USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1290 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: B 1 MET CE :methyl 146:sc= 0 (180deg=-0.675) USER MOD Set 1.2: B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 49 GLN : amide:sc= -1.14 K(o=-3.3,f=-5.4!) USER MOD Set 2.2: A 50 ASN : amide:sc= -0.8 K(o=-3.3,f=-7.1) USER MOD Set 2.3: B 45 MET CE :methyl 171:sc= -0.209 (180deg=-0.317) USER MOD Set 2.4: B 49 GLN : amide:sc= -1.19 K(o=-3.3,f=-6.6!) USER MOD Set 3.1: A 1 MET CE :methyl -155:sc= -2.05 (180deg=-3.07!) USER MOD Set 3.2: A 6 LYS NZ :NH3+ 140:sc= -0.364 (180deg=-1.6!) USER MOD Single : A 1 MET N :NH3+ 178:sc= -0.151 (180deg=-0.16) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -154:sc= -0.172 (180deg=-0.654) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 161:sc= -0.372 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 23 THR OG1 : rot -110:sc= -1.49! USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot -61:sc= 0.423 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.0466 X(o=-0.047,f=-0.26) USER MOD Single : A 35 MET CE :methyl -167:sc= -1.58 (180deg=-2.32) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.144 USER MOD Single : A 45 MET CE :methyl 151:sc= -1.98 (180deg=-4.64!) USER MOD Single : A 51 LYS NZ :NH3+ -150:sc= -5.09! (180deg=-6.34!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.018) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -60:sc= 1.12 USER MOD Single : A 67 LYS NZ :NH3+ -158:sc= -0.0202 (180deg=-0.165) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -110:sc= 2.01 (180deg=-0.325) USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ -143:sc=-0.00176 (180deg=-1.15) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 150:sc= -0.355 (180deg=-0.6) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot -128:sc= 0.823 USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HD1:sc= -0.271 X(o=-0.27,f=-0.0023) USER MOD Single : B 23 THR OG1 : rot 100:sc= -1.4 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot 72:sc= 1.19 USER MOD Single : B 30 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= -0.217 X(o=-0.22,f=-0.044) USER MOD Single : B 35 MET CE :methyl -135:sc= -0.581 (180deg=-3.39!) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0.0843 USER MOD Single : B 50 ASN : amide:sc= -0.0098 K(o=-0.0098,f=-1) USER MOD Single : B 51 LYS NZ :NH3+ -143:sc= -6.87! (180deg=-10.7!) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 SER OG : rot 71:sc= 0.355 USER MOD Single : B 67 LYS NZ :NH3+ -159:sc= -0.0226 (180deg=-0.208) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.679 18.016 -10.198 1.00 0.00 N ATOM 2 CA MET A 1 7.239 18.532 -11.474 1.00 0.00 C ATOM 3 C MET A 1 8.675 18.062 -11.677 1.00 0.00 C ATOM 4 O MET A 1 9.625 18.800 -11.411 1.00 0.00 O ATOM 5 CB MET A 1 7.183 20.062 -11.448 1.00 0.00 C ATOM 6 CG MET A 1 7.131 20.693 -12.830 1.00 0.00 C ATOM 7 SD MET A 1 7.451 22.467 -12.796 1.00 0.00 S ATOM 8 CE MET A 1 5.787 23.114 -12.922 1.00 0.00 C ATOM 0 H1 MET A 1 5.713 18.380 -10.071 1.00 0.00 H new ATOM 0 H2 MET A 1 6.657 16.977 -10.224 1.00 0.00 H new ATOM 0 H3 MET A 1 7.274 18.330 -9.405 1.00 0.00 H new ATOM 0 HA MET A 1 6.648 18.147 -12.305 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.306 20.375 -10.881 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.057 20.440 -10.918 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.864 20.208 -13.474 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.150 20.513 -13.271 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.818 24.116 -13.350 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.191 22.464 -13.563 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.337 23.157 -11.930 1.00 0.00 H new ATOM 20 N VAL A 2 8.827 16.829 -12.149 1.00 0.00 N ATOM 21 CA VAL A 2 10.148 16.259 -12.389 1.00 0.00 C ATOM 22 C VAL A 2 10.141 15.361 -13.621 1.00 0.00 C ATOM 23 O VAL A 2 10.881 14.380 -13.692 1.00 0.00 O ATOM 24 CB VAL A 2 10.638 15.445 -11.177 1.00 0.00 C ATOM 25 CG1 VAL A 2 10.978 16.368 -10.017 1.00 0.00 C ATOM 26 CG2 VAL A 2 9.593 14.418 -10.765 1.00 0.00 C ATOM 0 H VAL A 2 8.052 16.205 -12.373 1.00 0.00 H new ATOM 0 HA VAL A 2 10.829 17.094 -12.554 1.00 0.00 H new ATOM 0 HB VAL A 2 11.544 14.911 -11.463 1.00 0.00 H new ATOM 0 HG11 VAL A 2 11.322 15.775 -9.169 1.00 0.00 H new ATOM 0 HG12 VAL A 2 11.765 17.059 -10.320 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.091 16.932 -9.729 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.957 13.853 -9.907 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.668 14.928 -10.497 1.00 0.00 H new ATOM 0 HG23 VAL A 2 9.405 13.737 -11.595 1.00 0.00 H new ATOM 36 N GLU A 3 9.298 15.704 -14.590 1.00 0.00 N ATOM 37 CA GLU A 3 9.192 14.932 -15.822 1.00 0.00 C ATOM 38 C GLU A 3 8.758 15.819 -16.984 1.00 0.00 C ATOM 39 O GLU A 3 9.499 15.999 -17.950 1.00 0.00 O ATOM 40 CB GLU A 3 8.197 13.784 -15.643 1.00 0.00 C ATOM 41 CG GLU A 3 8.567 12.531 -16.421 1.00 0.00 C ATOM 42 CD GLU A 3 7.352 11.718 -16.827 1.00 0.00 C ATOM 43 OE1 GLU A 3 7.459 10.474 -16.871 1.00 0.00 O ATOM 44 OE2 GLU A 3 6.296 12.324 -17.100 1.00 0.00 O ATOM 0 H GLU A 3 8.678 16.513 -14.545 1.00 0.00 H new ATOM 0 HA GLU A 3 10.175 14.521 -16.050 1.00 0.00 H new ATOM 0 HB2 GLU A 3 8.127 13.537 -14.584 1.00 0.00 H new ATOM 0 HB3 GLU A 3 7.209 14.119 -15.958 1.00 0.00 H new ATOM 0 HG2 GLU A 3 9.126 12.813 -17.313 1.00 0.00 H new ATOM 0 HG3 GLU A 3 9.228 11.912 -15.814 1.00 0.00 H new ATOM 51 N SER A 4 7.554 16.370 -16.883 1.00 0.00 N ATOM 52 CA SER A 4 7.021 17.240 -17.927 1.00 0.00 C ATOM 53 C SER A 4 5.716 17.891 -17.481 1.00 0.00 C ATOM 54 O SER A 4 4.781 17.210 -17.062 1.00 0.00 O ATOM 55 CB SER A 4 6.794 16.445 -19.213 1.00 0.00 C ATOM 56 OG SER A 4 6.306 17.279 -20.249 1.00 0.00 O ATOM 0 H SER A 4 6.928 16.231 -16.090 1.00 0.00 H new ATOM 0 HA SER A 4 7.751 18.027 -18.117 1.00 0.00 H new ATOM 0 HB2 SER A 4 7.729 15.980 -19.526 1.00 0.00 H new ATOM 0 HB3 SER A 4 6.084 15.639 -19.026 1.00 0.00 H new ATOM 0 HG SER A 4 6.171 16.747 -21.061 1.00 0.00 H new ATOM 62 N LYS A 5 5.662 19.217 -17.575 1.00 0.00 N ATOM 63 CA LYS A 5 4.471 19.965 -17.184 1.00 0.00 C ATOM 64 C LYS A 5 4.201 19.820 -15.688 1.00 0.00 C ATOM 65 O LYS A 5 4.518 20.712 -14.902 1.00 0.00 O ATOM 66 CB LYS A 5 3.257 19.493 -17.988 1.00 0.00 C ATOM 67 CG LYS A 5 2.834 20.465 -19.079 1.00 0.00 C ATOM 68 CD LYS A 5 1.526 21.159 -18.734 1.00 0.00 C ATOM 69 CE LYS A 5 1.119 22.149 -19.813 1.00 0.00 C ATOM 70 NZ LYS A 5 -0.022 23.003 -19.382 1.00 0.00 N ATOM 0 H LYS A 5 6.429 19.795 -17.918 1.00 0.00 H new ATOM 0 HA LYS A 5 4.648 21.019 -17.399 1.00 0.00 H new ATOM 0 HB2 LYS A 5 3.485 18.528 -18.441 1.00 0.00 H new ATOM 0 HB3 LYS A 5 2.420 19.336 -17.308 1.00 0.00 H new ATOM 0 HG2 LYS A 5 3.615 21.211 -19.225 1.00 0.00 H new ATOM 0 HG3 LYS A 5 2.725 19.929 -20.022 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.740 20.414 -18.607 1.00 0.00 H new ATOM 0 HD3 LYS A 5 1.629 21.679 -17.782 1.00 0.00 H new ATOM 0 HE2 LYS A 5 1.970 22.781 -20.065 1.00 0.00 H new ATOM 0 HE3 LYS A 5 0.845 21.607 -20.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -0.269 23.664 -20.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -0.843 22.402 -19.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 0.248 23.540 -18.533 1.00 0.00 H new ATOM 84 N LYS A 6 3.614 18.691 -15.303 1.00 0.00 N ATOM 85 CA LYS A 6 3.303 18.431 -13.903 1.00 0.00 C ATOM 86 C LYS A 6 3.519 16.960 -13.561 1.00 0.00 C ATOM 87 O LYS A 6 3.950 16.174 -14.405 1.00 0.00 O ATOM 88 CB LYS A 6 1.858 18.834 -13.595 1.00 0.00 C ATOM 89 CG LYS A 6 1.711 19.647 -12.319 1.00 0.00 C ATOM 90 CD LYS A 6 2.599 20.882 -12.337 1.00 0.00 C ATOM 91 CE LYS A 6 3.827 20.701 -11.459 1.00 0.00 C ATOM 92 NZ LYS A 6 3.701 21.431 -10.166 1.00 0.00 N ATOM 0 H LYS A 6 3.345 17.942 -15.941 1.00 0.00 H new ATOM 0 HA LYS A 6 3.977 19.029 -13.290 1.00 0.00 H new ATOM 0 HB2 LYS A 6 1.465 19.412 -14.431 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.248 17.934 -13.515 1.00 0.00 H new ATOM 0 HG2 LYS A 6 0.671 19.948 -12.196 1.00 0.00 H new ATOM 0 HG3 LYS A 6 1.967 19.027 -11.460 1.00 0.00 H new ATOM 0 HD2 LYS A 6 2.910 21.092 -13.360 1.00 0.00 H new ATOM 0 HD3 LYS A 6 2.029 21.745 -11.993 1.00 0.00 H new ATOM 0 HE2 LYS A 6 3.979 19.640 -11.263 1.00 0.00 H new ATOM 0 HE3 LYS A 6 4.709 21.056 -11.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 4.089 20.847 -9.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 4.228 22.326 -10.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 2.698 21.630 -9.976 1.00 0.00 H new ATOM 106 N ILE A 7 3.220 16.596 -12.318 1.00 0.00 N ATOM 107 CA ILE A 7 3.383 15.219 -11.867 1.00 0.00 C ATOM 108 C ILE A 7 2.529 14.264 -12.691 1.00 0.00 C ATOM 109 O ILE A 7 1.308 14.220 -12.541 1.00 0.00 O ATOM 110 CB ILE A 7 3.011 15.068 -10.380 1.00 0.00 C ATOM 111 CG1 ILE A 7 3.688 16.158 -9.545 1.00 0.00 C ATOM 112 CG2 ILE A 7 3.398 13.685 -9.876 1.00 0.00 C ATOM 113 CD1 ILE A 7 2.753 17.275 -9.135 1.00 0.00 C ATOM 0 H ILE A 7 2.864 17.234 -11.606 1.00 0.00 H new ATOM 0 HA ILE A 7 4.435 14.966 -12.000 1.00 0.00 H new ATOM 0 HB ILE A 7 1.932 15.181 -10.278 1.00 0.00 H new ATOM 0 HG12 ILE A 7 4.115 15.706 -8.650 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.516 16.579 -10.115 1.00 0.00 H new ATOM 0 HG21 ILE A 7 3.129 13.593 -8.824 1.00 0.00 H new ATOM 0 HG22 ILE A 7 2.870 12.926 -10.453 1.00 0.00 H new ATOM 0 HG23 ILE A 7 4.473 13.544 -9.989 1.00 0.00 H new ATOM 0 HD11 ILE A 7 3.301 18.011 -8.546 1.00 0.00 H new ATOM 0 HD12 ILE A 7 2.345 17.753 -10.025 1.00 0.00 H new ATOM 0 HD13 ILE A 7 1.938 16.866 -8.537 1.00 0.00 H new ATOM 125 N ALA A 8 3.179 13.498 -13.562 1.00 0.00 N ATOM 126 CA ALA A 8 2.478 12.541 -14.410 1.00 0.00 C ATOM 127 C ALA A 8 2.192 11.246 -13.656 1.00 0.00 C ATOM 128 O ALA A 8 2.397 11.163 -12.445 1.00 0.00 O ATOM 129 CB ALA A 8 3.288 12.258 -15.667 1.00 0.00 C ATOM 0 H ALA A 8 4.190 13.522 -13.699 1.00 0.00 H new ATOM 0 HA ALA A 8 1.523 12.979 -14.699 1.00 0.00 H new ATOM 0 HB1 ALA A 8 2.753 11.542 -16.291 1.00 0.00 H new ATOM 0 HB2 ALA A 8 3.434 13.185 -16.222 1.00 0.00 H new ATOM 0 HB3 ALA A 8 4.258 11.844 -15.390 1.00 0.00 H new ATOM 135 N LYS A 9 1.711 10.239 -14.379 1.00 0.00 N ATOM 136 CA LYS A 9 1.390 8.950 -13.778 1.00 0.00 C ATOM 137 C LYS A 9 1.165 7.889 -14.849 1.00 0.00 C ATOM 138 O LYS A 9 0.457 8.124 -15.828 1.00 0.00 O ATOM 139 CB LYS A 9 0.145 9.076 -12.911 1.00 0.00 C ATOM 140 CG LYS A 9 -1.042 9.552 -13.698 1.00 0.00 C ATOM 141 CD LYS A 9 -1.954 10.443 -12.870 1.00 0.00 C ATOM 142 CE LYS A 9 -2.615 11.513 -13.722 1.00 0.00 C ATOM 143 NZ LYS A 9 -4.093 11.535 -13.538 1.00 0.00 N ATOM 0 H LYS A 9 1.535 10.292 -15.382 1.00 0.00 H new ATOM 0 HA LYS A 9 2.234 8.643 -13.160 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -0.082 8.110 -12.460 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.341 9.771 -12.094 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.699 10.100 -14.576 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.606 8.692 -14.059 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.720 9.834 -12.390 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -1.378 10.915 -12.074 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -2.203 12.488 -13.464 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -2.382 11.336 -14.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -4.506 12.278 -14.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.490 10.613 -13.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -4.316 11.729 -12.541 1.00 0.00 H new ATOM 157 N LYS A 10 1.761 6.716 -14.656 1.00 0.00 N ATOM 158 CA LYS A 10 1.609 5.622 -15.604 1.00 0.00 C ATOM 159 C LYS A 10 0.961 4.426 -14.913 1.00 0.00 C ATOM 160 O LYS A 10 1.351 4.060 -13.810 1.00 0.00 O ATOM 161 CB LYS A 10 2.974 5.234 -16.182 1.00 0.00 C ATOM 162 CG LYS A 10 3.695 6.384 -16.867 1.00 0.00 C ATOM 163 CD LYS A 10 5.151 6.468 -16.433 1.00 0.00 C ATOM 164 CE LYS A 10 6.035 7.011 -17.544 1.00 0.00 C ATOM 165 NZ LYS A 10 6.052 6.111 -18.729 1.00 0.00 N ATOM 0 H LYS A 10 2.352 6.501 -13.853 1.00 0.00 H new ATOM 0 HA LYS A 10 0.966 5.944 -16.423 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.603 4.849 -15.379 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.839 4.423 -16.898 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.644 6.255 -17.948 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.190 7.322 -16.634 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.233 7.109 -15.555 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.501 5.479 -16.139 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.679 7.997 -17.842 1.00 0.00 H new ATOM 0 HE3 LYS A 10 7.051 7.138 -17.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 6.941 6.244 -19.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 5.979 5.122 -18.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 5.248 6.337 -19.348 1.00 0.00 H new ATOM 179 N LYS A 11 -0.035 3.818 -15.546 1.00 0.00 N ATOM 180 CA LYS A 11 -0.702 2.676 -14.930 1.00 0.00 C ATOM 181 C LYS A 11 0.287 1.541 -14.738 1.00 0.00 C ATOM 182 O LYS A 11 0.707 0.893 -15.697 1.00 0.00 O ATOM 183 CB LYS A 11 -1.890 2.208 -15.774 1.00 0.00 C ATOM 184 CG LYS A 11 -3.176 2.981 -15.508 1.00 0.00 C ATOM 185 CD LYS A 11 -2.941 4.484 -15.488 1.00 0.00 C ATOM 186 CE LYS A 11 -2.588 5.013 -16.867 1.00 0.00 C ATOM 187 NZ LYS A 11 -3.753 5.658 -17.531 1.00 0.00 N ATOM 0 H LYS A 11 -0.392 4.087 -16.463 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.084 2.987 -13.958 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.633 2.301 -16.829 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.067 1.150 -15.581 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.911 2.739 -16.276 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.598 2.667 -14.553 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -3.836 4.988 -15.122 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -2.136 4.718 -14.791 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -1.775 5.733 -16.782 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -2.225 4.194 -17.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -3.469 6.005 -18.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -4.521 4.964 -17.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -4.084 6.456 -16.952 1.00 0.00 H new ATOM 201 N THR A 12 0.669 1.315 -13.486 1.00 0.00 N ATOM 202 CA THR A 12 1.622 0.271 -13.159 1.00 0.00 C ATOM 203 C THR A 12 0.944 -0.879 -12.426 1.00 0.00 C ATOM 204 O THR A 12 -0.013 -0.669 -11.683 1.00 0.00 O ATOM 205 CB THR A 12 2.762 0.836 -12.309 1.00 0.00 C ATOM 206 OG1 THR A 12 3.163 2.107 -12.791 1.00 0.00 O ATOM 207 CG2 THR A 12 3.986 -0.053 -12.281 1.00 0.00 C ATOM 0 H THR A 12 0.330 1.844 -12.682 1.00 0.00 H new ATOM 0 HA THR A 12 2.033 -0.113 -14.093 1.00 0.00 H new ATOM 0 HB THR A 12 2.362 0.905 -11.297 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.660 2.580 -12.091 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.756 0.407 -11.661 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.720 -1.026 -11.867 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.366 -0.181 -13.295 1.00 0.00 H new ATOM 215 N THR A 13 1.437 -2.097 -12.637 1.00 0.00 N ATOM 216 CA THR A 13 0.855 -3.265 -11.986 1.00 0.00 C ATOM 217 C THR A 13 1.760 -3.832 -10.907 1.00 0.00 C ATOM 218 O THR A 13 2.975 -3.932 -11.078 1.00 0.00 O ATOM 219 CB THR A 13 0.565 -4.376 -12.989 1.00 0.00 C ATOM 220 OG1 THR A 13 0.420 -3.859 -14.299 1.00 0.00 O ATOM 221 CG2 THR A 13 -0.685 -5.156 -12.651 1.00 0.00 C ATOM 0 H THR A 13 2.229 -2.299 -13.247 1.00 0.00 H new ATOM 0 HA THR A 13 -0.073 -2.918 -11.532 1.00 0.00 H new ATOM 0 HB THR A 13 1.423 -5.047 -12.938 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.236 -4.593 -14.922 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.842 -5.933 -13.399 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.573 -5.615 -11.669 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.542 -4.483 -12.642 1.00 0.00 H new ATOM 229 N LEU A 14 1.135 -4.248 -9.821 1.00 0.00 N ATOM 230 CA LEU A 14 1.829 -4.863 -8.708 1.00 0.00 C ATOM 231 C LEU A 14 1.040 -6.083 -8.260 1.00 0.00 C ATOM 232 O LEU A 14 -0.172 -5.999 -8.071 1.00 0.00 O ATOM 233 CB LEU A 14 1.984 -3.879 -7.545 1.00 0.00 C ATOM 234 CG LEU A 14 2.422 -2.456 -7.919 1.00 0.00 C ATOM 235 CD1 LEU A 14 2.802 -1.683 -6.667 1.00 0.00 C ATOM 236 CD2 LEU A 14 3.583 -2.473 -8.907 1.00 0.00 C ATOM 0 H LEU A 14 0.127 -4.168 -9.687 1.00 0.00 H new ATOM 0 HA LEU A 14 2.829 -5.158 -9.027 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.032 -3.818 -7.018 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.711 -4.289 -6.843 1.00 0.00 H new ATOM 0 HG LEU A 14 1.582 -1.959 -8.404 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.111 -0.675 -6.942 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.943 -1.629 -5.998 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.624 -2.190 -6.162 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.868 -1.450 -9.151 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.433 -2.990 -8.461 1.00 0.00 H new ATOM 0 HD23 LEU A 14 3.279 -2.991 -9.816 1.00 0.00 H new ATOM 248 N ALA A 15 1.706 -7.223 -8.110 1.00 0.00 N ATOM 249 CA ALA A 15 1.001 -8.432 -7.711 1.00 0.00 C ATOM 250 C ALA A 15 0.900 -8.540 -6.202 1.00 0.00 C ATOM 251 O ALA A 15 1.781 -9.085 -5.539 1.00 0.00 O ATOM 252 CB ALA A 15 1.705 -9.656 -8.276 1.00 0.00 C ATOM 0 H ALA A 15 2.710 -7.334 -8.255 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.011 -8.380 -8.113 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.170 -10.556 -7.972 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.724 -9.595 -9.364 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.726 -9.696 -7.897 1.00 0.00 H new ATOM 258 N PHE A 16 -0.213 -8.046 -5.682 1.00 0.00 N ATOM 259 CA PHE A 16 -0.505 -8.094 -4.266 1.00 0.00 C ATOM 260 C PHE A 16 -1.978 -7.873 -4.033 1.00 0.00 C ATOM 261 O PHE A 16 -2.727 -7.560 -4.952 1.00 0.00 O ATOM 262 CB PHE A 16 0.289 -7.065 -3.475 1.00 0.00 C ATOM 263 CG PHE A 16 1.772 -7.307 -3.479 1.00 0.00 C ATOM 264 CD1 PHE A 16 2.575 -6.774 -4.475 1.00 0.00 C ATOM 265 CD2 PHE A 16 2.362 -8.070 -2.484 1.00 0.00 C ATOM 266 CE1 PHE A 16 3.939 -6.998 -4.478 1.00 0.00 C ATOM 267 CE2 PHE A 16 3.725 -8.297 -2.482 1.00 0.00 C ATOM 268 CZ PHE A 16 4.515 -7.760 -3.479 1.00 0.00 C ATOM 0 H PHE A 16 -0.941 -7.598 -6.238 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.212 -9.083 -3.914 1.00 0.00 