USER MOD reduce.3.24.130724 H: found=0, std=0, add=1158, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1158 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 10 ASN : amide:sc= -0.457 K(o=-0.64,f=-2.4!) USER MOD Set 1.2: A 87 GLN :FLIP amide:sc= 0.262 F(o=-1.8,f=-0.64) USER MOD Set 1.3: A 89 GLN :FLIP amide:sc= -0.44 F(o=-5.8!,f=-0.64) USER MOD Single : A 1 MET CE :methyl -178:sc= 0 (180deg=-0.024) USER MOD Single : A 1 MET N :NH3+ -179:sc= 0 (180deg=-0.00162) USER MOD Single : A 3 THR OG1 : rot 170:sc= -0.486 USER MOD Single : A 9 SER OG : rot 77:sc= -0.439 USER MOD Single : A 24 LYS NZ :NH3+ 175:sc= -1.72 (180deg=-1.89) USER MOD Single : A 25 SER OG : rot -159:sc= -0.216 USER MOD Single : A 28 ASN : amide:sc= 0 K(o=0,f=-3.4!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 41:sc= -1.08! USER MOD Single : A 34 THR OG1 : rot 46:sc= -0.925 USER MOD Single : A 37 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00553) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= -0.191 (180deg=-0.191) USER MOD Single : A 41 LYS NZ :NH3+ -148:sc= 0.637 (180deg=0.178) USER MOD Single : A 46 LYS NZ :NH3+ -158:sc= 0.342 (180deg=-0.0136) USER MOD Single : A 49 LYS NZ :NH3+ -168:sc= 0.198 (180deg=0.153) USER MOD Single : A 50 GLN :FLIP amide:sc= -0.0176 F(o=-1.9!,f=-0.018) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot -123:sc= 0.0149 USER MOD Single : A 74 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.48) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 164:sc= -1.47! (180deg=-2.34!) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.85 K(o=-0.85,f=-6.1!) USER MOD Single : A 100 LYS NZ :NH3+ -128:sc= -0.536 (180deg=-2.48!) USER MOD Single : A 101 LYS NZ :NH3+ -136:sc= 0.017 (180deg=-0.0238) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc=-0.00299 X(o=-0.003,f=-0.003) USER MOD Single : A 116 LYS NZ :NH3+ 163:sc= 0.637 (180deg=0.483) USER MOD Single : A 117 LYS NZ :NH3+ -136:sc= -0.826 (180deg=-3.38!) USER MOD Single : A 120 LYS NZ :NH3+ -167:sc= 0.213 (180deg=0.113) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot -41:sc= 0.0786 USER MOD Single : A 131 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.1) USER MOD Single : A 132 HIS : no HD1:sc= -0.162 X(o=-0.16,f=-0.33) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=-0.0066) USER MOD Single : A 134 HIS : no HE2:sc= 0.257 K(o=0.26,f=-0.9) USER MOD Single : A 135 HIS : no HD1:sc= -0.0594 X(o=-0.059,f=0) USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.354 -15.695 -0.164 1.00 52.12 N ATOM 2 CA MET A 1 -2.647 -15.414 1.098 1.00 12.33 C ATOM 3 C MET A 1 -1.449 -14.476 0.838 1.00 62.30 C ATOM 4 O MET A 1 -0.675 -14.700 -0.102 1.00 35.33 O ATOM 5 CB MET A 1 -2.161 -16.733 1.767 1.00 2.40 C ATOM 6 CG MET A 1 -3.257 -17.757 2.105 1.00 72.42 C ATOM 7 SD MET A 1 -2.696 -19.078 3.219 1.00 51.41 S ATOM 8 CE MET A 1 -1.319 -19.806 2.327 1.00 4.43 C ATOM 0 H1 MET A 1 -4.169 -16.313 0.025 1.00 52.12 H new ATOM 0 H2 MET A 1 -3.686 -14.803 -0.582 1.00 52.12 H new ATOM 0 H3 MET A 1 -2.707 -16.168 -0.827 1.00 52.12 H new ATOM 0 HA MET A 1 -3.342 -14.922 1.778 1.00 12.33 H new ATOM 0 HB2 MET A 1 -1.438 -17.209 1.105 1.00 2.40 H new ATOM 0 HB3 MET A 1 -1.632 -16.479 2.686 1.00 2.40 H new ATOM 0 HG2 MET A 1 -4.099 -17.238 2.564 1.00 72.42 H new ATOM 0 HG3 MET A 1 -3.624 -18.203 1.181 1.00 72.42 H new ATOM 0 HE1 MET A 1 -0.920 -20.646 2.896 1.00 4.43 H new ATOM 0 HE2 MET A 1 -1.661 -20.157 1.353 1.00 4.43 H new ATOM 0 HE3 MET A 1 -0.538 -19.058 2.190 1.00 4.43 H new ATOM 20 N GLY A 2 -1.313 -13.421 1.673 1.00 31.31 N ATOM 21 CA GLY A 2 -0.167 -12.507 1.605 1.00 73.24 C ATOM 22 C GLY A 2 -0.227 -11.509 0.446 1.00 24.34 C ATOM 23 O GLY A 2 0.787 -11.262 -0.210 1.00 1.11 O ATOM 0 H GLY A 2 -1.988 -13.187 2.401 1.00 31.31 H new ATOM 0 HA2 GLY A 2 -0.101 -11.954 2.542 1.00 73.24 H new ATOM 0 HA3 GLY A 2 0.747 -13.094 1.517 1.00 73.24 H new ATOM 27 N THR A 3 -1.420 -10.944 0.178 1.00 14.45 N ATOM 28 CA THR A 3 -1.580 -9.854 -0.809 1.00 51.42 C ATOM 29 C THR A 3 -1.076 -8.544 -0.195 1.00 23.24 C ATOM 30 O THR A 3 -1.283 -8.294 0.996 1.00 62.21 O ATOM 31 CB THR A 3 -3.065 -9.701 -1.279 1.00 34.52 C ATOM 32 OG1 THR A 3 -3.947 -9.691 -0.139 1.00 5.44 O ATOM 33 CG2 THR A 3 -3.472 -10.840 -2.230 1.00 75.31 C ATOM 0 H THR A 3 -2.290 -11.224 0.631 1.00 14.45 H new ATOM 0 HA THR A 3 -0.991 -10.102 -1.692 1.00 51.42 H new ATOM 0 HB THR A 3 -3.147 -8.756 -1.817 1.00 34.52 H new ATOM 0 HG1 THR A 3 -4.849 -9.435 -0.425 1.00 5.44 H new ATOM 0 HG21 THR A 3 -4.509 -10.704 -2.538 1.00 75.31 H new ATOM 0 HG22 THR A 3 -2.828 -10.828 -3.109 1.00 75.31 H new ATOM 0 HG23 THR A 3 -3.368 -11.796 -1.718 1.00 75.31 H