USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 60 HIS : no HD1:sc= -0.869 K(o=-0.87,f=-3.8!) USER MOD Single : A 4 SER OG : rot 32:sc= 0.549 USER MOD Single : A 6 LYS NZ :NH3+ 175:sc= 1.28 (180deg=1.18) USER MOD Single : A 7 TYR OH : rot 103:sc= 1.77 USER MOD Single : A 8 GLN :FLIP amide:sc= -0.0329 F(o=-0.9,f=-0.033) USER MOD Single : A 10 GLN : amide:sc=-0.00042 X(o=-0.00042,f=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0.0334 USER MOD Single : A 12 GLN : amide:sc= -2.42! K(o=-2.4!,f=-3.8) USER MOD Single : A 14 ASN : amide:sc= 0.024 K(o=0.024,f=-0.78) USER MOD Single : A 19 MET CE :methyl -170:sc= 0 (180deg=-0.0757) USER MOD Single : A 20 LYS NZ :NH3+ 150:sc= 0.0111 (180deg=-0.288) USER MOD Single : A 22 MET CE :methyl 143:sc= -0.18 (180deg=-0.874) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 31 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.086) USER MOD Single : A 33 LYS NZ :NH3+ -160:sc= -0.152 (180deg=-0.758) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot -173:sc= -2.37! USER MOD Single : A 43 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-5.7!) USER MOD Single : A 46 LYS NZ :NH3+ 166:sc=-0.00743 (180deg=-0.199) USER MOD Single : A 47 LYS NZ :NH3+ -119:sc= -0.611 (180deg=-2.35!) USER MOD Single : A 49 LYS NZ :NH3+ -111:sc= 1.05 (180deg=-0.797) USER MOD Single : A 53 THR OG1 : rot 75:sc= 0.677 USER MOD Single : A 54 TYR OH : rot 130:sc= 0.0508 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= 0.676 K(o=0.68,f=-4.7!) USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.037 USER MOD Single : A 69 CYS SG : rot 12:sc= -0.433 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 138:sc= 0.971 (180deg=0.315) USER MOD Single : A 84 LYS NZ :NH3+ -175:sc= 0.0902 (180deg=0.078) USER MOD Single : A 85 MET CE :methyl 154:sc= -0.0645 (180deg=-0.522) USER MOD Single : A 89 ASN : amide:sc= 0.983 K(o=0.98,f=-2.1!) USER MOD Single : A 90 LYS NZ :NH3+ -174:sc= 1.14 (180deg=0.898!) USER MOD Single : A 91 MET CE :methyl -118:sc= -10.4! (180deg=-10.9!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 150:sc= -0.201 (180deg=-0.906) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 72:sc= 0.829 USER MOD Single : A 105 ASN : amide:sc= -0.175 K(o=-0.17,f=-2.6!) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 144:sc= 0.886 USER MOD Single : A 111 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 MET CE :methyl -134:sc= -0.0764 (180deg=-0.37) USER MOD Single : A 114 THR OG1 : rot 79:sc= 0.0868 USER MOD Single : A 120 TYR OH : rot 150:sc= -0.0429 USER MOD Single : A 121 LYS NZ :NH3+ 158:sc= -0.0574 (180deg=-0.347) USER MOD Single : A 124 SER OG : rot 180:sc= -0.305 USER MOD Single : A 125 LYS NZ :NH3+ -173:sc= 0.966 (180deg=0.922) USER MOD ----------------------------------------------------------------- ATOM 54 N SER A 4 7.701 -11.122 8.235 1.00 0.00 N ATOM 55 CA SER A 4 7.149 -10.392 9.375 1.00 0.00 C ATOM 56 C SER A 4 8.143 -9.390 9.988 1.00 0.00 C ATOM 57 O SER A 4 9.116 -9.752 10.653 1.00 0.00 O ATOM 58 CB SER A 4 6.599 -11.375 10.415 1.00 0.00 C ATOM 59 OG SER A 4 7.634 -12.053 11.114 1.00 0.00 O ATOM 0 HA SER A 4 6.323 -9.784 9.006 1.00 0.00 H new ATOM 0 HB2 SER A 4 5.975 -10.836 11.127 1.00 0.00 H new ATOM 0 HB3 SER A 4 5.959 -12.105 9.919 1.00 0.00 H new ATOM 0 HG SER A 4 8.417 -11.468 11.188 1.00 0.00 H new ATOM 65 N GLY A 5 7.862 -8.121 9.770 1.00 0.00 N ATOM 66 CA GLY A 5 8.744 -7.061 10.204 1.00 0.00 C ATOM 67 C GLY A 5 8.238 -5.715 9.740 1.00 0.00 C ATOM 68 O GLY A 5 7.214 -5.637 9.061 1.00 0.00 O ATOM 0 H GLY A 5 7.021 -7.799 9.290 1.00 0.00 H new ATOM 0 HA2 GLY A 5 8.822 -7.070 11.291 1.00 0.00 H new ATOM 0 HA3 GLY A 5 9.746 -7.232 9.811 1.00 0.00 H new ATOM 72 N LYS A 6 8.941 -4.654 10.092 1.00 0.00 N ATOM 73 CA LYS A 6 8.520 -3.312 9.717 1.00 0.00 C ATOM 74 C LYS A 6 9.216 -2.884 8.421 1.00 0.00 C ATOM 75 O LYS A 6 10.406 -3.143 8.227 1.00 0.00 O ATOM 76 CB LYS A 6 8.865 -2.319 10.824 1.00 0.00 C ATOM 77 CG LYS A 6 7.957 -1.114 10.885 1.00 0.00 C ATOM 78 CD LYS A 6 6.718 -1.411 11.679 1.00 0.00 C ATOM 79 CE LYS A 6 6.753 -0.685 12.989 1.00 0.00 C ATOM 80 NZ LYS A 6 5.565 -0.982 13.831 1.00 0.00 N ATOM 0 H LYS A 6 9.803 -4.693 10.635 1.00 0.00 H new ATOM 0 HA LYS A 6 7.441 -3.321 9.565 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.828 -2.835 11.783 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.891 -1.979 10.684 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.489 -0.276 11.335 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.681 -0.811 9.875 1.00 0.00 H new ATOM 0 HD2 LYS A 6 5.835 -1.112 11.114 1.00 0.00 H new ATOM 0 HD3 LYS A 6 6.638 -2.484 11.852 1.00 0.00 H new ATOM 0 HE2 LYS A 6 7.658 -0.961 13.531 1.00 0.00 H new ATOM 0 HE3 LYS A 6 6.806 0.388 12.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 5.674 -0.525 14.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 4.709 -0.618 13.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.479 -2.010 13.959 1.00 0.00 H new ATOM 94 N TYR A 7 8.471 -2.230 7.542 1.00 0.00 N ATOM 95 CA TYR A 7 9.010 -1.719 6.289 1.00 0.00 C ATOM 96 C TYR A 7 8.603 -0.265 6.100 1.00 0.00 C ATOM 97 O TYR A 7 7.425 0.052 5.973 1.00 0.00 O ATOM 98 CB TYR A 7 8.515 -2.550 5.105 1.00 0.00 C ATOM 99 CG TYR A 7 9.005 -3.976 5.125 1.00 0.00 C ATOM 100 CD1 TYR A 7 8.389 -4.920 5.926 1.00 0.00 C ATOM 101 CD2 TYR A 7 10.084 -4.372 4.353 1.00 0.00 C ATOM 102 CE1 TYR A 7 8.836 -6.222 5.969 1.00 0.00 C ATOM 103 CE2 TYR A 7 10.535 -5.675 4.383 1.00 0.00 C ATOM 104 CZ TYR A 7 9.913 -6.595 5.195 1.00 0.00 C ATOM 105 OH TYR A 7 10.380 -7.889 5.244 1.00 0.00 O ATOM 0 H TYR A 7 7.478 -2.039 7.676 1.00 0.00 H new ATOM 0 HA TYR A 7 10.097 -1.788 6.332 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.425 -2.549 5.101 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.838 -2.076 4.178 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.541 -4.631 6.529 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.579 -3.651 3.719 1.00 0.00 H new ATOM 0 HE1 TYR A 7 8.346 -6.945 6.604 1.00 0.00 H new ATOM 0 HE2 TYR A 7 11.374 -5.972 3.771 1.00 0.00 H new ATOM 0 HH TYR A 7 10.081 -8.375 4.448 1.00 0.00 H new ATOM 115 N GLN A 8 9.577 0.618 6.074 1.00 0.00 N ATOM 116 CA GLN A 8 9.302 2.030 5.923 1.00 0.00 C ATOM 117 C GLN A 8 9.322 2.378 4.439 1.00 0.00 C ATOM 118 O GLN A 8 10.262 2.024 3.722 1.00 0.00 O ATOM 119 CB GLN A 8 10.337 2.849 6.712 1.00 0.00 C ATOM 120 CG GLN A 8 11.618 3.156 5.949 1.00 0.00 C ATOM 121 CD GLN A 8 12.630 3.956 6.751 1.00 0.00 C ATOM 122 OE1 GLN A 8 12.150 4.786 7.667 1.00 0.00 O flip ATOM 123 NE2 GLN A 8 13.837 3.832 6.542 1.00 0.00 N flip ATOM 0 H GLN A 8 10.566 0.383 6.155 1.00 0.00 H new ATOM 0 HA GLN A 8 8.317 2.272 6.323 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.879 3.789 7.020 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.593 2.306 7.622 1.00 0.00 H new ATOM 0 HG2 GLN A 8 12.076 2.218 5.634 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.367 3.708 5.043 1.00 0.00 H new ATOM 0 HE21 GLN A 8 14.167 3.182 5.828 1.00 0.00 H new ATOM 0 HE22 GLN A 8 14.507 4.379 7.083 1.00 0.00 H new ATOM 132 N VAL A 9 8.264 3.010 3.952 1.00 0.00 N ATOM 133 CA VAL A 9 8.223 3.380 2.549 1.00 0.00 C ATOM 134 C VAL A 9 9.291 4.384 2.248 1.00 0.00 C ATOM 135 O VAL A 9 9.421 5.421 2.901 1.00 0.00 O ATOM 136 CB VAL A 9 6.897 3.983 2.079 1.00 0.00 C ATOM 137 CG1 VAL A 9 6.878 4.076 0.554 1.00 0.00 C ATOM 138 CG2 VAL A 9 5.712 3.193 2.585 1.00 0.00 C ATOM 0 H VAL A 9 7.441 3.272 4.495 1.00 0.00 H new ATOM 0 HA VAL A 9 8.367 2.440 2.017 1.00 0.00 H new ATOM 0 HB VAL A 9 6.815 4.986 2.497 1.00 0.00 H new ATOM 0 HG11 VAL A 9 5.931 4.506 0.227 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.699 4.709 0.218 1.00 0.00 H new ATOM 0 HG13 VAL A 9 6.990 3.079 0.127 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.790 3.653 2.230 1.00 0.00 H new ATOM 0 HG22 VAL A 9 5.773 2.169 2.216 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.718 3.186 3.675 1.00 0.00 H new ATOM 148 N GLN A 10 10.063 4.031 1.280 1.00 0.00 N ATOM 149 CA GLN A 10 10.895 4.945 0.603 1.00 0.00 C ATOM 150 C GLN A 10 10.211 5.260 -0.716 1.00 0.00 C ATOM 151 O GLN A 10 9.095 5.735 -0.730 1.00 0.00 O ATOM 152 CB GLN A 10 12.290 4.372 0.405 1.00 0.00 C ATOM 153 CG GLN A 10 12.923 3.876 1.682 1.00 0.00 C ATOM 154 CD GLN A 10 14.430 3.982 1.647 1.00 0.00 C ATOM 155 OE1 GLN A 10 15.002 4.986 2.067 1.00 0.00 O ATOM 156 NE2 GLN A 10 15.085 2.960 1.130 1.00 0.00 N ATOM 0 H GLN A 10 10.130 3.074 0.934 1.00 0.00 H new ATOM 0 HA GLN A 10 11.033 5.858 1.182 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.239 3.550 -0.309 1.00 0.00 H new ATOM 0 HB3 GLN A 10 12.930 5.137 -0.035 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.539 4.452 2.524 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.637 2.838 1.849 1.00 0.00 H new ATOM 0 HE21 GLN A 10 14.574 2.145 0.792 1.00 0.00 H new ATOM 0 HE22 GLN A 10 16.103 2.985 1.068 1.00 0.00 H new ATOM 165 N SER A 11 10.702 4.719 -1.784 1.00 0.00 N ATOM 166 CA SER A 11 10.620 5.434 -3.044 1.00 0.00 C ATOM 167 C SER A 11 9.234 5.369 -3.637 1.00 0.00 C ATOM 168 O SER A 11 8.716 4.315 -3.945 1.00 0.00 O ATOM 169 CB SER A 11 11.560 4.815 -4.029 1.00 0.00 C ATOM 170 OG SER A 11 12.677 4.219 -3.380 1.00 0.00 O ATOM 0 H SER A 11 11.156 3.807 -1.825 1.00 0.00 H new ATOM 0 HA SER A 11 10.876 6.474 -2.843 1.00 0.00 H new ATOM 0 HB2 SER A 11 11.032 4.061 -4.613 1.00 0.00 H new ATOM 0 HB3 SER A 11 11.907 5.575 -4.729 1.00 0.00 H new ATOM 0 HG SER A 11 13.271 3.822 -4.050 1.00 0.00 H new ATOM 176 N GLN A 12 8.693 6.522 -3.896 1.00 0.00 N ATOM 177 CA GLN A 12 7.343 6.618 -4.399 1.00 0.00 C ATOM 178 C GLN A 12 7.339 7.448 -5.662 1.00 0.00 C ATOM 179 O GLN A 12 8.221 8.284 -5.865 1.00 0.00 O ATOM 180 CB GLN A 12 6.363 7.253 -3.395 1.00 0.00 C ATOM 181 CG GLN A 12 6.749 7.138 -1.938 1.00 0.00 C ATOM 182 CD GLN A 12 7.654 8.286 -1.507 1.00 0.00 C ATOM 183 OE1 GLN A 12 8.878 8.222 -1.623 1.00 0.00 O ATOM 184 NE2 GLN A 12 7.050 9.356 -1.014 1.00 0.00 N ATOM 0 H GLN A 12 9.164 7.418 -3.768 1.00 0.00 H new ATOM 0 HA GLN A 12 7.006 5.599 -4.587 1.00 0.00 H new ATOM 0 HB2 GLN A 12 6.254 8.309 -3.640 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.384 6.792 -3.530 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.850 7.131 -1.322 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.258 6.189 -1.769 1.00 0.00 H new ATOM 0 HE21 GLN A 12 6.033 9.375 -0.932 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.601 10.161 -0.716 1.00 0.00 H new ATOM 193 N GLU A 13 6.361 7.215 -6.508 1.00 0.00 N ATOM 194 CA GLU A 13 6.204 8.004 -7.709 1.00 0.00 C ATOM 195 C GLU A 13 4.773 8.362 -7.906 1.00 0.00 C ATOM 196 O GLU A 13 3.880 7.714 -7.354 1.00 0.00 O ATOM 197 CB GLU A 13 6.649 7.265 -8.957 1.00 0.00 C ATOM 198 CG GLU A 13 8.009 6.642 -8.843 1.00 0.00 C ATOM 199 CD GLU A 13 8.703 6.513 -10.175 1.00 0.00 C ATOM 200 OE1 GLU A 13 8.874 7.548 -10.858 1.00 0.00 O ATOM 201 OE2 GLU A 13 9.104 5.386 -10.536 1.00 0.00 O ATOM 0 H GLU A 13 5.661 6.484 -6.386 1.00 0.00 H new ATOM 0 HA GLU A 13 6.828 8.887 -7.571 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.921 6.486 -9.185 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.647 7.959 -9.798 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.625 7.243 -8.174 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.915 5.655 -8.390 1.00 0.00 H new ATOM 208 N ASN A 14 4.572 9.381 -8.713 1.00 0.00 N ATOM 209 CA ASN A 14 3.264 9.720 -9.209 1.00 0.00 C ATOM 210 C ASN A 14 2.289 10.005 -8.073 1.00 0.00 C ATOM 211 O ASN A 14 1.088 9.764 -8.192 1.00 0.00 O ATOM 212 CB ASN A 14 2.747 8.591 -10.089 1.00 0.00 C ATOM 213 CG ASN A 14 3.327 8.610 -11.489 1.00 0.00 C ATOM 214 OD1 ASN A 14 4.451 9.063 -11.714 1.00 0.00 O ATOM 215 ND2 ASN A 14 2.562 8.103 -12.442 1.00 0.00 N ATOM 0 H ASN A 14 5.316 9.997 -9.042 1.00 0.00 H new ATOM 0 HA ASN A 14 3.346 10.632 -9.800 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.982 7.636 -9.619 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.661 8.657 -10.152 1.00 0.00 H new ATOM 0 HD21 ASN A 14 2.897 8.077 -13.405 1.00 0.00 H new ATOM 0 HD22 ASN A 14 1.637 7.738 -12.214 1.00 0.00 H new ATOM 222 N PHE A 15 2.816 10.530 -6.978 1.00 0.00 N ATOM 223 CA PHE A 15 1.991 10.892 -5.841 1.00 0.00 C ATOM 224 C PHE A 15 1.180 12.124 -6.189 1.00 0.00 C ATOM 225 O PHE A 15 -0.012 12.212 -5.883 1.00 0.00 O ATOM 226 CB PHE A 15 2.861 11.160 -4.605 1.00 0.00 C ATOM 227 CG PHE A 15 2.088 11.645 -3.406 1.00 0.00 C ATOM 228 CD1 PHE A 15 1.693 12.970 -3.310 1.00 0.00 C ATOM 229 CD2 PHE A 15 1.753 10.778 -2.379 1.00 0.00 C ATOM 230 CE1 PHE A 15 0.983 13.422 -2.219 1.00 0.00 C ATOM 231 CE2 PHE A 15 1.043 11.224 -1.280 1.00 0.00 C ATOM 232 CZ PHE A 15 0.656 12.548 -1.201 1.00 0.00 C ATOM 0 H PHE A 15 3.812 10.714 -6.855 1.00 0.00 H new ATOM 0 HA PHE A 15 1.319 10.066 -5.608 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.388 10.244 -4.339 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.619 11.901 -4.860 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.946 13.659 -4.103 1.00 0.00 H new ATOM 0 HD2 PHE A 15 2.050 9.741 -2.438 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.683 14.458 -2.160 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.791 10.539 -0.484 1.00 0.00 H new ATOM 0 HZ PHE A 15 0.099 12.899 -0.345 1.00 0.00 H new ATOM 242 N GLU A 16 1.841 13.069 -6.849 1.00 0.00 N ATOM 243 CA GLU A 16 1.212 14.317 -7.233 1.00 0.00 C ATOM 244 C GLU A 16 0.013 14.041 -8.103 1.00 0.00 C ATOM 245 O GLU A 16 -1.084 14.383 -7.739 1.00 0.00 O ATOM 246 CB GLU A 16 2.179 15.216 -7.999 1.00 0.00 C ATOM 247 CG GLU A 16 3.622 14.814 -7.842 1.00 0.00 C ATOM 248 CD GLU A 16 4.574 15.714 -8.608 1.00 0.00 C ATOM 249 OE1 GLU A 16 4.354 16.942 -8.631 1.00 0.00 O ATOM 250 OE2 GLU A 16 5.550 15.190 -9.195 1.00 0.00 O ATOM 0 H GLU A 16 2.819 12.988 -7.128 1.00 0.00 H new ATOM 0 HA GLU A 16 0.907 14.828 -6.320 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.918 15.199 -9.057 1.00 0.00 H new ATOM 0 HB3 GLU A 16 2.057 16.244 -7.657 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.886 14.832 -6.784 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.747 13.787 -8.185 1.00 0.00 H new ATOM 257 N PRO A 17 0.200 13.384 -9.249 1.00 0.00 N ATOM 258 CA PRO A 17 -0.884 13.167 -10.198 1.00 0.00 C ATOM 259 C PRO A 17 -2.071 12.440 -9.574 1.00 0.00 C ATOM 260 O PRO A 17 -3.214 12.630 -9.993 1.00 0.00 O ATOM 261 CB PRO A 17 -0.271 12.317 -11.289 1.00 0.00 C ATOM 262 CG PRO A 17 1.007 11.790 -10.732 1.00 0.00 C ATOM 263 CD PRO A 17 1.459 12.775 -9.696 1.00 0.00 C ATOM 0 HA PRO A 17 -1.280 14.116 -10.560 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -0.939 11.503 -11.570 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -0.091 12.907 -12.188 1.00 0.00 H new ATOM 0 HG2 PRO A 17 0.861 10.804 -10.292 1.00 0.00 H new ATOM 0 HG3 PRO A 17 1.756 11.681 -11.516 1.00 0.00 H new ATOM 0 HD2 PRO A 17 1.984 12.286 -8.876 1.00 0.00 H new ATOM 0 HD3 PRO A 17 2.140 13.516 -10.114 1.00 0.00 H new ATOM 271 N PHE A 18 -1.796 11.616 -8.569 1.00 0.00 N ATOM 272 CA PHE A 18 -2.847 10.887 -7.879 1.00 0.00 C ATOM 273 C PHE A 18 -3.636 11.827 -6.974 1.00 0.00 C ATOM 274 O PHE A 18 -4.860 11.894 -7.055 1.00 0.00 O ATOM 275 CB PHE A 18 -2.248 9.739 -7.061 1.00 0.00 C ATOM 276 CG PHE A 18 -3.279 8.784 -6.541 1.00 0.00 C ATOM 277 CD1 PHE A 18 -3.976 7.978 -7.417 1.00 0.00 C ATOM 278 CD2 PHE A 18 -3.558 8.697 -5.187 1.00 0.00 C ATOM 279 CE1 PHE A 18 -4.933 7.100 -6.965 1.00 0.00 C ATOM 280 CE2 PHE A 18 -4.519 7.817 -4.723 1.00 0.00 C ATOM 281 CZ PHE A 18 -5.209 7.017 -5.615 1.00 0.00 C ATOM 0 H PHE A 18 -0.855 11.438 -8.217 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.526 10.468 -8.622 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.536 9.193 -7.680 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -1.689 10.153 -6.222 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -3.767 8.037 -8.475 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -3.021 9.321 -4.488 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.468 6.476 -7.665 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -4.730 7.755 -3.666 1.00 0.00 H new ATOM 0 HZ PHE A 18 -5.961 6.330 -5.257 1.00 0.00 H new ATOM 291 N MET A 19 -2.921 12.578 -6.140 1.00 0.00 N ATOM 292 CA MET A 19 -3.541 13.573 -5.264 1.00 0.00 C ATOM 293 C MET A 19 -4.083 14.731 -6.072 1.00 0.00 C ATOM 294 O MET A 19 -5.085 15.331 -5.710 1.00 0.00 O ATOM 295 CB MET A 19 -2.537 14.081 -4.229 1.00 0.00 C ATOM 296 CG MET A 19 -2.549 13.283 -2.935 1.00 0.00 C ATOM 297 SD MET A 19 -2.206 11.530 -3.193 1.00 0.00 S ATOM 298 CE MET A 19 -2.546 10.873 -1.563 1.00 0.00 C ATOM 0 H MET A 19 -1.907 12.517 -6.051 1.00 0.00 H new ATOM 0 HA MET A 19 -4.369 13.094 -4.741 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.536 14.048 -4.658 1.00 0.00 H new ATOM 0 HB3 MET A 19 -2.754 15.126 -4.005 1.00 0.00 H new ATOM 0 HG2 MET A 19 -1.808 13.697 -2.251 1.00 0.00 H new ATOM 0 HG3 MET A 19 -3.522 13.392 -2.455 1.00 0.00 H new ATOM 0 HE1 MET A 19 -2.212 9.837 -1.511 1.00 0.00 H new ATOM 0 HE2 MET A 19 -2.016 11.463 -0.815 1.00 0.00 H new ATOM 0 HE3 MET A 19 -3.618 10.919 -1.369 1.00 0.00 H new ATOM 308 N LYS A 20 -3.420 15.033 -7.170 1.00 0.00 N ATOM 309 CA LYS A 20 -3.847 16.091 -8.058 1.00 0.00 C ATOM 310 C LYS A 20 -5.231 15.775 -8.567 1.00 0.00 C ATOM 311 O LYS A 20 -6.151 16.586 -8.441 1.00 0.00 O ATOM 312 CB LYS A 20 -2.878 16.209 -9.217 1.00 0.00 C ATOM 313 CG LYS A 20 -1.908 17.352 -9.056 1.00 0.00 C ATOM 314 CD LYS A 20 -0.608 17.059 -9.750 1.00 0.00 C ATOM 315 CE LYS A 20 0.283 18.263 -9.735 1.00 0.00 C ATOM 316 NZ LYS A 20 1.676 17.946 -10.159 1.00 0.00 N ATOM 0 H LYS A 20 -2.572 14.552 -7.470 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.866 17.040 -7.522 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -2.321 15.277 -9.315 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -3.440 16.343 -10.142 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.344 18.264 -9.464 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.726 17.532 -7.997 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.108 16.224 -9.259 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -0.800 16.755 -10.779 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.130 19.025 -10.396 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.300 18.687 -8.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 2.099 18.780 -10.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.241 17.683 -9.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 1.662 17.154 -10.833 1.00 0.00 H new ATOM 330 N ALA A 21 -5.386 14.530 -9.021 1.00 0.00 N ATOM 331 CA ALA A 21 -6.661 14.035 -9.506 1.00 0.00 C ATOM 332 C ALA A 21 -7.624 13.833 -8.347 1.00 0.00 C ATOM 333 O ALA A 21 -8.839 13.745 -8.518 1.00 0.00 O ATOM 334 CB ALA A 21 -6.472 12.750 -10.273 1.00 0.00 C ATOM 0 H ALA A 21 -4.631 13.845 -9.060 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.087 14.776 -10.183 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.438 12.393 -10.629 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.815 12.928 -11.124 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.026 11.999 -9.621 1.00 0.00 H new ATOM 340 N MET A 22 -7.041 13.755 -7.168 1.00 0.00 N ATOM 341 CA MET A 22 -7.780 13.654 -5.920 1.00 0.00 C ATOM 342 C MET A 22 -8.277 15.028 -5.490 1.00 0.00 C ATOM 343 O MET A 22 -9.053 15.163 -4.544 1.00 0.00 O ATOM 344 CB MET A 22 -6.881 13.039 -4.850 1.00 0.00 C ATOM 345 CG MET A 22 -7.014 11.535 -4.755 1.00 0.00 C ATOM 346 SD MET A 22 -6.029 10.827 -3.421 1.00 0.00 S ATOM 347 CE MET A 22 -6.743 11.649 -1.997 1.00 0.00 C ATOM 0 H MET A 22 -6.028 13.760 -7.045 1.00 0.00 H new ATOM 0 HA MET A 22 -8.650 13.012 -6.061 1.00 0.00 H new ATOM 0 HB2 MET A 22 -5.843 13.293 -5.066 1.00 0.00 H new ATOM 0 HB3 MET A 22 -7.123 13.481 -3.883 1.00 0.00 H new ATOM 0 HG2 MET A 22 -8.062 11.277 -4.603 1.00 0.00 H new ATOM 0 HG3 MET A 22 -6.710 11.088 -5.701 1.00 0.00 H new ATOM 0 HE1 MET A 22 -6.778 10.956 -1.157 1.00 0.00 H new ATOM 0 HE2 MET A 22 -6.132 12.512 -1.731 1.00 0.00 H new ATOM 0 HE3 MET A 22 -7.753 11.980 -2.237 1.00 0.00 H new ATOM 357 N GLY A 23 -7.803 16.039 -6.199 1.00 0.00 N ATOM 358 CA GLY A 23 -8.260 17.397 -5.985 1.00 0.00 C ATOM 359 C GLY A 23 -7.219 18.256 -5.300 1.00 0.00 C ATOM 360 O GLY A 23 -7.516 19.361 -4.847 1.00 0.00 O ATOM 0 H GLY A 23 -7.099 15.941 -6.930 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.522 17.844 -6.944 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.168 17.381 -5.382 1.00 0.00 H new ATOM 364 N LEU A 24 -6.001 17.747 -5.219 1.00 0.00 N ATOM 365 CA LEU A 24 -4.936 18.435 -4.499 1.00 0.00 C ATOM 366 C LEU A 24 -4.166 19.355 -5.430 1.00 0.00 C ATOM 367 O LEU A 24 -3.706 18.955 -6.500 1.00 0.00 O ATOM 368 CB LEU A 24 -3.995 17.436 -3.813 1.00 0.00 C ATOM 369 CG LEU A 24 -3.250 17.981 -2.598 1.00 0.00 C ATOM 370 CD1 LEU A 24 -4.242 18.351 -1.512 1.00 0.00 C ATOM 371 CD2 LEU A 24 -2.237 16.972 -2.059 1.00 0.00 C ATOM 0 H LEU A 24 -5.723 16.861 -5.641 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.396 19.045 -3.721 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.575 16.566 -3.504 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.264 17.089 -4.543 1.00 0.00 H new ATOM 0 HG LEU A 24 -2.700 18.869 -2.911 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.706 18.740 -0.646 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.925 19.113 -1.888 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.809 17.467 -1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.726 17.396 -1.194 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.754 16.059 -1.764 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.507 16.740 -2.834 1.00 0.00 H new ATOM 383 N PRO A 25 -4.040 20.609 -5.010 1.00 0.00 N ATOM 384 CA PRO A 25 -3.295 21.629 -5.735 1.00 0.00 C ATOM 385 C PRO A 25 -1.800 21.366 -5.701 1.00 0.00 C ATOM 386 O PRO A 25 -1.314 20.759 -4.754 1.00 0.00 O ATOM 387 CB PRO A 25 -3.602 22.927 -4.994 1.00 0.00 C ATOM 388 CG PRO A 25 -4.317 22.558 -3.742 1.00 0.00 C ATOM 389 CD PRO A 25 -4.627 21.103 -3.771 1.00 0.00 C ATOM 0 HA PRO A 25 -3.579 21.653 -6.787 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -2.683 23.468 -4.768 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -4.216 23.585 -5.609 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -3.702 22.794 -2.874 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -5.236 23.137 -3.649 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -4.204 20.594 -2.905 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -5.703 20.930 -3.749 1.00 0.00 H new ATOM 397 N GLU A 26 -1.074 21.831 -6.710 1.00 0.00 N ATOM 398 CA GLU A 26 0.371 21.595 -6.802 1.00 0.00 C ATOM 399 C GLU A 26 1.098 21.991 -5.518 1.00 0.00 C ATOM 400 O GLU A 26 1.991 21.277 -5.065 1.00 0.00 O ATOM 401 CB GLU A 26 0.985 22.339 -7.986 1.00 0.00 C ATOM 402 CG GLU A 26 0.938 23.840 -7.844 1.00 0.00 C ATOM 403 CD GLU A 26 -0.467 24.402 -7.856 1.00 0.00 C ATOM 404 OE1 GLU A 26 -1.112 24.365 -8.917 1.00 0.00 O ATOM 405 OE2 GLU A 26 -0.936 24.869 -6.795 1.00 0.00 O ATOM 0 H GLU A 26 -1.459 22.376 -7.481 1.00 0.00 H new ATOM 0 HA GLU A 26 0.498 20.523 -6.953 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.022 22.026 -8.103 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.460 22.052 -8.897 1.00 0.00 H new ATOM 0 HG2 GLU A 26 1.427 24.125 -6.912 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.509 24.292 -8.655 1.00 0.00 H new ATOM 412 N ASP A 27 0.709 23.113 -4.928 1.00 0.00 N ATOM 413 CA ASP A 27 1.365 23.594 -3.719 1.00 0.00 C ATOM 414 C ASP A 27 1.165 22.617 -2.571 1.00 0.00 C ATOM 415 O ASP A 27 2.111 22.291 -1.862 1.00 0.00 O ATOM 416 CB ASP A 27 0.842 24.979 -3.334 1.00 0.00 C ATOM 417 CG ASP A 27 1.321 25.432 -1.967 1.00 0.00 C ATOM 418 OD1 ASP A 27 2.520 25.748 -1.823 1.00 0.00 O ATOM 419 OD2 ASP A 27 0.491 25.499 -1.033 1.00 0.00 O ATOM 0 H ASP A 27 -0.052 23.704 -5.263 1.00 0.00 H new ATOM 0 HA ASP A 27 2.433 23.672 -3.924 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.161 25.703 -4.084 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -0.248 24.967 -3.346 1.00 0.00 H new ATOM 424 N LEU A 28 -0.054 22.115 -2.423 1.00 0.00 N ATOM 425 CA LEU A 28 -0.344 21.129 -1.387 1.00 0.00 C ATOM 426 C LEU A 28 0.247 19.782 -1.768 1.00 0.00 C ATOM 427 O LEU A 28 0.661 18.996 -0.915 1.00 0.00 O ATOM 428 CB LEU A 28 -1.842 21.009 -1.159 1.00 0.00 C ATOM 429 CG LEU A 28 -2.447 22.127 -0.326 1.00 0.00 C ATOM 430 CD1 LEU A 28 -3.942 21.933 -0.191 1.00 0.00 C ATOM 431 CD2 LEU A 28 -1.790 22.177 1.040 1.00 0.00 C ATOM 0 H LEU A 28 -0.854 22.371 -3.002 1.00 0.00 H new ATOM 0 HA LEU A 28 0.113 21.462 -0.455 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.343 20.983 -2.127 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.047 20.057 -0.669 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.268 23.076 -0.831 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.361 22.741 0.408 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.400 21.939 -1.180 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.143 20.979 0.296 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.232 22.982 1.627 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.944 21.227 1.553 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.721 22.358 0.923 1.00 0.00 H new ATOM 443 N ILE A 29 0.284 19.541 -3.066 1.00 0.00 N ATOM 444 CA ILE A 29 0.918 18.381 -3.637 1.00 0.00 C ATOM 445 C ILE A 29 2.390 18.320 -3.252 1.00 0.00 C ATOM 446 O ILE A 29 2.879 17.280 -2.833 1.00 0.00 O ATOM 447 CB ILE A 29 0.766 18.450 -5.166 1.00 0.00 C ATOM 448 CG1 ILE A 29 -0.580 17.872 -5.573 1.00 0.00 C ATOM 449 CG2 ILE A 29 1.878 17.732 -5.868 1.00 0.00 C ATOM 450 CD1 ILE A 29 -0.643 16.370 -5.535 1.00 0.00 C ATOM 0 H ILE A 29 -0.135 20.161 -3.760 1.00 0.00 H new ATOM 0 HA ILE A 29 0.442 17.479 -3.253 1.00 0.00 H new ATOM 0 HB ILE A 29 0.817 19.497 -5.465 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.349 18.273 -4.914 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.817 18.209 -6.582 1.00 0.00 H new ATOM 0 HG21 ILE A 29 1.734 17.804 -6.946 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.832 18.186 -5.598 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.878 16.683 -5.571 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.636 16.040 -5.839 1.00 0.00 H new ATOM 0 HD12 ILE A 29 0.101 15.957 -6.216 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.439 16.023 -4.522 1.00 0.00 H new ATOM 462 N GLN A 30 3.079 19.445 -3.361 1.00 0.00 N ATOM 463 CA GLN A 30 4.501 19.508 -3.044 1.00 0.00 C ATOM 464 C GLN A 30 4.760 19.203 -1.567 1.00 0.00 C ATOM 465 O GLN A 30 5.853 18.782 -1.185 1.00 0.00 O ATOM 466 CB GLN A 30 5.062 20.892 -3.388 1.00 0.00 C ATOM 467 CG GLN A 30 5.074 21.200 -4.865 1.00 0.00 C ATOM 468 CD GLN A 30 5.703 22.543 -5.179 1.00 0.00 C ATOM 469 OE1 GLN A 30 6.607 23.003 -4.482 1.00 0.00 O ATOM 470 NE2 GLN A 30 5.221 23.185 -6.229 1.00 0.00 N ATOM 0 H GLN A 30 2.677 20.331 -3.667 1.00 0.00 H new ATOM 0 HA GLN A 30 5.005 18.751 -3.644 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.471 21.650 -2.874 1.00 0.00 H new ATOM 0 HB3 GLN A 30 6.079 20.966 -3.004 1.00 0.00 H new ATOM 0 HG2 GLN A 30 5.620 20.416 -5.391 1.00 0.00 H new ATOM 0 HG3 GLN A 30 4.052 21.185 -5.243 1.00 0.00 H new ATOM 0 HE21 GLN A 30 4.471 22.769 -6.781 1.00 0.00 H new ATOM 0 HE22 GLN A 30 5.599 24.096 -6.487 1.00 0.00 H new ATOM 479 N LYS A 31 3.744 19.417 -0.745 1.00 0.00 N ATOM 480 CA LYS A 31 3.866 19.270 0.699 1.00 0.00 C ATOM 481 C LYS A 31 3.525 17.861 1.123 1.00 0.00 C ATOM 482 O LYS A 31 3.747 17.463 2.265 1.00 0.00 O ATOM 483 CB LYS A 31 2.968 20.262 1.400 1.00 0.00 C ATOM 484 CG LYS A 31 3.370 21.684 1.115 1.00 0.00 C ATOM 485 CD LYS A 31 2.170 22.578 1.133 1.00 0.00 C ATOM 486 CE LYS A 31 1.606 22.723 2.530 1.00 0.00 C ATOM 487 NZ LYS A 31 2.483 23.549 3.401 1.00 0.00 N ATOM 0 H LYS A 31 2.814 19.697 -1.058 1.00 0.00 H new ATOM 0 HA LYS A 31 4.900 19.470 0.981 1.00 0.00 H new ATOM 0 HB2 LYS A 31 1.937 20.106 1.082 1.00 0.00 H new ATOM 0 HB3 LYS A 31 3.001 20.084 2.475 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.093 22.020 1.858 1.00 0.00 H new ATOM 0 HG3 LYS A 31 3.861 21.742 0.143 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.441 23.560 0.745 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.404 22.174 0.471 1.00 0.00 H new ATOM 0 HE2 LYS A 31 0.617 23.177 2.476 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.480 21.736 2.