H new ATOM 0 HB2 PHE A 16 0.091 -6.074 -3.885 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -0.066 -7.060 -2.444 1.00 0.00 H new ATOM 0 HD1 PHE A 16 2.130 -6.177 -5.257 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.749 -8.492 -1.701 1.00 0.00 H new ATOM 0 HE1 PHE A 16 4.554 -6.578 -5.260 1.00 0.00 H new ATOM 0 HE2 PHE A 16 4.172 -8.894 -1.701 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.581 -7.935 -3.478 1.00 0.00 H new ATOM 278 N ASP A 17 -2.370 -8.011 -2.790 1.00 0.00 N ATOM 279 CA ASP A 17 -3.742 -7.805 -2.375 1.00 0.00 C ATOM 280 C ASP A 17 -3.985 -8.567 -1.113 1.00 0.00 C ATOM 281 O ASP A 17 -4.652 -8.094 -0.201 1.00 0.00 O ATOM 282 CB ASP A 17 -4.744 -8.235 -3.433 1.00 0.00 C ATOM 283 CG ASP A 17 -5.286 -7.060 -4.227 1.00 0.00 C ATOM 284 OD1 ASP A 17 -4.585 -6.031 -4.315 1.00 0.00 O ATOM 285 OD2 ASP A 17 -6.412 -7.169 -4.755 1.00 0.00 O ATOM 0 H ASP A 17 -1.743 -8.272 -2.029 1.00 0.00 H new ATOM 0 HA ASP A 17 -3.885 -6.736 -2.217 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.269 -8.942 -4.113 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.571 -8.759 -2.955 1.00 0.00 H new ATOM 290 N GLU A 18 -3.416 -9.748 -1.045 1.00 0.00 N ATOM 291 CA GLU A 18 -3.574 -10.545 0.142 1.00 0.00 C ATOM 292 C GLU A 18 -3.314 -9.670 1.368 1.00 0.00 C ATOM 293 O GLU A 18 -4.216 -9.396 2.169 1.00 0.00 O ATOM 294 CB GLU A 18 -2.617 -11.737 0.129 1.00 0.00 C ATOM 295 CG GLU A 18 -3.069 -12.891 1.011 1.00 0.00 C ATOM 296 CD GLU A 18 -2.214 -13.045 2.254 1.00 0.00 C ATOM 297 OE1 GLU A 18 -0.975 -13.128 2.115 1.00 0.00 O ATOM 298 OE2 GLU A 18 -2.783 -13.082 3.364 1.00 0.00 O ATOM 0 H GLU A 18 -2.851 -10.169 -1.783 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.591 -10.934 0.177 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.509 -12.094 -0.895 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.632 -11.405 0.456 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.107 -12.733 1.306 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.038 -13.817 0.436 1.00 0.00 H new ATOM 305 N ASP A 19 -2.077 -9.197 1.479 1.00 0.00 N ATOM 306 CA ASP A 19 -1.689 -8.336 2.588 1.00 0.00 C ATOM 307 C ASP A 19 -2.008 -6.876 2.304 1.00 0.00 C ATOM 308 O ASP A 19 -2.560 -6.183 3.156 1.00 0.00 O ATOM 309 CB ASP A 19 -0.199 -8.498 2.893 1.00 0.00 C ATOM 310 CG ASP A 19 0.065 -9.558 3.944 1.00 0.00 C ATOM 311 OD1 ASP A 19 -0.595 -9.518 5.004 1.00 0.00 O ATOM 312 OD2 ASP A 19 0.931 -10.425 3.709 1.00 0.00 O ATOM 0 H ASP A 19 -1.328 -9.395 0.816 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.269 -8.642 3.459 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.330 -8.759 1.977 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.205 -7.545 3.233 1.00 0.00 H new ATOM 317 N VAL A 20 -1.656 -6.401 1.115 1.00 0.00 N ATOM 318 CA VAL A 20 -1.918 -5.013 0.769 1.00 0.00 C ATOM 319 C VAL A 20 -3.416 -4.726 0.765 1.00 0.00 C ATOM 320 O VAL A 20 -3.848 -3.709 1.291 1.00 0.00 O ATOM 321 CB VAL A 20 -1.294 -4.613 -0.585 1.00 0.00 C ATOM 322 CG1 VAL A 20 0.168 -5.025 -0.639 1.00 0.00 C ATOM 323 CG2 VAL A 20 -2.058 -5.221 -1.744 1.00 0.00 C ATOM 0 H VAL A 20 -1.196 -6.947 0.387 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.441 -4.405 1.538 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.356 -3.528 -0.674 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.592 -4.735 -1.600 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.715 -4.530 0.163 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.246 -6.105 -0.519 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.594 -4.921 -2.683 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.040 -6.308 -1.662 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -3.091 -4.873 -1.722 1.00 0.00 H new ATOM 333 N TYR A 21 -4.215 -5.626 0.192 1.00 0.00 N ATOM 334 CA TYR A 21 -5.661 -5.423 0.168 1.00 0.00 C ATOM 335 C TYR A 21 -6.222 -5.471 1.583 1.00 0.00 C ATOM 336 O TYR A 21 -7.022 -4.613 1.960 1.00 0.00 O ATOM 337 CB TYR A 21 -6.383 -6.443 -0.725 1.00 0.00 C ATOM 338 CG TYR A 21 -7.676 -5.924 -1.310 1.00 0.00 C ATOM 339 CD1 TYR A 21 -8.882 -6.565 -1.059 1.00 0.00 C ATOM 340 CD2 TYR A 21 -7.691 -4.790 -2.113 1.00 0.00 C ATOM 341 CE1 TYR A 21 -10.067 -6.092 -1.591 1.00 0.00 C ATOM 342 CE2 TYR A 21 -8.872 -4.310 -2.649 1.00 0.00 C ATOM 343 CZ TYR A 21 -10.056 -4.965 -2.384 1.00 0.00 C ATOM 344 OH TYR A 21 -11.233 -4.491 -2.917 1.00 0.00 O ATOM 0 H TYR A 21 -3.893 -6.486 -0.253 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.840 -4.438 -0.262 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -5.718 -6.737 -1.537 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.591 -7.340 -0.143 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.894 -7.448 -0.438 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -6.765 -4.275 -2.322 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -10.996 -6.603 -1.386 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -8.867 -3.427 -3.271 1.00 0.00 H new ATOM 0 HH TYR A 21 -11.051 -3.689 -3.450 1.00 0.00 H new ATOM 354 N HIS A 22 -5.798 -6.455 2.384 1.00 0.00 N ATOM 355 CA HIS A 22 -6.285 -6.536 3.755 1.00 0.00 C ATOM 356 C HIS A 22 -5.771 -5.351 4.561 1.00 0.00 C ATOM 357 O HIS A 22 -6.524 -4.723 5.305 1.00 0.00 O ATOM 358 CB HIS A 22 -5.860 -7.851 4.412 1.00 0.00 C ATOM 359 CG HIS A 22 -6.962 -8.861 4.497 1.00 0.00 C ATOM 360 ND1 HIS A 22 -7.282 -9.717 3.464 1.00 0.00 N ATOM 361 CD2 HIS A 22 -7.822 -9.151 5.502 1.00 0.00 C ATOM 362 CE1 HIS A 22 -8.290 -10.488 3.830 1.00 0.00 C ATOM 363 NE2 HIS A 22 -8.636 -10.166 5.062 1.00 0.00 N ATOM 0 H HIS A 22 -5.138 -7.184 2.113 1.00 0.00 H new ATOM 0 HA HIS A 22 -7.374 -6.507 3.734 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -5.030 -8.277 3.849 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -5.490 -7.643 5.416 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -7.861 -8.673 6.470 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -8.753 -11.253 3.224 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -9.386 -10.600 5.600 1.00 0.00 H new ATOM 372 N THR A 23 -4.490 -5.033 4.398 1.00 0.00 N ATOM 373 CA THR A 23 -3.902 -3.904 5.104 1.00 0.00 C ATOM 374 C THR A 23 -4.548 -2.606 4.642 1.00 0.00 C ATOM 375 O THR A 23 -4.918 -1.756 5.452 1.00 0.00 O ATOM 376 CB THR A 23 -2.399 -3.832 4.878 1.00 0.00 C ATOM 377 OG1 THR A 23 -2.100 -3.764 3.496 1.00 0.00 O ATOM 378 CG2 THR A 23 -1.644 -5.009 5.458 1.00 0.00 C ATOM 0 H THR A 23 -3.846 -5.537 3.789 1.00 0.00 H new ATOM 0 HA THR A 23 -4.083 -4.046 6.169 1.00 0.00 H new ATOM 0 HB THR A 23 -2.076 -2.929 5.395 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.685 -4.604 3.209 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.579 -4.891 5.260 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.810 -5.053 6.534 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.999 -5.931 4.998 1.00 0.00 H new ATOM 386 N LEU A 24 -4.708 -2.467 3.327 1.00 0.00 N ATOM 387 CA LEU A 24 -5.340 -1.281 2.768 1.00 0.00 C ATOM 388 C LEU A 24 -6.723 -1.095 3.380 1.00 0.00 C ATOM 389 O LEU A 24 -7.297 -0.011 3.322 1.00 0.00 O ATOM 390 CB LEU A 24 -5.451 -1.381 1.243 1.00 0.00 C ATOM 391 CG LEU A 24 -4.379 -0.610 0.466 1.00 0.00 C ATOM 392 CD1 LEU A 24 -4.293 0.827 0.955 1.00 0.00 C ATOM 393 CD2 LEU A 24 -3.026 -1.291 0.594 1.00 0.00 C ATOM 0 H LEU A 24 -4.410 -3.156 2.637 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.718 -0.418 3.007 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.400 -2.432 0.958 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.432 -1.015 0.940 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.664 -0.603 -0.586 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.526 1.358 0.391 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.255 1.319 0.811 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.036 0.836 2.014 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.280 -0.726 0.035 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.737 -1.332 1.644 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.089 -2.303 0.195 1.00 0.00 H new ATOM 405 N LYS A 25 -7.256 -2.169 3.962 1.00 0.00 N ATOM 406 CA LYS A 25 -8.570 -2.126 4.574 1.00 0.00 C ATOM 407 C LYS A 25 -8.603 -1.217 5.798 1.00 0.00 C ATOM 408 O LYS A 25 -9.517 -0.404 5.937 1.00 0.00 O ATOM 409 CB LYS A 25 -9.033 -3.534 4.953 1.00 0.00 C ATOM 410 CG LYS A 25 -10.523 -3.629 5.237 1.00 0.00 C ATOM 411 CD LYS A 25 -11.350 -3.098 4.074 1.00 0.00 C ATOM 412 CE LYS A 25 -11.822 -1.675 4.329 1.00 0.00 C ATOM 413 NZ LYS A 25 -13.285 -1.526 4.093 1.00 0.00 N ATOM 0 H LYS A 25 -6.793 -3.076 4.019 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.254 -1.710 3.835 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.781 -4.220 4.144 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.482 -3.864 5.834 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.792 -4.667 5.431 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.759 -3.065 6.139 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.756 -3.127 3.161 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.212 -3.745 3.914 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.589 -1.394 5.356 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.278 -0.990 3.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.568 -0.542 4.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.504 -1.770 3.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.806 -2.161 4.731 1.00 0.00 H new ATOM 427 N LEU A 26 -7.614 -1.337 6.684 1.00 0.00 N ATOM 428 CA LEU A 26 -7.594 -0.484 7.870 1.00 0.00 C ATOM 429 C LEU A 26 -7.231 0.931 7.470 1.00 0.00 C ATOM 430 O LEU A 26 -7.874 1.890 7.884 1.00 0.00 O ATOM 431 CB LEU A 26 -6.623 -0.987 8.944 1.00 0.00 C ATOM 432 CG LEU A 26 -6.308 -2.476 8.901 1.00 0.00 C ATOM 433 CD1 LEU A 26 -5.164 -2.720 7.941 1.00 0.00 C ATOM 434 CD2 LEU A 26 -5.969 -2.993 10.292 1.00 0.00 C ATOM 0 H LEU A 26 -6.839 -1.996 6.608 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.593 -0.510 8.306 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.689 -0.433 8.851 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.038 -0.750 9.924 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.186 -3.019 8.551 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.937 -3.786 7.909 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.446 -2.379 6.945 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.284 -2.172 8.277 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.747 -4.059 10.240 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.100 -2.460 10.677 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.817 -2.831 10.957 1.00 0.00 H new ATOM 446 N VAL A 27 -6.201 1.045 6.645 1.00 0.00 N ATOM 447 CA VAL A 27 -5.752 2.346 6.163 1.00 0.00 C ATOM 448 C VAL A 27 -6.833 3.028 5.354 1.00 0.00 C ATOM 449 O VAL A 27 -7.055 4.226 5.490 1.00 0.00 O ATOM 450 CB VAL A 27 -4.490 2.247 5.290 1.00 0.00 C ATOM 451 CG1 VAL A 27 -3.253 2.656 6.064 1.00 0.00 C ATOM 452 CG2 VAL A 27 -4.332 0.862 4.746 1.00 0.00 C ATOM 0 H VAL A 27 -5.660 0.255 6.295 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.519 2.929 7.054 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.608 2.938 4.455 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.377 2.575 5.420 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.360 3.686 6.403 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.130 2.001 6.927 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.433 0.813 4.131 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.246 0.155 5.571 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.201 0.608 4.139 1.00 0.00 H new ATOM 462 N SER A 28 -7.499 2.276 4.490 1.00 0.00 N ATOM 463 CA SER A 28 -8.534 2.868 3.667 1.00 0.00 C ATOM 464 C SER A 28 -9.692 3.369 4.518 1.00 0.00 C ATOM 465 O SER A 28 -10.284 4.409 4.224 1.00 0.00 O ATOM 466 CB SER A 28 -9.037 1.881 2.613 1.00 0.00 C ATOM 467 OG SER A 28 -9.655 0.758 3.219 1.00 0.00 O ATOM 0 H SER A 28 -7.344 1.278 4.345 1.00 0.00 H new ATOM 0 HA SER A 28 -8.092 3.721 3.152 1.00 0.00 H new ATOM 0 HB2 SER A 28 -9.748 2.379 1.954 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.204 1.551 1.993 1.00 0.00 H new ATOM 0 HG SER A 28 -9.005 0.293 3.786 1.00 0.00 H new ATOM 473 N VAL A 29 -10.002 2.632 5.578 1.00 0.00 N ATOM 474 CA VAL A 29 -11.081 3.003 6.477 1.00 0.00 C ATOM 475 C VAL A 29 -10.615 4.088 7.438 1.00 0.00 C ATOM 476 O VAL A 29 -11.298 5.091 7.648 1.00 0.00 O ATOM 477 CB VAL A 29 -11.577 1.765 7.262 1.00 0.00 C ATOM 478 CG1 VAL A 29 -11.323 1.895 8.756 1.00 0.00 C ATOM 479 CG2 VAL A 29 -13.051 1.507 6.983 1.00 0.00 C ATOM 0 H VAL A 29 -9.518 1.772 5.834 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.910 3.393 5.886 1.00 0.00 H new ATOM 0 HB VAL A 29 -11.001 0.908 6.913 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.687 1.003 9.266 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -10.253 2.004 8.935 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.846 2.771 9.139 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.380 0.633 7.544 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.636 2.375 7.287 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.194 1.329 5.917 1.00 0.00 H new ATOM 489 N TYR A 30 -9.445 3.869 8.019 1.00 0.00 N ATOM 490 CA TYR A 30 -8.871 4.813 8.968 1.00 0.00 C ATOM 491 C TYR A 30 -8.381 6.075 8.265 1.00 0.00 C ATOM 492 O TYR A 30 -8.321 7.143 8.876 1.00 0.00 O ATOM 493 CB TYR A 30 -7.717 4.169 9.739 1.00 0.00 C ATOM 494 CG TYR A 30 -8.167 3.341 10.921 1.00 0.00 C ATOM 495 CD1 TYR A 30 -8.733 3.942 12.039 1.00 0.00 C ATOM 496 CD2 TYR A 30 -8.027 1.959 10.920 1.00 0.00 C ATOM 497 CE1 TYR A 30 -9.146 3.189 13.122 1.00 0.00 C ATOM 498 CE2 TYR A 30 -8.438 1.199 11.999 1.00 0.00 C ATOM 499 CZ TYR A 30 -8.996 1.818 13.097 1.00 0.00 C ATOM 500 OH TYR A 30 -9.406 1.065 14.173 1.00 0.00 O ATOM 0 H TYR A 30 -8.872 3.042 7.849 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.657 5.092 9.670 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -7.145 3.537 9.060 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -7.044 4.951 10.089 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -8.852 5.015 12.062 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -7.590 1.470 10.062 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -9.584 3.672 13.983 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -8.322 0.125 11.982 1.00 0.00 H new ATOM 0 HH TYR A 30 -9.231 0.117 13.995 1.00 0.00 H new ATOM 510 N LEU A 31 -8.029 5.961 6.985 1.00 0.00 N ATOM 511 CA LEU A 31 -7.551 7.116 6.238 1.00 0.00 C ATOM 512 C LEU A 31 -8.599 7.578 5.229 1.00 0.00 C ATOM 513 O LEU A 31 -8.391 8.561 4.518 1.00 0.00 O ATOM 514 CB LEU A 31 -6.237 6.797 5.506 1.00 0.00 C ATOM 515 CG LEU A 31 -5.156 6.030 6.298 1.00 0.00 C ATOM 516 CD1 LEU A 31 -3.783 6.629 6.034 1.00 0.00 C ATOM 517 CD2 LEU A 31 -5.441 6.018 7.795 1.00 0.00 C ATOM 0 H LEU A 31 -8.066 5.092 6.452 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.367 7.917 6.954 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.479 6.217 4.616 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.803 7.737 5.166 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.174 4.997 5.952 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.031 6.078 6.599 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.557 6.565 4.970 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.776 7.674 6.344 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.654 5.467 8.311 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.472 7.042 8.168 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.401 5.536 7.979 1.00 0.00 H new ATOM 529 N ASN A 32 -9.722 6.859 5.159 1.00 0.00 N ATOM 530 CA ASN A 32 -10.785 7.202 4.220 1.00 0.00 C ATOM 531 C ASN A 32 -10.199 7.399 2.829 1.00 0.00 C ATOM 532 O ASN A 32 -10.642 8.259 2.067 1.00 0.00 O ATOM 533 CB ASN A 32 -11.509 8.471 4.671 1.00 0.00 C ATOM 534 CG ASN A 32 -12.999 8.416 4.399 1.00 0.00 C ATOM 535 OD1 ASN A 32 -13.668 7.441 4.739 1.00 0.00 O ATOM 536 ND2 ASN A 32 -13.526 9.467 3.782 1.00 0.00 N ATOM 0 H ASN A 32 -9.915 6.042 5.738 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.506 6.385 4.192 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -11.343 8.621 5.738 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -11.081 9.332 4.158 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -14.524 9.488 3.572 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -12.933 10.254 3.518 1.00 0.00 H new ATOM 543 N ARG A 33 -9.180 6.605 2.521 1.00 0.00 N ATOM 544 CA ARG A 33 -8.501 6.695 1.234 1.00 0.00 C ATOM 545 C ARG A 33 -8.522 5.366 0.492 1.00 0.00 C ATOM 546 O ARG A 33 -8.369 4.304 1.094 1.00 0.00 O ATOM 547 CB ARG A 33 -7.052 7.137 1.443 1.00 0.00 C ATOM 548 CG ARG A 33 -6.919 8.574 1.921 1.00 0.00 C ATOM 549 CD ARG A 33 -5.755 9.283 1.245 1.00 0.00 C ATOM 550 NE ARG A 33 -5.731 10.711 1.554 1.00 0.00 N ATOM 551 CZ ARG A 33 -6.515 11.611 0.967 1.00 0.00 C ATOM 552 NH1 ARG A 33 -7.387 11.237 0.038 1.00 0.00 N ATOM 553 NH2 ARG A 33 -6.429 12.889 1.308 1.00 0.00 N ATOM 0 H ARG A 33 -8.806 5.891 3.146 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.033 7.429 0.629 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -6.580 6.476 2.170 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.507 7.022 0.506 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -7.843 9.114 1.715 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.776 8.587 3.001 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -4.818 8.827 1.564 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -5.825 9.147 0.166 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.074 11.037 2.262 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -7.458 10.255 -0.229 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -7.986 11.932 -0.409 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -5.761 13.183 2.021 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.030 13.579 0.857 1.00 0.00 H new ATOM 567 N ASP A 34 -8.690 5.432 -0.824 1.00 0.00 N ATOM 568 CA ASP A 34 -8.701 4.231 -1.649 1.00 0.00 C ATOM 569 C ASP A 34 -7.378 3.493 -1.490 1.00 0.00 C ATOM 570 O ASP A 34 -6.402 4.063 -1.004 1.00 0.00 O ATOM 571 CB ASP A 34 -8.937 4.590 -3.117 1.00 0.00 C ATOM 572 CG ASP A 34 -10.255 4.051 -3.639 1.00 0.00 C ATOM 573 OD1 ASP A 34 -10.614 2.911 -3.281 1.00 0.00 O ATOM 574 OD2 ASP A 34 -10.930 4.772 -4.405 1.00 0.00 O ATOM 0 H ASP A 34 -8.820 6.302 -1.341 1.00 0.00 H new ATOM 0 HA ASP A 34 -9.515 3.583 -1.323 