new ATOM 41 N VAL A 4 -0.418 -7.710 -1.015 1.00 52.42 N ATOM 42 CA VAL A 4 0.263 -6.501 -0.534 1.00 43.34 C ATOM 43 C VAL A 4 -0.472 -5.301 -1.116 1.00 71.14 C ATOM 44 O VAL A 4 -0.482 -5.110 -2.334 1.00 33.34 O ATOM 45 CB VAL A 4 1.791 -6.477 -0.961 1.00 10.11 C ATOM 46 CG1 VAL A 4 2.544 -5.296 -0.289 1.00 25.05 C ATOM 47 CG2 VAL A 4 2.475 -7.829 -0.638 1.00 21.35 C ATOM 0 H VAL A 4 -0.344 -7.854 -2.022 1.00 52.42 H new ATOM 0 HA VAL A 4 0.244 -6.479 0.556 1.00 43.34 H new ATOM 0 HB VAL A 4 1.835 -6.326 -2.040 1.00 10.11 H new ATOM 0 HG11 VAL A 4 3.588 -5.306 -0.601 1.00 25.05 H new ATOM 0 HG12 VAL A 4 2.085 -4.354 -0.589 1.00 25.05 H new ATOM 0 HG13 VAL A 4 2.488 -5.398 0.795 1.00 25.05 H new ATOM 0 HG21 VAL A 4 3.522 -7.788 -0.940 1.00 21.35 H new ATOM 0 HG22 VAL A 4 2.413 -8.021 0.433 1.00 21.35 H new ATOM 0 HG23 VAL A 4 1.972 -8.630 -1.180 1.00 21.35 H new ATOM 57 N VAL A 5 -1.104 -4.508 -0.240 1.00 10.51 N ATOM 58 CA VAL A 5 -1.859 -3.315 -0.644 1.00 41.12 C ATOM 59 C VAL A 5 -1.223 -2.066 0.010 1.00 23.02 C ATOM 60 O VAL A 5 -1.222 -1.907 1.228 1.00 31.30 O ATOM 61 CB VAL A 5 -3.410 -3.469 -0.336 1.00 14.53 C ATOM 62 CG1 VAL A 5 -4.051 -4.532 -1.265 1.00 61.25 C ATOM 63 CG2 VAL A 5 -3.698 -3.820 1.138 1.00 14.41 C ATOM 0 H VAL A 5 -1.106 -4.675 0.766 1.00 10.51 H new ATOM 0 HA VAL A 5 -1.797 -3.192 -1.725 1.00 41.12 H new ATOM 0 HB VAL A 5 -3.859 -2.495 -0.530 1.00 14.53 H new ATOM 0 HG11 VAL A 5 -5.113 -4.621 -1.037 1.00 61.25 H new ATOM 0 HG12 VAL A 5 -3.927 -4.229 -2.305 1.00 61.25 H new ATOM 0 HG13 VAL A 5 -3.564 -5.494 -1.107 1.00 61.25 H new ATOM 0 HG21 VAL A 5 -4.774 -3.912 1.287 1.00 14.41 H new ATOM 0 HG22 VAL A 5 -3.215 -4.765 1.388 1.00 14.41 H new ATOM 0 HG23 VAL A 5 -3.309 -3.032 1.782 1.00 14.41 H new ATOM 73 N ILE A 6 -0.642 -1.196 -0.839 1.00 75.53 N ATOM 74 CA ILE A 6 0.177 -0.050 -0.400 1.00 53.12 C ATOM 75 C ILE A 6 -0.663 1.230 -0.508 1.00 51.31 C ATOM 76 O ILE A 6 -0.928 1.699 -1.612 1.00 20.11 O ATOM 77 CB ILE A 6 1.502 0.116 -1.266 1.00 41.43 C ATOM 78 CG1 ILE A 6 2.365 -1.202 -1.331 1.00 21.21 C ATOM 79 CG2 ILE A 6 2.368 1.293 -0.739 1.00 33.35 C ATOM 80 CD1 ILE A 6 1.883 -2.251 -2.326 1.00 13.35 C ATOM 0 H ILE A 6 -0.728 -1.269 -1.853 1.00 75.53 H new ATOM 0 HA ILE A 6 0.482 -0.233 0.630 1.00 53.12 H new ATOM 0 HB ILE A 6 1.174 0.336 -2.282 1.00 41.43 