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.980 23.779 4.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 3.349 23.018 3.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.735 24.428 2.906 1.00 0.00 H new ATOM 501 N GLY A 32 2.943 17.129 0.198 1.00 0.00 N ATOM 502 CA GLY A 32 2.563 15.763 0.459 1.00 0.00 C ATOM 503 C GLY A 32 3.350 14.781 -0.378 1.00 0.00 C ATOM 504 O GLY A 32 3.462 13.608 -0.029 1.00 0.00 O ATOM 0 H GLY A 32 2.724 17.460 -0.742 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.715 15.541 1.515 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.499 15.639 0.257 1.00 0.00 H new ATOM 508 N LYS A 33 3.909 15.278 -1.476 1.00 0.00 N ATOM 509 CA LYS A 33 4.472 14.415 -2.524 1.00 0.00 C ATOM 510 C LYS A 33 5.566 13.466 -2.034 1.00 0.00 C ATOM 511 O LYS A 33 5.766 12.403 -2.622 1.00 0.00 O ATOM 512 CB LYS A 33 4.997 15.241 -3.693 1.00 0.00 C ATOM 513 CG LYS A 33 6.275 15.963 -3.429 1.00 0.00 C ATOM 514 CD LYS A 33 6.448 16.980 -4.512 1.00 0.00 C ATOM 515 CE LYS A 33 6.991 16.366 -5.794 1.00 0.00 C ATOM 516 NZ LYS A 33 8.246 15.598 -5.577 1.00 0.00 N ATOM 0 H LYS A 33 3.987 16.276 -1.669 1.00 0.00 H new ATOM 0 HA LYS A 33 3.641 13.791 -2.852 1.00 0.00 H new ATOM 0 HB2 LYS A 33 5.139 14.582 -4.549 1.00 0.00 H new ATOM 0 HB3 LYS A 33 4.237 15.970 -3.974 1.00 0.00 H new ATOM 0 HG2 LYS A 33 6.249 16.444 -2.451 1.00 0.00 H new ATOM 0 HG3 LYS A 33 7.114 15.267 -3.419 1.00 0.00 H new ATOM 0 HD2 LYS A 33 5.490 17.457 -4.717 1.00 0.00 H new ATOM 0 HD3 LYS A 33 7.126 17.762 -4.170 1.00 0.00 H new ATOM 0 HE2 LYS A 33 6.237 15.707 -6.224 1.00 0.00 H new ATOM 0 HE3 LYS A 33 7.175 17.157 -6.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 8.749 15.493 -6.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 8.851 16.106 -4.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 8.016 14.658 -5.197 1.00 0.00 H new ATOM 530 N ASP A 34 6.284 13.832 -0.983 1.00 0.00 N ATOM 531 CA ASP A 34 7.419 13.033 -0.551 1.00 0.00 C ATOM 532 C ASP A 34 7.076 12.215 0.681 1.00 0.00 C ATOM 533 O ASP A 34 7.897 11.442 1.166 1.00 0.00 O ATOM 534 CB ASP A 34 8.623 13.923 -0.259 1.00 0.00 C ATOM 535 CG ASP A 34 8.496 14.678 1.045 1.00 0.00 C ATOM 536 OD1 ASP A 34 7.919 15.782 1.034 1.00 0.00 O ATOM 537 OD2 ASP A 34 8.997 14.183 2.081 1.00 0.00 O ATOM 0 H ASP A 34 6.105 14.664 -0.421 1.00 0.00 H new ATOM 0 HA ASP A 34 7.669 12.350 -1.363 1.00 0.00 H new ATOM 0 HB2 ASP A 34 9.523 13.309 -0.231 1.00 0.00 H new ATOM 0 HB3 ASP A 34 8.748 14.635 -1.074 1.00 0.00 H new ATOM 542 N ILE A 35 5.866 12.388 1.178 1.00 0.00 N ATOM 543 CA ILE A 35 5.429 11.725 2.378 1.00 0.00 C ATOM 544 C ILE A 35 5.029 10.279 2.116 1.00 0.00 C ATOM 545 O ILE A 35 4.388 9.959 1.114 1.00 0.00 O ATOM 546 CB ILE A 35 4.260 12.497 3.024 1.00 0.00 C ATOM 547 CG1 ILE A 35 4.787 13.724 3.761 1.00 0.00 C ATOM 548 CG2 ILE A 35 3.453 11.622 3.946 1.00 0.00 C ATOM 549 CD1 ILE A 35 5.218 14.848 2.862 1.00 0.00 C ATOM 0 H ILE A 35 5.162 12.994 0.756 1.00 0.00 H new ATOM 0 HA ILE A 35 6.272 11.711 3.069 1.00 0.00 H new ATOM 0 HB ILE A 35 3.592 12.823 2.227 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.012 14.090 4.434 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.632 13.426 4.381 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.640 12.204 4.380 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.040 10.784 3.384 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.094 11.244 4.742 1.00 0.00 H new ATOM 0 HD11 ILE A 35 5.579 15.680 3.467 1.00 0.00 H new ATOM 0 HD12 ILE A 35 6.017 14.503 2.206 1.00 0.00 H new ATOM 0 HD13 ILE A 35 4.371 15.178 2.260 1.00 0.00 H new ATOM 561 N LYS A 36 5.443 9.418 3.028 1.00 0.00 N ATOM 562 CA LYS A 36 5.081 8.013 2.992 1.00 0.00 C ATOM 563 C LYS A 36 4.579 7.596 4.357 1.00 0.00 C ATOM 564 O LYS A 36 3.391 7.678 4.654 1.00 0.00 O ATOM 565 CB LYS A 36 6.264 7.116 2.604 1.00 0.00 C ATOM 566 CG LYS A 36 7.347 7.786 1.777 1.00 0.00 C ATOM 567 CD LYS A 36 8.360 8.490 2.658 1.00 0.00 C ATOM 568 CE LYS A 36 9.536 9.005 1.852 1.00 0.00 C ATOM 569 NZ LYS A 36 10.563 9.627 2.722 1.00 0.00 N ATOM 0 H LYS A 36 6.040 9.673 3.815 1.00 0.00 H new ATOM 0 HA LYS A 36 4.307 7.892 2.234 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.716 6.726 3.516 1.00 0.00 H new ATOM 0 HB3 LYS A 36 5.882 6.261 2.046 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.852 7.040 1.164 1.00 0.00 H new ATOM 0 HG3 LYS A 36 6.893 8.505 1.095 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.879 9.321 3.174 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.717 7.802 3.425 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.982 8.183 1.292 1.00 0.00 H new ATOM 0 HE3 LYS A 36 9.186 9.735 1.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 11.353 9.968 2.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 10.143 10.427 3.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.915 8.923 3.402 1.00 0.00 H new ATOM 583 N GLY A 37 5.515 7.201 5.191 1.00 0.00 N ATOM 584 CA GLY A 37 5.199 6.742 6.527 1.00 0.00 C ATOM 585 C GLY A 37 5.825 5.395 6.811 1.00 0.00 C ATOM 586 O GLY A 37 6.576 4.867 5.984 1.00 0.00 O ATOM 0 H GLY A 37 6.510 7.188 4.966 1.00 0.00 H new ATOM 0 HA2 GLY A 37 5.553 7.470 7.257 1.00 0.00 H new ATOM 0 HA3 GLY A 37 4.117 6.674 6.643 1.00 0.00 H new ATOM 590 N VAL A 38 5.515 4.825 7.964 1.00 0.00 N ATOM 591 CA VAL A 38 6.063 3.532 8.336 1.00 0.00 C ATOM 592 C VAL A 38 5.015 2.439 8.177 1.00 0.00 C ATOM 593 O VAL A 38 3.882 2.581 8.636 1.00 0.00 O ATOM 594 CB VAL A 38 6.586 3.534 9.784 1.00 0.00 C ATOM 595 CG1 VAL A 38 7.241 2.207 10.131 1.00 0.00 C ATOM 596 CG2 VAL A 38 7.560 4.674 9.953 1.00 0.00 C ATOM 0 H VAL A 38 4.889 5.236 8.656 1.00 0.00 H new ATOM 0 HA VAL A 38 6.900 3.332 7.667 1.00 0.00 H new ATOM 0 HB VAL A 38 5.747 3.669 10.467 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.601 2.237 11.159 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.513 1.403 10.025 1.00 0.00 H new ATOM 0 HG13 VAL A 38 8.080 2.028 9.458 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.936 4.683 10.976 1.00 0.00 H new ATOM 0 HG22 VAL A 38 8.393 4.546 9.262 1.00 0.00 H new ATOM 0 HG23 VAL A 38 7.056 5.617 9.743 1.00 0.00 H new ATOM 606 N SER A 39 5.398 1.363 7.510 1.00 0.00 N ATOM 607 CA SER A 39 4.511 0.232 7.287 1.00 0.00 C ATOM 608 C SER A 39 5.051 -0.999 8.005 1.00 0.00 C ATOM 609 O SER A 39 6.248 -1.121 8.213 1.00 0.00 O ATOM 610 CB SER A 39 4.365 -0.042 5.796 1.00 0.00 C ATOM 611 OG SER A 39 4.143 1.161 5.079 1.00 0.00 O ATOM 0 H SER A 39 6.329 1.248 7.109 1.00 0.00 H new ATOM 0 HA SER A 39 3.526 0.470 7.689 1.00 0.00 H new ATOM 0 HB2 SER A 39 5.264 -0.532 5.423 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.535 -0.728 5.628 1.00 0.00 H new ATOM 0 HG SER A 39 3.943 0.952 4.143 1.00 0.00 H new ATOM 617 N GLU A 40 4.171 -1.876 8.433 1.00 0.00 N ATOM 618 CA GLU A 40 4.583 -3.100 9.093 1.00 0.00 C ATOM 619 C GLU A 40 3.902 -4.291 8.449 1.00 0.00 C ATOM 620 O GLU A 40 2.703 -4.247 8.163 1.00 0.00 O ATOM 621 CB GLU A 40 4.242 -3.043 10.578 1.00 0.00 C ATOM 622 CG GLU A 40 4.853 -4.175 11.382 1.00 0.00 C ATOM 623 CD GLU A 40 4.320 -4.214 12.797 1.00 0.00 C ATOM 624 OE1 GLU A 40 4.904 -3.544 13.673 1.00 0.00 O ATOM 625 OE2 GLU A 40 3.303 -4.895 13.040 1.00 0.00 O ATOM 0 H GLU A 40 3.162 -1.766 8.337 1.00 0.00 H new ATOM 0 HA GLU A 40 5.662 -3.208 8.987 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.585 -2.092 10.985 1.00 0.00 H new ATOM 0 HB3 GLU A 40 3.159 -3.068 10.695 1.00 0.00 H new ATOM 0 HG2 GLU A 40 4.644 -5.124 10.889 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.937 -4.060 11.405 1.00 0.00 H new ATOM 632 N ILE A 41 4.671 -5.345 8.225 1.00 0.00 N ATOM 633 CA ILE A 41 4.186 -6.516 7.519 1.00 0.00 C ATOM 634 C ILE A 41 4.376 -7.766 8.362 1.00 0.00 C ATOM 635 O ILE A 41 5.500 -8.169 8.620 1.00 0.00 O ATOM 636 CB ILE A 41 4.961 -6.714 6.200 1.00 0.00 C ATOM 637 CG1 ILE A 41 5.098 -5.389 5.458 1.00 0.00 C ATOM 638 CG2 ILE A 41 4.280 -7.750 5.325 1.00 0.00 C ATOM 639 CD1 ILE A 41 3.776 -4.828 4.999 1.00 0.00 C ATOM 0 H ILE A 41 5.643 -5.411 8.526 1.00 0.00 H new ATOM 0 HA ILE A 41 3.127 -6.358 7.314 1.00 0.00 H new ATOM 0 HB ILE A 41 5.959 -7.079 6.441 1.00 0.00 H new ATOM 0 HG12 ILE A 41 5.587 -4.664 6.109 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.746 -5.529 4.593 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.844 -7.873 4.400 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.238 -8.702 5.854 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.268 -7.420 5.091 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.942 -3.885 4.478 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.295 -5.536 4.324 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.134 -4.657 5.863 1.00 0.00 H new ATOM 651 N VAL A 42 3.291 -8.388 8.770 1.00 0.00 N ATOM 652 CA VAL A 42 3.361 -9.652 9.489 1.00 0.00 C ATOM 653 C VAL A 42 2.549 -10.676 8.721 1.00 0.00 C ATOM 654 O VAL A 42 1.482 -10.367 8.257 1.00 0.00 O ATOM 655 CB VAL A 42 2.787 -9.533 10.912 1.00 0.00 C ATOM 656 CG1 VAL A 42 3.274 -10.685 11.775 1.00 0.00 C ATOM 657 CG2 VAL A 42 3.136 -8.193 11.537 1.00 0.00 C ATOM 0 H VAL A 42 2.344 -8.041 8.618 1.00 0.00 H new ATOM 0 HA VAL A 42 4.407 -9.947 9.572 1.00 0.00 H new ATOM 0 HB VAL A 42 1.700 -9.588 10.848 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.860 -10.588 12.779 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.949 -11.629 11.338 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.363 -10.665 11.828 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.716 -8.140 12.542 1.00 0.00 H new ATOM 0 HG22 VAL A 42 4.220 -8.088 11.590 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.723 -7.389 10.928 1.00 0.00 H new ATOM 667 N HIS A 43 3.026 -11.881 8.567 1.00 0.00 N ATOM 668 CA HIS A 43 2.294 -12.838 7.738 1.00 0.00 C ATOM 669 C HIS A 43 1.901 -14.085 8.523 1.00 0.00 C ATOM 670 O HIS A 43 2.743 -14.769 9.094 1.00 0.00 O ATOM 671 CB HIS A 43 3.096 -13.153 6.460 1.00 0.00 C ATOM 672 CG HIS A 43 2.740 -14.441 5.765 1.00 0.00 C ATOM 673 ND1 HIS A 43 3.687 -15.358 5.361 1.00 0.00 N ATOM 674 CD2 HIS A 43 1.547 -14.947 5.373 1.00 0.00 C ATOM 675 CE1 HIS A 43 3.093 -16.364 4.755 1.00 0.00 C ATOM 676 NE2 HIS A 43 1.796 -16.141 4.747 1.00 0.00 N ATOM 0 H HIS A 43 3.889 -12.230 8.984 1.00 0.00 H new ATOM 0 HA HIS A 43 1.353 -12.385 7.427 1.00 0.00 H new ATOM 0 HB2 HIS A 43 2.959 -12.332 5.756 1.00 0.00 H new ATOM 0 HB3 HIS A 43 4.155 -13.181 6.716 1.00 0.00 H new ATOM 0 HD2 HIS A 43 0.579 -14.494 5.525 1.00 0.00 H new ATOM 0 HE1 HIS A 43 3.587 -17.228 4.335 1.00 0.00 H new ATOM 0 HE2 HIS A 43 1.091 -16.756 4.341 1.00 0.00 H new ATOM 685 N GLU A 44 0.595 -14.345 8.551 1.00 0.00 N ATOM 686 CA GLU A 44 0.029 -15.491 9.257 1.00 0.00 C ATOM 687 C GLU A 44 -0.745 -16.403 8.296 1.00 0.00 C ATOM 688 O GLU A 44 -1.812 -16.036 7.800 1.00 0.00 O ATOM 689 CB GLU A 44 -0.887 -15.007 10.384 1.00 0.00 C ATOM 690 CG GLU A 44 -1.788 -13.871 9.954 1.00 0.00 C ATOM 691 CD GLU A 44 -2.632 -13.306 11.079 1.00 0.00 C ATOM 692 OE1 GLU A 44 -3.751 -13.817 11.301 1.00 0.00 O ATOM 693 OE2 GLU A 44 -2.200 -12.336 11.731 1.00 0.00 O ATOM 0 H GLU A 44 -0.101 -13.765 8.083 1.00 0.00 H new ATOM 0 HA GLU A 44 0.847 -16.071 9.684 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -1.499 -15.839 10.733 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -0.278 -14.683 11.228 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -1.176 -13.073 9.534 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -2.446 -14.221 9.158 1.00 0.00 H new ATOM 700 N GLY A 45 -0.201 -17.586 8.028 1.00 0.00 N ATOM 701 CA GLY A 45 -0.852 -18.520 7.120 1.00 0.00 C ATOM 702 C GLY A 45 -0.914 -17.998 5.697 1.00 0.00 C ATOM 703 O GLY A 45 0.075 -18.034 4.968 1.00 0.00 O ATOM 0 H GLY A 45 0.680 -17.917 8.422 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -0.315 -19.468 7.133 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.863 -18.721 7.474 1.00 0.00 H new ATOM 707 N LYS A 46 -2.085 -17.536 5.295 1.00 0.00 N ATOM 708 CA LYS A 46 -2.251 -16.839 4.028 1.00 0.00 C ATOM 709 C LYS A 46 -2.314 -15.350 4.252 1.00 0.00 C ATOM 710 O LYS A 46 -1.720 -14.569 3.520 1.00 0.00 O ATOM 711 CB LYS A 46 -3.516 -17.275 3.327 1.00 0.00 C ATOM 712 CG LYS A 46 -3.269 -18.284 2.224 1.00 0.00 C ATOM 713 CD LYS A 46 -3.131 -19.697 2.770 1.00 0.00 C ATOM 714 CE LYS A 46 -4.463 -20.242 3.258 1.00 0.00 C ATOM 715 NZ LYS A 46 -5.427 -20.462 2.143 1.00 0.00 N ATOM 0 H LYS A 46 -2.946 -17.632 5.834 1.00 0.00 H new ATOM 0 HA LYS A 46 -1.392 -17.087 3.405 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -4.199 -17.706 4.059 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -4.011 -16.400 2.906 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.091 -18.249 1.509 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -2.363 -18.014 1.681 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -2.733 -20.350 1.994 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.413 -19.702 3.590 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -4.298 -21.183 3.783 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -4.896 -19.547 3.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -6.219 -21.046 2.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -5.789 -19.545 1.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -4.946 -20.949 1.360 1.00 0.00 H new ATOM 729 N LYS A 47 -3.019 -14.968 5.289 1.00 0.00 N ATOM 730 CA LYS A 47 -3.276 -13.571 5.546 1.00 0.00 C ATOM 731 C LYS A 47 -2.022 -12.875 6.024 1.00 0.00 C ATOM 732 O LYS A 47 -1.289 -13.375 6.871 1.00 0.00 O ATOM 733 CB LYS A 47 -4.357 -13.410 6.605 1.00 0.00 C ATOM 734 CG LYS A 47 -5.410 -14.496 6.564 1.00 0.00 C ATOM 735 CD LYS A 47 -6.593 -14.165 7.447 1.00 0.00 C ATOM 736 CE LYS A 47 -6.250 -14.230 8.934 1.00 0.00 C ATOM 737 NZ LYS A 47 -5.508 -13.032 9.416 1.00 0.00 N ATOM 0 H LYS A 47 -3.427 -15.607 5.971 1.00 0.00 H new ATOM 0 HA LYS A 47 -3.609 -13.121 4.611 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -3.891 -13.404 7.590 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.840 -12.442 6.475 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -5.750 -14.634 5.538 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.971 -15.441 6.884 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -6.955 -13.166 7.204 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -7.406 -14.859 7.234 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -7.170 -14.335 9.509 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -5.652 -15.121 9.