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -8.920 5.674 -3.230 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.121 4.194 -3.721 1.00 0.00 H new ATOM 579 N MET A 35 -7.340 2.228 -1.891 1.00 0.00 N ATOM 580 CA MET A 35 -6.125 1.447 -1.772 1.00 0.00 C ATOM 581 C MET A 35 -4.984 2.121 -2.533 1.00 0.00 C ATOM 582 O MET A 35 -3.895 2.316 -1.993 1.00 0.00 O ATOM 583 CB MET A 35 -6.364 0.024 -2.283 1.00 0.00 C ATOM 584 CG MET A 35 -5.238 -0.509 -3.142 1.00 0.00 C ATOM 585 SD MET A 35 -5.364 -2.282 -3.445 1.00 0.00 S ATOM 586 CE MET A 35 -3.648 -2.773 -3.301 1.00 0.00 C ATOM 0 H MET A 35 -8.131 1.729 -2.297 1.00 0.00 H new ATOM 0 HA MET A 35 -5.840 1.389 -0.721 1.00 0.00 H new ATOM 0 HB2 MET A 35 -6.505 -0.640 -1.430 1.00 0.00 H new ATOM 0 HB3 MET A 35 -7.289 0.004 -2.859 1.00 0.00 H new ATOM 0 HG2 MET A 35 -5.235 0.018 -4.096 1.00 0.00 H new ATOM 0 HG3 MET A 35 -4.286 -0.295 -2.657 1.00 0.00 H new ATOM 0 HE1 MET A 35 -3.526 -3.786 -3.685 1.00 0.00 H new ATOM 0 HE2 MET A 35 -3.024 -2.089 -3.877 1.00 0.00 H new ATOM 0 HE3 MET A 35 -3.348 -2.743 -2.254 1.00 0.00 H new ATOM 596 N THR A 36 -5.246 2.483 -3.785 1.00 0.00 N ATOM 597 CA THR A 36 -4.244 3.145 -4.612 1.00 0.00 C ATOM 598 C THR A 36 -3.834 4.472 -3.980 1.00 0.00 C ATOM 599 O THR A 36 -2.651 4.799 -3.911 1.00 0.00 O ATOM 600 CB THR A 36 -4.782 3.378 -6.032 1.00 0.00 C ATOM 601 OG1 THR A 36 -6.104 2.884 -6.154 1.00 0.00 O ATOM 602 CG2 THR A 36 -3.949 2.723 -7.116 1.00 0.00 C ATOM 0 H THR A 36 -6.142 2.329 -4.248 1.00 0.00 H new ATOM 0 HA THR A 36 -3.369 2.499 -4.677 1.00 0.00 H new ATOM 0 HB THR A 36 -4.743 4.458 -6.175 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.430 3.043 -7.064 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.391 2.932 -8.090 1.00 0.00 H new ATOM 0 HG22 THR A 36 -2.934 3.120 -7.085 1.00 0.00 H new ATOM 0 HG23 THR A 36 -3.922 1.646 -6.953 1.00 0.00 H new ATOM 610 N GLU A 37 -4.821 5.227 -3.511 1.00 0.00 N ATOM 611 CA GLU A 37 -4.560 6.514 -2.877 1.00 0.00 C ATOM 612 C GLU A 37 -3.664 6.340 -1.656 1.00 0.00 C ATOM 613 O GLU A 37 -2.780 7.157 -1.401 1.00 0.00 O ATOM 614 CB GLU A 37 -5.873 7.185 -2.470 1.00 0.00 C ATOM 615 CG GLU A 37 -5.751 8.687 -2.272 1.00 0.00 C ATOM 616 CD GLU A 37 -5.478 9.425 -3.568 1.00 0.00 C ATOM 617 OE1 GLU A 37 -5.818 8.885 -4.641 1.00 0.00 O ATOM 618 OE2 GLU A 37 -4.925 10.544 -3.509 1.00 0.00 O ATOM 0 H GLU A 37 -5.807 4.971 -3.558 1.00 0.00 H new ATOM 0 HA GLU A 37 -4.047 7.151 -3.598 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.625 6.987 -3.234 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -6.232 6.733 -1.545 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -6.671 9.067 -1.828 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -4.947 8.893 -1.565 1.00 0.00 H new ATOM 625 N ILE A 38 -3.894 5.266 -0.906 1.00 0.00 N ATOM 626 CA ILE A 38 -3.106 4.981 0.287 1.00 0.00 C ATOM 627 C ILE A 38 -1.734 4.430 -0.090 1.00 0.00 C ATOM 628 O ILE A 38 -0.712 4.938 0.364 1.00 0.00 O ATOM 629 CB ILE A 38 -3.827 3.966 1.206 1.00 0.00 C ATOM 630 CG1 ILE A 38 -4.852 4.659 2.115 1.00 0.00 C ATOM 631 CG2 ILE A 38 -2.836 3.198 2.063 1.00 0.00 C ATOM 632 CD1 ILE A 38 -4.317 5.899 2.798 1.00 0.00 C ATOM 0 H ILE A 38 -4.621 4.578 -1.104 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.983 5.920 0.826 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.350 3.268 0.553 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.726 4.929 1.522 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.188 3.953 2.874 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.373 2.493 2.697 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -2.145 2.653 1.420 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.278 3.896 2.687 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -5.096 6.335 3.423 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.461 5.632 3.418 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -4.008 6.624 2.045 1.00 0.00 H new ATOM 644 N ILE A 39 -1.713 3.387 -0.918 1.00 0.00 N ATOM 645 CA ILE A 39 -0.453 2.787 -1.335 1.00 0.00 C ATOM 646 C ILE A 39 0.397 3.810 -2.071 1.00 0.00 C ATOM 647 O ILE A 39 1.625 3.803 -1.976 1.00 0.00 O ATOM 648 CB ILE A 39 -0.671 1.549 -2.234 1.00 0.00 C ATOM 649 CG1 ILE A 39 -1.049 1.971 -3.655 1.00 0.00 C ATOM 650 CG2 ILE A 39 -1.741 0.643 -1.643 1.00 0.00 C ATOM 651 CD1 ILE A 39 0.132 2.022 -4.599 1.00 0.00 C ATOM 0 H ILE A 39 -2.546 2.946 -1.308 1.00 0.00 H new ATOM 0 HA ILE A 39 0.064 2.459 -0.433 1.00 0.00 H new ATOM 0 HB ILE A 39 0.265 0.992 -2.282 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.790 1.275 -4.048 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.521 2.953 -3.621 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.881 -0.224 -2.289 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.430 0.311 -0.653 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.679 1.192 -1.563 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.206 2.328 -5.589 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.864 2.740 -4.228 1.00 0.00 H new ATOM 0 HD13 ILE A 39 0.591 1.035 -4.661 1.00 0.00 H new ATOM 663 N GLU A 40 -0.269 4.700 -2.798 1.00 0.00 N ATOM 664 CA GLU A 40 0.419 5.740 -3.540 1.00 0.00 C ATOM 665 C GLU A 40 0.771 6.893 -2.612 1.00 0.00 C ATOM 666 O GLU A 40 1.726 7.631 -2.858 1.00 0.00 O ATOM 667 CB GLU A 40 -0.440 6.243 -4.701 1.00 0.00 C ATOM 668 CG GLU A 40 -0.720 5.188 -5.759 1.00 0.00 C ATOM 669 CD GLU A 40 -1.990 5.469 -6.539 1.00 0.00 C ATOM 670 OE1 GLU A 40 -2.078 5.037 -7.708 1.00 0.00 O ATOM 671 OE2 GLU A 40 -2.897 6.122 -5.982 1.00 0.00 O ATOM 0 H GLU A 40 -1.285 4.719 -2.887 1.00 0.00 H new ATOM 0 HA GLU A 40 1.336 5.318 -3.953 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.388 6.610 -4.307 1.00 0.00 H new ATOM 0 HB3 GLU A 40 0.060 7.091 -5.170 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.122 5.138 -6.449 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -0.800 4.211 -5.281 1.00 0.00 H new ATOM 678 N GLU A 41 0.013 7.035 -1.528 1.00 0.00 N ATOM 679 CA GLU A 41 0.284 8.088 -0.563 1.00 0.00 C ATOM 680 C GLU A 41 1.347 7.620 0.424 1.00 0.00 C ATOM 681 O GLU A 41 2.135 8.417 0.936 1.00 0.00 O ATOM 682 CB GLU A 41 -0.995 8.484 0.179 1.00 0.00 C ATOM 683 CG GLU A 41 -0.771 9.516 1.271 1.00 0.00 C ATOM 684 CD GLU A 41 -1.899 9.549 2.284 1.00 0.00 C ATOM 685 OE1 GLU A 41 -2.434 10.648 2.542 1.00 0.00 O ATOM 686 OE2 GLU A 41 -2.249 8.476 2.818 1.00 0.00 O ATOM 0 H GLU A 41 -0.784 6.440 -1.300 1.00 0.00 H new ATOM 0 HA GLU A 41 0.652 8.965 -1.095 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.714 8.878 -0.539 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.440 7.592 0.620 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.166 9.299 1.784 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -0.666 10.502 0.818 1.00 0.00 H new ATOM 693 N ALA A 42 1.366 6.314 0.678 1.00 0.00 N ATOM 694 CA ALA A 42 2.333 5.728 1.593 1.00 0.00 C ATOM 695 C ALA A 42 3.698 5.621 0.931 1.00 0.00 C ATOM 696 O ALA A 42 4.724 5.912 1.546 1.00 0.00 O ATOM 697 CB ALA A 42 1.859 4.359 2.057 1.00 0.00 C ATOM 0 H ALA A 42 0.721 5.643 0.261 1.00 0.00 H new ATOM 0 HA ALA A 42 2.423 6.378 2.463 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.593 3.933 2.741 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.902 4.459 2.568 1.00 0.00 H new ATOM 0 HB3 ALA A 42 1.743 3.703 1.195 1.00 0.00 H new ATOM 703 N VAL A 43 3.703 5.207 -0.332 1.00 0.00 N ATOM 704 CA VAL A 43 4.944 5.067 -1.088 1.00 0.00 C ATOM 705 C VAL A 43 5.777 6.328 -0.988 1.00 0.00 C ATOM 706 O VAL A 43 6.893 6.321 -0.469 1.00 0.00 O ATOM 707 CB VAL A 43 4.671 4.773 -2.584 1.00 0.00 C ATOM 708 CG1 VAL A 43 3.584 5.665 -3.140 1.00 0.00 C ATOM 709 CG2 VAL A 43 5.932 4.932 -3.410 1.00 0.00 C ATOM 0 H VAL A 43 2.862 4.962 -0.854 1.00 0.00 H new ATOM 0 HA VAL A 43 5.486 4.227 -0.654 1.00 0.00 H new ATOM 0 HB VAL A 43 4.333 3.739 -2.646 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.422 5.428 -4.192 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.660 5.502 -2.585 1.00 0.00 H new ATOM 0 HG13 VAL A 43 3.885 6.708 -3.045 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.711 4.720 -4.456 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.301 5.953 -3.317 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.692 4.238 -3.051 1.00 0.00 H new ATOM 719 N VAL A 44 5.215 7.407 -1.491 1.00 0.00 N ATOM 720 CA VAL A 44 5.877 8.693 -1.472 1.00 0.00 C ATOM 721 C VAL A 44 6.270 9.057 -0.051 1.00 0.00 C ATOM 722 O VAL A 44 7.437 9.299 0.239 1.00 0.00 O ATOM 723 CB VAL A 44 4.964 9.778 -2.081 1.00 0.00 C ATOM 724 CG1 VAL A 44 5.034 11.093 -1.306 1.00 0.00 C ATOM 725 CG2 VAL A 44 5.302 10.000 -3.546 1.00 0.00 C ATOM 0 H VAL A 44 4.291 7.417 -1.922 1.00 0.00 H new ATOM 0 HA VAL A 44 6.782 8.632 -2.076 1.00 0.00 H new ATOM 0 HB VAL A 44 3.939 9.416 -2.007 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.375 11.826 -1.772 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.719 10.925 -0.276 1.00 0.00 H new ATOM 0 HG13 VAL A 44 6.058 11.467 -1.316 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.648 10.768 -3.958 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.340 10.321 -3.635 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.161 9.070 -4.097 1.00 0.00 H new ATOM 735 N MET A 45 5.290 9.075 0.838 1.00 0.00 N ATOM 736 CA MET A 45 5.552 9.395 2.231 1.00 0.00 C ATOM 737 C MET A 45 6.671 8.515 2.775 1.00 0.00 C ATOM 738 O MET A 45 7.437 8.940 3.639 1.00 0.00 O ATOM 739 CB MET A 45 4.290 9.228 3.077 1.00 0.00 C ATOM 740 CG MET A 45 4.469 9.655 4.526 1.00 0.00 C ATOM 741 SD MET A 45 5.165 11.311 4.689 1.00 0.00 S ATOM 742 CE MET A 45 5.972 11.185 6.283 1.00 0.00 C ATOM 0 H MET A 45 4.314 8.874 0.622 1.00 0.00 H new ATOM 0 HA MET A 45 5.864 10.438 2.286 1.00 0.00 H new ATOM 0 HB2 MET A 45 3.484 9.811 2.632 1.00 0.00 H new ATOM 0 HB3 MET A 45 3.980 8.183 3.050 1.00 0.00 H new ATOM 0 HG2 MET A 45 3.504 9.621 5.031 1.00 0.00 H new ATOM 0 HG3 MET A 45 5.119 8.942 5.032 1.00 0.00 H new ATOM 0 HE1 MET A 45 6.829 11.858 6.311 1.00 0.00 H new ATOM 0 HE2 MET A 45 5.269 11.459 7.069 1.00 0.00 H new ATOM 0 HE3 MET A 45 6.310 10.161 6.440 1.00 0.00 H new ATOM 752 N TRP A 46 6.779 7.293 2.250 1.00 0.00 N ATOM 753 CA TRP A 46 7.830 6.389 2.686 1.00 0.00 C ATOM 754 C TRP A 46 9.179 6.928 2.242 1.00 0.00 C ATOM 755 O TRP A 46 10.034 7.234 3.067 1.00 0.00 O ATOM 756 CB TRP A 46 7.609 4.981 2.128 1.00 0.00 C ATOM 757 CG TRP A 46 8.514 3.951 2.735 1.00 0.00 C ATOM 758 CD1 TRP A 46 8.203 3.075 3.736 1.00 0.00 C ATOM 759 CD2 TRP A 46 9.878 3.690 2.381 1.00 0.00 C ATOM 760 NE1 TRP A 46 9.290 2.285 4.024 1.00 0.00 N ATOM 761 CE2 TRP A 46 10.329 2.643 3.208 1.00 0.00 C ATOM 762 CE3 TRP A 46 10.760 4.237 1.446 1.00 0.00 C ATOM 763 CZ2 TRP A 46 11.623 2.135 3.127 1.00 0.00 C ATOM 764 CZ3 TRP A 46 12.045 3.733 1.367 1.00 0.00 C ATOM 765 CH2 TRP A 46 12.465 2.691 2.202 1.00 0.00 C ATOM 0 H TRP A 46 6.159 6.916 1.533 1.00 0.00 H new ATOM 0 HA TRP A 46 7.807 6.324 3.774 1.00 0.00 H new ATOM 0 HB2 TRP A 46 6.573 4.689 2.299 1.00 0.00 H new ATOM 0 HB3 TRP A 46 7.762 4.998 1.049 1.00 0.00 H new ATOM 0 HD1 TRP A 46 7.244 3.012 4.229 1.00 0.00 H new ATOM 0 HE1 TRP A 46 9.318 1.551 4.731 1.00 0.00 H new ATOM 0 HE3 TRP A 46 10.444 5.040 0.796 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 11.950 1.332 3.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 12.736 4.150 0.649 1.00 0.00 H new ATOM 0 HH2 TRP A 46 13.475 2.318 2.115 1.00 0.00 H new ATOM 776 N LEU A 47 9.355 7.070 0.932 1.00 0.00 N ATOM 777 CA LEU A 47 10.599 7.605 0.391 1.00 0.00 C ATOM 778 C LEU A 47 10.880 8.970 0.982 1.00 0.00 C ATOM 779 O LEU A 47 12.006 9.288 1.359 1.00 0.00 O ATOM 780 CB LEU A 47 10.533 7.758 -1.129 1.00 0.00 C ATOM 781 CG LEU A 47 9.169 8.133 -1.710 1.00 0.00 C ATOM 782 CD1 LEU A 47 9.081 9.640 -1.891 1.00 0.00 C ATOM 783 CD2 LEU A 47 8.935 7.417 -3.035 1.00 0.00 C ATOM 0 H LEU A 47 8.657 6.824 0.230 1.00 0.00 H new ATOM 0 HA LEU A 47 11.389 6.899 0.649 1.00 0.00 H new ATOM 0 HB2 LEU A 47 11.254 8.518 -1.429 1.00 0.00 H new ATOM 0 HB3 LEU A 47 10.852 6.820 -1.582 1.00 0.00 H new ATOM 0 HG LEU A 47 8.391 7.817 -1.015 1.00 0.00 H new ATOM 0 HD11 LEU A 47 8.107 9.900 -2.305 1.00 0.00 H new ATOM 0 HD12 LEU A 47 9.208 10.130 -0.926 1.00 0.00 H new ATOM 0 HD13 LEU A 47 9.865 9.971 -2.572 1.00 0.00 H new ATOM 0 HD21 LEU A 47 7.959 7.697 -3.432 1.00 0.00 H new ATOM 0 HD22 LEU A 47 9.711 7.702 -3.745 1.00 0.00 H new ATOM 0 HD23 LEU A 47 8.967 6.339 -2.877 1.00 0.00 H new ATOM 795 N ILE A 48 9.839 9.780 1.032 1.00 0.00 N ATOM 796 CA ILE A 48 9.940 11.122 1.542 1.00 0.00 C ATOM 797 C ILE A 48 10.407 11.133 2.989 1.00 0.00 C ATOM 798 O ILE A 48 11.252 11.943 3.371 1.00 0.00 O ATOM 799 CB ILE A 48 8.582 11.842 1.401 1.00 0.00 C ATOM 800 CG1 ILE A 48 8.710 12.984 0.406 1.00 0.00 C ATOM 801 CG2 ILE A 48 8.071 12.347 2.741 1.00 0.00 C ATOM 802 CD1 ILE A 48 8.742 12.533 -1.038 1.00 0.00 C ATOM 0 H ILE A 48 8.904 9.520 0.719 1.00 0.00 H new ATOM 0 HA ILE A 48 10.687 11.655 0.954 1.00 0.00 H new ATOM 0 HB ILE A 48 7.851 11.124 1.031 1.00 0.00 H new ATOM 0 HG12 ILE A 48 7.874 13.670 0.545 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.620 13.543 0.623 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.113 12.848 2.600 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.944 11.506 3.422 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.789 13.050 3.163 1.00 0.00 H new ATOM 0 HD11 ILE A 48 8.835 13.402 -1.689 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.594 11.871 -1.194 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.821 12.000 -1.273 1.00 0.00 H new ATOM 814 N GLN A 49 9.848 10.243 3.797 1.00 0.00 N ATOM 815 CA GLN A 49 10.217 10.183 5.199 1.00 0.00 C ATOM 816 C GLN A 49 11.484 9.356 5.419 1.00 0.00 C ATOM 817 O GLN A 49 12.210 9.573 6.390 1.00 0.00 O ATOM 818 CB GLN A 49 9.060 9.622 6.036 1.00 0.00 C ATOM 819 CG GLN A 49 8.894 8.110 5.938 1.00 0.00 C ATOM 820 CD GLN A 49 9.039 7.418 7.282 1.00 0.00 C ATOM 821 OE1 GLN A 49 9.080 8.065 8.327 1.00 0.00 O ATOM 822 NE2 GLN A 49 9.115 6.092 7.258 1.00 0.00 N ATOM 0 H GLN A 49 9.146 9.562 3.508 1.00 0.00 H new ATOM 0 HA GLN A 49 10.429 11.201 5.525 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.217 9.892 7.080 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.133 10.099 5.720 1.00 0.00 H new ATOM 0 HG2 GLN A 49 7.913 7.882 5.520 1.00 0.00 H new ATOM 0 HG3 GLN A 49 9.636 7.711 5.246 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.077 5.595 6.368 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.211 5.571 8.129 1.00 0.00 H new ATOM 831 N ASN A 50 11.737 8.394 4.534 1.00 0.00 N ATOM 832 CA ASN A 50 12.911 7.531 4.670 1.00 0.00 C ATOM 833 C ASN A 50 14.077 7.989 3.799 1.00 0.00 C ATOM 834 O ASN A 50 15.154 8.299 4.302 1.00 0.00 O ATOM 835 CB ASN A 50 12.553 6.082 4.331 1.00 0.00 C ATOM 836 CG ASN A 50 12.124 5.292 5.552 1.00 0.00 C ATOM 837 OD1 ASN A 50 10.936 5.041 5.757 1.00 0.00 O ATOM 838 ND2 ASN A 50 13.092 4.896 6.371 1.00 0.00 N ATOM 0 H ASN A 50 11.152 8.193 3.723 1.00 0.00 H new ATOM 0 HA ASN A 50 13.230 7.598 5.710 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.750 6.072 3.594 1.00 0.00 H new ATOM 0 HB3 ASN A 50 13.413 5.596 3.871 1.00 0.00 H new ATOM 0 HD21 ASN A 50 12.864 4.361 7.209 1.00 0.00 H new ATOM 0 HD22 ASN A 50 14.063 5.127 6.162 1.00 0.00 H new ATOM 845 N LYS A 51 13.858 8.005 2.492 1.00 0.00 N ATOM 846 CA LYS A 51 14.894 8.396 1.536 1.00 0.00 C ATOM 847 C LYS A 51 15.535 9.734 1.894 1.00 0.00 C ATOM 848 O LYS A 51 16.744 9.812 2.113 1.00 0.00 O ATOM 849 CB LYS A 51 14.314 8.461 0.124 1.00 0.00 C ATOM 850 CG LYS A 51 15.371 8.373 -0.966 1.00 0.00 C ATOM 851 CD LYS A 51 15.384 7.005 -1.632 1.00 0.00 C ATOM 852 CE LYS A 51 15.612 5.889 -0.624 1.00 0.00 C ATOM 853 NZ LYS A 51 17.036 5.806 -0.198 1.00 0.00 N ATOM 0 H LYS A 51 12.968 7.751 2.064 1.00 0.00 H new ATOM 0 HA LYS A 51 15.673 7.635 1.578 1.00 0.00 H new ATOM 0 HB2 LYS A 51 13.600 7.648 -0.006 1.00 0.00 H new ATOM 0 HB3 LYS A 51 13.760 9.393 0.009 1.00 0.00 H new ATOM 0 HG2 LYS A 51 15.184 9.141 -1.717 1.00 0.00 H new ATOM 0 HG3 LYS A 51 16.352 8.578 -0.538 1.00 0.00 H new ATOM 0 HD2 LYS A 51 14.437 6.842 -2.147 1.00 0.00 H new ATOM 0 HD3 LYS A 51 16.167 6.977 -2.389 1.00 0.00 H new ATOM 0 HE2 LYS A 51 14.981 6.055 0.249 1.00 0.00 H new ATOM 0 HE3 LYS A 51 15.308 4.938 -1.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 17.269 4.822 0.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 17.650 6.127 -0.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 17.185 6.411 0.634 1.00 0.00 H new ATOM 867 N GLU A 52 14.725 10.789 1.940 1.00 0.00 N ATOM 868 CA GLU A 52 15.221 12.128 2.257 1.00 0.00 C ATOM 869 C GLU A 52 16.162 12.108 3.460 1.00 0.00 C ATOM 870 O GLU A 52 17.070 12.934 3.566 1.00 0.00 O ATOM 871 CB GLU A 52 14.050 13.074 2.530 1.00 0.00 C ATOM 872 CG GLU A 52 13.266 13.447 1.281 1.00 0.00 C ATOM 873 CD GLU A 52 13.301 14.934 0.990 1.00 0.00 C ATOM 874 OE1 GLU A 52 14.311 15.584 1.338 1.00 0.00 O ATOM 875 OE2 GLU A 52 12.321 15.451 0.414 1.00 0.00 O ATOM 0 H GLU A 52 13.722 10.744 1.762 1.00 0.00 H new ATOM 0 HA GLU A 52 15.783 12.485 1.394 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.375 12.606 3.247 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.429 13.983 2.996 1.00 0.00 H new ATOM 0 HG2 GLU A 52 13.671 12.904 0.427 1.00 0.00 H new ATOM 0 HG3 GLU A 52 12.230 13.128 1.399 1.00 0.00 H new ATOM 882 N LYS A 53 15.938 11.163 4.365 1.00 0.00 N ATOM 883 CA LYS A 53 16.763 11.035 5.562 1.00 0.00 C ATOM 884 C LYS A 53 17.334 9.626 5.689 1.00 0.00 C ATOM 885 O LYS A 53 17.568 9.147 6.797 1.00 0.00 O ATOM 886 CB LYS A 53 15.948 11.382 6.809 1.00 0.00 C ATOM 887 CG LYS A 53 14.692 10.541 6.969 1.00 0.00 C ATOM 888 CD LYS A 53 14.402 10.247 8.432 1.00 0.00 C ATOM 889 CE LYS A 53 15.052 8.948 8.878 1.00 0.00 C ATOM 890 NZ LYS A 53 15.301 8.928 10.345 1.00 0.00 N ATOM 0 H LYS A 53 15.191 10.472 4.293 1.00 0.00 H new ATOM 0 HA LYS A 53 17.594 11.734 5.472 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.576 11.253 7.691 1.00 0.00 H new ATOM 0 HB3 LYS A 53 15.668 12.435 6.768 1.00 0.00 H new ATOM 0 HG2 LYS A 53 13.844 11.064 6.527 1.00 0.00 H new ATOM 0 HG3 LYS A 53 14.808 9.604 6.424 1.00 0.00 H new ATOM 0 HD2 LYS A 53 14.767 11.068 9.049 1.00 0.00 H new ATOM 0 HD3 LYS A 53 13.325 10.188 8.586 1.00 0.00 H new ATOM 0 HE2 LYS A 53 14.411 8.109 8.607 1.00 0.00 H new ATOM 0 HE3 LYS A 53 15.995 8.813 8.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 15.745 8.026 10.