H new ATOM 0 HG12 ILE A 6 3.391 -0.932 -1.582 1.00 21.21 H new ATOM 0 HG13 ILE A 6 2.387 -1.651 -0.338 1.00 21.21 H new ATOM 0 HG21 ILE A 6 3.267 1.384 -1.348 1.00 33.35 H new ATOM 0 HG22 ILE A 6 1.796 2.219 -0.795 1.00 33.35 H new ATOM 0 HG23 ILE A 6 2.649 1.102 0.297 1.00 33.35 H new ATOM 0 HD11 ILE A 6 2.545 -3.116 -2.292 1.00 13.35 H new ATOM 0 HD12 ILE A 6 0.870 -2.559 -2.068 1.00 13.35 H new ATOM 0 HD13 ILE A 6 1.889 -1.829 -3.331 1.00 13.35 H new ATOM 92 N VAL A 7 -1.078 1.779 0.638 1.00 31.32 N ATOM 93 CA VAL A 7 -1.907 2.993 0.684 1.00 21.12 C ATOM 94 C VAL A 7 -0.997 4.218 0.689 1.00 44.22 C ATOM 95 O VAL A 7 -0.242 4.430 1.640 1.00 55.14 O ATOM 96 CB VAL A 7 -2.836 3.023 1.951 1.00 24.20 C ATOM 97 CG1 VAL A 7 -3.812 4.229 1.925 1.00 2.14 C ATOM 98 CG2 VAL A 7 -3.595 1.700 2.078 1.00 44.33 C ATOM 0 H VAL A 7 -0.851 1.399 1.557 1.00 31.32 H new ATOM 0 HA VAL A 7 -2.550 2.997 -0.196 1.00 21.12 H new ATOM 0 HB VAL A 7 -2.203 3.149 2.829 1.00 24.20 H new ATOM 0 HG11 VAL A 7 -4.436 4.212 2.819 1.00 2.14 H new ATOM 0 HG12 VAL A 7 -3.242 5.158 1.898 1.00 2.14 H new ATOM 0 HG13 VAL A 7 -4.445 4.166 1.040 1.00 2.14 H new ATOM 0 HG21 VAL A 7 -4.236 1.731 2.959 1.00 44.33 H new ATOM 0 HG22 VAL A 7 -4.207 1.545 1.190 1.00 44.33 H new ATOM 0 HG23 VAL A 7 -2.883 0.880 2.176 1.00 44.33 H new ATOM 108 N VAL A 8 -1.047 4.991 -0.402 1.00 13.03 N ATOM 109 CA VAL A 8 -0.262 6.221 -0.549 1.00 44.02 C ATOM 110 C VAL A 8 -1.189 7.445 -0.646 1.00 32.31 C ATOM 111 O VAL A 8 -2.208 7.411 -1.348 1.00 30.43 O ATOM 112 CB VAL A 8 0.677 6.182 -1.814 1.00 15.51 C ATOM 113 CG1 VAL A 8 1.544 7.464 -1.887 1.00 50.32 C ATOM 114 CG2 VAL A 8 1.561 4.909 -1.826 1.00 3.41 C ATOM 0 H VAL A 8 -1.634 4.780 -1.209 1.00 13.03 H new ATOM 0 HA VAL A 8 0.366 6.300 0.338 1.00 44.02 H new ATOM 0 HB VAL A 8 0.044 6.145 -2.701 1.00 15.51 H new ATOM 0 HG11 VAL A 8 2.186 7.419 -2.767 1.00 50.32 H new ATOM 0 HG12 VAL A 8 0.896 8.338 -1.954 1.00 50.32 H new ATOM 0 HG13 VAL A 8 2.161 7.538 -0.991 1.00 50.32 H new ATOM 0 HG21 VAL A 8 2.196 4.915 -2.712 1.00 3.41 H new ATOM 0 HG22 VAL A 8 2.185 4.891 -0.933 1.00 3.41 H new ATOM 0 HG23 VAL A 8 0.925 4.024 -1.842 1.00 3.41 H new ATOM 124 N SER A 9 -0.808 8.514 0.069 1.00 71.50 N ATOM 125 CA SER A 9 -1.393 9.853 -0.082 1.00 72.30 C ATOM 126 C SER A 9 -0.402 10.886 0.469 1.00 52.13 C