USER MOD reduce.3.24.130724 H: found=0, std=0, add=1174, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1174 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 3 LYS NZ :NH3+ 159:sc= 2 (180deg=0.124) USER MOD Set 1.2: A 18 GLN : amide:sc= -0.255 K(o=1.7,f=-7.7!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 159:sc= 1.09 (180deg=0.799) USER MOD Single : A 9 TYR OH : rot 180:sc= -0.85 USER MOD Single : A 11 ASN : amide:sc= -0.075 K(o=-0.075,f=-1) USER MOD Single : A 15 LYS NZ :NH3+ 177:sc= 0.958 (180deg=0.843) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 174:sc= 1.24 (180deg=1.05) USER MOD Single : A 31 LYS NZ :NH3+ -136:sc= -0.395 (180deg=-0.845!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -156:sc= 1.25 (180deg=0.54) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl -163:sc= -0.074 (180deg=-0.476) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0.00924 USER MOD Single : A 64 HIS : no HD1:sc= -0.217 K(o=-0.22,f=-0.93) USER MOD Single : A 65 HIS : no HE2:sc= 1.02 K(o=1,f=-3.1!) USER MOD Single : A 66 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 67 HIS : no HD1:sc=-0.00396 X(o=-0.004,f=-0.004) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 69 HIS : no HD1:sc= -0.0482 X(o=-0.048,f=-0.27) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 144:sc= 0.0102 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ 176:sc= 0.652 (180deg=0.642) USER MOD Single : B 9 TYR OH : rot 180:sc= 0 USER MOD Single : B 11 ASN : amide:sc= 0.0815 X(o=0.081,f=0) USER MOD Single : B 15 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0215) USER MOD Single : B 18 GLN : amide:sc= 0.92 K(o=0.92,f=-1.4) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 23 LYS NZ :NH3+ -161:sc= 1.11 (180deg=0.785) USER MOD Single : B 29 LYS NZ :NH3+ -143:sc= 1.02 (180deg=-1.67!) USER MOD Single : B 31 LYS NZ :NH3+ -175:sc= -0.1 (180deg=-0.138) USER MOD Single : B 35 LYS NZ :NH3+ -140:sc= -2.02! (180deg=-4.85!) USER MOD Single : B 46 SER OG : rot 180:sc= 0.0788 USER MOD Single : B 51 LYS NZ :NH3+ 162:sc= 0.824 (180deg=0.554) USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 THR OG1 : rot 180:sc= -0.0217 USER MOD Single : B 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0.378 USER MOD Single : B 61 SER OG : rot 180:sc= 0.0315 USER MOD Single : B 64 HIS : no HE2:sc= 0.148 K(o=0.15,f=-1.7!) USER MOD Single : B 65 HIS : no HD1:sc= 0 X(o=0,f=-0.018) USER MOD Single : B 66 HIS : no HD1:sc= -1.16 K(o=-1.2,f=0.31) USER MOD Single : B 67 HIS : no HD1:sc= 0 X(o=0,f=-0.0071) USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.182 7.479 -2.131 1.00 0.00 N ATOM 2 CA MET A 1 -1.031 7.822 -0.960 1.00 0.00 C ATOM 3 C MET A 1 -1.841 6.602 -0.540 1.00 0.00 C ATOM 4 O MET A 1 -2.755 6.178 -1.246 1.00 0.00 O ATOM 5 CB MET A 1 -1.950 9.010 -1.281 1.00 0.00 C ATOM 6 CG MET A 1 -1.219 10.344 -1.341 1.00 0.00 C ATOM 7 SD MET A 1 0.148 10.344 -2.529 1.00 0.00 S ATOM 8 CE MET A 1 0.811 11.986 -2.294 1.00 0.00 C ATOM 0 H1 MET A 1 0.087 8.350 -2.631 1.00 0.00 H new ATOM 0 H2 MET A 1 0.675 6.987 -1.806 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.713 6.860 -2.776 1.00 0.00 H new ATOM 0 HA MET A 1 -0.388 8.119 -0.131 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.442 8.831 -2.237 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.734 9.068 -0.525 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.927 11.129 -1.609 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.833 10.586 -0.351 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.661 12.134 -2.960 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.042 12.725 -2.519 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.135 12.103 -1.260 1.00 0.00 H new ATOM 20 N PRO A 2 -1.500 6.018 0.619 1.00 0.00 N ATOM 21 CA PRO A 2 -1.975 4.701 1.015 1.00 0.00 C ATOM 22 C PRO A 2 -3.241 4.684 1.872 1.00 0.00 C ATOM 23 O PRO A 2 -3.223 5.046 3.046 1.00 0.00 O ATOM 24 CB PRO A 2 -0.799 4.168 1.825 1.00 0.00 C ATOM 25 CG PRO A 2 -0.123 5.374 2.405 1.00 0.00 C ATOM 26 CD PRO A 2 -0.601 6.582 1.633 1.00 0.00 C ATOM 0 HA PRO A 2 -2.263 4.120 0.139 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -1.139 3.494 2.611 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -0.114 3.601 1.194 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -0.364 5.476 3.463 1.00 0.00 H new ATOM 0 HG3 PRO A 2 0.960 5.277 2.333 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -1.121 7.289 2.279 1.00 0.00 H new ATOM 0 HD3 PRO A 2 0.230 7.119 1.176 1.00 0.00 H new ATOM 34 N LYS A 3 -4.330 4.251 1.265 1.00 0.00 N ATOM 35 CA LYS A 3 -5.501 3.807 2.003 1.00 0.00 C ATOM 36 C LYS A 3 -5.736 2.365 1.613 1.00 0.00 C ATOM 37 O LYS A 3 -5.259 1.943 0.563 1.00 0.00 O ATOM 38 CB LYS A 3 -6.734 4.650 1.666 1.00 0.00 C ATOM 39 CG LYS A 3 -7.945 4.345 2.540 1.00 0.00 C ATOM 40 CD LYS A 3 -9.202 5.056 2.053 1.00 0.00 C ATOM 41 CE LYS A 3 -9.796 4.386 0.822 1.00 0.00 C ATOM 42 NZ LYS A 3 -10.336 3.035 1.130 1.00 0.00 N ATOM 0 H LYS A 3 -4.429 4.197 0.251 1.00 0.00 H new ATOM 0 HA LYS A 3 -5.332 3.913 3.075 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -6.480 5.705 1.768 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -7.001 4.486 0.622 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -8.120 3.269 2.552 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -7.735 4.645 3.566 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -9.943 5.069 2.852 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -8.964 6.094 1.821 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -10.592 5.011 0.417 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -9.031 4.304 0.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -11.026 2.762 0.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -9.558 2.345 1.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -10.802 3.051 2.059 1.00 0.00 H new ATOM 56 N ILE A 4 -6.442 1.603 2.425 1.00 0.00 N ATOM 57 CA ILE A 4 -6.648 0.220 2.102 1.00 0.00 C ATOM 58 C ILE A 4 -7.589 0.086 0.914 1.00 0.00 C ATOM 59 O ILE A 4 -8.671 0.684 0.882 1.00 0.00 O ATOM 60 CB ILE A 4 -7.177 -0.594 3.294 1.00 0.00 C ATOM 61 CG1 ILE A 4 -8.629 -0.250 3.632 1.00 0.00 C ATOM 62 CG2 ILE A 4 -6.291 -0.401 4.517 1.00 0.00 C ATOM 63 CD1 ILE A 4 -8.840 1.065 4.368 1.00 0.00 C ATOM 0 H ILE A 4 -6.872 1.917 3.295 1.00 0.00 H new ATOM 0 HA ILE A 4 -5.673 -0.192 1.841 1.00 0.00 H new ATOM 0 HB ILE A 4 -7.150 -1.643 2.998 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -9.202 -0.223 2.705 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -9.042 -1.056 4.239 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -6.685 -0.986 5.348 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.278 -0.732 4.288 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -6.275 0.654 4.792 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -9.904 1.209 4.557 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -8.303 1.042 5.316 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -8.465 1.887 3.759 1.00 0.00 H new ATOM 75 N ILE A 5 -7.144 -0.651 -0.085 1.00 0.00 N ATOM 76 CA ILE A 5 -7.953 -0.912 -1.252 1.00 0.00 C ATOM 77 C ILE A 5 -8.454 -2.336 -1.198 1.00 0.00 C ATOM 78 O ILE A 5 -7.820 -3.196 -0.596 1.00 0.00 O ATOM 79 CB ILE A 5 -7.155 -0.744 -2.559 1.00 0.00 C ATOM 80 CG1 ILE A 5 -6.175 0.421 -2.460 1.00 0.00 C ATOM 81 CG2 ILE A 5 -8.104 -0.531 -3.725 1.00 0.00 C ATOM 82 CD1 ILE A 5 -5.288 0.554 -3.674 1.00 0.00 C ATOM 0 H ILE A 5 -6.219 -1.081 -0.108 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.774 -0.195 -1.247 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.581 -1.655 -2.726 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -6.733 1.347 -2.322 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -5.552 0.290 -1.575 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.530 -0.413 -4.644 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.765 -1.392 -3.818 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -8.699 0.366 -3.551 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -4.614 1.401 -3.541 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -4.704 -0.358 -3.800 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.904 0.716 -4.559 1.00 0.00 H new ATOM 94 N GLU A 6 -9.588 -2.579 -1.817 1.00 0.00 N ATOM 95 CA GLU A 6 -10.099 -3.914 -1.958 1.00 0.00 C ATOM 96 C GLU A 6 -10.066 -4.299 -3.427 1.00 0.00 C ATOM 97 O GLU A 6 -10.817 -3.762 -4.233 1.00 0.00 O ATOM 98 CB GLU A 6 -11.521 -3.985 -1.423 1.00 0.00 C ATOM 99 CG GLU A 6 -11.687 -3.411 -0.028 1.00 0.00 C ATOM 100 CD GLU A 6 -13.122 -3.458 0.441 1.00 0.00 C ATOM 101 OE1 GLU A 6 -13.606 -4.570 0.727 1.00 0.00 O ATOM 102 OE2 GLU A 6 -13.762 -2.395 0.537 1.00 0.00 O ATOM 0 H GLU A 6 -10.176 -1.857 -2.233 1.00 0.00 H new ATOM 0 HA GLU A 6 -9.483 -4.609 -1.387 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -12.182 -3.450 -2.105 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -11.844 -5.026 -1.417 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -11.060 -3.967 0.669 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -11.337 -2.379 -0.018 1.00 0.00 H new ATOM 109 N ALA A 7 -9.157 -5.183 -3.769 1.00 0.00 N ATOM 110 CA ALA A 7 -8.991 -5.626 -5.140 1.00 0.00 C ATOM 111 C ALA A 7 -9.443 -7.069 -5.289 1.00 0.00 C ATOM 112 O ALA A 7 -9.678 -7.763 -4.295 1.00 0.00 O ATOM 113 CB ALA A 7 -7.533 -5.488 -5.554 1.00 0.00 C ATOM 0 H ALA A 7 -8.512 -5.616 -3.109 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.606 -5.002 -5.788 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -7.414 -5.822 -6.585 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -7.229 -4.444 -5.474 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -6.910 -6.099 -4.901 1.00 0.00 H new ATOM 119 N VAL A 8 -9.590 -7.503 -6.528 1.00 0.00 N ATOM 120 CA VAL A 8 -9.884 -8.879 -6.832 1.00 0.00 C ATOM 121 C VAL A 8 -8.763 -9.501 -7.659 1.00 0.00 C ATOM 122 O VAL A 8 -8.451 -9.044 -8.764 1.00 0.00 O ATOM 123 CB VAL A 8 -11.226 -9.018 -7.579 1.00 0.00 C ATOM 124 CG1 VAL A 8 -12.396 -8.864 -6.622 1.00 0.00 C ATOM 125 CG2 VAL A 8 -11.333 -8.009 -8.711 1.00 0.00 C ATOM 0 H VAL A 8 -9.507 -6.904 -7.349 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.964 -9.411 -5.884 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.261 -10.018 -8.011 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.332 -8.966 -7.172 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -12.341 -9.635 -5.853 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.356 -7.881 -6.153 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -12.290 -8.132 -9.219 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.264 -6.999 -8.306 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -10.522 -8.171 -9.421 1.00 0.00 H new ATOM 135 N TYR A 9 -8.128 -10.511 -7.088 1.00 0.00 N ATOM 136 CA TYR A 9 -7.117 -11.292 -7.790 1.00 0.00 C ATOM 137 C TYR A 9 -7.766 -12.131 -8.849 1.00 0.00 C ATOM 138 O TYR A 9 -8.587 -12.992 -8.573 1.00 0.00 O ATOM 139 CB TYR A 9 -6.345 -12.174 -6.802 1.00 0.00 C ATOM 140 CG TYR A 9 -5.266 -13.032 -7.426 1.00 0.00 C ATOM 141 CD1 TYR A 9 -4.127 -12.458 -7.961 1.00 0.00 C ATOM 142 CD2 TYR A 9 -5.383 -14.416 -7.471 1.00 0.00 C ATOM 143 CE1 TYR A 9 -3.131 -13.227 -8.519 1.00 0.00 C ATOM 144 CE2 TYR A 9 -4.389 -15.199 -8.026 1.00 0.00 C ATOM 145 CZ TYR A 9 -3.264 -14.597 -8.552 1.00 0.00 C ATOM 146 OH TYR A 9 -2.261 -15.366 -9.098 1.00 0.00 O ATOM 0 H TYR A 9 -8.296 -10.814 -6.129 1.00 0.00 H new ATOM 0 HA TYR A 9 -6.410 -10.612 -8.266 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -5.889 -11.535 -6.046 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -7.053 -12.823 -6.286 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -4.017 -11.384 -7.941 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -6.266 -14.888 -7.065 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -2.249 -12.758 -8.929 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -4.492 -16.274 -8.048 1.00 0.00 H new ATOM 0 HH TYR A 9 -2.508 -16.313 -9.043 1.00 0.00 H new ATOM 156 N GLU A 10 -7.399 -11.780 -10.056 1.00 0.00 N ATOM 157 CA GLU A 10 -7.698 -12.502 -11.260 1.00 0.00 C ATOM 158 C GLU A 10 -6.600 -13.517 -11.462 1.00 0.00 C ATOM 159 O GLU A 10 -5.819 -13.746 -10.548 1.00 0.00 O ATOM 160 CB GLU A 10 -7.824 -11.525 -12.437 1.00 0.00 C ATOM 161 CG GLU A 10 -8.795 -11.962 -13.524 1.00 0.00 C ATOM 162 CD GLU A 10 -9.116 -10.840 -14.498 1.00 0.00 C ATOM 163 OE1 GLU A 10 -8.290 -10.561 -15.388 1.00 0.00 O ATOM 164 OE2 GLU A 10 -10.191 -10.212 -14.360 1.00 0.00 O ATOM 0 H GLU A 10 -6.854 -10.936 -10.231 1.00 0.00 H new ATOM 0 HA GLU A 10 -8.652 -13.024 -11.191 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -8.141 -10.555 -12.054 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -6.839 -11.385 -12.883 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -8.370 -12.804 -14.071 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -9.718 -12.315 -13.063 1.00 0.00 H new ATOM 171 N ASN A 11 -6.586 -14.156 -12.612 1.00 0.00 N ATOM 172 CA ASN A 11 -5.719 -15.297 -12.895 1.00 0.00 C ATOM 173 C ASN A 11 -4.249 -14.902 -12.946 1.00 0.00 C ATOM 174 O ASN A 11 -3.522 -15.245 -13.879 1.00 0.00 O ATOM 175 CB ASN A 11 -6.100 -15.796 -14.260 1.00 0.00 C ATOM 176 CG ASN A 11 -6.066 -17.307 -14.381 1.00 0.00 C ATOM 177 OD1 ASN A 11 -6.319 -18.030 -13.419 1.00 0.00 O ATOM 178 ND2 ASN A 11 -5.745 -17.792 -15.568 1.00 0.00 N ATOM 0 H ASN A 11 -7.185 -13.898 -13.396 1.00 0.00 H new ATOM 0 HA ASN A 11 -5.843 -16.041 -12.109 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -7.102 -15.442 -14.501 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -5.424 -15.365 -14.998 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -5.700 -18.801 -15.712 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -5.542 -17.157 -16.340 1.00 0.00 H new ATOM 185 N GLY A 12 -3.830 -14.196 -11.930 1.00 0.00 N ATOM 186 CA GLY A 12 -2.474 -13.710 -11.841 1.00 0.00 C ATOM 187 C GLY A 12 -2.471 -12.205 -11.773 1.00 0.00 C ATOM 188 O GLY A 12 -1.422 -11.560 -11.786 1.00 0.00 O ATOM 0 H GLY A 12 -4.419 -13.940 -11.137 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -1.988 -14.123 -10.957 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -1.901 -14.045 -12.706 1.00 0.00 H new ATOM 192 N VAL A 13 -3.673 -11.646 -11.711 1.00 0.00 N ATOM 193 CA VAL A 13 -3.844 -10.199 -11.746 1.00 0.00 C ATOM 194 C VAL A 13 -4.469 -9.686 -10.460 1.00 0.00 C ATOM 195 O VAL A 13 -5.159 -10.421 -9.777 1.00 0.00 O ATOM 196 CB VAL A 13 -4.791 -9.801 -12.880 1.00 0.00 C ATOM 197 CG1 VAL A 13 -4.555 -8.359 -13.294 1.00 0.00 C ATOM 198 CG2 VAL A 13 -4.653 -10.743 -14.072 1.00 0.00 C ATOM 0 H VAL A 13 -4.544 -12.172 -11.636 1.00 0.00 H new ATOM 0 HA VAL A 13 -2.852 -9.770 -11.887 1.00 0.00 H new ATOM 0 HB VAL A 13 -5.813 -9.886 -12.510 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -5.238 -8.096 -14.101 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.730 -7.702 -12.442 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -3.527 -8.242 -13.636 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.339 -10.434 -14.861 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -3.630 -10.709 -14.446 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -4.892 -11.760 -13.761 1.00 0.00 H new ATOM 208 N PHE A 14 -4.236 -8.431 -10.125 1.00 0.00 N ATOM 209 CA PHE A 14 -5.044 -7.779 -9.117 1.00 0.00 C ATOM 210 C PHE A 14 -5.692 -6.519 -9.690 1.00 0.00 C ATOM 211 O PHE A 14 -5.009 -5.600 -10.137 1.00 0.00 O ATOM 212 CB PHE A 14 -4.209 -7.419 -7.896 1.00 0.00 C ATOM 213 CG PHE A 14 -3.787 -8.587 -7.050 1.00 0.00 C ATOM 214 CD1 PHE A 14 -4.614 -9.061 -6.044 1.00 0.00 C ATOM 215 CD2 PHE A 14 -2.560 -9.200 -7.248 1.00 0.00 C ATOM 216 CE1 PHE A 14 -4.225 -10.123 -5.250 1.00 0.00 C ATOM 217 CE2 PHE A 14 -2.168 -10.264 -6.460 1.00 0.00 C ATOM 218 CZ PHE A 14 -3.001 -10.726 -5.459 1.00 0.00 C ATOM 0 H PHE A 14 -3.503 -7.850 -10.531 1.00 0.00 H new ATOM 0 HA PHE A 14 -5.824 -8.476 -8.809 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.317 -6.889 -8.228 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.779 -6.727 -7.276 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -5.574 -8.595 -5.879 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -1.903 -8.842 -8.027 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -4.878 -10.481 -4.467 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -1.210 -10.735 -6.626 1.00 0.00 H new ATOM 0 HZ PHE A 14 -2.695 -11.557 -4.841 1.00 0.00 H new ATOM 228 N LYS A 15 -7.011 -6.494 -9.697 1.00 0.00 N ATOM 229 CA LYS A 15 -7.754 -5.300 -10.077 1.00 0.00 C ATOM 230 C LYS A 15 -8.507 -4.778 -8.879 1.00 0.00 C ATOM 231 O LYS A 15 -9.322 -5.497 -8.311 1.00 0.00 O ATOM 232 CB LYS A 15 -8.767 -5.588 -11.180 1.00 0.00 C ATOM 233 CG LYS A 15 -8.245 -5.354 -12.588 1.00 0.00 C ATOM 234 CD LYS A 15 -7.415 -6.517 -13.092 1.00 0.00 C ATOM 235 CE LYS A 15 -8.237 -7.791 -13.196 1.00 0.00 C ATOM 236 NZ LYS A 15 -9.392 -7.645 -14.127 1.00 0.00 N ATOM 0 H LYS A 15 -7.596 -7.290 -9.443 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.033 -4.569 -10.443 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -9.094 -6.624 -11.094 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -9.645 -4.962 -11.022 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -9.085 -5.191 -13.263 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -7.642 -4.446 -12.604 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -7.000 -6.271 -14.069 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -6.573 -6.681 -12.420 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -7.599 -8.606 -13.538 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -8.603 -8.066 -12.