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 15.933 9.713 10.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.399 9.031 10.852 1.00 0.00 H new ATOM 904 N LEU A 54 17.546 8.965 4.551 1.00 0.00 N ATOM 905 CA LEU A 54 18.076 7.602 4.537 1.00 0.00 C ATOM 906 C LEU A 54 19.379 7.512 5.331 1.00 0.00 C ATOM 907 O LEU A 54 20.442 7.891 4.839 1.00 0.00 O ATOM 908 CB LEU A 54 18.317 7.147 3.097 1.00 0.00 C ATOM 909 CG LEU A 54 18.548 5.646 2.922 1.00 0.00 C ATOM 910 CD1 LEU A 54 17.221 4.911 2.808 1.00 0.00 C ATOM 911 CD2 LEU A 54 19.414 5.380 1.700 1.00 0.00 C ATOM 0 H LEU A 54 17.359 9.352 3.626 1.00 0.00 H new ATOM 0 HA LEU A 54 17.340 6.948 5.006 1.00 0.00 H new ATOM 0 HB2 LEU A 54 17.459 7.440 2.491 1.00 0.00 H new ATOM 0 HB3 LEU A 54 19.182 7.680 2.704 1.00 0.00 H new ATOM 0 HG LEU A 54 19.071 5.273 3.802 1.00 0.00 H new ATOM 0 HD11 LEU A 54 17.406 3.844 2.684 1.00 0.00 H new ATOM 0 HD12 LEU A 54 16.635 5.075 3.712 1.00 0.00 H new ATOM 0 HD13 LEU A 54 16.670 5.287 1.946 1.00 0.00 H new ATOM 0 HD21 LEU A 54 19.569 4.307 1.590 1.00 0.00 H new ATOM 0 HD22 LEU A 54 18.917 5.768 0.811 1.00 0.00 H new ATOM 0 HD23 LEU A 54 20.378 5.875 1.822 1.00 0.00 H new ATOM 923 N PRO A 55 19.311 7.009 6.579 1.00 0.00 N ATOM 924 CA PRO A 55 20.479 6.870 7.449 1.00 0.00 C ATOM 925 C PRO A 55 21.316 5.642 7.112 1.00 0.00 C ATOM 926 O PRO A 55 20.832 4.701 6.484 1.00 0.00 O ATOM 927 CB PRO A 55 19.876 6.727 8.859 1.00 0.00 C ATOM 928 CG PRO A 55 18.391 6.842 8.690 1.00 0.00 C ATOM 929 CD PRO A 55 18.101 6.531 7.252 1.00 0.00 C ATOM 0 HA PRO A 55 21.155 7.718 7.344 1.00 0.00 H new ATOM 0 HB2 PRO A 55 20.145 5.768 9.302 1.00 0.00 H new ATOM 0 HB3 PRO A 55 20.254 7.503 9.525 1.00 0.00 H new ATOM 0 HG2 PRO A 55 17.871 6.148 9.350 1.00 0.00 H new ATOM 0 HG3 PRO A 55 18.048 7.844 8.947 1.00 0.00 H new ATOM 0 HD2 PRO A 55 17.940 5.465 7.091 1.00 0.00 H new ATOM 0 HD3 PRO A 55 17.208 7.045 6.897 1.00 0.00 H new ATOM 937 N ASN A 56 22.570 5.652 7.551 1.00 0.00 N ATOM 938 CA ASN A 56 23.469 4.530 7.314 1.00 0.00 C ATOM 939 C ASN A 56 23.121 3.366 8.239 1.00 0.00 C ATOM 940 O ASN A 56 23.377 2.206 7.918 1.00 0.00 O ATOM 941 CB ASN A 56 24.923 4.958 7.533 1.00 0.00 C ATOM 942 CG ASN A 56 25.631 5.285 6.233 1.00 0.00 C ATOM 943 OD1 ASN A 56 26.555 4.583 5.822 1.00 0.00 O ATOM 944 ND2 ASN A 56 25.201 6.358 5.579 1.00 0.00 N ATOM 0 H ASN A 56 22.986 6.424 8.072 1.00 0.00 H new ATOM 0 HA ASN A 56 23.350 4.204 6.281 1.00 0.00 H new ATOM 0 HB2 ASN A 56 24.948 5.830 8.186 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.460 4.160 8.046 1.00 0.00 H new ATOM 0 HD21 ASN A 56 25.640 6.629 4.699 1.00 0.00 H new ATOM 0 HD22 ASN A 56 24.432 6.911 5.957 1.00 0.00 H new ATOM 951 N GLU A 57 22.534 3.689 9.390 1.00 0.00 N ATOM 952 CA GLU A 57 22.147 2.678 10.366 1.00 0.00 C ATOM 953 C GLU A 57 20.846 1.992 9.958 1.00 0.00 C ATOM 954 O GLU A 57 20.590 0.851 10.344 1.00 0.00 O ATOM 955 CB GLU A 57 21.989 3.311 11.750 1.00 0.00 C ATOM 956 CG GLU A 57 21.061 4.514 11.767 1.00 0.00 C ATOM 957 CD GLU A 57 20.672 4.929 13.172 1.00 0.00 C ATOM 958 OE1 GLU A 57 20.949 6.087 13.547 1.00 0.00 O ATOM 959 OE2 GLU A 57 20.089 4.096 13.897 1.00 0.00 O ATOM 0 H GLU A 57 22.317 4.646 9.668 1.00 0.00 H new ATOM 0 HA GLU A 57 22.935 1.926 10.403 1.00 0.00 H new ATOM 0 HB2 GLU A 57 21.609 2.560 12.442 1.00 0.00 H new ATOM 0 HB3 GLU A 57 22.970 3.614 12.116 1.00 0.00 H new ATOM 0 HG2 GLU A 57 21.548 5.351 11.266 1.00 0.00 H new ATOM 0 HG3 GLU A 57 20.161 4.282 11.198 1.00 0.00 H new ATOM 966 N LEU A 58 20.028 2.691 9.176 1.00 0.00 N ATOM 967 CA LEU A 58 18.757 2.141 8.715 1.00 0.00 C ATOM 968 C LEU A 58 18.974 1.168 7.562 1.00 0.00 C ATOM 969 O LEU A 58 18.130 0.315 7.299 1.00 0.00 O ATOM 970 CB LEU A 58 17.817 3.263 8.271 1.00 0.00 C ATOM 971 CG LEU A 58 16.411 3.211 8.879 1.00 0.00 C ATOM 972 CD1 LEU A 58 15.932 4.608 9.243 1.00 0.00 C ATOM 973 CD2 LEU A 58 15.439 2.547 7.915 1.00 0.00 C ATOM 0 H LEU A 58 20.222 3.637 8.849 1.00 0.00 H new ATOM 0 HA LEU A 58 18.303 1.603 9.547 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.272 4.220 8.527 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.728 3.233 7.185 1.00 0.00 H new ATOM 0 HG LEU A 58 16.453 2.616 9.791 1.00 0.00 H new ATOM 0 HD11 LEU A 58 14.932 4.549 9.673 1.00 0.00 H new ATOM 0 HD12 LEU A 58 16.614 5.049 9.970 1.00 0.00 H new ATOM 0 HD13 LEU A 58 15.906 5.229 8.347 1.00 0.00 H new ATOM 0 HD21 LEU A 58 14.445 2.518 8.362 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.402 3.116 6.986 1.00 0.00 H new ATOM 0 HD23 LEU A 58 15.772 1.531 7.705 1.00 0.00 H new ATOM 985 N LYS A 59 20.112 1.310 6.876 1.00 0.00 N ATOM 986 CA LYS A 59 20.455 0.450 5.742 1.00 0.00 C ATOM 987 C LYS A 59 19.972 -0.986 5.953 1.00 0.00 C ATOM 988 O LYS A 59 19.235 -1.525 5.129 1.00 0.00 O ATOM 989 CB LYS A 59 21.967 0.462 5.511 1.00 0.00 C ATOM 990 CG LYS A 59 22.359 0.626 4.051 1.00 0.00 C ATOM 991 CD LYS A 59 23.857 0.465 3.855 1.00 0.00 C ATOM 992 CE LYS A 59 24.251 -1.000 3.752 1.00 0.00 C ATOM 993 NZ LYS A 59 23.927 -1.569 2.414 1.00 0.00 N ATOM 0 H LYS A 59 20.815 2.018 7.089 1.00 0.00 H new ATOM 0 HA LYS A 59 19.948 0.847 4.862 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.408 1.273 6.090 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.391 -0.468 5.890 1.00 0.00 H new ATOM 0 HG2 LYS A 59 21.831 -0.111 3.446 1.00 0.00 H new ATOM 0 HG3 LYS A 59 22.048 1.609 3.698 1.00 0.00 H new ATOM 0 HD2 LYS A 59 24.165 0.990 2.951 1.00 0.00 H new ATOM 0 HD3 LYS A 59 24.386 0.927 4.688 1.00 0.00 H new ATOM 0 HE2 LYS A 59 25.320 -1.103 3.941 1.00 0.00 H new ATOM 0 HE3 LYS A 59 23.734 -1.570 4.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 24.331 -2.524 2.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 22.895 -1.619 2.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 24.329 -0.962 1.672 1.00 0.00 H new ATOM 1007 N PRO A 60 20.381 -1.627 7.061 1.00 0.00 N ATOM 1008 CA PRO A 60 19.977 -3.004 7.360 1.00 0.00 C ATOM 1009 C PRO A 60 18.479 -3.125 7.612 1.00 0.00 C ATOM 1010 O PRO A 60 17.879 -4.168 7.350 1.00 0.00 O ATOM 1011 CB PRO A 60 20.767 -3.349 8.626 1.00 0.00 C ATOM 1012 CG PRO A 60 21.097 -2.034 9.245 1.00 0.00 C ATOM 1013 CD PRO A 60 21.264 -1.071 8.103 1.00 0.00 C ATOM 0 HA PRO A 60 20.180 -3.676 6.526 1.00 0.00 H new ATOM 0 HB2 PRO A 60 20.177 -3.967 9.303 1.00 0.00 H new ATOM 0 HB3 PRO A 60 21.670 -3.910 8.387 1.00 0.00 H new ATOM 0 HG2 PRO A 60 20.303 -1.709 9.917 1.00 0.00 H new ATOM 0 HG3 PRO A 60 22.010 -2.099 9.837 1.00 0.00 H new ATOM 0 HD2 PRO A 60 20.969 -0.060 8.383 1.00 0.00 H new ATOM 0 HD3 PRO A 60 22.300 -1.020 7.768 1.00 0.00 H new ATOM 1021 N LYS A 61 17.876 -2.054 8.114 1.00 0.00 N ATOM 1022 CA LYS A 61 16.446 -2.048 8.390 1.00 0.00 C ATOM 1023 C LYS A 61 15.649 -2.163 7.100 1.00 0.00 C ATOM 1024 O LYS A 61 14.556 -2.728 7.082 1.00 0.00 O ATOM 1025 CB LYS A 61 16.038 -0.777 9.130 1.00 0.00 C ATOM 1026 CG LYS A 61 14.631 -0.844 9.705 1.00 0.00 C ATOM 1027 CD LYS A 61 14.633 -1.425 11.107 1.00 0.00 C ATOM 1028 CE LYS A 61 15.443 -0.562 12.062 1.00 0.00 C ATOM 1029 NZ LYS A 61 16.500 -1.346 12.761 1.00 0.00 N ATOM 0 H LYS A 61 18.354 -1.181 8.337 1.00 0.00 H new ATOM 0 HA LYS A 61 16.228 -2.909 9.022 1.00 0.00 H new ATOM 0 HB2 LYS A 61 16.745 -0.592 9.938 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.105 0.070 8.448 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.196 0.155 9.724 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.000 -1.454 9.058 1.00 0.00 H new ATOM 0 HD2 LYS A 61 13.608 -1.509 11.470 1.00 0.00 H new ATOM 0 HD3 LYS A 61 15.047 -2.433 11.085 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.904 0.256 11.509 1.00 0.00 H new ATOM 0 HE3 LYS A 61 14.777 -0.113 12.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 17.029 -0.721 13.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 16.059 -2.112 13.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 17.151 -1.753 12.060 1.00 0.00 H new ATOM 1043 N ILE A 62 16.204 -1.632 6.014 1.00 0.00 N ATOM 1044 CA ILE A 62 15.538 -1.691 4.720 1.00 0.00 C ATOM 1045 C ILE A 62 15.128 -3.128 4.415 1.00 0.00 C ATOM 1046 O ILE A 62 14.092 -3.374 3.795 1.00 0.00 O ATOM 1047 CB ILE A 62 16.442 -1.120 3.603 1.00 0.00 C ATOM 1048 CG1 ILE A 62 16.351 0.407 3.592 1.00 0.00 C ATOM 1049 CG2 ILE A 62 16.063 -1.685 2.238 1.00 0.00 C ATOM 1050 CD1 ILE A 62 16.471 1.029 4.968 1.00 0.00 C ATOM 0 H ILE A 62 17.108 -1.159 6.005 1.00 0.00 H new ATOM 0 HA ILE A 62 14.641 -1.073 4.759 1.00 0.00 H new ATOM 0 HB ILE A 62 17.470 -1.418 3.810 1.00 0.00 H new ATOM 0 HG12 ILE A 62 17.138 0.805 2.952 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.400 0.703 3.150 1.00 0.00 H new ATOM 0 HG21 ILE A 62 16.718 -1.263 1.475 1.00 0.00 H new ATOM 0 HG22 ILE A 62 16.172 -2.770 2.250 1.00 0.00 H new ATOM 0 HG23 ILE A 62 15.029 -1.426 2.012 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.398 2.113 4.885 1.00 0.00 H new ATOM 0 HD12 ILE A 62 15.668 0.659 5.606 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.433 0.763 5.405 1.00 0.00 H new ATOM 1062 N ASP A 63 15.925 -4.074 4.903 1.00 0.00 N ATOM 1063 CA ASP A 63 15.616 -5.479 4.729 1.00 0.00 C ATOM 1064 C ASP A 63 14.429 -5.808 5.616 1.00 0.00 C ATOM 1065 O ASP A 63 13.500 -6.501 5.205 1.00 0.00 O ATOM 1066 CB ASP A 63 16.819 -6.350 5.099 1.00 0.00 C ATOM 1067 CG ASP A 63 16.972 -7.544 4.179 1.00 0.00 C ATOM 1068 OD1 ASP A 63 17.283 -8.645 4.680 1.00 0.00 O ATOM 1069 OD2 ASP A 63 16.782 -7.379 2.956 1.00 0.00 O ATOM 0 H ASP A 63 16.785 -3.889 5.419 1.00 0.00 H new ATOM 0 HA ASP A 63 15.376 -5.682 3.685 1.00 0.00 H new ATOM 0 HB2 ASP A 63 17.726 -5.747 5.061 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.710 -6.698 6.126 1.00 0.00 H new ATOM 1074 N GLU A 64 14.461 -5.258 6.831 1.00 0.00 N ATOM 1075 CA GLU A 64 13.381 -5.442 7.789 1.00 0.00 C ATOM 1076 C GLU A 64 12.066 -4.994 7.168 1.00 0.00 C ATOM 1077 O GLU A 64 11.059 -5.689 7.251 1.00 0.00 O ATOM 1078 CB GLU A 64 13.662 -4.647 9.068 1.00 0.00 C ATOM 1079 CG GLU A 64 14.017 -5.520 10.260 1.00 0.00 C ATOM 1080 CD GLU A 64 13.910 -4.779 11.578 1.00 0.00 C ATOM 1081 OE1 GLU A 64 12.772 -4.525 12.026 1.00 0.00 O ATOM 1082 OE2 GLU A 64 14.964 -4.451 12.163 1.00 0.00 O ATOM 0 H GLU A 64 15.229 -4.680 7.172 1.00 0.00 H new ATOM 0 HA GLU A 64 13.312 -6.498 8.049 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.480 -3.951 8.881 1.00 0.00 H new ATOM 0 HB3 GLU A 64 12.785 -4.049 9.314 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.357 -6.387 10.280 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.033 -5.896 10.140 1.00 0.00 H new ATOM 1089 N ILE A 65 12.099 -3.831 6.521 1.00 0.00 N ATOM 1090 CA ILE A 65 10.923 -3.282 5.854 1.00 0.00 C ATOM 1091 C ILE A 65 10.345 -4.289 4.868 1.00 0.00 C ATOM 1092 O ILE A 65 9.140 -4.526 4.843 1.00 0.00 O ATOM 1093 CB ILE A 65 11.273 -1.984 5.092 1.00 0.00 C ATOM 1094 CG1 ILE A 65 11.995 -0.995 6.012 1.00 0.00 C ATOM 1095 CG2 ILE A 65 10.020 -1.352 4.505 1.00 0.00 C ATOM 1096 CD1 ILE A 65 11.241 -0.696 7.289 1.00 0.00 C ATOM 0 H ILE A 65 12.933 -3.249 6.445 1.00 0.00 H new ATOM 0 HA ILE A 65 10.186 -3.059 6.625 1.00 0.00 H new ATOM 0 HB ILE A 65 11.944 -2.240 4.272 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.976 -1.396 6.265 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.161 -0.063 5.471 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.288 -0.439 3.973 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.550 -2.051 3.813 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.323 -1.112 5.308 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.811 0.011 7.891 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.270 -0.265 7.046 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.098 -1.619 7.851 1.00 0.00 H new ATOM 1108 N SER A 66 11.217 -4.875 4.053 1.00 0.00 N ATOM 1109 CA SER A 66 10.797 -5.852 3.056 1.00 0.00 C ATOM 1110 C SER A 66 10.345 -7.161 3.702 1.00 0.00 C ATOM 1111 O SER A 66 9.292 -7.698 3.360 1.00 0.00 O ATOM 1112 CB SER A 66 11.934 -6.125 2.071 1.00 0.00 C ATOM 1113 OG SER A 66 12.780 -4.996 1.943 1.00 0.00 O ATOM 0 H SER A 66 12.220 -4.689 4.064 1.00 0.00 H new ATOM 0 HA SER A 66 9.946 -5.430 2.521 1.00 0.00 H new ATOM 0 HB2 SER A 66 12.515 -6.982 2.410 1.00 0.00 H new ATOM 0 HB3 SER A 66 11.521 -6.386 1.097 1.00 0.00 H new ATOM 0 HG SER A 66 12.258 -4.231 1.622 1.00 0.00 H new ATOM 1119 N LYS A 67 11.147 -7.680 4.627 1.00 0.00 N ATOM 1120 CA LYS A 67 10.814 -8.933 5.296 1.00 0.00 C ATOM 1121 C LYS A 67 9.667 -8.748 6.289 1.00 0.00 C ATOM 1122 O LYS A 67 9.009 -9.716 6.670 1.00 0.00 O ATOM 1123 CB LYS A 67 12.041 -9.511 6.006 1.00 0.00 C ATOM 1124 CG LYS A 67 12.816 -8.490 6.824 1.00 0.00 C ATOM 1125 CD LYS A 67 12.990 -8.941 8.269 1.00 0.00 C ATOM 1126 CE LYS A 67 14.438 -8.830 8.718 1.00 0.00 C ATOM 1127 NZ LYS A 67 15.324 -9.769 7.975 1.00 0.00 N ATOM 0 H LYS A 67 12.025 -7.257 4.928 1.00 0.00 H new ATOM 0 HA LYS A 67 10.488 -9.637 4.531 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.721 -10.321 6.662 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.707 -9.948 5.262 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.795 -8.329 6.372 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.294 -7.534 6.802 1.00 0.00 H new ATOM 0 HD2 LYS A 67 12.359 -8.334 8.919 1.00 0.00 H new ATOM 0 HD3 LYS A 67 12.654 -9.973 8.372 1.00 0.00 H new ATOM 0 HE2 LYS A 67 14.787 -7.808 8.570 1.00 0.00 H new ATOM 0 HE3 LYS A 67 14.504 -9.037 9.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 16.187 -9.943 8.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.825 -10.668 7.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 15.580 -9.352 7.057 1.00 0.00 H new ATOM 1141 N ARG A 68 9.429 -7.507 6.703 1.00 0.00 N ATOM 1142 CA ARG A 68 8.356 -7.216 7.650 1.00 0.00 C ATOM 1143 C ARG A 68 7.055 -6.901 6.925 1.00 0.00 C ATOM 1144 O ARG A 68 5.974 -7.221 7.415 1.00 0.00 O ATOM 1145 CB ARG A 68 8.736 -6.051 8.562 1.00 0.00 C ATOM 1146 CG ARG A 68 9.810 -6.406 9.576 1.00 0.00 C ATOM 1147 CD ARG A 68 10.565 -5.173 10.052 1.00 0.00 C ATOM 1148 NE ARG A 68 9.863 -4.486 11.136 1.00 0.00 N ATOM 1149 CZ ARG A 68 8.971 -3.514 10.950 1.00 0.00 C ATOM 1150 NH1 ARG A 68 8.662 -3.107 9.725 1.00 0.00 N ATOM 1151 NH2 ARG A 68 8.385 -2.947 11.995 1.00 0.00 N ATOM 0 H ARG A 68 9.961 -6.691 6.400 1.00 0.00 H new ATOM 0 HA ARG A 68 8.207 -8.107 8.260 1.00 0.00 H new ATOM 0 HB2 ARG A 68 9.085 -5.219 7.950 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.847 -5.708 9.090 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.353 -6.905 10.430 1.00 0.00 H new ATOM 0 HG3 ARG A 68 10.511 -7.113 9.131 1.00 0.00 H new ATOM 0 HD2 ARG A 68 11.559 -5.465 10.391 1.00 0.00 H new ATOM 0 HD3 ARG A 68 10.702 -4.487 9.216 1.00 0.00 H new ATOM 0 HE ARG A 68 10.069 -4.769 12.094 1.00 0.00 H new ATOM 0 HH11 ARG A 68 9.109 -3.539 8.916 1.00 0.00 H new ATOM 0 HH12 ARG A 68 7.978 -2.362 9.592 1.00 0.00 H new ATOM 0 HH21 ARG A 68 8.617 -3.255 12.939 1.00 0.00 H new ATOM 0 HH22 ARG A 68 7.702 -2.203 11.855 1.00 0.00 H new ATOM 1165 N PHE A 69 7.158 -6.278 5.753 1.00 0.00 N ATOM 1166 CA PHE A 69 5.970 -5.941 4.979 1.00 0.00 C ATOM 1167 C PHE A 69 5.218 -7.216 4.602 1.00 0.00 C ATOM 1168 O PHE A 69 3.992 -7.223 4.497 1.00 0.00 O ATOM 1169 CB PHE A 69 6.347 -5.119 3.733 1.00 0.00 C ATOM 1170 CG PHE A 69 6.130 -5.829 2.423 1.00 0.00 C ATOM 1171 CD1 PHE A 69 4.854 -5.971 1.901 1.00 0.00 C ATOM 1172 CD2 PHE A 69 7.201 -6.353 1.717 1.00 0.00 C ATOM 1173 CE1 PHE A 69 4.651 -6.622 0.698 1.00 0.00 C ATOM 1174 CE2 PHE A 69 7.004 -7.006 0.515 1.00 0.00 C ATOM 1175 CZ PHE A 69 5.728 -7.140 0.005 1.00 0.00 C ATOM 0 H PHE A 69 8.041 -6.000 5.324 1.00 0.00 H new ATOM 0 HA PHE A 69 5.311 -5.323 5.589 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.765 -4.197 3.732 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.396 -4.833 3.807 1.00 0.00 H new ATOM 0 HD1 PHE A 69 4.009 -5.569 2.440 1.00 0.00 H new ATOM 0 HD2 PHE A 69 8.201 -6.250 2.111 1.00 0.00 H new ATOM 0 HE1 PHE A 69 3.652 -6.725 0.301 1.00 0.00 H new ATOM 0 HE2 PHE A 69 7.847 -7.411 -0.025 1.00 0.00 H new ATOM 0 HZ PHE A 69 5.572 -7.649 -0.935 1.00 0.00 H new ATOM 1185 N PHE A 70 5.970 -8.296 4.424 1.00 0.00 N ATOM 1186 CA PHE A 70 5.393 -9.590 4.087 1.00 0.00 C ATOM 1187 C PHE A 70 5.662 -10.582 5.214 1.00 0.00 C ATOM 1188 O PHE A 70 6.511 -11.466 5.088 1.00 0.00 O ATOM 1189 CB PHE A 70 5.977 -10.113 2.774 1.00 0.00 C ATOM 1190 CG PHE A 70 5.093 -11.109 2.079 1.00 0.00 C ATOM 1191 CD1 PHE A 70 5.577 -12.360 1.728 1.00 0.00 C ATOM 1192 CD2 PHE A 70 3.778 -10.795 1.778 1.00 0.00 C ATOM 1193 CE1 PHE A 70 4.765 -13.278 1.090 1.00 0.00 C ATOM 1194 CE2 PHE A 70 2.960 -11.709 1.140 1.00 0.00 C ATOM 1195 CZ PHE A 70 3.455 -12.953 0.796 1.00 0.00 C ATOM 0 H PHE A 70 6.987 -8.300 4.508 1.00 0.00 H new ATOM 0 HA PHE A 70 4.317 -9.473 3.961 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.158 -9.271 2.105 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.944 -10.575 2.974 1.00 0.00 H new ATOM 0 HD1 PHE A 70 6.600 -12.620 1.956 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.387 -9.824 2.045 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.154 -14.249 0.821 1.00 0.00 H new ATOM 0 HE2 PHE A 70 1.936 -11.452 0.911 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.819 -13.670 0.298 1.00 0.00 H new ATOM 1205 N PRO A 71 4.947 -10.438 6.344 1.00 0.00 N ATOM 1206 CA PRO A 71 5.118 -11.314 7.506 1.00 0.00 C ATOM 1207 C PRO A 71 4.458 -12.675 7.312 1.00 0.00 C ATOM 1208 O PRO A 71 3.599 -13.077 8.097 1.00 0.00 O ATOM 1209 CB PRO A 71 4.427 -10.537 8.625 1.00 0.00 C ATOM 1210 CG PRO A 71 3.366 -9.752 7.935 1.00 0.00 C ATOM 1211 CD PRO A 71 3.919 -9.403 6.579 1.00 0.00 C ATOM 0 HA PRO A 71 6.166 -11.538 7.702 1.00 0.00 H new ATOM 0 HB2 PRO A 71 4.002 -11.209 9.371 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.128 -9.885 9.146 1.00 0.00 H new ATOM 0 HG2 PRO A 71 2.448 -10.333 7.844 1.00 0.00 H new ATOM 0 HG3 PRO A 71 3.119 -8.852 8.498 1.00 0.00 H new ATOM 0 HD2 PRO A 71 3.144 -9.426 5.812 1.00 0.00 H new ATOM 0 HD3 PRO A 71 4.349 -8.401 6.567 1.00 0.00 H new ATOM 1219 N ALA A 72 4.862 -13.382 6.261 1.00 0.00 N ATOM 1220 CA ALA A 72 4.308 -14.698 5.966 1.00 0.00 C ATOM 1221 C ALA A 72 5.370 -15.784 6.095 1.00 0.00 C ATOM 1222 O ALA A 72 6.075 -16.093 5.135 1.00 0.00 O ATOM 1223 CB ALA A 72 3.701 -14.713 4.571 1.00 0.00 C ATOM 0 H ALA A 72 5.571 -13.065 5.600 1.00 0.00 H new ATOM 0 HA ALA A 72 3.524 -14.907 6.694 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.291 -15.701 4.363 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.905 -13.970 4.512 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.471 -14.478 3.836 1.00 0.00 H new ATOM 1229 N LYS A 73 5.477 -16.359 7.288 1.00 0.00 N ATOM 1230 CA LYS A 73 6.453 -17.412 7.544 1.00 0.00 C ATOM 1231 C LYS A 73 5.969 -18.344 8.649 1.00 0.00 C ATOM 1232 O LYS A 73 5.872 -19.563 8.394 1.00 0.00 O ATOM 1233 CB LYS A 73 7.803 -16.802 7.929 1.00 0.00 C ATOM 1234 CG LYS A 73 8.729 -16.577 6.744 1.00 0.00 C ATOM 1235 CD LYS A 73 10.129 -16.200 7.196 1.00 0.00 C ATOM 1236 CE LYS A 73 11.023 -15.860 6.014 1.00 0.00 C ATOM 1237 NZ LYS A 73 12.467 -15.997 6.353 1.00 0.00 N ATOM 1238 OXT LYS A 73 5.692 -17.848 9.762 1.00 0.00 O ATOM 0 H LYS A 73 4.900 -16.114 8.093 1.00 0.00 H new ATOM 0 HA LYS A 73 6.573 -17.993 6.630 1.00 0.00 H new ATOM 0 HB2 LYS A 73 7.632 -15.850 8.432 1.00 0.00 H new ATOM 0 HB3 LYS A 73 8.297 -17.457 8.646 1.00 0.00 H new ATOM 0 HG2 LYS A 73 8.772 -17.482 6.138 1.00 0.00 H new ATOM 0 HG3 LYS A 73 8.325 -15.788 6.110 1.00 0.00 H new ATOM 0 HD2 LYS A 73 10.077 -15.346 7.872 1.00 0.00 H new ATOM 0 HD3 LYS A 73 10.566 -17.025 7.758 1.00 0.00 H new ATOM 0 HE2 LYS A 73 10.783 -16.515 5.177 1.00 0.00 H new ATOM 0 HE3 LYS A 73 10.822 -14.840 5.