USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1047 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 40 THR OG1 : rot 8:sc= 1.81 USER MOD Set 1.2: A 128 TYR OH : rot -41:sc= 1.03 USER MOD Set 2.1: A 82 SER OG : rot 100:sc= 1.78 USER MOD Set 2.2: A 93 HIS : +bothHN:sc= 0.718 K(o=2.5,f=-6.8!) USER MOD Set 3.1: A 36 THR OG1 : rot -53:sc= 1.14 USER MOD Set 3.2: A 37 LYS NZ :NH3+ 147:sc= 1.14 (180deg=-0.272) USER MOD Set 3.3: A 56 THR OG1 : rot -132:sc= 1.01 USER MOD Set 4.1: A 53 THR OG1 : rot 54:sc= 2.12 USER MOD Set 4.2: A 60 THR OG1 : rot -38:sc= 1.23 USER MOD Set 5.1: A 29 THR OG1 : rot -1:sc= 2.14 USER MOD Set 5.2: A 58 LYS NZ :NH3+ 166:sc= 0.91 (180deg=-0.474) USER MOD Single : A 1 VAL N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0084 USER MOD Single : A 9 LYS NZ :NH3+ -111:sc= 0.908 (180deg=-0.863!) USER MOD Single : A 13 SER OG : rot -52:sc= 2.29 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 1.15 K(o=1.1,f=-1.1) USER MOD Single : A 19 TYR OH : rot 0:sc= 0 USER MOD Single : A 20 MET CE :methyl 169:sc= -0.012 (180deg=-0.22) USER MOD Single : A 21 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0579) USER MOD Single : A 22 SER OG : rot 33:sc= 1.2 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 ASN : amide:sc= 0.887 K(o=0.89,f=-5.9!) USER MOD Single : A 35 MET CE :methyl 173:sc= 0 (180deg=-0.0304) USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.0348 USER MOD Single : A 45 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 48 THR OG1 : rot -78:sc= 0.9 USER MOD Single : A 52 LYS NZ :NH3+ -109:sc= 0.617 (180deg=-3.43!) USER MOD Single : A 54 GLN : amide:sc=-0.00509 X(o=-0.0051,f=-0.36) USER MOD Single : A 55 SER OG : rot -57:sc= 1.86 USER MOD Single : A 59 ASN : amide:sc= -0.254 X(o=-0.25,f=-0.64) USER MOD Single : A 63 SER OG : rot 180:sc= 0.0107 USER MOD Single : A 65 LYS NZ :NH3+ -132:sc= 1.07 (180deg=0.422) USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.258 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.127 USER MOD Single : A 79 LYS NZ :NH3+ 156:sc= -0.865 (180deg=-1.67!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -145:sc= 1.21 (180deg=-0.84) USER MOD Single : A 95 GLN : amide:sc= 0.58 K(o=0.58,f=-0.44) USER MOD Single : A 96 LYS NZ :NH3+ -169:sc= -0.0183 (180deg=-0.154) USER MOD Single : A 98 ASN : amide:sc= -0.68 K(o=-0.68,f=-1.8) USER MOD Single : A 100 GLN : amide:sc= -0.0593 K(o=-0.059,f=-9.2!) USER MOD Single : A 102 THR OG1 : rot -98:sc= 0.2 USER MOD Single : A 103 SER OG : rot 180:sc= -0.111 USER MOD Single : A 108 MET CE :methyl 171:sc= 0 (180deg=-0.0468) USER MOD Single : A 112 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.206) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.0763 USER MOD Single : A 119 HIS : no HE2:sc= 0.838 K(o=0.84,f=-3.1!) USER MOD Single : A 121 THR OG1 : rot -50:sc= 0.0979 USER MOD Single : A 124 CYS SG : rot 27:sc= 0.408 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.0269 USER MOD Single : A 127 THR OG1 : rot -26:sc= 1.07 USER MOD Single : A 130 LYS NZ :NH3+ 176:sc= 2.38 (180deg=2.36) USER MOD Single : A 131 GLN : amide:sc= 1.04 K(o=1,f=-4!) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.178 -12.433 -3.075 1.00 0.00 N ATOM 2 CA VAL A 1 10.196 -11.703 -1.819 1.00 0.00 C ATOM 3 C VAL A 1 11.480 -10.873 -1.696 1.00 0.00 C ATOM 4 O VAL A 1 11.409 -9.669 -1.420 1.00 0.00 O ATOM 5 CB VAL A 1 9.902 -12.664 -0.651 1.00 0.00 C ATOM 6 CG1 VAL A 1 10.949 -13.758 -0.438 1.00 0.00 C ATOM 7 CG2 VAL A 1 9.715 -11.911 0.667 1.00 0.00 C ATOM 0 H1 VAL A 1 9.302 -12.989 -3.141 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.222 -11.761 -3.868 1.00 0.00 H new ATOM 0 H3 VAL A 1 10.997 -13.072 -3.117 1.00 0.00 H new ATOM 0 HA VAL A 1 9.395 -10.964 -1.786 1.00 0.00 H new ATOM 0 HB VAL A 1 8.976 -13.156 -0.950 1.00 0.00 H new ATOM 0 HG11 VAL A 1 10.655 -14.384 0.405 1.00 0.00 H new ATOM 0 HG12 VAL A 1 11.023 -14.371 -1.336 1.00 0.00 H new ATOM 0 HG13 VAL A 1 11.916 -13.300 -0.231 1.00 0.00 H new ATOM 0 HG21 VAL A 1 9.509 -12.623 1.467 1.00 0.00 H new ATOM 0 HG22 VAL A 1 10.623 -11.355 0.900 1.00 0.00 H new ATOM 0 HG23 VAL A 1 8.879 -11.218 0.575 1.00 0.00 H new ATOM 19 N ASP A 2 12.638 -11.495 -1.963 1.00 0.00 N ATOM 20 CA ASP A 2 13.969 -10.889 -2.038 1.00 0.00 C ATOM 21 C ASP A 2 14.060 -9.937 -3.238 1.00 0.00 C ATOM 22 O ASP A 2 14.812 -10.147 -4.187 1.00 0.00 O ATOM 23 CB ASP A 2 15.033 -11.994 -2.145 1.00 0.00 C ATOM 24 CG ASP A 2 14.820 -13.106 -1.134 1.00 0.00 C ATOM 25 OD1 ASP A 2 13.867 -13.879 -1.380 1.00 0.00 O ATOM 26 OD2 ASP A 2 15.577 -13.142 -0.142 1.00 0.00 O ATOM 0 H ASP A 2 12.668 -12.498 -2.143 1.00 0.00 H new ATOM 0 HA ASP A 2 14.147 -10.310 -1.132 1.00 0.00 H new ATOM 0 HB2 ASP A 2 15.016 -12.414 -3.151 1.00 0.00 H new ATOM 0 HB3 ASP A 2 16.021 -11.558 -1.998 1.00 0.00 H new ATOM 31 N ALA A 3 13.254 -8.884 -3.192 1.00 0.00 N ATOM 32 CA ALA A 3 12.904 -8.031 -4.313 1.00 0.00 C ATOM 33 C ALA A 3 12.184 -6.804 -3.767 1.00 0.00 C ATOM 34 O ALA A 3 12.470 -5.681 -4.176 1.00 0.00 O ATOM 35 CB ALA A 3 11.997 -8.797 -5.285 1.00 0.00 C ATOM 0 H ALA A 3 12.805 -8.589 -2.325 1.00 0.00 H new ATOM 0 HA ALA A 3 13.799 -7.724 -4.854 1.00 0.00 H new ATOM 0 HB1 ALA A 3 11.737 -8.152 -6.125 1.00 0.00 H new ATOM 0 HB2 ALA A 3 12.521 -9.679 -5.653 1.00 0.00 H new ATOM 0 HB3 ALA A 3 11.088 -9.104 -4.769 1.00 0.00 H new ATOM 41 N PHE A 4 11.274 -7.019 -2.812 1.00 0.00 N ATOM 42 CA PHE A 4 10.470 -5.961 -2.225 1.00 0.00 C ATOM 43 C PHE A 4 11.253 -5.193 -1.165 1.00 0.00 C ATOM 44 O PHE A 4 11.185 -3.969 -1.130 1.00 0.00 O ATOM 45 CB PHE A 4 9.189 -6.570 -1.641 1.00 0.00 C ATOM 46 CG PHE A 4 8.409 -7.446 -2.605 1.00 0.00 C ATOM 47 CD1 PHE A 4 8.326 -7.104 -3.969 1.00 0.00 C ATOM 48 CD2 PHE A 4 7.877 -8.673 -2.165 1.00 0.00 C ATOM 49 CE1 PHE A 4 7.773 -8.003 -4.888 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.339 -9.581 -3.094 1.00 0.00 C ATOM 51 CZ PHE A 4 7.313 -9.254 -4.459 1.00 0.00 C ATOM 0 H PHE A 4 11.079 -7.943 -2.426 1.00 0.00 H new ATOM 0 HA PHE A 4 10.203 -5.243 -3.000 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.451 -7.162 -0.764 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.542 -5.762 -1.299 1.00 0.00 H new ATOM 0 HD1 PHE A 4 8.690 -6.145 -4.307 1.00 0.00 H new ATOM 0 HD2 PHE A 4 7.882 -8.917 -1.113 1.00 0.00 H new ATOM 0 HE1 PHE A 4 7.701 -7.731 -5.931 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.946 -10.529 -2.758 1.00 0.00 H new ATOM 0 HZ PHE A 4 6.938 -9.967 -5.178 1.00 0.00 H new ATOM 61 N VAL A 5 11.980 -5.918 -0.310 1.00 0.00 N ATOM 62 CA VAL A 5 12.629 -5.415 0.899 1.00 0.00 C ATOM 63 C VAL A 5 13.347 -4.076 0.680 1.00 0.00 C ATOM 64 O VAL A 5 14.461 -4.069 0.149 1.00 0.00 O ATOM 65 CB VAL A 5 13.618 -6.478 1.421 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.385 -5.958 2.650 1.00 0.00 C ATOM 67 CG2 VAL A 5 12.903 -7.772 1.822 1.00 0.00 C ATOM 0 H VAL A 5 12.138 -6.916 -0.450 1.00 0.00 H new ATOM 0 HA VAL A 5 11.851 -5.227 1.639 1.00 0.00 H new ATOM 0 HB VAL A 5 14.308 -6.684 0.603 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.076 -6.725 2.999 1.00 0.00 H new ATOM 0 HG12 VAL A 5 14.944 -5.063 2.378 1.00 0.00 H new ATOM 0 HG13 VAL A 5 13.679 -5.717 3.444 1.00 0.00 H new ATOM 0 HG21 VAL A 5 13.634 -8.495 2.184 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.182 -7.560 2.611 1.00 0.00 H new ATOM 0 HG23 VAL A 5 12.384 -8.184 0.957 1.00 0.00 H new ATOM 77 N GLY A 6 12.749 -2.966 1.129 1.00 0.00 N ATOM 78 CA GLY A 6 13.408 -1.674 1.262 1.00 0.00 C ATOM 79 C GLY A 6 12.524 -0.500 0.840 1.00 0.00 C ATOM 80 O GLY A 6 11.311 -0.630 0.662 1.00 0.00 O ATOM 0 H GLY A 6 11.770 -2.948 1.415 1.00 0.00 H new ATOM 0 HA2 GLY A 6 13.715 -1.535 2.299 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.315 -1.672 0.658 1.00 0.00 H new ATOM 84 N THR A 7 13.164 0.664 0.697 1.00 0.00 N ATOM 85 CA THR A 7 12.551 1.913 0.283 1.00 0.00 C ATOM 86 C THR A 7 12.295 1.902 -1.222 1.00 0.00 C ATOM 87 O THR A 7 13.239 1.958 -2.009 1.00 0.00 O ATOM 88 CB THR A 7 13.488 3.072 0.658 1.00 0.00 C ATOM 89 OG1 THR A 7 14.085 2.822 1.911 1.00 0.00 O ATOM 90 CG2 THR A 7 12.732 4.398 0.731 1.00 0.00 C ATOM 0 H THR A 7 14.164 0.757 0.876 1.00 0.00 H new ATOM 0 HA THR A 7 11.594 2.039 0.789 1.00 0.00 H new ATOM 0 HB THR A 7 14.251 3.143 -0.117 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.682 3.564 2.143 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.424 5.197 0.998 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.284 4.615 -0.239 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.948 4.329 1.485 1.00 0.00 H new ATOM 98 N TRP A 8 11.024 1.845 -1.612 1.00 0.00 N ATOM 99 CA TRP A 8 10.571 2.062 -2.973 1.00 0.00 C ATOM 100 C TRP A 8 10.434 3.574 -3.176 1.00 0.00 C ATOM 101 O TRP A 8 9.579 4.188 -2.543 1.00 0.00 O ATOM 102 CB TRP A 8 9.212 1.372 -3.152 1.00 0.00 C ATOM 103 CG TRP A 8 9.136 -0.123 -3.089 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.073 -0.960 -2.594 1.00 0.00 C ATOM 105 CD2 TRP A 8 8.011 -0.974 -3.469 1.00 0.00 C ATOM 106 NE1 TRP A 8 9.628 -2.258 -2.678 1.00 0.00 N ATOM 107 CE2 TRP A 8 8.362 -2.333 -3.214 1.00 0.00 C ATOM 108 CE3 TRP A 8 6.706 -0.729 -3.949 1.00 0.00 C ATOM 109 CZ2 TRP A 8 7.473 -3.394 -3.445 1.00 0.00 C ATOM 110 CZ3 TRP A 8 5.802 -1.786 -4.174 1.00 0.00 C ATOM 111 CH2 TRP A 8 6.189 -3.118 -3.939 1.00 0.00 C ATOM 0 H TRP A 8 10.262 1.640 -0.966 1.00 0.00 H new ATOM 0 HA TRP A 8 11.271 1.652 -3.701 1.00 0.00 H new ATOM 0 HB2 TRP A 8 8.541 1.767 -2.389 1.00 0.00 H new ATOM 0 HB3 TRP A 8 8.813 1.680 -4.118 1.00 0.00 H new ATOM 0 HD1 TRP A 8 11.028 -0.656 -2.193 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.171 -3.068 -2.379 1.00 0.00 H new ATOM 0 HE3 TRP A 8 6.395 0.286 -4.147 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 7.774 -4.412 -3.245 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 4.805 -1.572 -4.529 1.00 0.00 H new ATOM 0 HH2 TRP A 8 5.500 -3.925 -4.138 1.00 0.00 H new ATOM 122 N LYS A 9 11.252 4.183 -4.037 1.00 0.00 N ATOM 123 CA LYS A 9 11.147 5.593 -4.415 1.00 0.00 C ATOM 124 C LYS A 9 10.370 5.702 -5.730 1.00 0.00 C ATOM 125 O LYS A 9 10.720 5.030 -6.696 1.00 0.00 O ATOM 126 CB LYS A 9 12.564 6.173 -4.508 1.00 0.00 C ATOM 127 CG LYS A 9 12.647 7.512 -5.249 1.00 0.00 C ATOM 128 CD LYS A 9 13.997 8.186 -4.953 1.00 0.00 C ATOM 129 CE LYS A 9 14.496 9.020 -6.140 1.00 0.00 C ATOM 130 NZ LYS A 9 15.262 8.199 -7.105 1.00 0.00 N ATOM 0 H LYS A 9 12.021 3.699 -4.500 1.00 0.00 H new ATOM 0 HA LYS A 9 10.598 6.171 -3.672 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.958 6.303 -3.500 1.00 0.00 H new ATOM 0 HB3 LYS A 9 13.208 5.451 -5.011 1.00 0.00 H new ATOM 0 HG2 LYS A 9 12.537 7.352 -6.322 1.00 0.00 H new ATOM 0 HG3 LYS A 9 11.829 8.162 -4.938 1.00 0.00 H new ATOM 0 HD2 LYS A 9 13.898 8.826 -4.076 1.00 0.00 H new ATOM 0 HD3 LYS A 9 14.737 7.424 -4.709 1.00 0.00 H new ATOM 0 HE2 LYS A 9 13.646 9.477 -6.646 1.00 0.00 H new ATOM 0 HE3 LYS A 9 15.124 9.833 -5.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 16.264 8.476 -7.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.173 7.194 -6.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 14.887 8.350 -8.063 1.00 0.00 H new ATOM 144 N LEU A 10 9.290 6.492 -5.770 1.00 0.00 N ATOM 145 CA LEU A 10 8.434 6.577 -6.951 1.00 0.00 C ATOM 146 C LEU A 10 9.196 7.146 -8.152 1.00 0.00 C ATOM 147 O LEU A 10 9.980 8.080 -7.986 1.00 0.00 O ATOM 148 CB LEU A 10 7.196 7.421 -6.616 1.00 0.00 C ATOM 149 CG LEU A 10 6.219 7.544 -7.800 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.778 7.443 -7.300 1.00 0.00 C ATOM 151 CD2 LEU A 10 6.401 8.873 -8.548 1.00 0.00 C ATOM 0 H LEU A 10 8.991 7.082 -4.993 1.00 0.00 H new ATOM 0 HA LEU A 10 8.112 5.574 -7.233 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.677 6.975 -5.767 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.514 8.417 -6.308 1.00 0.00 H new ATOM 0 HG LEU A 10 6.434 6.728 -8.490 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.093 7.531 -8.143 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.629 6.480 -6.811 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.583 8.246 -6.589 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.695 8.924 -9.377 1.00 0.00 H new ATOM 0 HD22 LEU A 10 6.219 9.703 -7.865 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.418 8.937 -8.934 1.00 0.00 H new ATOM 163 N VAL A 11 8.939 6.617 -9.358 1.00 0.00 N ATOM 164 CA VAL A 11 9.509 7.147 -10.596 1.00 0.00 C ATOM 165 C VAL A 11 8.593 6.909 -11.821 1.00 0.00 C ATOM 166 O VAL A 11 9.070 6.898 -12.953 1.00 0.00 O ATOM 167 CB VAL A 11 10.958 6.626 -10.743 1.00 0.00 C ATOM 168 CG1 VAL A 11 11.031 5.152 -11.148 1.00 0.00 C ATOM 169 CG2 VAL A 11 11.812 7.493 -11.677 1.00 0.00 C ATOM 0 H VAL A 11 8.330 5.811 -9.497 1.00 0.00 H new ATOM 0 HA VAL A 11 9.566 8.234 -10.545 1.00 0.00 H new ATOM 0 HB VAL A 11 11.385 6.705 -9.743 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.075 4.850 -11.234 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.537 4.542 -10.391 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.533 5.013 -12.108 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.818 7.078 -11.740 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.363 7.509 -12.670 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.863 8.509 -11.285 1.00 0.00 H new ATOM 179 N ASP A 12 7.276 6.764 -11.611 1.00 0.00 N ATOM 180 CA ASP A 12 6.224 6.881 -12.630 1.00 0.00 C ATOM 181 C ASP A 12 4.898 7.109 -11.899 1.00 0.00 C ATOM 182 O ASP A 12 4.803 6.821 -10.705 1.00 0.00 O ATOM 183 CB ASP A 12 6.158 5.664 -13.568 1.00 0.00 C ATOM 184 CG ASP A 12 4.864 5.616 -14.381 1.00 0.00 C ATOM 185 OD1 ASP A 12 4.504 6.675 -14.944 1.00 0.00 O ATOM 186 OD2 ASP A 12 4.202 4.557 -14.351 1.00 0.00 O ATOM 0 H ASP A 12 6.900 6.553 -10.687 1.00 0.00 H new ATOM 0 HA ASP A 12 6.449 7.723 -13.284 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.009 5.688 -14.248 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.246 4.751 -12.979 1.00 0.00 H new ATOM 191 N SER A 13 3.902 7.677 -12.583 1.00 0.00 N ATOM 192 CA SER A 13 2.665 8.176 -12.008 1.00 0.00 C ATOM 193 C SER A 13 1.754 8.709 -13.123 1.00 0.00 C ATOM 194 O SER A 13 1.551 9.921 -13.218 1.00 0.00 O ATOM 195 CB SER A 13 3.013 9.257 -10.960 1.00 0.00 C ATOM 196 OG SER A 13 1.906 10.086 -10.649 1.00 0.00 O ATOM 0 H SER A 13 3.944 7.804 -13.594 1.00 0.00 H new ATOM 0 HA SER A 13 2.117 7.379 -11.505 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.369 8.775 -10.050 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.830 9.873 -11.335 1.00 0.00 H new ATOM 0 HG SER A 13 1.521 10.442 -11.477 1.00 0.00 H new ATOM 202 N LYS A 14 1.141 7.828 -13.919 1.00 0.00 N ATOM 203 CA LYS A 14 0.054 8.224 -14.814 1.00 0.00 C ATOM 204 C LYS A 14 -1.279 7.929 -14.114 1.00 0.00 C ATOM 205 O LYS A 14 -1.405 6.904 -13.444 1.00 0.00 O ATOM 206 CB LYS A 14 0.167 7.479 -16.153 1.00 0.00 C ATOM 207 CG LYS A 14 -0.588 8.204 -17.283 1.00 0.00 C ATOM 208 CD LYS A 14 0.290 9.213 -18.044 1.00 0.00 C ATOM 209 CE LYS A 14 1.178 8.500 -19.078 1.00 0.00 C ATOM 210 NZ LYS A 14 2.018 9.442 -19.847 1.00 0.00 N ATOM 0 H LYS A 14 1.380 6.837 -13.961 1.00 0.00 H new ATOM 0 HA LYS A 14 0.113 9.290 -15.035 1.00 0.00 H new ATOM 0 HB2 LYS A 14 1.218 7.380 -16.425 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.230 6.470 -16.041 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -0.975 7.466 -17.985 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.448 8.725 -16.862 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.343 9.945 -18.546 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.915 9.761 -17.339 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.818 7.780 -18.568 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.548 7.935 -19.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.597 8.913 -20.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.409 10.114 -20.