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -9.893 -8.553 -14.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -10.043 -6.921 -13.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -9.047 -7.359 -15.066 1.00 0.00 H new ATOM 250 N PRO A 16 -8.258 -3.540 -8.461 1.00 0.00 N ATOM 251 CA PRO A 16 -8.969 -2.974 -7.335 1.00 0.00 C ATOM 252 C PRO A 16 -10.442 -2.771 -7.659 1.00 0.00 C ATOM 253 O PRO A 16 -10.859 -2.837 -8.815 1.00 0.00 O ATOM 254 CB PRO A 16 -8.265 -1.627 -7.082 1.00 0.00 C ATOM 255 CG PRO A 16 -7.051 -1.617 -7.959 1.00 0.00 C ATOM 256 CD PRO A 16 -7.281 -2.627 -9.039 1.00 0.00 C ATOM 0 HA PRO A 16 -8.948 -3.625 -6.461 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.924 -0.793 -7.321 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -7.988 -1.524 -6.033 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -6.892 -0.627 -8.385 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.158 -1.864 -7.384 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -7.659 -2.160 -9.949 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -6.359 -3.144 -9.305 1.00 0.00 H new ATOM 264 N LEU A 17 -11.210 -2.505 -6.629 1.00 0.00 N ATOM 265 CA LEU A 17 -12.624 -2.189 -6.777 1.00 0.00 C ATOM 266 C LEU A 17 -12.818 -0.738 -6.399 1.00 0.00 C ATOM 267 O LEU A 17 -13.916 -0.183 -6.461 1.00 0.00 O ATOM 268 CB LEU A 17 -13.487 -3.093 -5.889 1.00 0.00 C ATOM 269 CG LEU A 17 -13.350 -4.594 -6.157 1.00 0.00 C ATOM 270 CD1 LEU A 17 -14.219 -5.387 -5.196 1.00 0.00 C ATOM 271 CD2 LEU A 17 -13.720 -4.915 -7.599 1.00 0.00 C ATOM 0 H LEU A 17 -10.880 -2.500 -5.664 1.00 0.00 H new ATOM 0 HA LEU A 17 -12.934 -2.359 -7.808 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -13.232 -2.902 -4.847 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -14.532 -2.811 -6.018 1.00 0.00 H new ATOM 0 HG LEU A 17 -12.310 -4.879 -5.997 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -14.109 -6.452 -5.401 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -13.910 -5.181 -4.171 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -15.262 -5.098 -5.326 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -13.617 -5.986 -7.771 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -14.751 -4.615 -7.785 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -13.057 -4.373 -8.274 1.00 0.00 H new ATOM 283 N GLN A 18 -11.712 -0.150 -5.988 1.00 0.00 N ATOM 284 CA GLN A 18 -11.656 1.257 -5.640 1.00 0.00 C ATOM 285 C GLN A 18 -10.671 1.967 -6.544 1.00 0.00 C ATOM 286 O GLN A 18 -9.649 1.393 -6.924 1.00 0.00 O ATOM 287 CB GLN A 18 -11.227 1.436 -4.183 1.00 0.00 C ATOM 288 CG GLN A 18 -12.313 1.126 -3.171 1.00 0.00 C ATOM 289 CD GLN A 18 -11.773 0.986 -1.763 1.00 0.00 C ATOM 290 OE1 GLN A 18 -11.603 1.971 -1.041 1.00 0.00 O ATOM 291 NE2 GLN A 18 -11.540 -0.248 -1.347 1.00 0.00 N ATOM 0 H GLN A 18 -10.822 -0.637 -5.885 1.00 0.00 H new ATOM 0 HA GLN A 18 -12.650 1.685 -5.769 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -10.369 0.792 -3.987 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.894 2.464 -4.038 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -13.061 1.918 -3.192 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -12.818 0.203 -3.456 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -11.694 -1.036 -1.976 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.207 -0.412 -0.397 1.00 0.00 H new ATOM 300 N LYS A 19 -10.981 3.200 -6.896 1.00 0.00 N ATOM 301 CA LYS A 19 -10.046 4.017 -7.634 1.00 0.00 C ATOM 302 C LYS A 19 -8.979 4.495 -6.682 1.00 0.00 C ATOM 303 O LYS A 19 -9.263 4.820 -5.528 1.00 0.00 O ATOM 304 CB LYS A 19 -10.728 5.212 -8.291 1.00 0.00 C ATOM 305 CG LYS A 19 -11.779 4.828 -9.310 1.00 0.00 C ATOM 306 CD LYS A 19 -12.310 6.050 -10.034 1.00 0.00 C ATOM 307 CE LYS A 19 -13.620 5.756 -10.746 1.00 0.00 C ATOM 308 NZ LYS A 19 -14.050 6.891 -11.605 1.00 0.00 N ATOM 0 H LYS A 19 -11.869 3.653 -6.683 1.00 0.00 H new ATOM 0 HA LYS A 19 -9.612 3.416 -8.433 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -11.191 5.825 -7.518 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -9.972 5.829 -8.777 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -11.353 4.131 -10.031 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -12.600 4.311 -8.813 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -12.458 6.860 -9.320 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -11.571 6.394 -10.758 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -13.508 4.860 -11.357 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -14.395 5.545 -10.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -14.947 6.651 -12.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -14.181 7.740 -11.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -13.323 7.077 -12.325 1.00 0.00 H new ATOM 322 N VAL A 20 -7.760 4.530 -7.152 1.00 0.00 N ATOM 323 CA VAL A 20 -6.649 4.816 -6.271 1.00 0.00 C ATOM 324 C VAL A 20 -5.719 5.856 -6.851 1.00 0.00 C ATOM 325 O VAL A 20 -5.721 6.132 -8.049 1.00 0.00 O ATOM 326 CB VAL A 20 -5.859 3.533 -5.925 1.00 0.00 C ATOM 327 CG1 VAL A 20 -4.928 3.099 -7.047 1.00 0.00 C ATOM 328 CG2 VAL A 20 -5.115 3.688 -4.619 1.00 0.00 C ATOM 0 H VAL A 20 -7.509 4.367 -8.127 1.00 0.00 H new ATOM 0 HA VAL A 20 -7.077 5.221 -5.354 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.591 2.734 -5.805 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -4.398 2.194 -6.751 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.510 2.901 -7.947 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -4.207 3.891 -7.249 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -4.568 2.771 -4.401 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -4.414 4.519 -4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -5.826 3.886 -3.817 1.00 0.00 H new ATOM 338 N ASP A 21 -4.931 6.419 -5.962 1.00 0.00 N ATOM 339 CA ASP A 21 -3.971 7.448 -6.307 1.00 0.00 C ATOM 340 C ASP A 21 -2.575 6.849 -6.307 1.00 0.00 C ATOM 341 O ASP A 21 -1.558 7.541 -6.352 1.00 0.00 O ATOM 342 CB ASP A 21 -4.097 8.590 -5.306 1.00 0.00 C ATOM 343 CG ASP A 21 -3.114 9.719 -5.543 1.00 0.00 C ATOM 344 OD1 ASP A 21 -3.118 10.310 -6.647 1.00 0.00 O ATOM 345 OD2 ASP A 21 -2.333 10.025 -4.618 1.00 0.00 O ATOM 0 H ASP A 21 -4.937 6.175 -4.972 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.165 7.844 -7.304 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.111 8.988 -5.348 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.950 8.197 -4.300 1.00 0.00 H new ATOM 350 N LEU A 22 -2.551 5.534 -6.270 1.00 0.00 N ATOM 351 CA LEU A 22 -1.320 4.787 -6.429 1.00 0.00 C ATOM 352 C LEU A 22 -0.799 4.969 -7.839 1.00 0.00 C ATOM 353 O LEU A 22 -1.554 4.917 -8.813 1.00 0.00 O ATOM 354 CB LEU A 22 -1.536 3.301 -6.136 1.00 0.00 C ATOM 355 CG LEU A 22 -1.248 2.850 -4.701 1.00 0.00 C ATOM 356 CD1 LEU A 22 -1.962 3.723 -3.681 1.00 0.00 C ATOM 357 CD2 LEU A 22 -1.649 1.395 -4.521 1.00 0.00 C ATOM 0 H LEU A 22 -3.379 4.955 -6.130 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.588 5.167 -5.716 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -2.570 3.051 -6.374 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -0.905 2.723 -6.811 1.00 0.00 H new ATOM 0 HG LEU A 22 -0.177 2.953 -4.529 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.732 3.370 -2.676 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -1.629 4.755 -3.789 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.038 3.670 -3.847 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.440 1.084 -3.497 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -2.714 1.283 -4.724 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -1.081 0.773 -5.212 1.00 0.00 H new ATOM 369 N LYS A 23 0.484 5.199 -7.934 1.00 0.00 N ATOM 370 CA LYS A 23 1.110 5.474 -9.203 1.00 0.00 C ATOM 371 C LYS A 23 1.657 4.196 -9.815 1.00 0.00 C ATOM 372 O LYS A 23 1.398 3.100 -9.317 1.00 0.00 O ATOM 373 CB LYS A 23 2.216 6.514 -9.026 1.00 0.00 C ATOM 374 CG LYS A 23 1.726 7.903 -8.617 1.00 0.00 C ATOM 375 CD LYS A 23 0.923 8.582 -9.726 1.00 0.00 C ATOM 376 CE LYS A 23 -0.501 8.041 -9.837 1.00 0.00 C ATOM 377 NZ LYS A 23 -1.235 8.627 -10.994 1.00 0.00 N ATOM 0 H LYS A 23 1.123 5.201 -7.139 1.00 0.00 H new ATOM 0 HA LYS A 23 0.363 5.879 -9.886 1.00 0.00 H new ATOM 0 HB2 LYS A 23 2.917 6.154 -8.273 1.00 0.00 H new ATOM 0 HB3 LYS A 23 2.769 6.599 -9.961 1.00 0.00 H new ATOM 0 HG2 LYS A 23 1.109 7.820 -7.723 1.00 0.00 H new ATOM 0 HG3 LYS A 23 2.582 8.526 -8.357 1.00 0.00 H new ATOM 0 HD2 LYS A 23 0.886 9.655 -9.538 1.00 0.00 H new ATOM 0 HD3 LYS A 23 1.436 8.443 -10.678 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -0.469 6.956 -9.940 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -1.043 8.258 -8.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -2.196 8.232 -11.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -1.289 9.660 -10.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -0.733 8.399 -11.876 1.00 0.00 H new ATOM 391 N GLU A 24 2.394 4.341 -10.905 1.00 0.00 N ATOM 392 CA GLU A 24 2.980 3.213 -11.587 1.00 0.00 C ATOM 393 C GLU A 24 3.941 2.500 -10.668 1.00 0.00 C ATOM 394 O GLU A 24 4.501 3.129 -9.766 1.00 0.00 O ATOM 395 CB GLU A 24 3.671 3.673 -12.868 1.00 0.00 C ATOM 396 CG GLU A 24 2.715 4.088 -13.981 1.00 0.00 C ATOM 397 CD GLU A 24 1.865 5.290 -13.618 1.00 0.00 C ATOM 398 OE1 GLU A 24 2.375 6.429 -13.681 1.00 0.00 O ATOM 399 OE2 GLU A 24 0.687 5.101 -13.251 1.00 0.00 O ATOM 0 H GLU A 24 2.598 5.243 -11.335 1.00 0.00 H new ATOM 0 HA GLU A 24 2.194 2.511 -11.866 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.324 4.514 -12.633 1.00 0.00 H new ATOM 0 HB3 GLU A 24 4.308 2.867 -13.233 1.00 0.00 H new ATOM 0 HG2 GLU A 24 3.289 4.315 -14.879 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.063 3.249 -14.223 1.00 0.00 H new ATOM 406 N GLY A 25 4.230 1.241 -11.020 1.00 0.00 N ATOM 407 CA GLY A 25 4.606 0.207 -10.065 1.00 0.00 C ATOM 408 C GLY A 25 5.093 0.734 -8.754 1.00 0.00 C ATOM 409 O GLY A 25 6.280 0.721 -8.421 1.00 0.00 O ATOM 0 H GLY A 25 4.207 0.915 -11.986 1.00 0.00 H new ATOM 0 HA2 GLY A 25 3.746 -0.439 -9.888 1.00 0.00 H new ATOM 0 HA3 GLY A 25 5.385 -0.414 -10.507 1.00 0.00 H new ATOM 413 N GLU A 26 4.105 1.231 -8.035 1.00 0.00 N ATOM 414 CA GLU A 26 4.240 1.625 -6.661 1.00 0.00 C ATOM 415 C GLU A 26 4.289 0.370 -5.798 1.00 0.00 C ATOM 416 O GLU A 26 3.677 -0.648 -6.149 1.00 0.00 O ATOM 417 CB GLU A 26 3.052 2.514 -6.283 1.00 0.00 C ATOM 418 CG GLU A 26 3.309 3.392 -5.082 1.00 0.00 C ATOM 419 CD GLU A 26 2.149 4.315 -4.760 1.00 0.00 C ATOM 420 OE1 GLU A 26 1.853 5.220 -5.575 1.00 0.00 O ATOM 421 OE2 GLU A 26 1.524 4.141 -3.695 1.00 0.00 O ATOM 0 H GLU A 26 3.166 1.372 -8.407 1.00 0.00 H new ATOM 0 HA GLU A 26 5.158 2.192 -6.503 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.796 3.144 -7.135 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.187 1.883 -6.082 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.515 2.762 -4.217 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.202 3.990 -5.261 1.00 0.00 H new ATOM 428 N ARG A 27 5.032 0.437 -4.701 1.00 0.00 N ATOM 429 CA ARG A 27 5.213 -0.716 -3.835 1.00 0.00 C ATOM 430 C ARG A 27 4.111 -0.775 -2.800 1.00 0.00 C ATOM 431 O ARG A 27 3.952 0.130 -1.974 1.00 0.00 O ATOM 432 CB ARG A 27 6.567 -0.661 -3.147 1.00 0.00 C ATOM 433 CG ARG A 27 6.941 -1.920 -2.383 1.00 0.00 C ATOM 434 CD ARG A 27 7.251 -3.072 -3.325 1.00 0.00 C ATOM 435 NE ARG A 27 7.751 -4.244 -2.610 1.00 0.00 N ATOM 436 CZ ARG A 27 8.556 -5.156 -3.150 1.00 0.00 C ATOM 437 NH1 ARG A 27 8.998 -5.015 -4.394 1.00 0.00 N ATOM 438 NH2 ARG A 27 8.944 -6.200 -2.438 1.00 0.00 N ATOM 0 H ARG A 27 5.518 1.279 -4.392 1.00 0.00 H new ATOM 0 HA ARG A 27 5.170 -1.615 -4.450 1.00 0.00 H new ATOM 0 HB2 ARG A 27 7.333 -0.466 -3.897 1.00 0.00 H new ATOM 0 HB3 ARG A 27 6.575 0.183 -2.457 1.00 0.00 H new ATOM 0 HG2 ARG A 27 7.808 -1.721 -1.753 1.00 0.00 H new ATOM 0 HG3 ARG A 27 6.123 -2.201 -1.720 1.00 0.00 H new ATOM 0 HD2 ARG A 27 6.351 -3.341 -3.877 1.00 0.00 H new ATOM 0 HD3 ARG A 27 7.991 -2.752 -4.058 1.00 0.00 H new ATOM 0 HE ARG A 27 7.466 -4.371 -1.639 1.00 0.00 H new ATOM 0 HH11 ARG A 27 8.721 -4.202 -4.945 1.00 0.00 H new ATOM 0 HH12 ARG A 27 9.615 -5.719 -4.799 1.00 0.00 H new ATOM 0 HH21 ARG A 27 8.626 -6.307 -1.475 1.00 0.00 H new ATOM 0 HH22 ARG A 27 9.561 -6.899 -2.852 1.00 0.00 H new ATOM 452 N VAL A 28 3.368 -1.856 -2.849 1.00 0.00 N ATOM 453 CA VAL A 28 2.191 -2.021 -2.001 1.00 0.00 C ATOM 454 C VAL A 28 2.020 -3.482 -1.565 1.00 0.00 C ATOM 455 O VAL A 28 2.413 -4.392 -2.295 1.00 0.00 O ATOM 456 CB VAL A 28 0.909 -1.522 -2.709 1.00 0.00 C ATOM 457 CG1 VAL A 28 0.249 -0.420 -1.900 1.00 0.00 C ATOM 458 CG2 VAL A 28 1.215 -1.021 -4.113 1.00 0.00 C ATOM 0 H VAL A 28 3.553 -2.645 -3.469 1.00 0.00 H new ATOM 0 HA VAL A 28 2.349 -1.411 -1.111 1.00 0.00 H new ATOM 0 HB VAL A 28 0.224 -2.366 -2.787 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.651 -0.081 -2.413 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -0.017 -0.802 -0.914 1.00 0.00 H new ATOM 0 HG13 VAL A 28 0.941 0.415 -1.791 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.295 -0.677 -4.585 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.925 -0.196 -4.058 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.645 -1.831 -4.703 1.00 0.00 H new ATOM 468 N LYS A 29 1.450 -3.703 -0.367 1.00 0.00 N ATOM 469 CA LYS A 29 1.292 -5.049 0.169 1.00 0.00 C ATOM 470 C LYS A 29 -0.167 -5.393 0.293 1.00 0.00 C ATOM 471 O LYS A 29 -0.997 -4.551 0.637 1.00 0.00 O ATOM 472 CB LYS A 29 1.935 -5.187 1.541 1.00 0.00 C ATOM 473 CG LYS A 29 3.440 -5.382 1.508 1.00 0.00 C ATOM 474 CD LYS A 29 3.854 -6.617 2.293 1.00 0.00 C ATOM 475 CE LYS A 29 5.362 -6.718 2.417 1.00 0.00 C ATOM 476 NZ LYS A 29 5.791 -8.066 2.879 1.00 0.00 N ATOM 0 H LYS A 29 1.095 -2.964 0.240 1.00 0.00 H new ATOM 0 HA LYS A 29 1.786 -5.729 -0.525 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.708 -4.296 2.127 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.482 -6.033 2.058 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.774 -5.476 0.475 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.932 -4.503 1.923 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.408 -6.584 3.287 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.468 -7.509 1.800 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.821 -6.502 1.452 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.720 -5.963 3.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.829 -8.128 2.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.458 -8.222 3.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.386 -8.792 2.254 1.00 0.00 H new ATOM 490 N ILE A 30 -0.459 -6.640 0.037 1.00 0.00 N ATOM 491 CA ILE A 30 -1.810 -7.136 0.108 1.00 0.00 C ATOM 492 C ILE A 30 -1.975 -8.003 1.319 1.00 0.00 C ATOM 493 O ILE A 30 -1.138 -8.850 1.609 1.00 0.00 O ATOM 494 CB ILE A 30 -2.182 -8.001 -1.100 1.00 0.00 C ATOM 495 CG1 ILE A 30 -1.446 -7.536 -2.352 1.00 0.00 C ATOM 496 CG2 ILE A 30 -3.680 -7.987 -1.309 1.00 0.00 C ATOM 497 CD1 ILE A 30 -1.862 -8.243 -3.617 1.00 0.00 C ATOM 0 H ILE A 30 0.232 -7.342 -0.227 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.453 -6.257 0.141 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.873 -9.027 -0.901 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.609 -6.466 -2.478 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.376 -7.681 -2.204 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.933 -8.605 -2.170 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.175 -8.381 -0.421 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -4.013 -6.964 -1.486 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -1.290 -7.851 -4.458 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -1.673 -9.312 -3.516 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -2.925 -8.078 -3.793 1.00 0.00 H new ATOM 509 N LYS A 31 -3.050 -7.793 2.012 1.00 0.00 N ATOM 510 CA LYS A 31 -3.469 -8.712 3.014 1.00 0.00 C ATOM 511 C LYS A 31 -4.668 -9.442 2.468 1.00 0.00 C ATOM 512 O LYS A 31 -5.490 -8.868 1.746 1.00 0.00 O ATOM 513 CB LYS A 31 -3.812 -8.020 4.324 1.00 0.00 C ATOM 514 CG LYS A 31 -5.221 -7.474 4.366 1.00 0.00 C ATOM 515 CD LYS A 31 -5.642 -7.116 5.776 1.00 0.00 C ATOM 516 CE LYS A 31 -5.641 -8.344 6.679 1.00 0.00 C ATOM 517 NZ LYS A 31 -6.631 -9.370 6.239 1.00 0.00 N ATOM 0 H LYS A 31 -3.658 -6.982 1.897 1.00 0.00 H new ATOM 0 HA LYS A 31 -2.656 -9.401 3.244 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.680 -8.726 5.144 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.109 -7.203 4.489 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -5.288 -6.591 3.731 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.910 -8.213 3.957 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -4.965 -6.363 6.180 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -6.638 -6.674 5.760 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -4.644 -8.785 6.689 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -5.865 -8.041 7.