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -4.577 -13.322 9.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -5.381 -12.363 8.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.047 -12.573 10.178 1.00 0.00 H new ATOM 751 N VAL A 48 -1.774 -11.727 5.453 1.00 0.00 N ATOM 752 CA VAL A 48 -0.646 -10.925 5.837 1.00 0.00 C ATOM 753 C VAL A 48 -1.149 -9.612 6.412 1.00 0.00 C ATOM 754 O VAL A 48 -2.051 -8.985 5.856 1.00 0.00 O ATOM 755 CB VAL A 48 0.298 -10.673 4.644 1.00 0.00 C ATOM 756 CG1 VAL A 48 1.486 -9.825 5.056 1.00 0.00 C ATOM 757 CG2 VAL A 48 0.765 -11.985 4.040 1.00 0.00 C ATOM 0 H VAL A 48 -2.346 -11.323 4.711 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.071 -11.460 6.593 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.262 -10.125 3.887 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.134 -9.664 4.195 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.134 -8.864 5.431 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.045 -10.337 5.839 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.430 -11.783 3.200 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.299 -12.563 4.794 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.098 -12.553 3.691 1.00 0.00 H new ATOM 767 N LYS A 49 -0.576 -9.221 7.527 1.00 0.00 N ATOM 768 CA LYS A 49 -0.991 -8.027 8.229 1.00 0.00 C ATOM 769 C LYS A 49 -0.245 -6.831 7.683 1.00 0.00 C ATOM 770 O LYS A 49 0.982 -6.762 7.768 1.00 0.00 O ATOM 771 CB LYS A 49 -0.698 -8.157 9.719 1.00 0.00 C ATOM 772 CG LYS A 49 -0.883 -9.565 10.264 1.00 0.00 C ATOM 773 CD LYS A 49 -0.421 -9.668 11.707 1.00 0.00 C ATOM 774 CE LYS A 49 -1.444 -9.105 12.681 1.00 0.00 C ATOM 775 NZ LYS A 49 -2.731 -9.846 12.616 1.00 0.00 N ATOM 0 H LYS A 49 0.192 -9.722 7.974 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.063 -7.895 8.085 1.00 0.00 H new ATOM 0 HB2 LYS A 49 0.327 -7.837 9.907 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.350 -7.477 10.268 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.934 -9.847 10.196 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.323 -10.270 9.650 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.227 -10.713 11.951 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.522 -9.133 11.824 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.047 -9.154 13.695 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.618 -8.052 12.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.463 -9.234 12.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.614 -10.694 12.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -3.017 -10.130 13.575 1.00 0.00 H new ATOM 789 N LEU A 50 -0.987 -5.904 7.110 1.00 0.00 N ATOM 790 CA LEU A 50 -0.403 -4.682 6.596 1.00 0.00 C ATOM 791 C LEU A 50 -0.842 -3.502 7.437 1.00 0.00 C ATOM 792 O LEU A 50 -2.017 -3.126 7.454 1.00 0.00 O ATOM 793 CB LEU A 50 -0.774 -4.460 5.127 1.00 0.00 C ATOM 794 CG LEU A 50 0.285 -4.883 4.099 1.00 0.00 C ATOM 795 CD1 LEU A 50 0.574 -6.374 4.168 1.00 0.00 C ATOM 796 CD2 LEU A 50 -0.152 -4.492 2.696 1.00 0.00 C ATOM 0 H LEU A 50 -1.997 -5.974 6.989 1.00 0.00 H new ATOM 0 HA LEU A 50 0.681 -4.776 6.653 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.694 -5.005 4.918 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -0.991 -3.402 4.983 1.00 0.00 H new ATOM 0 HG LEU A 50 1.208 -4.357 4.343 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.328 -6.633 3.425 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.942 -6.628 5.162 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.341 -6.932 3.966 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.609 -4.799 1.979 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.094 -4.985 2.458 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.285 -3.411 2.644 1.00 0.00 H new ATOM 808 N THR A 51 0.101 -2.949 8.165 1.00 0.00 N ATOM 809 CA THR A 51 -0.130 -1.740 8.917 1.00 0.00 C ATOM 810 C THR A 51 0.661 -0.615 8.276 1.00 0.00 C ATOM 811 O THR A 51 1.883 -0.650 8.270 1.00 0.00 O ATOM 812 CB THR A 51 0.307 -1.910 10.380 1.00 0.00 C ATOM 813 OG1 THR A 51 -0.217 -3.139 10.900 1.00 0.00 O ATOM 814 CG2 THR A 51 -0.182 -0.746 11.214 1.00 0.00 C ATOM 0 H THR A 51 1.046 -3.324 8.252 1.00 0.00 H new ATOM 0 HA THR A 51 -1.196 -1.511 8.908 1.00 0.00 H new ATOM 0 HB THR A 51 1.396 -1.935 10.423 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.064 -3.246 11.833 1.00 0.00 H new ATOM 0 HG21 THR A 51 0.135 -0.881 12.248 1.00 0.00 H new ATOM 0 HG22 THR A 51 0.236 0.182 10.824 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.270 -0.700 11.172 1.00 0.00 H new ATOM 822 N ILE A 52 -0.019 0.374 7.732 1.00 0.00 N ATOM 823 CA ILE A 52 0.667 1.392 6.954 1.00 0.00 C ATOM 824 C ILE A 52 0.314 2.792 7.434 1.00 0.00 C ATOM 825 O ILE A 52 -0.854 3.185 7.436 1.00 0.00 O ATOM 826 CB ILE A 52 0.335 1.303 5.442 1.00 0.00 C ATOM 827 CG1 ILE A 52 0.460 -0.133 4.916 1.00 0.00 C ATOM 828 CG2 ILE A 52 1.244 2.232 4.652 1.00 0.00 C ATOM 829 CD1 ILE A 52 -0.829 -0.915 5.001 1.00 0.00 C ATOM 0 H ILE A 52 -1.029 0.496 7.810 1.00 0.00 H new ATOM 0 HA ILE A 52 1.731 1.204 7.098 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.702 1.614 5.311 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.792 -0.105 3.878 1.00 0.00 H new ATOM 0 HG13 ILE A 52 1.231 -0.654 5.483 1.00 0.00 H new ATOM 0 HG21 ILE A 52 1.003 2.162 3.591 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.098 3.258 4.990 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.283 1.943 4.807 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.670 -1.921 4.613 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -1.151 -0.974 6.041 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.597 -0.415 4.411 1.00 0.00 H new ATOM 841 N THR A 53 1.325 3.537 7.835 1.00 0.00 N ATOM 842 CA THR A 53 1.153 4.938 8.165 1.00 0.00 C ATOM 843 C THR A 53 1.319 5.772 6.902 1.00 0.00 C ATOM 844 O THR A 53 2.316 5.632 6.199 1.00 0.00 O ATOM 845 CB THR A 53 2.200 5.402 9.195 1.00 0.00 C ATOM 846 OG1 THR A 53 2.344 4.416 10.229 1.00 0.00 O ATOM 847 CG2 THR A 53 1.799 6.737 9.810 1.00 0.00 C ATOM 0 H THR A 53 2.279 3.193 7.941 1.00 0.00 H new ATOM 0 HA THR A 53 0.158 5.067 8.591 1.00 0.00 H new ATOM 0 HB THR A 53 3.153 5.528 8.681 1.00 0.00 H new ATOM 0 HG1 THR A 53 2.849 3.651 9.883 1.00 0.00 H new ATOM 0 HG21 THR A 53 2.553 7.045 10.534 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.720 7.490 9.026 1.00 0.00 H new ATOM 0 HG23 THR A 53 0.836 6.633 10.311 1.00 0.00 H new ATOM 855 N TYR A 54 0.337 6.601 6.593 1.00 0.00 N ATOM 856 CA TYR A 54 0.464 7.546 5.497 1.00 0.00 C ATOM 857 C TYR A 54 0.550 8.951 6.059 1.00 0.00 C ATOM 858 O TYR A 54 -0.475 9.581 6.335 1.00 0.00 O ATOM 859 CB TYR A 54 -0.728 7.448 4.540 1.00 0.00 C ATOM 860 CG TYR A 54 -0.846 6.124 3.820 1.00 0.00 C ATOM 861 CD1 TYR A 54 -1.569 5.075 4.370 1.00 0.00 C ATOM 862 CD2 TYR A 54 -0.245 5.930 2.584 1.00 0.00 C ATOM 863 CE1 TYR A 54 -1.688 3.868 3.710 1.00 0.00 C ATOM 864 CE2 TYR A 54 -0.357 4.726 1.917 1.00 0.00 C ATOM 865 CZ TYR A 54 -1.080 3.697 2.483 1.00 0.00 C ATOM 866 OH TYR A 54 -1.194 2.493 1.822 1.00 0.00 O ATOM 0 H TYR A 54 -0.556 6.639 7.085 1.00 0.00 H new ATOM 0 HA TYR A 54 1.369 7.308 4.937 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.645 7.624 5.102 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.650 8.244 3.800 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -2.046 5.205 5.330 1.00 0.00 H new ATOM 0 HD2 TYR A 54 0.320 6.734 2.136 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -2.254 3.062 4.152 1.00 0.00 H new ATOM 0 HE2 TYR A 54 0.119 4.591 0.957 1.00 0.00 H new ATOM 0 HH TYR A 54 -1.477 2.653 0.898 1.00 0.00 H new ATOM 876 N GLY A 55 1.775 9.443 6.196 1.00 0.00 N ATOM 877 CA GLY A 55 2.010 10.765 6.754 1.00 0.00 C ATOM 878 C GLY A 55 1.663 10.854 8.232 1.00 0.00 C ATOM 879 O GLY A 55 2.532 11.105 9.064 1.00 0.00 O ATOM 0 H GLY A 55 2.622 8.943 5.927 1.00 0.00 H new ATOM 0 HA2 GLY A 55 3.058 11.031 6.615 1.00 0.00 H new ATOM 0 HA3 GLY A 55 1.420 11.497 6.203 1.00 0.00 H new ATOM 883 N SER A 56 0.396 10.637 8.551 1.00 0.00 N ATOM 884 CA SER A 56 -0.088 10.727 9.923 1.00 0.00 C ATOM 885 C SER A 56 -1.178 9.687 10.230 1.00 0.00 C ATOM 886 O SER A 56 -1.272 9.201 11.357 1.00 0.00 O ATOM 887 CB SER A 56 -0.601 12.141 10.195 1.00 0.00 C ATOM 888 OG SER A 56 -1.312 12.645 9.077 1.00 0.00 O ATOM 0 H SER A 56 -0.324 10.394 7.870 1.00 0.00 H new ATOM 0 HA SER A 56 0.749 10.507 10.585 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.250 12.135 11.071 1.00 0.00 H new ATOM 0 HB3 SER A 56 0.238 12.799 10.424 1.00 0.00 H new ATOM 0 HG SER A 56 -1.632 13.550 9.274 1.00 0.00 H new ATOM 894 N LYS A 57 -2.008 9.348 9.241 1.00 0.00 N ATOM 895 CA LYS A 57 -3.030 8.338 9.425 1.00 0.00 C ATOM 896 C LYS A 57 -2.449 6.952 9.202 1.00 0.00 C ATOM 897 O LYS A 57 -1.493 6.787 8.456 1.00 0.00 O ATOM 898 CB LYS A 57 -4.152 8.565 8.431 1.00 0.00 C ATOM 899 CG LYS A 57 -5.477 7.984 8.860 1.00 0.00 C ATOM 900 CD LYS A 57 -5.893 8.494 10.223 1.00 0.00 C ATOM 901 CE LYS A 57 -6.116 9.997 10.219 1.00 0.00 C ATOM 902 NZ LYS A 57 -6.248 10.540 11.595 1.00 0.00 N ATOM 0 H LYS A 57 -1.986 9.762 8.309 1.00 0.00 H new ATOM 0 HA LYS A 57 -3.411 8.410 10.444 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.271 9.637 8.271 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -3.869 8.129 7.473 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -6.242 8.239 8.126 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -5.408 6.896 8.883 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -6.808 7.992 10.535 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -5.126 8.242 10.955 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -5.283 10.486 9.714 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -7.016 10.229 9.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -6.399 11.568 11.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -7.058 10.092 12.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -5.380 10.341 12.132 1.00 0.00 H new ATOM 916 N VAL A 58 -3.040 5.965 9.840 1.00 0.00 N ATOM 917 CA VAL A 58 -2.568 4.593 9.735 1.00 0.00 C ATOM 918 C VAL A 58 -3.687 3.670 9.275 1.00 0.00 C ATOM 919 O VAL A 58 -4.718 3.543 9.939 1.00 0.00 O ATOM 920 CB VAL A 58 -2.001 4.081 11.075 1.00 0.00 C ATOM 921 CG1 VAL A 58 -1.532 2.652 10.927 1.00 0.00 C ATOM 922 CG2 VAL A 58 -0.859 4.966 11.551 1.00 0.00 C ATOM 0 H VAL A 58 -3.855 6.084 10.442 1.00 0.00 H new ATOM 0 HA VAL A 58 -1.767 4.588 8.996 1.00 0.00 H new ATOM 0 HB VAL A 58 -2.794 4.117 11.822 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.133 2.300 11.878 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -2.371 2.023 10.630 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.753 2.602 10.166 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.475 4.586 12.498 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -0.062 4.962 10.808 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -1.221 5.985 11.689 1.00 0.00 H new ATOM 932 N ILE A 59 -3.489 3.039 8.131 1.00 0.00 N ATOM 933 CA ILE A 59 -4.434 2.059 7.631 1.00 0.00 C ATOM 934 C ILE A 59 -3.930 0.659 7.956 1.00 0.00 C ATOM 935 O ILE A 59 -2.824 0.279 7.564 1.00 0.00 O ATOM 936 CB ILE A 59 -4.649 2.200 6.108 1.00 0.00 C ATOM 937 CG1 ILE A 59 -5.138 3.606 5.777 1.00 0.00 C ATOM 938 CG2 ILE A 59 -5.655 1.192 5.617 1.00 0.00 C ATOM 939 CD1 ILE A 59 -5.237 3.886 4.293 1.00 0.00 C ATOM 0 H ILE A 59 -2.679 3.189 7.530 1.00 0.00 H new ATOM 0 HA ILE A 59 -5.394 2.232 8.118 1.00 0.00 H new ATOM 0 HB ILE A 59 -3.696 2.019 5.611 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -6.117 3.756 6.231 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -4.462 4.331 6.230 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -5.792 1.308 4.542 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.295 0.185 5.830 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -6.607 1.352 6.123 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -5.591 4.905 4.138 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -4.255 3.770 3.834 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -5.936 3.185 3.836 1.00 0.00 H new ATOM 951 N HIS A 60 -4.722 -0.088 8.701 1.00 0.00 N ATOM 952 CA HIS A 60 -4.328 -1.423 9.130 1.00 0.00 C ATOM 953 C HIS A 60 -5.321 -2.456 8.609 1.00 0.00 C ATOM 954 O HIS A 60 -6.501 -2.414 8.951 1.00 0.00 O ATOM 955 CB HIS A 60 -4.248 -1.465 10.664 1.00 0.00 C ATOM 956 CG HIS A 60 -3.716 -2.748 11.238 1.00 0.00 C ATOM 957 ND1 HIS A 60 -3.153 -2.832 12.490 1.00 0.00 N ATOM 958 CD2 HIS A 60 -3.688 -4.004 10.738 1.00 0.00 C ATOM 959 CE1 HIS A 60 -2.815 -4.082 12.736 1.00 0.00 C ATOM 960 NE2 HIS A 60 -3.131 -4.818 11.687 1.00 0.00 N ATOM 0 H HIS A 60 -5.644 0.204 9.024 1.00 0.00 H new ATOM 0 HA HIS A 60 -3.346 -1.662 8.721 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -3.616 -0.644 11.002 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -5.244 -1.289 11.070 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -4.042 -4.310 9.765 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -2.356 -4.444 13.644 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -2.985 -5.824 11.598 1.00 0.00 H new ATOM 969 N ASN A 61 -4.838 -3.385 7.792 1.00 0.00 N ATOM 970 CA ASN A 61 -5.675 -4.460 7.273 1.00 0.00 C ATOM 971 C ASN A 61 -4.851 -5.715 7.072 1.00 0.00 C ATOM 972 O ASN A 61 -3.716 -5.648 6.602 1.00 0.00 O ATOM 973 CB ASN A 61 -6.316 -4.083 5.929 1.00 0.00 C ATOM 974 CG ASN A 61 -7.416 -3.045 6.046 1.00 0.00 C ATOM 975 OD1 ASN A 61 -8.580 -3.380 6.273 1.00 0.00 O ATOM 976 ND2 ASN A 61 -7.066 -1.783 5.856 1.00 0.00 N ATOM 0 H ASN A 61 -3.869 -3.415 7.474 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.463 -4.633 8.006 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.542 -3.705 5.261 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.725 -4.982 5.467 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -7.771 -1.047 5.895 