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.640 9.963 -19.196 1.00 0.00 H new ATOM 224 N ASN A 15 -2.267 8.825 -14.221 1.00 0.00 N ATOM 225 CA ASN A 15 -3.671 8.603 -13.842 1.00 0.00 C ATOM 226 C ASN A 15 -3.916 8.318 -12.351 1.00 0.00 C ATOM 227 O ASN A 15 -5.061 8.180 -11.935 1.00 0.00 O ATOM 228 CB ASN A 15 -4.308 7.495 -14.700 1.00 0.00 C ATOM 229 CG ASN A 15 -4.250 7.764 -16.201 1.00 0.00 C ATOM 230 OD1 ASN A 15 -3.957 8.872 -16.640 1.00 0.00 O ATOM 231 ND2 ASN A 15 -4.484 6.735 -17.008 1.00 0.00 N ATOM 0 H ASN A 15 -2.106 9.763 -14.588 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.155 9.560 -14.038 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.804 6.552 -14.490 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.350 7.373 -14.403 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -4.422 6.855 -18.019 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.726 5.825 -16.617 1.00 0.00 H new ATOM 238 N PHE A 16 -2.873 8.214 -11.519 1.00 0.00 N ATOM 239 CA PHE A 16 -3.028 7.817 -10.122 1.00 0.00 C ATOM 240 C PHE A 16 -3.944 8.771 -9.350 1.00 0.00 C ATOM 241 O PHE A 16 -4.601 8.343 -8.405 1.00 0.00 O ATOM 242 CB PHE A 16 -1.654 7.706 -9.442 1.00 0.00 C ATOM 243 CG PHE A 16 -1.644 7.036 -8.074 1.00 0.00 C ATOM 244 CD1 PHE A 16 -2.230 5.768 -7.889 1.00 0.00 C ATOM 245 CD2 PHE A 16 -1.039 7.681 -6.978 1.00 0.00 C ATOM 246 CE1 PHE A 16 -2.185 5.143 -6.631 1.00 0.00 C ATOM 247 CE2 PHE A 16 -1.004 7.059 -5.718 1.00 0.00 C ATOM 248 CZ PHE A 16 -1.563 5.784 -5.547 1.00 0.00 C ATOM 0 H PHE A 16 -1.909 8.401 -11.795 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.506 6.838 -10.110 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.987 7.152 -10.102 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.239 8.709 -9.338 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -2.716 5.274 -8.718 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -0.599 8.659 -7.106 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.630 4.168 -6.498 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -0.546 7.564 -4.880 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.515 5.296 -4.584 1.00 0.00 H new ATOM 258 N ASP A 17 -3.961 10.056 -9.730 1.00 0.00 N ATOM 259 CA ASP A 17 -4.844 11.030 -9.104 1.00 0.00 C ATOM 260 C ASP A 17 -6.289 10.691 -9.464 1.00 0.00 C ATOM 261 O ASP A 17 -7.010 10.154 -8.625 1.00 0.00 O ATOM 262 CB ASP A 17 -4.447 12.465 -9.477 1.00 0.00 C ATOM 263 CG ASP A 17 -5.087 13.426 -8.485 1.00 0.00 C ATOM 264 OD1 ASP A 17 -6.326 13.557 -8.539 1.00 0.00 O ATOM 265 OD2 ASP A 17 -4.322 13.958 -7.652 1.00 0.00 O ATOM 0 H ASP A 17 -3.370 10.438 -10.469 1.00 0.00 H new ATOM 0 HA ASP A 17 -4.747 10.977 -8.020 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -3.362 12.573 -9.460 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -4.775 12.696 -10.491 1.00 0.00 H new ATOM 270 N ASP A 18 -6.645 10.919 -10.734 1.00 0.00 N ATOM 271 CA ASP A 18 -7.882 10.510 -11.398 1.00 0.00 C ATOM 272 C ASP A 18 -8.474 9.249 -10.767 1.00 0.00 C ATOM 273 O ASP A 18 -9.565 9.284 -10.201 1.00 0.00 O ATOM 274 CB ASP A 18 -7.571 10.313 -12.893 1.00 0.00 C ATOM 275 CG ASP A 18 -8.511 9.321 -13.565 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.678 9.705 -13.775 1.00 0.00 O ATOM 277 OD2 ASP A 18 -8.036 8.196 -13.833 1.00 0.00 O ATOM 0 H ASP A 18 -6.030 11.431 -11.367 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.641 11.283 -11.278 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.639 11.274 -13.403 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.544 9.965 -13.003 1.00 0.00 H new ATOM 282 N TYR A 19 -7.706 8.159 -10.818 1.00 0.00 N ATOM 283 CA TYR A 19 -8.069 6.861 -10.279 1.00 0.00 C ATOM 284 C TYR A 19 -8.717 6.992 -8.896 1.00 0.00 C ATOM 285 O TYR A 19 -9.870 6.601 -8.698 1.00 0.00 O ATOM 286 CB TYR A 19 -6.802 5.993 -10.254 1.00 0.00 C ATOM 287 CG TYR A 19 -7.003 4.514 -9.992 1.00 0.00 C ATOM 288 CD1 TYR A 19 -7.201 4.042 -8.681 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.806 3.593 -11.037 1.00 0.00 C ATOM 290 CE1 TYR A 19 -7.192 2.663 -8.415 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.789 2.218 -10.768 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.956 1.752 -9.456 1.00 0.00 C ATOM 293 OH TYR A 19 -6.830 0.424 -9.190 1.00 0.00 O ATOM 0 H TYR A 19 -6.783 8.163 -11.252 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.820 6.384 -10.909 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -6.293 6.104 -11.211 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.133 6.387 -9.489 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -7.361 4.744 -7.876 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -6.668 3.946 -12.048 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.366 2.304 -7.411 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.647 1.514 -11.575 1.00 0.00 H new ATOM 0 HH TYR A 19 -6.929 0.273 -8.227 1.00 0.00 H new ATOM 303 N MET A 20 -7.980 7.538 -7.923 1.00 0.00 N ATOM 304 CA MET A 20 -8.474 7.640 -6.556 1.00 0.00 C ATOM 305 C MET A 20 -9.527 8.742 -6.415 1.00 0.00 C ATOM 306 O MET A 20 -10.456 8.619 -5.612 1.00 0.00 O ATOM 307 CB MET A 20 -7.313 7.767 -5.565 1.00 0.00 C ATOM 308 CG MET A 20 -6.514 9.066 -5.660 1.00 0.00 C ATOM 309 SD MET A 20 -5.322 9.261 -4.319 1.00 0.00 S ATOM 310 CE MET A 20 -4.182 7.904 -4.690 1.00 0.00 C ATOM 0 H MET A 20 -7.042 7.914 -8.061 1.00 0.00 H new ATOM 0 HA MET A 20 -8.991 6.714 -6.304 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.709 7.676 -4.553 1.00 0.00 H new ATOM 0 HB3 MET A 20 -6.633 6.929 -5.718 1.00 0.00 H new ATOM 0 HG2 MET A 20 -5.987 9.093 -6.614 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.203 9.911 -5.652 1.00 0.00 H new ATOM 0 HE1 MET A 20 -3.287 8.003 -4.076 1.00 0.00 H new ATOM 0 HE2 MET A 20 -4.667 6.952 -4.474 1.00 0.00 H new ATOM 0 HE3 MET A 20 -3.905 7.939 -5.744 1.00 0.00 H new ATOM 320 N LYS A 21 -9.394 9.801 -7.220 1.00 0.00 N ATOM 321 CA LYS A 21 -10.294 10.943 -7.355 1.00 0.00 C ATOM 322 C LYS A 21 -11.538 10.518 -8.154 1.00 0.00 C ATOM 323 O LYS A 21 -11.978 11.215 -9.064 1.00 0.00 O ATOM 324 CB LYS A 21 -9.481 12.073 -8.028 1.00 0.00 C ATOM 325 CG LYS A 21 -9.830 13.532 -7.699 1.00 0.00 C ATOM 326 CD LYS A 21 -11.067 14.082 -8.428 1.00 0.00 C ATOM 327 CE LYS A 21 -12.361 13.989 -7.608 1.00 0.00 C ATOM 328 NZ LYS A 21 -12.372 14.936 -6.473 1.00 0.00 N ATOM 0 H LYS A 21 -8.590 9.885 -7.842 1.00 0.00 H new ATOM 0 HA LYS A 21 -10.665 11.307 -6.397 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.432 11.920 -7.776 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.571 11.947 -9.107 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -9.991 13.618 -6.624 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -8.973 14.159 -7.944 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.889 15.125 -8.691 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.200 13.536 -9.362 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -13.215 14.190 -8.255 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.479 12.973 -7.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -13.326 14.974 -6.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -11.696 14.619 -5.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -12.102 15.883 -6.808 1.00 0.00 H new ATOM 342 N SER A 22 -12.110 9.372 -7.779 1.00 0.00 N ATOM 343 CA SER A 22 -13.197 8.655 -8.432 1.00 0.00 C ATOM 344 C SER A 22 -13.443 7.367 -7.645 1.00 0.00 C ATOM 345 O SER A 22 -14.587 7.040 -7.338 1.00 0.00 O ATOM 346 CB SER A 22 -12.877 8.335 -9.901 1.00 0.00 C ATOM 347 OG SER A 22 -13.143 9.453 -10.719 1.00 0.00 O ATOM 0 H SER A 22 -11.795 8.885 -6.940 1.00 0.00 H new ATOM 0 HA SER A 22 -14.088 9.282 -8.440 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.830 8.047 -9.997 1.00 0.00 H new ATOM 0 HB3 SER A 22 -13.473 7.484 -10.232 1.00 0.00 H new ATOM 0 HG SER A 22 -12.966 10.276 -10.216 1.00 0.00 H new ATOM 353 N LEU A 23 -12.373 6.643 -7.288 1.00 0.00 N ATOM 354 CA LEU A 23 -12.476 5.482 -6.408 1.00 0.00 C ATOM 355 C LEU A 23 -13.221 5.838 -5.117 1.00 0.00 C ATOM 356 O LEU A 23 -14.100 5.095 -4.679 1.00 0.00 O ATOM 357 CB LEU A 23 -11.077 4.936 -6.090 1.00 0.00 C ATOM 358 CG LEU A 23 -11.071 3.456 -5.685 1.00 0.00 C ATOM 359 CD1 LEU A 23 -11.391 2.579 -6.904 1.00 0.00 C ATOM 360 CD2 LEU A 23 -9.684 3.094 -5.141 1.00 0.00 C ATOM 0 H LEU A 23 -11.423 6.847 -7.600 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.047 4.709 -6.923 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.438 5.067 -6.963 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.641 5.526 -5.284 1.00 0.00 H new ATOM 0 HG LEU A 23 -11.826 3.284 -4.918 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.385 1.530 -6.609 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.375 2.841 -7.292 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.640 2.743 -7.677 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -9.670 2.044 -4.850 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.934 3.267 -5.913 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -9.461 3.714 -4.273 1.00 0.00 H new ATOM 372 N GLY A 24 -12.875 6.979 -4.518 1.00 0.00 N ATOM 373 CA GLY A 24 -13.533 7.487 -3.326 1.00 0.00 C ATOM 374 C GLY A 24 -12.578 8.460 -2.658 1.00 0.00 C ATOM 375 O GLY A 24 -12.638 9.654 -2.939 1.00 0.00 O ATOM 0 H GLY A 24 -12.121 7.578 -4.855 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.467 7.984 -3.586 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.784 6.670 -2.649 1.00 0.00 H new ATOM 379 N VAL A 25 -11.665 7.913 -1.850 1.00 0.00 N ATOM 380 CA VAL A 25 -10.476 8.551 -1.290 1.00 0.00 C ATOM 381 C VAL A 25 -10.145 9.944 -1.850 1.00 0.00 C ATOM 382 O VAL A 25 -10.222 10.915 -1.102 1.00 0.00 O ATOM 383 CB VAL A 25 -9.304 7.541 -1.321 1.00 0.00 C ATOM 384 CG1 VAL A 25 -9.312 6.649 -2.571 1.00 0.00 C ATOM 385 CG2 VAL A 25 -7.934 8.206 -1.149 1.00 0.00 C ATOM 0 H VAL A 25 -11.746 6.942 -1.550 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.691 8.799 -0.251 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.471 6.899 -0.456 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.466 5.963 -2.534 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -10.240 6.079 -2.605 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -9.235 7.271 -3.463 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -7.154 7.445 -1.180 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -7.774 8.923 -1.954 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -7.899 8.724 -0.190 1.00 0.00 H new ATOM 395 N GLY A 26 -9.740 10.049 -3.125 1.00 0.00 N ATOM 396 CA GLY A 26 -9.410 11.314 -3.788 1.00 0.00 C ATOM 397 C GLY A 26 -8.683 12.335 -2.911 1.00 0.00 C ATOM 398 O GLY A 26 -8.990 13.524 -2.970 1.00 0.00 O ATOM 0 H GLY A 26 -9.631 9.238 -3.734 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -8.790 11.099 -4.659 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.332 11.765 -4.156 1.00 0.00 H new ATOM 402 N PHE A 27 -7.748 11.876 -2.072 1.00 0.00 N ATOM 403 CA PHE A 27 -7.350 12.657 -0.913 1.00 0.00 C ATOM 404 C PHE A 27 -6.527 13.901 -1.263 1.00 0.00 C ATOM 405 O PHE A 27 -5.775 13.917 -2.241 1.00 0.00 O ATOM 406 CB PHE A 27 -6.703 11.761 0.159 1.00 0.00 C ATOM 407 CG PHE A 27 -5.642 10.738 -0.237 1.00 0.00 C ATOM 408 CD1 PHE A 27 -4.771 10.939 -1.324 1.00 0.00 C ATOM 409 CD2 PHE A 27 -5.451 9.615 0.591 1.00 0.00 C ATOM 410 CE1 PHE A 27 -3.672 10.085 -1.525 1.00 0.00 C ATOM 411 CE2 PHE A 27 -4.404 8.713 0.340 1.00 0.00 C ATOM 412 CZ PHE A 27 -3.503 8.957 -0.708 1.00 0.00 C ATOM 0 H PHE A 27 -7.265 10.984 -2.176 1.00 0.00 H new ATOM 0 HA PHE A 27 -8.260 13.066 -0.474 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -6.256 12.419 0.904 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -7.507 11.218 0.655 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -4.948 11.755 -2.009 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -6.115 9.446 1.426 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -2.959 10.297 -2.308 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -4.292 7.831 0.954 1.00 0.00 H new ATOM 0 HZ PHE A 27 -2.682 8.278 -0.885 1.00 0.00 H new ATOM 422 N ALA A 28 -6.641 14.936 -0.421 1.00 0.00 N ATOM 423 CA ALA A 28 -5.832 16.147 -0.488 1.00 0.00 C ATOM 424 C ALA A 28 -4.391 15.803 -0.106 1.00 0.00 C ATOM 425 O ALA A 28 -3.927 16.091 0.996 1.00 0.00 O ATOM 426 CB ALA A 28 -6.425 17.217 0.433 1.00 0.00 C ATOM 0 H ALA A 28 -7.317 14.949 0.343 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.832 16.550 -1.501 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -5.817 18.120 0.380 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.443 17.445 0.117 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -6.438 16.848 1.459 1.00 0.00 H new ATOM 432 N THR A 29 -3.708 15.116 -1.017 1.00 0.00 N ATOM 433 CA THR A 29 -2.356 14.621 -0.844 1.00 0.00 C ATOM 434 C THR A 29 -1.764 14.277 -2.204 1.00 0.00 C ATOM 435 O THR A 29 -0.660 14.710 -2.521 1.00 0.00 O ATOM 436 CB THR A 29 -2.357 13.390 0.081 1.00 0.00 C ATOM 437 OG1 THR A 29 -2.694 13.767 1.394 1.00 0.00 O ATOM 438 CG2 THR A 29 -0.968 12.777 0.140 1.00 0.00 C ATOM 0 H THR A 29 -4.101 14.883 -1.929 1.00 0.00 H new ATOM 0 HA THR A 29 -1.742 15.393 -0.379 1.00 0.00 H new ATOM 0 HB THR A 29 -3.081 12.679 -0.317 1.00 0.00 H new ATOM 0 HG1 THR A 29 -2.831 14.737 1.431 1.00 0.00 H new ATOM 0 HG21 THR A 29 -0.982 11.907 0.797 1.00 0.00 H new ATOM 0 HG22 THR A 29 -0.663 12.471 -0.861 1.00 0.00 H new ATOM 0 HG23 THR A 29 -0.262 13.512 0.526 1.00 0.00 H new ATOM 446 N ARG A 30 -2.488 13.483 -2.999 1.00 0.00 N ATOM 447 CA ARG A 30 -1.985 12.938 -4.257 1.00 0.00 C ATOM 448 C ARG A 30 -1.414 14.052 -5.138 1.00 0.00 C ATOM 449 O ARG A 30 -0.313 13.917 -5.668 1.00 0.00 O ATOM 450 CB ARG A 30 -3.109 12.159 -4.944 1.00 0.00 C ATOM 451 CG ARG A 30 -2.591 11.078 -5.898 1.00 0.00 C ATOM 452 CD ARG A 30 -1.950 11.645 -7.168 1.00 0.00 C ATOM 453 NE ARG A 30 -0.488 11.489 -7.179 1.00 0.00 N ATOM 454 CZ ARG A 30 0.205 11.049 -8.237 1.00 0.00 C ATOM 455 NH1 ARG A 30 -0.316 11.089 -9.464 1.00 0.00 N ATOM 456 NH2 ARG A 30 1.426 10.544 -8.077 1.00 0.00 N ATOM 0 H ARG A 30 -3.444 13.201 -2.784 1.00 0.00 H new ATOM 0 HA ARG A 30 -1.163 12.248 -4.067 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -3.739 11.695 -4.185 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -3.739 12.854 -5.499 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -1.860 10.462 -5.375 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -3.417 10.424 -6.177 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -2.372 11.144 -8.039 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -2.200 12.702 -7.256 1.00 0.00 H new ATOM 0 HE ARG A 30 0.028 11.730 -6.333 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -1.256 11.459 -9.607 1.00 0.00 H new ATOM 0 HH12 ARG A 30 0.225 10.750 -10.259 1.00 0.00 H new ATOM 0 HH21 ARG A 30 1.838 10.491 -7.145 1.00 0.00 H new ATOM 0 HH22 ARG A 30 1.950 10.210 -8.886 1.00 0.00 H new ATOM 470 N GLN A 31 -2.154 15.161 -5.209 1.00 0.00 N ATOM 471 CA GLN A 31 -1.774 16.449 -5.772 1.00 0.00 C ATOM 472 C GLN A 31 -0.298 16.828 -5.575 1.00 0.00 C ATOM 473 O GLN A 31 0.293 17.379 -6.499 1.00 0.00 O ATOM 474 CB GLN A 31 -2.710 17.536 -5.213 1.00 0.00 C ATOM 475 CG GLN A 31 -2.919 17.445 -3.691 1.00 0.00 C ATOM 476 CD GLN A 31 -3.689 18.634 -3.130 1.00 0.00 C ATOM 477 OE1 GLN A 31 -3.211 19.324 -2.237 1.00 0.00 O ATOM 478 NE2 GLN A 31 -4.900 18.870 -3.627 1.00 0.00 N ATOM 0 H GLN A 31 -3.107 15.178 -4.845 1.00 0.00 H new ATOM 0 HA GLN A 31 -1.887 16.365 -6.853 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -2.301 18.517 -5.457 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -3.678 17.461 -5.709 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -3.457 16.526 -3.457 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -1.949 17.381 -3.199 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -5.271 18.278 -4.370 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -5.458 19.643 -3.265 1.00 0.00 H new ATOM 487 N VAL A 32 0.272 16.569 -4.391 1.00 0.00 N ATOM 488 CA VAL A 32 1.676 16.817 -4.055 1.00 0.00 C ATOM 489 C VAL A 32 2.474 15.504 -4.080 1.00 0.00 C ATOM 490 O VAL A 32 3.673 15.504 -4.386 1.00 0.00 O ATOM 491 CB VAL A 32 1.753 17.519 -2.685 1.00 0.00 C ATOM 492 CG1 