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -7.144 -9.735 7.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -7.306 -8.939 5.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -6.134 -10.152 5.767 1.00 0.00 H new ATOM 531 N LEU A 32 -4.764 -10.690 2.792 1.00 0.00 N ATOM 532 CA LEU A 32 -5.806 -11.519 2.279 1.00 0.00 C ATOM 533 C LEU A 32 -6.862 -11.651 3.348 1.00 0.00 C ATOM 534 O LEU A 32 -6.547 -11.950 4.500 1.00 0.00 O ATOM 535 CB LEU A 32 -5.186 -12.836 1.884 1.00 0.00 C ATOM 536 CG LEU A 32 -6.127 -13.904 1.396 1.00 0.00 C ATOM 537 CD1 LEU A 32 -7.056 -13.375 0.313 1.00 0.00 C ATOM 538 CD2 LEU A 32 -5.305 -15.067 0.882 1.00 0.00 C ATOM 0 H LEU A 32 -4.119 -11.166 3.423 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.290 -11.103 1.395 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -4.451 -12.646 1.102 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -4.642 -13.228 2.743 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.760 -14.232 2.221 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.722 -14.173 -0.017 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -7.647 -12.550 0.711 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.465 -13.023 -0.533 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -5.970 -15.852 0.523 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.668 -14.729 0.064 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.684 -15.458 1.688 1.00 0.00 H new ATOM 550 N GLU A 33 -8.103 -11.376 2.994 1.00 0.00 N ATOM 551 CA GLU A 33 -9.091 -11.108 4.012 1.00 0.00 C ATOM 552 C GLU A 33 -9.511 -12.345 4.784 1.00 0.00 C ATOM 553 O GLU A 33 -9.788 -13.409 4.227 1.00 0.00 O ATOM 554 CB GLU A 33 -10.299 -10.392 3.446 1.00 0.00 C ATOM 555 CG GLU A 33 -11.147 -9.738 4.519 1.00 0.00 C ATOM 556 CD GLU A 33 -10.356 -8.758 5.372 1.00 0.00 C ATOM 557 OE1 GLU A 33 -9.375 -9.179 6.033 1.00 0.00 O ATOM 558 OE2 GLU A 33 -10.704 -7.562 5.393 1.00 0.00 O ATOM 0 H GLU A 33 -8.442 -11.333 2.033 1.00 0.00 H new ATOM 0 HA GLU A 33 -8.602 -10.446 4.727 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -9.967 -9.633 2.738 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -10.910 -11.103 2.889 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -11.981 -9.215 4.050 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -11.574 -10.509 5.160 1.00 0.00 H new ATOM 565 N LEU A 34 -9.538 -12.156 6.087 1.00 0.00 N ATOM 566 CA LEU A 34 -9.891 -13.178 7.045 1.00 0.00 C ATOM 567 C LEU A 34 -10.366 -12.509 8.334 1.00 0.00 C ATOM 568 O LEU A 34 -10.387 -11.281 8.428 1.00 0.00 O ATOM 569 CB LEU A 34 -8.696 -14.076 7.348 1.00 0.00 C ATOM 570 CG LEU A 34 -7.666 -13.500 8.322 1.00 0.00 C ATOM 571 CD1 LEU A 34 -6.786 -14.607 8.878 1.00 0.00 C ATOM 572 CD2 LEU A 34 -6.808 -12.439 7.656 1.00 0.00 C ATOM 0 H LEU A 34 -9.308 -11.261 6.519 1.00 0.00 H new ATOM 0 HA LEU A 34 -10.686 -13.795 6.625 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -9.066 -15.018 7.753 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -8.192 -14.309 6.410 1.00 0.00 H new ATOM 0 HG LEU A 34 -8.210 -13.031 9.142 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -6.059 -14.181 9.569 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -7.405 -15.334 9.405 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -6.263 -15.101 8.060 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -6.087 -12.050 8.375 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -6.277 -12.878 6.811 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -7.443 -11.626 7.303 1.00 0.00 H new ATOM 584 N LYS A 35 -10.721 -13.305 9.327 1.00 0.00 N ATOM 585 CA LYS A 35 -11.060 -12.776 10.637 1.00 0.00 C ATOM 586 C LYS A 35 -10.218 -13.462 11.705 1.00 0.00 C ATOM 587 O LYS A 35 -9.692 -14.554 11.485 1.00 0.00 O ATOM 588 CB LYS A 35 -12.553 -12.962 10.919 1.00 0.00 C ATOM 589 CG LYS A 35 -13.033 -12.346 12.225 1.00 0.00 C ATOM 590 CD LYS A 35 -12.854 -10.836 12.233 1.00 0.00 C ATOM 591 CE LYS A 35 -13.357 -10.225 13.531 1.00 0.00 C ATOM 592 NZ LYS A 35 -13.153 -8.750 13.574 1.00 0.00 N ATOM 0 H LYS A 35 -10.782 -14.320 9.252 1.00 0.00 H new ATOM 0 HA LYS A 35 -10.844 -11.708 10.656 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -13.121 -12.527 10.097 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.777 -14.029 10.932 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -14.085 -12.589 12.377 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -12.481 -12.782 13.058 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -11.800 -10.592 12.099 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -13.392 -10.400 11.391 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -14.418 -10.447 13.648 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -12.840 -10.686 14.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -13.510 -8.376 14.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -12.139 -8.537 13.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -13.667 -8.305 12.787 1.00 0.00 H new ATOM 606 N VAL A 36 -10.085 -12.809 12.851 1.00 0.00 N ATOM 607 CA VAL A 36 -9.295 -13.347 13.953 1.00 0.00 C ATOM 608 C VAL A 36 -9.991 -14.567 14.538 1.00 0.00 C ATOM 609 O VAL A 36 -11.211 -14.571 14.722 1.00 0.00 O ATOM 610 CB VAL A 36 -9.071 -12.302 15.067 1.00 0.00 C ATOM 611 CG1 VAL A 36 -8.094 -12.821 16.110 1.00 0.00 C ATOM 612 CG2 VAL A 36 -8.583 -10.984 14.481 1.00 0.00 C ATOM 0 H VAL A 36 -10.514 -11.904 13.043 1.00 0.00 H new ATOM 0 HA VAL A 36 -8.320 -13.625 13.553 1.00 0.00 H new ATOM 0 HB VAL A 36 -10.027 -12.123 15.559 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -7.953 -12.066 16.884 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -8.491 -13.732 16.559 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -7.137 -13.038 15.636 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -8.432 -10.263 15.284 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -7.641 -11.146 13.956 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -9.326 -10.599 13.783 1.00 0.00 H new ATOM 622 N GLU A 37 -9.214 -15.596 14.821 1.00 0.00 N ATOM 623 CA GLU A 37 -9.743 -16.850 15.290 1.00 0.00 C ATOM 624 C GLU A 37 -9.749 -16.916 16.817 1.00 0.00 C ATOM 625 O GLU A 37 -8.807 -16.474 17.474 1.00 0.00 O ATOM 626 CB GLU A 37 -8.907 -17.987 14.721 1.00 0.00 C ATOM 627 CG GLU A 37 -7.441 -17.934 15.122 1.00 0.00 C ATOM 628 CD GLU A 37 -6.633 -19.065 14.528 1.00 0.00 C ATOM 629 OE1 GLU A 37 -7.057 -20.233 14.643 1.00 0.00 O ATOM 630 OE2 GLU A 37 -5.572 -18.791 13.931 1.00 0.00 O ATOM 0 H GLU A 37 -8.198 -15.579 14.730 1.00 0.00 H new ATOM 0 HA GLU A 37 -10.775 -16.941 14.952 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -9.330 -18.936 15.051 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -8.977 -17.968 13.633 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.015 -16.982 14.803 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.364 -17.970 16.209 1.00 0.00 H new ATOM 637 N PRO A 38 -10.832 -17.447 17.396 1.00 0.00 N ATOM 638 CA PRO A 38 -10.898 -17.743 18.822 1.00 0.00 C ATOM 639 C PRO A 38 -10.246 -19.089 19.123 1.00 0.00 C ATOM 640 O PRO A 38 -9.661 -19.709 18.236 1.00 0.00 O ATOM 641 CB PRO A 38 -12.402 -17.784 19.092 1.00 0.00 C ATOM 642 CG PRO A 38 -12.999 -18.265 17.814 1.00 0.00 C ATOM 643 CD PRO A 38 -12.096 -17.779 16.706 1.00 0.00 C ATOM 0 HA PRO A 38 -10.373 -17.017 19.443 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -12.639 -18.455 19.918 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -12.784 -16.799 19.362 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -13.072 -19.353 17.806 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -14.010 -17.877 17.688 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -11.947 -18.547 15.947 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -12.516 -16.909 16.201 1.00 0.00 H new ATOM 651 N ILE A 39 -10.333 -19.541 20.358 1.00 0.00 N ATOM 652 CA ILE A 39 -9.789 -20.830 20.722 1.00 0.00 C ATOM 653 C ILE A 39 -10.859 -21.726 21.336 1.00 0.00 C ATOM 654 O ILE A 39 -11.835 -21.242 21.917 1.00 0.00 O ATOM 655 CB ILE A 39 -8.592 -20.689 21.686 1.00 0.00 C ATOM 656 CG1 ILE A 39 -8.753 -19.497 22.638 1.00 0.00 C ATOM 657 CG2 ILE A 39 -7.292 -20.573 20.906 1.00 0.00 C ATOM 658 CD1 ILE A 39 -9.755 -19.723 23.752 1.00 0.00 C ATOM 0 H ILE A 39 -10.775 -19.034 21.125 1.00 0.00 H new ATOM 0 HA ILE A 39 -9.431 -21.298 19.805 1.00 0.00 H new ATOM 0 HB ILE A 39 -8.562 -21.591 22.298 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -7.783 -19.264 23.078 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -9.059 -18.624 22.061 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -6.458 -20.474 21.601 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -7.153 -21.466 20.296 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -7.332 -19.696 20.260 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.809 -18.833 24.379 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -10.737 -19.924 23.323 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -9.442 -20.574 24.356 1.00 0.00 H new ATOM 670 N ASP A 40 -10.690 -23.028 21.177 1.00 0.00 N ATOM 671 CA ASP A 40 -11.600 -23.986 21.784 1.00 0.00 C ATOM 672 C ASP A 40 -11.015 -24.453 23.105 1.00 0.00 C ATOM 673 O ASP A 40 -9.805 -24.646 23.214 1.00 0.00 O ATOM 674 CB ASP A 40 -11.840 -25.175 20.850 1.00 0.00 C ATOM 675 CG ASP A 40 -13.052 -25.999 21.252 1.00 0.00 C ATOM 676 OD1 ASP A 40 -14.186 -25.614 20.885 1.00 0.00 O ATOM 677 OD2 ASP A 40 -12.888 -27.038 21.923 1.00 0.00 O ATOM 0 H ASP A 40 -9.934 -23.445 20.635 1.00 0.00 H new ATOM 0 HA ASP A 40 -12.563 -23.507 21.961 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -11.975 -24.811 19.832 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -10.956 -25.813 20.846 1.00 0.00 H new ATOM 682 N LEU A 41 -11.862 -24.600 24.110 1.00 0.00 N ATOM 683 CA LEU A 41 -11.402 -24.930 25.452 1.00 0.00 C ATOM 684 C LEU A 41 -10.832 -26.348 25.500 1.00 0.00 C ATOM 685 O LEU A 41 -11.563 -27.334 25.375 1.00 0.00 O ATOM 686 CB LEU A 41 -12.555 -24.779 26.455 1.00 0.00 C ATOM 687 CG LEU A 41 -12.149 -24.458 27.900 1.00 0.00 C ATOM 688 CD1 LEU A 41 -13.367 -24.080 28.723 1.00 0.00 C ATOM 689 CD2 LEU A 41 -11.434 -25.632 28.549 1.00 0.00 C ATOM 0 H LEU A 41 -12.873 -24.496 24.024 1.00 0.00 H new ATOM 0 HA LEU A 41 -10.605 -24.238 25.724 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -13.218 -23.990 26.101 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -13.132 -25.704 26.457 1.00 0.00 H new ATOM 0 HG LEU A 41 -11.461 -23.613 27.868 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -13.060 -23.856 29.745 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -13.843 -23.202 28.286 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.073 -24.910 28.730 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.160 -25.371 29.571 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -12.094 -26.499 28.560 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.534 -25.869 27.982 1.00 0.00 H new ATOM 701 N GLY A 42 -9.521 -26.437 25.671 1.00 0.00 N ATOM 702 CA GLY A 42 -8.863 -27.720 25.813 1.00 0.00 C ATOM 703 C GLY A 42 -7.664 -27.628 26.727 1.00 0.00 C ATOM 704 O GLY A 42 -6.682 -26.956 26.416 1.00 0.00 O ATOM 0 H GLY A 42 -8.895 -25.633 25.714 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -9.569 -28.450 26.209 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -8.548 -28.079 24.833 1.00 0.00 H new ATOM 708 N GLU A 43 -7.748 -28.300 27.856 1.00 0.00 N ATOM 709 CA GLU A 43 -6.726 -28.234 28.876 1.00 0.00 C ATOM 710 C GLU A 43 -6.347 -29.634 29.342 1.00 0.00 C ATOM 711 O GLU A 43 -7.089 -30.588 29.109 1.00 0.00 O ATOM 712 CB GLU A 43 -7.262 -27.434 30.052 1.00 0.00 C ATOM 713 CG GLU A 43 -7.707 -26.029 29.690 1.00 0.00 C ATOM 714 CD GLU A 43 -8.360 -25.311 30.848 1.00 0.00 C ATOM 715 OE1 GLU A 43 -9.292 -25.879 31.455 1.00 0.00 O ATOM 716 OE2 GLU A 43 -7.960 -24.167 31.149 1.00 0.00 O ATOM 0 H GLU A 43 -8.531 -28.910 28.092 1.00 0.00 H new ATOM 0 HA GLU A 43 -5.837 -27.754 28.466 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -8.105 -27.970 30.489 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -6.490 -27.373 30.819 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -6.845 -25.455 29.351 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -8.407 -26.077 28.856 1.00 0.00 H new ATOM 723 N PRO A 44 -5.183 -29.786 29.991 1.00 0.00 N ATOM 724 CA PRO A 44 -4.783 -31.052 30.614 1.00 0.00 C ATOM 725 C PRO A 44 -5.654 -31.380 31.826 1.00 0.00 C ATOM 726 O PRO A 44 -6.366 -30.515 32.338 1.00 0.00 O ATOM 727 CB PRO A 44 -3.332 -30.809 31.052 1.00 0.00 C ATOM 728 CG PRO A 44 -2.903 -29.568 30.341 1.00 0.00 C ATOM 729 CD PRO A 44 -4.147 -28.754 30.145 1.00 0.00 C ATOM 0 HA PRO A 44 -4.890 -31.895 29.931 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -3.264 -30.685 32.133 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -2.695 -31.653 30.787 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -2.165 -29.019 30.926 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -2.438 -29.807 29.384 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -4.345 -28.104 30.998 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -4.078 -28.114 29.266 1.00 0.00 H new ATOM 737 N VAL A 45 -5.603 -32.623 32.284 1.00 0.00 N ATOM 738 CA VAL A 45 -6.410 -33.037 33.424 1.00 0.00 C ATOM 739 C VAL A 45 -5.543 -33.119 34.676 1.00 0.00 C ATOM 740 O VAL A 45 -4.352 -33.419 34.600 1.00 0.00 O ATOM 741 CB VAL A 45 -7.084 -34.406 33.188 1.00 0.00 C ATOM 742 CG1 VAL A 45 -8.246 -34.616 34.147 1.00 0.00 C ATOM 743 CG2 VAL A 45 -7.533 -34.553 31.738 1.00 0.00 C ATOM 0 H VAL A 45 -5.016 -33.357 31.888 1.00 0.00 H new ATOM 0 HA VAL A 45 -7.192 -32.289 33.554 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.345 -35.182 33.387 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -8.702 -35.588 33.959 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -7.882 -34.579 35.174 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -8.988 -33.832 33.997 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.004 -35.526 31.600 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.248 -33.766 31.497 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.668 -34.472 31.079 1.00 0.00 H new ATOM 753 N SER A 46 -6.147 -32.840 35.815 1.00 0.00 N ATOM 754 CA SER A 46 -5.459 -32.891 37.086 1.00 0.00 C ATOM 755 C SER A 46 -5.849 -34.157 37.843 1.00 0.00 C ATOM 756 O SER A 46 -6.696 -34.923 37.381 1.00 0.00 O ATOM 757 CB SER A 46 -5.816 -31.657 37.902 1.00 0.00 C ATOM 758 OG SER A 46 -5.488 -30.467 37.200 1.00 0.00 O ATOM 0 H SER A 46 -7.129 -32.572 35.883 1.00 0.00 H new ATOM 0 HA SER A 46 -4.383 -32.909 36.915 1.00 0.00 H new ATOM 0 HB2 SER A 46 -6.881 -31.665 38.132 1.00 0.00 H new ATOM 0 HB3 SER A 46 -5.284 -31.680 38.853 1.00 0.00 H new ATOM 0 HG SER A 46 -5.729 -29.689 37.745 1.00 0.00 H new ATOM 764 N VAL A 47 -5.245 -34.372 39.004 1.00 0.00 N ATOM 765 CA VAL A 47 -5.540 -35.547 39.809 1.00 0.00 C ATOM 766 C VAL A 47 -5.797 -35.144 41.260 1.00 0.00 C ATOM 767 O VAL A 47 -5.365 -34.077 41.698 1.00 0.00 O ATOM 768 CB VAL A 47 -4.381 -36.570 39.734 1.00 0.00 C ATOM 769 CG1 VAL A 47 -3.152 -36.069 40.479 1.00 0.00 C ATOM 770 CG2 VAL A 47 -4.813 -37.940 40.252 1.00 0.00 C ATOM 0 H VAL A 47 -4.548 -33.747 39.409 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.438 -36.018 39.410 1.00 0.00 H new ATOM 0 HB VAL A 47 -4.112 -36.681 38.683 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -2.356 -36.810 40.408 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -2.816 -35.131 40.037 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -3.403 -35.906 41.527 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.976 -38.635 40.185 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.130 -37.853 41.291 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.642 -38.312 39.650 1.00 0.00 H new ATOM 780 N GLU A 48 -6.518 -35.980 41.999 1.00 0.00 N ATOM 781 CA GLU A 48 -6.785 -35.712 43.403 1.00 0.00 C ATOM 782 C GLU A 48 -5.527 -35.936 44.230 1.00 0.00 C ATOM 783 O GLU A 48 -4.875 -36.976 44.127 1.00 0.00 O ATOM 784 CB GLU A 48 -7.909 -36.597 43.929 1.00 0.00 C ATOM 785 CG GLU A 48 -9.231 -36.413 43.198 1.00 0.00 C ATOM 786 CD GLU A 48 -10.350 -37.223 43.818 1.00 0.00 C ATOM 787 OE1 GLU A 48 -10.958 -36.750 44.798 1.00 0.00 O ATOM 788 OE2 GLU A 48 -10.618 -38.344 43.337 1.00 0.00 O ATOM 0 H GLU A 48 -6.926 -36.846 41.648 1.00 0.00 H new ATOM 0 HA GLU A 48 -7.096 -34.671 43.491 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -7.604 -37.640 43.851 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -8.058 -36.387 44.988 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.503 -35.358 43.205 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.110 -36.704 42.155 1.00 0.00 H new ATOM 795 N GLU A 49 -5.203 -34.956 45.054 1.00 0.00 N ATOM 796 CA GLU A 49 -3.986 -34.989 45.856 1.00 0.00 C ATOM 797 C GLU A 49 -4.204 -35.747 47.160 1.00 0.00 C ATOM 798 O GLU A 49 -3.271 -36.313 47.730 1.00 0.00 O ATOM 799 CB GLU A 49 -3.516 -33.561 46.139 1.00 0.00 C ATOM 800 CG GLU A 49 -2.190 -33.492 46.875 1.00 0.00 C ATOM 801 CD GLU A 49 -1.750 -32.071 47.152 1.00 0.00 C ATOM 802 OE1 GLU