460 1.00 30.34 H new ATOM 0 HB THR A 102 -12.172 -1.918 3.876 1.00 12.43 H new ATOM 0 HG1 THR A 102 -14.135 -0.557 3.747 1.00 25.01 H new ATOM 0 HG21 THR A 102 -12.819 -0.348 5.667 1.00 34.32 H new ATOM 0 HG22 THR A 102 -11.052 -0.425 5.466 1.00 34.32 H new ATOM 0 HG23 THR A 102 -11.962 0.963 4.821 1.00 34.32 H new ATOM 1456 N LYS A 103 -9.362 -2.138 3.482 1.00 71.01 N ATOM 1457 CA LYS A 103 -8.125 -2.578 4.116 1.00 40.10 C ATOM 1458 C LYS A 103 -6.911 -2.146 3.299 1.00 74.10 C ATOM 1459 O LYS A 103 -5.886 -1.754 3.854 1.00 4.12 O ATOM 1460 CB LYS A 103 -8.126 -4.099 4.282 1.00 20.23 C ATOM 1461 CG LYS A 103 -8.528 -4.559 5.673 1.00 11.31 C ATOM 1462 CD LYS A 103 -7.454 -5.427 6.306 1.00 5.20 C ATOM 1463 CE LYS A 103 -7.400 -5.237 7.814 1.00 12.22 C ATOM 1464 NZ LYS A 103 -6.844 -6.433 8.505 1.00 74.33 N ATOM 0 H LYS A 103 -9.936 -2.894 3.109 1.00 71.01 H new ATOM 0 HA LYS A 103 -8.064 -2.111 5.099 1.00 40.10 H new ATOM 0 HB2 LYS A 103 -8.809 -4.535 3.553 1.00 20.23 H new ATOM 0 HB3 LYS A 103 -7.131 -4.481 4.055 1.00 20.23 H new ATOM 0 HG2 LYS A 103 -8.714 -3.690 6.305 1.00 11.31 H new ATOM 0 HG3 LYS A 103 -9.462 -5.118 5.616 1.00 11.31 H new ATOM 0 HD2 LYS A 103 -7.650 -6.475 6.077 1.00 5.20 H new ATOM 0 HD3 LYS A 103 -6.484 -5.182 5.872 1.00 5.20 H new ATOM 0 HE2 LYS A 103 -6.789 -4.366 8.048 1.00 12.22 H new ATOM 0 HE3 LYS A 103 -8.403 -5.034 8.190 1.00 12.22 H new ATOM 0 HZ1 LYS A 103 -6.824 -6.263 9.531 1.00 74.33 H new ATOM 0 HZ2 LYS A 103 -7.441 -7.260 8.302 1.00 74.33 H new ATOM 0 HZ3 LYS A 103 -5.878 -6.612 8.165 1.00 74.33 H new ATOM 1478 N MET A 104 -7.036 -2.220 1.978 1.00 55.21 N ATOM 1479 CA MET A 104 -5.950 -1.834 1.085 1.00 10.41 C ATOM 1480 C MET A 104 -5.757 -0.320 1.087 1.00 63.51 C ATOM 1481 O MET A 104 -4.635 0.172 1.218 1.00 14.14 O ATOM 1482 CB MET A 104 -6.232 -2.322 -0.337 1.00 50.31 C ATOM 1483 CG MET A 104 -5.541 -3.632 -0.678 1.00 44.33 C ATOM 1484 SD MET A 104 -6.052 -4.987 0.395 1.00 23.13 S ATOM 1485 CE MET A 104 -4.562 -5.236 1.358 1.00 31.43 C ATOM 0 H MET A 104 -7.878 -2.544 1.502 1.00 55.21 H new ATOM 0 HA MET A 104 -5.033 -2.300 1.446 1.00 10.41 H new ATOM 0 HB2 MET A 104 -7.308 -2.444 -0.464 1.00 50.31 H new ATOM 0 HB3 MET A 104 -5.913 -1.557 -1.045 1.00 50.31 H new ATOM 0 HG2 MET A 104 -5.757 -3.893 -1.714 1.00 44.33 H new ATOM 0 HG3 MET A 104 -4.462 -3.500 -0.601 1.00 44.33 H new ATOM 0 HE1 MET A 104 -4.830 -5.520 2.376 1.00 31.43 H new ATOM 0 HE2 MET A 104 -3.965 -6.028 0.906 1.00 31.43 H new ATOM 0 HE3 MET A 104 -3.984 -4.312 1.379 1.00 31.43 H new ATOM 1495 N LEU A 105 -6.855 0.412 0.940 1.00 32.10 N ATOM 1496 CA LEU A 105 -6.806 1.870 0.925 1.00 74.25 C ATOM 1497 C LEU A 105 -6.277 2.411 2.249 1.00 40.03 C ATOM 1498 O LEU A 105 -5.583 3.428 2.283 1.00 73.34 O ATOM 1499 CB LEU A 105 -8.197 2.443 0.645 1.00 3.34 C ATOM 1500 CG LEU A 105 -8.682 2.353 -0.802 1.00 20.22 C ATOM 1501 CD1 LEU A 105 -10.193 2.511 -0.869 1.00 70.01 C ATOM 1502 CD2 LEU A 105 -7.995 3.404 -1.661 1.00 70.14 C ATOM 0 H LEU A 105 -7.790 0.020 0.829 1.00 32.10 H new ATOM 0 HA LEU A 105 -6.126 2.178 0.131 1.00 74.25 H new ATOM 0 HB2 LEU A 105 -8.916 1.926 1.281 1.00 3.34 H new ATOM 0 HB3 LEU A 105 -8.203 3.491 0.944 1.00 3.34 H new ATOM 0 HG LEU A 105 -8.423 1.369 -1.192 1.00 20.22 H new ATOM 0 HD11 LEU A 105 -10.520 2.444 -1.907 1.00 70.01 H new ATOM 0 HD12 LEU A 105 -10.668 1.721 -0.287 1.00 70.01 H new ATOM 0 HD13 LEU A 105 -10.476 3.481 -0.461 1.00 70.01 H new ATOM 0 HD21 LEU A 105 -8.352 3.325 -2.688 1.00 70.14 H new ATOM 0 HD22 LEU A 105 -8.223 4.397 -1.273 1.00 70.14 H new ATOM 0 HD23 LEU A 105 -6.917 3.244 -1.639 1.00 70.14 H new ATOM 1514 N TYR A 106 -6.607 1.724 3.337 1.00 40.23 N ATOM 1515 CA TYR A 106 -6.165 2.136 4.664 1.00 70.12 C ATOM 1516 C TYR A 106 -4.642 2.179 4.742 1.00 50.13 C ATOM 1517 O TYR A 106 -4.061 3.160 5.206 1.00 65.30 O ATOM 1518 CB TYR A 106 -6.714 1.182 5.726 1.00 54.11 C ATOM 1519 CG TYR A 106 -6.177 1.447 7.114 1.00 3.10 C ATOM 1520 CD1 TYR A 106 -6.336 2.689 7.716 1.00 4.32 C ATOM 1521 CD2 TYR A 106 -5.509 0.456 7.823 1.00 51.20 C ATOM 1522 CE1 TYR A 106 -5.846 2.936 8.984 1.00 45.50 C ATOM 1523 CE2 TYR A 106 -5.017 0.694 9.092 1.00 71.03 C ATOM 1524 CZ TYR A 106 -5.187 1.936 9.668 1.00 75.52 C ATOM 1525 OH TYR A 106 -4.698 2.177 10.931 1.00 65.22 O ATOM 0 H TYR A 106 -7.179 0.879 3.326 1.00 40.23 H new ATOM 0 HA TYR A 106 -6.549 3.139 4.852 1.00 70.12 H new ATOM 0 HB2 TYR A 106 -7.801 1.260 5.745 1.00 54.11 H new ATOM 0 HB3 TYR A 106 -6.473 0.158 5.442 1.00 54.11 H new ATOM 0 HD1 TYR A 106 -6.851 3.475 7.184 1.00 4.32 H new ATOM 0 HD2 TYR A 106 -5.372 -0.517 7.374 1.00 51.20 H new ATOM 0 HE1 TYR A 106 -5.978 3.907 