VAL A 32 3.195 17.810 -2.243 1.00 0.00 C ATOM 493 CG2 VAL A 32 0.981 18.846 -2.746 1.00 0.00 C ATOM 0 H VAL A 32 -0.253 16.167 -3.614 1.00 0.00 H new ATOM 0 HA VAL A 32 2.126 17.474 -4.799 1.00 0.00 H new ATOM 0 HB VAL A 32 1.313 16.839 -1.956 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.185 18.305 -1.272 1.00 0.00 H new ATOM 0 HG12 VAL A 32 3.748 16.874 -2.168 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.676 18.458 -2.975 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.035 19.343 -1.777 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.421 19.488 -3.509 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -0.062 18.649 -2.995 1.00 0.00 H new ATOM 503 N GLY A 33 1.812 14.382 -3.767 1.00 0.00 N ATOM 504 CA GLY A 33 2.319 13.017 -3.825 1.00 0.00 C ATOM 505 C GLY A 33 2.537 12.556 -5.268 1.00 0.00 C ATOM 506 O GLY A 33 1.964 11.560 -5.715 1.00 0.00 O ATOM 0 H GLY A 33 0.844 14.413 -3.446 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.259 12.954 -3.277 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.616 12.346 -3.331 1.00 0.00 H new ATOM 510 N ASN A 34 3.390 13.289 -5.976 1.00 0.00 N ATOM 511 CA ASN A 34 3.844 13.146 -7.348 1.00 0.00 C ATOM 512 C ASN A 34 5.151 13.938 -7.414 1.00 0.00 C ATOM 513 O ASN A 34 6.237 13.365 -7.475 1.00 0.00 O ATOM 514 CB ASN A 34 2.804 13.650 -8.382 1.00 0.00 C ATOM 515 CG ASN A 34 1.928 14.823 -7.933 1.00 0.00 C ATOM 516 OD1 ASN A 34 2.354 15.650 -7.137 1.00 0.00 O ATOM 517 ND2 ASN A 34 0.701 14.908 -8.436 1.00 0.00 N ATOM 0 H ASN A 34 3.833 14.099 -5.542 1.00 0.00 H new ATOM 0 HA ASN A 34 3.988 12.098 -7.610 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.334 13.944 -9.288 1.00 0.00 H new ATOM 0 HB3 ASN A 34 2.153 12.817 -8.649 1.00 0.00 H new ATOM 0 HD21 ASN A 34 0.089 15.676 -8.161 1.00 0.00 H new ATOM 0 HD22 ASN A 34 0.371 14.205 -9.098 1.00 0.00 H new ATOM 524 N MET A 35 5.046 15.263 -7.310 1.00 0.00 N ATOM 525 CA MET A 35 6.153 16.192 -7.367 1.00 0.00 C ATOM 526 C MET A 35 7.132 15.927 -6.224 1.00 0.00 C ATOM 527 O MET A 35 8.340 16.035 -6.421 1.00 0.00 O ATOM 528 CB MET A 35 5.585 17.618 -7.347 1.00 0.00 C ATOM 529 CG MET A 35 6.638 18.685 -7.683 1.00 0.00 C ATOM 530 SD MET A 35 6.223 19.781 -9.074 1.00 0.00 S ATOM 531 CE MET A 35 4.724 20.579 -8.440 1.00 0.00 C ATOM 0 H MET A 35 4.148 15.728 -7.179 1.00 0.00 H new ATOM 0 HA MET A 35 6.722 16.062 -8.288 1.00 0.00 H new ATOM 0 HB2 MET A 35 4.764 17.687 -8.061 1.00 0.00 H new ATOM 0 HB3 MET A 35 5.168 17.824 -6.361 1.00 0.00 H new ATOM 0 HG2 MET A 35 6.805 19.298 -6.797 1.00 0.00 H new ATOM 0 HG3 MET A 35 7.580 18.184 -7.906 1.00 0.00 H new ATOM 0 HE1 MET A 35 4.416 21.370 -9.124 1.00 0.00 H new ATOM 0 HE2 MET A 35 3.926 19.841 -8.357 1.00 0.00 H new ATOM 0 HE3 MET A 35 4.927 21.006 -7.458 1.00 0.00 H new ATOM 541 N THR A 36 6.639 15.548 -5.039 1.00 0.00 N ATOM 542 CA THR A 36 7.531 15.277 -3.916 1.00 0.00 C ATOM 543 C THR A 36 8.269 13.931 -4.031 1.00 0.00 C ATOM 544 O THR A 36 8.876 13.507 -3.048 1.00 0.00 O ATOM 545 CB THR A 36 6.802 15.447 -2.571 1.00 0.00 C ATOM 546 OG1 THR A 36 7.762 15.680 -1.548 1.00 0.00 O ATOM 547 CG2 THR A 36 5.909 14.238 -2.245 1.00 0.00 C ATOM 0 H THR A 36 5.646 15.425 -4.839 1.00 0.00 H new ATOM 0 HA THR A 36 8.319 16.029 -3.955 1.00 0.00 H new ATOM 0 HB THR A 36 6.135 16.307 -2.639 1.00 0.00 H new ATOM 0 HG1 THR A 36 8.439 14.972 -1.567 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.413 14.399 -1.288 1.00 0.00 H new ATOM 0 HG22 THR A 36 5.159 14.119 -3.027 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.521 13.338 -2.189 1.00 0.00 H new ATOM 555 N LYS A 37 8.291 13.278 -5.202 1.00 0.00 N ATOM 556 CA LYS A 37 9.000 12.017 -5.423 1.00 0.00 C ATOM 557 C LYS A 37 8.786 11.029 -4.259 1.00 0.00 C ATOM 558 O LYS A 37 9.750 10.609 -3.620 1.00 0.00 O ATOM 559 CB LYS A 37 10.489 12.269 -5.768 1.00 0.00 C ATOM 560 CG LYS A 37 11.367 12.935 -4.687 1.00 0.00 C ATOM 561 CD LYS A 37 11.425 14.472 -4.767 1.00 0.00 C ATOM 562 CE LYS A 37 11.896 15.087 -3.435 1.00 0.00 C ATOM 563 NZ LYS A 37 10.845 15.080 -2.388 1.00 0.00 N ATOM 0 H LYS A 37 7.808 13.620 -6.033 1.00 0.00 H new ATOM 0 HA LYS A 37 8.568 11.527 -6.296 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.941 11.312 -6.026 1.00 0.00 H new ATOM 0 HB3 LYS A 37 10.527 12.891 -6.662 1.00 0.00 H new ATOM 0 HG2 LYS A 37 10.991 12.649 -3.705 1.00 0.00 H new ATOM 0 HG3 LYS A 37 12.380 12.541 -4.767 1.00 0.00 H new ATOM 0 HD2 LYS A 37 12.102 14.771 -5.567 1.00 0.00 H new ATOM 0 HD3 LYS A 37 10.439 14.862 -5.021 1.00 0.00 H new ATOM 0 HE2 LYS A 37 12.764 14.536 -3.074 1.00 0.00 H new ATOM 0 HE3 LYS A 37 12.220 16.113 -3.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 11.286 14.956 -1.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.327 15.982 -2.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 10.184 14.297 -2.565 1.00 0.00 H new ATOM 577 N PRO A 38 7.524 10.701 -3.933 1.00 0.00 N ATOM 578 CA PRO A 38 7.185 10.040 -2.684 1.00 0.00 C ATOM 579 C PRO A 38 7.831 8.660 -2.579 1.00 0.00 C ATOM 580 O PRO A 38 8.122 8.009 -3.587 1.00 0.00 O ATOM 581 CB PRO A 38 5.655 9.979 -2.643 1.00 0.00 C ATOM 582 CG PRO A 38 5.268 10.030 -4.120 1.00 0.00 C ATOM 583 CD PRO A 38 6.326 10.961 -4.712 1.00 0.00 C ATOM 0 HA PRO A 38 7.570 10.589 -1.825 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.300 9.066 -2.164 1.00 0.00 H new ATOM 0 HB3 PRO A 38 5.233 10.816 -2.086 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.295 9.042 -4.580 1.00 0.00 H new ATOM 0 HG3 PRO A 38 4.260 10.420 -4.261 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.489 10.754 -5.770 1.00 0.00 H new ATOM 0 HD3 PRO A 38 6.022 12.005 -4.635 1.00 0.00 H new ATOM 591 N THR A 39 8.055 8.229 -1.339 1.00 0.00 N ATOM 592 CA THR A 39 8.715 6.983 -1.018 1.00 0.00 C ATOM 593 C THR A 39 7.690 6.010 -0.443 1.00 0.00 C ATOM 594 O THR A 39 6.563 6.374 -0.103 1.00 0.00 O ATOM 595 CB THR A 39 9.870 7.265 -0.044 1.00 0.00 C ATOM 596 OG1 THR A 39 9.488 8.231 0.914 1.00 0.00 O ATOM 597 CG2 THR A 39 11.081 7.822 -0.796 1.00 0.00 C ATOM 0 H THR A 39 7.772 8.757 -0.514 1.00 0.00 H new ATOM 0 HA THR A 39 9.141 6.522 -1.909 1.00 0.00 H new ATOM 0 HB THR A 39 10.121 6.323 0.443 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.235 8.397 1.527 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.889 8.016 -0.091 1.00 0.00 H new ATOM 0 HG22 THR A 39 11.413 7.097 -1.539 1.00 0.00 H new ATOM 0 HG23 THR A 39 10.804 8.751 -1.295 1.00 0.00 H new ATOM 605 N THR A 40 8.047 4.734 -0.370 1.00 0.00 N ATOM 606 CA THR A 40 7.193 3.702 0.178 1.00 0.00 C ATOM 607 C THR A 40 8.107 2.616 0.746 1.00 0.00 C ATOM 608 O THR A 40 8.741 1.890 -0.013 1.00 0.00 O ATOM 609 CB THR A 40 6.236 3.216 -0.929 1.00 0.00 C ATOM 610 OG1 THR A 40 5.304 4.232 -1.268 1.00 0.00 O ATOM 611 CG2 THR A 40 5.457 1.957 -0.550 1.00 0.00 C ATOM 0 H THR A 40 8.950 4.388 -0.695 1.00 0.00 H new ATOM 0 HA THR A 40 6.557 4.052 0.991 1.00 0.00 H new ATOM 0 HB THR A 40 6.874 2.974 -1.779 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.553 5.067 -0.820 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.804 1.671 -1.374 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.155 1.146 -0.343 1.00 0.00 H new ATOM 0 HG23 THR A 40 4.856 2.154 0.338 1.00 0.00 H new ATOM 619 N ILE A 41 8.224 2.508 2.071 1.00 0.00 N ATOM 620 CA ILE A 41 8.939 1.388 2.672 1.00 0.00 C ATOM 621 C ILE A 41 8.057 0.158 2.489 1.00 0.00 C ATOM 622 O ILE A 41 6.920 0.155 2.968 1.00 0.00 O ATOM 623 CB ILE A 41 9.259 1.664 4.156 1.00 0.00 C ATOM 624 CG1 ILE A 41 10.455 2.620 4.307 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.486 0.379 4.970 1.00 0.00 C ATOM 626 CD1 ILE A 41 11.826 1.946 4.191 1.00 0.00 C ATOM 0 H ILE A 41 7.837 3.175 2.739 1.00 0.00 H new ATOM 0 HA ILE A 41 9.904 1.231 2.191 1.00 0.00 H new ATOM 0 HB ILE A 41 8.374 2.149 4.568 1.00 0.00 H new ATOM 0 HG12 ILE A 41 10.381 3.397 3.546 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.388 3.115 5.276 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.707 0.638 6.005 1.00 0.00 H new ATOM 0 HG22 ILE A 41 8.588 -0.238 4.934 1.00 0.00 H new ATOM 0 HG23 ILE A 41 10.324 -0.176 4.548 1.00 0.00 H new ATOM 0 HD11 ILE A 41 12.610 2.694 4.310 1.00 0.00 H new ATOM 0 HD12 ILE A 41 11.926 1.189 4.968 1.00 0.00 H new ATOM 0 HD13 ILE A 41 11.918 1.476 3.212 1.00 0.00 H new ATOM 638 N ILE A 42 8.578 -0.869 1.808 1.00 0.00 N ATOM 639 CA ILE A 42 7.997 -2.201 1.829 1.00 0.00 C ATOM 640 C ILE A 42 8.968 -3.100 2.586 1.00 0.00 C ATOM 641 O ILE A 42 10.135 -3.197 2.206 1.00 0.00 O ATOM 642 CB ILE A 42 7.738 -2.733 0.413 1.00 0.00 C ATOM 643 CG1 ILE A 42 6.870 -1.780 -0.422 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.087 -4.123 0.489 1.00 0.00 C ATOM 645 CD1 ILE A 42 5.535 -1.395 0.194 1.00 0.00 C ATOM 0 H ILE A 42 9.414 -0.792 1.229 1.00 0.00 H new ATOM 0 HA ILE A 42 7.025 -2.179 2.322 1.00 0.00 H new ATOM 0 HB ILE A 42 8.702 -2.807 -0.091 1.00 0.00 H new ATOM 0 HG12 ILE A 42 7.439 -0.869 -0.609 1.00 0.00 H new ATOM 0 HG13 ILE A 42 6.682 -2.243 -1.391 1.00 0.00 H new ATOM 0 HG21 ILE A 42 6.906 -4.495 -0.519 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.752 -4.808 1.015 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.141 -4.053 1.026 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.005 -0.721 -0.479 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.936 -2.292 0.355 1.00 0.00 H new ATOM 0 HD13 ILE A 42 5.705 -0.896 1.148 1.00 0.00 H new ATOM 657 N GLU A 43 8.490 -3.744 3.650 1.00 0.00 N ATOM 658 CA GLU A 43 9.275 -4.662 4.462 1.00 0.00 C ATOM 659 C GLU A 43 8.545 -6.005 4.490 1.00 0.00 C ATOM 660 O GLU A 43 7.316 -6.035 4.423 1.00 0.00 O ATOM 661 CB GLU A 43 9.469 -4.038 5.848 1.00 0.00 C ATOM 662 CG GLU A 43 10.385 -4.851 6.768 1.00 0.00 C ATOM 663 CD GLU A 43 10.584 -4.118 8.089 1.00 0.00 C ATOM 664 OE1 GLU A 43 9.552 -3.734 8.682 1.00 0.00 O ATOM 665 OE2 GLU A 43 11.761 -3.934 8.464 1.00 0.00 O ATOM 0 H GLU A 43 7.529 -3.638 3.974 1.00 0.00 H new ATOM 0 HA GLU A 43 10.270 -4.840 4.054 1.00 0.00 H new ATOM 0 HB2 GLU A 43 9.883 -3.037 5.731 1.00 0.00 H new ATOM 0 HB3 GLU A 43 8.496 -3.927 6.326 1.00 0.00 H new ATOM 0 HG2 GLU A 43 9.951 -5.834 6.950 1.00 0.00 H new ATOM 0 HG3 GLU A 43 11.348 -5.013 6.284 1.00 0.00 H new ATOM 672 N VAL A 44 9.298 -7.110 4.522 1.00 0.00 N ATOM 673 CA VAL A 44 8.759 -8.461 4.450 1.00 0.00 C ATOM 674 C VAL A 44 8.822 -9.088 5.842 1.00 0.00 C ATOM 675 O VAL A 44 9.893 -9.395 6.363 1.00 0.00 O ATOM 676 CB VAL A 44 9.447 -9.288 3.343 1.00 0.00 C ATOM 677 CG1 VAL A 44 9.427 -8.509 2.019 1.00 0.00 C ATOM 678 CG2 VAL A 44 10.873 -9.737 3.683 1.00 0.00 C ATOM 0 H VAL A 44 10.315 -7.084 4.600 1.00 0.00 H new ATOM 0 HA VAL A 44 7.711 -8.438 4.152 1.00 0.00 H new ATOM 0 HB VAL A 44 8.869 -10.207 3.248 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.914 -9.099 1.242 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.395 -8.310 1.730 1.00 0.00 H new ATOM 0 HG13 VAL A 44 9.957 -7.565 2.144 1.00 0.00 H new ATOM 0 HG21 VAL A 44 11.281 -10.312 2.852 1.00 0.00 H new ATOM 0 HG22 VAL A 44 11.498 -8.861 3.861 1.00 0.00 H new ATOM 0 HG23 VAL A 44 10.855 -10.358 4.579 1.00 0.00 H new ATOM 688 N ASN A 45 7.664 -9.287 6.463 1.00 0.00 N ATOM 689 CA ASN A 45 7.538 -9.931 7.759 1.00 0.00 C ATOM 690 C ASN A 45 7.577 -11.447 7.548 1.00 0.00 C ATOM 691 O ASN A 45 6.655 -12.167 7.921 1.00 0.00 O ATOM 692 CB ASN A 45 6.233 -9.474 8.420 1.00 0.00 C ATOM 693 CG ASN A 45 6.160 -7.963 8.597 1.00 0.00 C ATOM 694 OD1 ASN A 45 5.496 -7.276 7.825 1.00 0.00 O ATOM 695 ND2 ASN A 45 6.837 -7.431 9.610 1.00 0.00 N ATOM 0 H ASN A 45 6.769 -8.997 6.068 1.00 0.00 H new ATOM 0 HA ASN A 45 8.358 -9.655 8.423 1.00 0.00 H new ATOM 0 HB2 ASN A 45 5.389 -9.806 7.815 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.136 -9.955 9.394 1.00 0.00 H new ATOM 0 HD21 ASN A 45 6.815 -6.423 9.765 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.379 -8.031 10.232 1.00 0.00 H new ATOM 702 N GLY A 46 8.653 -11.936 6.927 1.00 0.00 N ATOM 703 CA GLY A 46 8.829 -13.342 6.592 1.00 0.00 C ATOM 704 C GLY A 46 7.730 -13.860 5.659 1.00 0.00 C ATOM 705 O GLY A 46 7.915 -13.893 4.444 1.00 0.00 O ATOM 0 H GLY A 46 9.438 -11.351 6.640 1.00 0.00 H new ATOM 0 HA2 GLY A 46 9.800 -13.481 6.118 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.834 -13.933 7.508 1.00 0.00 H new ATOM 709 N ASP A 47 6.602 -14.287 6.234 1.00 0.00 N ATOM 710 CA ASP A 47 5.442 -14.802 5.515 1.00 0.00 C ATOM 711 C ASP A 47 4.506 -13.661 5.109 1.00 0.00 C ATOM 712 O ASP A 47 3.775 -13.752 4.121 1.00 0.00 O ATOM 713 CB ASP A 47 4.704 -15.825 6.395 1.00 0.00 C ATOM 714 CG ASP A 47 3.716 -15.175 7.359 1.00 0.00 C ATOM 715 OD1 ASP A 47 4.116 -14.245 8.083 1.00 0.00 O ATOM 716 OD2 ASP A 47 2.538 -15.607 7.312 1.00 0.00 O ATOM 0 H ASP A 47 6.471 -14.282 7.246 1.00 0.00 H new ATOM 0 HA ASP A 47 5.779 -15.296 4.604 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.171 -16.529 5.756 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.434 -16.401 6.964 1.00 0.00 H new ATOM 721 N THR A 48 4.506 -12.602 5.913 1.00 0.00 N ATOM 722 CA THR A 48 3.682 -11.425 5.767 1.00 0.00 C ATOM 723 C THR A 48 4.551 -10.311 5.185 1.00 0.00 C ATOM 724 O THR A 48 5.759 -10.470 5.011 1.00 0.00 O ATOM 725 CB THR A 48 3.066 -11.081 7.140 1.00 0.00 C ATOM 726 OG1 THR A 48 3.856 -11.562 8.209 1.00 0.00 O ATOM 727 CG2 THR A 48 1.707 -11.743 7.334 1.00 0.00 C ATOM 0 H THR A 48 5.118 -12.547 6.727 1.00 0.00 H new ATOM 0 HA THR A 48 2.849 -11.579 5.081 1.00 0.00 H new ATOM 0 HB THR A 48 2.994 -9.993 7.146 1.00 0.00 H new ATOM 0 HG1 THR A 48 3.706 -12.524 8.319 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.308 -11.475 8.313 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.022 -11.402 6.558 1.00 0.00 H new ATOM 0 HG23 THR A 48 1.817 -12.826 7.271 1.00 0.00 H new ATOM 735 N VAL A 49 3.945 -9.178 4.850 1.00 0.00 N ATOM 736 CA VAL A 49 4.620 -8.053 4.236 1.00 0.00 C ATOM 737 C VAL A 49 3.829 -6.802 4.603 1.00 0.00 C ATOM 738 O VAL A 49 2.620 -6.891 4.822 1.00 0.00 O ATOM 739 CB VAL A 49 4.760 -8.311 2.721 1.00 0.00 C ATOM 740 CG1 VAL A 49 3.439 -8.738 2.076 1.00 0.00 C ATOM 741 CG2 VAL A 49 5.319 -7.107 1.951 1.00 0.00 C ATOM 0 H VAL A 49 2.949 -9.018 5.003 1.00 0.00 H new ATOM 0 HA VAL A 49 5.639 -7.912 4.597 1.00 0.00 H new ATOM 0 HB VAL A 49 5.477 -9.129 2.650 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.592 -8.907 1.010 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.087 -9.658 2.542 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.696 -7.953 2.216 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.392 -7.355 0.892 1.00 0.00 H new ATOM 0 HG22 VAL A 49 4.654 -6.253 2.079 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.308 -6.857 2.335 1.00 0.00 H new ATOM 751 N ILE A 50 4.513 -5.662 4.727 1.00 0.00 N ATOM 752 CA ILE A 50 3.928 -4.420 5.203 1.00 0.00 C ATOM 753 C ILE A 50 4.262 -3.280 4.245 1.00 0.00 C ATOM 754 O ILE A 50 5.421 -3.110 3.866 1.00 0.00 O ATOM 755 CB ILE A 50 4.334 -4.178 6.672 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.527 -3.034 7.301 1.00 0.00 C ATOM 757 CG2 ILE A 50 5.839 -3.944 6.840 1.00 0.00 C ATOM 758 CD1 ILE A 50 3.686 -2.977 8.823 1.00 0.00 C ATOM 0 H ILE A 50 5.503 -5.582 4.494 1.00 0.00 H new ATOM 0 HA ILE A 50 2.840 -4.480 5.207 1.00 0.00 H new ATOM 0 HB ILE A 50 4.095 -5.096 7.208 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.848 -2.086 6.869 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.473 -3.157 7.053 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.066 -3.779 7.893 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.385 -4.817 6.483 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.138 -3.069 6.263 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.096 -2.151 9.220 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.340 -3.913 9.260 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.736 -2.826 9.074 1.00 0.00 H new ATOM 770 N ILE A 51 3.227 -2.536 3.834 1.00 0.00 N ATOM 771 CA ILE A 51 3.327 -1.315 3.047 1.00 0.00 C ATOM 772 C ILE A 51 3.368 -0.151 4.027 1.00 0.00 C ATOM 773 O ILE A 51 2.555 -0.140 4.951 1.00 0.00 O ATOM 774 CB ILE A 51 2.100 -1.189 2.110 1.00 0.00 C ATOM 775 CG1 ILE A 51 2.245 -2.076 0.863 1.00 0.00 C ATOM 776 CG2 ILE A 51 1.851 0.256 1.649 1.00 0.00 C ATOM 777 CD1 ILE A 51 0.887 -2.506 0.294 1.00 0.00 C ATOM 0 H ILE A 51 2.262 -2.784 4.053 1.00 0.00 H new ATOM 0 HA ILE A 51 4.222 -1.323 2.425 1.00 0.00 H new ATOM 0 HB ILE A 51 1.249 -1.520 2.705 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.802 -1.535 0.098 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.828 -2.962 1.116 1.00 0.00 H new ATOM 0 HG21 ILE A 51 0.979 0.284 0.995 1.00 0.00 H new ATOM 0 HG22 ILE A 51 1.673 0.890 2.518 1.00 0.00 H new ATOM 0 HG23 ILE A 51 2.723 0.620 1.107 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.042 -3.131 -0.586 1.00 0.00 H new ATOM 0 HD12 ILE A 51 0.339 -3.071 1.048 1.00 0.00 H new ATOM 0 HD13 ILE A 51 0.313 -1.622 0.015 1.00 0.00 H new ATOM 789 N LYS A 52 4.261 0.825 3.808 1.00 0.00 N ATOM 790 CA LYS A 52 4.238 2.121 4.480 1.00 0.00 C ATOM 791 C LYS A 52 4.273 3.238 3.431 1.00 0.00 C ATOM 792 O LYS A 52 5.214 3.291 2.644 1.00 0.00 O ATOM 793 CB LYS A 52 5.419 2.240 5.448 1.00 0.00 C ATOM 794 CG LYS A 52 5.629 0.943 6.241 1.00 0.00 C ATOM 795 CD LYS A 52 6.430 1.191 7.523 1.00 0.00 C ATOM 796 CE LYS A 52 6.396 -0.061 8.417 1.00 0.00 C ATOM 797 NZ LYS A 52 6.226 0.278 9.844 1.00 0.00 N ATOM 0 H LYS A 52 5.031 0.729 3.146 1.00 0.00 H new ATOM 0 HA LYS A 52 3.320 2.213 5.061 1.00 0.00 H new ATOM 0 HB2 LYS A 52 6.325 2.478 4.891 1.00 0.00 H new ATOM 0 HB3 LYS A 52 5.243 3.065 6.138 1.00 0.00 H new ATOM 0 HG2 LYS A 52 4.661 0.509 6.494 1.00 0.00 H new ATOM 0 HG3 LYS A 52 6.152 0.216 5.619 1.00 0.00 H new ATOM 0 HD2 LYS A 52 7.461 1.442 7.274 1.00 0.00 H new ATOM 0 HD3 LYS A 52 6.015 2.043 8.061 1.00 0.00 H new ATOM 0 HE2 LYS A 52 5.580 -0.710 8.100 1.00 0.00 H new ATOM 0 HE3 LYS A 52 7.320 -0.624 8.