A 49 -1.064 -31.479 46.289 1.00 0.00 O ATOM 803 OE2 GLU A 49 -2.077 -31.541 48.233 1.00 0.00 O ATOM 0 H GLU A 49 -5.770 -34.119 45.188 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.216 -35.516 45.293 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -3.426 -33.023 45.195 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.276 -33.047 46.728 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.274 -34.033 47.818 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -1.425 -33.997 46.285 1.00 0.00 H new ATOM 810 N ILE A 50 -5.445 -35.772 47.613 1.00 0.00 N ATOM 811 CA ILE A 50 -5.786 -36.375 48.899 1.00 0.00 C ATOM 812 C ILE A 50 -5.665 -37.899 48.845 1.00 0.00 C ATOM 813 O ILE A 50 -5.582 -38.576 49.872 1.00 0.00 O ATOM 814 CB ILE A 50 -7.213 -35.966 49.338 1.00 0.00 C ATOM 815 CG1 ILE A 50 -7.348 -34.439 49.298 1.00 0.00 C ATOM 816 CG2 ILE A 50 -7.527 -36.493 50.735 1.00 0.00 C ATOM 817 CD1 ILE A 50 -8.729 -33.933 49.660 1.00 0.00 C ATOM 0 H ILE A 50 -6.241 -35.380 47.109 1.00 0.00 H new ATOM 0 HA ILE A 50 -5.075 -36.003 49.637 1.00 0.00 H new ATOM 0 HB ILE A 50 -7.930 -36.407 48.646 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -6.621 -34.002 49.983 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -7.094 -34.088 48.298 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -8.535 -36.192 51.019 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -7.459 -37.581 50.737 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -6.811 -36.083 51.448 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -8.743 -32.844 49.608 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -9.460 -34.339 48.961 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -8.979 -34.251 50.672 1.00 0.00 H new ATOM 829 N LYS A 51 -5.614 -38.427 47.641 1.00 0.00 N ATOM 830 CA LYS A 51 -5.481 -39.842 47.433 1.00 0.00 C ATOM 831 C LYS A 51 -4.088 -40.159 46.904 1.00 0.00 C ATOM 832 O LYS A 51 -3.623 -39.517 45.961 1.00 0.00 O ATOM 833 CB LYS A 51 -6.541 -40.266 46.434 1.00 0.00 C ATOM 834 CG LYS A 51 -7.957 -40.108 46.963 1.00 0.00 C ATOM 835 CD LYS A 51 -8.999 -40.267 45.870 1.00 0.00 C ATOM 836 CE LYS A 51 -10.391 -39.969 46.404 1.00 0.00 C ATOM 837 NZ LYS A 51 -11.415 -39.961 45.329 1.00 0.00 N ATOM 0 H LYS A 51 -5.664 -37.881 46.781 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.615 -40.383 48.370 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.431 -39.675 45.525 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -6.376 -41.308 46.159 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -8.136 -40.847 47.744 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -8.063 -39.126 47.424 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -8.770 -39.595 45.043 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -8.966 -41.282 45.475 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -10.658 -40.715 47.152 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -10.386 -39.001 46.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -12.226 -39.382 45.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -11.004 -39.562 44.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -11.734 -40.934 45.146 1.00 0.00 H new ATOM 851 N LYS A 52 -3.435 -41.154 47.497 1.00 0.00 N ATOM 852 CA LYS A 52 -2.070 -41.496 47.134 1.00 0.00 C ATOM 853 C LYS A 52 -1.629 -42.767 47.859 1.00 0.00 C ATOM 854 O LYS A 52 -2.079 -43.031 48.974 1.00 0.00 O ATOM 855 CB LYS A 52 -1.154 -40.335 47.521 1.00 0.00 C ATOM 856 CG LYS A 52 0.274 -40.468 47.041 1.00 0.00 C ATOM 857 CD LYS A 52 1.093 -39.284 47.501 1.00 0.00 C ATOM 858 CE LYS A 52 2.495 -39.307 46.915 1.00 0.00 C ATOM 859 NZ LYS A 52 3.297 -38.138 47.357 1.00 0.00 N ATOM 0 H LYS A 52 -3.833 -41.737 48.233 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.013 -41.675 46.060 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.573 -39.411 47.121 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.150 -40.240 48.607 1.00 0.00 H new ATOM 0 HG2 LYS A 52 0.709 -41.391 47.424 1.00 0.00 H new ATOM 0 HG3 LYS A 52 0.295 -40.533 45.953 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.592 -38.360 47.210 1.00 0.00 H new ATOM 0 HD3 LYS A 52 1.154 -39.285 48.589 1.00 0.00 H new ATOM 0 HE2 LYS A 52 2.998 -40.227 47.213 1.00 0.00 H new ATOM 0 HE3 LYS A 52 2.434 -39.315 45.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 4.247 -38.190 46.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 2.830 -37.261 47.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 3.377 -38.144 48.394 1.00 0.00 H new ATOM 873 N ILE A 53 -0.741 -43.529 47.217 1.00 0.00 N ATOM 874 CA ILE A 53 -0.151 -44.733 47.790 1.00 0.00 C ATOM 875 C ILE A 53 -1.193 -45.792 48.174 1.00 0.00 C ATOM 876 O ILE A 53 -1.897 -45.674 49.181 1.00 0.00 O ATOM 877 CB ILE A 53 0.723 -44.368 48.999 1.00 0.00 C ATOM 878 CG1 ILE A 53 1.886 -43.482 48.547 1.00 0.00 C ATOM 879 CG2 ILE A 53 1.237 -45.613 49.713 1.00 0.00 C ATOM 880 CD1 ILE A 53 2.845 -44.156 47.584 1.00 0.00 C ATOM 0 H ILE A 53 -0.410 -43.322 46.275 1.00 0.00 H new ATOM 0 HA ILE A 53 0.469 -45.182 47.014 1.00 0.00 H new ATOM 0 HB ILE A 53 0.110 -43.816 49.712 1.00 0.00 H new ATOM 0 HG12 ILE A 53 1.483 -42.587 48.073 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.442 -43.155 49.426 1.00 0.00 H new ATOM 0 HG21 ILE A 53 1.852 -45.317 50.563 1.00 0.00 H new ATOM 0 HG22 ILE A 53 0.392 -46.206 50.065 1.00 0.00 H new ATOM 0 HG23 ILE A 53 1.835 -46.208 49.022 1.00 0.00 H new ATOM 0 HD11 ILE A 53 3.639 -43.460 47.314 1.00 0.00 H new ATOM 0 HD12 ILE A 53 3.280 -45.035 48.059 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.306 -44.458 46.686 1.00 0.00 H new ATOM 892 N ARG A 54 -1.279 -46.831 47.355 1.00 0.00 N ATOM 893 CA ARG A 54 -2.169 -47.944 47.632 1.00 0.00 C ATOM 894 C ARG A 54 -1.486 -48.913 48.604 1.00 0.00 C ATOM 895 O ARG A 54 -0.257 -48.999 48.640 1.00 0.00 O ATOM 896 CB ARG A 54 -2.567 -48.637 46.318 1.00 0.00 C ATOM 897 CG ARG A 54 -3.632 -49.708 46.485 1.00 0.00 C ATOM 898 CD ARG A 54 -3.025 -51.095 46.541 1.00 0.00 C ATOM 899 NE ARG A 54 -3.858 -52.023 47.299 1.00 0.00 N ATOM 900 CZ ARG A 54 -4.245 -53.213 46.854 1.00 0.00 C ATOM 901 NH1 ARG A 54 -3.990 -53.581 45.605 1.00 0.00 N ATOM 902 NH2 ARG A 54 -4.916 -54.024 47.659 1.00 0.00 N ATOM 0 H ARG A 54 -0.742 -46.924 46.493 1.00 0.00 H new ATOM 0 HA ARG A 54 -3.084 -47.583 48.102 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -2.929 -47.885 45.617 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -1.680 -49.087 45.873 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -4.197 -49.521 47.398 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -4.338 -49.652 45.656 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -2.890 -51.473 45.528 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -2.036 -51.040 46.996 1.00 0.00 H new ATOM 0 HE ARG A 54 -4.163 -51.740 48.230 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -3.493 -52.948 44.978 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -4.291 -54.497 45.272 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -5.132 -53.733 48.612 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -5.217 -54.940 47.325 1.00 0.00 H new ATOM 916 N ASP A 55 -2.285 -49.631 49.392 1.00 0.00 N ATOM 917 CA ASP A 55 -1.770 -50.467 50.482 1.00 0.00 C ATOM 918 C ASP A 55 -1.025 -51.700 49.981 1.00 0.00 C ATOM 919 O ASP A 55 -1.238 -52.174 48.867 1.00 0.00 O ATOM 920 CB ASP A 55 -2.910 -50.910 51.406 1.00 0.00 C ATOM 921 CG ASP A 55 -3.911 -51.820 50.715 1.00 0.00 C ATOM 922 OD1 ASP A 55 -4.630 -51.344 49.808 1.00 0.00 O ATOM 923 OD2 ASP A 55 -3.986 -53.012 51.075 1.00 0.00 O ATOM 0 H ASP A 55 -3.300 -49.652 49.296 1.00 0.00 H new ATOM 0 HA ASP A 55 -1.060 -49.849 51.031 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -2.491 -51.428 52.269 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.428 -50.029 51.784 1.00 0.00 H new ATOM 928 N GLY A 56 -0.143 -52.197 50.835 1.00 0.00 N ATOM 929 CA GLY A 56 0.596 -53.413 50.558 1.00 0.00 C ATOM 930 C GLY A 56 0.997 -54.112 51.844 1.00 0.00 C ATOM 931 O GLY A 56 2.156 -54.067 52.256 1.00 0.00 O ATOM 0 H GLY A 56 0.078 -51.769 51.734 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -0.013 -54.083 49.951 1.00 0.00 H new ATOM 0 HA3 GLY A 56 1.487 -53.177 49.976 1.00 0.00 H new ATOM 935 N THR A 57 0.031 -54.753 52.481 1.00 0.00 N ATOM 936 CA THR A 57 0.226 -55.330 53.802 1.00 0.00 C ATOM 937 C THR A 57 0.618 -56.806 53.728 1.00 0.00 C ATOM 938 O THR A 57 0.132 -57.552 52.879 1.00 0.00 O ATOM 939 CB THR A 57 -1.067 -55.193 54.631 1.00 0.00 C ATOM 940 OG1 THR A 57 -1.581 -53.858 54.504 1.00 0.00 O ATOM 941 CG2 THR A 57 -0.820 -55.506 56.103 1.00 0.00 C ATOM 0 H THR A 57 -0.906 -54.888 52.100 1.00 0.00 H new ATOM 0 HA THR A 57 1.040 -54.784 54.278 1.00 0.00 H new ATOM 0 HB THR A 57 -1.793 -55.911 54.248 1.00 0.00 H new ATOM 0 HG1 THR A 57 -2.404 -53.773 55.030 1.00 0.00 H new ATOM 0 HG21 THR A 57 -1.752 -55.400 56.659 1.00 0.00 H new ATOM 0 HG22 THR A 57 -0.453 -56.528 56.201 1.00 0.00 H new ATOM 0 HG23 THR A 57 -0.078 -54.814 56.503 1.00 0.00 H new ATOM 949 N TRP A 58 1.503 -57.217 54.621 1.00 0.00 N ATOM 950 CA TRP A 58 1.851 -58.619 54.767 1.00 0.00 C ATOM 951 C TRP A 58 1.656 -59.028 56.221 1.00 0.00 C ATOM 952 O TRP A 58 2.073 -58.311 57.133 1.00 0.00 O ATOM 953 CB TRP A 58 3.293 -58.872 54.321 1.00 0.00 C ATOM 954 CG TRP A 58 3.648 -60.327 54.263 1.00 0.00 C ATOM 955 CD1 TRP A 58 4.214 -61.078 55.252 1.00 0.00 C ATOM 956 CD2 TRP A 58 3.450 -61.210 53.151 1.00 0.00 C ATOM 957 NE1 TRP A 58 4.382 -62.372 54.823 1.00 0.00 N ATOM 958 CE2 TRP A 58 3.924 -62.477 53.536 1.00 0.00 C ATOM 959 CE3 TRP A 58 2.925 -61.050 51.864 1.00 0.00 C ATOM 960 CZ2 TRP A 58 3.878 -63.580 52.684 1.00 0.00 C ATOM 961 CZ3 TRP A 58 2.883 -62.142 51.019 1.00 0.00 C ATOM 962 CH2 TRP A 58 3.360 -63.394 51.430 1.00 0.00 C ATOM 0 H TRP A 58 1.996 -56.593 55.260 1.00 0.00 H new ATOM 0 HA TRP A 58 1.201 -59.220 54.131 1.00 0.00 H new ATOM 0 HB2 TRP A 58 3.445 -58.428 53.337 1.00 0.00 H new ATOM 0 HB3 TRP A 58 3.972 -58.366 55.007 1.00 0.00 H new ATOM 0 HD1 TRP A 58 4.489 -60.709 56.229 1.00 0.00 H new ATOM 0 HE1 TRP A 58 4.783 -63.132 55.373 1.00 0.00 H new ATOM 0 HE3 TRP A 58 2.559 -60.088 51.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 4.238 -64.547 53.002 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.476 -62.029 50.025 1.00 0.00 H new ATOM 0 HH2 TRP A 58 3.318 -64.228 50.745 1.00 0.00 H new ATOM 973 N MET A 59 1.030 -60.175 56.435 1.00 0.00 N ATOM 974 CA MET A 59 0.638 -60.593 57.776 1.00 0.00 C ATOM 975 C MET A 59 1.686 -61.488 58.428 1.00 0.00 C ATOM 976 O MET A 59 2.081 -62.513 57.867 1.00 0.00 O ATOM 977 CB MET A 59 -0.704 -61.331 57.732 1.00 0.00 C ATOM 978 CG MET A 59 -1.199 -61.766 59.101 1.00 0.00 C ATOM 979 SD MET A 59 -2.737 -62.707 59.029 1.00 0.00 S ATOM 980 CE MET A 59 -3.851 -61.484 58.342 1.00 0.00 C ATOM 0 H MET A 59 0.781 -60.835 55.698 1.00 0.00 H new ATOM 0 HA MET A 59 0.545 -59.689 58.378 1.00 0.00 H new ATOM 0 HB2 MET A 59 -1.451 -60.684 57.273 1.00 0.00 H new ATOM 0 HB3 MET A 59 -0.607 -62.209 57.093 1.00 0.00 H new ATOM 0 HG2 MET A 59 -0.431 -62.371 59.583 1.00 0.00 H new ATOM 0 HG3 MET A 59 -1.348 -60.884 59.724 1.00 0.00 H new ATOM 0 HE1 MET A 59 -4.882 -61.794 58.513 1.00 0.00 H new ATOM 0 HE2 MET A 59 -3.677 -60.522 58.824 1.00 0.00 H new ATOM 0 HE3 MET A 59 -3.673 -61.390 57.271 1.00 0.00 H new ATOM 990 N SER A 60 2.135 -61.088 59.609 1.00 0.00 N ATOM 991 CA SER A 60 2.986 -61.935 60.428 1.00 0.00 C ATOM 992 C SER A 60 2.109 -62.932 61.183 1.00 0.00 C ATOM 993 O SER A 60 0.950 -62.640 61.479 1.00 0.00 O ATOM 994 CB SER A 60 3.803 -61.085 61.407 1.00 0.00 C ATOM 995 OG SER A 60 4.690 -61.888 62.166 1.00 0.00 O ATOM 0 H SER A 60 1.923 -60.179 60.021 1.00 0.00 H new ATOM 0 HA SER A 60 3.686 -62.477 59.792 1.00 0.00 H new ATOM 0 HB2 SER A 60 4.369 -60.334 60.856 1.00 0.00 H new ATOM 0 HB3 SER A 60 3.130 -60.549 62.076 1.00 0.00 H new ATOM 0 HG SER A 60 5.200 -61.321 62.781 1.00 0.00 H new ATOM 1001 N SER A 61 2.647 -64.103 61.484 1.00 0.00 N ATOM 1002 CA SER A 61 1.852 -65.163 62.087 1.00 0.00 C ATOM 1003 C SER A 61 2.140 -65.322 63.577 1.00 0.00 C ATOM 1004 O SER A 61 1.446 -66.079 64.262 1.00 0.00 O ATOM 1005 CB SER A 61 2.119 -66.473 61.347 1.00 0.00 C ATOM 1006 OG SER A 61 3.513 -66.682 61.185 1.00 0.00 O ATOM 0 H SER A 61 3.625 -64.344 61.322 1.00 0.00 H new ATOM 0 HA SER A 61 0.800 -64.893 61.997 1.00 0.00 H new ATOM 0 HB2 SER A 61 1.683 -67.305 61.901 1.00 0.00 H new ATOM 0 HB3 SER A 61 1.634 -66.451 60.371 1.00 0.00 H new ATOM 0 HG SER A 61 3.664 -67.526 60.711 1.00 0.00 H new ATOM 1012 N LEU A 62 3.137 -64.578 64.061 1.00 0.00 N ATOM 1013 CA LEU A 62 3.586 -64.629 65.456 1.00 0.00 C ATOM 1014 C LEU A 62 3.574 -66.051 66.015 1.00 0.00 C ATOM 1015 O LEU A 62 2.647 -66.443 66.733 1.00 0.00 O ATOM 1016 CB LEU A 62 2.744 -63.710 66.346 1.00 0.00 C ATOM 1017 CG LEU A 62 2.947 -62.205 66.138 1.00 0.00 C ATOM 1018 CD1 LEU A 62 2.269 -61.724 64.861 1.00 0.00 C ATOM 1019 CD2 LEU A 62 2.427 -61.434 67.343 1.00 0.00 C ATOM 0 H LEU A 62 3.662 -63.916 63.490 1.00 0.00 H new ATOM 0 HA LEU A 62 4.617 -64.276 65.461 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.692 -63.941 66.181 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.962 -63.946 67.388 1.00 0.00 H new ATOM 0 HG LEU A 62 4.016 -62.019 66.034 1.00 0.00 H new ATOM 0 HD11 LEU A 62 2.432 -60.653 64.744 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.690 -62.251 64.005 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.199 -61.924 64.920 1.00 0.00 H new ATOM 0 HD21 LEU A 62 2.577 -60.366 67.184 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.364 -61.636 67.473 1.00 0.00 H new ATOM 0 HD23 LEU A 62 2.968 -61.747 68.236 1.00 0.00 H new ATOM 1031 N GLU A 63 4.598 -66.821 65.681 1.00 0.00 N ATOM 1032 CA GLU A 63 4.661 -68.212 66.086 1.00 0.00 C ATOM 1033 C GLU A 63 5.030 -68.332 67.556 1.00 0.00 C ATOM 1034 O GLU A 63 5.617 -67.418 68.137 1.00 0.00 O ATOM 1035 CB GLU A 63 5.661 -68.985 65.206 1.00 0.00 C ATOM 1036 CG GLU A 63 7.134 -68.657 65.453 1.00 0.00 C ATOM 1037 CD GLU A 63 7.732 -69.445 66.612 1.00 0.00 C ATOM 1038 OE1 GLU A 63 7.788 -70.693 66.526 1.00 0.00 O ATOM 1039 OE2 GLU A 63 8.150 -68.827 67.613 1.00 0.00 O ATOM 0 H GLU A 63 5.396 -66.504 65.130 1.00 0.00 H new ATOM 0 HA GLU A 63 3.673 -68.652 65.951 1.00 0.00 H new ATOM 0 HB2 GLU A 63 5.511 -70.053 65.366 1.00 0.00 H new ATOM 0 HB3 GLU A 63 5.431 -68.784 64.160 1.00 0.00 H new ATOM 0 HG2 GLU A 63 7.704 -68.864 64.547 1.00 0.00 H new ATOM 0 HG3 GLU A 63 7.234 -67.591 65.655 1.00 0.00 H new ATOM 1046 N HIS A 64 4.655 -69.452 68.154 1.00 0.00 N ATOM 1047 CA HIS A 64 5.095 -69.794 69.498 1.00 0.00 C ATOM 1048 C HIS A 64 5.277 -71.298 69.621 1.00 0.00 C ATOM 1049 O HIS A 64 4.380 -72.013 70.068 1.00 0.00 O ATOM 1050 CB HIS A 64 4.117 -69.293 70.568 1.00 0.00 C ATOM 1051 CG HIS A 64 4.327 -67.865 70.961 1.00 0.00 C ATOM 1052 ND1 HIS A 64 5.572 -67.282 71.034 1.00 0.00 N ATOM 1053 CD2 HIS A 64 3.443 -66.904 71.322 1.00 0.00 C ATOM 1054 CE1 HIS A 64 5.447 -66.028 71.422 1.00 0.00 C ATOM 1055 NE2 HIS A 64 4.166 -65.771 71.604 1.00 0.00 N ATOM 0 H HIS A 64 4.042 -70.145 67.725 1.00 0.00 H new ATOM 0 HA HIS A 64 6.050 -69.296 69.667 1.00 0.00 H new ATOM 0 HB2 HIS A 64 3.098 -69.412 70.199 1.00 0.00 H new ATOM 0 HB3 HIS A 64 4.210 -69.921 71.454 1.00 0.00 H new ATOM 0 HD2 HIS A 64 2.370 -67.009 71.378 1.00 0.00 H new ATOM 0 HE1 HIS A 64 6.257 -65.329 71.567 1.00 0.00 H new ATOM 0 HE2 HIS A 64 3.776 -64.878 71.905 1.00 0.00 H new ATOM 1064 N HIS A 65 6.426 -71.781 69.178 1.00 0.00 N ATOM 1065 CA HIS A 65 6.733 -73.201 69.260 1.00 0.00 C ATOM 1066 C HIS A 65 7.789 -73.449 70.323 1.00 0.00 C ATOM 1067 O HIS A 65 8.978 -73.226 70.103 1.00 0.00 O ATOM 1068 CB HIS A 65 7.193 -73.734 67.899 1.00 0.00 C ATOM 1069 CG HIS A 65 6.120 -73.687 66.851 1.00 0.00 C ATOM 1070 ND1 HIS A 65 6.086 -72.741 65.849 1.00 0.00 N ATOM 1071 CD2 HIS A 65 5.034 -74.472 66.661 1.00 0.00 C ATOM 1072 CE1 HIS A 65 5.023 -72.948 65.088 1.00 0.00 C ATOM 1073 NE2 HIS A 65 4.371 -73.991 65.560 1.00 0.00 N ATOM 0 H HIS A 65 7.161 -71.212 68.758 1.00 0.00 H new ATOM 0 HA HIS A 65 5.827 -73.738 69.542 1.00 0.00 H new ATOM 0 HB2 HIS A 65 8.049 -73.152 67.559 1.00 0.00 H new ATOM 0 HB3 HIS A 65 7.533 -74.763 68.015 1.00 0.00 H new ATOM 0 HD1 HIS A 65 6.772 -71.998 65.715 1.00 0.00 H new ATOM 0 HD2 HIS A 65 4.743 -75.320 67.264 1.00 0.00 H new ATOM 0 HE1 HIS A 65 4.739 -72.362 64.227 1.00 0.00 H new ATOM 1082 N HIS A 66 7.331 -73.876 71.488 1.00 0.00 N ATOM 1083 CA HIS A 66 8.200 -74.135 72.631 1.00 0.00 C ATOM 1084 C HIS A 66 7.695 -75.345 73.403 1.00 0.00 C ATOM 1085 O HIS A 66 6.483 -75.549 73.521 1.00 0.00 O ATOM 1086 CB HIS A 66 8.258 -72.920 73.568 1.00 0.00 C ATOM 1087 CG HIS A 66 9.280 -71.890 73.179 1.00 0.00 C ATOM 1088 ND1 HIS A 66 9.055 -70.920 72.225 1.00 0.00 N ATOM 1089 CD2 HIS A 66 10.536 -71.674 73.637 1.00 0.00 C ATOM 1090 CE1 HIS A 66 10.127 -70.156 72.115 1.00 0.00 C ATOM 1091 NE2 HIS A 66 11.042 -70.591 72.960 1.00 0.00 N ATOM 0 H HIS A 66 6.344 -74.054 71.671 1.00 0.00 H new ATOM 0 HA HIS A 66 9.204 -74.331 72.254 1.00 0.00 H new ATOM 0 HB2 HIS A 66 7.276 -72.449 73.594 1.00 0.00 H new ATOM 0 HB3 HIS A 66 8.473 -73.265 74.579 1.00 0.00 H new ATOM 