9.437 1.00 45.50 H new ATOM 0 HE2 TYR A 106 -4.502 -0.088 9.630 1.00 71.03 H new ATOM 0 HH TYR A 106 -4.262 1.368 11.273 1.00 65.22 H new ATOM 1535 N SER A 107 -4.002 1.108 4.283 1.00 0.20 N ATOM 1536 CA SER A 107 -2.547 1.021 4.303 1.00 65.20 C ATOM 1537 C SER A 107 -1.926 2.096 3.417 1.00 45.14 C ATOM 1538 O SER A 107 -0.892 2.673 3.753 1.00 3.15 O ATOM 1539 CB SER A 107 -2.091 -0.364 3.839 1.00 73.20 C ATOM 1540 OG SER A 107 -0.682 -0.418 3.701 1.00 21.24 O ATOM 0 H SER A 107 -4.468 0.289 3.893 1.00 0.20 H new ATOM 0 HA SER A 107 -2.213 1.182 5.328 1.00 65.20 H new ATOM 0 HB2 SER A 107 -2.418 -1.117 4.556 1.00 73.20 H new ATOM 0 HB3 SER A 107 -2.562 -0.605 2.886 1.00 73.20 H new ATOM 0 HG SER A 107 -0.416 -1.314 3.405 1.00 21.24 H new ATOM 1546 N SER A 108 -2.564 2.360 2.281 1.00 35.12 N ATOM 1547 CA SER A 108 -2.074 3.363 1.343 1.00 21.13 C ATOM 1548 C SER A 108 -2.176 4.762 1.942 1.00 50.51 C ATOM 1549 O SER A 108 -1.262 5.575 1.807 1.00 4.43 O ATOM 1550 CB SER A 108 -2.863 3.297 0.034 1.00 31.13 C ATOM 1551 OG SER A 108 -2.368 4.232 -0.908 1.00 5.33 O ATOM 0 H SER A 108 -3.422 1.893 1.988 1.00 35.12 H new ATOM 0 HA SER A 108 -1.025 3.150 1.137 1.00 21.13 H new ATOM 0 HB2 SER A 108 -2.801 2.291 -0.381 1.00 31.13 H new ATOM 0 HB3 SER A 108 -3.916 3.497 0.230 1.00 31.13 H new ATOM 0 HG SER A 108 -2.776 4.063 -1.783 1.00 5.33 H new ATOM 1557 N SER A 109 -3.296 5.036 2.604 1.00 61.04 N ATOM 1558 CA SER A 109 -3.521 6.338 3.220 1.00 1.12 C ATOM 1559 C SER A 109 -2.632 6.519 4.447 1.00 11.00 C ATOM 1560 O SER A 109 -2.018 7.570 4.632 1.00 24.44 O ATOM 1561 CB SER A 109 -4.991 6.492 3.614 1.00 11.23 C ATOM 1562 OG SER A 109 -5.275 5.787 4.810 1.00 32.01 O ATOM 0 H SER A 109 -4.062 4.373 2.727 1.00 61.04 H new ATOM 0 HA SER A 109 -3.265 7.107 2.491 1.00 1.12 H new ATOM 0 HB2 SER A 109 -5.227 7.548 3.746 1.00 11.23 H new ATOM 0 HB3 SER A 109 -5.627 6.122 2.810 1.00 11.23 H new ATOM 0 HG SER A 109 -4.924 4.874 4.743 1.00 32.01 H new ATOM 1568 N ARG A 110 -2.569 5.487 5.282 1.00 75.11 N ATOM 1569 CA ARG A 110 -1.757 5.531 6.492 1.00 55.21 C ATOM 1570 C ARG A 110 -0.304 5.854 6.160 1.00 64.14 C ATOM 1571 O ARG A 110 0.357 6.603 6.880 1.00 54.14 O ATOM 1572 CB ARG A 110 -1.838 4.196 7.235 1.00 42.23 C ATOM 1573 CG ARG A 110 -1.676 4.326 8.740 1.00 11.44 C ATOM 1574 CD ARG A 110 -1.116 3.052 9.353 1.00 44.23 C ATOM 1575 NE ARG A 110 0.298 3.185 9.693 1.00 24.43 N ATOM 1576 CZ ARG A 110 1.079 2.155 10.003 1.00 43.55 C ATOM 1577 NH1 ARG A 110 0.586 0.925 10.014 1.00 63.35 N ATOM 1578 NH2 ARG A 110 2.356 2.356 10.301 1.00 5.42 N ATOM 0 H ARG A 110 -3.071 4.610 5.143 1.00 75.11 H new ATOM 0 HA ARG A 110 -2.149 6.320 7.134 1.00 55.21 H new ATOM 0 HB2 ARG A 110 -2.799 3.728 7.021 1.00 42.23 H new ATOM 0 HB3 ARG A 110 -1.066 3.529 6.851 1.00 42.23 H new ATOM 0 HG2 ARG A 110 -1.013 5.161 8.965 1.00 11.44 H new ATOM 0 HG3 ARG A 110 -2.641 4.555 9.192 1.00 11.44 H new ATOM 0 HD2 ARG A 110 -1.683 2.802 10.250 1.00 44.23 H new ATOM 0 HD3 ARG A 110 -1.245 2.226 8.654 1.00 44.23 H new ATOM 0 HE ARG A 110 0.709 4.119 9.693 1.00 24.43 H new ATOM 0 HH11 ARG A 110 -0.395 0.767 9.784 1.00 63.35 H new ATOM 0 HH12 ARG A 110 1.188 0.137 10.252 1.00 63.35 H new ATOM 0 HH21 ARG A 110 2.739 3.301 10.292 1.00 5.42 H new ATOM 0 HH22 ARG A 110 2.955 1.565 10.539 1.00 5.42 H new ATOM 1592 N ASP A 111 0.188 5.283 5.066 1.00 43.25 N ATOM 1593 CA ASP A 111 1.564 5.510 4.637 1.00 14.21 C ATOM 1594 C ASP A 111 1.812 6.991 4.369 1.00 11.44 C ATOM 1595 O ASP A 111 2.865 7.526 4.714 1.00 1.52 O ATOM 1596 CB ASP A 111 1.870 4.694 3.381 1.00 64.33 C ATOM 1597 CG ASP A 111 3.255 4.078 3.414 1.00 4.11 C ATOM 1598 OD1 ASP A 111 3.439 3.071 4.128 1.00 23.44 O ATOM 1599 OD2 ASP A 111 4.156 4.604 2.727 1.00 52.33 O ATOM 0 H ASP A 111 -0.345 4.660 4.460 1.00 43.25 H new ATOM 0 HA ASP A 111 2.227 5.188 5.440 1.00 14.21 H new ATOM 0 HB2 ASP A 111 1.127 3.904 3.274 1.00 64.33 H new ATOM 0 HB3 ASP A 111 1.782 5.335 2.504 1.00 64.33 H new ATOM 1604 N ALA A 112 0.835 7.648 3.752 1.00 63.45 N ATOM 1605 CA ALA A 112 0.948 9.067 3.438 1.00 35.23 C ATOM 1606 C ALA A 112 0.667 9.924 4.668 1.00 54.13 C ATOM 1607 O ALA A 112 1.102 11.074 4.748 1.00 31.44 O ATOM 1608 CB ALA A 112 -0.002 9.434 2.308 1.00 51.42 C ATOM 0 H ALA A 112 -0.044 7.220 3.460 1.00 63.45 H new ATOM 0 HA ALA A 112 1.971 9.264 3.116 1.00 35.23 H new ATOM 0 HB1 ALA A 112 0.093 10.496 2.084 1.00 51.42 H new ATOM 0 HB2 ALA A 112 0.246 8.852 1.420 1.00 51.42 H new ATOM 0 HB3 ALA A 112 -1.027 9.217 2.609 1.00 51.42 H new ATOM 1614 N LEU A 113 -0.064 9.359 5.623 1.00 44.12 N ATOM 1615 CA LEU A 113 -0.404 10.072 6.849 1.00 5.51 C ATOM 1616 C LEU A 113 0.731 9.982 7.864 