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.114 0.093 10.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 5.978 1.284 9.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 5.466 -0.304 10.251 1.00 0.00 H new ATOM 811 N THR A 53 3.257 4.106 3.383 1.00 0.00 N ATOM 812 CA THR A 53 3.022 5.035 2.278 1.00 0.00 C ATOM 813 C THR A 53 3.652 6.409 2.555 1.00 0.00 C ATOM 814 O THR A 53 2.957 7.305 3.028 1.00 0.00 O ATOM 815 CB THR A 53 1.502 5.173 2.071 1.00 0.00 C ATOM 816 OG1 THR A 53 0.882 5.708 3.223 1.00 0.00 O ATOM 817 CG2 THR A 53 0.832 3.835 1.780 1.00 0.00 C ATOM 0 H THR A 53 2.563 4.182 4.127 1.00 0.00 H new ATOM 0 HA THR A 53 3.491 4.642 1.376 1.00 0.00 H new ATOM 0 HB THR A 53 1.379 5.837 1.215 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.323 6.547 3.472 1.00 0.00 H new ATOM 0 HG21 THR A 53 -0.239 3.987 1.642 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.257 3.405 0.873 1.00 0.00 H new ATOM 0 HG23 THR A 53 0.997 3.156 2.616 1.00 0.00 H new ATOM 825 N GLN A 54 4.940 6.607 2.277 1.00 0.00 N ATOM 826 CA GLN A 54 5.647 7.796 2.736 1.00 0.00 C ATOM 827 C GLN A 54 5.535 8.970 1.754 1.00 0.00 C ATOM 828 O GLN A 54 6.340 9.094 0.828 1.00 0.00 O ATOM 829 CB GLN A 54 7.105 7.437 3.029 1.00 0.00 C ATOM 830 CG GLN A 54 7.225 6.333 4.085 1.00 0.00 C ATOM 831 CD GLN A 54 8.687 6.013 4.367 1.00 0.00 C ATOM 832 OE1 GLN A 54 9.464 5.773 3.447 1.00 0.00 O ATOM 833 NE2 GLN A 54 9.081 6.005 5.637 1.00 0.00 N ATOM 0 H GLN A 54 5.512 5.958 1.736 1.00 0.00 H new ATOM 0 HA GLN A 54 5.172 8.140 3.655 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.590 7.112 2.109 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.635 8.326 3.372 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.733 6.648 5.005 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.711 5.436 3.740 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.412 6.208 6.380 1.00 0.00 H new ATOM 0 HE22 GLN A 54 10.052 5.796 5.868 1.00 0.00 H new ATOM 842 N SER A 55 4.576 9.876 1.986 1.00 0.00 N ATOM 843 CA SER A 55 4.574 11.188 1.344 1.00 0.00 C ATOM 844 C SER A 55 4.927 12.265 2.371 1.00 0.00 C ATOM 845 O SER A 55 4.665 12.105 3.566 1.00 0.00 O ATOM 846 CB SER A 55 3.220 11.459 0.675 1.00 0.00 C ATOM 847 OG SER A 55 2.183 11.602 1.622 1.00 0.00 O ATOM 0 H SER A 55 3.790 9.719 2.617 1.00 0.00 H new ATOM 0 HA SER A 55 5.330 11.208 0.559 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.288 12.364 0.072 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.981 10.641 -0.004 1.00 0.00 H new ATOM 0 HG SER A 55 2.138 10.799 2.181 1.00 0.00 H new ATOM 853 N THR A 56 5.477 13.393 1.910 1.00 0.00 N ATOM 854 CA THR A 56 5.680 14.575 2.734 1.00 0.00 C ATOM 855 C THR A 56 4.325 15.268 2.908 1.00 0.00 C ATOM 856 O THR A 56 4.135 16.378 2.411 1.00 0.00 O ATOM 857 CB THR A 56 6.699 15.491 2.036 1.00 0.00 C ATOM 858 OG1 THR A 56 6.225 15.830 0.748 1.00 0.00 O ATOM 859 CG2 THR A 56 8.066 14.820 1.890 1.00 0.00 C ATOM 0 H THR A 56 5.794 13.506 0.947 1.00 0.00 H new ATOM 0 HA THR A 56 6.072 14.319 3.718 1.00 0.00 H new ATOM 0 HB THR A 56 6.816 16.381 2.655 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.941 15.701 0.091 1.00 0.00 H new ATOM 0 HG21 THR A 56 8.755 15.502 1.392 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.455 14.568 2.877 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.964 13.911 1.297 1.00 0.00 H new ATOM 867 N PHE A 57 3.363 14.572 3.520 1.00 0.00 N ATOM 868 CA PHE A 57 1.971 14.999 3.584 1.00 0.00 C ATOM 869 C PHE A 57 1.151 14.000 4.399 1.00 0.00 C ATOM 870 O PHE A 57 0.371 14.385 5.267 1.00 0.00 O ATOM 871 CB PHE A 57 1.372 15.111 2.170 1.00 0.00 C ATOM 872 CG PHE A 57 0.517 16.341 1.943 1.00 0.00 C ATOM 873 CD1 PHE A 57 -0.771 16.424 2.503 1.00 0.00 C ATOM 874 CD2 PHE A 57 1.022 17.418 1.193 1.00 0.00 C ATOM 875 CE1 PHE A 57 -1.575 17.549 2.252 1.00 0.00 C ATOM 876 CE2 PHE A 57 0.216 18.541 0.940 1.00 0.00 C ATOM 877 CZ PHE A 57 -1.090 18.597 1.451 1.00 0.00 C ATOM 0 H PHE A 57 3.536 13.684 3.990 1.00 0.00 H new ATOM 0 HA PHE A 57 1.938 15.977 4.064 1.00 0.00 H new ATOM 0 HB2 PHE A 57 2.185 15.111 1.444 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.769 14.224 1.974 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -1.142 15.623 3.126 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.031 17.382 0.811 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -2.567 17.608 2.675 1.00 0.00 H new ATOM 0 HE2 PHE A 57 0.602 19.361 0.352 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.722 19.444 1.229 1.00 0.00 H new ATOM 887 N LYS A 58 1.281 12.710 4.070 1.00 0.00 N ATOM 888 CA LYS A 58 0.485 11.641 4.651 1.00 0.00 C ATOM 889 C LYS A 58 1.355 10.391 4.747 1.00 0.00 C ATOM 890 O LYS A 58 2.080 10.069 3.805 1.00 0.00 O ATOM 891 CB LYS A 58 -0.745 11.406 3.765 1.00 0.00 C ATOM 892 CG LYS A 58 -1.804 10.514 4.429 1.00 0.00 C ATOM 893 CD LYS A 58 -3.065 10.373 3.559 1.00 0.00 C ATOM 894 CE LYS A 58 -4.153 11.420 3.855 1.00 0.00 C ATOM 895 NZ LYS A 58 -3.687 12.812 3.685 1.00 0.00 N ATOM 0 H LYS A 58 1.956 12.381 3.380 1.00 0.00 H new ATOM 0 HA LYS A 58 0.139 11.900 5.652 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.194 12.367 3.514 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -0.428 10.948 2.828 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.381 9.527 4.617 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.076 10.934 5.397 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -2.780 10.448 2.510 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.485 9.378 3.705 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.004 11.246 3.196 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.508 11.285 4.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.506 13.452 3.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -3.066 13.070 4.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.160 12.895 2.792 1.00 0.00 H new ATOM 909 N ASN A 59 1.293 9.708 5.890 1.00 0.00 N ATOM 910 CA ASN A 59 2.022 8.477 6.149 1.00 0.00 C ATOM 911 C ASN A 59 1.026 7.516 6.786 1.00 0.00 C ATOM 912 O ASN A 59 0.399 7.875 7.779 1.00 0.00 O ATOM 913 CB ASN A 59 3.238 8.742 7.053 1.00 0.00 C ATOM 914 CG ASN A 59 4.364 9.454 6.302 1.00 0.00 C ATOM 915 OD1 ASN A 59 5.389 8.853 5.999 1.00 0.00 O ATOM 916 ND2 ASN A 59 4.176 10.732 5.980 1.00 0.00 N ATOM 0 H ASN A 59 0.719 10.007 6.678 1.00 0.00 H new ATOM 0 HA ASN A 59 2.426 8.047 5.232 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.931 9.348 7.906 1.00 0.00 H new ATOM 0 HB3 ASN A 59 3.608 7.797 7.450 1.00 0.00 H new ATOM 0 HD21 ASN A 59 4.896 11.240 5.466 1.00 0.00 H new ATOM 0 HD22 ASN A 59 3.312 11.203 6.247 1.00 0.00 H new ATOM 923 N THR A 60 0.836 6.336 6.190 1.00 0.00 N ATOM 924 CA THR A 60 0.030 5.255 6.741 1.00 0.00 C ATOM 925 C THR A 60 0.847 3.977 6.570 1.00 0.00 C ATOM 926 O THR A 60 1.823 3.989 5.814 1.00 0.00 O ATOM 927 CB THR A 60 -1.324 5.145 6.011 1.00 0.00 C ATOM 928 OG1 THR A 60 -1.166 4.648 4.704 1.00 0.00 O ATOM 929 CG2 THR A 60 -2.042 6.485 5.872 1.00 0.00 C ATOM 0 H THR A 60 1.251 6.105 5.288 1.00 0.00 H new ATOM 0 HA THR A 60 -0.199 5.436 7.791 1.00 0.00 H new ATOM 0 HB THR A 60 -1.914 4.469 6.631 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.346 5.014 4.312 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.988 6.339 5.350 1.00 0.00 H new ATOM 0 HG22 THR A 60 -2.234 6.899 6.862 1.00 0.00 H new ATOM 0 HG23 THR A 60 -1.417 7.175 5.305 1.00 0.00 H new ATOM 937 N GLU A 61 0.450 2.884 7.227 1.00 0.00 N ATOM 938 CA GLU A 61 0.996 1.572 6.941 1.00 0.00 C ATOM 939 C GLU A 61 -0.067 0.495 7.138 1.00 0.00 C ATOM 940 O GLU A 61 -0.969 0.674 7.955 1.00 0.00 O ATOM 941 CB GLU A 61 2.275 1.314 7.753 1.00 0.00 C ATOM 942 CG GLU A 61 2.138 1.467 9.272 1.00 0.00 C ATOM 943 CD GLU A 61 3.474 1.167 9.934 1.00 0.00 C ATOM 944 OE1 GLU A 61 4.346 2.064 9.959 1.00 0.00 O ATOM 945 OE2 GLU A 61 3.717 -0.004 10.302 1.00 0.00 O ATOM 0 H GLU A 61 -0.254 2.892 7.965 1.00 0.00 H new ATOM 0 HA GLU A 61 1.292 1.533 5.893 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.623 0.304 7.538 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.049 1.998 7.405 1.00 0.00 H new ATOM 0 HG2 GLU A 61 1.817 2.479 9.519 1.00 0.00 H new ATOM 0 HG3 GLU A 61 1.373 0.789 9.649 1.00 0.00 H new ATOM 952 N ILE A 62 0.029 -0.596 6.370 1.00 0.00 N ATOM 953 CA ILE A 62 -0.865 -1.748 6.460 1.00 0.00 C ATOM 954 C ILE A 62 -0.077 -3.019 6.142 1.00 0.00 C ATOM 955 O ILE A 62 0.789 -3.009 5.262 1.00 0.00 O ATOM 956 CB ILE A 62 -2.102 -1.603 5.546 1.00 0.00 C ATOM 957 CG1 ILE A 62 -1.726 -1.348 4.074 1.00 0.00 C ATOM 958 CG2 ILE A 62 -3.053 -0.517 6.067 1.00 0.00 C ATOM 959 CD1 ILE A 62 -2.946 -1.361 3.147 1.00 0.00 C ATOM 0 H ILE A 62 0.748 -0.702 5.654 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.251 -1.808 7.478 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.624 -2.560 5.576 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -1.222 -0.385 3.993 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.017 -2.108 3.747 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -3.914 -0.438 5.403 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -3.391 -0.780 7.070 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.531 0.439 6.099 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.626 -1.176 2.122 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.436 -2.333 3.205 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.645 -0.583 3.454 1.00 0.00 H new ATOM 971 N SER A 63 -0.359 -4.102 6.876 1.00 0.00 N ATOM 972 CA SER A 63 0.284 -5.399 6.729 1.00 0.00 C ATOM 973 C SER A 63 -0.654 -6.380 6.030 1.00 0.00 C ATOM 974 O SER A 63 -1.872 -6.213 6.069 1.00 0.00 O ATOM 975 CB SER A 63 0.740 -5.910 8.100 1.00 0.00 C ATOM 976 OG SER A 63 -0.251 -5.672 9.083 1.00 0.00 O ATOM 0 H SER A 63 -1.066 -4.092 7.611 1.00 0.00 H new ATOM 0 HA SER A 63 1.170 -5.300 6.101 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.952 -6.978 8.043 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.668 -5.416 8.387 1.00 0.00 H new ATOM 0 HG SER A 63 0.060 -6.008 9.949 1.00 0.00 H new ATOM 982 N PHE A 64 -0.089 -7.385 5.355 1.00 0.00 N ATOM 983 CA PHE A 64 -0.849 -8.376 4.615 1.00 0.00 C ATOM 984 C PHE A 64 -0.011 -9.635 4.408 1.00 0.00 C ATOM 985 O PHE A 64 1.213 -9.600 4.527 1.00 0.00 O ATOM 986 CB PHE A 64 -1.336 -7.780 3.285 1.00 0.00 C ATOM 987 CG PHE A 64 -0.274 -7.303 2.312 1.00 0.00 C ATOM 988 CD1 PHE A 64 0.360 -6.066 2.511 1.00 0.00 C ATOM 989 CD2 PHE A 64 0.042 -8.069 1.176 1.00 0.00 C ATOM 990 CE1 PHE A 64 1.322 -5.615 1.596 1.00 0.00 C ATOM 991 CE2 PHE A 64 0.943 -7.574 0.215 1.00 0.00 C ATOM 992 CZ PHE A 64 1.578 -6.337 0.420 1.00 0.00 C ATOM 0 H PHE A 64 0.920 -7.528 5.311 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.731 -8.663 5.188 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.945 -8.531 2.781 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.991 -6.938 3.511 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.106 -5.462 3.369 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.409 -9.041 1.040 1.00 0.00 H new ATOM 0 HE1 PHE A 64 1.870 -4.706 1.797 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.146 -8.144 -0.679 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.258 -5.945 -0.322 1.00 0.00 H new ATOM 1002 N LYS A 65 -0.679 -10.752 4.112 1.00 0.00 N ATOM 1003 CA LYS A 65 -0.050 -11.996 3.688 1.00 0.00 C ATOM 1004 C LYS A 65 0.180 -11.908 2.186 1.00 0.00 C ATOM 1005 O LYS A 65 -0.763 -11.608 1.457 1.00 0.00 O ATOM 1006 CB LYS A 65 -1.002 -13.167 3.970 1.00 0.00 C ATOM 1007 CG LYS A 65 -1.172 -13.458 5.467 1.00 0.00 C ATOM 1008 CD LYS A 65 -0.102 -14.414 6.010 1.00 0.00 C ATOM 1009 CE LYS A 65 -0.307 -15.859 5.529 1.00 0.00 C ATOM 1010 NZ LYS A 65 0.516 -16.797 6.315 1.00 0.00 N ATOM 0 H LYS A 65 -1.696 -10.814 4.163 1.00 0.00 H new ATOM 0 HA LYS A 65 0.888 -12.151 4.221 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.977 -12.947 3.536 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.626 -14.061 3.473 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.131 -12.521 6.022 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.159 -13.888 5.640 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.883 -14.067 5.698 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.118 -14.391 7.100 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.359 -16.130 5.617 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.045 -15.936 4.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 1.022 -17.438 5.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 1.204 -16.263 6.