ATOM 127 O SER A 9 0.378 10.580 1.384 1.00 54.35 O ATOM 128 CB SER A 9 -2.766 9.968 0.620 1.00 11.04 C ATOM 129 OG SER A 9 -2.663 9.756 2.011 1.00 11.44 O ATOM 0 H SER A 9 -0.075 8.471 0.777 1.00 71.50 H new ATOM 0 HA SER A 9 -1.574 10.042 -1.140 1.00 72.30 H new ATOM 0 HB2 SER A 9 -3.188 10.955 0.433 1.00 11.04 H new ATOM 0 HB3 SER A 9 -3.455 9.240 0.192 1.00 11.04 H new ATOM 0 HG SER A 9 -2.290 10.556 2.437 1.00 11.44 H new ATOM 135 N ASN A 10 -0.429 12.096 -0.109 1.00 0.45 N ATOM 136 CA ASN A 10 0.516 13.180 0.232 1.00 44.10 C ATOM 137 C ASN A 10 0.317 13.689 1.670 1.00 54.12 C ATOM 138 O ASN A 10 1.294 13.945 2.384 1.00 11.21 O ATOM 139 CB ASN A 10 0.401 14.355 -0.783 1.00 42.55 C ATOM 140 CG ASN A 10 0.774 13.968 -2.221 1.00 64.32 C ATOM 141 OD1 ASN A 10 0.509 12.857 -2.682 1.00 74.12 O ATOM 142 ND2 ASN A 10 1.399 14.882 -2.945 1.00 12.03 N ATOM 0 H ASN A 10 -1.106 12.355 -0.827 1.00 0.45 H new ATOM 0 HA ASN A 10 1.520 12.760 0.170 1.00 44.10 H new ATOM 0 HB2 ASN A 10 -0.621 14.734 -0.772 1.00 42.55 H new ATOM 0 HB3 ASN A 10 1.047 15.170 -0.456 1.00 42.55 H new ATOM 0 HD21 ASN A 10 1.671 14.673 -3.905 1.00 12.03 H new ATOM 0 HD22 ASN A 10 1.608 15.796 -2.543 1.00 12.03 H new ATOM 149 N ASP A 11 -0.952 13.818 2.083 1.00 34.44 N ATOM 150 CA ASP A 11 -1.316 14.316 3.424 1.00 71.53 C ATOM 151 C ASP A 11 -1.252 13.167 4.448 1.00 35.51 C ATOM 152 O ASP A 11 -1.639 12.025 4.149 1.00 2.23 O ATOM 153 CB ASP A 11 -2.726 14.957 3.400 1.00 60.33 C ATOM 154 CG ASP A 11 -3.123 15.623 4.738 1.00 1.01 C ATOM 155 OD1 ASP A 11 -2.828 16.824 4.932 1.00 5.11 O ATOM 156 OD2 ASP A 11 -3.725 14.953 5.601 1.00 11.43 O ATOM 0 H ASP A 11 -1.756 13.582 1.501 1.00 34.44 H new ATOM 0 HA ASP A 11 -0.602 15.084 3.721 1.00 71.53 H new ATOM 0 HB2 ASP A 11 -2.764 15.703 2.606 1.00 60.33 H new ATOM 0 HB3 ASP A 11 -3.461 14.191 3.152 1.00 60.33 H new ATOM 161 N GLU A 12 -0.793 13.520 5.659 1.00 74.32 N ATOM 162 CA GLU A 12 -0.537 12.575 6.767 1.00 22.43 C ATOM 163 C GLU A 12 -1.849 12.066 7.379 1.00 42.01 C ATOM 164 O GLU A 12 -2.056 10.858 7.504 1.00 3.13 O ATOM 165 CB GLU A 12 0.316 13.272 7.860 1.00 1.21 C ATOM 166 CG GLU A 12 1.649 13.832 7.354 1.00 51.31 C ATOM 167 CD GLU A 12 2.450 14.551 8.447 1.00 21.44 C ATOM 168 OE1 GLU A 12 3.148 13.875 9.231 1.00 32.12 O ATOM 169 OE2 GLU A 12 2.368 15.796 8.536 1.00 31.33 