1.00 5.21 C ATOM 1617 O LEU A 113 0.882 10.852 8.722 1.00 42.43 O ATOM 1618 CB LEU A 113 -1.689 9.505 7.453 1.00 73.11 C ATOM 1619 CG LEU A 113 -2.988 10.197 7.039 1.00 51.55 C ATOM 1620 CD1 LEU A 113 -3.808 9.295 6.130 1.00 70.30 C ATOM 1621 CD2 LEU A 113 -3.795 10.597 8.266 1.00 64.43 C ATOM 0 H LEU A 113 -0.432 8.409 5.572 1.00 44.12 H new ATOM 0 HA LEU A 113 -0.560 11.121 6.598 1.00 5.51 H new ATOM 0 HB2 LEU A 113 -1.760 8.452 7.182 1.00 73.11 H new ATOM 0 HB3 LEU A 113 -1.607 9.550 8.539 1.00 73.11 H new ATOM 0 HG LEU A 113 -2.734 11.101 6.486 1.00 51.55 H new ATOM 0 HD11 LEU A 113 -4.729 9.805 5.846 1.00 70.30 H new ATOM 0 HD12 LEU A 113 -3.232 9.060 5.235 1.00 70.30 H new ATOM 0 HD13 LEU A 113 -4.052 8.372 6.657 1.00 70.30 H new ATOM 0 HD21 LEU A 113 -4.716 11.088 7.952 1.00 64.43 H new ATOM 0 HD22 LEU A 113 -4.038 9.708 8.847 1.00 64.43 H new ATOM 0 HD23 LEU A 113 -3.210 11.282 8.879 1.00 64.43 H new ATOM 1633 N VAL A 114 1.529 8.924 7.759 1.00 4.24 N ATOM 1634 CA VAL A 114 2.653 8.722 8.666 1.00 63.42 C ATOM 1635 C VAL A 114 3.535 9.963 8.734 1.00 11.53 C ATOM 1636 O VAL A 114 3.793 10.514 9.805 1.00 74.01 O ATOM 1637 CB VAL A 114 3.513 7.519 8.234 1.00 32.50 C ATOM 1638 CG1 VAL A 114 4.962 7.721 8.649 1.00 41.23 C ATOM 1639 CG2 VAL A 114 2.957 6.230 8.821 1.00 61.45 C ATOM 0 H VAL A 114 1.418 8.194 7.055 1.00 4.24 H new ATOM 0 HA VAL A 114 2.232 8.524 9.652 1.00 63.42 H new ATOM 0 HB VAL A 114 3.479 7.442 7.147 1.00 32.50 H new ATOM 0 HG11 VAL A 114 5.554 6.861 8.335 1.00 41.23 H new ATOM 0 HG12 VAL A 114 5.353 8.622 8.177 1.00 41.23 H new ATOM 0 HG13 VAL A 114 5.019 7.825 9.733 1.00 41.23 H new ATOM 0 HG21 VAL A 114 3.576 5.390 8.506 1.00 61.45 H new ATOM 0 HG22 VAL A 114 2.960 6.295 9.909 1.00 61.45 H new ATOM 0 HG23 VAL A 114 1.936 6.080 8.469 1.00 61.45 H new ATOM 1649 N PRO A 115 4.009 10.417 7.565 1.00 44.43 N ATOM 1650 CA PRO A 115 4.869 11.601 7.465 1.00 60.41 C ATOM 1651 C PRO A 115 4.117 12.891 7.773 1.00 41.04 C ATOM 1652 O PRO A 115 4.691 13.846 8.297 1.00 44.41 O ATOM 1653 CB PRO A 115 5.327 11.584 6.004 1.00 2.04 C ATOM 1654 CG PRO A 115 4.259 10.838 5.281 1.00 45.41 C ATOM 1655 CD PRO A 115 3.743 9.811 6.250 1.00 72.14 C ATOM 0 HA PRO A 115 5.688 11.572 8.183 1.00 60.41 H new ATOM 0 HB2 PRO A 115 5.438 12.595 5.612 1.00 2.04 H new ATOM 0 HB3 PRO A 115 6.294 11.093 5.898 1.00 2.04 H new ATOM 0 HG2 PRO A 115 3.462 11.509 4.962 1.00 45.41 H new ATOM 0 HG3 PRO A 115 4.654 10.363 4.383 1.00 45.41 H new ATOM 0 HD2 PRO A 115 2.680 9.619 6.104 1.00 72.14 H new ATOM 0 HD3 PRO A 115 4.258 8.857 6.136 1.00 72.14 H new ATOM 1663 N LEU A 116 2.830 12.913 7.444 1.00 21.14 N ATOM 1664 CA LEU A 116 1.999 14.087 7.686 1.00 34.15 C ATOM 1665 C LEU A 116 1.827 14.334 9.182 1.00 61.31 C ATOM 1666 O LEU A 116 1.999 15.455 9.661 1.00 22.14 O ATOM 1667 CB LEU A 116 0.630 13.912 7.027 1.00 72.44 C ATOM 1668 CG LEU A 116 0.026 15.164 6.390 1.00 64.24 C ATOM 1669 CD1 LEU A 116 0.011 16.314 7.384 1.00 3.31 C ATOM 1670 CD2 LEU A 116 0.799 15.550 5.137 1.00 73.25 C ATOM 0 H LEU A 116 2.340 12.131 7.009 1.00 21.14 H new ATOM 0 HA LEU A 116 2.499 14.951 7.248 1.00 34.15 H new ATOM 0 HB2 LEU A 116 0.714 13.143 6.259 1.00 72.44 H new ATOM 0 HB3 LEU A 116 -0.067 13.538 7.777 1.00 72.44 H new ATOM 0 HG LEU A 116 -1.003 14.944 6.105 1.00 64.24 H new ATOM 0 HD11 LEU A 116 -0.422 17.196 6.913 1.00 3.31 H new ATOM 0 HD12 LEU A 116 -0.586 16.036 8.253 1.00 3.31 H new ATOM 0 HD13 LEU A 116 1.030 16.535 7.700 1.00 3.31 H new ATOM 0 HD21 LEU A 116 0.356 16.443 4.697 1.00 73.25 H new ATOM 0 HD22 LEU A 116 1.838 15.752 5.398 1.00 73.25 H new ATOM 0 HD23 LEU A 116 0.758 14.732 4.418 1.00 73.25 H new ATOM 1682 N THR A 117 1.489 13.278 9.916 1.00 53.12 N ATOM 1683 CA THR A 117 1.295 13.379 11.357 1.00 41.43 C ATOM 1684 C THR A 117 2.489 12.810 12.113 1.00 24.44 C ATOM 1685 O THR A 117 2.341 11.902 12.931 1.00 1.14 O ATOM 1686 CB THR A 117 0.019 12.643 11.805 1.00 33.12 C ATOM 1687 OG1 THR A 117 0.031 11.298 11.314 1.00 20.10 O ATOM 1688 CG2 THR A 117 -1.225 13.360 11.303 1.00 40.44 C ATOM 0 H THR A 117 1.344 12.343 9.536 1.00 53.12 H new ATOM 0 HA THR A 117 1.194 14.439 11.589 1.00 41.43 H new ATOM 0 HB THR A 117 -0.003 12.632 12.895 1.00 33.12 H new ATOM 0 HG1 THR A 117 0.025 10.674 12.070 1.00 20.10 H new ATOM 0 HG21 THR A 117 -2.113 12.821 11.632 1.00 40.44 H new ATOM 0 HG22 THR A 117 -1.247 14.374 11.703 1.00 40.44 H new ATOM 0 HG23 THR A 117 -1.208 13.400 10.214 1.00 40.44 H new ATOM 1696 N GLN A 118 3.672 13.348 11.835 1.00 1.33 N ATOM 1697 CA GLN A 118 4.892 12.892 12.491 1.00 40.21 C ATOM 1698 C GLN A 118 4.733 12.908 14.008 1.00 64.24 C ATOM 1699 O GLN A 118 4.437 13.944 