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.097 -17.353 6.945 1.00 0.00 H new ATOM 1024 N LEU A 66 1.376 -12.234 1.693 1.00 0.00 N ATOM 1025 CA LEU A 66 1.577 -12.426 0.260 1.00 0.00 C ATOM 1026 C LEU A 66 1.020 -13.791 -0.169 1.00 0.00 C ATOM 1027 O LEU A 66 1.733 -14.605 -0.750 1.00 0.00 O ATOM 1028 CB LEU A 66 3.054 -12.221 -0.113 1.00 0.00 C ATOM 1029 CG LEU A 66 4.048 -13.069 0.706 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.992 -13.853 -0.203 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.913 -12.187 1.609 1.00 0.00 C ATOM 0 H LEU A 66 2.212 -12.369 2.261 1.00 0.00 H new ATOM 0 HA LEU A 66 1.020 -11.671 -0.296 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.184 -12.454 -1.170 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.304 -11.168 0.015 1.00 0.00 H new ATOM 0 HG LEU A 66 3.447 -13.753 1.305 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.679 -14.440 0.406 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.412 -14.520 -0.841 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.559 -13.159 -0.824 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.604 -12.812 2.174 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.478 -11.483 0.997 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.274 -11.636 2.300 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.258 -14.054 0.128 1.00 0.00 N ATOM 1044 CA GLY A 67 -0.864 -15.360 -0.090 1.00 0.00 C ATOM 1045 C GLY A 67 -2.035 -15.613 0.858 1.00 0.00 C ATOM 1046 O GLY A 67 -1.998 -16.596 1.595 1.00 0.00 O ATOM 0 H GLY A 67 -0.895 -13.364 0.526 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.210 -15.431 -1.121 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.112 -16.136 0.048 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.061 -14.750 0.847 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.333 -14.995 1.532 1.00 0.00 C ATOM 1052 C VAL A 68 -5.360 -13.906 1.193 1.00 0.00 C ATOM 1053 O VAL A 68 -4.999 -12.819 0.731 1.00 0.00 O ATOM 1054 CB VAL A 68 -4.156 -15.195 3.064 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -4.629 -14.023 3.931 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -4.898 -16.461 3.513 1.00 0.00 C ATOM 0 H VAL A 68 -3.028 -13.856 0.358 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.728 -15.939 1.157 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.080 -15.276 3.215 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.464 -14.258 4.982 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.069 -13.126 3.667 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.692 -13.850 3.761 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.770 -16.596 4.587 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -5.959 -16.362 3.283 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -4.492 -17.326 2.988 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.632 -14.213 1.458 1.00 0.00 N ATOM 1067 CA GLU A 69 -7.788 -13.337 1.430 1.00 0.00 C ATOM 1068 C GLU A 69 -8.138 -12.912 2.858 1.00 0.00 C ATOM 1069 O GLU A 69 -8.308 -13.766 3.727 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.972 -14.088 0.798 1.00 0.00 C ATOM 1071 CG GLU A 69 -8.607 -14.823 -0.505 1.00 0.00 C ATOM 1072 CD GLU A 69 -8.045 -16.234 -0.309 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -7.604 -16.546 0.822 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -8.059 -16.975 -1.313 1.00 0.00 O ATOM 0 H GLU A 69 -6.893 -15.164 1.719 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.568 -12.448 0.839 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.360 -14.810 1.517 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.774 -13.379 0.594 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.496 -14.885 -1.132 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.874 -14.227 -1.049 1.00 0.00 H new ATOM 1081 N PHE A 70 -8.243 -11.608 3.128 1.00 0.00 N ATOM 1082 CA PHE A 70 -8.509 -11.106 4.471 1.00 0.00 C ATOM 1083 C PHE A 70 -9.143 -9.714 4.410 1.00 0.00 C ATOM 1084 O PHE A 70 -9.034 -9.017 3.399 1.00 0.00 O ATOM 1085 CB PHE A 70 -7.223 -11.121 5.313 1.00 0.00 C ATOM 1086 CG PHE A 70 -6.147 -10.167 4.831 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -5.460 -10.421 3.632 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -5.938 -8.950 5.506 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -4.635 -9.435 3.071 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -5.155 -7.946 4.921 1.00 0.00 C ATOM 1091 CZ PHE A 70 -4.546 -8.173 3.677 1.00 0.00 C ATOM 0 H PHE A 70 -8.146 -10.877 2.423 1.00 0.00 H new ATOM 0 HA PHE A 70 -9.226 -11.765 4.961 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.475 -10.874 6.344 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.818 -12.133 5.318 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -5.567 -11.377 3.141 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.382 -8.789 6.477 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -4.070 -9.647 2.175 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -5.021 -7.001 5.426 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.008 -7.375 3.186 1.00 0.00 H new ATOM 1101 N ASP A 71 -9.850 -9.341 5.483 1.00 0.00 N ATOM 1102 CA ASP A 71 -10.510 -8.046 5.602 1.00 0.00 C ATOM 1103 C ASP A 71 -9.459 -6.947 5.768 1.00 0.00 C ATOM 1104 O ASP A 71 -8.366 -7.211 6.266 1.00 0.00 O ATOM 1105 CB ASP A 71 -11.510 -8.067 6.768 1.00 0.00 C ATOM 1106 CG ASP A 71 -12.642 -7.069 6.561 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -12.361 -5.979 6.025 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -13.793 -7.451 6.866 1.00 0.00 O ATOM 0 H ASP A 71 -9.978 -9.940 6.299 1.00 0.00 H new ATOM 0 HA ASP A 71 -11.075 -7.834 4.694 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -11.924 -9.070 6.873 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -10.989 -7.838 7.698 1.00 0.00 H new ATOM 1113 N GLU A 72 -9.764 -5.738 5.310 1.00 0.00 N ATOM 1114 CA GLU A 72 -8.812 -4.662 5.088 1.00 0.00 C ATOM 1115 C GLU A 72 -9.617 -3.359 4.963 1.00 0.00 C ATOM 1116 O GLU A 72 -10.841 -3.362 5.108 1.00 0.00 O ATOM 1117 CB GLU A 72 -7.927 -5.044 3.884 1.00 0.00 C ATOM 1118 CG GLU A 72 -6.649 -4.215 3.694 1.00 0.00 C ATOM 1119 CD GLU A 72 -6.806 -3.186 2.591 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -6.713 -3.596 1.411 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -7.054 -2.018 2.947 1.00 0.00 O ATOM 0 H GLU A 72 -10.720 -5.473 5.075 1.00 0.00 H new ATOM 0 HA GLU A 72 -8.113 -4.500 5.908 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -7.644 -6.092 3.985 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -8.527 -4.962 2.978 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.400 -3.712 4.628 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.817 -4.878 3.457 1.00 0.00 H new ATOM 1128 N THR A 73 -8.964 -2.209 4.814 1.00 0.00 N ATOM 1129 CA THR A 73 -9.586 -0.907 5.023 1.00 0.00 C ATOM 1130 C THR A 73 -8.739 0.147 4.314 1.00 0.00 C ATOM 1131 O THR A 73 -7.731 0.590 4.863 1.00 0.00 O ATOM 1132 CB THR A 73 -9.710 -0.613 6.532 1.00 0.00 C ATOM 1133 OG1 THR A 73 -10.433 -1.632 7.201 1.00 0.00 O ATOM 1134 CG2 THR A 73 -10.435 0.713 6.782 1.00 0.00 C ATOM 0 H THR A 73 -7.982 -2.156 4.543 1.00 0.00 H new ATOM 0 HA THR A 73 -10.594 -0.894 4.608 1.00 0.00 H new ATOM 0 HB THR A 73 -8.692 -0.563 6.919 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.493 -1.418 8.155 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.507 0.892 7.855 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.879 1.526 6.315 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.437 0.666 6.354 1.00 0.00 H new ATOM 1142 N THR A 74 -9.145 0.561 3.110 1.00 0.00 N ATOM 1143 CA THR A 74 -8.365 1.543 2.365 1.00 0.00 C ATOM 1144 C THR A 74 -8.697 2.958 2.841 1.00 0.00 C ATOM 1145 O THR A 74 -9.613 3.159 3.642 1.00 0.00 O ATOM 1146 CB THR A 74 -8.550 1.363 0.854 1.00 0.00 C ATOM 1147 OG1 THR A 74 -7.523 2.036 0.157 1.00 0.00 O ATOM 1148 CG2 THR A 74 -9.876 1.938 0.373 1.00 0.00 C ATOM 0 H THR A 74 -9.991 0.238 2.642 1.00 0.00 H new ATOM 0 HA THR A 74 -7.306 1.380 2.564 1.00 0.00 H new ATOM 0 HB THR A 74 -8.525 0.291 0.659 1.00 0.00 H new ATOM 0 HG1 THR A 74 -7.648 1.914 -0.807 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.968 1.790 -0.703 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.697 1.432 0.880 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.913 3.004 0.597 1.00 0.00 H new ATOM 1156 N ALA A 75 -7.965 3.942 2.308 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.847 5.308 2.822 1.00 0.00 C ATOM 1158 C ALA A 75 -9.121 6.169 2.722 1.00 0.00 C ATOM 1159 O ALA A 75 -9.027 7.395 2.769 1.00 0.00 O ATOM 1160 CB ALA A 75 -6.666 5.985 2.117 1.00 0.00 C ATOM 0 H ALA A 75 -7.411 3.798 1.464 1.00 0.00 H new ATOM 0 HA ALA A 75 -7.679 5.225 3.896 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -6.559 7.005 2.485 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -5.752 5.428 2.322 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.846 6.004 1.042 1.00 0.00 H new ATOM 1166 N ASP A 76 -10.298 5.550 2.607 1.00 0.00 N ATOM 1167 CA ASP A 76 -11.623 6.159 2.667 1.00 0.00 C ATOM 1168 C ASP A 76 -12.610 5.278 3.453 1.00 0.00 C ATOM 1169 O ASP A 76 -13.819 5.479 3.357 1.00 0.00 O ATOM 1170 CB ASP A 76 -12.129 6.401 1.241 1.00 0.00 C ATOM 1171 CG ASP A 76 -12.127 5.162 0.359 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -11.996 4.048 0.918 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -12.218 5.373 -0.874 1.00 0.00 O ATOM 0 H ASP A 76 -10.351 4.542 2.460 1.00 0.00 H new ATOM 0 HA ASP A 76 -11.550 7.110 3.194 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -13.144 6.797 1.290 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -11.510 7.167 0.773 1.00 0.00 H new ATOM 1178 N ASP A 77 -12.099 4.304 4.218 1.00 0.00 N ATOM 1179 CA ASP A 77 -12.867 3.235 4.852 1.00 0.00 C ATOM 1180 C ASP A 77 -13.790 2.535 3.851 1.00 0.00 C ATOM 1181 O ASP A 77 -14.895 2.111 4.191 1.00 0.00 O ATOM 1182 CB ASP A 77 -13.584 3.699 6.135 1.00 0.00 C ATOM 1183 CG ASP A 77 -14.266 2.563 6.920 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -13.797 1.405 6.872 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -15.265 2.880 7.609 1.00 0.00 O ATOM 0 H ASP A 77 -11.101 4.241 4.417 1.00 0.00 H new ATOM 0 HA ASP A 77 -12.156 2.480 5.187 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -12.861 4.192 6.785 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -14.334 4.444 5.870 1.00 0.00 H new ATOM 1190 N ARG A 78 -13.317 2.300 2.619 1.00 0.00 N ATOM 1191 CA ARG A 78 -13.827 1.117 1.943 1.00 0.00 C ATOM 1192 C ARG A 78 -13.262 -0.069 2.723 1.00 0.00 C ATOM 1193 O ARG A 78 -12.051 -0.301 2.708 1.00 0.00 O ATOM 1194 CB ARG A 78 -13.442 1.033 0.463 1.00 0.00 C ATOM 1195 CG ARG A 78 -13.948 2.208 -0.384 1.00 0.00 C ATOM 1196 CD ARG A 78 -15.060 1.760 -1.336 1.00 0.00 C ATOM 1197 NE ARG A 78 -15.318 2.778 -2.365 1.00 0.00 N ATOM 1198 CZ ARG A 78 -16.125 2.578 -3.418 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -16.863 1.468 -3.484 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -16.181 3.464 -4.413 1.00 0.00 N ATOM 0 H ARG A 78 -12.638 2.865 2.110 1.00 0.00 H new ATOM 0 HA ARG A 78 -14.917 1.137 1.933 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -12.356 0.983 0.383 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.835 0.105 0.049 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -14.320 2.998 0.269 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -13.122 2.630 -0.957 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -14.779 0.821 -1.812 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -15.972 1.570 -0.771 1.00 0.00 H new ATOM 0 HE ARG A 78 -14.859 3.684 -2.273 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -16.812 0.776 -2.736 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -17.478 1.311 -4.282 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -15.606 4.306 -4.379 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -16.799 3.300 -5.208 1.00 0.00 H new ATOM 1214 N LYS A 79 -14.130 -0.800 3.425 1.00 0.00 N ATOM 1215 CA LYS A 79 -13.760 -2.013 4.136 1.00 0.00 C ATOM 1216 C LYS A 79 -13.559 -3.129 3.112 1.00 0.00 C ATOM 1217 O LYS A 79 -14.399 -4.014 2.948 1.00 0.00 O ATOM 1218 CB LYS A 79 -14.829 -2.328 5.184 1.00 0.00 C ATOM 1219 CG LYS A 79 -14.342 -3.431 6.136 1.00 0.00 C ATOM 1220 CD LYS A 79 -15.355 -3.759 7.239 1.00 0.00 C ATOM 1221 CE LYS A 79 -15.310 -2.811 8.453 1.00 0.00 C ATOM 1222 NZ LYS A 79 -15.547 -1.382 8.128 1.00 0.00 N ATOM 0 H LYS A 79 -15.117 -0.560 3.513 1.00 0.00 H new ATOM 0 HA LYS A 79 -12.821 -1.896 4.678 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -15.066 -1.428 5.752 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -15.748 -2.645 4.691 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -14.134 -4.334 5.561 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -13.403 -3.120 6.593 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -16.358 -3.735 6.812 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -15.180 -4.778 7.584 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -16.057 -3.134 9.178 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -14.337 -2.904 8.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -15.900 -0.888 8.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -14.656 -0.944 7.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -16.251 -1.311 7.366 1.00 0.00 H new ATOM 1236 N VAL A 80 -12.471 -3.023 2.358 1.00 0.00 N ATOM 1237 CA VAL A 80 -12.166 -3.932 1.273 1.00 0.00 C ATOM 1238 C VAL A 80 -11.702 -5.274 1.837 1.00 0.00 C ATOM 1239 O VAL A 80 -11.148 -5.342 2.928 1.00 0.00 O ATOM 1240 CB VAL A 80 -11.097 -3.314 0.358 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -11.491 -1.921 -0.144 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -9.749 -3.208 1.076 1.00 0.00 C ATOM 0 H VAL A 80 -11.771 -2.293 2.489 1.00 0.00 H new ATOM 0 HA VAL A 80 -13.063 -4.104 0.678 1.00 0.00 H new ATOM 0 HB VAL A 80 -11.013 -3.984 -0.498 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -10.702 -1.529 -0.786 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.420 -1.988 -0.710 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -11.631 -1.254 0.707 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -9.013 -2.767 0.404 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -9.856 -2.579 1.960 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -9.417 -4.202 1.376 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.880 -6.345 1.070 1.00 0.00 N ATOM 1253 CA LYS A 81 -11.137 -7.573 1.256 1.00 0.00 C ATOM 1254 C LYS A 81 -9.899 -7.472 0.369 1.00 0.00 C ATOM 1255 O LYS A 81 -10.012 -7.328 -0.851 1.00 0.00 O ATOM 1256 CB LYS A 81 -12.000 -8.796 0.913 1.00 0.00 C ATOM 1257 CG LYS A 81 -12.705 -9.360 2.156 1.00 0.00 C ATOM 1258 CD LYS A 81 -13.693 -8.364 2.784 1.00 0.00 C ATOM 1259 CE LYS A 81 -14.157 -8.797 4.179 1.00 0.00 C ATOM 1260 NZ LYS A 81 -14.934 -10.048 4.196 1.00 0.00 N ATOM 0 H LYS A 81 -12.548 -6.379 0.300 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.842 -7.705 2.297 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.744 -8.518 0.167 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.375 -9.569 0.467 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -13.238 -10.271 1.884 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.956 -9.639 2.898 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -13.222 -7.383 2.850 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.561 -8.258 2.133 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.283 -8.917 4.819 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -14.762 -8.001 4.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.210 -10.272 5.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.787 -9.935 3.