0 HD2 HIS A 66 11.047 -72.248 74.396 1.00 0.00 H new ATOM 0 HE1 HIS A 66 10.236 -69.316 71.445 1.00 0.00 H new ATOM 0 HE2 HIS A 66 11.971 -70.190 73.089 1.00 0.00 H new ATOM 1100 N HIS A 67 8.615 -76.150 73.920 1.00 0.00 N ATOM 1101 CA HIS A 67 8.242 -77.322 74.700 1.00 0.00 C ATOM 1102 C HIS A 67 9.263 -77.575 75.806 1.00 0.00 C ATOM 1103 O HIS A 67 10.467 -77.450 75.593 1.00 0.00 O ATOM 1104 CB HIS A 67 8.101 -78.561 73.797 1.00 0.00 C ATOM 1105 CG HIS A 67 9.398 -79.118 73.284 1.00 0.00 C ATOM 1106 ND1 HIS A 67 10.106 -78.557 72.247 1.00 0.00 N ATOM 1107 CD2 HIS A 67 10.105 -80.205 73.671 1.00 0.00 C ATOM 1108 CE1 HIS A 67 11.189 -79.271 72.017 1.00 0.00 C ATOM 1109 NE2 HIS A 67 11.214 -80.280 72.869 1.00 0.00 N ATOM 0 H HIS A 67 9.620 -76.013 73.814 1.00 0.00 H new ATOM 0 HA HIS A 67 7.274 -77.129 75.162 1.00 0.00 H new ATOM 0 HB2 HIS A 67 7.582 -79.341 74.353 1.00 0.00 H new ATOM 0 HB3 HIS A 67 7.471 -78.303 72.946 1.00 0.00 H new ATOM 0 HD2 HIS A 67 9.843 -80.888 74.466 1.00 0.00 H new ATOM 0 HE1 HIS A 67 11.931 -79.066 71.260 1.00 0.00 H new ATOM 0 HE2 HIS A 67 11.938 -80.996 72.921 1.00 0.00 H new ATOM 1118 N HIS A 68 8.774 -77.916 76.988 1.00 0.00 N ATOM 1119 CA HIS A 68 9.644 -78.240 78.113 1.00 0.00 C ATOM 1120 C HIS A 68 9.572 -79.727 78.411 1.00 0.00 C ATOM 1121 O HIS A 68 8.550 -80.217 78.892 1.00 0.00 O ATOM 1122 CB HIS A 68 9.250 -77.446 79.363 1.00 0.00 C ATOM 1123 CG HIS A 68 9.485 -75.972 79.252 1.00 0.00 C ATOM 1124 ND1 HIS A 68 10.636 -75.361 79.693 1.00 0.00 N ATOM 1125 CD2 HIS A 68 8.702 -74.980 78.760 1.00 0.00 C ATOM 1126 CE1 HIS A 68 10.554 -74.061 79.483 1.00 0.00 C ATOM 1127 NE2 HIS A 68 9.391 -73.805 78.916 1.00 0.00 N ATOM 0 H HIS A 68 7.777 -77.976 77.196 1.00 0.00 H new ATOM 0 HA HIS A 68 10.664 -77.969 77.840 1.00 0.00 H new ATOM 0 HB2 HIS A 68 8.195 -77.620 79.573 1.00 0.00 H new ATOM 0 HB3 HIS A 68 9.811 -77.829 80.215 1.00 0.00 H new ATOM 0 HD2 HIS A 68 7.719 -75.094 78.326 1.00 0.00 H new ATOM 0 HE1 HIS A 68 11.310 -73.331 79.733 1.00 0.00 H new ATOM 0 HE2 HIS A 68 9.058 -72.882 78.638 1.00 0.00 H new ATOM 1136 N HIS A 69 10.645 -80.440 78.100 1.00 0.00 N ATOM 1137 CA HIS A 69 10.722 -81.869 78.368 1.00 0.00 C ATOM 1138 C HIS A 69 12.121 -82.386 78.082 1.00 0.00 C ATOM 1139 O HIS A 69 12.453 -82.586 76.894 1.00 0.00 O ATOM 1140 CB HIS A 69 9.704 -82.648 77.533 1.00 0.00 C ATOM 1141 CG HIS A 69 9.576 -84.079 77.952 1.00 0.00 C ATOM 1142 ND1 HIS A 69 9.716 -84.487 79.263 1.00 0.00 N ATOM 1143 CD2 HIS A 69 9.314 -85.197 77.237 1.00 0.00 C ATOM 1144 CE1 HIS A 69 9.544 -85.791 79.336 1.00 0.00 C ATOM 1145 NE2 HIS A 69 9.299 -86.247 78.122 1.00 0.00 N ATOM 1146 OXT HIS A 69 12.888 -82.581 79.041 1.00 0.00 O ATOM 0 H HIS A 69 11.478 -80.050 77.660 1.00 0.00 H new ATOM 0 HA HIS A 69 10.489 -82.020 79.422 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.731 -82.164 77.612 1.00 0.00 H new ATOM 0 HB3 HIS A 69 9.996 -82.607 76.484 1.00 0.00 H new ATOM 0 HD2 HIS A 69 9.148 -85.253 76.171 1.00 0.00 H new ATOM 0 HE1 HIS A 69 9.595 -86.386 80.236 1.00 0.00 H new ATOM 0 HE2 HIS A 69 9.126 -87.223 77.880 1.00 0.00 H new TER 1155 HIS A 69 ATOM 1156 N MET B 1 -2.425 -19.876 6.922 1.00 0.00 N ATOM 1157 CA MET B 1 -2.851 -18.493 7.216 1.00 0.00 C ATOM 1158 C MET B 1 -2.727 -17.650 5.956 1.00 0.00 C ATOM 1159 O MET B 1 -1.701 -17.700 5.286 1.00 0.00 O ATOM 1160 CB MET B 1 -1.993 -17.903 8.339 1.00 0.00 C ATOM 1161 CG MET B 1 -2.437 -16.519 8.786 1.00 0.00 C ATOM 1162 SD MET B 1 -1.438 -15.869 10.141 1.00 0.00 S ATOM 1163 CE MET B 1 -2.262 -14.306 10.453 1.00 0.00 C ATOM 0 H1 MET B 1 -1.932 -20.271 7.749 1.00 0.00 H new ATOM 0 H2 MET B 1 -3.260 -20.458 6.706 1.00 0.00 H new ATOM 0 H3 MET B 1 -1.783 -19.875 6.104 1.00 0.00 H new ATOM 0 HA MET B 1 -3.890 -18.496 7.545 1.00 0.00 H new ATOM 0 HB2 MET B 1 -2.018 -18.577 9.195 1.00 0.00 H new ATOM 0 HB3 MET B 1 -0.957 -17.852 8.004 1.00 0.00 H new ATOM 0 HG2 MET B 1 -2.383 -15.834 7.940 1.00 0.00 H new ATOM 0 HG3 MET B 1 -3.481 -16.560 9.097 1.00 0.00 H new ATOM 0 HE1 MET B 1 -1.758 -13.785 11.268 1.00 0.00 H new ATOM 0 HE2 MET B 1 -2.228 -13.691 9.554 1.00 0.00 H new ATOM 0 HE3 MET B 1 -3.301 -14.491 10.728 1.00 0.00 H new ATOM 1175 N PRO B 2 -3.783 -16.895 5.599 1.00 0.00 N ATOM 1176 CA PRO B 2 -3.784 -16.028 4.412 1.00 0.00 C ATOM 1177 C PRO B 2 -2.518 -15.181 4.301 1.00 0.00 C ATOM 1178 O PRO B 2 -2.301 -14.263 5.094 1.00 0.00 O ATOM 1179 CB PRO B 2 -5.003 -15.140 4.638 1.00 0.00 C ATOM 1180 CG PRO B 2 -5.935 -15.988 5.425 1.00 0.00 C ATOM 1181 CD PRO B 2 -5.070 -16.836 6.319 1.00 0.00 C ATOM 0 HA PRO B 2 -3.816 -16.602 3.486 1.00 0.00 H new ATOM 0 HB2 PRO B 2 -4.738 -14.232 5.179 1.00 0.00 H new ATOM 0 HB3 PRO B 2 -5.449 -14.829 3.693 1.00 0.00 H new ATOM 0 HG2 PRO B 2 -6.619 -15.375 6.012 1.00 0.00 H new ATOM 0 HG3 PRO B 2 -6.545 -16.609 4.769 1.00 0.00 H new ATOM 0 HD2 PRO B 2 -4.957 -16.391 7.307 1.00 0.00 H new ATOM 0 HD3 PRO B 2 -5.495 -17.829 6.464 1.00 0.00 H new ATOM 1189 N LYS B 3 -1.684 -15.510 3.317 1.00 0.00 N ATOM 1190 CA LYS B 3 -0.406 -14.833 3.127 1.00 0.00 C ATOM 1191 C LYS B 3 -0.606 -13.441 2.570 1.00 0.00 C ATOM 1192 O LYS B 3 -1.627 -13.149 1.945 1.00 0.00 O ATOM 1193 CB LYS B 3 0.505 -15.607 2.160 1.00 0.00 C ATOM 1194 CG LYS B 3 1.069 -16.904 2.714 1.00 0.00 C ATOM 1195 CD LYS B 3 0.010 -17.986 2.799 1.00 0.00 C ATOM 1196 CE LYS B 3 -0.392 -18.504 1.420 1.00 0.00 C ATOM 1197 NZ LYS B 3 -1.318 -19.672 1.493 1.00 0.00 N ATOM 0 H LYS B 3 -1.873 -16.246 2.636 1.00 0.00 H new ATOM 0 HA LYS B 3 0.065 -14.780 4.109 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -0.058 -15.830 1.254 1.00 0.00 H new ATOM 0 HB3 LYS B 3 1.334 -14.962 1.870 1.00 0.00 H new ATOM 0 HG2 LYS B 3 1.887 -17.245 2.080 1.00 0.00 H new ATOM 0 HG3 LYS B 3 1.487 -16.725 3.705 1.00 0.00 H new ATOM 0 HD2 LYS B 3 0.385 -18.813 3.402 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -0.870 -17.593 3.309 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -0.870 -17.701 0.859 1.00 0.00 H new ATOM 0 HE3 LYS B 3 0.504 -18.789 0.868 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -1.613 -19.942 0.533 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -0.831 -20.473 1.944 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -2.156 -19.416 2.054 1.00 0.00 H new ATOM 1211 N ILE B 4 0.375 -12.593 2.796 1.00 0.00 N ATOM 1212 CA ILE B 4 0.410 -11.306 2.161 1.00 0.00 C ATOM 1213 C ILE B 4 1.141 -11.421 0.837 1.00 0.00 C ATOM 1214 O ILE B 4 2.080 -12.209 0.700 1.00 0.00 O ATOM 1215 CB ILE B 4 1.105 -10.234 3.026 1.00 0.00 C ATOM 1216 CG1 ILE B 4 2.623 -10.406 3.049 1.00 0.00 C ATOM 1217 CG2 ILE B 4 0.563 -10.227 4.439 1.00 0.00 C ATOM 1218 CD1 ILE B 4 3.131 -11.612 3.825 1.00 0.00 C ATOM 0 H ILE B 4 1.160 -12.780 3.420 1.00 0.00 H new ATOM 0 HA ILE B 4 -0.623 -10.990 2.013 1.00 0.00 H new ATOM 0 HB ILE B 4 0.884 -9.273 2.561 1.00 0.00 H new ATOM 0 HG12 ILE B 4 2.979 -10.480 2.021 1.00 0.00 H new ATOM 0 HG13 ILE B 4 3.067 -9.507 3.476 1.00 0.00 H new ATOM 0 HG21 ILE B 4 1.074 -9.460 5.021 1.00 0.00 H new ATOM 0 HG22 ILE B 4 -0.506 -10.014 4.418 1.00 0.00 H new ATOM 0 HG23 ILE B 4 0.730 -11.202 4.897 1.00 0.00 H new ATOM 0 HD11 ILE B 4 4.220 -11.642 3.779 1.00 0.00 H new ATOM 0 HD12 ILE B 4 2.814 -11.535 4.865 1.00 0.00 H new ATOM 0 HD13 ILE B 4 2.724 -12.524 3.388 1.00 0.00 H new ATOM 1230 N ILE B 5 0.691 -10.679 -0.148 1.00 0.00 N ATOM 1231 CA ILE B 5 1.377 -10.645 -1.417 1.00 0.00 C ATOM 1232 C ILE B 5 1.961 -9.264 -1.622 1.00 0.00 C ATOM 1233 O ILE B 5 1.395 -8.269 -1.174 1.00 0.00 O ATOM 1234 CB ILE B 5 0.434 -10.963 -2.592 1.00 0.00 C ATOM 1235 CG1 ILE B 5 -0.516 -12.120 -2.243 1.00 0.00 C ATOM 1236 CG2 ILE B 5 1.236 -11.295 -3.842 1.00 0.00 C ATOM 1237 CD1 ILE B 5 0.188 -13.441 -2.003 1.00 0.00 C ATOM 0 H ILE B 5 -0.143 -10.094 -0.095 1.00 0.00 H new ATOM 0 HA ILE B 5 2.158 -11.405 -1.396 1.00 0.00 H new ATOM 0 HB ILE B 5 -0.170 -10.077 -2.788 1.00 0.00 H new ATOM 0 HG12 ILE B 5 -1.084 -11.855 -1.351 1.00 0.00 H new ATOM 0 HG13 ILE B 5 -1.235 -12.244 -3.053 1.00 0.00 H new ATOM 0 HG21 ILE B 5 0.555 -11.517 -4.663 1.00 0.00 H new ATOM 0 HG22 ILE B 5 1.861 -10.443 -4.110 1.00 0.00 H new ATOM 0 HG23 ILE B 5 1.867 -12.162 -3.650 1.00 0.00 H new ATOM 0 HD11 ILE B 5 -0.549 -14.207 -1.762 1.00 0.00 H new ATOM 0 HD12 ILE B 5 0.733 -13.731 -2.901 1.00 0.00 H new ATOM 0 HD13 ILE B 5 0.886 -13.336 -1.173 1.00 0.00 H new ATOM 1249 N GLU B 6 3.096 -9.202 -2.273 1.00 0.00 N ATOM 1250 CA GLU B 6 3.701 -7.936 -2.604 1.00 0.00 C ATOM 1251 C GLU B 6 3.593 -7.721 -4.099 1.00 0.00 C ATOM 1252 O GLU B 6 3.897 -8.623 -4.884 1.00 0.00 O ATOM 1253 CB GLU B 6 5.153 -7.893 -2.143 1.00 0.00 C ATOM 1254 CG GLU B 6 5.310 -8.060 -0.639 1.00 0.00 C ATOM 1255 CD GLU B 6 5.517 -9.495 -0.220 1.00 0.00 C ATOM 1256 OE1 GLU B 6 5.993 -10.295 -1.051 1.00 0.00 O ATOM 1257 OE2 GLU B 6 5.206 -9.826 0.946 1.00 0.00 O ATOM 0 H GLU B 6 3.622 -10.018 -2.586 1.00 0.00 H new ATOM 0 HA GLU B 6 3.177 -7.132 -2.087 1.00 0.00 H new ATOM 0 HB2 GLU B 6 5.712 -8.680 -2.650 1.00 0.00 H new ATOM 0 HB3 GLU B 6 5.595 -6.943 -2.445 1.00 0.00 H new ATOM 0 HG2 GLU B 6 6.157 -7.463 -0.300 1.00 0.00 H new ATOM 0 HG3 GLU B 6 4.423 -7.667 -0.141 1.00 0.00 H new ATOM 1264 N ALA B 7 3.131 -6.547 -4.492 1.00 0.00 N ATOM 1265 CA ALA B 7 2.849 -6.276 -5.885 1.00 0.00 C ATOM 1266 C ALA B 7 3.209 -4.844 -6.252 1.00 0.00 C ATOM 1267 O ALA B 7 3.419 -3.994 -5.377 1.00 0.00 O ATOM 1268 CB ALA B 7 1.377 -6.520 -6.155 1.00 0.00 C ATOM 0 H ALA B 7 2.944 -5.767 -3.862 1.00 0.00 H new ATOM 0 HA ALA B 7 3.456 -6.943 -6.497 1.00 0.00 H new ATOM 0 HB1 ALA B 7 1.161 -6.317 -7.204 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.133 -7.558 -5.929 1.00 0.00 H new ATOM 0 HB3 ALA B 7 0.778 -5.861 -5.527 1.00 0.00 H new ATOM 1274 N VAL B 8 3.294 -4.599 -7.552 1.00 0.00 N ATOM 1275 CA VAL B 8 3.509 -3.277 -8.085 1.00 0.00 C ATOM 1276 C VAL B 8 2.336 -2.868 -8.978 1.00 0.00 C ATOM 1277 O VAL B 8 1.913 -3.618 -9.861 1.00 0.00 O ATOM 1278 CB VAL B 8 4.820 -3.210 -8.887 1.00 0.00 C ATOM 1279 CG1 VAL B 8 6.017 -3.198 -7.952 1.00 0.00 C ATOM 1280 CG2 VAL B 8 4.929 -4.371 -9.864 1.00 0.00 C ATOM 0 H VAL B 8 3.214 -5.323 -8.266 1.00 0.00 H new ATOM 0 HA VAL B 8 3.582 -2.585 -7.246 1.00 0.00 H new ATOM 0 HB VAL B 8 4.811 -2.283 -9.461 1.00 0.00 H new ATOM 0 HG11 VAL B 8 6.935 -3.150 -8.537 1.00 0.00 H new ATOM 0 HG12 VAL B 8 5.959 -2.329 -7.297 1.00 0.00 H new ATOM 0 HG13 VAL B 8 6.017 -4.106 -7.350 1.00 0.00 H new ATOM 0 HG21 VAL B 8 5.866 -4.296 -10.416 1.00 0.00 H new ATOM 0 HG22 VAL B 8 4.906 -5.312 -9.315 1.00 0.00 H new ATOM 0 HG23 VAL B 8 4.093 -4.338 -10.563 1.00 0.00 H new ATOM 1290 N TYR B 9 1.792 -1.693 -8.716 1.00 0.00 N ATOM 1291 CA TYR B 9 0.665 -1.160 -9.487 1.00 0.00 C ATOM 1292 C TYR B 9 1.180 -0.456 -10.736 1.00 0.00 C ATOM 1293 O TYR B 9 1.672 0.662 -10.685 1.00 0.00 O ATOM 1294 CB TYR B 9 -0.122 -0.204 -8.578 1.00 0.00 C ATOM 1295 CG TYR B 9 -1.494 0.203 -9.065 1.00 0.00 C ATOM 1296 CD1 TYR B 9 -2.573 -0.666 -8.968 1.00 0.00 C ATOM 1297 CD2 TYR B 9 -1.720 1.473 -9.583 1.00 0.00 C ATOM 1298 CE1 TYR B 9 -3.835 -0.286 -9.370 1.00 0.00 C ATOM 1299 CE2 TYR B 9 -2.980 1.859 -9.992 1.00 0.00 C ATOM 1300 CZ TYR B 9 -4.033 0.974 -9.888 1.00 0.00 C ATOM 1301 OH TYR B 9 -5.291 1.357 -10.294 1.00 0.00 O ATOM 0 H TYR B 9 2.112 -1.078 -7.968 1.00 0.00 H new ATOM 0 HA TYR B 9 0.004 -1.961 -9.818 1.00 0.00 H new ATOM 0 HB2 TYR B 9 -0.231 -0.673 -7.600 1.00 0.00 H new ATOM 0 HB3 TYR B 9 0.472 0.699 -8.434 1.00 0.00 H new ATOM 0 HD1 TYR B 9 -2.420 -1.658 -8.570 1.00 0.00 H new ATOM 0 HD2 TYR B 9 -0.897 2.168 -9.667 1.00 0.00 H new ATOM 0 HE1 TYR B 9 -4.664 -0.972 -9.279 1.00 0.00 H new ATOM 0 HE2 TYR B 9 -3.141 2.849 -10.392 1.00 0.00 H new ATOM 0 HH TYR B 9 -5.259 2.276 -10.634 1.00 0.00 H new ATOM 1311 N GLU B 10 1.095 -1.144 -11.855 1.00 0.00 N ATOM 1312 CA GLU B 10 1.581 -0.610 -13.102 1.00 0.00 C ATOM 1313 C GLU B 10 0.440 -0.399 -14.081 1.00 0.00 C ATOM 1314 O GLU B 10 -0.278 -1.338 -14.411 1.00 0.00 O ATOM 1315 CB GLU B 10 2.620 -1.539 -13.712 1.00 0.00 C ATOM 1316 CG GLU B 10 3.806 -1.809 -12.803 1.00 0.00 C ATOM 1317 CD GLU B 10 4.988 -2.377 -13.556 1.00 0.00 C ATOM 1318 OE1 GLU B 10 5.732 -1.581 -14.174 1.00 0.00 O ATOM 1319 OE2 GLU B 10 5.190 -3.608 -13.529 1.00 0.00 O ATOM 0 H GLU B 10 0.691 -2.078 -11.923 1.00 0.00 H new ATOM 0 HA GLU B 10 2.046 0.354 -12.895 1.00 0.00 H new ATOM 0 HB2 GLU B 10 2.144 -2.486 -13.964 1.00 0.00 H new ATOM 0 HB3 GLU B 10 2.980 -1.105 -14.645 1.00 0.00 H new ATOM 0 HG2 GLU B 10 4.102 -0.883 -12.311 1.00 0.00 H new ATOM 0 HG3 GLU B 10 3.509 -2.505 -12.019 1.00 0.00 H new ATOM 1326 N ASN B 11 0.271 0.847 -14.503 1.00 0.00 N ATOM 1327 CA ASN B 11 -0.701 1.222 -15.536 1.00 0.00 C ATOM 1328 C ASN B 11 -2.131 0.984 -15.065 1.00 0.00 C ATOM 1329 O ASN B 11 -3.013 0.648 -15.857 1.00 0.00 O ATOM 1330 CB ASN B 11 -0.443 0.433 -16.818 1.00 0.00 C ATOM 1331 CG ASN B 11 -0.815 1.216 -18.068 1.00 0.00 C ATOM 1332 OD1 ASN B 11 0.007 1.940 -18.628 1.00 0.00 O ATOM 1333 ND2 ASN B 11 -2.059 1.089 -18.504 1.00 0.00 N ATOM 0 H ASN B 11 0.806 1.636 -14.139 1.00 0.00 H new ATOM 0 HA ASN B 11 -0.579 2.287 -15.735 1.00 0.00 H new ATOM 0 HB2 ASN B 11 0.611 0.158 -16.866 1.00 0.00 H new ATOM 0 HB3 ASN B 11 -1.014 -0.495 -16.791 1.00 0.00 H new ATOM 0 HD21 ASN B 11 -2.364 1.602 -19.331 1.00 0.00 H new ATOM 0 HD22 ASN B 11 -2.712 0.479 -18.012 1.00 0.00 H new ATOM 1340 N GLY B 12 -2.358 1.165 -13.776 1.00 0.00 N ATOM 1341 CA GLY B 12 -3.683 0.958 -13.228 1.00 0.00 C ATOM 1342 C GLY B 12 -3.951 -0.500 -12.912 1.00 0.00 C ATOM 1343 O GLY B 12 -5.094 -0.899 -12.688 1.00 0.00 O ATOM 0 H GLY B 12 -1.651 1.451 -13.098 1.00 0.00 H new ATOM 0 HA2 GLY B 12 -3.796 1.551 -12.321 1.00 0.00 H new ATOM 0 HA3 GLY B 12 -4.428 1.317 -13.938 1.00 0.00 H new ATOM 1347 N VAL B 13 -2.896 -1.297 -12.892 1.00 0.00 N ATOM 1348 CA VAL B 13 -3.018 -2.712 -12.583 1.00 0.00 C ATOM 1349 C VAL B 13 -2.196 -3.040 -11.366 1.00 0.00 C ATOM 1350 O VAL B 13 -1.139 -2.464 -11.173 1.00 0.00 O ATOM 1351 CB VAL B 13 -2.456 -3.582 -13.704 1.00 0.00 C ATOM 1352 CG1 VAL B 13 -2.884 -5.033 -13.534 1.00 0.00 C ATOM 1353 CG2 VAL B 13 -2.852 -3.054 -15.074 1.00 0.00 C ATOM 0 H VAL B 13 -1.944 -0.988 -13.086 1.00 0.00 H new ATOM 0 HA VAL B 13 -4.080 -2.909 -12.436 1.00 0.00 H new ATOM 0 HB VAL B 13 -1.369 -3.539 -13.639 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -2.470 -5.632 -14.346 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -2.516 -5.411 -12.580 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -3.972 -5.096 -13.554 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -2.434 -3.699 -15.847 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -3.939 -3.043 -15.159 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -2.468 -2.042 -15.199 1.00 0.00 H new ATOM 1363 N PHE B 14 -2.647 -3.976 -10.568 1.00 0.00 N ATOM 1364 CA PHE B 14 -1.839 -4.456 -9.474 1.00 0.00 C ATOM 1365 C PHE B 14 -1.191 -5.767 -9.892 1.00 0.00 C ATOM 1366 O PHE B 14 -1.871 -6.763 -10.147 1.00 0.00 O ATOM 1367 CB PHE B 14 -2.710 -4.644 -8.244 1.00 0.00 C ATOM 1368 CG PHE B 14 -2.088 -4.205 -6.957 1.00 0.00 C ATOM 1369 CD1 PHE B 14 -1.989 -2.861 -6.659 1.00 0.00 C ATOM 1370 CD2 PHE B 14 -1.629 -5.128 -6.035 1.00 0.00 C ATOM 1371 CE1 PHE B 14 -1.428 -2.442 -5.475 1.00 0.00 C ATOM 1372 CE2 PHE B 14 -1.066 -4.712 -4.844 1.00 0.00 C ATOM 1373 CZ PHE B 14 -0.970 -3.368 -4.565 1.00 0.00 C ATOM 0 H PHE B 14 -3.562 -4.418 -10.654 1.00 0.00 H new ATOM 0 HA PHE B 14 -1.059 -3.736 -9.228 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -3.639 -4.093 -8.388 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -2.974 -5.698 -8.162 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -2.356 -2.130 -7.364 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -1.711 -6.184 -6.248 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -1.347 -1.387 -5.259 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -0.702 -5.440 -4.134 1.00 0.00 H new ATOM 0 HZ PHE B 14 -0.535 -3.040 -3.632 1.00 0.00 H new ATOM 1383 N LYS B 15 0.118 -5.744 -9.988 1.00 0.00 N ATOM 1384 CA LYS B 15 0.878 -6.875 -10.485 1.00 0.00 C ATOM 1385 C LYS B 15 1.836 -7.385 -9.422 1.00 0.00 C ATOM 1386 O LYS B 15 2.815 -6.715 -9.108 1.00 0.00 O ATOM 1387 CB LYS B 15 1.684 -6.443 -11.705 1.00 0.00 C ATOM 1388 CG LYS B 15 0.839 -6.162 -12.932 1.00 0.00 C ATOM 1389 CD LYS B 15 1.629 -5.416 -14.000 1.00 0.00 C ATOM 1390 CE LYS B 15 2.912 -6.146 -14.378 1.00 0.00 C ATOM 1391 NZ LYS B 15 2.645 -7.489 -14.953 1.00 0.00 N ATOM 0 H LYS B 15 0.690 -4.941 -9.724 1.00 0.00 H new ATOM 0 HA LYS B 15 0.183 -7.671 -10.750 1.00 0.00 H new ATOM 0 HB2 LYS B 15 2.252 -5.547 -11.454 1.00 0.00 H new ATOM 0 HB3 LYS B 15 2.407 -7.222 -11.945 1.00 0.00 H new ATOM 0 HG2 LYS B 15 0.469 -7.102 -13.342 1.00 0.00 H new ATOM 0 HG3 LYS B 15 -0.033 -5.574 -12.647 1.00 0.00 H new ATOM 0 HD2 LYS B 15 1.009 -5.290 -14.888 1.00 0.00 H new ATOM 0 HD3 LYS B 15 1.874 -4.417 -13.638 1.00 0.00 H new ATOM 0 HE2 LYS B 15 3.469 -5.548 -15.099 1.00 0.00 H new ATOM 0 HE3 LYS B 15 3.543 -6.250 -13.495 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 3.544 -7.935 -15.226 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 2.167 -8.081 -14.244 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 2.037 -7.393 -15.791 