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.091 -1.546 5.671 1.00 0.00 H new ATOM 983 N GLU A 62 -5.400 -6.853 7.446 1.00 0.00 N ATOM 984 CA GLU A 62 -4.822 -8.117 7.047 1.00 0.00 C ATOM 985 C GLU A 62 -5.595 -8.657 5.862 1.00 0.00 C ATOM 986 O GLU A 62 -6.826 -8.643 5.861 1.00 0.00 O ATOM 987 CB GLU A 62 -4.843 -9.158 8.165 1.00 0.00 C ATOM 988 CG GLU A 62 -4.059 -8.782 9.407 1.00 0.00 C ATOM 989 CD GLU A 62 -4.833 -7.923 10.374 1.00 0.00 C ATOM 990 OE1 GLU A 62 -6.065 -8.080 10.457 1.00 0.00 O ATOM 991 OE2 GLU A 62 -4.200 -7.109 11.072 1.00 0.00 O ATOM 0 H GLU A 62 -6.239 -6.927 8.021 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.778 -7.932 6.793 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.879 -9.342 8.450 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.448 -10.096 7.775 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.743 -9.693 9.916 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.154 -8.253 9.109 1.00 0.00 H new ATOM 998 N PHE A 63 -4.887 -9.132 4.861 1.00 0.00 N ATOM 999 CA PHE A 63 -5.538 -9.717 3.710 1.00 0.00 C ATOM 1000 C PHE A 63 -5.131 -11.162 3.567 1.00 0.00 C ATOM 1001 O PHE A 63 -3.980 -11.516 3.806 1.00 0.00 O ATOM 1002 CB PHE A 63 -5.270 -8.927 2.415 1.00 0.00 C ATOM 1003 CG PHE A 63 -3.834 -8.540 2.120 1.00 0.00 C ATOM 1004 CD1 PHE A 63 -2.770 -9.179 2.719 1.00 0.00 C ATOM 1005 CD2 PHE A 63 -3.570 -7.500 1.245 1.00 0.00 C ATOM 1006 CE1 PHE A 63 -1.464 -8.790 2.459 1.00 0.00 C ATOM 1007 CE2 PHE A 63 -2.274 -7.112 0.972 1.00 0.00 C ATOM 1008 CZ PHE A 63 -1.220 -7.756 1.581 1.00 0.00 C ATOM 0 H PHE A 63 -3.868 -9.125 4.820 1.00 0.00 H new ATOM 0 HA PHE A 63 -6.614 -9.668 3.878 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -5.639 -9.518 1.577 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.865 -8.014 2.447 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.956 -9.995 3.401 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -4.391 -6.984 0.769 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.641 -9.296 2.943 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -2.086 -6.304 0.281 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.205 -7.452 1.371 1.00 0.00 H new ATOM 1018 N THR A 64 -6.067 -11.992 3.166 1.00 0.00 N ATOM 1019 CA THR A 64 -5.815 -13.408 3.074 1.00 0.00 C ATOM 1020 C THR A 64 -5.323 -13.725 1.672 1.00 0.00 C ATOM 1021 O THR A 64 -5.955 -13.357 0.686 1.00 0.00 O ATOM 1022 CB THR A 64 -7.090 -14.208 3.348 1.00 0.00 C ATOM 1023 OG1 THR A 64 -7.790 -13.657 4.473 1.00 0.00 O ATOM 1024 CG2 THR A 64 -6.763 -15.665 3.613 1.00 0.00 C ATOM 0 H THR A 64 -7.010 -11.709 2.899 1.00 0.00 H new ATOM 0 HA THR A 64 -5.067 -13.682 3.817 1.00 0.00 H new ATOM 0 HB THR A 64 -7.726 -14.147 2.465 1.00 0.00 H new ATOM 0 HG1 THR A 64 -8.605 -14.176 4.638 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.684 -16.215 3.805 1.00 0.00 H new ATOM 0 HG22 THR A 64 -6.262 -16.089 2.743 1.00 0.00 H new ATOM 0 HG23 THR A 64 -6.108 -15.739 4.481 1.00 0.00 H new ATOM 1032 N LEU A 65 -4.188 -14.389 1.594 1.00 0.00 N ATOM 1033 CA LEU A 65 -3.511 -14.607 0.337 1.00 0.00 C ATOM 1034 C LEU A 65 -4.352 -15.411 -0.651 1.00 0.00 C ATOM 1035 O LEU A 65 -4.660 -16.578 -0.411 1.00 0.00 O ATOM 1036 CB LEU A 65 -2.238 -15.363 0.587 1.00 0.00 C ATOM 1037 CG LEU A 65 -0.973 -14.520 0.640 1.00 0.00 C ATOM 1038 CD1 LEU A 65 -0.137 -14.857 -0.553 1.00 0.00 C ATOM 1039 CD2 LEU A 65 -1.299 -13.027 0.656 1.00 0.00 C ATOM 0 H LEU A 65 -3.711 -14.792 2.401 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.319 -13.626 -0.098 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -2.335 -15.900 1.530 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -2.121 -16.112 -0.196 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.430 -14.741 1.559 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.777 -14.263 -0.536 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.118 -15.917 -0.531 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.696 -14.637 -1.463 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.373 -12.453 0.694 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.851 -12.765 -0.247 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.905 -12.796 1.532 1.00 0.00 H new ATOM 1051 N GLY A 66 -4.707 -14.773 -1.752 1.00 0.00 N ATOM 1052 CA GLY A 66 -5.480 -15.406 -2.808 1.00 0.00 C ATOM 1053 C GLY A 66 -6.854 -15.760 -2.333 1.00 0.00 C ATOM 1054 O GLY A 66 -7.510 -16.659 -2.861 1.00 0.00 O ATOM 0 H GLY A 66 -4.467 -13.800 -1.940 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.550 -14.735 -3.664 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.967 -16.305 -3.149 1.00 0.00 H new ATOM 1058 N GLU A 67 -7.278 -15.038 -1.323 1.00 0.00 N ATOM 1059 CA GLU A 67 -8.547 -15.265 -0.706 1.00 0.00 C ATOM 1060 C GLU A 67 -9.242 -13.916 -0.519 1.00 0.00 C ATOM 1061 O GLU A 67 -8.579 -12.911 -0.260 1.00 0.00 O ATOM 1062 CB GLU A 67 -8.331 -15.984 0.629 1.00 0.00 C ATOM 1063 CG GLU A 67 -9.600 -16.488 1.291 1.00 0.00 C ATOM 1064 CD GLU A 67 -10.327 -17.505 0.440 1.00 0.00 C ATOM 1065 OE1 GLU A 67 -9.998 -18.709 0.534 1.00 0.00 O ATOM 1066 OE2 GLU A 67 -11.218 -17.108 -0.337 1.00 0.00 O ATOM 0 H GLU A 67 -6.743 -14.274 -0.910 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.182 -15.897 -1.327 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.662 -16.829 0.467 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.825 -15.304 1.315 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.352 -16.934 2.254 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -10.262 -15.645 1.491 1.00 0.00 H new ATOM 1073 N GLU A 68 -10.557 -13.871 -0.676 1.00 0.00 N ATOM 1074 CA GLU A 68 -11.262 -12.597 -0.631 1.00 0.00 C ATOM 1075 C GLU A 68 -11.297 -12.032 0.786 1.00 0.00 C ATOM 1076 O GLU A 68 -11.777 -12.674 1.721 1.00 0.00 O ATOM 1077 CB GLU A 68 -12.673 -12.722 -1.171 1.00 0.00 C ATOM 1078 CG GLU A 68 -13.345 -11.379 -1.334 1.00 0.00 C ATOM 1079 CD GLU A 68 -14.716 -11.477 -1.963 1.00 0.00 C ATOM 1080 OE1 GLU A 68 -15.563 -12.235 -1.448 1.00 0.00 O ATOM 1081 OE2 GLU A 68 -14.949 -10.797 -2.981 1.00 0.00 O ATOM 0 H GLU A 68 -11.150 -14.686 -0.833 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.709 -11.907 -1.268 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.647 -13.232 -2.134 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -13.264 -13.342 -0.497 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.432 -10.902 -0.358 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.715 -10.736 -1.948 1.00 0.00 H new ATOM 1088 N CYS A 69 -10.792 -10.816 0.911 1.00 0.00 N ATOM 1089 CA CYS A 69 -10.683 -10.118 2.177 1.00 0.00 C ATOM 1090 C CYS A 69 -11.383 -8.779 2.086 1.00 0.00 C ATOM 1091 O CYS A 69 -11.605 -8.264 1.006 1.00 0.00 O ATOM 1092 CB CYS A 69 -9.213 -9.903 2.522 1.00 0.00 C ATOM 1093 SG CYS A 69 -8.208 -9.402 1.106 1.00 0.00 S ATOM 0 H CYS A 69 -10.440 -10.278 0.119 1.00 0.00 H new ATOM 0 HA CYS A 69 -11.153 -10.718 2.957 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -9.138 -9.142 3.299 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.807 -10.825 2.938 1.00 0.00 H new ATOM 0 HG CYS A 69 -8.985 -9.071 0.118 1.00 0.00 H new ATOM 1099 N GLU A 70 -11.750 -8.222 3.208 1.00 0.00 N ATOM 1100 CA GLU A 70 -12.357 -6.912 3.209 1.00 0.00 C ATOM 1101 C GLU A 70 -11.332 -5.845 3.574 1.00 0.00 C ATOM 1102 O GLU A 70 -10.679 -5.921 4.616 1.00 0.00 O ATOM 1103 CB GLU A 70 -13.547 -6.881 4.147 1.00 0.00 C ATOM 1104 CG GLU A 70 -14.808 -7.396 3.507 1.00 0.00 C ATOM 1105 CD GLU A 70 -16.026 -7.280 4.395 1.00 0.00 C ATOM 1106 OE1 GLU A 70 -15.945 -7.660 5.580 1.00 0.00 O ATOM 1107 OE2 GLU A 70 -17.083 -6.833 3.897 1.00 0.00 O ATOM 0 H GLU A 70 -11.642 -8.648 4.129 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.718 -6.693 2.204 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.323 -7.479 5.030 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.709 -5.858 4.487 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.988 -6.846 2.583 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.666 -8.441 3.233 1.00 0.00 H new ATOM 1114 N LEU A 71 -11.205 -4.858 2.705 1.00 0.00 N ATOM 1115 CA LEU A 71 -10.203 -3.826 2.828 1.00 0.00 C ATOM 1116 C LEU A 71 -10.823 -2.533 3.333 1.00 0.00 C ATOM 1117 O LEU A 71 -11.747 -2.003 2.723 1.00 0.00 O ATOM 1118 CB LEU A 71 -9.594 -3.578 1.458 1.00 0.00 C ATOM 1119 CG LEU A 71 -8.088 -3.825 1.338 1.00 0.00 C ATOM 1120 CD1 LEU A 71 -7.321 -2.933 2.296 1.00 0.00 C ATOM 1121 CD2 LEU A 71 -7.765 -5.288 1.597 1.00 0.00 C ATOM 0 H LEU A 71 -11.804 -4.754 1.886 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.442 -4.150 3.538 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.105 -4.214 0.735 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.796 -2.545 1.174 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.781 -3.579 0.321 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.253 -3.124 2.195 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.526 -1.888 2.064 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.632 -3.145 3.319 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.690 -5.445 1.507 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.089 -5.560 2.602 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.284 -5.910 0.868 1.00 0.00 H new ATOM 1133 N GLU A 72 -10.300 -2.023 4.430 1.00 0.00 N ATOM 1134 CA GLU A 72 -10.798 -0.783 5.007 1.00 0.00 C ATOM 1135 C GLU A 72 -9.864 0.363 4.642 1.00 0.00 C ATOM 1136 O GLU A 72 -8.649 0.262 4.805 1.00 0.00 O ATOM 1137 CB GLU A 72 -10.911 -0.897 6.531 1.00 0.00 C ATOM 1138 CG GLU A 72 -11.589 0.304 7.174 1.00 0.00 C ATOM 1139 CD GLU A 72 -11.625 0.225 8.685 1.00 0.00 C ATOM 1140 OE1 GLU A 72 -12.559 -0.402 9.233 1.00 0.00 O ATOM 1141 OE2 GLU A 72 -10.725 0.796 9.333 1.00 0.00 O ATOM 0 H GLU A 72 -9.528 -2.447 4.944 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.791 -0.587 4.603 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -11.470 -1.799 6.781 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.914 -1.013 6.955 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.066 1.212 6.876 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.608 0.384 6.796 1.00 0.00 H new ATOM 1215 N LYS A 78 -15.069 0.091 4.230 1.00 0.00 N ATOM 1216 CA LYS A 78 -14.402 -1.143 3.903 1.00 0.00 C ATOM 1217 C LYS A 78 -15.085 -1.848 2.736 1.00 0.00 C ATOM 1218 O LYS A 78 -16.314 -1.899 2.657 1.00 0.00 O ATOM 1219 CB LYS A 78 -14.398 -2.030 5.130 1.00 0.00 C ATOM 1220 CG LYS A 78 -13.790 -3.391 4.887 1.00 0.00 C ATOM 1221 CD LYS A 78 -13.829 -4.266 6.127 1.00 0.00 C ATOM 1222 CE LYS A 78 -13.176 -3.584 7.315 1.00 0.00 C ATOM 1223 NZ LYS A 78 -12.985 -4.512 8.460 1.00 0.00 N ATOM 0 HA LYS A 78 -13.379 -0.927 3.596 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -13.847 -1.532 5.927 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -15.422 -2.156 5.481 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -14.325 -3.887 4.077 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.757 -3.272 4.560 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -14.864 -4.508 6.370 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -13.321 -5.209 5.924 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -12.210 -3.178 7.013 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -13.791 -2.741 7.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -12.536 -4.003 9.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.908 -4.880 8.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.377 -5.303 8.168 1.00 0.00 H new ATOM 1237 N VAL A 79 -14.286 -2.398 1.841 1.00 0.00 N ATOM 1238 CA VAL A 79 -14.797 -3.072 0.664 1.00 0.00 C ATOM 1239 C VAL A 79 -14.166 -4.460 0.507 1.00 0.00 C ATOM 1240 O VAL A 79 -12.972 -4.636 0.731 1.00 0.00 O ATOM 1241 CB VAL A 79 -14.539 -2.221 -0.597 1.00 0.00 C ATOM 1242 CG1 VAL A 79 -13.065 -1.938 -0.772 1.00 0.00 C ATOM 1243 CG2 VAL A 79 -15.100 -2.907 -1.811 1.00 0.00 C ATOM 0 H VAL A 79 -13.268 -2.390 1.909 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.872 -3.200 0.788 1.00 0.00 H new ATOM 0 HB VAL A 79 -15.046 -1.264 -0.473 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -12.914 -1.337 -1.669 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.693 -1.394 0.097 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.523 -2.879 -0.870 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.911 -2.296 -2.694 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.622 -3.879 -1.933 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -16.174 -3.044 -1.688 1.00 0.00 H new ATOM 1253 N LYS A 80 -14.989 -5.442 0.152 1.00 0.00 N ATOM 1254 CA LYS A 80 -14.508 -6.781 -0.169 1.00 0.00 C ATOM 1255 C LYS A 80 -13.621 -6.756 -1.394 1.00 0.00 C ATOM 1256 O LYS A 80 -14.045 -6.382 -2.488 1.00 0.00 O ATOM 1257 CB LYS A 80 -15.683 -7.725 -0.425 1.00 0.00 C ATOM 1258 CG LYS A 80 -16.384 -8.193 0.824 1.00 0.00 C ATOM 1259 CD LYS A 80 -17.822 -8.592 0.548 1.00 0.00 C ATOM 1260 CE LYS A 80 -18.735 -7.379 0.487 1.00 0.00 C ATOM 1261 NZ LYS A 80 -18.926 -6.767 1.831 1.00 0.00 N ATOM 0 H LYS A 80 -16.001 -5.333 0.079 1.00 0.00 H new ATOM 0 HA LYS A 80 -13.931 -7.138 0.684 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.406 -7.221 -1.067 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.322 -8.595 -0.973 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.846 -9.042 1.246 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -16.364 -7.399 1.571 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -17.875 -9.136 -0.395 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -18.168 -9.270 1.328 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -18.313 -6.639 -0.193 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -19.703 -7.672 0.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.884 -5.731 1.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -19.852 -7.047 2.