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 13.043 -15.757 5.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 12.703 -15.353 7.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 12.665 -16.977 6.640 1.00 0.00 H new TER 1252 LYS A 73 ATOM 1253 N MET B 1 -8.527 -18.821 -1.954 1.00 0.00 N ATOM 1254 CA MET B 1 -7.891 -19.762 -2.913 1.00 0.00 C ATOM 1255 C MET B 1 -6.877 -20.661 -2.213 1.00 0.00 C ATOM 1256 O MET B 1 -6.724 -20.609 -0.993 1.00 0.00 O ATOM 1257 CB MET B 1 -7.207 -18.949 -4.013 1.00 0.00 C ATOM 1258 CG MET B 1 -6.288 -17.860 -3.482 1.00 0.00 C ATOM 1259 SD MET B 1 -7.151 -16.304 -3.190 1.00 0.00 S ATOM 1260 CE MET B 1 -6.784 -15.424 -4.707 1.00 0.00 C ATOM 0 H1 MET B 1 -9.522 -19.089 -1.812 1.00 0.00 H new ATOM 0 H2 MET B 1 -8.025 -18.860 -1.044 1.00 0.00 H new ATOM 0 H3 MET B 1 -8.480 -17.854 -2.334 1.00 0.00 H new ATOM 0 HA MET B 1 -8.657 -20.406 -3.344 1.00 0.00 H new ATOM 0 HB2 MET B 1 -6.630 -19.623 -4.646 1.00 0.00 H new ATOM 0 HB3 MET B 1 -7.970 -18.493 -4.644 1.00 0.00 H new ATOM 0 HG2 MET B 1 -5.831 -18.197 -2.552 1.00 0.00 H new ATOM 0 HG3 MET B 1 -5.479 -17.694 -4.193 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.632 -14.795 -4.977 1.00 0.00 H new ATOM 0 HE2 MET B 1 -5.902 -14.801 -4.562 1.00 0.00 H new ATOM 0 HE3 MET B 1 -6.595 -16.140 -5.506 1.00 0.00 H new ATOM 1272 N VAL B 2 -6.186 -21.485 -2.995 1.00 0.00 N ATOM 1273 CA VAL B 2 -5.185 -22.395 -2.450 1.00 0.00 C ATOM 1274 C VAL B 2 -3.779 -21.979 -2.866 1.00 0.00 C ATOM 1275 O VAL B 2 -3.296 -22.364 -3.931 1.00 0.00 O ATOM 1276 CB VAL B 2 -5.436 -23.844 -2.910 1.00 0.00 C ATOM 1277 CG1 VAL B 2 -6.624 -24.441 -2.172 1.00 0.00 C ATOM 1278 CG2 VAL B 2 -5.651 -23.898 -4.414 1.00 0.00 C ATOM 0 H VAL B 2 -6.301 -21.541 -4.007 1.00 0.00 H new ATOM 0 HA VAL B 2 -5.269 -22.345 -1.364 1.00 0.00 H new ATOM 0 HB VAL B 2 -4.554 -24.439 -2.672 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -6.786 -25.464 -2.510 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -6.424 -24.440 -1.100 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -7.515 -23.847 -2.375 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -5.827 -24.929 -4.720 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -6.515 -23.289 -4.680 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -4.766 -23.515 -4.922 1.00 0.00 H new ATOM 1288 N GLU B 3 -3.126 -21.190 -2.019 1.00 0.00 N ATOM 1289 CA GLU B 3 -1.774 -20.721 -2.298 1.00 0.00 C ATOM 1290 C GLU B 3 -1.058 -20.327 -1.011 1.00 0.00 C ATOM 1291 O GLU B 3 -0.062 -20.943 -0.629 1.00 0.00 O ATOM 1292 CB GLU B 3 -1.811 -19.532 -3.260 1.00 0.00 C ATOM 1293 CG GLU B 3 -0.437 -19.100 -3.746 1.00 0.00 C ATOM 1294 CD GLU B 3 -0.442 -18.672 -5.200 1.00 0.00 C ATOM 1295 OE1 GLU B 3 -0.482 -19.557 -6.080 1.00 0.00 O ATOM 1296 OE2 GLU B 3 -0.404 -17.450 -5.459 1.00 0.00 O ATOM 0 H GLU B 3 -3.512 -20.862 -1.133 1.00 0.00 H new ATOM 0 HA GLU B 3 -1.223 -21.538 -2.763 1.00 0.00 H new ATOM 0 HB2 GLU B 3 -2.427 -19.791 -4.121 1.00 0.00 H new ATOM 0 HB3 GLU B 3 -2.294 -18.689 -2.765 1.00 0.00 H new ATOM 0 HG2 GLU B 3 -0.080 -18.275 -3.129 1.00 0.00 H new ATOM 0 HG3 GLU B 3 0.266 -19.923 -3.616 1.00 0.00 H new ATOM 1303 N SER B 4 -1.571 -19.298 -0.345 1.00 0.00 N ATOM 1304 CA SER B 4 -0.981 -18.822 0.901 1.00 0.00 C ATOM 1305 C SER B 4 -1.993 -18.878 2.041 1.00 0.00 C ATOM 1306 O SER B 4 -2.777 -17.950 2.232 1.00 0.00 O ATOM 1307 CB SER B 4 -0.465 -17.393 0.731 1.00 0.00 C ATOM 1308 OG SER B 4 0.754 -17.202 1.428 1.00 0.00 O ATOM 0 H SER B 4 -2.394 -18.777 -0.647 1.00 0.00 H new ATOM 0 HA SER B 4 -0.145 -19.476 1.151 1.00 0.00 H new ATOM 0 HB2 SER B 4 -0.319 -17.180 -0.328 1.00 0.00 H new ATOM 0 HB3 SER B 4 -1.211 -16.688 1.098 1.00 0.00 H new ATOM 0 HG SER B 4 1.062 -16.281 1.301 1.00 0.00 H new ATOM 1314 N LYS B 5 -1.969 -19.976 2.792 1.00 0.00 N ATOM 1315 CA LYS B 5 -2.883 -20.160 3.915 1.00 0.00 C ATOM 1316 C LYS B 5 -4.333 -20.195 3.439 1.00 0.00 C ATOM 1317 O LYS B 5 -4.925 -21.266 3.300 1.00 0.00 O ATOM 1318 CB LYS B 5 -2.693 -19.045 4.946 1.00 0.00 C ATOM 1319 CG LYS B 5 -1.371 -19.125 5.692 1.00 0.00 C ATOM 1320 CD LYS B 5 -0.949 -17.766 6.226 1.00 0.00 C ATOM 1321 CE LYS B 5 -0.061 -17.029 5.237 1.00 0.00 C ATOM 1322 NZ LYS B 5 1.068 -16.334 5.916 1.00 0.00 N ATOM 0 H LYS B 5 -1.325 -20.753 2.642 1.00 0.00 H new ATOM 0 HA LYS B 5 -2.653 -21.117 4.384 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -2.759 -18.081 4.442 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -3.510 -19.084 5.666 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -1.461 -19.830 6.519 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -0.599 -19.511 5.026 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -1.834 -17.167 6.438 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -0.417 -17.894 7.169 1.00 0.00 H new ATOM 0 HE2 LYS B 5 0.334 -17.736 4.507 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -0.657 -16.301 4.686 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 1.252 -15.427 5.442 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 0.821 -16.161 6.911 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 1.920 -16.928 5.869 1.00 0.00 H new ATOM 1336 N LYS B 6 -4.903 -19.019 3.191 1.00 0.00 N ATOM 1337 CA LYS B 6 -6.283 -18.920 2.731 1.00 0.00 C ATOM 1338 C LYS B 6 -6.383 -18.008 1.512 1.00 0.00 C ATOM 1339 O LYS B 6 -6.951 -18.385 0.487 1.00 0.00 O ATOM 1340 CB LYS B 6 -7.180 -18.392 3.853 1.00 0.00 C ATOM 1341 CG LYS B 6 -8.655 -18.689 3.642 1.00 0.00 C ATOM 1342 CD LYS B 6 -9.398 -17.479 3.100 1.00 0.00 C ATOM 1343 CE LYS B 6 -9.659 -17.608 1.607 1.00 0.00 C ATOM 1344 NZ LYS B 6 -10.859 -16.835 1.184 1.00 0.00 N ATOM 0 H LYS B 6 -4.430 -18.122 3.301 1.00 0.00 H new ATOM 0 HA LYS B 6 -6.619 -19.917 2.446 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -6.861 -18.830 4.799 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -7.044 -17.314 3.939 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -8.763 -19.523 2.949 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -9.103 -18.999 4.586 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -10.345 -17.366 3.628 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -8.816 -16.577 3.292 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -8.788 -17.257 1.055 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -9.796 -18.659 1.352 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -11.002 -16.949 0.160 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -11.695 -17.187 1.692 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -10.719 -15.828 1.404 1.00 0.00 H new ATOM 1358 N ILE B 7 -5.828 -16.807 1.632 1.00 0.00 N ATOM 1359 CA ILE B 7 -5.853 -15.841 0.540 1.00 0.00 C ATOM 1360 C ILE B 7 -4.484 -15.729 -0.123 1.00 0.00 C ATOM 1361 O ILE B 7 -3.467 -16.088 0.469 1.00 0.00 O ATOM 1362 CB ILE B 7 -6.287 -14.448 1.034 1.00 0.00 C ATOM 1363 CG1 ILE B 7 -7.564 -14.552 1.874 1.00 0.00 C ATOM 1364 CG2 ILE B 7 -6.494 -13.508 -0.144 1.00 0.00 C ATOM 1365 CD1 ILE B 7 -7.329 -14.362 3.356 1.00 0.00 C ATOM 0 H ILE B 7 -5.355 -16.479 2.474 1.00 0.00 H new ATOM 0 HA ILE B 7 -6.579 -16.203 -0.188 1.00 0.00 H new ATOM 0 HB ILE B 7 -5.496 -14.040 1.663 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -8.278 -13.804 1.529 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -8.020 -15.528 1.709 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -6.800 -12.528 0.222 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -5.562 -13.412 -0.701 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -7.268 -13.909 -0.798 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -8.276 -14.449 3.889 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -6.639 -15.125 3.716 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -6.902 -13.375 3.533 1.00 0.00 H new ATOM 1377 N ALA B 8 -4.467 -15.232 -1.356 1.00 0.00 N ATOM 1378 CA ALA B 8 -3.221 -15.077 -2.098 1.00 0.00 C ATOM 1379 C ALA B 8 -3.080 -13.665 -2.659 1.00 0.00 C ATOM 1380 O ALA B 8 -3.965 -12.827 -2.489 1.00 0.00 O ATOM 1381 CB ALA B 8 -3.146 -16.101 -3.220 1.00 0.00 C ATOM 0 H ALA B 8 -5.300 -14.930 -1.861 1.00 0.00 H new ATOM 0 HA ALA B 8 -2.395 -15.246 -1.407 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -2.211 -15.975 -3.766 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -3.187 -17.106 -2.799 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -3.986 -15.958 -3.900 1.00 0.00 H new ATOM 1387 N LYS B 9 -1.959 -13.413 -3.327 1.00 0.00 N ATOM 1388 CA LYS B 9 -1.691 -12.105 -3.918 1.00 0.00 C ATOM 1389 C LYS B 9 -2.526 -11.905 -5.175 1.00 0.00 C ATOM 1390 O LYS B 9 -2.901 -12.870 -5.843 1.00 0.00 O ATOM 1391 CB LYS B 9 -0.203 -11.981 -4.258 1.00 0.00 C ATOM 1392 CG LYS B 9 0.560 -11.060 -3.321 1.00 0.00 C ATOM 1393 CD LYS B 9 1.589 -11.818 -2.494 1.00 0.00 C ATOM 1394 CE LYS B 9 0.947 -12.934 -1.685 1.00 0.00 C ATOM 1395 NZ LYS B 9 1.755 -14.185 -1.724 1.00 0.00 N ATOM 0 H LYS B 9 -1.219 -14.099 -3.473 1.00 0.00 H new ATOM 0 HA LYS B 9 -1.961 -11.336 -3.194 1.00 0.00 H new ATOM 0 HB2 LYS B 9 0.251 -12.971 -4.230 1.00 0.00 H new ATOM 0 HB3 LYS B 9 -0.102 -11.612 -5.279 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.060 -10.285 -3.902 1.00 0.00 H new ATOM 0 HG3 LYS B 9 -0.141 -10.557 -2.655 1.00 0.00 H new ATOM 0 HD2 LYS B 9 2.349 -12.237 -3.153 1.00 0.00 H new ATOM 0 HD3 LYS B 9 2.097 -11.126 -1.822 1.00 0.00 H new ATOM 0 HE2 LYS B 9 0.829 -12.611 -0.651 1.00 0.00 H new ATOM 0 HE3 LYS B 9 -0.052 -13.135 -2.073 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 1.618 -14.715 -0.840 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 1.451 -14.770 -2.528 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 2.761 -13.945 -1.831 1.00 0.00 H new ATOM 1409 N LYS B 10 -2.822 -10.650 -5.490 1.00 0.00 N ATOM 1410 CA LYS B 10 -3.624 -10.334 -6.668 1.00 0.00 C ATOM 1411 C LYS B 10 -2.943 -9.276 -7.529 1.00 0.00 C ATOM 1412 O LYS B 10 -2.296 -8.372 -7.011 1.00 0.00 O ATOM 1413 CB LYS B 10 -4.995 -9.827 -6.229 1.00 0.00 C ATOM 1414 CG LYS B 10 -5.933 -10.916 -5.733 1.00 0.00 C ATOM 1415 CD LYS B 10 -6.798 -10.421 -4.579 1.00 0.00 C ATOM 1416 CE LYS B 10 -8.273 -10.696 -4.829 1.00 0.00 C ATOM 1417 NZ LYS B 10 -8.576 -12.153 -4.821 1.00 0.00 N ATOM 0 H LYS B 10 -2.521 -9.838 -4.951 1.00 0.00 H new ATOM 0 HA LYS B 10 -3.734 -11.241 -7.262 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -4.861 -9.090 -5.437 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -5.465 -9.312 -7.067 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -6.571 -11.249 -6.551 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -5.352 -11.780 -5.410 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -6.488 -10.909 -3.655 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -6.645 -9.351 -4.441 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -8.870 -10.197 -4.065 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -8.564 -10.270 -5.789 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -9.591 -12.297 -4.995 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -8.026 -12.626 -5.566 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -8.323 -12.555 -3.896 1.00 0.00 H new ATOM 1431 N LYS B 11 -3.100 -9.369 -8.844 1.00 0.00 N ATOM 1432 CA LYS B 11 -2.499 -8.381 -9.730 1.00 0.00 C ATOM 1433 C LYS B 11 -3.234 -7.056 -9.589 1.00 0.00 C ATOM 1434 O LYS B 11 -4.370 -6.913 -10.043 1.00 0.00 O ATOM 1435 CB LYS B 11 -2.535 -8.848 -11.186 1.00 0.00 C ATOM 1436 CG LYS B 11 -2.102 -10.293 -11.378 1.00 0.00 C ATOM 1437 CD LYS B 11 -0.633 -10.485 -11.041 1.00 0.00 C ATOM 1438 CE LYS B 11 0.265 -9.712 -11.995 1.00 0.00 C ATOM 1439 NZ LYS B 11 1.434 -10.521 -12.436 1.00 0.00 N ATOM 0 H LYS B 11 -3.628 -10.104 -9.314 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.455 -8.253 -9.445 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -3.547 -8.728 -11.571 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -1.889 -8.203 -11.781 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -2.709 -10.942 -10.747 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -2.282 -10.593 -12.410 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -0.447 -10.156 -10.019 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -0.384 -11.545 -11.085 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -0.312 -9.403 -12.867 1.00 0.00 H new ATOM 0 HE3 LYS B 11 0.616 -8.803 -11.507 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 2.021 -9.958 -13.085 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 1.999 -10.795 -11.607 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 1.100 -11.376 -12.925 1.00 0.00 H new ATOM 1453 N THR B 12 -2.587 -6.092 -8.946 1.00 0.00 N ATOM 1454 CA THR B 12 -3.187 -4.783 -8.734 1.00 0.00 C ATOM 1455 C THR B 12 -2.533 -3.734 -9.623 1.00 0.00 C ATOM 1456 O THR B 12 -1.346 -3.821 -9.923 1.00 0.00 O ATOM 1457 CB THR B 12 -3.063 -4.374 -7.267 1.00 0.00 C ATOM 1458 OG1 THR B 12 -3.343 -5.471 -6.415 1.00 0.00 O ATOM 1459 CG2 THR B 12 -3.991 -3.243 -6.879 1.00 0.00 C ATOM 0 H THR B 12 -1.647 -6.193 -8.563 1.00 0.00 H new ATOM 0 HA THR B 12 -4.243 -4.848 -8.998 1.00 0.00 H new ATOM 0 HB THR B 12 -2.034 -4.034 -7.149 1.00 0.00 H new ATOM 0 HG1 THR B 12 -4.020 -5.209 -5.757 1.00 0.00 H new ATOM 0 HG21 THR B 12 -3.851 -3.003 -5.825 1.00 0.00 H new ATOM 0 HG22 THR B 12 -3.767 -2.364 -7.484 1.00 0.00 H new ATOM 0 HG23 THR B 12 -5.024 -3.546 -7.048 1.00 0.00 H new ATOM 1467 N THR B 13 -3.310 -2.741 -10.046 1.00 0.00 N ATOM 1468 CA THR B 13 -2.778 -1.687 -10.901 1.00 0.00 C ATOM 1469 C THR B 13 -2.919 -0.314 -10.259 1.00 0.00 C ATOM 1470 O THR B 13 -4.007 0.088 -9.850 1.00 0.00 O ATOM 1471 CB THR B 13 -3.475 -1.676 -12.260 1.00 0.00 C ATOM 1472 OG1 THR B 13 -3.810 -2.989 -12.671 1.00 0.00 O ATOM 1473 CG2 THR B 13 -2.631 -1.049 -13.347 1.00 0.00 C ATOM 0 H THR B 13 -4.299 -2.645 -9.814 1.00 0.00 H new ATOM 0 HA THR B 13 -1.718 -1.903 -11.038 1.00 0.00 H new ATOM 0 HB THR B 13 -4.374 -1.075 -12.122 1.00 0.00 H new ATOM 0 HG1 THR B 13 -4.257 -2.955 -13.543 1.00 0.00 H new ATOM 0 HG21 THR B 13 -3.178 -1.069 -14.290 1.00 0.00 H new ATOM 0 HG22 THR B 13 -2.404 -0.017 -13.081 1.00 0.00 H new ATOM 0 HG23 THR B 13 -1.702 -1.609 -13.455 1.00 0.00 H new ATOM 1481 N LEU B 14 -1.808 0.406 -10.206 1.00 0.00 N ATOM 1482 CA LEU B 14 -1.789 1.750 -9.653 1.00 0.00 C ATOM 1483 C LEU B 14 -1.364 2.726 -10.739 1.00 0.00 C ATOM 1484 O LEU B 14 -0.394 2.478 -11.454 1.00 0.00 O ATOM 1485 CB LEU B 14 -0.835 1.835 -8.457 1.00 0.00 C ATOM 1486 CG LEU B 14 -0.740 0.569 -7.603 1.00 0.00 C ATOM 1487 CD1 LEU B 14 0.670 0.399 -7.063 1.00 0.00 C ATOM 1488 CD2 LEU B 14 -1.746 0.613 -6.463 1.00 0.00 C ATOM 0 H LEU B 14 -0.903 0.078 -10.542 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.788 2.006 -9.300 1.00 0.00 H new ATOM 0 HB2 LEU B 14 0.161 2.080 -8.825 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.151 2.660 -7.819 1.00 0.00 H new ATOM 0 HG LEU B 14 -0.976 -0.289 -8.233 1.00 0.00 H new ATOM 0 HD11 LEU B 14 0.721 -0.506 -6.458 1.00 0.00 H new ATOM 0 HD12 LEU B 14 1.371 0.320 -7.894 1.00 0.00 H new ATOM 0 HD13 LEU B 14 0.931 1.261 -6.449 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -1.662 -0.296 -5.868 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -1.544 1.479 -5.833 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -2.754 0.688 -6.870 1.00 0.00 H new ATOM 1500 N ALA B 15 -2.101 3.817 -10.889 1.00 0.00 N ATOM 1501 CA ALA B 15 -1.789 4.788 -11.929 1.00 0.00 C ATOM 1502 C ALA B 15 -0.774 5.825 -11.464 1.00 0.00 C ATOM 1503 O ALA B 15 -1.132 6.871 -10.926 1.00 0.00 O ATOM 1504 CB ALA B 15 -3.058 5.466 -12.419 1.00 0.00 C ATOM 0 H ALA B 15 -2.909 4.051 -10.312 1.00 0.00 H new ATOM 0 HA ALA B 15 -1.335 4.242 -12.756 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -2.808 6.189 -13.196 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -3.737 4.717 -12.826 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -3.540 5.980 -11.587 1.00 0.00 H new ATOM 1510 N PHE B 16 0.492 5.518 -11.714 1.00 0.00 N ATOM 1511 CA PHE B 16 1.613 6.390 -11.372 1.00 0.00 C ATOM 1512 C PHE B 16 2.890 5.778 -11.895 1.00 0.00 C ATOM 1513 O PHE B 16 2.886 4.675 -12.421 1.00 0.00 O ATOM 1514 CB PHE B 16 1.738 6.619 -9.864 1.00 0.00 C ATOM 1515 CG PHE B 16 0.782 7.642 -9.321 1.00 0.00 C ATOM 1516 CD1 PHE B 16 0.846 8.961 -9.741 1.00 0.00 C ATOM 1517 CD2 PHE B 16 -0.179 7.284 -8.392 1.00 0.00 C ATOM 1518 CE1 PHE B 16 -0.033 9.904 -9.242 1.00 0.00 C ATOM 1519 CE2 PHE B 16 -1.061 8.222 -7.888 1.00 0.00 C ATOM 1520 CZ PHE B 16 -0.988 9.534 -8.315 1.00 0.00 C ATOM 0 H PHE B 16 0.775 4.648 -12.165 1.00 0.00 H new ATOM 0 HA PHE B 16 1.431 7.361 -11.833 1.00 0.00 H new ATOM 0 HB2 PHE B 16 1.574 5.673 -9.348 1.00 0.00 H new ATOM 0 HB3 PHE B 16 2.757 6.933 -9.638 1.00 0.00 H new ATOM 0 HD1 PHE B 16 1.591 9.255 -10.466 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -0.241 6.259 -8.056 1.00 0.00 H new ATOM 0 HE1 PHE B 16 0.027 10.929 -9.577 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -1.805 7.930 -7.162 1.00 0.00 H new ATOM 0 HZ PHE B 16 -1.676 10.269 -7.925 1.00 0.00 H new ATOM 1530 N ASP B 17 3.974 6.506 -11.769 1.00 0.00 N ATOM 1531 CA ASP B 17 5.269 6.047 -12.239 1.00 0.00 C ATOM 1532 C ASP B 17 6.179 7.231 -12.386 1.00 0.00 