1.00 0.00 H new ATOM 1405 N PRO B 16 1.576 -8.559 -8.843 1.00 0.00 N ATOM 1406 CA PRO B 16 2.417 -9.083 -7.774 1.00 0.00 C ATOM 1407 C PRO B 16 3.801 -9.488 -8.254 1.00 0.00 C ATOM 1408 O PRO B 16 4.062 -9.603 -9.453 1.00 0.00 O ATOM 1409 CB PRO B 16 1.641 -10.310 -7.284 1.00 0.00 C ATOM 1410 CG PRO B 16 0.785 -10.714 -8.434 1.00 0.00 C ATOM 1411 CD PRO B 16 0.451 -9.446 -9.164 1.00 0.00 C ATOM 0 HA PRO B 16 2.600 -8.335 -7.003 1.00 0.00 H new ATOM 0 HB2 PRO B 16 2.317 -11.114 -6.995 1.00 0.00 H new ATOM 0 HB3 PRO B 16 1.037 -10.071 -6.408 1.00 0.00 H new ATOM 0 HG2 PRO B 16 1.310 -11.413 -9.085 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -0.119 -11.217 -8.090 1.00 0.00 H new ATOM 0 HD2 PRO B 16 0.365 -9.612 -10.238 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -0.498 -9.028 -8.829 1.00 0.00 H new ATOM 1419 N LEU B 17 4.669 -9.736 -7.291 1.00 0.00 N ATOM 1420 CA LEU B 17 5.984 -10.295 -7.551 1.00 0.00 C ATOM 1421 C LEU B 17 5.957 -11.746 -7.122 1.00 0.00 C ATOM 1422 O LEU B 17 6.881 -12.523 -7.383 1.00 0.00 O ATOM 1423 CB LEU B 17 7.081 -9.530 -6.796 1.00 0.00 C ATOM 1424 CG LEU B 17 7.306 -8.079 -7.236 1.00 0.00 C ATOM 1425 CD1 LEU B 17 6.281 -7.146 -6.613 1.00 0.00 C ATOM 1426 CD2 LEU B 17 8.712 -7.634 -6.883 1.00 0.00 C ATOM 0 H LEU B 17 4.482 -9.555 -6.305 1.00 0.00 H new ATOM 0 HA LEU B 17 6.217 -10.211 -8.613 1.00 0.00 H new ATOM 0 HB2 LEU B 17 6.835 -9.534 -5.734 1.00 0.00 H new ATOM 0 HB3 LEU B 17 8.019 -10.073 -6.908 1.00 0.00 H new ATOM 0 HG LEU B 17 7.183 -8.033 -8.318 1.00 0.00 H new ATOM 0 HD11 LEU B 17 6.469 -6.125 -6.945 1.00 0.00 H new ATOM 0 HD12 LEU B 17 5.280 -7.449 -6.919 1.00 0.00 H new ATOM 0 HD13 LEU B 17 6.358 -7.194 -5.527 1.00 0.00 H new ATOM 0 HD21 LEU B 17 8.858 -6.602 -7.201 1.00 0.00 H new ATOM 0 HD22 LEU B 17 8.856 -7.705 -5.805 1.00 0.00 H new ATOM 0 HD23 LEU B 17 9.434 -8.275 -7.389 1.00 0.00 H new ATOM 1438 N GLN B 18 4.867 -12.094 -6.453 1.00 0.00 N ATOM 1439 CA GLN B 18 4.599 -13.475 -6.090 1.00 0.00 C ATOM 1440 C GLN B 18 3.563 -14.048 -7.038 1.00 0.00 C ATOM 1441 O GLN B 18 2.668 -13.330 -7.486 1.00 0.00 O ATOM 1442 CB GLN B 18 4.029 -13.593 -4.676 1.00 0.00 C ATOM 1443 CG GLN B 18 4.892 -13.030 -3.562 1.00 0.00 C ATOM 1444 CD GLN B 18 4.281 -13.323 -2.201 1.00 0.00 C ATOM 1445 OE1 GLN B 18 3.625 -14.347 -2.015 1.00 0.00 O ATOM 1446 NE2 GLN B 18 4.471 -12.429 -1.246 1.00 0.00 N ATOM 0 H GLN B 18 4.151 -11.434 -6.150 1.00 0.00 H new ATOM 0 HA GLN B 18 5.545 -14.013 -6.144 1.00 0.00 H new ATOM 0 HB2 GLN B 18 3.064 -13.088 -4.651 1.00 0.00 H new ATOM 0 HB3 GLN B 18 3.843 -14.647 -4.467 1.00 0.00 H new ATOM 0 HG2 GLN B 18 5.891 -13.462 -3.617 1.00 0.00 H new ATOM 0 HG3 GLN B 18 5.003 -11.953 -3.691 1.00 0.00 H new ATOM 0 HE21 GLN B 18 5.020 -11.591 -1.434 1.00 0.00 H new ATOM 0 HE22 GLN B 18 4.068 -12.578 -0.321 1.00 0.00 H new ATOM 1455 N LYS B 19 3.674 -15.325 -7.354 1.00 0.00 N ATOM 1456 CA LYS B 19 2.557 -16.025 -7.955 1.00 0.00 C ATOM 1457 C LYS B 19 1.650 -16.495 -6.848 1.00 0.00 C ATOM 1458 O LYS B 19 2.061 -17.215 -5.937 1.00 0.00 O ATOM 1459 CB LYS B 19 2.997 -17.186 -8.832 1.00 0.00 C ATOM 1460 CG LYS B 19 3.265 -16.783 -10.277 1.00 0.00 C ATOM 1461 CD LYS B 19 4.304 -15.676 -10.379 1.00 0.00 C ATOM 1462 CE LYS B 19 4.588 -15.297 -11.826 1.00 0.00 C ATOM 1463 NZ LYS B 19 5.571 -14.184 -11.926 1.00 0.00 N ATOM 0 H LYS B 19 4.511 -15.889 -7.208 1.00 0.00 H new ATOM 0 HA LYS B 19 2.027 -15.340 -8.617 1.00 0.00 H new ATOM 0 HB2 LYS B 19 3.901 -17.627 -8.412 1.00 0.00 H new ATOM 0 HB3 LYS B 19 2.227 -17.958 -8.814 1.00 0.00 H new ATOM 0 HG2 LYS B 19 3.606 -17.653 -10.838 1.00 0.00 H new ATOM 0 HG3 LYS B 19 2.335 -16.451 -10.739 1.00 0.00 H new ATOM 0 HD2 LYS B 19 3.954 -14.798 -9.836 1.00 0.00 H new ATOM 0 HD3 LYS B 19 5.228 -16.000 -9.900 1.00 0.00 H new ATOM 0 HE2 LYS B 19 4.969 -16.167 -12.361 1.00 0.00 H new ATOM 0 HE3 LYS B 19 3.658 -15.005 -12.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 5.737 -13.956 -12.927 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 5.197 -13.345 -11.438 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 6.467 -14.471 -11.483 1.00 0.00 H new ATOM 1477 N VAL B 20 0.414 -16.094 -6.950 1.00 0.00 N ATOM 1478 CA VAL B 20 -0.480 -16.116 -5.807 1.00 0.00 C ATOM 1479 C VAL B 20 -1.244 -17.426 -5.693 1.00 0.00 C ATOM 1480 O VAL B 20 -1.567 -18.083 -6.684 1.00 0.00 O ATOM 1481 CB VAL B 20 -1.452 -14.915 -5.835 1.00 0.00 C ATOM 1482 CG1 VAL B 20 -2.217 -14.789 -4.525 1.00 0.00 C ATOM 1483 CG2 VAL B 20 -0.694 -13.629 -6.124 1.00 0.00 C ATOM 0 H VAL B 20 -0.006 -15.746 -7.812 1.00 0.00 H new ATOM 0 HA VAL B 20 0.146 -16.032 -4.919 1.00 0.00 H new ATOM 0 HB VAL B 20 -2.175 -15.090 -6.632 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -2.892 -13.935 -4.578 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -2.795 -15.697 -4.352 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -1.513 -14.645 -3.705 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -1.391 -12.791 -6.141 1.00 0.00 H new ATOM 0 HG22 VAL B 20 0.052 -13.464 -5.347 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -0.199 -13.708 -7.092 1.00 0.00 H new ATOM 1493 N ASP B 21 -1.529 -17.768 -4.450 1.00 0.00 N ATOM 1494 CA ASP B 21 -2.146 -19.034 -4.072 1.00 0.00 C ATOM 1495 C ASP B 21 -3.663 -18.879 -4.013 1.00 0.00 C ATOM 1496 O ASP B 21 -4.387 -19.710 -3.462 1.00 0.00 O ATOM 1497 CB ASP B 21 -1.567 -19.417 -2.707 1.00 0.00 C ATOM 1498 CG ASP B 21 -2.020 -20.768 -2.183 1.00 0.00 C ATOM 1499 OD1 ASP B 21 -1.954 -21.760 -2.938 1.00 0.00 O ATOM 1500 OD2 ASP B 21 -2.428 -20.840 -0.999 1.00 0.00 O ATOM 0 H ASP B 21 -1.335 -17.161 -3.653 1.00 0.00 H new ATOM 0 HA ASP B 21 -1.936 -19.816 -4.801 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -0.479 -19.415 -2.775 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -1.842 -18.650 -1.983 1.00 0.00 H new ATOM 1505 N LEU B 22 -4.127 -17.805 -4.619 1.00 0.00 N ATOM 1506 CA LEU B 22 -5.523 -17.413 -4.546 1.00 0.00 C ATOM 1507 C LEU B 22 -6.321 -17.815 -5.778 1.00 0.00 C ATOM 1508 O LEU B 22 -5.822 -18.478 -6.686 1.00 0.00 O ATOM 1509 CB LEU B 22 -5.618 -15.907 -4.357 1.00 0.00 C ATOM 1510 CG LEU B 22 -5.433 -15.431 -2.925 1.00 0.00 C ATOM 1511 CD1 LEU B 22 -5.468 -13.912 -2.860 1.00 0.00 C ATOM 1512 CD2 LEU B 22 -6.507 -16.036 -2.037 1.00 0.00 C ATOM 0 H LEU B 22 -3.548 -17.178 -5.177 1.00 0.00 H new ATOM 0 HA LEU B 22 -5.956 -17.940 -3.696 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -4.866 -15.428 -4.984 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -6.592 -15.571 -4.714 1.00 0.00 H new ATOM 0 HG LEU B 22 -4.458 -15.760 -2.565 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -5.334 -13.589 -1.828 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -4.667 -13.503 -3.475 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -6.429 -13.554 -3.231 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -6.369 -15.691 -1.012 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -7.490 -15.729 -2.394 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -6.434 -17.123 -2.067 1.00 0.00 H new ATOM 1524 N LYS B 23 -7.566 -17.371 -5.784 1.00 0.00 N ATOM 1525 CA LYS B 23 -8.512 -17.671 -6.842 1.00 0.00 C ATOM 1526 C LYS B 23 -8.921 -16.394 -7.561 1.00 0.00 C ATOM 1527 O LYS B 23 -8.836 -15.308 -6.994 1.00 0.00 O ATOM 1528 CB LYS B 23 -9.745 -18.359 -6.238 1.00 0.00 C ATOM 1529 CG LYS B 23 -10.934 -18.475 -7.181 1.00 0.00 C ATOM 1530 CD LYS B 23 -12.166 -18.995 -6.459 1.00 0.00 C ATOM 1531 CE LYS B 23 -13.430 -18.771 -7.275 1.00 0.00 C ATOM 1532 NZ LYS B 23 -13.742 -17.325 -7.437 1.00 0.00 N ATOM 0 H LYS B 23 -7.952 -16.785 -5.044 1.00 0.00 H new ATOM 0 HA LYS B 23 -8.044 -18.338 -7.567 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -9.461 -19.358 -5.908 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -10.055 -17.806 -5.351 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -11.151 -17.500 -7.617 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -10.683 -19.144 -8.004 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -12.047 -20.059 -6.256 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -12.261 -18.495 -5.495 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -13.313 -19.229 -8.257 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -14.268 -19.270 -6.789 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -14.741 -17.213 -7.703 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -13.565 -16.829 -6.540 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -13.138 -16.921 -8.181 1.00 0.00 H new ATOM 1546 N GLU B 24 -9.343 -16.530 -8.809 1.00 0.00 N ATOM 1547 CA GLU B 24 -9.846 -15.414 -9.573 1.00 0.00 C ATOM 1548 C GLU B 24 -11.099 -14.853 -8.911 1.00 0.00 C ATOM 1549 O GLU B 24 -12.072 -15.575 -8.675 1.00 0.00 O ATOM 1550 CB GLU B 24 -10.167 -15.842 -11.004 1.00 0.00 C ATOM 1551 CG GLU B 24 -9.149 -16.787 -11.631 1.00 0.00 C ATOM 1552 CD GLU B 24 -9.359 -18.233 -11.217 1.00 0.00 C ATOM 1553 OE1 GLU B 24 -10.205 -18.916 -11.833 1.00 0.00 O ATOM 1554 OE2 GLU B 24 -8.694 -18.688 -10.265 1.00 0.00 O ATOM 0 H GLU B 24 -9.344 -17.417 -9.313 1.00 0.00 H new ATOM 0 HA GLU B 24 -9.077 -14.643 -9.604 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -11.144 -16.325 -11.014 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -10.246 -14.950 -11.626 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -9.210 -16.712 -12.717 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -8.145 -16.474 -11.346 1.00 0.00 H new ATOM 1561 N GLY B 25 -11.053 -13.571 -8.601 1.00 0.00 N ATOM 1562 CA GLY B 25 -12.148 -12.924 -7.917 1.00 0.00 C ATOM 1563 C GLY B 25 -11.999 -12.995 -6.412 1.00 0.00 C ATOM 1564 O GLY B 25 -12.989 -12.913 -5.681 1.00 0.00 O ATOM 0 H GLY B 25 -10.265 -12.959 -8.814 1.00 0.00 H new ATOM 0 HA2 GLY B 25 -12.203 -11.880 -8.227 1.00 0.00 H new ATOM 0 HA3 GLY B 25 -13.087 -13.393 -8.211 1.00 0.00 H new ATOM 1568 N GLU B 26 -10.770 -13.173 -5.940 1.00 0.00 N ATOM 1569 CA GLU B 26 -10.526 -13.262 -4.493 1.00 0.00 C ATOM 1570 C GLU B 26 -10.392 -11.882 -3.835 1.00 0.00 C ATOM 1571 O GLU B 26 -9.827 -10.954 -4.418 1.00 0.00 O ATOM 1572 CB GLU B 26 -9.295 -14.117 -4.193 1.00 0.00 C ATOM 1573 CG GLU B 26 -9.626 -15.570 -3.905 1.00 0.00 C ATOM 1574 CD GLU B 26 -10.676 -15.740 -2.825 1.00 0.00 C ATOM 1575 OE1 GLU B 26 -10.399 -15.398 -1.658 1.00 0.00 O ATOM 1576 OE2 GLU B 26 -11.786 -16.219 -3.140 1.00 0.00 O ATOM 0 H GLU B 26 -9.936 -13.258 -6.521 1.00 0.00 H new ATOM 0 HA GLU B 26 -11.402 -13.745 -4.060 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -8.613 -14.069 -5.042 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -8.769 -13.695 -3.337 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -9.976 -16.045 -4.821 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -8.717 -16.090 -3.604 1.00 0.00 H new ATOM 1583 N ARG B 27 -10.918 -11.767 -2.608 1.00 0.00 N ATOM 1584 CA ARG B 27 -10.960 -10.510 -1.883 1.00 0.00 C ATOM 1585 C ARG B 27 -9.684 -10.249 -1.100 1.00 0.00 C ATOM 1586 O ARG B 27 -9.308 -10.988 -0.173 1.00 0.00 O ATOM 1587 CB ARG B 27 -12.129 -10.503 -0.921 1.00 0.00 C ATOM 1588 CG ARG B 27 -12.355 -9.165 -0.250 1.00 0.00 C ATOM 1589 CD ARG B 27 -12.985 -8.171 -1.207 1.00 0.00 C ATOM 1590 NE ARG B 27 -14.415 -8.442 -1.404 1.00 0.00 N ATOM 1591 CZ ARG B 27 -15.380 -7.529 -1.278 1.00 0.00 C ATOM 1592 NH1 ARG B 27 -15.080 -6.282 -0.939 1.00 0.00 N ATOM 1593 NH2 ARG B 27 -16.653 -7.868 -1.471 1.00 0.00 N ATOM 0 H ARG B 27 -11.325 -12.551 -2.097 1.00 0.00 H new ATOM 0 HA ARG B 27 -11.070 -9.722 -2.628 1.00 0.00 H new ATOM 0 HB2 ARG B 27 -13.033 -10.787 -1.459 1.00 0.00 H new ATOM 0 HB3 ARG B 27 -11.963 -11.260 -0.155 1.00 0.00 H new ATOM 0 HG2 ARG B 27 -12.999 -9.295 0.619 1.00 0.00 H new ATOM 0 HG3 ARG B 27 -11.405 -8.772 0.113 1.00 0.00 H new ATOM 0 HD2 ARG B 27 -12.856 -7.160 -0.820 1.00 0.00 H new ATOM 0 HD3 ARG B 27 -12.470 -8.213 -2.167 1.00 0.00 H new ATOM 0 HE ARG B 27 -14.689 -9.392 -1.654 1.00 0.00 H new ATOM 0 HH11 ARG B 27 -14.109 -6.018 -0.774 1.00 0.00 H new ATOM 0 HH12 ARG B 27 -15.821 -5.587 -0.844 1.00 0.00 H new ATOM 0 HH21 ARG B 27 -16.893 -8.828 -1.716 1.00 0.00 H new ATOM 0 HH22 ARG B 27 -17.388 -7.167 -1.374 1.00 0.00 H new ATOM 1607 N VAL B 28 -9.068 -9.148 -1.445 1.00 0.00 N ATOM 1608 CA VAL B 28 -7.802 -8.754 -0.857 1.00 0.00 C ATOM 1609 C VAL B 28 -7.804 -7.265 -0.509 1.00 0.00 C ATOM 1610 O VAL B 28 -8.509 -6.474 -1.140 1.00 0.00 O ATOM 1611 CB VAL B 28 -6.625 -9.063 -1.809 1.00 0.00 C ATOM 1612 CG1 VAL B 28 -6.530 -10.556 -2.093 1.00 0.00 C ATOM 1613 CG2 VAL B 28 -6.757 -8.291 -3.111 1.00 0.00 C ATOM 0 H VAL B 28 -9.426 -8.495 -2.142 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.673 -9.332 0.058 1.00 0.00 H new ATOM 0 HB VAL B 28 -5.709 -8.746 -1.311 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -5.693 -10.746 -2.765 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -6.374 -11.095 -1.158 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.455 -10.897 -2.559 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -5.915 -8.528 -3.761 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -7.687 -8.569 -3.606 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -6.763 -7.221 -2.901 1.00 0.00 H new ATOM 1623 N LYS B 29 -7.028 -6.902 0.504 1.00 0.00 N ATOM 1624 CA LYS B 29 -6.896 -5.525 0.935 1.00 0.00 C ATOM 1625 C LYS B 29 -5.454 -5.090 0.748 1.00 0.00 C ATOM 1626 O LYS B 29 -4.540 -5.884 0.950 1.00 0.00 O ATOM 1627 CB LYS B 29 -7.257 -5.392 2.399 1.00 0.00 C ATOM 1628 CG LYS B 29 -8.558 -6.067 2.790 1.00 0.00 C ATOM 1629 CD LYS B 29 -9.794 -5.332 2.308 1.00 0.00 C ATOM 1630 CE LYS B 29 -11.042 -6.051 2.806 1.00 0.00 C ATOM 1631 NZ LYS B 29 -12.234 -5.169 2.877 1.00 0.00 N ATOM 0 H LYS B 29 -6.472 -7.561 1.049 1.00 0.00 H new ATOM 0 HA LYS B 29 -7.567 -4.902 0.344 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -6.450 -5.812 2.999 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -7.322 -4.333 2.649 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -8.568 -7.080 2.386 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -8.599 -6.156 3.876 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -9.784 -4.305 2.672 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -9.800 -5.284 1.219 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -11.258 -6.891 2.146 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -10.845 -6.465 3.795 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -12.802 -5.420 3.711 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -11.928 -4.178 2.952 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -12.808 -5.291 2.018 1.00 0.00 H new ATOM 1645 N ILE B 30 -5.247 -3.848 0.388 1.00 0.00 N ATOM 1646 CA ILE B 30 -3.899 -3.360 0.101 1.00 0.00 C ATOM 1647 C ILE B 30 -3.622 -2.044 0.774 1.00 0.00 C ATOM 1648 O ILE B 30 -4.450 -1.140 0.791 1.00 0.00 O ATOM 1649 CB ILE B 30 -3.654 -3.141 -1.390 1.00 0.00 C ATOM 1650 CG1 ILE B 30 -4.099 -4.361 -2.190 1.00 0.00 C ATOM 1651 CG2 ILE B 30 -2.177 -2.850 -1.635 1.00 0.00 C ATOM 1652 CD1 ILE B 30 -4.314 -4.084 -3.659 1.00 0.00 C ATOM 0 H ILE B 30 -5.984 -3.150 0.284 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.240 -4.141 0.481 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.241 -2.285 -1.722 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.350 -5.146 -2.084 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.026 -4.745 -1.763 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.009 -2.695 -2.701 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -1.887 -1.953 -1.087 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -1.578 -3.694 -1.292 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -4.629 -5.000 -4.160 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -5.085 -3.323 -3.777 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.383 -3.730 -4.102 1.00 0.00 H new ATOM 1664 N LYS B 31 -2.442 -1.975 1.317 1.00 0.00 N ATOM 1665 CA LYS B 31 -1.875 -0.754 1.815 1.00 0.00 C ATOM 1666 C LYS B 31 -0.369 -0.917 1.861 1.00 0.00 C ATOM 1667 O LYS B 31 0.131 -1.987 2.213 1.00 0.00 O ATOM 1668 CB LYS B 31 -2.412 -0.422 3.204 1.00 0.00 C ATOM 1669 CG LYS B 31 -1.990 0.949 3.703 1.00 0.00 C ATOM 1670 CD LYS B 31 -2.485 1.191 5.113 1.00 0.00 C ATOM 1671 CE LYS B 31 -2.239 2.625 5.560 1.00 0.00 C ATOM 1672 NZ LYS B 31 -0.798 2.992 5.488 1.00 0.00 N ATOM 0 H LYS B 31 -1.832 -2.785 1.429 1.00 0.00 H new ATOM 0 HA LYS B 31 -2.149 0.069 1.155 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -3.501 -0.475 3.187 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -2.068 -1.179 3.909 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -0.903 1.031 3.677 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -2.384 1.718 3.039 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -3.551 0.971 5.167 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -1.984 0.506 5.797 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -2.818 3.304 4.934 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -2.595 2.752 6.582 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -0.663 3.946 5.880 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -0.238 2.309 6.