O ATOM 0 H GLU A 12 -0.584 14.488 5.904 1.00 74.32 H new ATOM 0 HA GLU A 12 0.005 11.718 6.366 1.00 22.43 H new ATOM 0 HB2 GLU A 12 -0.265 14.085 8.295 1.00 1.21 H new ATOM 0 HB3 GLU A 12 0.515 12.559 8.660 1.00 1.21 H new ATOM 0 HG2 GLU A 12 2.249 13.017 6.948 1.00 51.31 H new ATOM 0 HG3 GLU A 12 1.458 14.526 6.535 1.00 51.31 H new ATOM 176 N ARG A 13 -2.741 13.017 7.723 1.00 51.51 N ATOM 177 CA ARG A 13 -4.000 12.749 8.454 1.00 65.20 C ATOM 178 C ARG A 13 -4.916 11.794 7.683 1.00 22.23 C ATOM 179 O ARG A 13 -5.763 11.129 8.279 1.00 3.11 O ATOM 180 CB ARG A 13 -4.747 14.069 8.715 1.00 51.10 C ATOM 181 CG ARG A 13 -3.932 15.133 9.488 1.00 31.52 C ATOM 182 CD ARG A 13 -4.541 16.534 9.333 1.00 43.32 C ATOM 183 NE ARG A 13 -4.578 16.936 7.907 1.00 11.11 N ATOM 184 CZ ARG A 13 -5.605 17.528 7.284 1.00 73.25 C ATOM 185 NH1 ARG A 13 -6.733 17.816 7.932 1.00 11.33 N ATOM 186 NH2 ARG A 13 -5.495 17.818 5.996 1.00 65.42 N ATOM 0 H ARG A 13 -2.608 14.003 7.500 1.00 51.51 H new ATOM 0 HA ARG A 13 -3.734 12.275 9.399 1.00 65.20 H new ATOM 0 HB2 ARG A 13 -5.055 14.491 7.758 1.00 51.10 H new ATOM 0 HB3 ARG A 13 -5.657 13.851 9.275 1.00 51.10 H new ATOM 0 HG2 ARG A 13 -3.895 14.867 10.544 1.00 31.52 H new ATOM 0 HG3 ARG A 13 -2.904 15.140 9.124 1.00 31.52 H new ATOM 0 HD2 ARG A 13 -5.550 16.545 9.745 1.00 43.32 H new ATOM 0 HD3 ARG A 13 -3.956 17.255 9.904 1.00 43.32 H new ATOM 0 HE ARG A 13 -3.746 16.744 7.349 1.00 11.11 H new ATOM 0 HH11 ARG A 13 -6.826 17.585 8.921 1.00 11.33 H new ATOM 0 HH12 ARG A 13 -7.503 18.267 7.439 1.00 11.33 H new ATOM 0 HH21 ARG A 13 -4.637 17.590 5.493 1.00 65.42 H new ATOM 0 HH22 ARG A 13 -6.268 18.269 5.507 1.00 65.42 H new ATOM 200 N ILE A 14 -4.759 11.788 6.351 1.00 13.42 N ATOM 201 CA ILE A 14 -5.466 10.859 5.468 1.00 15.44 C ATOM 202 C ILE A 14 -5.003 9.423 5.763 1.00 13.21 C ATOM 203 O ILE A 14 -5.812 8.567 6.043 1.00 72.13 O ATOM 204 CB ILE A 14 -5.234 11.232 3.958 1.00 23.13 C ATOM 205 CG1 ILE A 14 -5.665 12.723 3.692 1.00 24.50 C ATOM 206 CG2 ILE A 14 -5.955 10.250 3.003 1.00 50.21 C ATOM 207 CD1 ILE A 14 -7.060 13.123 4.197 1.00 61.33 C ATOM 0 H ILE A 14 -4.137 12.429 5.859 1.00 13.42 H new ATOM 0 HA ILE A 14 -6.537 10.931 5.658 1.00 15.44 H new ATOM 0 HB ILE A 14 -4.168 11.142 3.749 1.00 23.13 H new ATOM 0 HG12 ILE A 14 -4.930 13.381 4.156 1.00 24.50 H new