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -14.354 -10.822 3.814 1.00 0.00 H new ATOM 1274 N SER A 82 -8.724 -7.548 0.990 1.00 0.00 N ATOM 1275 CA SER A 82 -7.477 -7.727 0.275 1.00 0.00 C ATOM 1276 C SER A 82 -7.349 -9.218 -0.009 1.00 0.00 C ATOM 1277 O SER A 82 -7.426 -10.026 0.913 1.00 0.00 O ATOM 1278 CB SER A 82 -6.300 -7.224 1.116 1.00 0.00 C ATOM 1279 OG SER A 82 -5.895 -5.934 0.706 1.00 0.00 O ATOM 0 H SER A 82 -8.617 -7.487 2.002 1.00 0.00 H new ATOM 0 HA SER A 82 -7.468 -7.156 -0.653 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.584 -7.202 2.168 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.463 -7.917 1.027 1.00 0.00 H new ATOM 0 HG SER A 82 -6.266 -5.265 1.318 1.00 0.00 H new ATOM 1285 N ILE A 83 -7.168 -9.570 -1.280 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.948 -10.927 -1.747 1.00 0.00 C ATOM 1287 C ILE A 83 -5.611 -10.901 -2.476 1.00 0.00 C ATOM 1288 O ILE A 83 -5.484 -10.283 -3.532 1.00 0.00 O ATOM 1289 CB ILE A 83 -8.159 -11.452 -2.553 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -7.729 -12.512 -3.585 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -9.006 -10.330 -3.176 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -8.899 -13.345 -4.118 1.00 0.00 C ATOM 0 H ILE A 83 -7.172 -8.888 -2.038 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.880 -11.656 -0.940 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.819 -11.944 -1.838 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -7.234 -12.017 -4.420 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.996 -13.177 -3.129 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.839 -10.766 -3.727 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -9.392 -9.684 -2.387 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.389 -9.743 -3.856 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -8.528 -14.072 -4.840 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.380 -13.867 -3.291 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.622 -12.689 -4.602 1.00 0.00 H new ATOM 1304 N VAL A 84 -4.586 -11.488 -1.854 1.00 0.00 N ATOM 1305 CA VAL A 84 -3.213 -11.349 -2.305 1.00 0.00 C ATOM 1306 C VAL A 84 -2.602 -12.722 -2.548 1.00 0.00 C ATOM 1307 O VAL A 84 -2.752 -13.608 -1.707 1.00 0.00 O ATOM 1308 CB VAL A 84 -2.404 -10.572 -1.261 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -1.014 -10.228 -1.801 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -3.117 -9.283 -0.842 1.00 0.00 C ATOM 0 H VAL A 84 -4.692 -12.072 -1.024 1.00 0.00 H new ATOM 0 HA VAL A 84 -3.195 -10.796 -3.244 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.306 -11.215 -0.386 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.456 -9.676 -1.044 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.482 -11.147 -2.047 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.113 -9.615 -2.697 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.514 -8.758 -0.101 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -3.257 -8.644 -1.714 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -4.088 -9.528 -0.412 1.00 0.00 H new ATOM 1320 N THR A 85 -1.893 -12.870 -3.669 1.00 0.00 N ATOM 1321 CA THR A 85 -1.109 -14.042 -4.034 1.00 0.00 C ATOM 1322 C THR A 85 0.119 -13.549 -4.813 1.00 0.00 C ATOM 1323 O THR A 85 0.379 -12.345 -4.849 1.00 0.00 O ATOM 1324 CB THR A 85 -1.979 -15.008 -4.861 1.00 0.00 C ATOM 1325 OG1 THR A 85 -2.548 -14.320 -5.955 1.00 0.00 O ATOM 1326 CG2 THR A 85 -3.114 -15.626 -4.040 1.00 0.00 C ATOM 0 H THR A 85 -1.851 -12.138 -4.378 1.00 0.00 H new ATOM 0 HA THR A 85 -0.773 -14.594 -3.156 1.00 0.00 H new ATOM 0 HB THR A 85 -1.324 -15.811 -5.198 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.099 -14.938 -6.479 1.00 0.00 H new ATOM 0 HG21 THR A 85 -3.695 -16.298 -4.671 1.00 0.00 H new ATOM 0 HG22 THR A 85 -2.695 -16.185 -3.204 1.00 0.00 H new ATOM 0 HG23 THR A 85 -3.761 -14.835 -3.660 1.00 0.00 H new ATOM 1334 N LEU A 86 0.877 -14.447 -5.450 1.00 0.00 N ATOM 1335 CA LEU A 86 1.898 -14.093 -6.423 1.00 0.00 C ATOM 1336 C LEU A 86 1.771 -15.061 -7.605 1.00 0.00 C ATOM 1337 O LEU A 86 1.575 -16.253 -7.375 1.00 0.00 O ATOM 1338 CB LEU A 86 3.276 -14.063 -5.734 1.00 0.00 C ATOM 1339 CG LEU A 86 3.810 -15.421 -5.241 1.00 0.00 C ATOM 1340 CD1 LEU A 86 4.837 -15.993 -6.228 1.00 0.00 C ATOM 1341 CD2 LEU A 86 4.478 -15.255 -3.869 1.00 0.00 C ATOM 0 H LEU A 86 0.792 -15.452 -5.298 1.00 0.00 H new ATOM 0 HA LEU A 86 1.770 -13.089 -6.828 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.000 -13.641 -6.431 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.220 -13.385 -4.882 1.00 0.00 H new ATOM 0 HG LEU A 86 2.967 -16.108 -5.164 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.201 -16.952 -5.860 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.367 -16.133 -7.202 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.673 -15.301 -6.325 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.853 -16.220 -3.528 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.307 -14.552 -3.951 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.749 -14.875 -3.153 1.00 0.00 H new ATOM 1353 N ASP A 87 1.828 -14.587 -8.859 1.00 0.00 N ATOM 1354 CA ASP A 87 1.464 -15.382 -10.048 1.00 0.00 C ATOM 1355 C ASP A 87 2.568 -16.372 -10.458 1.00 0.00 C ATOM 1356 O ASP A 87 2.686 -16.733 -11.628 1.00 0.00 O ATOM 1357 CB ASP A 87 1.066 -14.471 -11.240 1.00 0.00 C ATOM 1358 CG ASP A 87 2.266 -13.881 -11.979 1.00 0.00 C ATOM 1359 OD1 ASP A 87 3.332 -13.850 -11.339 1.00 0.00 O ATOM 1360 OD2 ASP A 87 2.152 -13.453 -13.155 1.00 0.00 O ATOM 0 H ASP A 87 2.129 -13.638 -9.081 1.00 0.00 H new ATOM 0 HA ASP A 87 0.594 -15.975 -9.767 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.463 -15.047 -11.942 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.439 -13.658 -10.873 1.00 0.00 H new ATOM 1365 N GLY A 88 3.418 -16.774 -9.513 1.00 0.00 N ATOM 1366 CA GLY A 88 4.691 -17.415 -9.797 1.00 0.00 C ATOM 1367 C GLY A 88 5.802 -16.399 -10.095 1.00 0.00 C ATOM 1368 O GLY A 88 6.960 -16.668 -9.785 1.00 0.00 O ATOM 0 H GLY A 88 3.234 -16.659 -8.516 1.00 0.00 H new ATOM 0 HA2 GLY A 88 4.983 -18.030 -8.946 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.576 -18.084 -10.650 1.00 0.00 H new ATOM 1372 N GLY A 89 5.477 -15.248 -10.698 1.00 0.00 N ATOM 1373 CA GLY A 89 6.429 -14.261 -11.187 1.00 0.00 C ATOM 1374 C GLY A 89 6.391 -12.947 -10.401 1.00 0.00 C ATOM 1375 O GLY A 89 7.449 -12.416 -10.084 1.00 0.00 O ATOM 0 H GLY A 89 4.508 -14.976 -10.861 1.00 0.00 H new ATOM 0 HA2 GLY A 89 7.434 -14.679 -11.136 1.00 0.00 H new ATOM 0 HA3 GLY A 89 6.222 -14.055 -12.237 1.00 0.00 H new ATOM 1379 N LYS A 90 5.195 -12.400 -10.147 1.00 0.00 N ATOM 1380 CA LYS A 90 4.951 -11.088 -9.556 1.00 0.00 C ATOM 1381 C LYS A 90 4.018 -11.246 -8.365 1.00 0.00 C ATOM 1382 O LYS A 90 3.208 -12.173 -8.351 1.00 0.00 O ATOM 1383 CB LYS A 90 4.246 -10.140 -10.548 1.00 0.00 C ATOM 1384 CG LYS A 90 4.882 -10.053 -11.944 1.00 0.00 C ATOM 1385 CD LYS A 90 4.114 -11.037 -12.827 1.00 0.00 C ATOM 1386 CE LYS A 90 4.565 -11.230 -14.268 1.00 0.00 C ATOM 1387 NZ LYS A 90 3.738 -12.310 -14.855 1.00 0.00 N ATOM 0 H LYS A 90 4.328 -12.892 -10.362 1.00 0.00 H new ATOM 0 HA LYS A 90 5.918 -10.672 -9.272 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.211 -10.463 -10.659 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.224 -9.140 -10.115 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.814 -9.040 -12.340 1.00 0.00 H new ATOM 0 HG3 LYS A 90 5.941 -10.309 -11.906 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.142 -12.011 -12.338 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.071 -10.720 -12.846 1.00 0.00 H new ATOM 0 HE2 LYS A 90 4.446 -10.306 -14.834 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.622 -11.493 -14.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.313 -12.865 -15.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.389 -12.931 -14.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.930 -11.893 -15.361 1.00 0.00 H new ATOM 1401 N LEU A 91 4.060 -10.302 -7.421 1.00 0.00 N ATOM 1402 CA LEU A 91 3.114 -10.251 -6.316 1.00 0.00 C ATOM 1403 C LEU A 91 1.827 -9.585 -6.808 1.00 0.00 C ATOM 1404 O LEU A 91 1.843 -8.445 -7.278 1.00 0.00 O ATOM 1405 CB LEU A 91 3.770 -9.577 -5.100 1.00 0.00 C ATOM 1406 CG LEU A 91 2.916 -9.581 -3.820 1.00 0.00 C ATOM 1407 CD1 LEU A 91 3.865 -9.483 -2.618 1.00 0.00 C ATOM 1408 CD2 LEU A 91 1.913 -8.421 -3.735 1.00 0.00 C ATOM 0 H LEU A 91 4.753 -9.554 -7.406 1.00 0.00 H new ATOM 0 HA LEU A 91 2.834 -11.247 -5.972 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.715 -10.078 -4.891 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.007 -8.545 -5.358 1.00 0.00 H new ATOM 0 HG LEU A 91 2.333 -10.502 -3.828 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.285 -9.484 -1.695 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.544 -10.335 -2.620 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.441 -8.560 -2.684 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.350 -8.494 -2.805 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.450 -7.473 -3.760 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.226 -8.471 -4.580 1.00 0.00 H new ATOM 1420 N VAL A 92 0.706 -10.303 -6.704 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.606 -9.861 -7.138 1.00 0.00 C ATOM 1422 C VAL A 92 -1.407 -9.492 -5.891 1.00 0.00 C ATOM 1423 O VAL A 92 -1.869 -10.378 -5.175 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.309 -10.974 -7.943 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -2.555 -10.412 -8.636 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -0.406 -11.593 -9.014 1.00 0.00 C ATOM 0 H VAL A 92 0.695 -11.240 -6.300 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.522 -8.995 -7.794 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.573 -11.752 -7.227 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.045 -11.204 -9.202 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.244 -10.022 -7.886 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.264 -9.609 -9.313 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.954 -12.369 -9.548 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.093 -10.821 -9.717 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.473 -12.030 -8.540 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.578 -8.192 -5.628 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.471 -7.710 -4.585 1.00 0.00 C ATOM 1438 C HIS A 93 -3.769 -7.282 -5.268 1.00 0.00 C ATOM 1439 O HIS A 93 -3.800 -6.227 -5.896 1.00 0.00 O ATOM 1440 CB HIS A 93 -1.783 -6.572 -3.811 1.00 0.00 C ATOM 1441 CG HIS A 93 -2.437 -6.184 -2.503 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -1.814 -6.153 -1.261 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -3.738 -5.790 -2.332 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -2.727 -5.754 -0.357 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -3.897 -5.533 -0.985 1.00 0.00 N ATOM 0 H HIS A 93 -1.098 -7.449 -6.136 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.707 -8.478 -3.848 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -0.753 -6.865 -3.609 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.744 -5.692 -4.453 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -0.841 -6.390 -1.069 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.491 -5.698 -3.100 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -2.550 -5.631 0.701 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -4.761 -5.226 -0.538 1.00 0.00 H new ATOM 1454 N VAL A 94 -4.829 -8.086 -5.160 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.166 -7.689 -5.576 1.00 0.00 C ATOM 1456 C VAL A 94 -6.860 -7.098 -4.347 1.00 0.00 C ATOM 1457 O VAL A 94 -6.626 -7.543 -3.221 1.00 0.00 O ATOM 1458 CB VAL A 94 -6.915 -8.891 -6.186 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.328 -8.522 -6.659 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -6.126 -9.468 -7.368 1.00 0.00 C ATOM 0 H VAL A 94 -4.779 -9.031 -4.780 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.143 -6.934 -6.362 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.007 -9.636 -5.395 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.812 -9.403 -7.080 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.911 -8.157 -5.813 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.265 -7.744 -7.420 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.668 -10.316 -7.788 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.003 -8.701 -8.133 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.146 -9.798 -7.025 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.668 -6.059 -4.551 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.421 -5.390 -3.505 1.00 0.00 C ATOM 1472 C GLN A 95 -9.866 -5.297 -4.000 1.00 0.00 C ATOM 1473 O GLN A 95 -10.154 -4.589 -4.969 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.757 -4.041 -3.203 1.00 0.00 C ATOM 1475 CG GLN A 95 -8.290 -3.372 -1.935 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.625 -2.012 -1.715 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -7.790 -1.102 -2.522 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -6.869 -1.847 -0.635 1.00 0.00 N ATOM 0 H GLN A 95 -7.817 -5.653 -5.475 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.429 -5.927 -2.557 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.682 -4.188 -3.103 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.910 -3.372 -4.050 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.370 -3.245 -2.012 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.105 -4.015 -1.075 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -6.745 -2.616 0.023 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -6.413 -0.951 -0.464 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.746 -6.090 -3.382 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.120 -6.323 -3.801 1.00 0.00 C ATOM 1489 C LYS A 96 -13.031 -5.826 -2.691 1.00 0.00 C ATOM 1490 O LYS A 96 -12.721 -6.071 -1.532 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.294 -7.838 -4.016 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.759 -8.279 -4.200 1.00 0.00 C ATOM 1493 CD LYS A 96 -14.381 -8.899 -2.935 1.00 0.00 C ATOM 1494 CE LYS A 96 -13.831 -10.291 -2.579 1.00 0.00 C ATOM 1495 NZ LYS A 96 -14.069 -11.285 -3.646 1.00 0.00 N ATOM 0 H LYS A 96 -10.503 -6.608 -2.538 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.364 -5.800 -4.726 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.722 -8.138 -4.894 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.870 -8.367 -3.162 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.354 -7.417 -4.502 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.812 -9.003 -5.013 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.211 -8.227 -2.094 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.460 -8.971 -3.072 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.760 -10.217 -2.389 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.296 -10.636 -1.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -13.852 -12.237 -3.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -15.065 -11.245 -3.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.458 -11.073 -4.460 1.00 0.00 H new ATOM 1509 N TRP A 97 -14.154 -5.170 -3.003 1.00 0.00 N ATOM 1510 CA TRP A 97 -15.132 -4.828 -1.977 1.00 0.00 C ATOM 1511 C TRP A 97 -16.456 -5.536 -2.237 1.00 0.00 C ATOM 1512 O TRP A 97 -16.746 -6.530 -1.574 1.00 0.00 O ATOM 1513 CB TRP A 97 -15.249 -3.313 -1.789 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.962 -2.436 -2.967 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.888 -1.783 -3.695 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.668 -2.023 -3.504 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -15.264 -0.940 -4.582 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.894 -1.026 -4.497 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -12.326 -2.374 -3.249 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.848 -0.363 -5.151 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -11.267 -1.706 -3.888 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.526 -0.669 -4.795 1.00 0.00 C ATOM 0 H TRP A 97 -14.402 -4.871 -3.946 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.780 -5.200 -1.015 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -16.262 -3.096 -1.449 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -14.574 -3.023 -0.984 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.957 -1.904 -3.597 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.758 -0.323 -5.227 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -12.108 -3.169 -2.551 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -13.055 0.371 -5.916 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -10.247 -1.994 -3.679 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.708 -0.106 -5.220 1.00 0.00 H new ATOM 1533 N ASN A 98 -17.269 -5.030 -3.169 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.639 -5.516 -3.326 1.00 0.00 C ATOM 1535 C ASN A 98 -19.141 -5.431 -4.762 1.00 0.00 C ATOM 1536 O ASN A 98 -19.519 -6.449 -5.334 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.588 -4.835 -2.325 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.735 -3.329 -2.529 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.856 -2.556 -2.165 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.829 -2.885 -3.139 1.00 0.00 N ATOM 0 H ASN A 98 -17.004 -4.291 -3.820 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.627 -6.580 -3.090 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.572 -5.299 -2.401 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -19.225 -5.020 -1.314 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.947 -1.887 -3.311 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -21.550 -3.543 -3.435 1.00 0.00 H new ATOM 1547 N GLY A 99 -19.182 -4.226 -5.333 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.682 -4.007 -6.681 1.00 0.00 C ATOM 1549 C GLY A 99 -18.588 -3.482 -7.601 1.00 0.00 C ATOM 1550 O GLY