14.600 1.00 11.42 O ATOM 1700 CB GLN A 118 6.075 13.770 12.081 1.00 45.41 C ATOM 1701 CG GLN A 118 7.273 12.981 11.577 1.00 51.11 C ATOM 1702 CD GLN A 118 8.456 13.867 11.240 1.00 0.12 C ATOM 1703 OE1 GLN A 118 8.561 14.994 11.726 1.00 72.30 O ATOM 1704 NE2 GLN A 118 9.356 13.362 10.404 1.00 34.33 N ATOM 0 H GLN A 118 3.812 14.100 11.160 1.00 1.33 H new ATOM 0 HA GLN A 118 5.083 11.866 12.175 1.00 40.21 H new ATOM 0 HB2 GLN A 118 5.751 14.460 11.302 1.00 45.41 H new ATOM 0 HB3 GLN A 118 6.382 14.374 12.935 1.00 45.41 H new ATOM 0 HG2 GLN A 118 7.571 12.257 12.335 1.00 51.11 H new ATOM 0 HG3 GLN A 118 6.984 12.415 10.691 1.00 51.11 H new ATOM 0 HE21 GLN A 118 9.230 12.424 10.025 1.00 34.33 H new ATOM 0 HE22 GLN A 118 10.173 13.913 10.141 1.00 34.33 H new ATOM 1713 N GLY A 119 4.933 11.750 14.631 1.00 54.22 N ATOM 1714 CA GLY A 119 4.807 11.653 16.073 1.00 34.12 C ATOM 1715 C GLY A 119 3.384 11.370 16.513 1.00 12.12 C ATOM 1716 O GLY A 119 2.894 11.964 17.474 1.00 31.42 O ATOM 0 H GLY A 119 5.180 10.878 14.163 1.00 54.22 H new ATOM 0 HA2 GLY A 119 5.461 10.862 16.439 1.00 34.12 H new ATOM 0 HA3 GLY A 119 5.146 12.584 16.528 1.00 34.12 H new ATOM 1720 N PHE A 120 2.717 10.462 15.808 1.00 44.32 N ATOM 1721 CA PHE A 120 1.341 10.104 16.129 1.00 31.12 C ATOM 1722 C PHE A 120 1.182 8.589 16.226 1.00 55.43 C ATOM 1723 O PHE A 120 1.947 7.836 15.625 1.00 34.40 O ATOM 1724 CB PHE A 120 0.386 10.662 15.072 1.00 10.31 C ATOM 1725 CG PHE A 120 0.158 9.729 13.918 1.00 72.14 C ATOM 1726 CD1 PHE A 120 1.225 9.250 13.175 1.00 22.04 C ATOM 1727 CD2 PHE A 120 -1.124 9.331 13.574 1.00 33.04 C ATOM 1728 CE1 PHE A 120 1.019 8.391 12.113 1.00 73.44 C ATOM 1729 CE2 PHE A 120 -1.337 8.472 12.513 1.00 22.40 C ATOM 1730 CZ PHE A 120 -0.264 8.002 11.780 1.00 32.15 C ATOM 0 H PHE A 120 3.108 9.961 15.010 1.00 44.32 H new ATOM 0 HA PHE A 120 1.095 10.540 17.097 1.00 31.12 H new ATOM 0 HB2 PHE A 120 -0.572 10.887 15.542 1.00 10.31 H new ATOM 0 HB3 PHE A 120 0.785 11.603 14.694 1.00 10.31 H new ATOM 0 HD1 PHE A 120 2.230 9.552 13.429 1.00 22.04 H new ATOM 0 HD2 PHE A 120 -1.967 9.697 14.142 1.00 33.04 H new ATOM 0 HE1 PHE A 120 1.860 8.024 11.544 1.00 73.44 H new ATOM 0 HE2 PHE A 120 -2.341 8.168 12.257 1.00 22.40 H new ATOM 0 HZ PHE A 120 -0.428 7.332 10.949 1.00 32.15 H new ATOM 1740 N GLN A 121 0.183 8.153 16.986 1.00 33.21 N ATOM 1741 CA GLN A 121 -0.076 6.729 17.163 1.00 73.25 C ATOM 1742 C GLN A 121 -1.286 6.290 16.344 1.00 62.04 C ATOM 1743 O GLN A 121 -2.429 6.468 16.762 1.00 40.32 O ATOM 1744 CB GLN A 121 -0.304 6.409 18.641 1.00 4.51 C ATOM 1745 CG GLN A 121 0.906 6.691 19.517 1.00 2.33 C ATOM 1746 CD GLN A 121 2.184 6.102 18.954 1.00 25.24 C ATOM 1747 OE1 GLN A 121 2.450 4.909 19.104 1.00 24.14 O ATOM 1748 NE2 GLN A 121 2.984 6.937 18.302 1.00 64.25 N ATOM 0 H GLN A 121 -0.460 8.765 17.489 1.00 33.21 H new ATOM 0 HA GLN A 121 0.798 6.181 16.811 1.00 73.25 H new ATOM 0 HB2 GLN A 121 -1.150 6.993 19.005 1.00 4.51 H new ATOM 0 HB3 GLN A 121 -0.576 5.358 18.739 1.00 4.51 H new ATOM 0 HG2 GLN A 121 1.026 7.769 19.629 1.00 2.33 H new ATOM 0 HG3 GLN A 121 0.731 6.285 20.513 1.00 2.33 H new ATOM 0 HE21 GLN A 121 2.724 7.918 18.201 1.00 64.25 H new ATOM 0 HE22 GLN A 121 3.858 6.597 17.902 1.00 64.25 H new ATOM 1757 N GLY A 122 -1.025 5.715 15.173 1.00 12.03 N ATOM 1758 CA GLY A 122 -2.103 5.260 14.314 1.00 44.20 C ATOM 1759 C GLY A 122 -2.415 3.789 14.505 1.00 10.31 C ATOM 1760 O GLY A 122 -1.606 2.927 14.162 1.00 30.42 O ATOM 0 H GLY A 122 -0.087 5.556 14.805 1.00 12.03 H new ATOM 0 HA2 GLY A 122 -2.998 5.848 14.518 1.00 44.20 H new ATOM 0 HA3 GLY A 122 -1.834 5.439 13.273 1.00 44.20 H new ATOM 1764 N ILE A 123 -3.590 3.502 15.055 1.00 51.30 N ATOM 1765 CA ILE A 123 -4.006 2.126 15.291 1.00 33.44 C ATOM 1766 C ILE A 123 -5.423 1.884 14.781 1.00 42.12 C ATOM 1767 O ILE A 123 -6.307 2.721 14.958 1.00 34.02 O ATOM 1768 CB ILE A 123 -3.944 1.768 16.788 1.00 34.12 C ATOM 1769 CG1 ILE A 123 -2.562 2.096 17.357 1.00 52.15 C ATOM 1770 CG2 ILE A 123 -4.273 0.297 16.995 1.00 24.12 C ATOM 1771 CD1 ILE A 123 -2.495 3.442 18.043 1.00 14.15 C ATOM 0 H ILE A 123 -4.270 4.204 15.345 1.00 51.30 H new ATOM 0 HA ILE A 123 -3.312 1.489 14.744 1.00 33.44 H new ATOM 0 HB ILE A 123 -4.685 2.364 17.320 1.00 34.12 H new ATOM 0 HG12 ILE A 123 -2.277 1.320 18.068 1.00 52.15 H new ATOM 0 HG13 ILE A 123 -1.830 2.072 16.549 1.00 52.15 H new ATOM 0 HG21 ILE A 123 -4.225 0.059 18.058 1.00 24.12 H new ATOM 0 HG22 ILE A 123 -5.277 0.093 16.622 1.00 24.12 H new ATOM 0 HG23 ILE A 123 -3.553 -0.317 16.453 1.00 24.12 H new ATOM 0 HD11 ILE A 123 -1.486 3.608 18.422 1.00 14.15 H new ATOM 0 HD12 ILE A 123 -2.748 4.227 17.330 1.00 