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.175 -7.095 2.472 1.00 0.00 H new ATOM 1275 N ALA A 81 -12.392 -7.168 -1.188 1.00 0.00 N ATOM 1276 CA ALA A 81 -11.390 -7.178 -2.226 1.00 0.00 C ATOM 1277 C ALA A 81 -10.541 -8.440 -2.150 1.00 0.00 C ATOM 1278 O ALA A 81 -10.244 -8.942 -1.070 1.00 0.00 O ATOM 1279 CB ALA A 81 -10.509 -5.964 -2.073 1.00 0.00 C ATOM 0 H ALA A 81 -12.057 -7.509 -0.287 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.888 -7.160 -3.195 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.749 -5.965 -2.854 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.115 -5.062 -2.157 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.025 -5.986 -1.097 1.00 0.00 H new ATOM 1285 N VAL A 82 -10.133 -8.946 -3.291 1.00 0.00 N ATOM 1286 CA VAL A 82 -9.348 -10.165 -3.325 1.00 0.00 C ATOM 1287 C VAL A 82 -7.877 -9.858 -3.554 1.00 0.00 C ATOM 1288 O VAL A 82 -7.508 -9.271 -4.572 1.00 0.00 O ATOM 1289 CB VAL A 82 -9.839 -11.128 -4.418 1.00 0.00 C ATOM 1290 CG1 VAL A 82 -9.067 -12.425 -4.359 1.00 0.00 C ATOM 1291 CG2 VAL A 82 -11.298 -11.425 -4.216 1.00 0.00 C ATOM 0 H VAL A 82 -10.329 -8.537 -4.205 1.00 0.00 H new ATOM 0 HA VAL A 82 -9.472 -10.646 -2.355 1.00 0.00 H new ATOM 0 HB VAL A 82 -9.685 -10.656 -5.389 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -9.425 -13.097 -5.139 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.007 -12.224 -4.512 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.211 -12.890 -3.384 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.641 -12.108 -4.993 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -11.444 -11.885 -3.239 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.869 -10.498 -4.270 1.00 0.00 H new ATOM 1301 N VAL A 83 -7.040 -10.237 -2.600 1.00 0.00 N ATOM 1302 CA VAL A 83 -5.606 -10.114 -2.770 1.00 0.00 C ATOM 1303 C VAL A 83 -5.031 -11.480 -3.104 1.00 0.00 C ATOM 1304 O VAL A 83 -5.392 -12.466 -2.488 1.00 0.00 O ATOM 1305 CB VAL A 83 -4.903 -9.552 -1.507 1.00 0.00 C ATOM 1306 CG1 VAL A 83 -4.714 -10.617 -0.456 1.00 0.00 C ATOM 1307 CG2 VAL A 83 -3.574 -8.917 -1.866 1.00 0.00 C ATOM 0 H VAL A 83 -7.330 -10.630 -1.705 1.00 0.00 H new ATOM 0 HA VAL A 83 -5.427 -9.407 -3.580 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.552 -8.783 -1.088 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.218 -10.186 0.414 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.686 -11.013 -0.161 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.101 -11.423 -0.860 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.100 -8.530 -0.964 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -2.926 -9.664 -2.325 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.739 -8.100 -2.568 1.00 0.00 H new ATOM 1317 N LYS A 84 -4.215 -11.543 -4.131 1.00 0.00 N ATOM 1318 CA LYS A 84 -3.425 -12.729 -4.421 1.00 0.00 C ATOM 1319 C LYS A 84 -2.085 -12.259 -4.939 1.00 0.00 C ATOM 1320 O LYS A 84 -1.974 -11.122 -5.381 1.00 0.00 O ATOM 1321 CB LYS A 84 -4.101 -13.643 -5.444 1.00 0.00 C ATOM 1322 CG LYS A 84 -3.272 -13.850 -6.676 1.00 0.00 C ATOM 1323 CD LYS A 84 -3.483 -15.231 -7.253 1.00 0.00 C ATOM 1324 CE LYS A 84 -2.932 -15.335 -8.662 1.00 0.00 C ATOM 1325 NZ LYS A 84 -1.452 -15.180 -8.701 1.00 0.00 N ATOM 0 H LYS A 84 -4.077 -10.778 -4.791 1.00 0.00 H new ATOM 0 HA LYS A 84 -3.315 -13.321 -3.512 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -4.305 -14.609 -4.982 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -5.063 -13.215 -5.727 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -3.531 -13.098 -7.422 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -2.218 -13.711 -6.436 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.998 -15.971 -6.616 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -4.548 -15.465 -7.259 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -3.206 -16.301 -9.087 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -3.392 -14.570 -9.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -1.130 -15.173 -9.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.184 -14.285 -8.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -1.006 -15.973 -8.197 1.00 0.00 H new ATOM 1339 N MET A 85 -1.076 -13.114 -4.932 1.00 0.00 N ATOM 1340 CA MET A 85 0.272 -12.624 -5.161 1.00 0.00 C ATOM 1341 C MET A 85 0.547 -12.469 -6.650 1.00 0.00 C ATOM 1342 O MET A 85 0.684 -13.447 -7.386 1.00 0.00 O ATOM 1343 CB MET A 85 1.304 -13.555 -4.502 1.00 0.00 C ATOM 1344 CG MET A 85 0.708 -14.505 -3.479 1.00 0.00 C ATOM 1345 SD MET A 85 0.882 -16.238 -3.940 1.00 0.00 S ATOM 1346 CE MET A 85 2.666 -16.393 -3.996 1.00 0.00 C ATOM 0 H MET A 85 -1.158 -14.119 -4.776 1.00 0.00 H new ATOM 0 HA MET A 85 0.362 -11.640 -4.702 1.00 0.00 H new ATOM 0 HB2 MET A 85 1.802 -14.137 -5.278 1.00 0.00 H new ATOM 0 HB3 MET A 85 2.070 -12.949 -4.018 1.00 0.00 H new ATOM 0 HG2 MET A 85 1.190 -14.341 -2.515 1.00 0.00 H new ATOM 0 HG3 MET A 85 -0.349 -14.274 -3.350 1.00 0.00 H new ATOM 0 HE1 MET A 85 2.947 -17.429 -3.807 1.00 0.00 H new ATOM 0 HE2 MET A 85 3.027 -16.093 -4.980 1.00 0.00 H new ATOM 0 HE3 MET A 85 3.111 -15.752 -3.235 1.00 0.00 H new ATOM 1390 N ASN A 89 6.633 -11.327 -6.286 1.00 0.00 N ATOM 1391 CA ASN A 89 7.168 -11.272 -4.938 1.00 0.00 C ATOM 1392 C ASN A 89 6.094 -11.002 -3.894 1.00 0.00 C ATOM 1393 O ASN A 89 6.212 -11.417 -2.744 1.00 0.00 O ATOM 1394 CB ASN A 89 8.279 -10.234 -4.886 1.00 0.00 C ATOM 1395 CG ASN A 89 9.614 -10.819 -5.309 1.00 0.00 C ATOM 1396 OD1 ASN A 89 9.868 -12.011 -5.125 1.00 0.00 O ATOM 1397 ND2 ASN A 89 10.478 -9.992 -5.871 1.00 0.00 N ATOM 0 HA ASN A 89 7.578 -12.251 -4.689 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.026 -9.397 -5.537 1.00 0.00 H new ATOM 0 HB3 ASN A 89 8.360 -9.838 -3.874 1.00 0.00 H new ATOM 0 HD21 ASN A 89 11.391 -10.334 -6.169 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.231 -9.012 -6.007 1.00 0.00 H new ATOM 1404 N LYS A 90 5.071 -10.283 -4.288 1.00 0.00 N ATOM 1405 CA LYS A 90 3.964 -9.946 -3.411 1.00 0.00 C ATOM 1406 C LYS A 90 2.668 -9.829 -4.186 1.00 0.00 C ATOM 1407 O LYS A 90 2.622 -10.162 -5.358 1.00 0.00 O ATOM 1408 CB LYS A 90 4.205 -8.778 -2.471 1.00 0.00 C ATOM 1409 CG LYS A 90 4.203 -9.223 -1.020 1.00 0.00 C ATOM 1410 CD LYS A 90 3.956 -8.066 -0.061 1.00 0.00 C ATOM 1411 CE LYS A 90 2.475 -7.746 0.076 1.00 0.00 C ATOM 1412 NZ LYS A 90 1.728 -8.838 0.758 1.00 0.00 N ATOM 0 H LYS A 90 4.978 -9.910 -5.233 1.00 0.00 H new ATOM 0 HA LYS A 90 3.874 -10.791 -2.728 1.00 0.00 H new ATOM 0 HB2 LYS A 90 5.160 -8.310 -2.708 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.434 -8.023 -2.622 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.434 -9.982 -0.876 1.00 0.00 H new ATOM 0 HG3 LYS A 90 5.159 -9.690 -0.784 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.366 -8.313 0.918 1.00 0.00 H new ATOM 0 HD3 LYS A 90 4.487 -7.182 -0.415 1.00 0.00 H new ATOM 0 HE2 LYS A 90 2.355 -6.819 0.637 1.00 0.00 H new ATOM 0 HE3 LYS A 90 2.048 -7.577 -0.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.710 -8.626 0.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 1.903 -9.738 0.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.048 -8.914 1.744 1.00 0.00 H new ATOM 1426 N MET A 91 1.610 -9.443 -3.494 1.00 0.00 N ATOM 1427 CA MET A 91 0.248 -9.674 -3.942 1.00 0.00 C ATOM 1428 C MET A 91 -0.433 -8.394 -4.409 1.00 0.00 C ATOM 1429 O MET A 91 -0.119 -7.297 -3.949 1.00 0.00 O ATOM 1430 CB MET A 91 -0.578 -10.264 -2.801 1.00 0.00 C ATOM 1431 CG MET A 91 0.013 -11.530 -2.235 1.00 0.00 C ATOM 1432 SD MET A 91 1.389 -11.188 -1.100 1.00 0.00 S ATOM 1433 CE MET A 91 2.328 -12.714 -1.141 1.00 0.00 C ATOM 0 H MET A 91 1.673 -8.957 -2.599 1.00 0.00 H new ATOM 0 HA MET A 91 0.304 -10.363 -4.784 1.00 0.00 H new ATOM 0 HB2 MET A 91 -0.667 -9.525 -2.005 1.00 0.00 H new ATOM 0 HB3 MET A 91 -1.587 -10.470 -3.159 1.00 0.00 H new ATOM 0 HG2 MET A 91 -0.761 -12.088 -1.709 1.00 0.00 H new ATOM 0 HG3 MET A 91 0.364 -12.163 -3.050 1.00 0.00 H new ATOM 0 HE1 MET A 91 2.345 -13.158 -0.146 1.00 0.00 H new ATOM 0 HE2 MET A 91 1.863 -13.409 -1.840 1.00 0.00 H new ATOM 0 HE3 MET A 91 3.348 -12.505 -1.462 1.00 0.00 H new ATOM 1443 N VAL A 92 -1.371 -8.567 -5.332 1.00 0.00 N ATOM 1444 CA VAL A 92 -2.180 -7.481 -5.856 1.00 0.00 C ATOM 1445 C VAL A 92 -3.598 -7.602 -5.319 1.00 0.00 C ATOM 1446 O VAL A 92 -4.163 -8.698 -5.298 1.00 0.00 O ATOM 1447 CB VAL A 92 -2.230 -7.508 -7.400 1.00 0.00 C ATOM 1448 CG1 VAL A 92 -3.212 -6.480 -7.945 1.00 0.00 C ATOM 1449 CG2 VAL A 92 -0.853 -7.268 -7.963 1.00 0.00 C ATOM 0 H VAL A 92 -1.591 -9.476 -5.740 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.727 -6.542 -5.539 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.578 -8.493 -7.710 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.221 -6.527 -9.034 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.211 -6.693 -7.564 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.908 -5.483 -7.628 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.896 -7.289 -9.052 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.489 -6.295 -7.633 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -0.176 -8.047 -7.612 1.00 0.00 H new ATOM 1459 N THR A 93 -4.161 -6.497 -4.873 1.00 0.00 N ATOM 1460 CA THR A 93 -5.535 -6.495 -4.409 1.00 0.00 C ATOM 1461 C THR A 93 -6.284 -5.304 -4.995 1.00 0.00 C ATOM 1462 O THR A 93 -5.814 -4.166 -4.943 1.00 0.00 O ATOM 1463 CB THR A 93 -5.633 -6.509 -2.862 1.00 0.00 C ATOM 1464 OG1 THR A 93 -7.003 -6.467 -2.448 1.00 0.00 O ATOM 1465 CG2 THR A 93 -4.871 -5.348 -2.235 1.00 0.00 C ATOM 0 H THR A 93 -3.692 -5.593 -4.822 1.00 0.00 H new ATOM 0 HA THR A 93 -6.004 -7.415 -4.759 1.00 0.00 H new ATOM 0 HB THR A 93 -5.177 -7.437 -2.517 1.00 0.00 H new ATOM 0 HG1 THR A 93 -7.049 -6.478 -1.469 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.965 -5.395 -1.150 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.818 -5.412 -2.511 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.284 -4.405 -2.595 1.00 0.00 H new ATOM 1473 N THR A 94 -7.419 -5.587 -5.611 1.00 0.00 N ATOM 1474 CA THR A 94 -8.239 -4.557 -6.225 1.00 0.00 C ATOM 1475 C THR A 94 -9.444 -4.237 -5.339 1.00 0.00 C ATOM 1476 O THR A 94 -10.220 -5.128 -4.993 1.00 0.00 O ATOM 1477 CB THR A 94 -8.712 -5.008 -7.614 1.00 0.00 C ATOM 1478 OG1 THR A 94 -7.599 -5.516 -8.366 1.00 0.00 O ATOM 1479 CG2 THR A 94 -9.353 -3.864 -8.375 1.00 0.00 C ATOM 0 H THR A 94 -7.796 -6.531 -5.699 1.00 0.00 H new ATOM 0 HA THR A 94 -7.636 -3.656 -6.335 1.00 0.00 H new ATOM 0 HB THR A 94 -9.457 -5.792 -7.478 1.00 0.00 H new ATOM 0 HG1 THR A 94 -7.906 -5.804 -9.251 1.00 0.00 H new ATOM 0 HG21 THR A 94 -9.677 -4.215 -9.355 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.214 -3.494 -7.819 1.00 0.00 H new ATOM 0 HG23 THR A 94 -8.629 -3.059 -8.500 1.00 0.00 H new ATOM 1487 N PHE A 95 -9.611 -2.966 -4.993 1.00 0.00 N ATOM 1488 CA PHE A 95 -10.655 -2.553 -4.066 1.00 0.00 C ATOM 1489 C PHE A 95 -11.078 -1.126 -4.369 1.00 0.00 C ATOM 1490 O PHE A 95 -10.263 -0.317 -4.803 1.00 0.00 O ATOM 1491 CB PHE A 95 -10.172 -2.674 -2.614 1.00 0.00 C ATOM 1492 CG PHE A 95 -8.986 -1.813 -2.271 1.00 0.00 C ATOM 1493 CD1 PHE A 95 -7.696 -2.296 -2.425 1.00 0.00 C ATOM 1494 CD2 PHE A 95 -9.163 -0.528 -1.784 1.00 0.00 C ATOM 1495 CE1 PHE A 95 -6.606 -1.512 -2.102 1.00 0.00 C ATOM 1496 CE2 PHE A 95 -8.077 0.260 -1.457 1.00 0.00 C ATOM 1497 CZ PHE A 95 -6.795 -0.233 -1.617 1.00 0.00 C ATOM 0 H PHE A 95 -9.034 -2.201 -5.343 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.515 -3.211 -4.191 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.996 -2.415 -1.949 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.917 -3.715 -2.416 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.542 -3.296 -2.802 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.162 -0.138 -1.659 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.606 -1.899 -2.229 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -8.229 1.259 -1.077 1.00 0.00 H new ATOM 0 HZ PHE A 95 -5.943 0.381 -1.363 1.00 0.00 H new ATOM 1507 N LYS A 96 -12.359 -0.830 -4.157 1.00 0.00 N ATOM 1508 CA LYS A 96 -12.940 0.460 -4.533 1.00 0.00 C ATOM 1509 C LYS A 96 -12.701 0.779 -6.005 1.00 0.00 C ATOM 1510 O LYS A 96 -12.722 1.942 -6.413 1.00 0.00 O ATOM 1511 CB LYS A 96 -12.403 1.574 -3.661 1.00 0.00 C ATOM 1512 CG LYS A 96 -13.084 1.621 -2.315 1.00 0.00 C ATOM 1513 CD LYS A 96 -12.630 2.811 -1.524 1.00 0.00 C ATOM 1514 CE LYS A 96 -13.054 4.110 -2.186 1.00 0.00 C ATOM 1515 NZ LYS A 96 -12.522 5.300 -1.475 1.00 0.00 N ATOM 0 H LYS A 96 -13.021 -1.473 -3.722 1.00 0.00 H new ATOM 0 HA LYS A 96 -14.016 0.384 -4.377 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.331 1.438 -3.520 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.539 2.529 -4.169 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.165 1.661 -2.452 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -12.867 0.708 -1.761 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.046 2.761 -0.518 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -11.545 2.790 -1.422 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.706 4.120 -3.219 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.142 4.163 -2.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.836 6.164 -1.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -12.874 5.306 -0.