C ATOM 1533 O ASP B 17 7.360 7.168 -12.077 1.00 0.00 O ATOM 1534 CB ASP B 17 5.159 5.314 -13.574 1.00 0.00 C ATOM 1535 CG ASP B 17 5.246 3.807 -13.421 1.00 0.00 C ATOM 1536 OD1 ASP B 17 5.294 3.108 -14.455 1.00 0.00 O ATOM 1537 OD2 ASP B 17 5.266 3.326 -12.269 1.00 0.00 O ATOM 0 H ASP B 17 3.988 7.431 -11.340 1.00 0.00 H new ATOM 0 HA ASP B 17 5.671 5.344 -11.510 1.00 0.00 H new ATOM 0 HB2 ASP B 17 4.213 5.573 -14.050 1.00 0.00 H new ATOM 0 HB3 ASP B 17 5.954 5.655 -14.238 1.00 0.00 H new ATOM 1542 N GLU B 18 5.621 8.333 -12.840 1.00 0.00 N ATOM 1543 CA GLU B 18 6.416 9.527 -13.000 1.00 0.00 C ATOM 1544 C GLU B 18 7.251 9.758 -11.740 1.00 0.00 C ATOM 1545 O GLU B 18 8.486 9.756 -11.782 1.00 0.00 O ATOM 1546 CB GLU B 18 5.529 10.739 -13.280 1.00 0.00 C ATOM 1547 CG GLU B 18 6.304 11.958 -13.756 1.00 0.00 C ATOM 1548 CD GLU B 18 6.819 12.804 -12.608 1.00 0.00 C ATOM 1549 OE1 GLU B 18 5.987 13.367 -11.865 1.00 0.00 O ATOM 1550 OE2 GLU B 18 8.053 12.902 -12.450 1.00 0.00 O ATOM 0 H GLU B 18 4.639 8.425 -13.100 1.00 0.00 H new ATOM 0 HA GLU B 18 7.081 9.394 -13.854 1.00 0.00 H new ATOM 0 HB2 GLU B 18 4.788 10.471 -14.034 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.982 10.997 -12.373 1.00 0.00 H new ATOM 0 HG2 GLU B 18 7.145 11.633 -14.369 1.00 0.00 H new ATOM 0 HG3 GLU B 18 5.662 12.567 -14.392 1.00 0.00 H new ATOM 1557 N ASP B 19 6.565 9.921 -10.612 1.00 0.00 N ATOM 1558 CA ASP B 19 7.239 10.133 -9.339 1.00 0.00 C ATOM 1559 C ASP B 19 7.622 8.815 -8.680 1.00 0.00 C ATOM 1560 O ASP B 19 8.766 8.636 -8.268 1.00 0.00 O ATOM 1561 CB ASP B 19 6.353 10.956 -8.399 1.00 0.00 C ATOM 1562 CG ASP B 19 7.025 12.237 -7.946 1.00 0.00 C ATOM 1563 OD1 ASP B 19 6.857 13.270 -8.629 1.00 0.00 O ATOM 1564 OD2 ASP B 19 7.719 12.210 -6.908 1.00 0.00 O ATOM 0 H ASP B 19 5.547 9.910 -10.556 1.00 0.00 H new ATOM 0 HA ASP B 19 8.158 10.684 -9.539 1.00 0.00 H new ATOM 0 HB2 ASP B 19 5.418 11.198 -8.905 1.00 0.00 H new ATOM 0 HB3 ASP B 19 6.097 10.355 -7.526 1.00 0.00 H new ATOM 1569 N VAL B 20 6.669 7.897 -8.573 1.00 0.00 N ATOM 1570 CA VAL B 20 6.948 6.613 -7.951 1.00 0.00 C ATOM 1571 C VAL B 20 8.042 5.866 -8.713 1.00 0.00 C ATOM 1572 O VAL B 20 8.963 5.331 -8.105 1.00 0.00 O ATOM 1573 CB VAL B 20 5.685 5.733 -7.826 1.00 0.00 C ATOM 1574 CG1 VAL B 20 4.579 6.497 -7.118 1.00 0.00 C ATOM 1575 CG2 VAL B 20 5.213 5.257 -9.184 1.00 0.00 C ATOM 0 H VAL B 20 5.711 8.016 -8.904 1.00 0.00 H new ATOM 0 HA VAL B 20 7.299 6.823 -6.941 1.00 0.00 H new ATOM 0 HB VAL B 20 5.942 4.855 -7.234 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.695 5.865 -7.037 1.00 0.00 H new ATOM 0 HG12 VAL B 20 4.914 6.782 -6.121 1.00 0.00 H new ATOM 0 HG13 VAL B 20 4.333 7.393 -7.688 1.00 0.00 H new ATOM 0 HG21 VAL B 20 4.323 4.640 -9.064 1.00 0.00 H new ATOM 0 HG22 VAL B 20 4.976 6.118 -9.809 1.00 0.00 H new ATOM 0 HG23 VAL B 20 6.000 4.670 -9.658 1.00 0.00 H new ATOM 1585 N TYR B 21 7.961 5.853 -10.046 1.00 0.00 N ATOM 1586 CA TYR B 21 8.980 5.181 -10.850 1.00 0.00 C ATOM 1587 C TYR B 21 10.323 5.875 -10.673 1.00 0.00 C ATOM 1588 O TYR B 21 11.337 5.217 -10.439 1.00 0.00 O ATOM 1589 CB TYR B 21 8.609 5.137 -12.339 1.00 0.00 C ATOM 1590 CG TYR B 21 9.319 4.045 -13.106 1.00 0.00 C ATOM 1591 CD1 TYR B 21 9.399 2.754 -12.600 1.00 0.00 C ATOM 1592 CD2 TYR B 21 9.913 4.306 -14.334 1.00 0.00 C ATOM 1593 CE1 TYR B 21 10.051 1.754 -13.297 1.00 0.00 C ATOM 1594 CE2 TYR B 21 10.565 3.311 -15.037 1.00 0.00 C ATOM 1595 CZ TYR B 21 10.632 2.037 -14.514 1.00 0.00 C ATOM 1596 OH TYR B 21 11.281 1.044 -15.211 1.00 0.00 O ATOM 0 H TYR B 21 7.213 6.293 -10.582 1.00 0.00 H new ATOM 0 HA TYR B 21 9.046 4.152 -10.498 1.00 0.00 H new ATOM 0 HB2 TYR B 21 7.532 4.995 -12.433 1.00 0.00 H new ATOM 0 HB3 TYR B 21 8.844 6.100 -12.792 1.00 0.00 H new ATOM 0 HD1 TYR B 21 8.945 2.528 -11.647 1.00 0.00 H new ATOM 0 HD2 TYR B 21 9.865 5.303 -14.746 1.00 0.00 H new ATOM 0 HE1 TYR B 21 10.105 0.755 -12.889 1.00 0.00 H new ATOM 0 HE2 TYR B 21 11.020 3.530 -15.992 1.00 0.00 H new ATOM 0 HH TYR B 21 11.633 1.409 -16.049 1.00 0.00 H new ATOM 1606 N HIS B 22 10.338 7.211 -10.764 1.00 0.00 N ATOM 1607 CA HIS B 22 11.583 7.944 -10.584 1.00 0.00 C ATOM 1608 C HIS B 22 12.101 7.739 -9.170 1.00 0.00 C ATOM 1609 O HIS B 22 13.276 7.432 -8.970 1.00 0.00 O ATOM 1610 CB HIS B 22 11.380 9.434 -10.868 1.00 0.00 C ATOM 1611 CG HIS B 22 12.660 10.195 -11.021 1.00 0.00 C ATOM 1612 ND1 HIS B 22 12.985 10.900 -12.161 1.00 0.00 N ATOM 1613 CD2 HIS B 22 13.700 10.361 -10.170 1.00 0.00 C ATOM 1614 CE1 HIS B 22 14.169 11.466 -12.004 1.00 0.00 C ATOM 1615 NE2 HIS B 22 14.623 11.155 -10.805 1.00 0.00 N ATOM 0 H HIS B 22 9.520 7.789 -10.957 1.00 0.00 H new ATOM 0 HA HIS B 22 12.319 7.562 -11.291 1.00 0.00 H new ATOM 0 HB2 HIS B 22 10.790 9.545 -11.778 1.00 0.00 H new ATOM 0 HB3 HIS B 22 10.800 9.874 -10.057 1.00 0.00 H new ATOM 0 HD2 HIS B 22 13.787 9.946 -9.177 1.00 0.00 H new ATOM 0 HE1 HIS B 22 14.678 12.079 -12.733 1.00 0.00 H new ATOM 0 HE2 HIS B 22 15.515 11.456 -10.413 1.00 0.00 H new ATOM 1624 N THR B 23 11.215 7.881 -8.188 1.00 0.00 N ATOM 1625 CA THR B 23 11.602 7.675 -6.800 1.00 0.00 C ATOM 1626 C THR B 23 12.069 6.240 -6.611 1.00 0.00 C ATOM 1627 O THR B 23 13.077 5.981 -5.957 1.00 0.00 O ATOM 1628 CB THR B 23 10.447 7.970 -5.852 1.00 0.00 C ATOM 1629 OG1 THR B 23 9.335 7.140 -6.139 1.00 0.00 O ATOM 1630 CG2 THR B 23 9.976 9.408 -5.904 1.00 0.00 C ATOM 0 H THR B 23 10.237 8.135 -8.327 1.00 0.00 H new ATOM 0 HA THR B 23 12.414 8.364 -6.566 1.00 0.00 H new ATOM 0 HB THR B 23 10.839 7.772 -4.854 1.00 0.00 H new ATOM 0 HG1 THR B 23 9.313 6.392 -5.506 1.00 0.00 H new ATOM 0 HG21 THR B 23 9.152 9.547 -5.204 1.00 0.00 H new ATOM 0 HG22 THR B 23 10.798 10.070 -5.633 1.00 0.00 H new ATOM 0 HG23 THR B 23 9.638 9.644 -6.913 1.00 0.00 H new ATOM 1638 N LEU B 24 11.338 5.307 -7.217 1.00 0.00 N ATOM 1639 CA LEU B 24 11.690 3.895 -7.145 1.00 0.00 C ATOM 1640 C LEU B 24 13.114 3.685 -7.647 1.00 0.00 C ATOM 1641 O LEU B 24 13.733 2.659 -7.375 1.00 0.00 O ATOM 1642 CB LEU B 24 10.718 3.049 -7.982 1.00 0.00 C ATOM 1643 CG LEU B 24 9.679 2.247 -7.190 1.00 0.00 C ATOM 1644 CD1 LEU B 24 10.319 1.559 -5.996 1.00 0.00 C ATOM 1645 CD2 LEU B 24 8.537 3.140 -6.735 1.00 0.00 C ATOM 0 H LEU B 24 10.499 5.505 -7.762 1.00 0.00 H new ATOM 0 HA LEU B 24 11.622 3.579 -6.104 1.00 0.00 H new ATOM 0 HB2 LEU B 24 10.191 3.710 -8.671 1.00 0.00 H new ATOM 0 HB3 LEU B 24 11.300 2.355 -8.588 1.00 0.00 H new ATOM 0 HG LEU B 24 9.275 1.481 -7.852 1.00 0.00 H new ATOM 0 HD11 LEU B 24 9.561 0.997 -5.451 1.00 0.00 H new ATOM 0 HD12 LEU B 24 11.097 0.878 -6.342 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.759 2.308 -5.337 1.00 0.00 H new ATOM 0 HD21 LEU B 24 7.813 2.548 -6.175 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.927 3.933 -6.098 1.00 0.00 H new ATOM 0 HD23 LEU B 24 8.050 3.580 -7.605 1.00 0.00 H new ATOM 1657 N LYS B 25 13.622 4.662 -8.395 1.00 0.00 N ATOM 1658 CA LYS B 25 14.961 4.577 -8.946 1.00 0.00 C ATOM 1659 C LYS B 25 16.030 4.641 -7.862 1.00 0.00 C ATOM 1660 O LYS B 25 16.968 3.844 -7.872 1.00 0.00 O ATOM 1661 CB LYS B 25 15.189 5.683 -9.977 1.00 0.00 C ATOM 1662 CG LYS B 25 16.422 5.466 -10.839 1.00 0.00 C ATOM 1663 CD LYS B 25 16.394 4.106 -11.523 1.00 0.00 C ATOM 1664 CE LYS B 25 17.363 3.131 -10.871 1.00 0.00 C ATOM 1665 NZ LYS B 25 18.500 2.794 -11.770 1.00 0.00 N ATOM 0 H LYS B 25 13.122 5.519 -8.630 1.00 0.00 H new ATOM 0 HA LYS B 25 15.046 3.607 -9.437 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.313 5.753 -10.622 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.281 6.638 -9.459 1.00 0.00 H new ATOM 0 HG2 LYS B 25 16.483 6.252 -11.592 1.00 0.00 H new ATOM 0 HG3 LYS B 25 17.317 5.545 -10.222 1.00 0.00 H new ATOM 0 HD2 LYS B 25 15.384 3.698 -11.482 1.00 0.00 H new ATOM 0 HD3 LYS B 25 16.648 4.223 -12.577 1.00 0.00 H new ATOM 0 HE2 LYS B 25 17.747 3.564 -9.947 1.00 0.00 H new ATOM 0 HE3 LYS B 25 16.832 2.219 -10.599 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 19.137 2.128 -11.289 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 18.136 2.358 -12.641 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 19.022 3.661 -12.009 1.00 0.00 H new ATOM 1679 N LEU B 26 15.898 5.575 -6.922 1.00 0.00 N ATOM 1680 CA LEU B 26 16.888 5.679 -5.855 1.00 0.00 C ATOM 1681 C LEU B 26 16.716 4.524 -4.888 1.00 0.00 C ATOM 1682 O LEU B 26 17.683 3.877 -4.501 1.00 0.00 O ATOM 1683 CB LEU B 26 16.803 7.008 -5.101 1.00 0.00 C ATOM 1684 CG LEU B 26 16.187 8.165 -5.876 1.00 0.00 C ATOM 1685 CD1 LEU B 26 14.684 8.135 -5.713 1.00 0.00 C ATOM 1686 CD2 LEU B 26 16.760 9.493 -5.402 1.00 0.00 C ATOM 0 H LEU B 26 15.137 6.253 -6.877 1.00 0.00 H new ATOM 0 HA LEU B 26 17.873 5.638 -6.319 1.00 0.00 H new ATOM 0 HB2 LEU B 26 16.222 6.853 -4.192 1.00 0.00 H new ATOM 0 HB3 LEU B 26 17.808 7.295 -4.792 1.00 0.00 H new ATOM 0 HG LEU B 26 16.430 8.059 -6.933 1.00 0.00 H new ATOM 0 HD11 LEU B 26 14.241 8.963 -6.267 1.00 0.00 H new ATOM 0 HD12 LEU B 26 14.295 7.192 -6.097 1.00 0.00 H new ATOM 0 HD13 LEU B 26 14.431 8.229 -4.657 1.00 0.00 H new ATOM 0 HD21 LEU B 26 16.307 10.307 -5.968 1.00 0.00 H new ATOM 0 HD22 LEU B 26 16.545 9.624 -4.342 1.00 0.00 H new ATOM 0 HD23 LEU B 26 17.839 9.500 -5.557 1.00 0.00 H new ATOM 1698 N VAL B 27 15.470 4.264 -4.519 1.00 0.00 N ATOM 1699 CA VAL B 27 15.158 3.170 -3.608 1.00 0.00 C ATOM 1700 C VAL B 27 15.568 1.840 -4.202 1.00 0.00 C ATOM 1701 O VAL B 27 16.105 0.982 -3.508 1.00 0.00 O ATOM 1702 CB VAL B 27 13.661 3.095 -3.262 1.00 0.00 C ATOM 1703 CG1 VAL B 27 13.390 3.638 -1.875 1.00 0.00 C ATOM 1704 CG2 VAL B 27 12.842 3.824 -4.280 1.00 0.00 C ATOM 0 H VAL B 27 14.659 4.795 -4.836 1.00 0.00 H new ATOM 0 HA VAL B 27 15.719 3.374 -2.696 1.00 0.00 H new ATOM 0 HB VAL B 27 13.371 2.044 -3.275 1.00 0.00 H new ATOM 0 HG11 VAL B 27 12.323 3.571 -1.660 1.00 0.00 H new ATOM 0 HG12 VAL B 27 13.945 3.054 -1.141 1.00 0.00 H new ATOM 0 HG13 VAL B 27 13.706 4.680 -1.824 1.00 0.00 H new ATOM 0 HG21 VAL B 27 11.787 3.757 -4.014 1.00 0.00 H new ATOM 0 HG22 VAL B 27 13.144 4.871 -4.307 1.00 0.00 H new ATOM 0 HG23 VAL B 27 12.998 3.376 -5.261 1.00 0.00 H new ATOM 1714 N SER B 28 15.294 1.651 -5.482 1.00 0.00 N ATOM 1715 CA SER B 28 15.633 0.393 -6.115 1.00 0.00 C ATOM 1716 C SER B 28 17.139 0.173 -6.129 1.00 0.00 C ATOM 1717 O SER B 28 17.612 -0.948 -5.932 1.00 0.00 O ATOM 1718 CB SER B 28 15.069 0.323 -7.536 1.00 0.00 C ATOM 1719 OG SER B 28 13.661 0.168 -7.519 1.00 0.00 O ATOM 0 H SER B 28 14.848 2.338 -6.090 1.00 0.00 H new ATOM 0 HA SER B 28 15.178 -0.404 -5.527 1.00 0.00 H new ATOM 0 HB2 SER B 28 15.331 1.230 -8.080 1.00 0.00 H new ATOM 0 HB3 SER B 28 15.523 -0.511 -8.070 1.00 0.00 H new ATOM 0 HG SER B 28 13.243 1.008 -7.237 1.00 0.00 H new ATOM 1725 N VAL B 29 17.884 1.249 -6.351 1.00 0.00 N ATOM 1726 CA VAL B 29 19.334 1.183 -6.383 1.00 0.00 C ATOM 1727 C VAL B 29 19.895 1.154 -4.967 1.00 0.00 C ATOM 1728 O VAL B 29 20.774 0.355 -4.645 1.00 0.00 O ATOM 1729 CB VAL B 29 19.904 2.392 -7.163 1.00 0.00 C ATOM 1730 CG1 VAL B 29 20.738 3.305 -6.278 1.00 0.00 C ATOM 1731 CG2 VAL B 29 20.707 1.924 -8.368 1.00 0.00 C ATOM 0 H VAL B 29 17.502 2.181 -6.512 1.00 0.00 H new ATOM 0 HA VAL B 29 19.632 0.266 -6.891 1.00 0.00 H new ATOM 0 HB VAL B 29 19.055 2.978 -7.516 1.00 0.00 H new ATOM 0 HG11 VAL B 29 21.116 4.139 -6.869 1.00 0.00 H new ATOM 0 HG12 VAL B 29 20.120 3.687 -5.465 1.00 0.00 H new ATOM 0 HG13 VAL B 29 21.576 2.744 -5.864 1.00 0.00 H new ATOM 0 HG21 VAL B 29 21.099 2.789 -8.903 1.00 0.00 H new ATOM 0 HG22 VAL B 29 21.535 1.299 -8.033 1.00 0.00 H new ATOM 0 HG23 VAL B 29 20.063 1.348 -9.033 1.00 0.00 H new ATOM 1741 N TYR B 30 19.377 2.043 -4.134 1.00 0.00 N ATOM 1742 CA TYR B 30 19.819 2.144 -2.748 1.00 0.00 C ATOM 1743 C TYR B 30 19.310 0.976 -1.912 1.00 0.00 C ATOM 1744 O TYR B 30 19.916 0.629 -0.898 1.00 0.00 O ATOM 1745 CB TYR B 30 19.354 3.463 -2.129 1.00 0.00 C ATOM 1746 CG TYR B 30 20.271 4.628 -2.426 1.00 0.00 C ATOM 1747 CD1 TYR B 30 21.620 4.575 -2.097 1.00 0.00 C ATOM 1748 CD2 TYR B 30 19.788 5.781 -3.032 1.00 0.00 C ATOM 1749 CE1 TYR B 30 22.461 5.638 -2.365 1.00 0.00 C ATOM 1750 CE2 TYR B 30 20.623 6.848 -3.303 1.00 0.00 C ATOM 1751 CZ TYR B 30 21.958 6.771 -2.968 1.00 0.00 C ATOM 1752 OH TYR B 30 22.793 7.831 -3.236 1.00 0.00 O ATOM 0 H TYR B 30 18.648 2.708 -4.393 1.00 0.00 H new ATOM 0 HA TYR B 30 20.909 2.113 -2.751 1.00 0.00 H new ATOM 0 HB2 TYR B 30 18.355 3.695 -2.497 1.00 0.00 H new ATOM 0 HB3 TYR B 30 19.275 3.340 -1.049 1.00 0.00 H new ATOM 0 HD1 TYR B 30 22.017 3.689 -1.624 1.00 0.00 H new ATOM 0 HD2 TYR B 30 18.743 5.844 -3.296 1.00 0.00 H new ATOM 0 HE1 TYR B 30 23.507 5.582 -2.103 1.00 0.00 H new ATOM 0 HE2 TYR B 30 20.232 7.737 -3.775 1.00 0.00 H new ATOM 0 HH TYR B 30 22.282 8.550 -3.663 1.00 0.00 H new ATOM 1762 N LEU B 31 18.202 0.364 -2.326 1.00 0.00 N ATOM 1763 CA LEU B 31 17.652 -0.761 -1.581 1.00 0.00 C ATOM 1764 C LEU B 31 17.847 -2.065 -2.347 1.00 0.00 C ATOM 1765 O LEU B 31 17.485 -3.137 -1.862 1.00 0.00 O ATOM 1766 CB LEU B 31 16.156 -0.552 -1.288 1.00 0.00 C ATOM 1767 CG LEU B 31 15.723 0.844 -0.791 1.00 0.00 C ATOM 1768 CD1 LEU B 31 14.683 0.715 0.314 1.00 0.00 C ATOM 1769 CD2 LEU B 31 16.905 1.670 -0.302 1.00 0.00 C ATOM 0 H LEU B 31 17.676 0.625 -3.160 1.00 0.00 H new ATOM 0 HA LEU B 31 18.189 -0.822 -0.634 1.00 0.00 H new ATOM 0 HB2 LEU B 31 15.599 -0.774 -2.198 1.00 0.00 H new ATOM 0 HB3 LEU B 31 15.852 -1.286 -0.541 1.00 0.00 H new ATOM 0 HG LEU B 31 15.285 1.367 -1.641 1.00 0.00 H new ATOM 0 HD11 LEU B 31 14.388 1.708 0.654 1.00 0.00 H new ATOM 0 HD12 LEU B 31 13.809 0.188 -0.069 1.00 0.00 H new ATOM 0 HD13 LEU B 31 15.107 0.157 1.149 1.00 0.00 H new ATOM 0 HD21 LEU B 31 16.553 2.644 0.038 1.00 0.00 H new ATOM 0 HD22 LEU B 31 17.394 1.153 0.524 1.00 0.00 H new ATOM 0 HD23 LEU B 31 17.616 1.806 -1.117 1.00 0.00 H new ATOM 1781 N ASN B 32 18.409 -1.973 -3.554 1.00 0.00 N ATOM 1782 CA ASN B 32 18.630 -3.152 -4.382 1.00 0.00 C ATOM 1783 C ASN B 32 17.341 -3.956 -4.479 1.00 0.00 C ATOM 1784 O ASN B 32 17.355 -5.187 -4.490 1.00 0.00 O ATOM 1785 CB ASN B 32 19.752 -4.015 -3.799 1.00 0.00 C ATOM 1786 CG ASN B 32 20.786 -4.397 -4.839 1.00 0.00 C ATOM 1787 OD1 ASN B 32 21.988 -4.378 -4.572 1.00 0.00 O ATOM 1788 ND2 ASN B 32 20.323 -4.747 -6.033 1.00 0.00 N ATOM 0 H ASN B 32 18.717 -1.097 -3.975 1.00 0.00 H new ATOM 0 HA ASN B 32 18.929 -2.833 -5.380 1.00 0.00 H new ATOM 0 HB2 ASN B 32 20.239 -3.474 -2.988 1.00 0.00 H new ATOM 0 HB3 ASN B 32 19.324 -4.919 -3.367 1.00 0.00 H new ATOM 0 HD21 ASN B 32 20.972 -5.014 -6.773 1.00 0.00 H new ATOM 0 HD22 ASN B 32 19.318 -4.748 -6.210 1.00 0.00 H new ATOM 1795 N ARG B 33 16.226 -3.236 -4.526 1.00 0.00 N ATOM 1796 CA ARG B 33 14.912 -3.863 -4.597 1.00 0.00 C ATOM 1797 C ARG B 33 14.129 -3.377 -5.808 1.00 0.00 C ATOM 1798 O ARG B 33 14.156 -2.193 -6.143 1.00 0.00 O ATOM 1799 CB ARG B 33 14.119 -3.556 -3.323 1.00 0.00 C ATOM 1800 CG ARG B 33 14.645 -4.274 -2.092 1.00 0.00 C ATOM 1801 CD ARG B 33 13.520 -4.658 -1.144 1.00 0.00 C ATOM 1802 NE ARG B 33 13.527 -6.085 -0.832 1.00 0.00 N ATOM 1803 CZ ARG B 33 14.444 -6.672 -0.067 1.00 0.00 C ATOM 1804 NH1 ARG B 33 15.434 -5.960 0.460 1.00 0.00 N ATOM 1805 NH2 ARG B 33 14.374 -7.975 0.171 1.00 0.00 N ATOM 0 H ARG B 33 16.206 -2.216 -4.516 1.00 0.00 H new ATOM 0 HA ARG B 33 15.060 -4.939 -4.693 1.00 0.00 H new ATOM 0 HB2 ARG B 33 14.139 -2.481 -3.143 1.00 0.00 H new ATOM 0 HB3 ARG B 33 13.077 -3.834 -3.478 1.00 0.00 H new ATOM 0 HG2 ARG B 33 15.187 -5.170 -2.396 1.00 0.00 H new ATOM 0 HG3 ARG B 33 15.356 -3.632 -1.572 1.00 0.00 H new ATOM 0 HD2 ARG B 33 13.613 -4.085 -0.221 1.00 0.00 H new ATOM 0 HD3 ARG B 33 12.563 -4.390 -1.591 1.00 0.00 H new ATOM 0 HE ARG B 33 12.785 -6.666 -1.224 1.00 0.00 H new ATOM 0 HH11 ARG B 33 15.494 -4.958 0.279 1.00 0.00 H new ATOM 0 HH12 ARG B 33 16.134 -6.415 1.046 1.00 0.00 H new ATOM 0 HH21 ARG B 33 13.617 -8.527 -0.232 1.00 0.00 H new ATOM 0 HH22 ARG B 33 15.077 -8.425 0.757 1.00 0.00 H new ATOM 1819 N ASP B 34 13.410 -4.291 -6.449 1.00 0.00 N ATOM 1820 CA ASP B 34 12.599 -3.939 -7.605 1.00 0.00 C ATOM 1821 C ASP B 34 11.583 -2.879 -7.206 1.00 0.00 C ATOM 1822 O ASP B 34 11.335 -2.671 -6.018 1.00 0.00 O ATOM 1823 CB ASP B 34 11.888 -5.174 -8.161 1.00 0.00 C ATOM 1824 CG ASP B 34 12.788 -6.004 -9.055 1.00 0.00 C ATOM 1825 OD1 ASP B 34 12.782 -5.774 -10.282 1.00 0.00 O ATOM 1826 OD2 ASP B 34 13.500 -6.885 -8.528 1.00 0.00 O ATOM 0 H ASP B 34 13.373 -5.276 -6.188 1.00 0.00 H new ATOM 0 HA ASP B 34 13.247 -3.542 -8.386 1.00 0.00 H new ATOM 0 HB2 ASP B 34 11.534 -5.790 -7.334 1.00 0.00 H new ATOM 0 HB3 ASP B 34 11.009 -4.861 -8.724 1.00 0.00 H new ATOM 1831 N MET B 35 10.999 -2.203 -8.186 1.00 0.00 N ATOM 1832 CA MET B 35 10.025 -1.170 -7.898 1.00 0.00 C ATOM 1833 C MET B 35 8.886 -1.730 -7.047 1.00 0.00 C ATOM 1834 O MET B 35 8.669 -1.292 -5.919 1.00 0.00 O ATOM 1835 CB MET B 35 9.492 -0.566 -9.202 1.00 0.00 C ATOM 1836 CG MET B 35 7.984 -0.402 -9.230 1.00 0.00 C ATOM 1837 SD MET B 35 7.419 0.682 -10.555 1.00 0.00 S ATOM 1838 CE MET B 35 6.649 1.996 -9.613 1.00 0.00 C ATOM 0 H MET B 35 11.183 -2.352 -9.178 1.00 0.00 H new ATOM 0 HA MET B 35 10.511 -0.378 -7.329 1.00 0.00 H new ATOM 0 HB2 MET B 35 9.957 0.408 -9.357 1.00 0.00 H new ATOM 0 HB3 MET B 35 9.795 -1.200 -10.035 1.00 0.00 H new ATOM 0 HG2 MET B 35 7.519 -1.381 -9.346 1.00 0.00 H new ATOM 0 HG3 MET B 35 7.650 -0.002 -8.273 1.00 0.00 H new ATOM 0 HE1 MET B 35 5.688 2.249 -10.060 1.00 0.00 H new ATOM 0 HE2 MET B 35 6.495 1.665 -8.586 1.00 0.00 H new ATOM 0 HE3 MET B 35 7.294 2.874 -9.619 1.00 0.00 H new ATOM 1848 N THR B 36 8.163 -2.698 -7.602 1.00 0.00 N ATOM 1849 CA THR B 36 7.042 -3.320 -6.904 1.00 0.00 C ATOM 1850 C THR B 36 7.464 -3.812 -5.523 1.00 0.00 C ATOM 1851 O THR B 36 6.707 -3.702 -4.560 1.00 0.00 O ATOM 1852 CB THR B 36 6.482 -4.479 -7.740 1.00 0.00 C ATOM 1853 OG1 THR B 36 6.689 -4.245 -9.121 1.00 0.00 O ATOM 1854 CG2 THR B 36 5.005 -4.723 -7.539 1.00 0.00 C ATOM 0 H THR B 36 8.334 -3.070 -8.536 1.00 0.00 H new ATOM 0 HA THR B 36 6.261 -2.572 -6.769 1.00 0.00 H new ATOM 0 HB THR B 36 7.024 -5.360 -7.395 1.00 0.00 H new ATOM 0 HG1 THR B 36 6.327 -4.995 -9.638 1.00 0.00 H new ATOM 0 HG21 THR B 36 4.686 -5.557 -8.164 1.00 0.00 H new ATOM 0 HG22 THR B 36 4.815 -4.960 -6.492 1.00 0.00 H new ATOM 0 HG23 THR B 36 4.447 -3.828 -7.816 1.00 0.00 H new ATOM 1862 N GLU B 37 8.678 -4.340 -5.427 1.00 0.00 N ATOM 1863 CA GLU B 37 9.191 -4.828 -4.154 1.00 0.00 C ATOM 1864 C GLU B 37 9.335 -3.675 -3.167 1.00 0.00 C ATOM 1865 O