14.15 H new ATOM 0 HD13 ILE A 123 -3.202 3.463 18.872 1.00 14.15 H new ATOM 1783 N GLN A 124 -5.630 0.734 14.148 1.00 64.12 N ATOM 1784 CA GLN A 124 -6.939 0.382 13.612 1.00 35.05 C ATOM 1785 C GLN A 124 -7.622 -0.664 14.488 1.00 54.40 C ATOM 1786 O GLN A 124 -7.132 -1.783 14.631 1.00 32.22 O ATOM 1787 CB GLN A 124 -6.805 -0.143 12.182 1.00 40.41 C ATOM 1788 CG GLN A 124 -5.856 -1.323 12.053 1.00 30.25 C ATOM 1789 CD GLN A 124 -6.561 -2.595 11.626 1.00 35.35 C ATOM 1790 OE1 GLN A 124 -7.338 -2.597 10.671 1.00 34.32 O ATOM 1791 NE2 GLN A 124 -6.294 -3.687 12.334 1.00 40.12 N ATOM 0 H GLN A 124 -4.908 0.030 13.994 1.00 64.12 H new ATOM 0 HA GLN A 124 -7.554 1.282 13.604 1.00 35.05 H new ATOM 0 HB2 GLN A 124 -7.789 -0.438 11.818 1.00 40.41 H new ATOM 0 HB3 GLN A 124 -6.456 0.665 11.539 1.00 40.41 H new ATOM 0 HG2 GLN A 124 -5.079 -1.082 11.328 1.00 30.25 H new ATOM 0 HG3 GLN A 124 -5.359 -1.491 13.008 1.00 30.25 H new ATOM 0 HE21 GLN A 124 -5.643 -3.640 13.118 1.00 40.12 H new ATOM 0 HE22 GLN A 124 -6.740 -4.572 12.093 1.00 40.12 H new ATOM 1800 N ALA A 125 -8.756 -0.290 15.072 1.00 74.13 N ATOM 1801 CA ALA A 125 -9.507 -1.196 15.932 1.00 73.11 C ATOM 1802 C ALA A 125 -11.005 -0.925 15.841 1.00 50.53 C ATOM 1803 O ALA A 125 -11.452 0.207 16.022 1.00 32.04 O ATOM 1804 CB ALA A 125 -9.033 -1.071 17.372 1.00 20.01 C ATOM 0 H ALA A 125 -9.174 0.634 14.965 1.00 74.13 H new ATOM 0 HA ALA A 125 -9.327 -2.215 15.589 1.00 73.11 H new ATOM 0 HB1 ALA A 125 -9.603 -1.753 18.003 1.00 20.01 H new ATOM 0 HB2 ALA A 125 -7.974 -1.322 17.430 1.00 20.01 H new ATOM 0 HB3 ALA A 125 -9.182 -0.048 17.717 1.00 20.01 H new ATOM 1810 N ASN A 126 -11.775 -1.970 15.557 1.00 31.13 N ATOM 1811 CA ASN A 126 -13.223 -1.843 15.441 1.00 74.34 C ATOM 1812 C ASN A 126 -13.912 -2.261 16.736 1.00 31.03 C ATOM 1813 O ASN A 126 -13.333 -2.973 17.557 1.00 14.24 O ATOM 1814 CB ASN A 126 -13.739 -2.695 14.279 1.00 43.35 C ATOM 1815 CG ASN A 126 -13.955 -4.143 14.674 1.00 13.41 C ATOM 1816 OD1 ASN A 126 -13.008 -4.855 15.008 1.00 13.20 O ATOM 1817 ND2 ASN A 126 -15.207 -4.585 14.638 1.00 50.31 N ATOM 0 H ASN A 126 -11.421 -2.914 15.403 1.00 31.13 H new ATOM 0 HA ASN A 126 -13.456 -0.796 15.248 1.00 74.34 H new ATOM 0 HB2 ASN A 126 -14.677 -2.277 13.914 1.00 43.35 H new ATOM 0 HB3 ASN A 126 -13.028 -2.649 13.454 1.00 43.35 H new ATOM 0 HD21 ASN A 126 -15.415 -5.550 14.894 1.00 50.31 H new ATOM 0 HD22 ASN A 126 -15.961 -3.959 14.355 1.00 50.31 H new ATOM 1824 N ASP A 127 -15.151 -1.814 16.912 1.00 24.10 N ATOM 1825 CA ASP A 127 -15.920 -2.143 18.107 1.00 43.53 C ATOM 1826 C ASP A 127 -15.266 -1.554 19.353 1.00 42.32 C ATOM 1827 O ASP A 127 -14.408 -0.676 19.260 1.00 71.21 O ATOM 1828 CB ASP A 127 -16.052 -3.659 18.253 1.00 21.22 C ATOM 1829 CG ASP A 127 -17.462 -4.086 18.611 1.00 1.43 C ATOM 1830 OD1 ASP A 127 -17.817 -4.019 19.807 1.00 23.21 O ATOM 1831 OD2 ASP A 127 -18.211 -4.485 17.696 1.00 51.13 O ATOM 0 H ASP A 127 -15.644 -1.223 16.243 1.00 24.10 H new ATOM 0 HA ASP A 127 -16.914 -1.709 18.001 1.00 43.53 H new ATOM 0 HB2 ASP A 127 -15.757 -4.138 17.320 1.00 21.22 H new ATOM 0 HB3 ASP A 127 -15.363 -4.008 19.022 1.00 21.22 H new ATOM 1836 N ALA A 128 -15.678 -2.042 20.518 1.00 21.11 N ATOM 1837 CA ALA A 128 -15.132 -1.565 21.782 1.00 23.15 C ATOM 1838 C ALA A 128 -13.608 -1.635 21.784 1.00 54.35 C ATOM 1839 O ALA A 128 -12.944 -0.882 22.495 1.00 44.40 O ATOM 1840 CB ALA A 128 -15.700 -2.372 22.941 1.00 64.13 C ATOM 0 H ALA A 128 -16.388 -2.768 20.613 1.00 21.11 H new ATOM 0 HA ALA A 128 -15.422 -0.521 21.903 1.00 23.15 H new ATOM 0 HB1 ALA A 128 -15.283 -2.005 23.879 1.00 64.13 H new ATOM 0 HB2 ALA A 128 -16.785 -2.267 22.960 1.00 64.13 H new ATOM 0 HB3 ALA A 128 -15.439 -3.423 22.815 1.00 64.13 H new ATOM 1846 N SER A 129 -13.062 -2.544 20.983 1.00 45.45 N ATOM 1847 CA SER A 129 -11.616 -2.714 20.895 1.00 70.43 C ATOM 1848 C SER A 129 -10.943 -1.423 20.441 1.00 1.52 C ATOM 1849 O SER A 129 -9.751 -1.219 20.665 1.00 4.33 O ATOM 1850 CB SER A 129 -11.273 -3.849 19.927 1.00 51.51 C ATOM 1851 OG SER A 129 -10.880 -5.016 20.628 1.00 41.33 O ATOM 0 H SER A 129 -13.598 -3.174 20.386 1.00 45.45 H new ATOM 0 HA SER A 129 -11.244 -2.967 21.888 1.00 70.43 H new ATOM 0 HB2 SER A 129 -12.137 -4.071 19.301 1.00 51.51 H new ATOM 0 HB3 SER A 129 -10.470 -3.533 19.261 1.00 51.51 H new ATOM 0 HG SER A 129 -10.668 -5.727 19.987 1.00 41.33 H new ATOM 1857 N GLY A 130 -11.718 -0.552 19.801 1.00 3.10 N ATOM 1858 CA GLY A 130 -11.180 0.709 19.325 1.00 14.53 C ATOM 1859 C GLY A 130 -11.261 1.805 20.370 1.00 23.21 C ATOM 1860 O GLY A 130 -10.639 2.858 20.225 1.00 1.22 O ATOM 0 H GLY A 130 -12.708 -0.697 19.604 1.00 3.10 H new