ATOM 0 HG13 ILE A 14 -5.623 12.906 2.618 1.00 24.50 H new ATOM 0 HG21 ILE A 14 -5.769 10.544 1.970 1.00 50.21 H new ATOM 0 HG22 ILE A 14 -5.578 9.240 3.167 1.00 50.21 H new ATOM 0 HG23 ILE A 14 -7.027 10.273 3.199 1.00 50.21 H new ATOM 0 HD11 ILE A 14 -7.247 14.170 3.958 1.00 61.33 H new ATOM 0 HD12 ILE A 14 -7.814 12.501 3.715 1.00 61.33 H new ATOM 0 HD13 ILE A 14 -7.110 12.983 5.277 1.00 61.33 H new ATOM 219 N LEU A 15 -3.680 9.210 5.777 1.00 52.11 N ATOM 220 CA LEU A 15 -3.069 7.902 6.111 1.00 44.14 C ATOM 221 C LEU A 15 -3.385 7.475 7.557 1.00 2.31 C ATOM 222 O LEU A 15 -3.460 6.282 7.840 1.00 54.05 O ATOM 223 CB LEU A 15 -1.541 7.954 5.869 1.00 43.21 C ATOM 224 CG LEU A 15 -1.126 8.128 4.377 1.00 71.04 C ATOM 225 CD1 LEU A 15 0.376 8.418 4.236 1.00 1.43 C ATOM 226 CD2 LEU A 15 -1.542 6.892 3.534 1.00 21.23 C ATOM 0 H LEU A 15 -2.997 9.935 5.558 1.00 52.11 H new ATOM 0 HA LEU A 15 -3.505 7.149 5.455 1.00 44.14 H new ATOM 0 HB2 LEU A 15 -1.123 8.778 6.447 1.00 43.21 H new ATOM 0 HB3 LEU A 15 -1.094 7.037 6.252 1.00 43.21 H new ATOM 0 HG LEU A 15 -1.661 8.995 3.988 1.00 71.04 H new ATOM 0 HD11 LEU A 15 0.627 8.533 3.182 1.00 1.43 H new ATOM 0 HD12 LEU A 15 0.621 9.336 4.770 1.00 1.43 H new ATOM 0 HD13 LEU A 15 0.947 7.591 4.657 1.00 1.43 H new ATOM 0 HD21 LEU A 15 -1.240 7.040 2.497 1.00 21.23 H new ATOM 0 HD22 LEU A 15 -1.055 6.001 3.930 1.00 21.23 H new ATOM 0 HD23 LEU A 15 -2.624 6.766 3.583 1.00 21.23 H new ATOM 238 N GLU A 16 -3.553 8.465 8.455 1.00 53.12 N ATOM 239 CA GLU A 16 -3.941 8.225 9.860 1.00 65.13 C ATOM 240 C GLU A 16 -5.410 7.765 9.979 1.00 53.01 C ATOM 241 O GLU A 16 -5.695 6.787 10.675 1.00 33.01 O ATOM 242 CB GLU A 16 -3.676 9.501 10.720 1.00 52.30 C ATOM 243 CG GLU A 16 -2.257 9.610 11.330 1.00 63.31 C ATOM 244 CD GLU A 16 -1.112 9.635 10.309 1.00 62.10 C ATOM 245 OE1 GLU A 16 -0.764 8.567 9.773 1.00 21.34 O ATOM 246 OE2 GLU A 16 -0.532 10.711 10.066 1.00 34.35 O ATOM 0 H GLU A 16 -3.424 9.451 8.229 1.00 53.12 H new ATOM 0 HA GLU A 16 -3.323 7.414 10.245 1.00 65.13 H new ATOM 0 HB2 GLU A 16 -3.855 10.379 10.100 1.00 52.30 H new ATOM 0 HB3 GLU A 16 -4.404 9.530 11.530 1.00 52.30 H new ATOM 0 HG2 GLU A 16 -2.206 10.517 11.933 1.00 63.31 H new ATOM 0 HG3 GLU A 16 -2.103 8.769 12.006 1.00 63.31 H new ATOM 253 N GLU A 17 -6.324 8.479 9.301 1.00 61.22 N ATOM 254 CA