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -11.483 5.265 -1.469 1.00 0.00 H new ATOM 1529 N GLY A 97 -12.461 -0.261 -6.791 1.00 0.00 N ATOM 1530 CA GLY A 97 -12.219 -0.084 -8.206 1.00 0.00 C ATOM 1531 C GLY A 97 -10.757 0.159 -8.519 1.00 0.00 C ATOM 1532 O GLY A 97 -10.365 0.180 -9.685 1.00 0.00 O ATOM 0 H GLY A 97 -12.430 -1.229 -6.470 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -12.560 -0.969 -8.743 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -12.810 0.757 -8.570 1.00 0.00 H new ATOM 1536 N ILE A 98 -9.942 0.345 -7.487 1.00 0.00 N ATOM 1537 CA ILE A 98 -8.530 0.597 -7.695 1.00 0.00 C ATOM 1538 C ILE A 98 -7.746 -0.690 -7.524 1.00 0.00 C ATOM 1539 O ILE A 98 -8.103 -1.546 -6.719 1.00 0.00 O ATOM 1540 CB ILE A 98 -7.968 1.706 -6.770 1.00 0.00 C ATOM 1541 CG1 ILE A 98 -7.645 1.191 -5.361 1.00 0.00 C ATOM 1542 CG2 ILE A 98 -8.953 2.862 -6.677 1.00 0.00 C ATOM 1543 CD1 ILE A 98 -6.199 0.775 -5.164 1.00 0.00 C ATOM 0 H ILE A 98 -10.235 0.326 -6.510 1.00 0.00 H new ATOM 0 HA ILE A 98 -8.417 0.964 -8.715 1.00 0.00 H new ATOM 0 HB ILE A 98 -7.034 2.047 -7.217 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -7.889 1.969 -4.638 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.289 0.339 -5.142 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -8.547 3.635 -6.024 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -9.121 3.278 -7.671 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -9.898 2.503 -6.269 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -6.057 0.424 -4.142 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -5.953 -0.027 -5.860 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.547 1.628 -5.348 1.00 0.00 H new ATOM 1555 N LYS A 99 -6.681 -0.821 -8.280 1.00 0.00 N ATOM 1556 CA LYS A 99 -5.932 -2.061 -8.333 1.00 0.00 C ATOM 1557 C LYS A 99 -4.529 -1.848 -7.769 1.00 0.00 C ATOM 1558 O LYS A 99 -3.735 -1.113 -8.344 1.00 0.00 O ATOM 1559 CB LYS A 99 -5.862 -2.539 -9.786 1.00 0.00 C ATOM 1560 CG LYS A 99 -7.211 -2.557 -10.495 1.00 0.00 C ATOM 1561 CD LYS A 99 -7.579 -1.205 -11.099 1.00 0.00 C ATOM 1562 CE LYS A 99 -7.071 -1.080 -12.523 1.00 0.00 C ATOM 1563 NZ LYS A 99 -7.683 -2.105 -13.410 1.00 0.00 N ATOM 0 H LYS A 99 -6.309 -0.079 -8.873 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.430 -2.820 -7.729 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -5.181 -1.892 -10.339 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.437 -3.543 -9.808 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -7.192 -3.309 -11.284 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -7.984 -2.856 -9.788 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -8.662 -1.081 -11.085 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -7.158 -0.405 -10.489 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -7.297 -0.084 -12.905 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -5.986 -1.188 -12.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -7.750 -1.731 -14.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.093 -2.961 -13.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -8.635 -2.340 -13.063 1.00 0.00 H new ATOM 1577 N SER A 100 -4.220 -2.479 -6.648 1.00 0.00 N ATOM 1578 CA SER A 100 -2.949 -2.229 -5.979 1.00 0.00 C ATOM 1579 C SER A 100 -2.050 -3.464 -5.990 1.00 0.00 C ATOM 1580 O SER A 100 -2.436 -4.527 -5.519 1.00 0.00 O ATOM 1581 CB SER A 100 -3.201 -1.778 -4.541 1.00 0.00 C ATOM 1582 OG SER A 100 -2.034 -1.220 -3.960 1.00 0.00 O ATOM 0 H SER A 100 -4.822 -3.160 -6.185 1.00 0.00 H new ATOM 0 HA SER A 100 -2.433 -1.440 -6.526 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.005 -1.042 -4.525 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.535 -2.627 -3.945 1.00 0.00 H new ATOM 0 HG SER A 100 -2.228 -0.940 -3.041 1.00 0.00 H new ATOM 1588 N VAL A 101 -0.845 -3.298 -6.515 1.00 0.00 N ATOM 1589 CA VAL A 101 0.153 -4.359 -6.554 1.00 0.00 C ATOM 1590 C VAL A 101 1.207 -4.126 -5.467 1.00 0.00 C ATOM 1591 O VAL A 101 1.603 -2.993 -5.203 1.00 0.00 O ATOM 1592 CB VAL A 101 0.828 -4.473 -7.952 1.00 0.00 C ATOM 1593 CG1 VAL A 101 0.229 -3.485 -8.928 1.00 0.00 C ATOM 1594 CG2 VAL A 101 2.333 -4.329 -7.861 1.00 0.00 C ATOM 0 H VAL A 101 -0.530 -2.420 -6.928 1.00 0.00 H new ATOM 0 HA VAL A 101 -0.358 -5.303 -6.365 1.00 0.00 H new ATOM 0 HB VAL A 101 0.628 -5.474 -8.333 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.719 -3.587 -9.896 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.837 -3.684 -9.039 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.372 -2.471 -8.554 1.00 0.00 H new ATOM 0 HG21 VAL A 101 2.768 -4.414 -8.857 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.580 -3.355 -7.439 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.736 -5.114 -7.221 1.00 0.00 H new ATOM 1604 N THR A 102 1.607 -5.193 -4.804 1.00 0.00 N ATOM 1605 CA THR A 102 2.665 -5.143 -3.812 1.00 0.00 C ATOM 1606 C THR A 102 3.686 -6.205 -4.158 1.00 0.00 C ATOM 1607 O THR A 102 3.292 -7.281 -4.566 1.00 0.00 O ATOM 1608 CB THR A 102 2.151 -5.400 -2.386 1.00 0.00 C ATOM 1609 OG1 THR A 102 0.745 -5.145 -2.308 1.00 0.00 O ATOM 1610 CG2 THR A 102 2.878 -4.512 -1.389 1.00 0.00 C ATOM 0 H THR A 102 1.207 -6.122 -4.938 1.00 0.00 H new ATOM 0 HA THR A 102 3.096 -4.142 -3.829 1.00 0.00 H new ATOM 0 HB THR A 102 2.342 -6.445 -2.142 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.258 -5.850 -2.783 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.501 -4.708 -0.385 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.946 -4.725 -1.423 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.708 -3.466 -1.643 1.00 0.00 H new ATOM 1618 N GLU A 103 4.968 -5.890 -4.068 1.00 0.00 N ATOM 1619 CA GLU A 103 6.031 -6.832 -4.360 1.00 0.00 C ATOM 1620 C GLU A 103 6.994 -6.954 -3.173 1.00 0.00 C ATOM 1621 O GLU A 103 7.500 -5.951 -2.684 1.00 0.00 O ATOM 1622 CB GLU A 103 6.761 -6.286 -5.568 1.00 0.00 C ATOM 1623 CG GLU A 103 7.544 -7.295 -6.357 1.00 0.00 C ATOM 1624 CD GLU A 103 8.923 -6.782 -6.718 1.00 0.00 C ATOM 1625 OE1 GLU A 103 9.024 -5.655 -7.249 1.00 0.00 O ATOM 1626 OE2 GLU A 103 9.911 -7.504 -6.484 1.00 0.00 O ATOM 0 H GLU A 103 5.300 -4.967 -3.788 1.00 0.00 H new ATOM 0 HA GLU A 103 5.628 -7.827 -4.549 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.033 -5.817 -6.230 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.441 -5.502 -5.236 1.00 0.00 H new ATOM 0 HG2 GLU A 103 7.638 -8.214 -5.779 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.000 -7.546 -7.268 1.00 0.00 H new ATOM 1633 N PHE A 104 7.241 -8.174 -2.709 1.00 0.00 N ATOM 1634 CA PHE A 104 8.139 -8.394 -1.576 1.00 0.00 C ATOM 1635 C PHE A 104 9.502 -8.872 -2.060 1.00 0.00 C ATOM 1636 O PHE A 104 9.675 -10.049 -2.362 1.00 0.00 O ATOM 1637 CB PHE A 104 7.549 -9.482 -0.682 1.00 0.00 C ATOM 1638 CG PHE A 104 7.793 -9.288 0.784 1.00 0.00 C ATOM 1639 CD1 PHE A 104 9.019 -9.602 1.344 1.00 0.00 C ATOM 1640 CD2 PHE A 104 6.788 -8.807 1.603 1.00 0.00 C ATOM 1641 CE1 PHE A 104 9.234 -9.442 2.697 1.00 0.00 C ATOM 1642 CE2 PHE A 104 6.997 -8.641 2.954 1.00 0.00 C ATOM 1643 CZ PHE A 104 8.220 -8.960 3.503 1.00 0.00 C ATOM 0 H PHE A 104 6.834 -9.025 -3.097 1.00 0.00 H new ATOM 0 HA PHE A 104 8.252 -7.456 -1.033 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.474 -9.531 -0.854 1.00 0.00 H new ATOM 0 HB3 PHE A 104 7.964 -10.444 -0.981 1.00 0.00 H new ATOM 0 HD1 PHE A 104 9.814 -9.976 0.716 1.00 0.00 H new ATOM 0 HD2 PHE A 104 5.827 -8.558 1.178 1.00 0.00 H new ATOM 0 HE1 PHE A 104 10.193 -9.693 3.126 1.00 0.00 H new ATOM 0 HE2 PHE A 104 6.204 -8.262 3.582 1.00 0.00 H new ATOM 0 HZ PHE A 104 8.386 -8.833 4.563 1.00 0.00 H new ATOM 1653 N ASN A 105 10.482 -7.993 -2.075 1.00 0.00 N ATOM 1654 CA ASN A 105 11.799 -8.364 -2.564 1.00 0.00 C ATOM 1655 C ASN A 105 12.824 -8.290 -1.442 1.00 0.00 C ATOM 1656 O ASN A 105 13.352 -7.217 -1.144 1.00 0.00 O ATOM 1657 CB ASN A 105 12.205 -7.453 -3.727 1.00 0.00 C ATOM 1658 CG ASN A 105 13.379 -7.998 -4.522 1.00 0.00 C ATOM 1659 OD1 ASN A 105 14.261 -8.673 -3.988 1.00 0.00 O ATOM 1660 ND2 ASN A 105 13.392 -7.716 -5.817 1.00 0.00 N ATOM 0 H ASN A 105 10.397 -7.027 -1.759 1.00 0.00 H new ATOM 0 HA ASN A 105 11.762 -9.392 -2.924 1.00 0.00 H new ATOM 0 HB2 ASN A 105 11.352 -7.320 -4.393 1.00 0.00 H new ATOM 0 HB3 ASN A 105 12.462 -6.468 -3.338 1.00 0.00 H new ATOM 0 HD21 ASN A 105 14.150 -8.061 -6.406 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.644 -7.154 -6.224 1.00 0.00 H new ATOM 1667 N GLY A 106 13.116 -9.438 -0.843 1.00 0.00 N ATOM 1668 CA GLY A 106 14.095 -9.500 0.223 1.00 0.00 C ATOM 1669 C GLY A 106 13.760 -8.598 1.394 1.00 0.00 C ATOM 1670 O GLY A 106 12.902 -8.917 2.217 1.00 0.00 O ATOM 0 H GLY A 106 12.688 -10.333 -1.080 1.00 0.00 H new ATOM 0 HA2 GLY A 106 14.174 -10.528 0.576 1.00 0.00 H new ATOM 0 HA3 GLY A 106 15.072 -9.223 -0.173 1.00 0.00 H new ATOM 1674 N ASP A 107 14.443 -7.468 1.455 1.00 0.00 N ATOM 1675 CA ASP A 107 14.275 -6.520 2.549 1.00 0.00 C ATOM 1676 C ASP A 107 13.501 -5.297 2.088 1.00 0.00 C ATOM 1677 O ASP A 107 13.315 -4.343 2.847 1.00 0.00 O ATOM 1678 CB ASP A 107 15.630 -6.063 3.076 1.00 0.00 C ATOM 1679 CG ASP A 107 16.590 -7.203 3.322 1.00 0.00 C ATOM 1680 OD1 ASP A 107 16.361 -7.987 4.259 1.00 0.00 O ATOM 1681 OD2 ASP A 107 17.595 -7.306 2.587 1.00 0.00 O ATOM 0 H ASP A 107 15.126 -7.181 0.754 1.00 0.00 H new ATOM 0 HA ASP A 107 13.723 -7.027 3.340 1.00 0.00 H new ATOM 0 HB2 ASP A 107 16.075 -5.370 2.362 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.484 -5.513 4.006 1.00 0.00 H new ATOM 1686 N THR A 108 13.084 -5.303 0.838 1.00 0.00 N ATOM 1687 CA THR A 108 12.419 -4.172 0.251 1.00 0.00 C ATOM 1688 C THR A 108 11.059 -4.587 -0.319 1.00 0.00 C ATOM 1689 O THR A 108 10.834 -5.754 -0.629 1.00 0.00 O ATOM 1690 CB THR A 108 13.280 -3.592 -0.872 1.00 0.00 C ATOM 1691 OG1 THR A 108 14.635 -4.049 -0.749 1.00 0.00 O ATOM 1692 CG2 THR A 108 13.257 -2.096 -0.812 1.00 0.00 C ATOM 0 H THR A 108 13.200 -6.095 0.206 1.00 0.00 H new ATOM 0 HA THR A 108 12.266 -3.420 1.025 1.00 0.00 H new ATOM 0 HB THR A 108 12.874 -3.927 -1.827 1.00 0.00 H new ATOM 0 HG1 THR A 108 15.175 -3.672 -1.475 1.00 0.00 H new ATOM 0 HG21 THR A 108 13.872 -1.690 -1.615 1.00 0.00 H new ATOM 0 HG22 THR A 108 12.232 -1.743 -0.927 1.00 0.00 H new ATOM 0 HG23 THR A 108 13.650 -1.764 0.149 1.00 0.00 H new ATOM 1700 N ILE A 109 10.157 -3.631 -0.438 1.00 0.00 N ATOM 1701 CA ILE A 109 8.828 -3.868 -0.969 1.00 0.00 C ATOM 1702 C ILE A 109 8.519 -2.859 -2.065 1.00 0.00 C ATOM 1703 O ILE A 109 8.822 -1.680 -1.928 1.00 0.00 O ATOM 1704 CB ILE A 109 7.754 -3.741 0.136 1.00 0.00 C ATOM 1705 CG1 ILE A 109 8.119 -4.620 1.335 1.00 0.00 C ATOM 1706 CG2 ILE A 109 6.375 -4.105 -0.398 1.00 0.00 C ATOM 1707 CD1 ILE A 109 6.988 -4.811 2.320 1.00 0.00 C ATOM 0 H ILE A 109 10.327 -2.662 -0.167 1.00 0.00 H new ATOM 0 HA ILE A 109 8.807 -4.881 -1.371 1.00 0.00 H new ATOM 0 HB ILE A 109 7.722 -2.702 0.463 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.441 -5.596 0.973 1.00 0.00 H new ATOM 0 HG13 ILE A 109 8.969 -4.176 1.854 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.639 -4.007 0.400 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.114 -3.435 -1.217 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.384 -5.133 -0.759 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.324 -5.445 3.141 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.680 -3.842 2.712 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.144 -5.284 1.818 1.00 0.00 H new ATOM 1719 N THR A 110 7.925 -3.320 -3.141 1.00 0.00 N ATOM 1720 CA THR A 110 7.519 -2.437 -4.220 1.00 0.00 C ATOM 1721 C THR A 110 5.993 -2.336 -4.254 1.00 0.00 C ATOM 1722 O THR A 110 5.302 -3.320 -4.496 1.00 0.00 O ATOM 1723 CB THR A 110 8.027 -2.959 -5.578 1.00 0.00 C ATOM 1724 OG1 THR A 110 9.353 -3.501 -5.454 1.00 0.00 O ATOM 1725 CG2 THR A 110 8.036 -1.827 -6.567 1.00 0.00 C ATOM 0 H THR A 110 7.710 -4.305 -3.297 1.00 0.00 H new ATOM 0 HA THR A 110 7.953 -1.453 -4.041 1.00 0.00 H new ATOM 0 HB THR A 110 7.363 -3.752 -5.921 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.443 -4.282 -6.039 1.00 0.00 H new ATOM 0 HG21 THR A 110 8.394 -2.189 -7.531 1.00 0.00 H new ATOM 0 HG22 THR A 110 7.025 -1.434 -6.680 1.00 0.00 H new ATOM 0 HG23 THR A 110 8.695 -1.036 -6.209 1.00 0.00 H new ATOM 1733 N ASN A 111 5.473 -1.152 -3.990 1.00 0.00 N ATOM 1734 CA ASN A 111 4.032 -0.929 -3.968 1.00 0.00 C ATOM 1735 C ASN A 111 3.610 -0.177 -5.217 1.00 0.00 C ATOM 1736 O ASN A 111 4.046 0.945 -5.434 1.00 0.00 O ATOM 1737 CB ASN A 111 3.637 -0.098 -2.737 1.00 0.00 C ATOM 1738 CG ASN A 111 2.131 0.001 -2.556 1.00 0.00 C ATOM 1739 OD1 ASN A 111 1.541 -0.998 -1.915 1.00 0.00 O flip ATOM 1740 ND2 ASN A 111 1.503 0.965 -2.992 1.00 0.00 N flip ATOM 0 H ASN A 111 6.029 -0.321 -3.786 1.00 0.00 H new ATOM 0 HA ASN A 111 3.535 -1.898 -3.927 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.078 -0.544 -1.846 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.054 0.905 -2.831 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.993 1.715 -3.480 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.492 1.015 -2.865 1.00 0.00 H new ATOM 1747 N THR A 112 2.796 -0.788 -6.051 1.00 0.00 N ATOM 1748 CA THR A 112 2.296 -0.110 -7.230 1.00 0.00 C ATOM 1749 C THR A 112 0.774 -0.009 -7.173 1.00 0.00 C ATOM 1750 O THR A 112 0.084 -1.014 -7.151 1.00 0.00 O ATOM 1751 CB THR A 112 2.712 -0.848 -8.514 1.00 0.00 C ATOM 1752 OG1 THR A 112 4.115 -1.144 -8.475 1.00 0.00 O ATOM 1753 CG2 THR A 112 2.400 -0.006 -9.736 1.00 0.00 C ATOM 0 H THR A 112 2.467 -1.747 -5.937 1.00 0.00 H new ATOM 0 HA THR A 112 2.729 0.890 -7.248 1.00 0.00 H new ATOM 0 HB THR A 112 2.148 -1.779 -8.577 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.373 -1.615 -9.295 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.701 -0.544 -10.635 1.00 0.00 H new ATOM 0 HG22 THR A 112 1.330 0.196 -9.775 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.945 0.936 -9.677 1.00 0.00 H new ATOM 1761 N MET A 113 0.248 1.190 -7.152 1.00 0.00 N ATOM 1762 CA MET A 113 -1.186 1.377 -7.151 1.00 0.00 C ATOM 1763 C MET A 113 -1.645 1.778 -8.531 1.00 0.00 C ATOM 1764 O MET A 113 -0.968 2.528 -9.220 1.00 0.00 O ATOM 1765 CB MET A 113 -1.610 2.464 -6.178 1.00 0.00 C ATOM 1766 CG MET A 113 -3.118 2.535 -6.025 1.00 0.00 C ATOM 1767 SD MET A 113 -3.667 3.983 -5.104 1.00 0.00 S ATOM 1768 CE MET A 113 -2.921 3.678 -3.505 1.00 0.00 C ATOM 0 H MET A 113 0.790 2.054 -7.135 1.00 0.00 H new ATOM 0 HA MET A 113 -1.638 0.433 -6.846 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.156 2.277 -5.205 1.00 0.00 H new ATOM 0 HB3 MET A 113 -1.235 3.427 -6.525 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.578 2.545 -7.013 1.00 0.00 H new ATOM 0 HG3 MET A 113 -3.469 1.635 -5.519 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.656 3.859 -2.720 1.00 0.00 H new ATOM 0 HE2 MET A 113 -2.582 2.643 -3.453 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.071 4.346 -3.367 1.00 0.00 H new ATOM 1778 N THR A 114 -2.770 1.257 -8.949 1.00 0.00 N ATOM 1779 CA THR A 114 -3.325 1.620 -10.229 1.00 0.00 C ATOM 1780 C THR A 114 -4.776 2.074 -10.094 1.00 0.00 C ATOM 1781 O THR A 114 -5.647 1.278 -9.741 1.00 0.00 O ATOM 1782 CB THR A 114 -3.266 0.434 -11.187 1.00 0.00 C ATOM 1783 OG1 THR A 114 -2.139 -0.396 -10.873 1.00 0.00 O ATOM 1784 CG2 THR A 114 -3.147 0.925 -12.609 1.00 0.00 C ATOM 0 H THR A 114 -3.321 0.579 -8.422 1.00 0.00 H new ATOM 0 HA THR A 114 -2.731 2.445 -10.622 1.00 0.00 H new ATOM 0 HB THR A 114 -4.182 -0.147 -11.081 