ATOM 0 HA2 GLY A 130 -10.140 0.569 19.030 1.00 14.53 H new ATOM 0 HA3 GLY A 130 -11.725 1.020 18.434 1.00 14.53 H new ATOM 1864 N LEU A 131 -12.029 1.558 21.425 1.00 12.32 N ATOM 1865 CA LEU A 131 -12.190 2.533 22.499 1.00 74.03 C ATOM 1866 C LEU A 131 -11.357 2.145 23.716 1.00 43.42 C ATOM 1867 O LEU A 131 -11.661 2.542 24.841 1.00 73.51 O ATOM 1868 CB LEU A 131 -13.664 2.649 22.892 1.00 52.03 C ATOM 1869 CG LEU A 131 -14.670 2.631 21.740 1.00 45.43 C ATOM 1870 CD1 LEU A 131 -16.082 2.430 22.267 1.00 42.13 C ATOM 1871 CD2 LEU A 131 -14.578 3.918 20.932 1.00 21.12 C ATOM 0 H LEU A 131 -12.550 0.692 21.560 1.00 12.32 H new ATOM 0 HA LEU A 131 -11.840 3.499 22.135 1.00 74.03 H new ATOM 0 HB2 LEU A 131 -13.904 1.830 23.570 1.00 52.03 H new ATOM 0 HB3 LEU A 131 -13.798 3.575 23.451 1.00 52.03 H new ATOM 0 HG LEU A 131 -14.427 1.795 21.084 1.00 45.43 H new ATOM 0 HD11 LEU A 131 -16.784 2.420 21.433 1.00 42.13 H new ATOM 0 HD12 LEU A 131 -16.139 1.481 22.801 1.00 42.13 H new ATOM 0 HD13 LEU A 131 -16.336 3.244 22.945 1.00 42.13 H new ATOM 0 HD21 LEU A 131 -15.301 3.888 20.117 1.00 21.12 H new ATOM 0 HD22 LEU A 131 -14.794 4.769 21.578 1.00 21.12 H new ATOM 0 HD23 LEU A 131 -13.573 4.019 20.523 1.00 21.12 H new ATOM 1883 N ASP A 132 -10.303 1.371 23.482 1.00 30.02 N ATOM 1884 CA ASP A 132 -9.423 0.932 24.559 1.00 43.51 C ATOM 1885 C ASP A 132 -8.560 2.087 25.059 1.00 24.52 C ATOM 1886 O ASP A 132 -7.510 2.384 24.488 1.00 55.14 O ATOM 1887 CB ASP A 132 -8.533 -0.217 24.083 1.00 71.00 C ATOM 1888 CG ASP A 132 -9.177 -1.573 24.293 1.00 34.14 C ATOM 1889 OD1 ASP A 132 -10.234 -1.829 23.680 1.00 52.03 O ATOM 1890 OD2 ASP A 132 -8.625 -2.378 25.072 1.00 33.34 O ATOM 0 H ASP A 132 -10.037 1.035 22.556 1.00 30.02 H new ATOM 0 HA ASP A 132 -10.044 0.582 25.383 1.00 43.51 H new ATOM 0 HB2 ASP A 132 -8.309 -0.085 23.025 1.00 71.00 H new ATOM 0 HB3 ASP A 132 -7.583 -0.182 24.617 1.00 71.00 H new ATOM 1895 N PHE A 133 -9.009 2.734 26.129 1.00 3.03 N ATOM 1896 CA PHE A 133 -8.279 3.857 26.706 1.00 43.24 C ATOM 1897 C PHE A 133 -6.886 3.426 27.157 1.00 13.44 C ATOM 1898 O PHE A 133 -5.918 4.172 27.013 1.00 60.33 O ATOM 1899 CB PHE A 133 -9.053 4.443 27.888 1.00 24.25 C ATOM 1900 CG PHE A 133 -9.246 3.472 29.018 1.00 73.21 C ATOM 1901 CD1 PHE A 133 -10.340 2.621 29.038 1.00 2.30 C ATOM 1902 CD2 PHE A 133 -8.335 3.410 30.060 1.00 40.12 C ATOM 1903 CE1 PHE A 133 -10.521 1.726 30.076 1.00 41.33 C ATOM 1904 CE2 PHE A 133 -8.511 2.517 31.100 1.00 65.12 C ATOM 1905 CZ PHE A 133 -9.605 1.675 31.108 1.00 34.14 C ATOM 0 H PHE A 133 -9.875 2.500 26.614 1.00 3.03 H new ATOM 0 HA PHE A 133 -8.172 4.622 25.937 1.00 43.24 H new ATOM 0 HB2 PHE A 133 -8.524 5.320 28.260 1.00 24.25 H new ATOM 0 HB3 PHE A 133 -10.029 4.783 27.541 1.00 24.25 H new ATOM 0 HD1 PHE A 133 -11.059 2.658 28.233 1.00 2.30 H new ATOM 0 HD2 PHE A 133 -7.478 4.067 30.060 1.00 40.12 H new ATOM 0 HE1 PHE A 133 -11.377 1.068 30.080 1.00 41.33 H new ATOM 0 HE2 PHE A 133 -7.793 2.478 31.906 1.00 65.12 H new ATOM 0 HZ PHE A 133 -9.744 0.977 31.920 1.00 34.14 H new ATOM 1915 N GLU A 134 -6.796 2.219 27.706 1.00 62.34 N ATOM 1916 CA GLU A 134 -5.523 1.689 28.180 1.00 45.50 C ATOM 1917 C GLU A 134 -4.557 1.471 27.018 1.00 13.33 C ATOM 1918 O GLU A 134 -3.367 1.764 27.125 1.00 62.44 O ATOM 1919 CB GLU A 134 -5.740 0.374 28.931 1.00 44.11 C ATOM 1920 CG GLU A 134 -4.619 0.033 29.899 1.00 42.55 C ATOM 1921 CD GLU A 134 -4.891 -1.236 30.683 1.00 43.51 C ATOM 1922 OE1 GLU A 134 -4.549 -2.327 30.181 1.00 2.02 O ATOM 1923 OE2 GLU A 134 -5.445 -1.138 31.797 1.00 12.43 O ATOM 0 H GLU A 134 -7.589 1.590 27.834 1.00 62.34 H new ATOM 0 HA GLU A 134 -5.086 2.420 28.861 1.00 45.50 H new ATOM 0 HB2 GLU A 134 -6.679 0.431 29.481 1.00 44.11 H new ATOM 0 HB3 GLU A 134 -5.843 -0.435 28.208 1.00 44.11 H new ATOM 0 HG2 GLU A 134 -3.687 -0.080 29.345 1.00 42.55 H new ATOM 0 HG3 GLU A 134 -4.479 0.862 30.593 1.00 42.55 H new ATOM 1930 N GLU A 135 -5.081 0.955 25.911 1.00 43.24 N ATOM 1931 CA GLU A 135 -4.265 0.697 24.730 1.00 71.41 C ATOM 1932 C GLU A 135 -3.768 2.002 24.116 1.00 65.13 C ATOM 1933 O GLU A 135 -2.615 2.101 23.693 1.00 53.52 O ATOM 1934 CB GLU A 135 -5.065 -0.095 23.693 1.00 32.14 C ATOM 1935 CG GLU A 135 -4.218 -0.635 22.553 1.00 32.24 C ATOM 1936 CD GLU A 135 -3.793 -2.074 22.773 1.00 33.12 C ATOM 1937 OE1 GLU A 135 -3.206 -2.364 23.836 1.00 34.34 O ATOM 1938 OE2 GLU A 135 -4.048 -2.910 21.881 1.00 35.22 O ATOM 0 H GLU A 135 -6.065 0.708 25.807 1.00 43.24 H new ATOM 0 HA GLU A 135 -3.401 0.109 25.039 1.00 71.41 H new ATOM 0 HB2 GLU A 135 -5.564 -0.927 24.190 1.00 32.14 H new ATOM 0 HB3 GLU A 135 -5.846 0.545 23.283 1.00 32.14 H new ATOM 0 HG2 