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -0.485 2.978 4.496 1.00 0.00 H new ATOM 1686 N LEU B 32 0.352 0.085 1.416 1.00 0.00 N ATOM 1687 CA LEU B 32 1.753 0.153 1.689 1.00 0.00 C ATOM 1688 C LEU B 32 2.206 1.590 1.686 1.00 0.00 C ATOM 1689 O LEU B 32 1.529 2.461 1.150 1.00 0.00 O ATOM 1690 CB LEU B 32 2.560 -0.671 0.716 1.00 0.00 C ATOM 1691 CG LEU B 32 3.806 -1.266 1.337 1.00 0.00 C ATOM 1692 CD1 LEU B 32 3.418 -2.170 2.489 1.00 0.00 C ATOM 1693 CD2 LEU B 32 4.634 -2.035 0.324 1.00 0.00 C ATOM 0 H LEU B 32 -0.016 0.860 0.864 1.00 0.00 H new ATOM 0 HA LEU B 32 1.924 -0.272 2.678 1.00 0.00 H new ATOM 0 HB2 LEU B 32 1.936 -1.475 0.324 1.00 0.00 H new ATOM 0 HB3 LEU B 32 2.845 -0.047 -0.131 1.00 0.00 H new ATOM 0 HG LEU B 32 4.422 -0.445 1.704 1.00 0.00 H new ATOM 0 HD11 LEU B 32 4.316 -2.597 2.935 1.00 0.00 H new ATOM 0 HD12 LEU B 32 2.880 -1.592 3.240 1.00 0.00 H new ATOM 0 HD13 LEU B 32 2.778 -2.972 2.122 1.00 0.00 H new ATOM 0 HD21 LEU B 32 5.518 -2.445 0.813 1.00 0.00 H new ATOM 0 HD22 LEU B 32 4.039 -2.849 -0.090 1.00 0.00 H new ATOM 0 HD23 LEU B 32 4.941 -1.365 -0.479 1.00 0.00 H new ATOM 1705 N GLU B 33 3.353 1.818 2.266 1.00 0.00 N ATOM 1706 CA GLU B 33 3.801 3.150 2.565 1.00 0.00 C ATOM 1707 C GLU B 33 5.294 3.142 2.871 1.00 0.00 C ATOM 1708 O GLU B 33 5.857 2.104 3.235 1.00 0.00 O ATOM 1709 CB GLU B 33 2.995 3.660 3.757 1.00 0.00 C ATOM 1710 CG GLU B 33 3.335 5.062 4.184 1.00 0.00 C ATOM 1711 CD GLU B 33 2.425 5.560 5.287 1.00 0.00 C ATOM 1712 OE1 GLU B 33 2.553 5.066 6.426 1.00 0.00 O ATOM 1713 OE2 GLU B 33 1.563 6.423 5.016 1.00 0.00 O ATOM 0 H GLU B 33 4.004 1.084 2.545 1.00 0.00 H new ATOM 0 HA GLU B 33 3.647 3.810 1.711 1.00 0.00 H new ATOM 0 HB2 GLU B 33 1.935 3.616 3.508 1.00 0.00 H new ATOM 0 HB3 GLU B 33 3.153 2.988 4.601 1.00 0.00 H new ATOM 0 HG2 GLU B 33 4.369 5.095 4.526 1.00 0.00 H new ATOM 0 HG3 GLU B 33 3.262 5.729 3.325 1.00 0.00 H new ATOM 1720 N LEU B 34 5.925 4.292 2.704 1.00 0.00 N ATOM 1721 CA LEU B 34 7.343 4.448 3.009 1.00 0.00 C ATOM 1722 C LEU B 34 7.533 4.603 4.508 1.00 0.00 C ATOM 1723 O LEU B 34 6.562 4.711 5.249 1.00 0.00 O ATOM 1724 CB LEU B 34 7.927 5.646 2.258 1.00 0.00 C ATOM 1725 CG LEU B 34 7.113 6.933 2.368 1.00 0.00 C ATOM 1726 CD1 LEU B 34 7.510 7.741 3.594 1.00 0.00 C ATOM 1727 CD2 LEU B 34 7.251 7.757 1.099 1.00 0.00 C ATOM 0 H LEU B 34 5.476 5.139 2.356 1.00 0.00 H new ATOM 0 HA LEU B 34 7.876 3.556 2.680 1.00 0.00 H new ATOM 0 HB2 LEU B 34 8.933 5.836 2.633 1.00 0.00 H new ATOM 0 HB3 LEU B 34 8.024 5.384 1.205 1.00 0.00 H new ATOM 0 HG LEU B 34 6.065 6.660 2.488 1.00 0.00 H new ATOM 0 HD11 LEU B 34 6.910 8.650 3.640 1.00 0.00 H new ATOM 0 HD12 LEU B 34 7.339 7.147 4.492 1.00 0.00 H new ATOM 0 HD13 LEU B 34 8.565 8.005 3.529 1.00 0.00 H new ATOM 0 HD21 LEU B 34 6.665 8.671 1.193 1.00 0.00 H new ATOM 0 HD22 LEU B 34 8.299 8.012 0.943 1.00 0.00 H new ATOM 0 HD23 LEU B 34 6.888 7.179 0.249 1.00 0.00 H new ATOM 1739 N LYS B 35 8.768 4.625 4.957 1.00 0.00 N ATOM 1740 CA LYS B 35 9.045 4.688 6.371 1.00 0.00 C ATOM 1741 C LYS B 35 9.009 6.116 6.890 1.00 0.00 C ATOM 1742 O LYS B 35 9.263 7.073 6.158 1.00 0.00 O ATOM 1743 CB LYS B 35 10.411 4.097 6.664 1.00 0.00 C ATOM 1744 CG LYS B 35 10.555 2.624 6.322 1.00 0.00 C ATOM 1745 CD LYS B 35 11.927 2.085 6.714 1.00 0.00 C ATOM 1746 CE LYS B 35 12.095 1.966 8.227 1.00 0.00 C ATOM 1747 NZ LYS B 35 12.273 3.281 8.909 1.00 0.00 N ATOM 0 H LYS B 35 9.596 4.600 4.362 1.00 0.00 H new ATOM 0 HA LYS B 35 8.269 4.114 6.876 1.00 0.00 H new ATOM 0 HB2 LYS B 35 11.161 4.659 6.108 1.00 0.00 H new ATOM 0 HB3 LYS B 35 10.630 4.233 7.723 1.00 0.00 H new ATOM 0 HG2 LYS B 35 9.780 2.054 6.835 1.00 0.00 H new ATOM 0 HG3 LYS B 35 10.400 2.482 5.252 1.00 0.00 H new ATOM 0 HD2 LYS B 35 12.074 1.107 6.257 1.00 0.00 H new ATOM 0 HD3 LYS B 35 12.700 2.742 6.316 1.00 0.00 H new ATOM 0 HE2 LYS B 35 11.222 1.464 8.644 1.00 0.00 H new ATOM 0 HE3 LYS B 35 12.957 1.335 8.441 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 12.990 3.190 9.657 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 12.584 3.992 8.216 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 11.370 3.579 9.330 1.00 0.00 H new ATOM 1761 N VAL B 36 8.702 6.243 8.166 1.00 0.00 N ATOM 1762 CA VAL B 36 8.779 7.515 8.851 1.00 0.00 C ATOM 1763 C VAL B 36 9.959 7.467 9.803 1.00 0.00 C ATOM 1764 O VAL B 36 10.184 6.449 10.461 1.00 0.00 O ATOM 1765 CB VAL B 36 7.496 7.829 9.644 1.00 0.00 C ATOM 1766 CG1 VAL B 36 7.526 9.255 10.180 1.00 0.00 C ATOM 1767 CG2 VAL B 36 6.255 7.600 8.786 1.00 0.00 C ATOM 0 H VAL B 36 8.393 5.469 8.754 1.00 0.00 H new ATOM 0 HA VAL B 36 8.899 8.302 8.107 1.00 0.00 H new ATOM 0 HB VAL B 36 7.450 7.147 10.493 1.00 0.00 H new ATOM 0 HG11 VAL B 36 6.610 9.454 10.736 1.00 0.00 H new ATOM 0 HG12 VAL B 36 8.385 9.378 10.840 1.00 0.00 H new ATOM 0 HG13 VAL B 36 7.604 9.955 9.348 1.00 0.00 H new ATOM 0 HG21 VAL B 36 5.363 7.829 9.369 1.00 0.00 H new ATOM 0 HG22 VAL B 36 6.293 8.249 7.911 1.00 0.00 H new ATOM 0 HG23 VAL B 36 6.222 6.559 8.465 1.00 0.00 H new ATOM 1777 N GLU B 37 10.716 8.541 9.863 1.00 0.00 N ATOM 1778 CA GLU B 37 11.939 8.560 10.646 1.00 0.00 C ATOM 1779 C GLU B 37 11.998 9.798 11.531 1.00 0.00 C ATOM 1780 O GLU B 37 12.046 10.928 11.037 1.00 0.00 O ATOM 1781 CB GLU B 37 13.142 8.507 9.704 1.00 0.00 C ATOM 1782 CG GLU B 37 14.468 8.244 10.394 1.00 0.00 C ATOM 1783 CD GLU B 37 15.584 7.994 9.409 1.00 0.00 C ATOM 1784 OE1 GLU B 37 16.235 8.971 8.980 1.00 0.00 O ATOM 1785 OE2 GLU B 37 15.811 6.817 9.047 1.00 0.00 O ATOM 0 H GLU B 37 10.508 9.415 9.380 1.00 0.00 H new ATOM 0 HA GLU B 37 11.958 7.688 11.300 1.00 0.00 H new ATOM 0 HB2 GLU B 37 12.972 7.728 8.961 1.00 0.00 H new ATOM 0 HB3 GLU B 37 13.208 9.452 9.165 1.00 0.00 H new ATOM 0 HG2 GLU B 37 14.724 9.097 11.022 1.00 0.00 H new ATOM 0 HG3 GLU B 37 14.368 7.382 11.053 1.00 0.00 H new ATOM 1792 N PRO B 38 11.966 9.595 12.854 1.00 0.00 N ATOM 1793 CA PRO B 38 12.042 10.679 13.831 1.00 0.00 C ATOM 1794 C PRO B 38 13.482 11.092 14.127 1.00 0.00 C ATOM 1795 O PRO B 38 14.425 10.565 13.527 1.00 0.00 O ATOM 1796 CB PRO B 38 11.394 10.057 15.067 1.00 0.00 C ATOM 1797 CG PRO B 38 11.757 8.617 14.982 1.00 0.00 C ATOM 1798 CD PRO B 38 11.841 8.281 13.513 1.00 0.00 C ATOM 0 HA PRO B 38 11.557 11.591 13.484 1.00 0.00 H new ATOM 0 HB2 PRO B 38 11.770 10.509 15.985 1.00 0.00 H new ATOM 0 HB3 PRO B 38 10.313 10.196 15.063 1.00 0.00 H new ATOM 0 HG2 PRO B 38 12.709 8.427 15.478 1.00 0.00 H new ATOM 0 HG3 PRO B 38 11.009 7.999 15.479 1.00 0.00 H new ATOM 0 HD2 PRO B 38 12.698 7.643 13.298 1.00 0.00 H new ATOM 0 HD3 PRO B 38 10.953 7.747 13.174 1.00 0.00 H new ATOM 1806 N ILE B 39 13.633 12.018 15.075 1.00 0.00 N ATOM 1807 CA ILE B 39 14.930 12.567 15.467 1.00 0.00 C ATOM 1808 C ILE B 39 15.503 13.436 14.346 1.00 0.00 C ATOM 1809 O ILE B 39 15.260 13.192 13.162 1.00 0.00 O ATOM 1810 CB ILE B 39 15.931 11.455 15.839 1.00 0.00 C ATOM 1811 CG1 ILE B 39 15.334 10.538 16.914 1.00 0.00 C ATOM 1812 CG2 ILE B 39 17.258 12.038 16.317 1.00 0.00 C ATOM 1813 CD1 ILE B 39 16.218 9.366 17.284 1.00 0.00 C ATOM 0 H ILE B 39 12.850 12.411 15.597 1.00 0.00 H new ATOM 0 HA ILE B 39 14.771 13.183 16.352 1.00 0.00 H new ATOM 0 HB ILE B 39 16.127 10.868 14.942 1.00 0.00 H new ATOM 0 HG12 ILE B 39 15.135 11.127 17.810 1.00 0.00 H new ATOM 0 HG13 ILE B 39 14.375 10.159 16.562 1.00 0.00 H new ATOM 0 HG21 ILE B 39 17.941 11.227 16.571 1.00 0.00 H new ATOM 0 HG22 ILE B 39 17.695 12.646 15.525 1.00 0.00 H new ATOM 0 HG23 ILE B 39 17.087 12.658 17.197 1.00 0.00 H new ATOM 0 HD11 ILE B 39 15.726 8.766 18.049 1.00 0.00 H new ATOM 0 HD12 ILE B 39 16.397 8.752 16.401 1.00 0.00 H new ATOM 0 HD13 ILE B 39 17.169 9.735 17.668 1.00 0.00 H new ATOM 1825 N ASP B 40 16.260 14.453 14.720 1.00 0.00 N ATOM 1826 CA ASP B 40 16.746 15.425 13.752 1.00 0.00 C ATOM 1827 C ASP B 40 18.022 16.116 14.231 1.00 0.00 C ATOM 1828 O ASP B 40 19.102 15.878 13.690 1.00 0.00 O ATOM 1829 CB ASP B 40 15.650 16.456 13.480 1.00 0.00 C ATOM 1830 CG ASP B 40 16.025 17.457 12.408 1.00 0.00 C ATOM 1831 OD1 ASP B 40 16.135 17.059 11.227 1.00 0.00 O ATOM 1832 OD2 ASP B 40 16.186 18.650 12.736 1.00 0.00 O ATOM 0 H ASP B 40 16.551 14.628 15.682 1.00 0.00 H new ATOM 0 HA ASP B 40 16.994 14.898 12.831 1.00 0.00 H new ATOM 0 HB2 ASP B 40 14.739 15.938 13.181 1.00 0.00 H new ATOM 0 HB3 ASP B 40 15.425 16.990 14.403 1.00 0.00 H new ATOM 1837 N LEU B 41 17.894 16.953 15.252 1.00 0.00 N ATOM 1838 CA LEU B 41 19.019 17.759 15.722 1.00 0.00 C ATOM 1839 C LEU B 41 19.679 17.159 16.959 1.00 0.00 C ATOM 1840 O LEU B 41 19.145 16.246 17.589 1.00 0.00 O ATOM 1841 CB LEU B 41 18.558 19.189 16.026 1.00 0.00 C ATOM 1842 CG LEU B 41 18.093 20.001 14.814 1.00 0.00 C ATOM 1843 CD1 LEU B 41 17.579 21.362 15.253 1.00 0.00 C ATOM 1844 CD2 LEU B 41 19.226 20.154 13.808 1.00 0.00 C ATOM 0 H LEU B 41 17.027 17.093 15.771 1.00 0.00 H new ATOM 0 HA LEU B 41 19.760 17.773 14.923 1.00 0.00 H new ATOM 0 HB2 LEU B 41 17.741 19.144 16.747 1.00 0.00 H new ATOM 0 HB3 LEU B 41 19.378 19.723 16.506 1.00 0.00 H new ATOM 0 HG LEU B 41 17.276 19.465 14.331 1.00 0.00 H new ATOM 0 HD11 LEU B 41 17.252 21.927 14.380 1.00 0.00 H new ATOM 0 HD12 LEU B 41 16.739 21.231 15.935 1.00 0.00 H new ATOM 0 HD13 LEU B 41 18.376 21.906 15.759 1.00 0.00 H new ATOM 0 HD21 LEU B 41 18.878 20.734 12.953 1.00 0.00 H new ATOM 0 HD22 LEU B 41 20.063 20.669 14.279 1.00 0.00 H new ATOM 0 HD23 LEU B 41 19.549 19.169 13.471 1.00 0.00 H new ATOM 1856 N GLY B 42 20.849 17.693 17.293 1.00 0.00 N ATOM 1857 CA GLY B 42 21.565 17.258 18.474 1.00 0.00 C ATOM 1858 C GLY B 42 22.949 17.863 18.543 1.00 0.00 C ATOM 1859 O GLY B 42 23.765 17.678 17.636 1.00 0.00 O ATOM 0 H GLY B 42 21.316 18.426 16.760 1.00 0.00 H new ATOM 0 HA2 GLY B 42 21.001 17.536 19.364 1.00 0.00 H new ATOM 0 HA3 GLY B 42 21.643 16.171 18.473 1.00 0.00 H new ATOM 1863 N GLU B 43 23.208 18.594 19.613 1.00 0.00 N ATOM 1864 CA GLU B 43 24.481 19.277 19.790 1.00 0.00 C ATOM 1865 C GLU B 43 25.427 18.459 20.664 1.00 0.00 C ATOM 1866 O GLU B 43 24.990 17.780 21.598 1.00 0.00 O ATOM 1867 CB GLU B 43 24.258 20.654 20.413 1.00 0.00 C ATOM 1868 CG GLU B 43 23.677 21.680 19.452 1.00 0.00 C ATOM 1869 CD GLU B 43 24.633 22.035 18.328 1.00 0.00 C ATOM 1870 OE1 GLU B 43 25.610 22.769 18.585 1.00 0.00 O ATOM 1871 OE2 GLU B 43 24.406 21.591 17.183 1.00 0.00 O ATOM 0 H GLU B 43 22.549 18.731 20.379 1.00 0.00 H new ATOM 0 HA GLU B 43 24.939 19.396 18.808 1.00 0.00 H new ATOM 0 HB2 GLU B 43 23.589 20.551 21.267 1.00 0.00 H new ATOM 0 HB3 GLU B 43 25.208 21.027 20.796 1.00 0.00 H new ATOM 0 HG2 GLU B 43 22.751 21.291 19.027 1.00 0.00 H new ATOM 0 HG3 GLU B 43 23.419 22.584 20.004 1.00 0.00 H new ATOM 1878 N PRO B 44 26.734 18.499 20.358 1.00 0.00 N ATOM 1879 CA PRO B 44 27.757 17.789 21.132 1.00 0.00 C ATOM 1880 C PRO B 44 27.964 18.401 22.518 1.00 0.00 C ATOM 1881 O PRO B 44 27.683 19.581 22.737 1.00 0.00 O ATOM 1882 CB PRO B 44 29.035 17.939 20.288 1.00 0.00 C ATOM 1883 CG PRO B 44 28.583 18.453 18.959 1.00 0.00 C ATOM 1884 CD PRO B 44 27.323 19.223 19.222 1.00 0.00 C ATOM 0 HA PRO B 44 27.474 16.752 21.312 1.00 0.00 H new ATOM 0 HB2 PRO B 44 29.736 18.630 20.757 1.00 0.00 H new ATOM 0 HB3 PRO B 44 29.550 16.984 20.184 1.00 0.00 H new ATOM 0 HG2 PRO B 44 29.343 19.091 18.508 1.00 0.00 H new ATOM 0 HG3 PRO B 44 28.402 17.633 18.264 1.00 0.00 H new ATOM 0 HD2 PRO B 44 27.529 20.265 19.468 1.00 0.00 H new ATOM 0 HD3 PRO B 44 26.661 19.225 18.356 1.00 0.00 H new ATOM 1892 N VAL B 45 28.466 17.595 23.446 1.00 0.00 N ATOM 1893 CA VAL B 45 28.692 18.048 24.817 1.00 0.00 C ATOM 1894 C VAL B 45 30.158 18.454 24.998 1.00 0.00 C ATOM 1895 O VAL B 45 31.025 18.039 24.223 1.00 0.00 O ATOM 1896 CB VAL B 45 28.323 16.946 25.843 1.00 0.00 C ATOM 1897 CG1 VAL B 45 28.259 17.505 27.255 1.00 0.00 C ATOM 1898 CG2 VAL B 45 27.007 16.277 25.467 1.00 0.00 C ATOM 0 H VAL B 45 28.725 16.623 23.276 1.00 0.00 H new ATOM 0 HA VAL B 45 28.049 18.909 24.997 1.00 0.00 H new ATOM 0 HB VAL B 45 29.110 16.192 25.819 1.00 0.00 H new ATOM 0 HG11 VAL B 45 27.998 16.707 27.951 1.00 0.00 H new ATOM 0 HG12 VAL B 45 29.230 17.920 27.526 1.00 0.00 H new ATOM 0 HG13 VAL B 45 27.503 18.289 27.302 1.00 0.00 H new ATOM 0 HG21 VAL B 45 26.768 15.507 26.201 1.00 0.00 H new ATOM 0 HG22 VAL B 45 26.212 17.022 25.450 1.00 0.00 H new ATOM 0 HG23 VAL B 45 27.099 15.822 24.481 1.00 0.00 H new ATOM 1908 N SER B 46 30.428 19.270 26.006 1.00 0.00 N ATOM 1909 CA SER B 46 31.771 19.779 26.251 1.00 0.00 C ATOM 1910 C SER B 46 32.599 18.839 27.121 1.00 0.00 C ATOM 1911 O SER B 46 32.074 17.900 27.726 1.00 0.00 O ATOM 1912 CB SER B 46 31.675 21.147 26.912 1.00 0.00 C ATOM 1913 OG SER B 46 30.565 21.200 27.801 1.00 0.00 O ATOM 0 H SER B 46 29.729 19.597 26.673 1.00 0.00 H new ATOM 0 HA SER B 46 32.279 19.856 25.290 1.00 0.00 H new ATOM 0 HB2 SER B 46 32.595 21.358 27.458 1.00 0.00 H new ATOM 0 HB3 SER B 46 31.573 21.919 26.149 1.00 0.00 H new ATOM 0 HG SER B 46 30.521 22.086 28.217 1.00 0.00 H new ATOM 1919 N VAL B 47 33.892 19.114 27.183 1.00 0.00 N ATOM 1920 CA VAL B 47 34.816 18.335 27.987 1.00 0.00 C ATOM 1921 C VAL B 47 35.735 19.280 28.761 1.00 0.00 C ATOM 1922 O VAL B 47 35.833 20.462 28.428 1.00 0.00 O ATOM 1923 CB VAL B 47 35.649 17.379 27.097 1.00 0.00 C ATOM 1924 CG1 VAL B 47 36.673 18.144 26.271 1.00 0.00 C ATOM 1925 CG2 VAL B 47 36.314 16.284 27.924 1.00 0.00 C ATOM 0 H VAL B 47 34.329 19.884 26.677 1.00 0.00 H new ATOM 0 HA VAL B 47 34.248 17.727 28.691 1.00 0.00 H new ATOM 0 HB VAL B 47 34.960 16.895 26.405 1.00 0.00 H new ATOM 0 HG11 VAL B 47 37.241 17.445 25.657 1.00 0.00 H new ATOM 0 HG12 VAL B 47 36.160 18.858 25.627 1.00 0.00 H new ATOM 0 HG13 VAL B 47 37.352 18.677 26.936 1.00 0.00 H new ATOM 0 HG21 VAL B 47 36.890 15.632 27.268 1.00 0.00 H new ATOM 0 HG22 VAL B 47 36.978 16.737 28.660 1.00 0.00 H new ATOM 0 HG23 VAL B 47 35.549 15.700 28.436 1.00 0.00 H new ATOM 1935 N GLU B 48 36.386 18.772 29.797 1.00 0.00 N ATOM 1936 CA GLU B 48 37.271 19.593 30.610 1.00 0.00 C ATOM 1937 C GLU B 48 38.656 19.678 29.990 1.00 0.00 C ATOM 1938 O GLU B 48 39.314 18.663 29.765 1.00 0.00 O ATOM 1939 CB GLU B 48 37.394 19.035 32.022 1.00 0.00 C ATOM 1940 CG GLU B 48 36.063 18.835 32.726 1.00 0.00 C ATOM 1941 CD GLU B 48 36.223 18.166 34.074 1.00 0.00 C ATOM 1942 OE1 GLU B 48 36.473 18.874 35.069 1.00 0.00 O ATOM 1943 OE2 GLU B 48 36.115 16.923 34.138 1.00 0.00 O ATOM 0 H GLU B 48 36.319 17.798 30.094 1.00 0.00 H new ATOM 0 HA GLU B 48 36.833 20.590 30.655 1.00 0.00 H new ATOM 0 HB2 GLU B 48 37.918 18.080 31.980 1.00 0.00 H new ATOM 0 HB3 GLU B 48 38.010 19.710 32.616 1.00 0.00 H new ATOM 0 HG2 GLU B 48 35.575 19.801 32.857 1.00 0.00 H new ATOM 0 HG3 GLU B 48 35.409 18.230 32.098 1.00 0.00 H new ATOM 1950 N GLU B 49 39.088 20.895 29.734 1.00 0.00 N ATOM 1951 CA GLU B 49 40.412 21.146 29.171 1.00 0.00 C ATOM 1952 C GLU B 49 41.466 21.231 30.269 1.00 0.00 C ATOM 1953 O GLU B 49 42.650 20.988 30.037 1.00 0.00 O ATOM 1954 CB GLU B 49 40.412 22.420 28.310 1.00 0.00 C ATOM 1955 CG GLU B 49 39.429 23.494 28.761 1.00 0.00 C ATOM 1956 CD GLU B 49 39.701 24.015 30.158 1.00 0.00 C ATOM 1957 OE1 GLU B 49 40.556 24.915 30.310 1.00 0.00 O ATOM 1958 OE2 GLU B 49 39.062 23.522 31.112 1.00 0.00 O ATOM 0 H GLU B 49 38.540 21.738 29.907 1.00 0.00 H new ATOM 0 HA GLU B 49 40.666 20.305 28.526 1.00 0.00 H new ATOM 0 HB2 GLU B 49 41.417 22.843 28.311 1.00 0.00 H new ATOM 0 HB3 GLU B 49 40.183 22.146 27.280 1.00 0.00 H new ATOM 0 HG2 GLU B 49 39.465 24.326 28.058 1.00 0.00 H new ATOM 0 HG3 GLU B 49 38.418 23.089 28.724 1.00 0.00 H new ATOM 1965 N ILE B 50 41.022 21.585 31.459 1.00 0.00 N ATOM 1966 CA ILE B 50 41.908 21.759 32.601 1.00 0.00 C ATOM 1967 C ILE B 50 42.423 20.414 33.119 1.00 0.00 C ATOM 1968 O ILE B 50 43.373 20.353 33.906 1.00 0.00 O ATOM 1969 CB ILE B 50 41.178 22.537 33.724 1.00 0.00 C ATOM 1970 CG1 ILE B 50 42.143 22.907 34.850 1.00 0.00 C ATOM 1971 CG2 ILE B 50 40.017 21.715 34.264 1.00 0.00 C ATOM 1972 CD1 ILE B 50 41.530 23.790 35.922 1.00 0.00 C ATOM 0 H ILE B 50 40.039 21.761 31.665 1.00 0.00 H new ATOM 0 HA ILE B 50 42.773 22.336 32.276 1.00 0.00 H new ATOM 0 HB ILE B 50 40.786 23.462 33.301 1.00 0.00 H new ATOM 0 HG12 ILE B 50 42.512 21.992 35.314 1.00 0.00 H new ATOM 0 HG13 ILE B 50 43.006 23.418 34.422 1.00 0.00 H new ATOM 0 HG21 ILE B 50 39.512 22.273 35.053 1.00 0.00 H new ATOM 0 HG22 ILE B 50 39.313 21.507 33.459 1.00 0.00 H new ATOM 0 HG23 ILE B 50 40.393 20.775 34.668 1.00 0.00 H new ATOM 0 HD11 ILE B 50 42.277 24.008 36.685 1.00 0.00 H new ATOM 0 HD12 ILE B 50 41.187 24.722 35.473 1.00 0.00 H new ATOM 0 HD13 ILE B 50 40.685 23.275 36.379 1.00 0.00 H new ATOM 1984 N LYS B 51 41.821 19.338 32.646 1.00 0.00 N ATOM 1985 CA LYS B 51 42.216 18.008 33.078 1.00 0.00 C ATOM 1986 C LYS B 51 43.478 17.589 32.333 1.00 0.00 C ATOM 1987 O LYS B 51 43.554 17.719 31.110 1.00 0.00 O ATOM 1988 CB LYS B 51 41.103 17.006 32.797 1.00 0.00 C ATOM 1989 CG LYS B 51 41.237 15.699 33.565 1.00 0.00 C ATOM 1990 CD LYS B 51 40.445 15.733 34.863 1.00 0.00 C ATOM 1991 CE LYS B 51 38.955 15.816 34.579 1.00 0.00 C ATOM 1992 NZ LYS B 51 38.141 15.947 35.814 1.00 0.00 N ATOM 0 H LYS B 51 41.061 19.357 31.966 1.00 0.00 H new ATOM 0 HA LYS B 51 42.409 18.027 34.151 1.00 0.00 H new ATOM 0 HB2 LYS B 51 40.145 17.464 33.044 1.00 0.00 H new ATOM 0 HB3 LYS B 51 41.086 16.788 31.729 1.00 0.00 H new ATOM 0 HG2 LYS B 51 40.887 14.874 32.945 1.00 0.00 H new ATOM 0 HG3 LYS B 51 42.288 