GLU B 37 9.056 -3.817 -1.979 1.00 0.00 O ATOM 1866 CB GLU B 37 10.540 -5.521 -4.353 1.00 0.00 C ATOM 1867 CG GLU B 37 10.946 -6.411 -3.190 1.00 0.00 C ATOM 1868 CD GLU B 37 12.056 -7.376 -3.554 1.00 0.00 C ATOM 1869 OE1 GLU B 37 12.927 -7.000 -4.367 1.00 0.00 O ATOM 1870 OE2 GLU B 37 12.057 -8.509 -3.027 1.00 0.00 O ATOM 0 H GLU B 37 9.322 -4.441 -6.211 1.00 0.00 H new ATOM 0 HA GLU B 37 8.483 -5.552 -3.750 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.500 -6.121 -5.262 1.00 0.00 H new ATOM 0 HB3 GLU B 37 11.309 -4.764 -4.505 1.00 0.00 H new ATOM 0 HG2 GLU B 37 11.270 -5.788 -2.357 1.00 0.00 H new ATOM 0 HG3 GLU B 37 10.078 -6.974 -2.848 1.00 0.00 H new ATOM 1877 N ILE B 38 9.769 -2.527 -3.676 1.00 0.00 N ATOM 1878 CA ILE B 38 9.953 -1.337 -2.855 1.00 0.00 C ATOM 1879 C ILE B 38 8.624 -0.631 -2.602 1.00 0.00 C ATOM 1880 O ILE B 38 8.237 -0.409 -1.456 1.00 0.00 O ATOM 1881 CB ILE B 38 10.916 -0.343 -3.538 1.00 0.00 C ATOM 1882 CG1 ILE B 38 12.387 -0.701 -3.276 1.00 0.00 C ATOM 1883 CG2 ILE B 38 10.652 1.081 -3.078 1.00 0.00 C ATOM 1884 CD1 ILE B 38 12.683 -1.036 -1.829 1.00 0.00 C ATOM 0 H ILE B 38 10.001 -2.396 -4.661 1.00 0.00 H new ATOM 0 HA ILE B 38 10.375 -1.665 -1.905 1.00 0.00 H new ATOM 0 HB ILE B 38 10.729 -0.413 -4.610 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.662 -1.551 -3.900 1.00 0.00 H new ATOM 0 HG13 ILE B 38 13.015 0.135 -3.582 1.00 0.00 H new ATOM 0 HG21 ILE B 38 11.345 1.759 -3.576 1.00 0.00 H new ATOM 0 HG22 ILE B 38 9.629 1.360 -3.329 1.00 0.00 H new ATOM 0 HG23 ILE B 38 10.792 1.147 -1.999 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.740 -1.278 -1.721 1.00 0.00 H new ATOM 0 HD12 ILE B 38 12.441 -0.179 -1.200 1.00 0.00 H new ATOM 0 HD13 ILE B 38 12.081 -1.892 -1.523 1.00 0.00 H new ATOM 1896 N ILE B 39 7.933 -0.262 -3.677 1.00 0.00 N ATOM 1897 CA ILE B 39 6.674 0.427 -3.562 1.00 0.00 C ATOM 1898 C ILE B 39 5.688 -0.369 -2.725 1.00 0.00 C ATOM 1899 O ILE B 39 4.882 0.200 -1.989 1.00 0.00 O ATOM 1900 CB ILE B 39 6.107 0.674 -4.958 1.00 0.00 C ATOM 1901 CG1 ILE B 39 4.735 1.309 -4.898 1.00 0.00 C ATOM 1902 CG2 ILE B 39 6.063 -0.608 -5.757 1.00 0.00 C ATOM 1903 CD1 ILE B 39 4.596 2.404 -5.914 1.00 0.00 C ATOM 0 H ILE B 39 8.234 -0.434 -4.636 1.00 0.00 H new ATOM 0 HA ILE B 39 6.840 1.380 -3.060 1.00 0.00 H new ATOM 0 HB ILE B 39 6.775 1.373 -5.461 1.00 0.00 H new ATOM 0 HG12 ILE B 39 3.973 0.550 -5.072 1.00 0.00 H new ATOM 0 HG13 ILE B 39 4.562 1.712 -3.900 1.00 0.00 H new ATOM 0 HG21 ILE B 39 5.655 -0.406 -6.747 1.00 0.00 H new ATOM 0 HG22 ILE B 39 7.071 -1.011 -5.855 1.00 0.00 H new ATOM 0 HG23 ILE B 39 5.431 -1.334 -5.246 1.00 0.00 H new ATOM 0 HD11 ILE B 39 3.599 2.840 -5.845 1.00 0.00 H new ATOM 0 HD12 ILE B 39 5.343 3.175 -5.723 1.00 0.00 H new ATOM 0 HD13 ILE B 39 4.745 1.994 -6.913 1.00 0.00 H new ATOM 1915 N GLU B 40 5.757 -1.688 -2.834 1.00 0.00 N ATOM 1916 CA GLU B 40 4.867 -2.543 -2.076 1.00 0.00 C ATOM 1917 C GLU B 40 5.408 -2.803 -0.675 1.00 0.00 C ATOM 1918 O GLU B 40 4.636 -3.081 0.243 1.00 0.00 O ATOM 1919 CB GLU B 40 4.620 -3.865 -2.800 1.00 0.00 C ATOM 1920 CG GLU B 40 3.284 -4.498 -2.446 1.00 0.00 C ATOM 1921 CD GLU B 40 2.165 -4.040 -3.362 1.00 0.00 C ATOM 1922 OE1 GLU B 40 2.366 -4.049 -4.594 1.00 0.00 O ATOM 1923 OE2 GLU B 40 1.088 -3.673 -2.847 1.00 0.00 O ATOM 0 H GLU B 40 6.416 -2.182 -3.436 1.00 0.00 H new ATOM 0 HA GLU B 40 3.916 -2.018 -1.984 1.00 0.00 H new ATOM 0 HB2 GLU B 40 4.662 -3.696 -3.876 1.00 0.00 H new ATOM 0 HB3 GLU B 40 5.422 -4.562 -2.555 1.00 0.00 H new ATOM 0 HG2 GLU B 40 3.373 -5.583 -2.501 1.00 0.00 H new ATOM 0 HG3 GLU B 40 3.030 -4.251 -1.415 1.00 0.00 H new ATOM 1930 N GLU B 41 6.727 -2.702 -0.492 1.00 0.00 N ATOM 1931 CA GLU B 41 7.289 -2.924 0.838 1.00 0.00 C ATOM 1932 C GLU B 41 7.221 -1.641 1.660 1.00 0.00 C ATOM 1933 O GLU B 41 7.083 -1.679 2.885 1.00 0.00 O ATOM 1934 CB GLU B 41 8.729 -3.449 0.767 1.00 0.00 C ATOM 1935 CG GLU B 41 9.757 -2.405 0.364 1.00 0.00 C ATOM 1936 CD GLU B 41 10.689 -2.033 1.501 1.00 0.00 C ATOM 1937 OE1 GLU B 41 11.385 -2.933 2.017 1.00 0.00 O ATOM 1938 OE2 GLU B 41 10.723 -0.842 1.876 1.00 0.00 O ATOM 0 H GLU B 41 7.404 -2.476 -1.221 1.00 0.00 H new ATOM 0 HA GLU B 41 6.690 -3.690 1.330 1.00 0.00 H new ATOM 0 HB2 GLU B 41 9.003 -3.855 1.741 1.00 0.00 H new ATOM 0 HB3 GLU B 41 8.768 -4.274 0.055 1.00 0.00 H new ATOM 0 HG2 GLU B 41 10.344 -2.783 -0.473 1.00 0.00 H new ATOM 0 HG3 GLU B 41 9.242 -1.510 0.014 1.00 0.00 H new ATOM 1945 N ALA B 42 7.297 -0.504 0.974 1.00 0.00 N ATOM 1946 CA ALA B 42 7.228 0.791 1.634 1.00 0.00 C ATOM 1947 C ALA B 42 5.795 1.104 2.048 1.00 0.00 C ATOM 1948 O ALA B 42 5.550 1.644 3.127 1.00 0.00 O ATOM 1949 CB ALA B 42 7.764 1.880 0.716 1.00 0.00 C ATOM 0 H ALA B 42 7.406 -0.456 -0.039 1.00 0.00 H new ATOM 0 HA ALA B 42 7.846 0.756 2.531 1.00 0.00 H new ATOM 0 HB1 ALA B 42 7.706 2.844 1.222 1.00 0.00 H new ATOM 0 HB2 ALA B 42 8.802 1.664 0.463 1.00 0.00 H new ATOM 0 HB3 ALA B 42 7.168 1.913 -0.196 1.00 0.00 H new ATOM 1955 N VAL B 43 4.853 0.758 1.176 1.00 0.00 N ATOM 1956 CA VAL B 43 3.438 0.996 1.436 1.00 0.00 C ATOM 1957 C VAL B 43 2.989 0.322 2.717 1.00 0.00 C ATOM 1958 O VAL B 43 2.550 0.973 3.664 1.00 0.00 O ATOM 1959 CB VAL B 43 2.549 0.469 0.281 1.00 0.00 C ATOM 1960 CG1 VAL B 43 2.936 -0.934 -0.126 1.00 0.00 C ATOM 1961 CG2 VAL B 43 1.084 0.496 0.668 1.00 0.00 C ATOM 0 H VAL B 43 5.046 0.310 0.280 1.00 0.00 H new ATOM 0 HA VAL B 43 3.323 2.076 1.525 1.00 0.00 H new ATOM 0 HB VAL B 43 2.708 1.132 -0.569 1.00 0.00 H new ATOM 0 HG11 VAL B 43 2.290 -1.268 -0.938 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.973 -0.943 -0.460 1.00 0.00 H new ATOM 0 HG13 VAL B 43 2.824 -1.604 0.726 1.00 0.00 H new ATOM 0 HG21 VAL B 43 0.482 0.121 -0.160 1.00 0.00 H new ATOM 0 HG22 VAL B 43 0.928 -0.133 1.544 1.00 0.00 H new ATOM 0 HG23 VAL B 43 0.787 1.519 0.898 1.00 0.00 H new ATOM 1971 N VAL B 44 3.090 -0.989 2.720 1.00 0.00 N ATOM 1972 CA VAL B 44 2.685 -1.785 3.857 1.00 0.00 C ATOM 1973 C VAL B 44 3.398 -1.323 5.118 1.00 0.00 C ATOM 1974 O VAL B 44 2.770 -1.108 6.151 1.00 0.00 O ATOM 1975 CB VAL B 44 2.950 -3.279 3.586 1.00 0.00 C ATOM 1976 CG1 VAL B 44 3.487 -3.996 4.820 1.00 0.00 C ATOM 1977 CG2 VAL B 44 1.689 -3.960 3.079 1.00 0.00 C ATOM 0 H VAL B 44 3.454 -1.532 1.937 1.00 0.00 H new ATOM 0 HA VAL B 44 1.614 -1.651 4.011 1.00 0.00 H new ATOM 0 HB VAL B 44 3.718 -3.339 2.815 1.00 0.00 H new ATOM 0 HG11 VAL B 44 3.660 -5.046 4.584 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.425 -3.535 5.130 1.00 0.00 H new ATOM 0 HG13 VAL B 44 2.761 -3.920 5.629 1.00 0.00 H new ATOM 0 HG21 VAL B 44 1.894 -5.014 2.893 1.00 0.00 H new ATOM 0 HG22 VAL B 44 0.901 -3.870 3.827 1.00 0.00 H new ATOM 0 HG23 VAL B 44 1.366 -3.484 2.153 1.00 0.00 H new ATOM 1987 N MET B 45 4.708 -1.155 5.032 1.00 0.00 N ATOM 1988 CA MET B 45 5.470 -0.704 6.186 1.00 0.00 C ATOM 1989 C MET B 45 4.907 0.609 6.715 1.00 0.00 C ATOM 1990 O MET B 45 4.944 0.864 7.918 1.00 0.00 O ATOM 1991 CB MET B 45 6.949 -0.538 5.846 1.00 0.00 C ATOM 1992 CG MET B 45 7.812 -0.290 7.073 1.00 0.00 C ATOM 1993 SD MET B 45 8.406 1.410 7.180 1.00 0.00 S ATOM 1994 CE MET B 45 8.968 1.468 8.881 1.00 0.00 C ATOM 0 H MET B 45 5.259 -1.321 4.190 1.00 0.00 H new ATOM 0 HA MET B 45 5.383 -1.467 6.959 1.00 0.00 H new ATOM 0 HB2 MET B 45 7.302 -1.433 5.334 1.00 0.00 H new ATOM 0 HB3 MET B 45 7.066 0.294 5.151 1.00 0.00 H new ATOM 0 HG2 MET B 45 7.238 -0.526 7.969 1.00 0.00 H new ATOM 0 HG3 MET B 45 8.666 -0.968 7.054 1.00 0.00 H new ATOM 0 HE1 MET B 45 9.507 2.399 9.055 1.00 0.00 H new ATOM 0 HE2 MET B 45 8.109 1.416 9.550 1.00 0.00 H new ATOM 0 HE3 MET B 45 9.630 0.624 9.074 1.00 0.00 H new ATOM 2004 N TRP B 46 4.371 1.438 5.819 1.00 0.00 N ATOM 2005 CA TRP B 46 3.794 2.707 6.235 1.00 0.00 C ATOM 2006 C TRP B 46 2.550 2.459 7.076 1.00 0.00 C ATOM 2007 O TRP B 46 2.489 2.849 8.242 1.00 0.00 O ATOM 2008 CB TRP B 46 3.446 3.572 5.023 1.00 0.00 C ATOM 2009 CG TRP B 46 3.098 4.981 5.392 1.00 0.00 C ATOM 2010 CD1 TRP B 46 1.971 5.667 5.042 1.00 0.00 C ATOM 2011 CD2 TRP B 46 3.882 5.875 6.190 1.00 0.00 C ATOM 2012 NE1 TRP B 46 2.007 6.934 5.573 1.00 0.00 N ATOM 2013 CE2 TRP B 46 3.171 7.085 6.282 1.00 0.00 C ATOM 2014 CE3 TRP B 46 5.118 5.769 6.835 1.00 0.00 C ATOM 2015 CZ2 TRP B 46 3.653 8.180 6.994 1.00 0.00 C ATOM 2016 CZ3 TRP B 46 5.596 6.856 7.541 1.00 0.00 C ATOM 2017 CH2 TRP B 46 4.865 8.048 7.617 1.00 0.00 C ATOM 0 H TRP B 46 4.326 1.254 4.817 1.00 0.00 H new ATOM 0 HA TRP B 46 4.532 3.241 6.834 1.00 0.00 H new ATOM 0 HB2 TRP B 46 4.291 3.580 4.335 1.00 0.00 H new ATOM 0 HB3 TRP B 46 2.607 3.123 4.492 1.00 0.00 H new ATOM 0 HD1 TRP B 46 1.169 5.272 4.437 1.00 0.00 H new ATOM 0 HE1 TRP B 46 1.286 7.646 5.458 1.00 0.00 H new ATOM 0 HE3 TRP B 46 5.689 4.854 6.782 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 3.091 9.100 7.053 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 6.550 6.785 8.043 1.00 0.00 H new ATOM 0 HH2 TRP B 46 5.265 8.880 8.178 1.00 0.00 H new ATOM 2028 N LEU B 47 1.566 1.791 6.483 1.00 0.00 N ATOM 2029 CA LEU B 47 0.330 1.472 7.190 1.00 0.00 C ATOM 2030 C LEU B 47 0.628 0.724 8.471 1.00 0.00 C ATOM 2031 O LEU B 47 0.014 0.958 9.508 1.00 0.00 O ATOM 2032 CB LEU B 47 -0.592 0.588 6.351 1.00 0.00 C ATOM 2033 CG LEU B 47 0.093 -0.382 5.389 1.00 0.00 C ATOM 2034 CD1 LEU B 47 0.152 -1.767 6.010 1.00 0.00 C ATOM 2035 CD2 LEU B 47 -0.643 -0.424 4.057 1.00 0.00 C ATOM 0 H LEU B 47 1.599 1.461 5.518 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.161 2.423 7.398 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -1.222 0.011 7.028 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.253 1.234 5.773 1.00 0.00 H new ATOM 0 HG LEU B 47 1.109 -0.035 5.203 1.00 0.00 H new ATOM 0 HD11 LEU B 47 0.641 -2.455 5.320 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.717 -1.724 6.941 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.860 -2.117 6.215 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.140 -1.120 3.385 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.669 -0.753 4.219 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -0.647 0.571 3.612 1.00 0.00 H new ATOM 2047 N ILE B 48 1.553 -0.208 8.372 1.00 0.00 N ATOM 2048 CA ILE B 48 1.923 -1.031 9.495 1.00 0.00 C ATOM 2049 C ILE B 48 2.529 -0.211 10.622 1.00 0.00 C ATOM 2050 O ILE B 48 2.226 -0.437 11.794 1.00 0.00 O ATOM 2051 CB ILE B 48 2.892 -2.136 9.040 1.00 0.00 C ATOM 2052 CG1 ILE B 48 2.222 -3.489 9.196 1.00 0.00 C ATOM 2053 CG2 ILE B 48 4.204 -2.086 9.807 1.00 0.00 C ATOM 2054 CD1 ILE B 48 0.960 -3.638 8.372 1.00 0.00 C ATOM 0 H ILE B 48 2.065 -0.413 7.514 1.00 0.00 H new ATOM 0 HA ILE B 48 1.016 -1.492 9.887 1.00 0.00 H new ATOM 0 HB ILE B 48 3.134 -1.973 7.990 1.00 0.00 H new ATOM 0 HG12 ILE B 48 2.927 -4.270 8.910 1.00 0.00 H new ATOM 0 HG13 ILE B 48 1.981 -3.647 10.247 1.00 0.00 H new ATOM 0 HG21 ILE B 48 4.861 -2.882 9.457 1.00 0.00 H new ATOM 0 HG22 ILE B 48 4.684 -1.121 9.644 1.00 0.00 H new ATOM 0 HG23 ILE B 48 4.009 -2.219 10.871 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.535 -4.629 8.533 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.237 -2.880 8.673 1.00 0.00 H new ATOM 0 HD13 ILE B 48 1.198 -3.513 7.316 1.00 0.00 H new ATOM 2066 N GLN B 49 3.388 0.734 10.273 1.00 0.00 N ATOM 2067 CA GLN B 49 4.023 1.562 11.280 1.00 0.00 C ATOM 2068 C GLN B 49 3.120 2.725 11.692 1.00 0.00 C ATOM 2069 O GLN B 49 3.341 3.354 12.727 1.00 0.00 O ATOM 2070 CB GLN B 49 5.370 2.089 10.773 1.00 0.00 C ATOM 2071 CG GLN B 49 5.251 3.227 9.769 1.00 0.00 C ATOM 2072 CD GLN B 49 6.597 3.806 9.382 1.00 0.00 C ATOM 2073 OE1 GLN B 49 7.002 3.743 8.221 1.00 0.00 O ATOM 2074 NE2 GLN B 49 7.299 4.374 10.356 1.00 0.00 N ATOM 0 H GLN B 49 3.658 0.943 9.312 1.00 0.00 H new ATOM 0 HA GLN B 49 4.197 0.941 12.159 1.00 0.00 H new ATOM 0 HB2 GLN B 49 5.959 2.429 11.625 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.920 1.268 10.313 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.744 2.866 8.874 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.628 4.016 10.191 1.00 0.00 H new ATOM 0 HE21 GLN B 49 6.924 4.404 11.304 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.213 4.780 10.156 1.00 0.00 H new ATOM 2083 N ASN B 50 2.109 3.017 10.875 1.00 0.00 N ATOM 2084 CA ASN B 50 1.191 4.116 11.164 1.00 0.00 C ATOM 2085 C ASN B 50 -0.086 3.623 11.839 1.00 0.00 C ATOM 2086 O ASN B 50 -0.564 4.223 12.800 1.00 0.00 O ATOM 2087 CB ASN B 50 0.844 4.870 9.878 1.00 0.00 C ATOM 2088 CG ASN B 50 0.597 6.346 10.121 1.00 0.00 C ATOM 2089 OD1 ASN B 50 0.303 6.762 11.242 1.00 0.00 O ATOM 2090 ND2 ASN B 50 0.714 7.146 9.068 1.00 0.00 N ATOM 0 H ASN B 50 1.906 2.511 10.013 1.00 0.00 H new ATOM 0 HA ASN B 50 1.695 4.792 11.855 1.00 0.00 H new ATOM 0 HB2 ASN B 50 1.657 4.754 9.161 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -0.044 4.425 9.428 1.00 0.00 H new ATOM 0 HD21 ASN B 50 0.558 8.149 9.170 1.00 0.00 H new ATOM 0 HD22 ASN B 50 0.960 6.758 8.157 1.00 0.00 H new ATOM 2097 N LYS B 51 -0.637 2.536 11.318 1.00 0.00 N ATOM 2098 CA LYS B 51 -1.868 1.959 11.852 1.00 0.00 C ATOM 2099 C LYS B 51 -1.653 1.363 13.239 1.00 0.00 C ATOM 2100 O LYS B 51 -2.314 1.753 14.201 1.00 0.00 O ATOM 2101 CB LYS B 51 -2.398 0.883 10.904 1.00 0.00 C ATOM 2102 CG LYS B 51 -2.694 1.395 9.505 1.00 0.00 C ATOM 2103 CD LYS B 51 -4.135 1.862 9.374 1.00 0.00 C ATOM 2104 CE LYS B 51 -4.222 3.374 9.245 1.00 0.00 C ATOM 2105 NZ LYS B 51 -4.029 4.057 10.554 1.00 0.00 N ATOM 0 H LYS B 51 -0.250 2.031 10.521 1.00 0.00 H new ATOM 0 HA LYS B 51 -2.600 2.762 11.939 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -1.668 0.076 10.839 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -3.308 0.456 11.325 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -2.021 2.219 9.268 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -2.499 0.606 8.779 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -4.592 1.395 8.502 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -4.704 1.537 10.245 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -3.467 3.722 8.540 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -5.193 3.648 8.833 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -4.654 4.886 10.609 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -4.258 3.399 11.326 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -3.039 4.364 10.643 1.00 0.00 H new ATOM 2119 N GLU B 52 -0.730 0.409 13.333 1.00 0.00 N ATOM 2120 CA GLU B 52 -0.432 -0.254 14.602 1.00 0.00 C ATOM 2121 C GLU B 52 -0.295 0.754 15.739 1.00 0.00 C ATOM 2122 O GLU B 52 -0.627 0.458 16.887 1.00 0.00 O ATOM 2123 CB GLU B 52 0.855 -1.072 14.477 1.00 0.00 C ATOM 2124 CG GLU B 52 0.845 -2.348 15.303 1.00 0.00 C ATOM 2125 CD GLU B 52 0.546 -3.579 14.470 1.00 0.00 C ATOM 2126 OE1 GLU B 52 1.391 -4.499 14.445 1.00 0.00 O ATOM 2127 OE2 GLU B 52 -0.533 -3.623 13.841 1.00 0.00 O ATOM 0 H GLU B 52 -0.174 0.077 12.545 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.265 -0.917 14.836 1.00 0.00 H new ATOM 0 HB2 GLU B 52 1.013 -1.328 13.429 1.00 0.00 H new ATOM 0 HB3 GLU B 52 1.699 -0.456 14.785 1.00 0.00 H new ATOM 0 HG2 GLU B 52 1.813 -2.469 15.789 1.00 0.00 H new ATOM 0 HG3 GLU B 52 0.100 -2.259 16.094 1.00 0.00 H new ATOM 2134 N LYS B 53 0.195 1.945 15.414 1.00 0.00 N ATOM 2135 CA LYS B 53 0.375 2.995 16.409 1.00 0.00 C ATOM 2136 C LYS B 53 -0.335 4.277 15.986 1.00 0.00 C ATOM 2137 O LYS B 53 0.089 5.373 16.348 1.00 0.00 O ATOM 2138 CB LYS B 53 1.865 3.270 16.624 1.00 0.00 C ATOM 2139 CG LYS B 53 2.603 3.647 15.350 1.00 0.00 C ATOM 2140 CD LYS B 53 3.547 4.818 15.576 1.00 0.00 C ATOM 2141 CE LYS B 53 2.957 6.117 15.052 1.00 0.00 C ATOM 2142 NZ LYS B 53 3.560 7.308 15.712 1.00 0.00 N ATOM 0 H LYS B 53 0.475 2.207 14.469 1.00 0.00 H new ATOM 0 HA LYS B 53 -0.065 2.652 17.346 1.00 0.00 H new ATOM 0 HB2 LYS B 53 1.976 4.075 17.350 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.331 2.384 17.056 1.00 0.00 H new ATOM 0 HG2 LYS B 53 3.168 2.788 14.988 1.00 0.00 H new ATOM 0 HG3 LYS B 53 1.882 3.904 14.574 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.758 4.916 16.641 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.497 4.622 15.079 1.00 0.00 H new ATOM 0 HE2 LYS B 53 3.116 6.179 13.975 1.00 0.00 H new ATOM 0 HE3 LYS B 53 1.879 6.118 15.216 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 3.130 8.173 15.327 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 3.387 7.262 16.736 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 4.585 7.322 15.535 1.00 0.00 H new ATOM 2156 N LEU B 54 -1.413 4.134 15.217 1.00 0.00 N ATOM 2157 CA LEU B 54 -2.175 5.286 14.741 1.00 0.00 C ATOM 2158 C LEU B 54 -2.607 6.180 15.902 1.00 0.00 C ATOM 2159 O LEU B 54 -3.564 5.867 16.612 1.00 0.00 O ATOM 2160 CB LEU B 54 -3.410 4.824 13.966 1.00 0.00 C ATOM 2161 CG LEU B 54 -4.251 5.949 13.359 1.00 0.00 C ATOM 2162 CD1 LEU B 54 -3.533 6.570 12.170 1.00 0.00 C ATOM 2163 CD2 LEU B 54 -5.619 5.426 12.946 1.00 0.00 C ATOM 0 H LEU B 54 -1.778 3.232 14.911 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.527 5.862 14.081 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.090 4.158 13.165 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -4.042 4.239 14.634 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.392 6.722 14.115 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -4.146 7.368 11.751 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -2.577 6.980 12.496 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -3.361 5.808 11.410 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -6.205 6.239 12.516 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -5.498 4.635 12.206 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -6.136 5.029 13.820 1.00 0.00 H new ATOM 2175 N PRO B 55 -1.904 7.307 16.115 1.00 0.00 N ATOM 2176 CA PRO B 55 -2.215 8.244 17.192 1.00 0.00 C ATOM 2177 C PRO B 55 -3.418 9.123 16.863 1.00 0.00 C ATOM 2178 O PRO B 55 -3.758 9.315 15.696 1.00 0.00 O ATOM 2179 CB PRO B 55 -0.947 9.108 17.314 1.00 0.00 C ATOM 2180 CG PRO B 55 0.040 8.538 16.342 1.00 0.00 C ATOM 2181 CD PRO B 55 -0.754 7.764 15.330 1.00 0.00 C ATOM 0 HA PRO B 55 -2.476 7.721 18.112 1.00 0.00 H new ATOM 0 HB2 PRO B 55 -1.163 10.151 17.083 1.00 0.00 H new ATOM 0 HB3 PRO B 55 -0.553 9.081 18.330 1.00 0.00 H new ATOM 0 HG2 PRO B 55 0.613 9.331 15.861 1.00 0.00 H new ATOM 0 HG3 PRO B 55 0.755 7.891 16.850 1.00 0.00 H new ATOM 0 HD2 PRO B 55 -1.058 8.387 14.489 1.00 0.00 H new ATOM 0 HD3 PRO B 55 -0.185 6.930 14.919 1.00 0.00 H new ATOM 2189 N ASN B 56 -4.051 