GLU A 135 -4.781 -0.565 21.622 1.00 32.24 H new ATOM 0 HG3 GLU A 135 -3.331 -0.012 22.437 1.00 32.24 H new ATOM 1945 N ILE A 136 -4.644 2.999 24.070 1.00 53.22 N ATOM 1946 CA ILE A 136 -4.295 4.298 23.508 1.00 24.02 C ATOM 1947 C ILE A 136 -3.213 4.982 24.337 1.00 65.11 C ATOM 1948 O ILE A 136 -2.229 5.487 23.797 1.00 44.05 O ATOM 1949 CB ILE A 136 -5.522 5.224 23.423 1.00 34.23 C ATOM 1950 CG1 ILE A 136 -6.603 4.594 22.542 1.00 51.32 C ATOM 1951 CG2 ILE A 136 -5.120 6.589 22.885 1.00 74.43 C ATOM 1952 CD1 ILE A 136 -8.001 5.073 22.865 1.00 50.44 C ATOM 0 H ILE A 136 -5.601 2.932 24.415 1.00 53.22 H new ATOM 0 HA ILE A 136 -3.919 4.115 22.502 1.00 24.02 H new ATOM 0 HB ILE A 136 -5.929 5.357 24.425 1.00 34.23 H new ATOM 0 HG12 ILE A 136 -6.384 4.816 21.498 1.00 51.32 H new ATOM 0 HG13 ILE A 136 -6.564 3.510 22.653 1.00 51.32 H new ATOM 0 HG21 ILE A 136 -5.999 7.232 22.831 1.00 74.43 H new ATOM 0 HG22 ILE A 136 -4.382 7.039 23.549 1.00 74.43 H new ATOM 0 HG23 ILE A 136 -4.691 6.476 21.889 1.00 74.43 H new ATOM 0 HD11 ILE A 136 -8.715 4.585 22.202 1.00 50.44 H new ATOM 0 HD12 ILE A 136 -8.240 4.827 23.900 1.00 50.44 H new ATOM 0 HD13 ILE A 136 -8.057 6.153 22.727 1.00 50.44 H new ATOM 1964 N SER A 137 -3.401 4.993 25.653 1.00 62.43 N ATOM 1965 CA SER A 137 -2.442 5.616 26.557 1.00 3.20 C ATOM 1966 C SER A 137 -1.093 4.906 26.493 1.00 71.33 C ATOM 1967 O SER A 137 -0.041 5.544 26.518 1.00 41.32 O ATOM 1968 CB SER A 137 -2.974 5.596 27.991 1.00 24.03 C ATOM 1969 OG SER A 137 -3.582 4.352 28.292 1.00 13.11 O ATOM 0 H SER A 137 -4.209 4.577 26.117 1.00 62.43 H new ATOM 0 HA SER A 137 -2.303 6.650 26.243 1.00 3.20 H new ATOM 0 HB2 SER A 137 -2.157 5.783 28.688 1.00 24.03 H new ATOM 0 HB3 SER A 137 -3.698 6.400 28.125 1.00 24.03 H new ATOM 0 HG SER A 137 -4.547 4.413 28.134 1.00 13.11 H new ATOM 1975 N ARG A 138 -1.133 3.580 26.410 1.00 73.15 N ATOM 1976 CA ARG A 138 0.085 2.781 26.343 1.00 54.32 C ATOM 1977 C ARG A 138 0.830 3.035 25.036 1.00 62.02 C ATOM 1978 O ARG A 138 2.061 3.050 25.003 1.00 72.30 O ATOM 1979 CB ARG A 138 -0.248 1.294 26.472 1.00 22.32 C ATOM 1980 CG ARG A 138 0.936 0.440 26.895 1.00 22.41 C ATOM 1981 CD ARG A 138 1.600 -0.224 25.699 1.00 71.04 C ATOM 1982 NE ARG A 138 1.579 -1.681 25.799 1.00 1.23 N ATOM 1983 CZ ARG A 138 2.207 -2.485 24.949 1.00 23.33 C ATOM 1984 NH1 ARG A 138 2.903 -1.977 23.941 1.00 35.21 N ATOM 1985 NH2 ARG A 138 2.141 -3.801 25.107 1.00 24.22 N ATOM 0 H ARG A 138 -1.996 3.036 26.388 1.00 73.15 H new ATOM 0 HA ARG A 138 0.729 3.075 27.172 1.00 54.32 H new ATOM 0 HB2 ARG A 138 -1.051 1.172 27.198 1.00 22.32 H new ATOM 0 HB3 ARG A 138 -0.625 0.930 25.516 1.00 22.32 H new ATOM 0 HG2 ARG A 138 1.664 1.059 27.419 1.00 22.41 H new ATOM 0 HG3 ARG A 138 0.603 -0.324 27.598 1.00 22.41 H new ATOM 0 HD2 ARG A 138 1.092 0.084 24.785 1.00 71.04 H new ATOM 0 HD3 ARG A 138 2.632 0.119 25.621 1.00 71.04 H new ATOM 0 HE ARG A 138 1.053 -2.104 26.564 1.00 1.23 H new ATOM 0 HH11 ARG A 138 2.957 -0.966 23.817 1.00 35.21 H new ATOM 0 HH12 ARG A 138 3.384 -2.597 23.290 1.00 35.21 H new ATOM 0 HH21 ARG A 138 1.608 -4.196 25.882 1.00 24.22 H new ATOM 0 HH22 ARG A 138 2.624 -4.418 24.454 1.00 24.22 H new ATOM 1999 N LYS A 139 0.076 3.234 23.960 1.00 64.12 N ATOM 2000 CA LYS A 139 0.664 3.488 22.650 1.00 60.22 C ATOM 2001 C LYS A 139 1.367 4.841 22.622 1.00 54.43 C ATOM 2002 O LYS A 139 2.509 4.950 22.177 1.00 65.21 O ATOM 2003 CB LYS A 139 -0.415 3.439 21.566 1.00 71.22 C ATOM 2004 CG LYS A 139 -0.951 2.042 21.303 1.00 25.12 C ATOM 2005 CD LYS A 139 -0.137 1.324 20.239 1.00 33.12 C ATOM 2006 CE LYS A 139 -0.570 -0.127 20.092 1.00 44.12 C ATOM 2007 NZ LYS A 139 0.427 -1.065 20.679 1.00 71.03 N ATOM 0 H LYS A 139 -0.944 3.224 23.969 1.00 64.12 H new ATOM 0 HA LYS A 139 1.403 2.711 22.454 1.00 60.22 H new ATOM 0 HB2 LYS A 139 -1.241 4.087 21.858 1.00 71.22 H new ATOM 0 HB3 LYS A 139 -0.006 3.842 20.640 1.00 71.22 H new ATOM 0 HG2 LYS A 139 -0.933 1.465 22.227 1.00 25.12 H new ATOM 0 HG3 LYS A 139 -1.992 2.104 20.986 1.00 25.12 H new ATOM 0 HD2 LYS A 139 -0.251 1.837 19.284 1.00 33.12 H new ATOM 0 HD3 LYS A 139 0.921 1.365 20.499 1.00 33.12 H new ATOM 0 HE2 LYS A 139 -1.534 -0.270 20.580 1.00 44.12 H new ATOM 0 HE3 LYS A 139 -0.710 -0.359 19.036 1.00 44.12 H new ATOM 0 HZ1 LYS A 139 0.096 -2.043 20.559 1.00 71.03 H new ATOM 0 HZ2 LYS A 139 1.341 -0.947 20.196 1.00 71.03 H new ATOM 0 HZ3 LYS A 139 0.542 -0.860 21.692 1.00 71.03 H new ATOM 2021 N VAL A 140 0.676 5.871 23.101 1.00 44.53 N ATOM 2022 CA VAL A 140 1.235 7.218 23.133 1.00 64.32 C ATOM 2023 C VAL A 140 2.387 7.311 24.128 1.00 54.11 C ATOM 2024 O VAL A 140 3.381 7.994 23.882 1.00 62.23 O ATOM 2025 