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.352 -0.957 -10.098 1.00 0.00 H new ATOM 0 HG21 THR A 114 -3.105 0.072 -13.286 1.00 0.00 H new ATOM 0 HG22 THR A 114 -4.012 1.542 -12.855 1.00 0.00 H new ATOM 0 HG23 THR A 114 -2.238 1.517 -12.715 1.00 0.00 H new ATOM 1792 N LEU A 115 -5.038 3.341 -10.363 1.00 0.00 N ATOM 1793 CA LEU A 115 -6.409 3.820 -10.437 1.00 0.00 C ATOM 1794 C LEU A 115 -6.726 4.146 -11.883 1.00 0.00 C ATOM 1795 O LEU A 115 -6.300 5.174 -12.385 1.00 0.00 O ATOM 1796 CB LEU A 115 -6.595 5.078 -9.590 1.00 0.00 C ATOM 1797 CG LEU A 115 -7.947 5.192 -8.880 1.00 0.00 C ATOM 1798 CD1 LEU A 115 -8.240 6.635 -8.543 1.00 0.00 C ATOM 1799 CD2 LEU A 115 -9.058 4.619 -9.729 1.00 0.00 C ATOM 0 H LEU A 115 -4.327 4.052 -10.533 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.076 3.047 -10.057 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -5.805 5.112 -8.840 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.464 5.950 -10.230 1.00 0.00 H new ATOM 0 HG LEU A 115 -7.894 4.615 -7.957 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.204 6.702 -8.039 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -7.460 7.021 -7.887 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.268 7.224 -9.460 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.006 4.714 -9.200 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.113 5.163 -10.672 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.857 3.566 -9.929 1.00 0.00 H new ATOM 1811 N GLY A 116 -7.522 3.295 -12.515 1.00 0.00 N ATOM 1812 CA GLY A 116 -7.833 3.441 -13.928 1.00 0.00 C ATOM 1813 C GLY A 116 -6.630 3.812 -14.790 1.00 0.00 C ATOM 1814 O GLY A 116 -5.884 2.942 -15.237 1.00 0.00 O ATOM 0 H GLY A 116 -7.966 2.493 -12.068 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.257 2.506 -14.295 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.601 4.206 -14.044 1.00 0.00 H new ATOM 1818 N ASP A 117 -6.442 5.107 -15.012 1.00 0.00 N ATOM 1819 CA ASP A 117 -5.346 5.606 -15.835 1.00 0.00 C ATOM 1820 C ASP A 117 -4.121 5.967 -14.992 1.00 0.00 C ATOM 1821 O ASP A 117 -2.982 5.806 -15.441 1.00 0.00 O ATOM 1822 CB ASP A 117 -5.809 6.831 -16.624 1.00 0.00 C ATOM 1823 CG ASP A 117 -4.692 7.490 -17.406 1.00 0.00 C ATOM 1824 OD1 ASP A 117 -4.358 7.000 -18.506 1.00 0.00 O ATOM 1825 OD2 ASP A 117 -4.152 8.509 -16.935 1.00 0.00 O ATOM 0 H ASP A 117 -7.041 5.838 -14.629 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.056 4.810 -16.521 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.601 6.535 -17.312 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -6.240 7.558 -15.936 1.00 0.00 H new ATOM 1830 N ILE A 118 -4.348 6.428 -13.766 1.00 0.00 N ATOM 1831 CA ILE A 118 -3.252 6.901 -12.923 1.00 0.00 C ATOM 1832 C ILE A 118 -2.553 5.755 -12.209 1.00 0.00 C ATOM 1833 O ILE A 118 -3.194 4.885 -11.620 1.00 0.00 O ATOM 1834 CB ILE A 118 -3.701 7.935 -11.884 1.00 0.00 C ATOM 1835 CG1 ILE A 118 -4.967 7.472 -11.213 1.00 0.00 C ATOM 1836 CG2 ILE A 118 -3.927 9.261 -12.539 1.00 0.00 C ATOM 1837 CD1 ILE A 118 -5.512 8.437 -10.228 1.00 0.00 C ATOM 0 H ILE A 118 -5.271 6.485 -13.336 1.00 0.00 H new ATOM 0 HA ILE A 118 -2.553 7.384 -13.606 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.918 8.042 -11.133 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -5.722 7.281 -11.976 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -4.775 6.524 -10.710 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -4.246 9.987 -11.791 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.001 9.600 -13.003 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.700 9.163 -13.302 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -6.423 8.032 -9.788 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -4.776 8.611 -9.443 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -5.738 9.379 -10.728 1.00 0.00 H new ATOM 1849 N VAL A 119 -1.236 5.756 -12.272 1.00 0.00 N ATOM 1850 CA VAL A 119 -0.448 4.758 -11.579 1.00 0.00 C ATOM 1851 C VAL A 119 0.320 5.419 -10.430 1.00 0.00 C ATOM 1852 O VAL A 119 0.728 6.572 -10.536 1.00 0.00 O ATOM 1853 CB VAL A 119 0.518 4.023 -12.537 1.00 0.00 C ATOM 1854 CG1 VAL A 119 1.795 4.809 -12.753 1.00 0.00 C ATOM 1855 CG2 VAL A 119 0.811 2.617 -12.036 1.00 0.00 C ATOM 0 H VAL A 119 -0.689 6.438 -12.797 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.126 4.007 -11.174 1.00 0.00 H new ATOM 0 HB VAL A 119 0.025 3.939 -13.505 1.00 0.00 H new ATOM 0 HG11 VAL A 119 2.449 4.261 -13.432 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.556 5.781 -13.185 1.00 0.00 H new ATOM 0 HG13 VAL A 119 2.301 4.951 -11.798 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.493 2.120 -12.726 1.00 0.00 H new ATOM 0 HG22 VAL A 119 1.270 2.671 -11.049 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.119 2.052 -11.974 1.00 0.00 H new ATOM 1865 N TYR A 120 0.464 4.700 -9.334 1.00 0.00 N ATOM 1866 CA TYR A 120 1.098 5.203 -8.119 1.00 0.00 C ATOM 1867 C TYR A 120 2.105 4.174 -7.623 1.00 0.00 C ATOM 1868 O TYR A 120 1.868 2.989 -7.747 1.00 0.00 O ATOM 1869 CB TYR A 120 0.027 5.464 -7.048 1.00 0.00 C ATOM 1870 CG TYR A 120 0.569 5.985 -5.739 1.00 0.00 C ATOM 1871 CD1 TYR A 120 1.306 7.156 -5.689 1.00 0.00 C ATOM 1872 CD2 TYR A 120 0.337 5.307 -4.550 1.00 0.00 C ATOM 1873 CE1 TYR A 120 1.801 7.639 -4.500 1.00 0.00 C ATOM 1874 CE2 TYR A 120 0.828 5.783 -3.351 1.00 0.00 C ATOM 1875 CZ TYR A 120 1.559 6.951 -3.330 1.00 0.00 C ATOM 1876 OH TYR A 120 2.051 7.427 -2.135 1.00 0.00 O ATOM 0 H TYR A 120 0.141 3.736 -9.256 1.00 0.00 H new ATOM 0 HA TYR A 120 1.615 6.139 -8.328 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -0.694 6.181 -7.440 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -0.515 4.537 -6.860 1.00 0.00 H new ATOM 0 HD1 TYR A 120 1.496 7.701 -6.602 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -0.237 4.392 -4.563 1.00 0.00 H new ATOM 0 HE1 TYR A 120 2.376 8.553 -4.483 1.00 0.00 H new ATOM 0 HE2 TYR A 120 0.640 5.243 -2.435 1.00 0.00 H new ATOM 0 HH TYR A 120 1.454 7.160 -1.406 1.00 0.00 H new ATOM 1886 N LYS A 121 3.258 4.599 -7.139 1.00 0.00 N ATOM 1887 CA LYS A 121 4.244 3.639 -6.650 1.00 0.00 C ATOM 1888 C LYS A 121 4.833 4.100 -5.320 1.00 0.00 C ATOM 1889 O LYS A 121 4.969 5.291 -5.093 1.00 0.00 O ATOM 1890 CB LYS A 121 5.350 3.465 -7.691 1.00 0.00 C ATOM 1891 CG LYS A 121 6.108 2.151 -7.621 1.00 0.00 C ATOM 1892 CD LYS A 121 7.497 2.353 -7.052 1.00 0.00 C ATOM 1893 CE LYS A 121 8.489 1.369 -7.622 1.00 0.00 C ATOM 1894 NZ LYS A 121 8.744 1.594 -9.072 1.00 0.00 N ATOM 0 H LYS A 121 3.536 5.578 -7.072 1.00 0.00 H new ATOM 0 HA LYS A 121 3.752 2.680 -6.487 1.00 0.00 H new ATOM 0 HB2 LYS A 121 4.910 3.559 -8.684 1.00 0.00 H new ATOM 0 HB3 LYS A 121 6.062 4.282 -7.580 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.558 1.442 -7.002 1.00 0.00 H new ATOM 0 HG3 LYS A 121 6.180 1.715 -8.618 1.00 0.00 H new ATOM 0 HD2 LYS A 121 7.831 3.369 -7.263 1.00 0.00 H new ATOM 0 HD3 LYS A 121 7.464 2.248 -5.968 1.00 0.00 H new ATOM 0 HE2 LYS A 121 9.428 1.446 -7.075 1.00 0.00 H new ATOM 0 HE3 LYS A 121 8.117 0.355 -7.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.661 1.177 -9.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 7.989 1.147 -9.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.760 2.615 -9.267 1.00 0.00 H new ATOM 1908 N ARG A 122 5.114 3.148 -4.433 1.00 0.00 N ATOM 1909 CA ARG A 122 5.866 3.387 -3.200 1.00 0.00 C ATOM 1910 C ARG A 122 6.836 2.232 -2.976 1.00 0.00 C ATOM 1911 O ARG A 122 6.509 1.103 -3.311 1.00 0.00 O ATOM 1912 CB ARG A 122 4.950 3.475 -1.985 1.00 0.00 C ATOM 1913 CG ARG A 122 4.022 4.665 -1.950 1.00 0.00 C ATOM 1914 CD ARG A 122 2.909 4.467 -0.923 1.00 0.00 C ATOM 1915 NE ARG A 122 3.271 3.528 0.142 1.00 0.00 N ATOM 1916 CZ ARG A 122 2.425 2.635 0.657 1.00 0.00 C ATOM 1917 NH1 ARG A 122 1.203 2.509 0.149 1.00 0.00 N ATOM 1918 NH2 ARG A 122 2.806 1.852 1.662 1.00 0.00 N ATOM 0 H ARG A 122 4.823 2.177 -4.550 1.00 0.00 H new ATOM 0 HA ARG A 122 6.392 4.335 -3.312 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.349 2.567 -1.940 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.568 3.493 -1.087 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.588 5.564 -1.708 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.586 4.819 -2.937 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.656 5.430 -0.480 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.015 4.105 -1.430 1.00 0.00 H new ATOM 0 HE ARG A 122 4.222 3.559 0.510 1.00 0.00 H new ATOM 0 HH11 ARG A 122 0.913 3.095 -0.634 1.00 0.00 H new ATOM 0 HH12 ARG A 122 0.555 1.826 0.542 1.00 0.00 H new ATOM 0 HH21 ARG A 122 3.749 1.933 2.042 1.00 0.00 H new ATOM 0 HH22 ARG A 122 2.155 1.171 2.053 1.00 0.00 H new ATOM 1932 N VAL A 123 8.022 2.471 -2.427 1.00 0.00 N ATOM 1933 CA VAL A 123 8.932 1.349 -2.196 1.00 0.00 C ATOM 1934 C VAL A 123 9.263 1.233 -0.721 1.00 0.00 C ATOM 1935 O VAL A 123 9.955 2.075 -0.196 1.00 0.00 O ATOM 1936 CB VAL A 123 10.230 1.506 -3.007 1.00 0.00 C ATOM 1937 CG1 VAL A 123 11.251 0.443 -2.620 1.00 0.00 C ATOM 1938 CG2 VAL A 123 9.909 1.419 -4.487 1.00 0.00 C ATOM 0 H VAL A 123 8.368 3.388 -2.143 1.00 0.00 H new ATOM 0 HA VAL A 123 8.428 0.441 -2.526 1.00 0.00 H new ATOM 0 HB VAL A 123 10.668 2.479 -2.786 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.158 0.578 -3.209 1.00 0.00 H new ATOM 0 HG12 VAL A 123 11.489 0.536 -1.560 1.00 0.00 H new ATOM 0 HG13 VAL A 123 10.837 -0.547 -2.813 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.826 1.530 -5.065 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.457 0.451 -4.705 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.213 2.213 -4.756 1.00 0.00 H new ATOM 1948 N SER A 124 8.846 0.171 -0.064 1.00 0.00 N ATOM 1949 CA SER A 124 9.022 0.087 1.379 1.00 0.00 C ATOM 1950 C SER A 124 10.233 -0.766 1.727 1.00 0.00 C ATOM 1951 O SER A 124 10.313 -1.923 1.375 1.00 0.00 O ATOM 1952 CB SER A 124 7.762 -0.479 2.026 1.00 0.00 C ATOM 1953 OG SER A 124 6.603 0.079 1.424 1.00 0.00 O ATOM 0 H SER A 124 8.390 -0.635 -0.492 1.00 0.00 H new ATOM 0 HA SER A 124 9.195 1.091 1.767 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.748 -1.564 1.921 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.765 -0.262 3.094 1.00 0.00 H new ATOM 0 HG SER A 124 5.802 -0.294 1.848 1.00 0.00 H new ATOM 1959 N LYS A 125 11.156 -0.180 2.441 1.00 0.00 N ATOM 1960 CA LYS A 125 12.420 -0.813 2.752 1.00 0.00 C ATOM 1961 C LYS A 125 12.526 -0.984 4.262 1.00 0.00 C ATOM 1962 O LYS A 125 12.007 -0.176 5.031 1.00 0.00 O ATOM 1963 CB LYS A 125 13.530 0.068 2.159 1.00 0.00 C ATOM 1964 CG LYS A 125 14.928 -0.183 2.677 1.00 0.00 C ATOM 1965 CD LYS A 125 15.208 0.688 3.883 1.00 0.00 C ATOM 1966 CE LYS A 125 16.656 0.601 4.331 1.00 0.00 C ATOM 1967 NZ LYS A 125 17.029 -0.763 4.785 1.00 0.00 N ATOM 0 H LYS A 125 11.056 0.758 2.829 1.00 0.00 H new ATOM 0 HA LYS A 125 12.510 -1.809 2.319 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.535 -0.069 1.078 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.277 1.111 2.347 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.040 -1.234 2.945 1.00 0.00 H new ATOM 0 HG3 LYS A 125 15.656 0.025 1.893 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.965 1.724 3.645 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.557 0.388 4.704 1.00 0.00 H new ATOM 0 HE2 LYS A 125 17.306 0.897 3.508 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.825 1.310 5.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 17.987 -0.744 5.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 16.354 -1.085 5.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.008 -1.416 3.976 1.00 0.00 H new ATOM 1981 N ARG A 126 13.188 -2.048 4.661 1.00 0.00 N ATOM 1982 CA ARG A 126 13.212 -2.485 6.044 1.00 0.00 C ATOM 1983 C ARG A 126 13.884 -1.491 6.955 1.00 0.00 C ATOM 1984 O ARG A 126 14.860 -0.843 6.578 1.00 0.00 O ATOM 1985 CB ARG A 126 13.955 -3.797 6.156 1.00 0.00 C ATOM 1986 CG ARG A 126 13.078 -5.021 6.118 1.00 0.00 C ATOM 1987 CD ARG A 126 13.942 -6.245 6.235 1.00 0.00 C ATOM 1988 NE ARG A 126 14.644 -6.258 7.525 1.00 0.00 N ATOM 1989 CZ ARG A 126 15.880 -6.718 7.727 1.00 0.00 C ATOM 1990 NH1 ARG A 126 16.571 -7.265 6.740 1.00 0.00 N ATOM 1991 NH2 ARG A 126 16.423 -6.629 8.935 1.00 0.00 N ATOM 0 H ARG A 126 13.730 -2.640 4.032 1.00 0.00 H new ATOM 0 HA ARG A 126 12.172 -2.590 6.354 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.679 -3.860 5.343 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.521 -3.800 7.088 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.355 -4.991 6.933 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.510 -5.049 5.188 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.329 -7.141 6.139 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.666 -6.266 5.420 1.00 0.00 H new ATOM 0 HE ARG A 126 14.146 -5.885 8.333 1.00 0.00 H new ATOM 0 HH11 ARG A 126 16.160 -7.339 5.810 1.00 0.00 H new ATOM 0 HH12 ARG A 126 17.515 -7.612 6.910 1.00 0.00 H new ATOM 0 HH21 ARG A 126 15.896 -6.211 9.702 1.00 0.00 H new ATOM 0 HH22 ARG A 126 17.367 -6.979 9.097 1.00 0.00 H new ATOM 2005 N ILE A 127 13.372 -1.399 8.159 1.00 0.00 N ATOM 2006 CA ILE A 127 14.001 -0.613 9.183 1.00 0.00 C ATOM 2007 C ILE A 127 14.705 -1.528 10.177 1.00 0.00 C ATOM 2008 O ILE A 127 15.949 -1.622 10.120 1.00 0.00 O ATOM 2009 CB ILE A 127 12.991 0.296 9.912 1.00 0.00 C ATOM 2010 CG1 ILE A 127 11.612 -0.360 9.954 1.00 0.00 C ATOM 2011 CG2 ILE A 127 12.948 1.663 9.266 1.00 0.00 C ATOM 2012 CD1 ILE A 127 10.607 0.313 9.078 1.00 0.00 C ATOM 2013 OXT ILE A 127 14.012 -2.184 10.980 1.00 0.00 O ATOM 0 H ILE A 127 12.513 -1.865 8.451 1.00 0.00 H new ATOM 0 HA ILE A 127 14.734 0.036 8.704 1.00 0.00 H new ATOM 0 HB ILE A 127 13.317 0.432 10.943 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.705 -1.403 9.652 1.00 0.00 H new ATOM 0 HG13 ILE A 127 11.248 -0.357 10.981 1.00 0.00 H new ATOM 0 HG21 ILE A 127 12.230 2.292 9.793 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.936 2.120 9.316 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.646 1.563 8.223 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.651 -0.205 9.157 1.00 0.00 H new ATOM 0 HD12 ILE A 127 10.485 1.349 9.393 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.950 0.286 8.044 1.00 0.00 H new