A 99 -18.875 -3.163 -8.751 1.00 0.00 O ATOM 0 H GLY A 99 -18.867 -3.375 -4.867 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.078 -4.941 -7.080 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.508 -3.297 -6.653 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.368 -3.298 -7.086 1.00 0.00 N ATOM 1555 CA GLN A 100 -16.212 -2.962 -7.883 1.00 0.00 C ATOM 1556 C GLN A 100 -14.997 -3.577 -7.196 1.00 0.00 C ATOM 1557 O GLN A 100 -14.986 -3.734 -5.971 1.00 0.00 O ATOM 1558 CB GLN A 100 -15.987 -1.448 -8.040 1.00 0.00 C ATOM 1559 CG GLN A 100 -17.208 -0.518 -8.129 1.00 0.00 C ATOM 1560 CD GLN A 100 -17.811 -0.199 -6.760 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -17.213 0.532 -5.969 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -18.989 -0.723 -6.445 1.00 0.00 N ATOM 0 H GLN A 100 -17.166 -3.382 -6.090 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.371 -3.351 -8.889 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -15.382 -1.116 -7.197 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.391 -1.296 -8.940 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.916 0.411 -8.618 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.968 -0.983 -8.756 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.473 -1.327 -7.110 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -19.410 -0.522 -5.538 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.976 -3.861 -8.000 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.711 -4.442 -7.603 1.00 0.00 C ATOM 1573 C GLU A 101 -11.589 -3.531 -8.101 1.00 0.00 C ATOM 1574 O GLU A 101 -11.821 -2.597 -8.887 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.587 -5.851 -8.220 1.00 0.00 C ATOM 1576 CG GLU A 101 -13.453 -6.924 -7.539 1.00 0.00 C ATOM 1577 CD GLU A 101 -14.951 -6.645 -7.562 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -15.450 -6.270 -8.644 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -15.562 -6.789 -6.480 1.00 0.00 O ATOM 0 H GLU A 101 -14.019 -3.679 -9.003 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.646 -4.533 -6.519 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -12.859 -5.797 -9.274 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -11.543 -6.163 -8.176 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.269 -7.882 -8.025 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -13.132 -7.026 -6.502 1.00 0.00 H new ATOM 1586 N THR A 102 -10.370 -3.818 -7.641 1.00 0.00 N ATOM 1587 CA THR A 102 -9.139 -3.295 -8.204 1.00 0.00 C ATOM 1588 C THR A 102 -8.041 -4.354 -8.150 1.00 0.00 C ATOM 1589 O THR A 102 -8.019 -5.184 -7.239 1.00 0.00 O ATOM 1590 CB THR A 102 -8.697 -2.040 -7.447 1.00 0.00 C ATOM 1591 OG1 THR A 102 -8.702 -2.265 -6.060 1.00 0.00 O ATOM 1592 CG2 THR A 102 -9.641 -0.882 -7.707 1.00 0.00 C ATOM 0 H THR A 102 -10.215 -4.437 -6.846 1.00 0.00 H new ATOM 0 HA THR A 102 -9.320 -3.029 -9.245 1.00 0.00 H new ATOM 0 HB THR A 102 -7.693 -1.803 -7.799 1.00 0.00 H new ATOM 0 HG1 THR A 102 -9.531 -1.913 -5.674 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.301 -0.005 -7.156 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.656 -0.657 -8.773 1.00 0.00 H new ATOM 0 HG23 THR A 102 -10.645 -1.150 -7.379 1.00 0.00 H new ATOM 1600 N SER A 103 -7.120 -4.303 -9.113 1.00 0.00 N ATOM 1601 CA SER A 103 -5.873 -5.049 -9.100 1.00 0.00 C ATOM 1602 C SER A 103 -4.727 -4.062 -8.882 1.00 0.00 C ATOM 1603 O SER A 103 -4.748 -2.958 -9.429 1.00 0.00 O ATOM 1604 CB SER A 103 -5.726 -5.835 -10.406 1.00 0.00 C ATOM 1605 OG SER A 103 -6.077 -5.037 -11.517 1.00 0.00 O ATOM 0 H SER A 103 -7.230 -3.723 -9.945 1.00 0.00 H new ATOM 0 HA SER A 103 -5.859 -5.777 -8.289 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.698 -6.182 -10.513 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.360 -6.721 -10.375 1.00 0.00 H new ATOM 0 HG SER A 103 -5.974 -5.559 -12.340 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.762 -4.446 -8.038 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.616 -3.640 -7.657 1.00 0.00 C ATOM 1613 C LEU A 104 -1.371 -4.534 -7.705 1.00 0.00 C ATOM 1614 O LEU A 104 -0.813 -4.878 -6.658 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.820 -3.032 -6.256 1.00 0.00 C ATOM 1616 CG LEU A 104 -4.126 -2.243 -6.076 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -5.255 -3.120 -5.531 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -3.923 -1.132 -5.044 1.00 0.00 C ATOM 0 H LEU A 104 -3.766 -5.362 -7.590 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.493 -2.806 -8.348 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.794 -3.836 -5.520 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.981 -2.372 -6.037 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.390 -1.855 -7.060 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.159 -2.521 -5.419 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.446 -3.940 -6.224 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.966 -3.524 -4.561 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.852 -0.576 -4.921 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.633 -1.571 -4.089 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -3.139 -0.457 -5.386 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.954 -4.944 -8.907 1.00 0.00 N ATOM 1631 CA VAL A 105 0.148 -5.893 -9.089 1.00 0.00 C ATOM 1632 C VAL A 105 1.484 -5.173 -8.884 1.00 0.00 C ATOM 1633 O VAL A 105 1.568 -3.991 -9.220 1.00 0.00 O ATOM 1634 CB VAL A 105 0.049 -6.567 -10.475 1.00 0.00 C ATOM 1635 CG1 VAL A 105 0.784 -5.815 -11.591 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.589 -8.000 -10.424 1.00 0.00 C ATOM 0 H VAL A 105 -1.372 -4.627 -9.782 1.00 0.00 H new ATOM 0 HA VAL A 105 0.082 -6.686 -8.344 1.00 0.00 H new ATOM 0 HB VAL A 105 -1.014 -6.557 -10.716 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.666 -6.353 -12.531 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.366 -4.813 -11.691 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.843 -5.743 -11.345 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.509 -8.454 -11.412 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.634 -7.984 -10.116 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.008 -8.582 -9.709 1.00 0.00 H new ATOM 1646 N ARG A 106 2.500 -5.856 -8.338 1.00 0.00 N ATOM 1647 CA ARG A 106 3.851 -5.327 -8.143 1.00 0.00 C ATOM 1648 C ARG A 106 4.891 -6.392 -8.488 1.00 0.00 C ATOM 1649 O ARG A 106 4.749 -7.528 -8.033 1.00 0.00 O ATOM 1650 CB ARG A 106 4.102 -4.862 -6.691 1.00 0.00 C ATOM 1651 CG ARG A 106 3.378 -5.691 -5.621 1.00 0.00 C ATOM 1652 CD ARG A 106 2.027 -5.061 -5.275 1.00 0.00 C ATOM 1653 NE ARG A 106 2.178 -3.885 -4.410 1.00 0.00 N ATOM 1654 CZ ARG A 106 1.162 -3.084 -4.058 1.00 0.00 C ATOM 1655 NH1 ARG A 106 -0.063 -3.309 -4.546 1.00 0.00 N ATOM 1656 NH2 ARG A 106 1.376 -2.066 -3.217 1.00 0.00 N ATOM 0 H ARG A 106 2.399 -6.817 -8.012 1.00 0.00 H new ATOM 0 HA ARG A 106 3.942 -4.465 -8.804 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.173 -4.894 -6.493 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.791 -3.821 -6.598 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.229 -6.709 -5.981 1.00 0.00 H new ATOM 0 HG3 ARG A 106 3.995 -5.757 -4.725 1.00 0.00 H new ATOM 0 HD2 ARG A 106 1.515 -4.773 -6.193 1.00 0.00 H new ATOM 0 HD3 ARG A 106 1.399 -5.800 -4.777 1.00 0.00 H new ATOM 0 HE ARG A 106 3.109 -3.664 -4.056 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -0.222 -4.088 -5.184 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -0.838 -2.701 -4.280 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.311 -1.900 -2.845 1.00 0.00 H new ATOM 0 HH22 ARG A 106 0.604 -1.456 -2.948 1.00 0.00 H new ATOM 1670 N GLU A 107 5.963 -6.011 -9.203 1.00 0.00 N ATOM 1671 CA GLU A 107 7.213 -6.768 -9.174 1.00 0.00 C ATOM 1672 C GLU A 107 8.412 -5.960 -9.662 1.00 0.00 C ATOM 1673 O GLU A 107 8.268 -5.118 -10.549 1.00 0.00 O ATOM 1674 CB GLU A 107 7.105 -8.069 -9.980 1.00 0.00 C ATOM 1675 CG GLU A 107 8.272 -9.033 -9.720 1.00 0.00 C ATOM 1676 CD GLU A 107 8.495 -9.239 -8.229 1.00 0.00 C ATOM 1677 OE1 GLU A 107 7.664 -9.938 -7.613 1.00 0.00 O ATOM 1678 OE2 GLU A 107 9.421 -8.572 -7.714 1.00 0.00 O ATOM 0 H GLU A 107 5.983 -5.187 -9.803 1.00 0.00 H new ATOM 0 HA GLU A 107 7.383 -7.010 -8.125 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.167 -8.567 -9.733 1.00 0.00 H new ATOM 0 HB3 GLU A 107 7.068 -7.830 -11.043 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.067 -9.992 -10.196 1.00 0.00 H new ATOM 0 HG3 GLU A 107 9.181 -8.639 -10.175 1.00 0.00 H new ATOM 1685 N MET A 108 9.586 -6.250 -9.088 1.00 0.00 N ATOM 1686 CA MET A 108 10.885 -5.806 -9.557 1.00 0.00 C ATOM 1687 C MET A 108 11.472 -6.868 -10.477 1.00 0.00 C ATOM 1688 O MET A 108 12.060 -7.847 -10.023 1.00 0.00 O ATOM 1689 CB MET A 108 11.797 -5.453 -8.371 1.00 0.00 C ATOM 1690 CG MET A 108 13.245 -5.143 -8.778 1.00 0.00 C ATOM 1691 SD MET A 108 14.365 -6.576 -8.817 1.00 0.00 S ATOM 1692 CE MET A 108 15.839 -5.797 -9.517 1.00 0.00 C ATOM 0 H MET A 108 9.649 -6.826 -8.248 1.00 0.00 H new ATOM 0 HA MET A 108 10.786 -4.889 -10.138 1.00 0.00 H new ATOM 0 HB2 MET A 108 11.383 -4.590 -7.849 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.797 -6.283 -7.664 1.00 0.00 H new ATOM 0 HG2 MET A 108 13.237 -4.682 -9.766 1.00 0.00 H new ATOM 0 HG3 MET A 108 13.650 -4.405 -8.085 1.00 0.00 H new ATOM 0 HE1 MET A 108 16.678 -6.491 -9.464 1.00 0.00 H new ATOM 0 HE2 MET A 108 15.652 -5.533 -10.558 1.00 0.00 H new ATOM 0 HE3 MET A 108 16.078 -4.896 -8.952 1.00 0.00 H new ATOM 1702 N VAL A 109 11.396 -6.601 -11.776 1.00 0.00 N ATOM 1703 CA VAL A 109 12.258 -7.204 -12.780 1.00 0.00 C ATOM 1704 C VAL A 109 13.118 -6.067 -13.334 1.00 0.00 C ATOM 1705 O VAL A 109 13.079 -4.963 -12.784 1.00 0.00 O ATOM 1706 CB VAL A 109 11.415 -7.954 -13.828 1.00 0.00 C ATOM 1707 CG1 VAL A 109 10.852 -9.232 -13.202 1.00 0.00 C ATOM 1708 CG2 VAL A 109 10.241 -7.123 -14.351 1.00 0.00 C ATOM 0 H VAL A 109 10.719 -5.946 -12.166 1.00 0.00 H new ATOM 0 HA VAL A 109 12.919 -7.971 -12.377 1.00 0.00 H new ATOM 0 HB VAL A 109 12.075 -8.173 -14.668 1.00 0.00 H new ATOM 0 HG11 VAL A 109 10.254 -9.766 -13.941 1.00 0.00 H new ATOM 0 HG12 VAL A 109 11.673 -9.868 -12.871 1.00 0.00 H new ATOM 0 HG13 VAL A 109 10.227 -8.974 -12.347 1.00 0.00 H new ATOM 0 HG21 VAL A 109 9.683 -7.703 -15.086 1.00 0.00 H new ATOM 0 HG22 VAL A 109 9.584 -6.860 -13.522 1.00 0.00 H new ATOM 0 HG23 VAL A 109 10.619 -6.213 -14.818 1.00 0.00 H new ATOM 1718 N ASP A 110 13.915 -6.332 -14.375 1.00 0.00 N ATOM 1719 CA ASP A 110 14.834 -5.348 -14.933 1.00 0.00 C ATOM 1720 C ASP A 110 15.675 -4.756 -13.788 1.00 0.00 C ATOM 1721 O ASP A 110 16.449 -5.487 -13.169 1.00 0.00 O ATOM 1722 CB ASP A 110 14.024 -4.343 -15.771 1.00 0.00 C ATOM 1723 CG ASP A 110 14.863 -3.185 -16.284 1.00 0.00 C ATOM 1724 OD1 ASP A 110 15.594 -3.392 -17.273 1.00 0.00 O ATOM 1725 OD2 ASP A 110 14.774 -2.126 -15.623 1.00 0.00 O ATOM 0 H ASP A 110 13.937 -7.234 -14.850 1.00 0.00 H new ATOM 0 HA ASP A 110 15.559 -5.778 -15.624 1.00 0.00 H new ATOM 0 HB2 ASP A 110 13.576 -4.863 -16.618 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.205 -3.952 -15.167 1.00 0.00 H new ATOM 1730 N GLY A 111 15.475 -3.486 -13.439 1.00 0.00 N ATOM 1731 CA GLY A 111 16.096 -2.825 -12.307 1.00 0.00 C ATOM 1732 C GLY A 111 15.127 -1.841 -11.655 1.00 0.00 C ATOM 1733 O GLY A 111 15.570 -0.890 -11.014 1.00 0.00 O ATOM 0 H GLY A 111 14.851 -2.871 -13.961 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.414 -3.568 -11.576 1.00 0.00 H new ATOM 0 HA3 GLY A 111 16.992 -2.297 -12.635 1.00 0.00 H new ATOM 1737 N LYS A 112 13.813 -2.053 -11.801 1.00 0.00 N ATOM 1738 CA LYS A 112 12.785 -1.185 -11.241 1.00 0.00 C ATOM 1739 C LYS A 112 11.544 -2.016 -10.950 1.00 0.00 C ATOM 1740 O LYS A 112 11.322 -3.048 -11.580 1.00 0.00 O ATOM 1741 CB LYS A 112 12.442 -0.031 -12.197 1.00 0.00 C ATOM 1742 CG LYS A 112 13.569 1.005 -12.269 1.00 0.00 C ATOM 1743 CD LYS A 112 13.095 2.288 -12.963 1.00 0.00 C ATOM 1744 CE LYS A 112 14.176 3.370 -12.826 1.00 0.00 C ATOM 1745 NZ LYS A 112 13.788 4.636 -13.480 1.00 0.00 N ATOM 0 H LYS A 112 13.435 -2.846 -12.320 1.00 0.00 H new ATOM 0 HA LYS A 112 13.162 -0.743 -10.319 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.251 -0.430 -13.193 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.524 0.454 -11.866 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.917 1.239 -11.263 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.418 0.587 -12.811 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.892 2.092 -14.016 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.162 2.632 -12.518 1.00 0.00 H new ATOM 0 HE2 LYS A 112 14.371 3.554 -11.769 1.00 0.00 H new ATOM 0 HE3 LYS A 112 15.107 3.008 -13.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.380 5.410 -13.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.922 4.551 -14.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 12.788 4.839 -13.277 1.00 0.00 H new ATOM 1759 N LEU A 113 10.747 -1.566 -9.981 1.00 0.00 N ATOM 1760 CA LEU A 113 9.504 -2.212 -9.621 1.00 0.00 C ATOM 1761 C LEU A 113 8.382 -1.602 -10.442 1.00 0.00 C ATOM 1762 O LEU A 113 8.159 -0.396 -10.370 1.00 0.00 O ATOM 1763 CB LEU A 113 9.265 -2.105 -8.117 1.00 0.00 C ATOM 1764 CG LEU A 113 8.062 -2.968 -7.693 1.00 0.00 C ATOM 1765 CD1 LEU A 113 8.456 -3.885 -6.537 1.00 0.00 C ATOM 1766 CD2 LEU A 113 6.872 -2.096 -7.299 1.00 0.00 C ATOM 0 H LEU A 113 10.955 -0.736 -9.425 1.00 0.00 H new ATOM 0 HA LEU A 113 9.546 -3.277 -9.848 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.157 -2.426 -7.579 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.086 -1.065 -7.846 1.00 0.00 H new ATOM 0 HG LEU A 113 7.763 -3.579 -8.544 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.598 -4.491 -6.245 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.271 -4.537 -6.851 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.780 -3.282 -5.689 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.037 -2.732 -7.004 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.152 -1.454 -6.464 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.576 -1.479 -8.147 1.00 0.00 H new ATOM 1778 N ILE A 114 7.691 -2.425 -11.227 1.00 0.00 N ATOM 1779 CA ILE A 114 6.521 -2.015 -11.988 1.00 0.00 C ATOM 1780 C ILE A 114 5.312 -2.222 -11.083 1.00 0.00 C ATOM 1781 O ILE A 114 5.216 -3.271 -10.444 1.00 0.00 O ATOM 1782 CB ILE A 114 6.438 -2.815 -13.302 1.00 0.00 C ATOM 1783 CG1 ILE A 114 7.693 -2.524 -14.150 1.00 0.00 C ATOM 1784 CG2 ILE A 114 5.161 -2.444 -14.074 1.00 0.00 C ATOM 1785 CD1 ILE A 114 7.778 -3.372 -15.421 1.00 0.00 C ATOM 0 H ILE A 114 7.934 -3.408 -11.352 1.00 0.00 H new ATOM 0 HA ILE A 114 6.569 -0.967 -12.283 1.00 0.00 H new ATOM 0 HB ILE A 114 6.396 -3.881 -13.079 1.00 0.00 H new ATOM 0 HG12 ILE A 114 7.700 -1.469 -14.425 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.581 -2.701 -13.544 1.00 0.00 H new ATOM 0 HG21 ILE A 114 5.116 -3.017 -15.000 1.00 0.00 H new ATOM 0 HG22 ILE A 114 4.287 -2.672 -13.463 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.173 -1.379 -14.307 1.00 0.00 H new ATOM 0 HD11 ILE A 114 8.685 -3.116 -15.969 1.00 0.00 H new ATOM 0 HD12 ILE A 114 7.802 -4.428 -15.153 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.908 -3.177 -16.048 1.00 0.00 H new ATOM 1797 N LEU A 115 4.417 -1.227 -11.011 1.00 0.00 N ATOM 1798 CA LEU A 115 3.180 -1.295 -10.249 1.00 0.00 C ATOM 1799 C LEU A 115 2.015 -1.016 -11.200 1.00 0.00 C ATOM 1800 O LEU A 115 1.969 0.051 -11.808 1.00 0.00 O ATOM 1801 CB LEU A 115 3.217 -0.271 -9.108 1.00 0.00 C ATOM 1802 CG LEU A 115 2.026 -0.411 -8.143 1.00 0.00 C ATOM 1803 CD1 LEU A 115 2.302 -1.475 -7.080 1.00 0.00 C ATOM 1804 CD2 LEU A 115 1.757 0.925 -7.448 1.00 0.00 C ATOM 0 H LEU A 115 4.543 -0.337 -11.494 1.00 0.00 H new ATOM 0 HA LEU A 115 3.056 -2.283 -9.806 1.00 0.00 H new ATOM 0 HB2 LEU A 115 4.146 -0.388 -8.551 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.222 0.735 -9.528 1.00 0.00 H new ATOM 0 HG LEU A 115 1.156 -0.711 -8.727 1.00 0.00 H new ATOM 0 HD11 LEU A 115 1.444 -1.553 -6.412 1.00 0.00 H new