CB VAL A 140 0.165 8.261 23.504 1.00 51.24 C ATOM 2026 CG1 VAL A 140 -0.909 8.330 22.429 1.00 73.52 C ATOM 2027 CG2 VAL A 140 -0.445 7.939 24.859 1.00 14.23 C ATOM 0 H VAL A 140 -0.271 5.799 23.472 1.00 44.53 H new ATOM 0 HA VAL A 140 1.606 7.431 22.131 1.00 64.32 H new ATOM 0 HB VAL A 140 0.643 9.239 23.569 1.00 51.24 H new ATOM 0 HG11 VAL A 140 -1.656 9.072 22.709 1.00 73.52 H new ATOM 0 HG12 VAL A 140 -0.455 8.612 21.479 1.00 73.52 H new ATOM 0 HG13 VAL A 140 -1.386 7.355 22.328 1.00 73.52 H new ATOM 0 HG21 VAL A 140 -1.199 8.686 25.105 1.00 14.23 H new ATOM 0 HG22 VAL A 140 -0.909 6.953 24.824 1.00 14.23 H new ATOM 0 HG23 VAL A 140 0.335 7.946 25.620 1.00 14.23 H new ATOM 2037 N LYS A 141 2.246 6.620 25.254 1.00 73.33 N ATOM 2038 CA LYS A 141 3.274 6.622 26.287 1.00 21.13 C ATOM 2039 C LYS A 141 4.586 6.057 25.751 1.00 13.11 C ATOM 2040 O LYS A 141 5.667 6.484 26.154 1.00 4.44 O ATOM 2041 CB LYS A 141 2.812 5.806 27.497 1.00 2.51 C ATOM 2042 CG LYS A 141 3.773 5.864 28.672 1.00 21.40 C ATOM 2043 CD LYS A 141 3.152 5.279 29.929 1.00 31.05 C ATOM 2044 CE LYS A 141 3.852 3.997 30.353 1.00 60.23 C ATOM 2045 NZ LYS A 141 2.937 3.083 31.091 1.00 20.11 N ATOM 0 H LYS A 141 1.429 6.051 25.474 1.00 73.33 H new ATOM 0 HA LYS A 141 3.442 7.654 26.595 1.00 21.13 H new ATOM 0 HB2 LYS A 141 1.836 6.169 27.818 1.00 2.51 H new ATOM 0 HB3 LYS A 141 2.682 4.767 27.196 1.00 2.51 H new ATOM 0 HG2 LYS A 141 4.683 5.317 28.426 1.00 21.40 H new ATOM 0 HG3 LYS A 141 4.063 6.899 28.856 1.00 21.40 H new ATOM 0 HD2 LYS A 141 3.207 6.009 30.737 1.00 31.05 H new ATOM 0 HD3 LYS A 141 2.095 5.077 29.754 1.00 31.05 H new ATOM 0 HE2 LYS A 141 4.241 3.487 29.472 1.00 60.23 H new ATOM 0 HE3 LYS A 141 4.707 4.242 30.983 1.00 60.23 H new ATOM 0 HZ1 LYS A 141 3.452 2.221 31.362 1.00 20.11 H new ATOM 0 HZ2 LYS A 141 2.585 3.560 31.946 1.00 20.11 H new ATOM 0 HZ3 LYS A 141 2.134 2.829 30.481 1.00 20.11 H new ATOM 2059 N SER A 142 4.482 5.096 24.839 1.00 32.21 N ATOM 2060 CA SER A 142 5.660 4.471 24.249 1.00 1.14 C ATOM 2061 C SER A 142 6.146 5.262 23.039 1.00 50.42 C ATOM 2062 O SER A 142 7.340 5.297 22.745 1.00 60.02 O ATOM 2063 CB SER A 142 5.349 3.030 23.840 1.00 55.44 C ATOM 2064 OG SER A 142 6.539 2.294 23.619 1.00 0.12 O ATOM 0 H SER A 142 3.594 4.733 24.492 1.00 32.21 H new ATOM 0 HA SER A 142 6.451 4.465 24.999 1.00 1.14 H new ATOM 0 HB2 SER A 142 4.759 2.547 24.619 1.00 55.44 H new ATOM 0 HB3 SER A 142 4.743 3.029 22.934 1.00 55.44 H new ATOM 0 HG SER A 142 6.313 1.376 23.360 1.00 0.12 H new ATOM 2070 N ASN A 143 5.210 5.897 22.340 1.00 21.11 N ATOM 2071 CA ASN A 143 5.542 6.688 21.161 1.00 74.15 C ATOM 2072 C ASN A 143 6.135 5.808 20.064 1.00 33.35 C ATOM 2073 O ASN A 143 6.957 6.260 19.268 1.00 3.31 O ATOM 2074 CB ASN A 143 6.527 7.799 21.527 1.00 41.54 C ATOM 2075 CG ASN A 143 6.688 8.819 20.415 1.00 31.33 C ATOM 2076 OD1 ASN A 143 5.985 8.769 19.405 1.00 24.45 O ATOM 2077 ND2 ASN A 143 7.617 9.750 20.597 1.00 53.31 N ATOM 0 H ASN A 143 4.216 5.879 22.570 1.00 21.11 H new ATOM 0 HA ASN A 143 4.622 7.136 20.785 1.00 74.15 H new ATOM 0 HB2 ASN A 143 6.183 8.302 22.431 1.00 41.54 H new ATOM 0 HB3 ASN A 143 7.498 7.359 21.756 1.00 41.54 H new ATOM 0 HD21 ASN A 143 7.771 10.463 19.884 1.00 53.31 H new ATOM 0 HD22 ASN A 143 8.176 9.753 21.450 1.00 53.31 H new ATOM 2084 N ARG A 144 5.711 4.549 20.030 1.00 33.40 N ATOM 2085 CA ARG A 144 6.200 3.605 19.032 1.00 20.25 C ATOM 2086 C ARG A 144 5.890 4.096 17.621 1.00 33.54 C ATOM 2087 O ARG A 144 4.858 4.724 17.385 1.00 11.23 O ATOM 2088 CB ARG A 144 5.575 2.226 19.254 1.00 55.34 C ATOM 2089 CG ARG A 144 6.596 1.119 19.456 1.00 42.32 C ATOM 2090 CD ARG A 144 5.947 -0.255 19.398 1.00 44.12 C ATOM 2091 NE ARG A 144 6.645 -1.225 20.238 1.00 74.23 N ATOM 2092 CZ ARG A 144 7.804 -1.783 19.909 1.00 45.24 C ATOM 2093 NH1 ARG A 144 8.394 -1.467 18.764 1.00 63.42 N ATOM 2094 NH2 ARG A 144 8.377 -2.658 20.726 1.00 40.52 N ATOM 0 H ARG A 144 5.030 4.159 20.682 1.00 33.40 H new ATOM 0 HA ARG A 144 7.282 3.527 19.141 1.00 20.25 H new ATOM 0 HB2 ARG A 144 4.921 2.269 20.125 1.00 55.34 H new ATOM 0 HB3 ARG A 144 4.948 1.979 18.397 1.00 55.34 H new ATOM 0 HG2 ARG A 144 7.368 1.190 18.690 1.00 42.32 H new ATOM 0 HG3 ARG A 144 7.090 1.249 20.419 1.00 42.32 H new ATOM 0 HD2 ARG A 144 4.908 -0.179 19.718 1.00 44.12 H new ATOM 0 HD3 ARG A 144 5.938 -0.608 18.367 1.00 44.12 H new ATOM 0 HE ARG A 144 6.218 -1.488 21.126 1.00 74.23 H new ATOM 0 HH11 ARG A 144 7.957 -0.794 18.134 1.00 63.42 H new ATOM 0 HH12 ARG A 144 9.284 -1.897 18.513 1.00 63.42 H new ATOM 0 HH21 ARG A 144 7.927 -2.903 21.608 1.00 40.52 H new ATOM 0 HH22 ARG A 144 9.267 -3.086 20.472 1.00 40.52 H new