15.510 33.783 1.00 0.00 H new ATOM 0 HD2 LYS B 51 40.660 14.840 35.450 1.00 0.00 H new ATOM 0 HD3 LYS B 51 40.755 16.590 35.462 1.00 0.00 H new ATOM 0 HE2 LYS B 51 38.761 16.669 33.929 1.00 0.00 H new ATOM 0 HE3 LYS B 51 38.643 14.924 34.036 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 37.194 16.300 35.570 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 38.056 15.018 36.274 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 38.602 16.615 36.464 1.00 0.00 H new ATOM 2006 N LYS B 52 44.457 17.080 33.067 1.00 0.00 N ATOM 2007 CA LYS B 52 45.736 16.723 32.494 1.00 0.00 C ATOM 2008 C LYS B 52 46.353 15.525 33.204 1.00 0.00 C ATOM 2009 O LYS B 52 46.806 15.630 34.344 1.00 0.00 O ATOM 2010 CB LYS B 52 46.669 17.911 32.610 1.00 0.00 C ATOM 2011 CG LYS B 52 46.361 19.036 31.636 1.00 0.00 C ATOM 2012 CD LYS B 52 46.963 20.353 32.089 1.00 0.00 C ATOM 2013 CE LYS B 52 46.494 21.498 31.210 1.00 0.00 C ATOM 2014 NZ LYS B 52 46.773 22.821 31.824 1.00 0.00 N ATOM 0 H LYS B 52 44.383 16.906 34.069 1.00 0.00 H new ATOM 0 HA LYS B 52 45.584 16.451 31.449 1.00 0.00 H new ATOM 0 HB2 LYS B 52 46.620 18.301 33.627 1.00 0.00 H new ATOM 0 HB3 LYS B 52 47.693 17.573 32.447 1.00 0.00 H new ATOM 0 HG2 LYS B 52 46.748 18.779 30.650 1.00 0.00 H new ATOM 0 HG3 LYS B 52 45.281 19.145 31.536 1.00 0.00 H new ATOM 0 HD2 LYS B 52 46.684 20.547 33.125 1.00 0.00 H new ATOM 0 HD3 LYS B 52 48.051 20.289 32.059 1.00 0.00 H new ATOM 0 HE2 LYS B 52 46.988 21.437 30.240 1.00 0.00 H new ATOM 0 HE3 LYS B 52 45.424 21.401 31.029 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 46.437 23.575 31.191 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 46.281 22.891 32.737 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 47.797 22.925 31.974 1.00 0.00 H new ATOM 2028 N ILE B 53 46.349 14.392 32.532 1.00 0.00 N ATOM 2029 CA ILE B 53 47.015 13.215 33.009 1.00 0.00 C ATOM 2030 C ILE B 53 48.353 13.057 32.283 1.00 0.00 C ATOM 2031 O ILE B 53 48.410 12.642 31.124 1.00 0.00 O ATOM 2032 CB ILE B 53 46.114 11.987 32.802 1.00 0.00 C ATOM 2033 CG1 ILE B 53 46.895 10.702 32.972 1.00 0.00 C ATOM 2034 CG2 ILE B 53 45.434 12.018 31.439 1.00 0.00 C ATOM 2035 CD1 ILE B 53 47.207 10.351 34.412 1.00 0.00 C ATOM 0 H ILE B 53 45.879 14.269 31.635 1.00 0.00 H new ATOM 0 HA ILE B 53 47.215 13.307 34.077 1.00 0.00 H new ATOM 0 HB ILE B 53 45.339 12.022 33.567 1.00 0.00 H new ATOM 0 HG12 ILE B 53 46.330 9.884 32.525 1.00 0.00 H new ATOM 0 HG13 ILE B 53 47.831 10.783 32.419 1.00 0.00 H new ATOM 0 HG21 ILE B 53 44.805 11.135 31.326 1.00 0.00 H new ATOM 0 HG22 ILE B 53 44.819 12.914 31.359 1.00 0.00 H new ATOM 0 HG23 ILE B 53 46.191 12.027 30.655 1.00 0.00 H new ATOM 0 HD11 ILE B 53 47.768 9.417 34.445 1.00 0.00 H new ATOM 0 HD12 ILE B 53 47.801 11.148 34.860 1.00 0.00 H new ATOM 0 HD13 ILE B 53 46.277 10.235 34.968 1.00 0.00 H new ATOM 2047 N ARG B 54 49.424 13.426 32.967 1.00 0.00 N ATOM 2048 CA ARG B 54 50.745 13.440 32.359 1.00 0.00 C ATOM 2049 C ARG B 54 51.705 12.555 33.147 1.00 0.00 C ATOM 2050 O ARG B 54 51.848 12.705 34.361 1.00 0.00 O ATOM 2051 CB ARG B 54 51.272 14.879 32.301 1.00 0.00 C ATOM 2052 CG ARG B 54 52.437 15.073 31.344 1.00 0.00 C ATOM 2053 CD ARG B 54 52.889 16.524 31.311 1.00 0.00 C ATOM 2054 NE ARG B 54 53.712 16.813 30.137 1.00 0.00 N ATOM 2055 CZ ARG B 54 54.415 17.931 29.967 1.00 0.00 C ATOM 2056 NH1 ARG B 54 54.483 18.842 30.929 1.00 0.00 N ATOM 2057 NH2 ARG B 54 55.070 18.126 28.831 1.00 0.00 N ATOM 0 H ARG B 54 49.405 13.720 33.944 1.00 0.00 H new ATOM 0 HA ARG B 54 50.672 13.046 31.345 1.00 0.00 H new ATOM 0 HB2 ARG B 54 50.458 15.541 32.005 1.00 0.00 H new ATOM 0 HB3 ARG B 54 51.582 15.182 33.301 1.00 0.00 H new ATOM 0 HG2 ARG B 54 53.269 14.437 31.647 1.00 0.00 H new ATOM 0 HG3 ARG B 54 52.144 14.758 30.342 1.00 0.00 H new ATOM 0 HD2 ARG B 54 52.016 17.176 31.311 1.00 0.00 H new ATOM 0 HD3 ARG B 54 53.455 16.748 32.215 1.00 0.00 H new ATOM 0 HE ARG B 54 53.750 16.111 29.398 1.00 0.00 H new ATOM 0 HH11 ARG B 54 53.994 18.690 31.811 1.00 0.00 H new ATOM 0 HH12 ARG B 54 55.025 19.694 30.787 1.00 0.00 H new ATOM 0 HH21 ARG B 54 55.033 17.422 28.094 1.00 0.00 H new ATOM 0 HH22 ARG B 54 55.610 18.980 28.694 1.00 0.00 H new ATOM 2071 N ASP B 55 52.349 11.625 32.459 1.00 0.00 N ATOM 2072 CA ASP B 55 53.301 10.732 33.108 1.00 0.00 C ATOM 2073 C ASP B 55 54.615 11.443 33.379 1.00 0.00 C ATOM 2074 O ASP B 55 54.933 12.455 32.751 1.00 0.00 O ATOM 2075 CB ASP B 55 53.564 9.487 32.261 1.00 0.00 C ATOM 2076 CG ASP B 55 52.428 8.491 32.311 1.00 0.00 C ATOM 2077 OD1 ASP B 55 52.443 7.609 33.199 1.00 0.00 O ATOM 2078 OD2 ASP B 55 51.520 8.572 31.460 1.00 0.00 O ATOM 0 H ASP B 55 52.232 11.468 31.458 1.00 0.00 H new ATOM 0 HA ASP B 55 52.858 10.425 34.055 1.00 0.00 H new ATOM 0 HB2 ASP B 55 53.733 9.786 31.227 1.00 0.00 H new ATOM 0 HB3 ASP B 55 54.479 9.005 32.607 1.00 0.00 H new ATOM 2083 N GLY B 56 55.373 10.898 34.314 1.00 0.00 N ATOM 2084 CA GLY B 56 56.647 11.471 34.674 1.00 0.00 C ATOM 2085 C GLY B 56 57.247 10.776 35.875 1.00 0.00 C ATOM 2086 O GLY B 56 56.525 10.339 36.770 1.00 0.00 O ATOM 0 H GLY B 56 55.123 10.058 34.836 1.00 0.00 H new ATOM 0 HA2 GLY B 56 57.332 11.397 33.829 1.00 0.00 H new ATOM 0 HA3 GLY B 56 56.522 12.532 34.891 1.00 0.00 H new ATOM 2090 N THR B 57 58.560 10.662 35.897 1.00 0.00 N ATOM 2091 CA THR B 57 59.234 10.003 37.000 1.00 0.00 C ATOM 2092 C THR B 57 60.119 11.000 37.743 1.00 0.00 C ATOM 2093 O THR B 57 60.354 12.112 37.264 1.00 0.00 O ATOM 2094 CB THR B 57 60.067 8.793 36.513 1.00 0.00 C ATOM 2095 OG1 THR B 57 60.498 8.002 37.630 1.00 0.00 O ATOM 2096 CG2 THR B 57 61.279 9.243 35.709 1.00 0.00 C ATOM 0 H THR B 57 59.180 11.015 35.168 1.00 0.00 H new ATOM 0 HA THR B 57 58.474 9.624 37.684 1.00 0.00 H new ATOM 0 HB THR B 57 59.428 8.191 35.867 1.00 0.00 H new ATOM 0 HG1 THR B 57 61.022 7.239 37.308 1.00 0.00 H new ATOM 0 HG21 THR B 57 61.843 8.370 35.382 1.00 0.00 H new ATOM 0 HG22 THR B 57 60.948 9.809 34.838 1.00 0.00 H new ATOM 0 HG23 THR B 57 61.915 9.873 36.331 1.00 0.00 H new ATOM 2104 N TRP B 58 60.594 10.610 38.912 1.00 0.00 N ATOM 2105 CA TRP B 58 61.399 11.473 39.735 1.00 0.00 C ATOM 2106 C TRP B 58 62.881 11.214 39.514 1.00 0.00 C ATOM 2107 O TRP B 58 63.302 10.076 39.314 1.00 0.00 O ATOM 2108 CB TRP B 58 61.039 11.242 41.193 1.00 0.00 C ATOM 2109 CG TRP B 58 59.966 12.161 41.704 1.00 0.00 C ATOM 2110 CD1 TRP B 58 60.130 13.201 42.570 1.00 0.00 C ATOM 2111 CD2 TRP B 58 58.568 12.128 41.375 1.00 0.00 C ATOM 2112 NE1 TRP B 58 58.926 13.814 42.807 1.00 0.00 N ATOM 2113 CE2 TRP B 58 57.951 13.176 42.088 1.00 0.00 C ATOM 2114 CE3 TRP B 58 57.780 11.320 40.554 1.00 0.00 C ATOM 2115 CZ2 TRP B 58 56.584 13.431 42.000 1.00 0.00 C ATOM 2116 CZ3 TRP B 58 56.424 11.573 40.468 1.00 0.00 C ATOM 2117 CH2 TRP B 58 55.837 12.622 41.189 1.00 0.00 C ATOM 0 H TRP B 58 60.429 9.686 39.311 1.00 0.00 H new ATOM 0 HA TRP B 58 61.199 12.509 39.463 1.00 0.00 H new ATOM 0 HB2 TRP B 58 60.711 10.210 41.318 1.00 0.00 H new ATOM 0 HB3 TRP B 58 61.933 11.368 41.803 1.00 0.00 H new ATOM 0 HD1 TRP B 58 61.072 13.499 43.006 1.00 0.00 H new ATOM 0 HE1 TRP B 58 58.780 14.616 43.420 1.00 0.00 H new ATOM 0 HE3 TRP B 58 58.223 10.509 39.994 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 56.130 14.240 42.553 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 55.807 10.953 39.835 1.00 0.00 H new ATOM 0 HH2 TRP B 58 54.774 12.795 41.102 1.00 0.00 H new ATOM 2128 N MET B 59 63.663 12.278 39.547 1.00 0.00 N ATOM 2129 CA MET B 59 65.104 12.169 39.395 1.00 0.00 C ATOM 2130 C MET B 59 65.790 12.681 40.652 1.00 0.00 C ATOM 2131 O MET B 59 65.564 13.818 41.075 1.00 0.00 O ATOM 2132 CB MET B 59 65.582 12.956 38.167 1.00 0.00 C ATOM 2133 CG MET B 59 65.070 12.407 36.846 1.00 0.00 C ATOM 2134 SD MET B 59 65.606 13.393 35.436 1.00 0.00 S ATOM 2135 CE MET B 59 64.869 12.475 34.086 1.00 0.00 C ATOM 0 H MET B 59 63.324 13.231 39.678 1.00 0.00 H new ATOM 0 HA MET B 59 65.364 11.121 39.246 1.00 0.00 H new ATOM 0 HB2 MET B 59 65.263 13.994 38.266 1.00 0.00 H new ATOM 0 HB3 MET B 59 66.672 12.958 38.150 1.00 0.00 H new ATOM 0 HG2 MET B 59 65.419 11.382 36.722 1.00 0.00 H new ATOM 0 HG3 MET B 59 63.981 12.372 36.868 1.00 0.00 H new ATOM 0 HE1 MET B 59 65.111 12.961 33.141 1.00 0.00 H new ATOM 0 HE2 MET B 59 65.260 11.458 34.081 1.00 0.00 H new ATOM 0 HE3 MET B 59 63.787 12.447 34.213 1.00 0.00 H new ATOM 2145 N SER B 60 66.628 11.848 41.245 1.00 0.00 N ATOM 2146 CA SER B 60 67.290 12.196 42.488 1.00 0.00 C ATOM 2147 C SER B 60 68.482 13.103 42.219 1.00 0.00 C ATOM 2148 O SER B 60 69.118 13.019 41.168 1.00 0.00 O ATOM 2149 CB SER B 60 67.743 10.932 43.222 1.00 0.00 C ATOM 2150 OG SER B 60 68.366 11.255 44.455 1.00 0.00 O ATOM 0 H SER B 60 66.866 10.924 40.884 1.00 0.00 H new ATOM 0 HA SER B 60 66.580 12.731 43.119 1.00 0.00 H new ATOM 0 HB2 SER B 60 66.885 10.285 43.403 1.00 0.00 H new ATOM 0 HB3 SER B 60 68.437 10.373 42.595 1.00 0.00 H new ATOM 0 HG SER B 60 68.645 10.431 44.906 1.00 0.00 H new ATOM 2156 N SER B 61 68.765 13.980 43.168 1.00 0.00 N ATOM 2157 CA SER B 61 69.923 14.851 43.092 1.00 0.00 C ATOM 2158 C SER B 61 71.091 14.231 43.844 1.00 0.00 C ATOM 2159 O SER B 61 72.182 14.800 43.888 1.00 0.00 O ATOM 2160 CB SER B 61 69.572 16.220 43.671 1.00 0.00 C ATOM 2161 OG SER B 61 68.730 16.092 44.810 1.00 0.00 O ATOM 0 H SER B 61 68.201 14.107 44.008 1.00 0.00 H new ATOM 0 HA SER B 61 70.216 14.977 42.050 1.00 0.00 H new ATOM 0 HB2 SER B 61 70.485 16.747 43.947 1.00 0.00 H new ATOM 0 HB3 SER B 61 69.073 16.823 42.912 1.00 0.00 H new ATOM 0 HG SER B 61 68.521 16.982 45.164 1.00 0.00 H new ATOM 2167 N LEU B 62 70.827 13.046 44.409 1.00 0.00 N ATOM 2168 CA LEU B 62 71.784 12.279 45.198 1.00 0.00 C ATOM 2169 C LEU B 62 72.639 13.154 46.112 1.00 0.00 C ATOM 2170 O LEU B 62 73.751 13.562 45.760 1.00 0.00 O ATOM 2171 CB LEU B 62 72.645 11.375 44.297 1.00 0.00 C ATOM 2172 CG LEU B 62 73.372 12.055 43.131 1.00 0.00 C ATOM 2173 CD1 LEU B 62 74.876 12.059 43.356 1.00 0.00 C ATOM 2174 CD2 LEU B 62 73.032 11.360 41.822 1.00 0.00 C ATOM 0 H LEU B 62 69.919 12.588 44.325 1.00 0.00 H new ATOM 0 HA LEU B 62 71.203 11.637 45.860 1.00 0.00 H new ATOM 0 HB2 LEU B 62 73.390 10.883 44.922 1.00 0.00 H new ATOM 0 HB3 LEU B 62 72.005 10.593 43.889 1.00 0.00 H new ATOM 0 HG LEU B 62 73.036 13.091 43.076 1.00 0.00 H new ATOM 0 HD11 LEU B 62 75.368 12.547 42.515 1.00 0.00 H new ATOM 0 HD12 LEU B 62 75.105 12.600 44.274 1.00 0.00 H new ATOM 0 HD13 LEU B 62 75.234 11.033 43.441 1.00 0.00 H new ATOM 0 HD21 LEU B 62 73.555 11.853 41.002 1.00 0.00 H new ATOM 0 HD22 LEU B 62 73.340 10.316 41.874 1.00 0.00 H new ATOM 0 HD23 LEU B 62 71.957 11.413 41.651 1.00 0.00 H new ATOM 2186 N GLU B 63 72.091 13.455 47.285 1.00 0.00 N ATOM 2187 CA GLU B 63 72.815 14.209 48.292 1.00 0.00 C ATOM 2188 C GLU B 63 74.056 13.426 48.711 1.00 0.00 C ATOM 2189 O GLU B 63 73.982 12.475 49.488 1.00 0.00 O ATOM 2190 CB GLU B 63 71.925 14.492 49.504 1.00 0.00 C ATOM 2191 CG GLU B 63 72.104 15.890 50.081 1.00 0.00 C ATOM 2192 CD GLU B 63 73.541 16.192 50.471 1.00 0.00 C ATOM 2193 OE1 GLU B 63 74.305 16.691 49.613 1.00 0.00 O ATOM 2194 OE2 GLU B 63 73.906 15.952 51.638 1.00 0.00 O ATOM 0 H GLU B 63 71.146 13.186 47.558 1.00 0.00 H new ATOM 0 HA GLU B 63 73.117 15.168 47.870 1.00 0.00 H new ATOM 0 HB2 GLU B 63 70.882 14.358 49.217 1.00 0.00 H new ATOM 0 HB3 GLU B 63 72.139 13.758 50.281 1.00 0.00 H new ATOM 0 HG2 GLU B 63 71.770 16.625 49.348 1.00 0.00 H new ATOM 0 HG3 GLU B 63 71.465 16.000 50.957 1.00 0.00 H new ATOM 2201 N HIS B 64 75.192 13.830 48.169 1.00 0.00 N ATOM 2202 CA HIS B 64 76.448 13.120 48.364 1.00 0.00 C ATOM 2203 C HIS B 64 77.131 13.555 49.653 1.00 0.00 C ATOM 2204 O HIS B 64 78.271 14.025 49.644 1.00 0.00 O ATOM 2205 CB HIS B 64 77.370 13.329 47.154 1.00 0.00 C ATOM 2206 CG HIS B 64 77.373 14.734 46.624 1.00 0.00 C ATOM 2207 ND1 HIS B 64 76.435 15.196 45.721 1.00 0.00 N ATOM 2208 CD2 HIS B 64 78.199 15.779 46.873 1.00 0.00 C ATOM 2209 CE1 HIS B 64 76.688 16.461 45.437 1.00 0.00 C ATOM 2210 NE2 HIS B 64 77.749 16.839 46.123 1.00 0.00 N ATOM 0 H HIS B 64 75.271 14.660 47.581 1.00 0.00 H new ATOM 0 HA HIS B 64 76.230 12.056 48.452 1.00 0.00 H new ATOM 0 HB2 HIS B 64 78.387 13.055 47.434 1.00 0.00 H new ATOM 0 HB3 HIS B 64 77.065 12.651 46.357 1.00 0.00 H new ATOM 0 HD1 HIS B 64 75.668 14.647 45.334 1.00 0.00 H new ATOM 0 HD2 HIS B 64 79.051 15.779 47.536 1.00 0.00 H new ATOM 0 HE1 HIS B 64 76.122 17.081 44.758 1.00 0.00 H new ATOM 2219 N HIS B 65 76.413 13.389 50.755 1.00 0.00 N ATOM 2220 CA HIS B 65 76.921 13.717 52.078 1.00 0.00 C ATOM 2221 C HIS B 65 78.004 12.725 52.485 1.00 0.00 C ATOM 2222 O HIS B 65 77.715 11.563 52.770 1.00 0.00 O ATOM 2223 CB HIS B 65 75.764 13.701 53.087 1.00 0.00 C ATOM 2224 CG HIS B 65 76.175 13.907 54.515 1.00 0.00 C ATOM 2225 ND1 HIS B 65 75.877 13.005 55.512 1.00 0.00 N ATOM 2226 CD2 HIS B 65 76.845 14.918 55.111 1.00 0.00 C ATOM 2227 CE1 HIS B 65 76.347 13.453 56.659 1.00 0.00 C ATOM 2228 NE2 HIS B 65 76.941 14.613 56.446 1.00 0.00 N ATOM 0 H HIS B 65 75.461 13.023 50.756 1.00 0.00 H new ATOM 0 HA HIS B 65 77.362 14.714 52.061 1.00 0.00 H new ATOM 0 HB2 HIS B 65 75.050 14.478 52.813 1.00 0.00 H new ATOM 0 HB3 HIS B 65 75.243 12.747 53.007 1.00 0.00 H new ATOM 0 HD2 HIS B 65 77.233 15.802 54.627 1.00 0.00 H new ATOM 0 HE1 HIS B 65 76.261 12.955 57.613 1.00 0.00 H new ATOM 0 HE2 HIS B 65 77.396 15.187 57.156 1.00 0.00 H new ATOM 2237 N HIS B 66 79.246 13.184 52.499 1.00 0.00 N ATOM 2238 CA HIS B 66 80.373 12.324 52.836 1.00 0.00 C ATOM 2239 C HIS B 66 81.453 13.091 53.599 1.00 0.00 C ATOM 2240 O HIS B 66 81.819 14.207 53.231 1.00 0.00 O ATOM 2241 CB HIS B 66 80.962 11.655 51.576 1.00 0.00 C ATOM 2242 CG HIS B 66 81.213 12.574 50.409 1.00 0.00 C ATOM 2243 ND1 HIS B 66 81.066 12.173 49.098 1.00 0.00 N ATOM 2244 CD2 HIS B 66 81.615 13.867 50.355 1.00 0.00 C ATOM 2245 CE1 HIS B 66 81.364 13.176 48.295 1.00 0.00 C ATOM 2246 NE2 HIS B 66 81.698 14.215 49.032 1.00 0.00 N ATOM 0 H HIS B 66 79.500 14.147 52.281 1.00 0.00 H new ATOM 0 HA HIS B 66 79.997 11.538 53.491 1.00 0.00 H new ATOM 0 HB2 HIS B 66 81.903 11.176 51.847 1.00 0.00 H new ATOM 0 HB3 HIS B 66 80.283 10.865 51.254 1.00 0.00 H new ATOM 0 HD2 HIS B 66 81.830 14.506 51.199 1.00 0.00 H new ATOM 0 HE1 HIS B 66 81.338 13.150 47.216 1.00 0.00 H new ATOM 0 HE2 HIS B 66 81.974 15.130 48.676 1.00 0.00 H new ATOM 2255 N HIS B 67 81.949 12.490 54.669 1.00 0.00 N ATOM 2256 CA HIS B 67 83.010 13.094 55.465 1.00 0.00 C ATOM 2257 C HIS B 67 84.235 12.190 55.490 1.00 0.00 C ATOM 2258 O HIS B 67 84.174 11.060 55.975 1.00 0.00 O ATOM 2259 CB HIS B 67 82.512 13.355 56.893 1.00 0.00 C ATOM 2260 CG HIS B 67 83.537 13.965 57.798 1.00 0.00 C ATOM 2261 ND1 HIS B 67 83.897 13.407 59.006 1.00 0.00 N ATOM 2262 CD2 HIS B 67 84.269 15.096 57.679 1.00 0.00 C ATOM 2263 CE1 HIS B 67 84.804 14.167 59.587 1.00 0.00 C ATOM 2264 NE2 HIS B 67 85.048 15.197 58.802 1.00 0.00 N ATOM 0 H HIS B 67 81.634 11.581 55.008 1.00 0.00 H new ATOM 0 HA HIS B 67 83.291 14.044 55.011 1.00 0.00 H new ATOM 0 HB2 HIS B 67 81.645 14.014 56.849 1.00 0.00 H new ATOM 0 HB3 HIS B 67 82.175 12.413 57.326 1.00 0.00 H new ATOM 0 HD2 HIS B 67 84.244 15.791 56.852 1.00 0.00 H new ATOM 0 HE1 HIS B 67 85.268 13.978 60.544 1.00 0.00 H new ATOM 0 HE2 HIS B 67 85.710 15.948 58.998 1.00 0.00 H new ATOM 2273 N HIS B 68 85.341 12.683 54.951 1.00 0.00 N ATOM 2274 CA HIS B 68 86.592 11.939 54.976 1.00 0.00 C ATOM 2275 C HIS B 68 87.230 12.068 56.355 1.00 0.00 C ATOM 2276 O HIS B 68 87.155 13.127 56.976 1.00 0.00 O ATOM 2277 CB HIS B 68 87.552 12.459 53.894 1.00 0.00 C ATOM 2278 CG HIS B 68 88.811 11.649 53.753 1.00 0.00 C ATOM 2279 ND1 HIS B 68 90.002 11.981 54.366 1.00 0.00 N ATOM 2280 CD2 HIS B 68 89.053 10.514 53.057 1.00 0.00 C ATOM 2281 CE1 HIS B 68 90.920 11.083 54.054 1.00 0.00 C ATOM 2282 NE2 HIS B 68 90.369 10.183 53.262 1.00 0.00 N ATOM 0 H HIS B 68 85.398 13.592 54.492 1.00 0.00 H new ATOM 0 HA HIS B 68 86.386 10.889 54.770 1.00 0.00 H new ATOM 0 HB2 HIS B 68 87.031 12.472 52.937 1.00 0.00 H new ATOM 0 HB3 HIS B 68 87.819 13.490 54.125 1.00 0.00 H new ATOM 0 HD2 HIS B 68 88.343 9.970 52.453 1.00 0.00 H new ATOM 0 HE1 HIS B 68 91.946 11.085 54.390 1.00 0.00 H new ATOM 0 HE2 HIS B 68 90.844 9.372 52.866 1.00 0.00 H new ATOM 2291 N HIS B 69 87.836 10.993 56.832 1.00 0.00 N ATOM 2292 CA HIS B 69 88.501 11.003 58.130 1.00 0.00 C ATOM 2293 C HIS B 69 89.994 11.229 57.960 1.00 0.00 C ATOM 2294 O HIS B 69 90.447 12.373 58.143 1.00 0.00 O ATOM 2295 CB HIS B 69 88.249 9.695 58.882 1.00 0.00 C ATOM 2296 CG HIS B 69 86.832 9.500 59.313 1.00 0.00 C ATOM 2297 ND1 HIS B 69 86.386 9.782 60.586 1.00 0.00 N ATOM 2298 CD2 HIS B 69 85.756 9.039 58.634 1.00 0.00 C ATOM 2299 CE1 HIS B 69 85.099 9.503 60.670 1.00 0.00 C ATOM 2300 NE2 HIS B 69 84.693 9.048 59.502 1.00 0.00 N ATOM 2301 OXT HIS B 69 90.708 10.264 57.614 1.00 0.00 O ATOM 0 H HIS B 69 87.883 10.100 56.341 1.00 0.00 H new ATOM 0 HA HIS B 69 88.085 11.822 58.716 1.00 0.00 H new ATOM 0 HB2 HIS B 69 88.541 8.860 58.245 1.00 0.00 H new ATOM 0 HB3 HIS B 69 88.892 9.665 59.762 1.00 0.00 H new ATOM 0 HD2 HIS B 69 85.737 8.723 57.601 1.00 0.00 H new ATOM 0 HE1 HIS B 69 84.482 9.627 61.548 1.00 0.00 H new ATOM 0 HE2 HIS B 69 83.743 8.751 59.279 1.00 0.00 H new TER 2310 HIS B 69