ATOM 0 HD12 LEU A 115 2.474 -2.437 -7.564 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.185 -1.195 -6.506 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.913 0.817 -6.767 1.00 0.00 H new ATOM 0 HD22 LEU A 115 2.641 1.227 -6.886 1.00 0.00 H new ATOM 0 HD23 LEU A 115 1.526 1.684 -8.195 1.00 0.00 H new ATOM 1816 N THR A 116 1.068 -1.950 -11.325 1.00 0.00 N ATOM 1817 CA THR A 116 -0.111 -1.742 -12.166 1.00 0.00 C ATOM 1818 C THR A 116 -1.335 -1.617 -11.266 1.00 0.00 C ATOM 1819 O THR A 116 -1.746 -2.604 -10.656 1.00 0.00 O ATOM 1820 CB THR A 116 -0.270 -2.866 -13.202 1.00 0.00 C ATOM 1821 OG1 THR A 116 0.979 -3.169 -13.787 1.00 0.00 O ATOM 1822 CG2 THR A 116 -1.222 -2.454 -14.324 1.00 0.00 C ATOM 0 H THR A 116 1.096 -2.855 -10.855 1.00 0.00 H new ATOM 0 HA THR A 116 0.006 -0.821 -12.737 1.00 0.00 H new ATOM 0 HB THR A 116 -0.672 -3.733 -12.679 1.00 0.00 H new ATOM 0 HG1 THR A 116 0.867 -3.887 -14.444 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.314 -3.270 -15.041 1.00 0.00 H new ATOM 0 HG22 THR A 116 -2.202 -2.227 -13.905 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.830 -1.571 -14.828 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.889 -0.403 -11.182 1.00 0.00 N ATOM 1831 CA LEU A 117 -3.179 -0.119 -10.572 1.00 0.00 C ATOM 1832 C LEU A 117 -4.212 -0.235 -11.691 1.00 0.00 C ATOM 1833 O LEU A 117 -4.076 0.436 -12.719 1.00 0.00 O ATOM 1834 CB LEU A 117 -3.168 1.314 -10.004 1.00 0.00 C ATOM 1835 CG LEU A 117 -2.691 1.489 -8.553 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -3.851 1.335 -7.570 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -1.551 0.544 -8.178 1.00 0.00 C ATOM 0 H LEU A 117 -1.432 0.431 -11.550 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.406 -0.805 -9.756 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.534 1.927 -10.645 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -4.179 1.715 -10.078 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.298 2.503 -8.486 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.484 1.464 -6.552 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -4.609 2.089 -7.781 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -4.288 0.342 -7.676 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -1.260 0.718 -7.142 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.881 -0.488 -8.294 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.697 0.727 -8.830 1.00 0.00 H new ATOM 1849 N THR A 118 -5.241 -1.066 -11.528 1.00 0.00 N ATOM 1850 CA THR A 118 -6.330 -1.124 -12.493 1.00 0.00 C ATOM 1851 C THR A 118 -7.668 -1.308 -11.786 1.00 0.00 C ATOM 1852 O THR A 118 -7.786 -2.104 -10.855 1.00 0.00 O ATOM 1853 CB THR A 118 -6.054 -2.184 -13.564 1.00 0.00 C ATOM 1854 OG1 THR A 118 -4.750 -1.996 -14.067 1.00 0.00 O ATOM 1855 CG2 THR A 118 -7.012 -2.035 -14.744 1.00 0.00 C ATOM 0 H THR A 118 -5.340 -1.705 -10.739 1.00 0.00 H new ATOM 0 HA THR A 118 -6.392 -0.172 -13.020 1.00 0.00 H new ATOM 0 HB THR A 118 -6.179 -3.165 -13.106 1.00 0.00 H new ATOM 0 HG1 THR A 118 -4.563 -2.671 -14.752 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.793 -2.800 -15.489 1.00 0.00 H new ATOM 0 HG22 THR A 118 -8.039 -2.150 -14.396 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.889 -1.048 -15.190 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.657 -0.527 -12.230 1.00 0.00 N ATOM 1864 CA HIS A 119 -10.012 -0.453 -11.726 1.00 0.00 C ATOM 1865 C HIS A 119 -10.959 -0.380 -12.925 1.00 0.00 C ATOM 1866 O HIS A 119 -10.566 0.116 -13.979 1.00 0.00 O ATOM 1867 CB HIS A 119 -10.133 0.833 -10.905 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.495 1.068 -10.305 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.218 0.184 -9.516 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.213 2.225 -10.435 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.351 0.822 -9.160 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.374 2.051 -9.714 1.00 0.00 N ATOM 0 H HIS A 119 -8.510 0.114 -13.010 1.00 0.00 H new ATOM 0 HA HIS A 119 -10.258 -1.318 -11.110 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.396 0.807 -10.102 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.880 1.680 -11.542 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -11.945 -0.764 -9.256 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -11.926 3.103 -10.994 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.123 0.411 -8.527 1.00 0.00 H new ATOM 1881 N GLY A 120 -12.207 -0.820 -12.731 1.00 0.00 N ATOM 1882 CA GLY A 120 -13.274 -0.880 -13.728 1.00 0.00 C ATOM 1883 C GLY A 120 -13.222 0.193 -14.819 1.00 0.00 C ATOM 1884 O GLY A 120 -13.365 -0.129 -15.994 1.00 0.00 O ATOM 0 H GLY A 120 -12.514 -1.163 -11.821 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -13.246 -1.860 -14.205 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -14.232 -0.803 -13.214 1.00 0.00 H new ATOM 1888 N THR A 121 -13.046 1.464 -14.437 1.00 0.00 N ATOM 1889 CA THR A 121 -12.943 2.567 -15.386 1.00 0.00 C ATOM 1890 C THR A 121 -11.789 3.504 -15.002 1.00 0.00 C ATOM 1891 O THR A 121 -11.906 4.723 -15.087 1.00 0.00 O ATOM 1892 CB THR A 121 -14.323 3.239 -15.532 1.00 0.00 C ATOM 1893 OG1 THR A 121 -14.334 4.132 -16.626 1.00 0.00 O ATOM 1894 CG2 THR A 121 -14.799 3.964 -14.267 1.00 0.00 C ATOM 0 H THR A 121 -12.972 1.751 -13.461 1.00 0.00 H new ATOM 0 HA THR A 121 -12.679 2.209 -16.381 1.00 0.00 H new ATOM 0 HB THR A 121 -15.025 2.424 -15.708 1.00 0.00 H new ATOM 0 HG1 THR A 121 -13.559 4.729 -16.569 1.00 0.00 H new ATOM 0 HG21 THR A 121 -15.777 4.410 -14.450 1.00 0.00 H new ATOM 0 HG22 THR A 121 -14.873 3.252 -13.445 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.086 4.746 -14.006 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.649 2.942 -14.583 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.421 3.713 -14.414 1.00 0.00 C ATOM 1904 C ALA A 122 -8.225 2.763 -14.431 1.00 0.00 C ATOM 1905 O ALA A 122 -8.191 1.803 -13.665 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.455 4.543 -13.124 1.00 0.00 C ATOM 0 H ALA A 122 -10.556 1.952 -14.355 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.328 4.418 -15.240 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.526 5.105 -13.028 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.296 5.235 -13.159 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.567 3.879 -12.267 1.00 0.00 H new ATOM 1912 N VAL A 123 -7.248 3.027 -15.301 1.00 0.00 N ATOM 1913 CA VAL A 123 -6.008 2.272 -15.410 1.00 0.00 C ATOM 1914 C VAL A 123 -4.855 3.222 -15.097 1.00 0.00 C ATOM 1915 O VAL A 123 -4.829 4.344 -15.601 1.00 0.00 O ATOM 1916 CB VAL A 123 -5.896 1.632 -16.808 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -5.775 2.650 -17.953 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -4.711 0.657 -16.863 1.00 0.00 C ATOM 0 H VAL A 123 -7.304 3.797 -15.968 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.981 1.447 -14.698 1.00 0.00 H new ATOM 0 HB VAL A 123 -6.834 1.098 -16.960 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -5.701 2.121 -18.903 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -6.655 3.293 -17.963 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.883 3.259 -17.806 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -4.649 0.216 -17.858 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.788 1.194 -16.646 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -4.854 -0.132 -16.124 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.921 2.796 -14.244 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.790 3.597 -13.811 1.00 0.00 C ATOM 1930 C CYS A 124 -1.528 2.738 -13.752 1.00 0.00 C ATOM 1931 O CYS A 124 -1.373 1.930 -12.836 1.00 0.00 O ATOM 1932 CB CYS A 124 -3.114 4.222 -12.445 1.00 0.00 C ATOM 1933 SG CYS A 124 -1.592 4.661 -11.559 1.00 0.00 S ATOM 0 H CYS A 124 -3.936 1.864 -13.830 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.604 4.399 -14.525 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.729 5.111 -12.584 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.698 3.521 -11.849 1.00 0.00 H new ATOM 0 HG CYS A 124 -0.643 4.894 -12.416 1.00 0.00 H new ATOM 1939 N THR A 125 -0.571 3.015 -14.635 1.00 0.00 N ATOM 1940 CA THR A 125 0.806 2.624 -14.413 1.00 0.00 C ATOM 1941 C THR A 125 1.357 3.422 -13.231 1.00 0.00 C ATOM 1942 O THR A 125 0.985 4.582 -13.012 1.00 0.00 O ATOM 1943 CB THR A 125 1.615 2.920 -15.680 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.294 4.212 -16.150 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.292 1.932 -16.799 1.00 0.00 C ATOM 0 H THR A 125 -0.732 3.511 -15.512 1.00 0.00 H new ATOM 0 HA THR A 125 0.873 1.559 -14.189 1.00 0.00 H new ATOM 0 HB THR A 125 2.670 2.838 -15.420 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.812 4.404 -16.960 1.00 0.00 H new ATOM 0 HG21 THR A 125 1.885 2.174 -17.681 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.528 0.920 -16.470 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.232 1.996 -17.046 1.00 0.00 H new ATOM 1953 N ARG A 126 2.195 2.777 -12.431 1.00 0.00 N ATOM 1954 CA ARG A 126 3.126 3.419 -11.535 1.00 0.00 C ATOM 1955 C ARG A 126 4.404 2.593 -11.653 1.00 0.00 C ATOM 1956 O ARG A 126 4.367 1.435 -12.072 1.00 0.00 O ATOM 1957 CB ARG A 126 2.584 3.370 -10.100 1.00 0.00 C ATOM 1958 CG ARG A 126 2.170 4.729 -9.520 1.00 0.00 C ATOM 1959 CD ARG A 126 1.618 4.495 -8.104 1.00 0.00 C ATOM 1960 NE ARG A 126 1.683 5.698 -7.257 1.00 0.00 N ATOM 1961 CZ ARG A 126 2.018 5.673 -5.954 1.00 0.00 C ATOM 1962 NH1 ARG A 126 2.070 4.512 -5.298 1.00 0.00 N ATOM 1963 NH2 ARG A 126 2.327 6.803 -5.313 1.00 0.00 N ATOM 0 H ARG A 126 2.241 1.759 -12.392 1.00 0.00 H new ATOM 0 HA ARG A 126 3.292 4.468 -11.779 1.00 0.00 H new ATOM 0 HB2 ARG A 126 1.722 2.703 -10.075 1.00 0.00 H new ATOM 0 HB3 ARG A 126 3.345 2.932 -9.454 1.00 0.00 H new ATOM 0 HG2 ARG A 126 3.024 5.406 -9.489 1.00 0.00 H new ATOM 0 HG3 ARG A 126 1.415 5.198 -10.151 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.583 4.162 -8.174 1.00 0.00 H new ATOM 0 HD3 ARG A 126 2.180 3.691 -7.629 1.00 0.00 H new ATOM 0 HE ARG A 126 1.462 6.599 -7.681 1.00 0.00 H new ATOM 0 HH11 ARG A 126 1.856 3.641 -5.784 1.00 0.00 H new ATOM 0 HH12 ARG A 126 2.324 4.495 -4.310 1.00 0.00 H new ATOM 0 HH21 ARG A 126 2.310 7.693 -5.811 1.00 0.00 H new ATOM 0 HH22 ARG A 126 2.580 6.776 -4.325 1.00 0.00 H new ATOM 1977 N THR A 127 5.532 3.147 -11.225 1.00 0.00 N ATOM 1978 CA THR A 127 6.752 2.380 -11.111 1.00 0.00 C ATOM 1979 C THR A 127 7.545 3.000 -9.969 1.00 0.00 C ATOM 1980 O THR A 127 7.464 4.210 -9.731 1.00 0.00 O ATOM 1981 CB THR A 127 7.491 2.292 -12.468 1.00 0.00 C ATOM 1982 OG1 THR A 127 7.955 0.986 -12.701 1.00 0.00 O ATOM 1983 CG2 THR A 127 8.727 3.175 -12.576 1.00 0.00 C ATOM 0 H THR A 127 5.620 4.126 -10.953 1.00 0.00 H new ATOM 0 HA THR A 127 6.569 1.334 -10.867 1.00 0.00 H new ATOM 0 HB THR A 127 6.743 2.622 -13.189 1.00 0.00 H new ATOM 0 HG1 THR A 127 8.099 0.532 -11.844 1.00 0.00 H new ATOM 0 HG21 THR A 127 9.180 3.049 -13.559 1.00 0.00 H new ATOM 0 HG22 THR A 127 8.442 4.218 -12.439 1.00 0.00 H new ATOM 0 HG23 THR A 127 9.445 2.891 -11.807 1.00 0.00 H new ATOM 1991 N TYR A 128 8.258 2.151 -9.240 1.00 0.00 N ATOM 1992 CA TYR A 128 9.081 2.506 -8.111 1.00 0.00 C ATOM 1993 C TYR A 128 10.493 1.975 -8.349 1.00 0.00 C ATOM 1994 O TYR A 128 10.725 1.105 -9.187 1.00 0.00 O ATOM 1995 CB TYR A 128 8.491 1.907 -6.832 1.00 0.00 C ATOM 1996 CG TYR A 128 7.312 2.646 -6.218 1.00 0.00 C ATOM 1997 CD1 TYR A 128 7.555 3.651 -5.264 1.00 0.00 C ATOM 1998 CD2 TYR A 128 6.000 2.164 -6.383 1.00 0.00 C ATOM 1999 CE1 TYR A 128 6.519 4.156 -4.465 1.00 0.00 C ATOM 2000 CE2 TYR A 128 4.964 2.654 -5.568 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.223 3.640 -4.602 1.00 0.00 C ATOM 2002 OH TYR A 128 4.220 4.054 -3.774 1.00 0.00 O ATOM 0 H TYR A 128 8.273 1.150 -9.437 1.00 0.00 H new ATOM 0 HA TYR A 128 9.116 3.589 -7.997 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.179 0.885 -7.046 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.283 1.848 -6.086 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.556 4.040 -5.145 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.789 1.418 -7.135 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.719 4.938 -3.748 1.00 0.00 H new ATOM 0 HE2 TYR A 128 3.962 2.269 -5.686 1.00 0.00 H new ATOM 0 HH TYR A 128 4.562 4.132 -2.859 1.00 0.00 H new ATOM 2012 N GLU A 129 11.430 2.520 -7.585 1.00 0.00 N ATOM 2013 CA GLU A 129 12.852 2.282 -7.650 1.00 0.00 C ATOM 2014 C GLU A 129 13.257 1.846 -6.244 1.00 0.00 C ATOM 2015 O GLU A 129 13.283 2.667 -5.327 1.00 0.00 O ATOM 2016 CB GLU A 129 13.459 3.626 -8.055 1.00 0.00 C ATOM 2017 CG GLU A 129 14.966 3.655 -8.291 1.00 0.00 C ATOM 2018 CD GLU A 129 15.377 5.115 -8.360 1.00 0.00 C ATOM 2019 OE1 GLU A 129 15.501 5.709 -7.264 1.00 0.00 O ATOM 2020 OE2 GLU A 129 15.446 5.664 -9.478 1.00 0.00 O ATOM 0 H GLU A 129 11.191 3.188 -6.852 1.00 0.00 H new ATOM 0 HA GLU A 129 13.177 1.518 -8.356 1.00 0.00 H new ATOM 0 HB2 GLU A 129 12.965 3.961 -8.967 1.00 0.00 H new ATOM 0 HB3 GLU A 129 13.222 4.354 -7.279 1.00 0.00 H new ATOM 0 HG2 GLU A 129 15.492 3.144 -7.485 1.00 0.00 H new ATOM 0 HG3 GLU A 129 15.221 3.138 -9.216 1.00 0.00 H new ATOM 2027 N LYS A 130 13.481 0.545 -6.040 1.00 0.00 N ATOM 2028 CA LYS A 130 13.814 0.027 -4.722 1.00 0.00 C ATOM 2029 C LYS A 130 15.287 0.305 -4.424 1.00 0.00 C ATOM 2030 O LYS A 130 16.159 -0.322 -5.019 1.00 0.00 O ATOM 2031 CB LYS A 130 13.433 -1.457 -4.599 1.00 0.00 C ATOM 2032 CG LYS A 130 13.436 -1.897 -3.126 1.00 0.00 C ATOM 2033 CD LYS A 130 14.750 -2.538 -2.666 1.00 0.00 C ATOM 2034 CE LYS A 130 14.734 -4.058 -2.879 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.764 -4.732 -2.070 1.00 0.00 N ATOM 0 H LYS A 130 13.437 -0.163 -6.773 1.00 0.00 H new ATOM 0 HA LYS A 130 13.227 0.542 -3.962 1.00 0.00 H new ATOM 0 HB2 LYS A 130 12.446 -1.621 -5.031 1.00 0.00 H new ATOM 0 HB3 LYS A 130 14.135 -2.067 -5.168 1.00 0.00 H new ATOM 0 HG2 LYS A 130 13.228 -1.030 -2.499 1.00 0.00 H new ATOM 0 HG3 LYS A 130 12.624 -2.606 -2.968 1.00 0.00 H new ATOM 0 HD2 LYS A 130 15.583 -2.100 -3.216 1.00 0.00 H new ATOM 0 HD3 LYS A 130 14.915 -2.318 -1.611 1.00 0.00 H new ATOM 0 HE2 LYS A 130 13.751 -4.452 -2.619 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.897 -4.279 -3.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 15.679 -5.762 -2.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 16.707 -4.424 -2.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 15.634 -4.486 -1.068 1.00 0.00 H new ATOM 2049 N GLN A 131 15.566 1.236 -3.506 1.00 0.00 N ATOM 2050 CA GLN A 131 16.928 1.685 -3.237 1.00 0.00 C ATOM 2051 C GLN A 131 17.823 0.538 -2.763 1.00 0.00 C ATOM 2052 O GLN A 131 18.888 0.295 -3.325 1.00 0.00 O ATOM 2053 CB GLN A 131 16.924 2.837 -2.216 1.00 0.00 C ATOM 2054 CG GLN A 131 17.355 4.173 -2.830 1.00 0.00 C ATOM 2055 CD GLN A 131 16.345 4.720 -3.833 1.00 0.00 C ATOM 2056 OE1 GLN A 131 15.377 5.362 -3.442 1.00 0.00 O ATOM 2057 NE2 GLN A 131 16.589 4.512 -5.124 1.00 0.00 N ATOM 0 H GLN A 131 14.857 1.694 -2.934 1.00 0.00 H new ATOM 0 HA GLN A 131 17.345 2.052 -4.175 1.00 0.00 H new ATOM 0 HB2 GLN A 131 15.924 2.941 -1.796 1.00 0.00 H new ATOM 0 HB3 GLN A 131 17.592 2.588 -1.391 1.00 0.00 H new ATOM 0 HG2 GLN A 131 17.500 4.903 -2.034 1.00 0.00 H new ATOM 0 HG3 GLN A 131 18.318 4.046 -3.325 1.00 0.00 H new ATOM 0 HE21 GLN A 131 17.406 3.972 -5.408 1.00 0.00 H new ATOM 0 HE22 GLN A 131 15.959 4.893 -5.830 1.00 0.00 H new ATOM 2066 N ALA A 132 17.418 -0.147 -1.689 1.00 0.00 N ATOM 2067 CA ALA A 132 18.273 -1.138 -1.046 1.00 0.00 C ATOM 2068 C ALA A 132 18.674 -2.236 -2.032 1.00 0.00 C ATOM 2069 O ALA A 132 17.955 -3.223 -2.184 1.00 0.00 O ATOM 2070 CB ALA A 132 17.580 -1.703 0.198 1.00 0.00 C ATOM 2071 OXT ALA A 132 19.845 -2.120 -2.753 1.00 0.00 O ATOM 0 H ALA A 132 16.504 -0.031 -1.251 1.00 0.00 H new ATOM 0 HA ALA A 132 19.194 -0.655 -0.721 1.00 0.00 H new ATOM 0 HB1 ALA A 132 18.227 -2.442 0.671 1.00 0.00 H new ATOM 0 HB2 ALA A 132 17.378 -0.895 0.901 1.00 0.00 H new ATOM 0 HB3 ALA A 132 16.641 -2.175 -0.091 1.00 0.00 H new