9.661 17.899 1.00 0.00 N ATOM 2190 CA ASN B 56 -5.208 10.527 17.720 1.00 0.00 C ATOM 2191 C ASN B 56 -4.779 11.907 17.229 1.00 0.00 C ATOM 2192 O ASN B 56 -5.545 12.608 16.568 1.00 0.00 O ATOM 2193 CB ASN B 56 -5.982 10.657 19.033 1.00 0.00 C ATOM 2194 CG ASN B 56 -6.722 9.386 19.399 1.00 0.00 C ATOM 2195 OD1 ASN B 56 -6.743 8.424 18.631 1.00 0.00 O ATOM 2196 ND2 ASN B 56 -7.337 9.376 20.576 1.00 0.00 N ATOM 0 H ASN B 56 -3.782 9.512 18.871 1.00 0.00 H new ATOM 0 HA ASN B 56 -5.857 10.078 16.968 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -5.290 10.914 19.835 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -6.695 11.478 18.951 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -7.853 8.548 20.875 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -7.293 10.196 21.181 1.00 0.00 H new ATOM 2203 N GLU B 57 -3.548 12.289 17.558 1.00 0.00 N ATOM 2204 CA GLU B 57 -3.014 13.585 17.154 1.00 0.00 C ATOM 2205 C GLU B 57 -2.478 13.539 15.724 1.00 0.00 C ATOM 2206 O GLU B 57 -2.357 14.574 15.067 1.00 0.00 O ATOM 2207 CB GLU B 57 -1.903 14.021 18.111 1.00 0.00 C ATOM 2208 CG GLU B 57 -0.751 13.033 18.197 1.00 0.00 C ATOM 2209 CD GLU B 57 0.403 13.556 19.031 1.00 0.00 C ATOM 2210 OE1 GLU B 57 0.687 14.770 18.957 1.00 0.00 O ATOM 2211 OE2 GLU B 57 1.021 12.751 19.759 1.00 0.00 O ATOM 0 H GLU B 57 -2.902 11.719 18.104 1.00 0.00 H new ATOM 0 HA GLU B 57 -3.827 14.310 17.192 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -1.517 14.989 17.790 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -2.326 14.161 19.106 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -1.110 12.098 18.626 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -0.395 12.807 17.192 1.00 0.00 H new ATOM 2218 N LEU B 58 -2.160 12.340 15.245 1.00 0.00 N ATOM 2219 CA LEU B 58 -1.641 12.173 13.892 1.00 0.00 C ATOM 2220 C LEU B 58 -2.759 12.260 12.861 1.00 0.00 C ATOM 2221 O LEU B 58 -2.511 12.570 11.698 1.00 0.00 O ATOM 2222 CB LEU B 58 -0.918 10.832 13.756 1.00 0.00 C ATOM 2223 CG LEU B 58 0.612 10.907 13.771 1.00 0.00 C ATOM 2224 CD1 LEU B 58 1.219 9.543 13.471 1.00 0.00 C ATOM 2225 CD2 LEU B 58 1.107 11.942 12.771 1.00 0.00 C ATOM 0 H LEU B 58 -2.252 11.472 15.772 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.934 12.981 13.707 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -1.241 10.180 14.568 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -1.233 10.361 12.825 1.00 0.00 H new ATOM 0 HG LEU B 58 0.929 11.212 14.768 1.00 0.00 H new ATOM 0 HD11 LEU B 58 2.306 9.617 13.486 1.00 0.00 H new ATOM 0 HD12 LEU B 58 0.894 8.826 14.225 1.00 0.00 H new ATOM 0 HD13 LEU B 58 0.892 9.208 12.487 1.00 0.00 H new ATOM 0 HD21 LEU B 58 2.196 11.981 12.796 1.00 0.00 H new ATOM 0 HD22 LEU B 58 0.777 11.667 11.769 1.00 0.00 H new ATOM 0 HD23 LEU B 58 0.703 12.921 13.030 1.00 0.00 H new ATOM 2237 N LYS B 59 -3.989 11.979 13.296 1.00 0.00 N ATOM 2238 CA LYS B 59 -5.158 12.019 12.415 1.00 0.00 C ATOM 2239 C LYS B 59 -5.047 13.136 11.373 1.00 0.00 C ATOM 2240 O LYS B 59 -5.136 12.881 10.174 1.00 0.00 O ATOM 2241 CB LYS B 59 -6.433 12.204 13.240 1.00 0.00 C ATOM 2242 CG LYS B 59 -7.601 11.364 12.750 1.00 0.00 C ATOM 2243 CD LYS B 59 -8.496 12.150 11.806 1.00 0.00 C ATOM 2244 CE LYS B 59 -9.608 12.862 12.558 1.00 0.00 C ATOM 2245 NZ LYS B 59 -10.882 12.873 11.787 1.00 0.00 N ATOM 0 H LYS B 59 -4.202 11.720 14.259 1.00 0.00 H new ATOM 0 HA LYS B 59 -5.201 11.069 11.883 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -6.224 11.950 14.279 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -6.719 13.256 13.221 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -7.224 10.477 12.241 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -8.185 11.018 13.603 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -7.899 12.880 11.260 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -8.929 11.476 11.067 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -9.769 12.371 13.518 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -9.304 13.887 12.771 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -11.615 13.368 12.334 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -10.736 13.364 10.882 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -11.186 11.895 11.606 1.00 0.00 H new ATOM 2259 N PRO B 60 -4.851 14.392 11.816 1.00 0.00 N ATOM 2260 CA PRO B 60 -4.729 15.534 10.903 1.00 0.00 C ATOM 2261 C PRO B 60 -3.527 15.409 9.973 1.00 0.00 C ATOM 2262 O PRO B 60 -3.542 15.922 8.853 1.00 0.00 O ATOM 2263 CB PRO B 60 -4.563 16.738 11.839 1.00 0.00 C ATOM 2264 CG PRO B 60 -4.104 16.162 13.135 1.00 0.00 C ATOM 2265 CD PRO B 60 -4.733 14.802 13.227 1.00 0.00 C ATOM 0 HA PRO B 60 -5.592 15.614 10.242 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -3.836 17.448 11.444 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -5.503 17.277 11.958 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -3.017 16.092 13.168 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -4.409 16.791 13.972 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -4.114 14.109 13.798 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -5.705 14.840 13.718 1.00 0.00 H new ATOM 2273 N LYS B 61 -2.488 14.723 10.438 1.00 0.00 N ATOM 2274 CA LYS B 61 -1.282 14.531 9.641 1.00 0.00 C ATOM 2275 C LYS B 61 -1.569 13.657 8.430 1.00 0.00 C ATOM 2276 O LYS B 61 -0.953 13.817 7.378 1.00 0.00 O ATOM 2277 CB LYS B 61 -0.172 13.897 10.477 1.00 0.00 C ATOM 2278 CG LYS B 61 1.215 14.414 10.129 1.00 0.00 C ATOM 2279 CD LYS B 61 1.375 15.879 10.505 1.00 0.00 C ATOM 2280 CE LYS B 61 1.276 16.081 12.008 1.00 0.00 C ATOM 2281 NZ LYS B 61 0.737 17.424 12.354 1.00 0.00 N ATOM 0 H LYS B 61 -2.457 14.291 11.362 1.00 0.00 H new ATOM 0 HA LYS B 61 -0.951 15.512 9.301 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -0.368 14.087 11.532 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -0.194 12.816 10.338 1.00 0.00 H new ATOM 0 HG2 LYS B 61 1.967 13.820 10.649 1.00 0.00 H new ATOM 0 HG3 LYS B 61 1.393 14.290 9.061 1.00 0.00 H new ATOM 0 HD2 LYS B 61 2.339 16.244 10.150 1.00 0.00 H new ATOM 0 HD3 LYS B 61 0.607 16.470 10.006 1.00 0.00 H new ATOM 0 HE2 LYS B 61 0.634 15.311 12.436 1.00 0.00 H new ATOM 0 HE3 LYS B 61 2.262 15.959 12.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 0.685 17.521 13.388 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 1.363 18.159 11.968 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 -0.215 17.531 11.948 1.00 0.00 H new ATOM 2295 N ILE B 62 -2.511 12.732 8.579 1.00 0.00 N ATOM 2296 CA ILE B 62 -2.876 11.844 7.485 1.00 0.00 C ATOM 2297 C ILE B 62 -3.172 12.665 6.235 1.00 0.00 C ATOM 2298 O ILE B 62 -2.822 12.272 5.119 1.00 0.00 O ATOM 2299 CB ILE B 62 -4.083 10.955 7.867 1.00 0.00 C ATOM 2300 CG1 ILE B 62 -3.615 9.786 8.742 1.00 0.00 C ATOM 2301 CG2 ILE B 62 -4.802 10.436 6.628 1.00 0.00 C ATOM 2302 CD1 ILE B 62 -2.640 10.192 9.830 1.00 0.00 C ATOM 0 H ILE B 62 -3.032 12.579 9.442 1.00 0.00 H new ATOM 0 HA ILE B 62 -2.038 11.179 7.278 1.00 0.00 H new ATOM 0 HB ILE B 62 -4.790 11.564 8.431 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -4.485 9.317 9.202 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -3.146 9.034 8.108 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.645 9.815 6.930 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.165 11.278 6.038 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -4.111 9.843 6.028 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -2.353 9.313 10.408 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -1.752 10.634 9.377 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -3.112 10.921 10.488 1.00 0.00 H new ATOM 2314 N ASP B 63 -3.770 13.836 6.436 1.00 0.00 N ATOM 2315 CA ASP B 63 -4.052 14.733 5.333 1.00 0.00 C ATOM 2316 C ASP B 63 -2.728 15.243 4.795 1.00 0.00 C ATOM 2317 O ASP B 63 -2.520 15.326 3.586 1.00 0.00 O ATOM 2318 CB ASP B 63 -4.933 15.898 5.792 1.00 0.00 C ATOM 2319 CG ASP B 63 -6.303 15.877 5.143 1.00 0.00 C ATOM 2320 OD1 ASP B 63 -6.742 14.788 4.719 1.00 0.00 O ATOM 2321 OD2 ASP B 63 -6.937 16.950 5.059 1.00 0.00 O ATOM 0 H ASP B 63 -4.065 14.180 7.350 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.596 14.204 4.551 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -5.047 15.859 6.875 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.437 16.840 5.557 1.00 0.00 H new ATOM 2326 N GLU B 64 -1.819 15.545 5.723 1.00 0.00 N ATOM 2327 CA GLU B 64 -0.485 16.009 5.375 1.00 0.00 C ATOM 2328 C GLU B 64 0.192 14.978 4.482 1.00 0.00 C ATOM 2329 O GLU B 64 0.781 15.315 3.459 1.00 0.00 O ATOM 2330 CB GLU B 64 0.344 16.243 6.642 1.00 0.00 C ATOM 2331 CG GLU B 64 0.689 17.703 6.882 1.00 0.00 C ATOM 2332 CD GLU B 64 -0.287 18.387 7.818 1.00 0.00 C ATOM 2333 OE1 GLU B 64 -1.510 18.266 7.593 1.00 0.00 O ATOM 2334 OE2 GLU B 64 0.170 19.042 8.778 1.00 0.00 O ATOM 0 H GLU B 64 -1.989 15.474 6.726 1.00 0.00 H new ATOM 0 HA GLU B 64 -0.562 16.954 4.837 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -0.207 15.862 7.502 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.267 15.667 6.574 1.00 0.00 H new ATOM 0 HG2 GLU B 64 1.694 17.771 7.298 1.00 0.00 H new ATOM 0 HG3 GLU B 64 0.702 18.231 5.928 1.00 0.00 H new ATOM 2341 N ILE B 65 0.073 13.712 4.869 1.00 0.00 N ATOM 2342 CA ILE B 65 0.642 12.608 4.103 1.00 0.00 C ATOM 2343 C ILE B 65 0.118 12.635 2.672 1.00 0.00 C ATOM 2344 O ILE B 65 0.845 12.331 1.726 1.00 0.00 O ATOM 2345 CB ILE B 65 0.285 11.253 4.752 1.00 0.00 C ATOM 2346 CG1 ILE B 65 0.703 11.242 6.224 1.00 0.00 C ATOM 2347 CG2 ILE B 65 0.939 10.102 4.000 1.00 0.00 C ATOM 2348 CD1 ILE B 65 2.133 11.684 6.444 1.00 0.00 C ATOM 0 H ILE B 65 -0.417 13.423 5.716 1.00 0.00 H new ATOM 0 HA ILE B 65 1.726 12.724 4.096 1.00 0.00 H new ATOM 0 HB ILE B 65 -0.796 11.121 4.697 1.00 0.00 H new ATOM 0 HG12 ILE B 65 0.037 11.895 6.788 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.576 10.236 6.623 1.00 0.00 H new ATOM 0 HG21 ILE B 65 0.673 9.158 4.476 1.00 0.00 H new ATOM 0 HG22 ILE B 65 0.591 10.098 2.967 1.00 0.00 H new ATOM 0 HG23 ILE B 65 2.022 10.224 4.018 1.00 0.00 H new ATOM 0 HD11 ILE B 65 2.364 11.653 7.509 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.807 11.016 5.907 1.00 0.00 H new ATOM 0 HD13 ILE B 65 2.260 12.702 6.075 1.00 0.00 H new ATOM 2360 N SER B 66 -1.153 13.004 2.525 1.00 0.00 N ATOM 2361 CA SER B 66 -1.785 13.075 1.212 1.00 0.00 C ATOM 2362 C SER B 66 -1.409 14.361 0.479 1.00 0.00 C ATOM 2363 O SER B 66 -0.903 14.318 -0.643 1.00 0.00 O ATOM 2364 CB SER B 66 -3.306 12.980 1.350 1.00 0.00 C ATOM 2365 OG SER B 66 -3.726 13.361 2.649 1.00 0.00 O ATOM 0 H SER B 66 -1.765 13.258 3.301 1.00 0.00 H new ATOM 0 HA SER B 66 -1.422 12.232 0.624 1.00 0.00 H new ATOM 0 HB2 SER B 66 -3.782 13.621 0.608 1.00 0.00 H new ATOM 0 HB3 SER B 66 -3.630 11.960 1.145 1.00 0.00 H new ATOM 0 HG SER B 66 -3.619 14.329 2.757 1.00 0.00 H new ATOM 2371 N LYS B 67 -1.664 15.505 1.109 1.00 0.00 N ATOM 2372 CA LYS B 67 -1.353 16.793 0.496 1.00 0.00 C ATOM 2373 C LYS B 67 0.147 16.935 0.254 1.00 0.00 C ATOM 2374 O LYS B 67 0.570 17.457 -0.778 1.00 0.00 O ATOM 2375 CB LYS B 67 -1.864 17.948 1.361 1.00 0.00 C ATOM 2376 CG LYS B 67 -1.649 17.744 2.852 1.00 0.00 C ATOM 2377 CD LYS B 67 -1.066 18.986 3.512 1.00 0.00 C ATOM 2378 CE LYS B 67 -1.884 19.411 4.721 1.00 0.00 C ATOM 2379 NZ LYS B 67 -3.259 19.837 4.340 1.00 0.00 N ATOM 0 H LYS B 67 -2.082 15.567 2.037 1.00 0.00 H new ATOM 0 HA LYS B 67 -1.861 16.833 -0.467 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -1.364 18.867 1.054 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -2.929 18.086 1.173 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -2.598 17.492 3.325 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -0.979 16.899 3.011 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -0.039 18.788 3.818 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -1.032 19.801 2.789 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -1.943 18.584 5.428 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -1.378 20.231 5.231 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -3.657 20.437 5.090 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -3.222 20.374 3.450 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -3.860 18.998 4.213 1.00 0.00 H new ATOM 2393 N ARG B 68 0.950 16.463 1.203 1.00 0.00 N ATOM 2394 CA ARG B 68 2.401 16.535 1.073 1.00 0.00 C ATOM 2395 C ARG B 68 2.893 15.525 0.047 1.00 0.00 C ATOM 2396 O ARG B 68 3.862 15.775 -0.667 1.00 0.00 O ATOM 2397 CB ARG B 68 3.085 16.287 2.418 1.00 0.00 C ATOM 2398 CG ARG B 68 2.718 17.305 3.482 1.00 0.00 C ATOM 2399 CD ARG B 68 3.069 16.807 4.877 1.00 0.00 C ATOM 2400 NE ARG B 68 4.493 16.513 5.010 1.00 0.00 N ATOM 2401 CZ ARG B 68 5.053 16.051 6.126 1.00 0.00 C ATOM 2402 NH1 ARG B 68 4.313 15.832 7.207 1.00 0.00 N ATOM 2403 NH2 ARG B 68 6.356 15.809 6.162 1.00 0.00 N ATOM 0 H ARG B 68 0.622 16.029 2.066 1.00 0.00 H new ATOM 0 HA ARG B 68 2.658 17.539 0.735 1.00 0.00 H new ATOM 0 HB2 ARG B 68 2.820 15.291 2.773 1.00 0.00 H new ATOM 0 HB3 ARG B 68 4.165 16.297 2.274 1.00 0.00 H new ATOM 0 HG2 ARG B 68 3.241 18.241 3.287 1.00 0.00 H new ATOM 0 HG3 ARG B 68 1.651 17.519 3.429 1.00 0.00 H new ATOM 0 HD2 ARG B 68 2.784 17.559 5.613 1.00 0.00 H new ATOM 0 HD3 ARG B 68 2.491 15.909 5.098 1.00 0.00 H new ATOM 0 HE ARG B 68 5.094 16.671 4.201 1.00 0.00 H new ATOM 0 HH11 ARG B 68 3.310 16.018 7.185 1.00 0.00 H new ATOM 0 HH12 ARG B 68 4.747 15.478 8.059 1.00 0.00 H new ATOM 0 HH21 ARG B 68 6.929 15.977 5.335 1.00 0.00 H new ATOM 0 HH22 ARG B 68 6.786 15.455 7.017 1.00 0.00 H new ATOM 2417 N PHE B 69 2.211 14.383 -0.030 1.00 0.00 N ATOM 2418 CA PHE B 69 2.577 13.342 -0.984 1.00 0.00 C ATOM 2419 C PHE B 69 2.681 13.939 -2.385 1.00 0.00 C ATOM 2420 O PHE B 69 3.525 13.537 -3.187 1.00 0.00 O ATOM 2421 CB PHE B 69 1.551 12.196 -0.933 1.00 0.00 C ATOM 2422 CG PHE B 69 1.125 11.669 -2.279 1.00 0.00 C ATOM 2423 CD1 PHE B 69 -0.208 11.697 -2.657 1.00 0.00 C ATOM 2424 CD2 PHE B 69 2.056 11.148 -3.164 1.00 0.00 C ATOM 2425 CE1 PHE B 69 -0.605 11.215 -3.889 1.00 0.00 C ATOM 2426 CE2 PHE B 69 1.665 10.663 -4.398 1.00 0.00 C ATOM 2427 CZ PHE B 69 0.333 10.698 -4.761 1.00 0.00 C ATOM 0 H PHE B 69 1.406 14.158 0.555 1.00 0.00 H new ATOM 0 HA PHE B 69 3.551 12.929 -0.720 1.00 0.00 H new ATOM 0 HB2 PHE B 69 1.973 11.375 -0.354 1.00 0.00 H new ATOM 0 HB3 PHE B 69 0.667 12.542 -0.398 1.00 0.00 H new ATOM 0 HD1 PHE B 69 -0.946 12.101 -1.980 1.00 0.00 H new ATOM 0 HD2 PHE B 69 3.099 11.121 -2.886 1.00 0.00 H new ATOM 0 HE1 PHE B 69 -1.647 11.242 -4.170 1.00 0.00 H new ATOM 0 HE2 PHE B 69 2.400 10.257 -5.077 1.00 0.00 H new ATOM 0 HZ PHE B 69 0.025 10.322 -5.725 1.00 0.00 H new ATOM 2437 N PHE B 70 1.828 14.918 -2.657 1.00 0.00 N ATOM 2438 CA PHE B 70 1.823 15.604 -3.939 1.00 0.00 C ATOM 2439 C PHE B 70 2.314 17.037 -3.751 1.00 0.00 C ATOM 2440 O PHE B 70 1.521 17.979 -3.725 1.00 0.00 O ATOM 2441 CB PHE B 70 0.419 15.594 -4.550 1.00 0.00 C ATOM 2442 CG PHE B 70 0.335 14.841 -5.848 1.00 0.00 C ATOM 2443 CD1 PHE B 70 0.945 13.604 -5.986 1.00 0.00 C ATOM 2444 CD2 PHE B 70 -0.353 15.370 -6.928 1.00 0.00 C ATOM 2445 CE1 PHE B 70 0.869 12.909 -7.178 1.00 0.00 C ATOM 2446 CE2 PHE B 70 -0.431 14.680 -8.122 1.00 0.00 C ATOM 2447 CZ PHE B 70 0.181 13.447 -8.248 1.00 0.00 C ATOM 0 H PHE B 70 1.125 15.256 -1.999 1.00 0.00 H new ATOM 0 HA PHE B 70 2.492 15.083 -4.624 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -0.276 15.151 -3.837 1.00 0.00 H new ATOM 0 HB3 PHE B 70 0.095 16.622 -4.714 1.00 0.00 H new ATOM 0 HD1 PHE B 70 1.485 13.179 -5.153 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.834 16.333 -6.835 1.00 0.00 H new ATOM 0 HE1 PHE B 70 1.347 11.945 -7.273 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -0.970 15.104 -8.957 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.121 12.906 -9.181 1.00 0.00 H new ATOM 2457 N PRO B 71 3.637 17.216 -3.600 1.00 0.00 N ATOM 2458 CA PRO B 71 4.238 18.537 -3.395 1.00 0.00 C ATOM 2459 C PRO B 71 4.213 19.391 -4.658 1.00 0.00 C ATOM 2460 O PRO B 71 5.074 19.258 -5.527 1.00 0.00 O ATOM 2461 CB PRO B 71 5.676 18.206 -2.994 1.00 0.00 C ATOM 2462 CG PRO B 71 5.952 16.894 -3.638 1.00 0.00 C ATOM 2463 CD PRO B 71 4.650 16.143 -3.610 1.00 0.00 C ATOM 0 HA PRO B 71 3.697 19.124 -2.652 1.00 0.00 H new ATOM 0 HB2 PRO B 71 6.370 18.972 -3.340 1.00 0.00 H new ATOM 0 HB3 PRO B 71 5.782 18.146 -1.911 1.00 0.00 H new ATOM 0 HG2 PRO B 71 6.305 17.027 -4.661 1.00 0.00 H new ATOM 0 HG3 PRO B 71 6.729 16.350 -3.101 1.00 0.00 H new ATOM 0 HD2 PRO B 71 4.541 15.495 -4.480 1.00 0.00 H new ATOM 0 HD3 PRO B 71 4.571 15.508 -2.728 1.00 0.00 H new ATOM 2471 N ALA B 72 3.218 20.268 -4.751 1.00 0.00 N ATOM 2472 CA ALA B 72 3.079 21.144 -5.907 1.00 0.00 C ATOM 2473 C ALA B 72 2.116 22.290 -5.614 1.00 0.00 C ATOM 2474 O ALA B 72 0.935 22.067 -5.342 1.00 0.00 O ATOM 2475 CB ALA B 72 2.607 20.351 -7.116 1.00 0.00 C ATOM 0 H ALA B 72 2.497 20.390 -4.040 1.00 0.00 H new ATOM 0 HA ALA B 72 4.057 21.573 -6.127 1.00 0.00 H new ATOM 0 HB1 ALA B 72 2.507 21.018 -7.972 1.00 0.00 H new ATOM 0 HB2 ALA B 72 3.333 19.571 -7.346 1.00 0.00 H new ATOM 0 HB3 ALA B 72 1.642 19.895 -6.897 1.00 0.00 H new ATOM 2481 N LYS B 73 2.626 23.515 -5.672 1.00 0.00 N ATOM 2482 CA LYS B 73 1.810 24.695 -5.414 1.00 0.00 C ATOM 2483 C LYS B 73 1.164 25.202 -6.698 1.00 0.00 C ATOM 2484 O LYS B 73 0.561 26.296 -6.666 1.00 0.00 O ATOM 2485 CB LYS B 73 2.660 25.801 -4.786 1.00 0.00 C ATOM 2486 CG LYS B 73 3.329 25.389 -3.485 1.00 0.00 C ATOM 2487 CD LYS B 73 4.751 24.904 -3.720 1.00 0.00 C ATOM 2488 CE LYS B 73 5.606 25.059 -2.472 1.00 0.00 C ATOM 2489 NZ LYS B 73 6.565 23.932 -2.313 1.00 0.00 N ATOM 2490 OXT LYS B 73 1.266 24.502 -7.728 1.00 0.00 O ATOM 0 H LYS B 73 3.601 23.717 -5.895 1.00 0.00 H new ATOM 0 HA LYS B 73 1.020 24.414 -4.718 1.00 0.00 H new ATOM 0 HB2 LYS B 73 3.426 26.107 -5.498 1.00 0.00 H new ATOM 0 HB3 LYS B 73 2.030 26.671 -4.601 1.00 0.00 H new ATOM 0 HG2 LYS B 73 3.341 26.234 -2.797 1.00 0.00 H new ATOM 0 HG3 LYS B 73 2.748 24.599 -3.010 1.00 0.00 H new ATOM 0 HD2 LYS B 73 4.734 23.857 -4.023 1.00 0.00 H new ATOM 0 HD3 LYS B 73 5.197 25.466 -4.540 1.00 0.00 H new ATOM 0 HE2 LYS B 73 6.156 25.999 -2.523 1.00 0.00 H new ATOM 0 HE3 LYS B 73 4.961 25.114 -1.595 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 7.129 24.075 -1.451 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 6.040 23.037 -2.239 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 7.197 23.895 -3.138 1.00 0.00 H new TER 2504 LYS B 73