GLU A 17 -7.765 8.153 9.298 1.00 61.43 C ATOM 255 C GLU A 17 -7.994 6.783 8.642 1.00 35.20 C ATOM 256 O GLU A 17 -8.652 5.900 9.207 1.00 42.34 O ATOM 257 CB GLU A 17 -8.556 9.262 8.550 1.00 22.35 C ATOM 258 CG GLU A 17 -10.079 9.049 8.516 1.00 61.01 C ATOM 259 CD GLU A 17 -10.826 10.211 7.850 1.00 21.10 C ATOM 260 OE1 GLU A 17 -11.060 11.238 8.525 1.00 10.25 O ATOM 261 OE2 GLU A 17 -11.180 10.102 6.655 1.00 2.11 O ATOM 0 H GLU A 17 -6.088 9.297 8.740 1.00 61.22 H new ATOM 0 HA GLU A 17 -8.125 8.105 10.326 1.00 61.43 H new ATOM 0 HB2 GLU A 17 -8.347 10.221 9.023 1.00 22.35 H new ATOM 0 HB3 GLU A 17 -8.188 9.325 7.526 1.00 22.35 H new ATOM 0 HG2 GLU A 17 -10.300 8.126 7.980 1.00 61.01 H new ATOM 0 HG3 GLU A 17 -10.447 8.923 9.534 1.00 61.01 H new ATOM 268 N LEU A 18 -7.375 6.626 7.463 1.00 33.20 N ATOM 269 CA LEU A 18 -7.401 5.396 6.655 1.00 4.13 C ATOM 270 C LEU A 18 -6.732 4.222 7.402 1.00 51.50 C ATOM 271 O LEU A 18 -7.109 3.065 7.183 1.00 55.42 O ATOM 272 CB LEU A 18 -6.720 5.650 5.269 1.00 61.31 C ATOM 273 CG LEU A 18 -7.607 6.292 4.133 1.00 14.52 C ATOM 274 CD1 LEU A 18 -8.313 7.609 4.559 1.00 53.10 C ATOM 275 CD2 LEU A 18 -6.763 6.507 2.858 1.00 64.40 C ATOM 0 H LEU A 18 -6.827 7.371 7.033 1.00 33.20 H new ATOM 0 HA LEU A 18 -8.441 5.117 6.482 1.00 4.13 H new ATOM 0 HB2 LEU A 18 -5.858 6.298 5.430 1.00 61.31 H new ATOM 0 HB3 LEU A 18 -6.339 4.698 4.901 1.00 61.31 H new ATOM 0 HG LEU A 18 -8.408 5.582 3.927 1.00 14.52 H new ATOM 0 HD11 LEU A 18 -8.904 7.991 3.726 1.00 53.10 H new ATOM 0 HD12 LEU A 18 -8.967 7.413 5.408 1.00 53.10 H new ATOM 0 HD13 LEU A 18 -7.564 8.349 4.841 1.00 53.10 H new ATOM 0 HD21 LEU A 18 -7.385 6.950 2.080 1.00 64.40 H new ATOM 0 HD22 LEU A 18 -5.930 7.174 3.081 1.00 64.40 H new ATOM 0 HD23 LEU A 18 -6.377 5.548 2.511 1.00 64.40 H new ATOM 287 N LEU A 19 -5.738 4.530 8.277 1.00 42.11 N ATOM 288 CA LEU A 19 -5.104 3.516 9.153 1.00 54.50 C ATOM 289 C LEU A 19 -6.149 2.897 10.071 1.00 51.43 C ATOM 290 O LEU A 19 -6.301 1.688 10.115 1.00 33.41 O ATOM 291 CB LEU A 19 -3.965 4.122 10.018 1.00 74.01 C ATOM 292 CG LEU A 19 -3.312 3.151 11.063 1.00 13.13 C ATOM 293 CD1 LEU A 19 -2.453 2.064 10.389 1.00 40.21 C ATOM 294 CD2 LEU A 19 -2.511 3.923 12.118 1.00 34.45 C ATOM 0 H LEU A 19 -5.361 5.471 8.392 1.00 42.11 H new ATOM 0 HA LEU A 19 -4.670 2.755 8.504 1.00 54.50 H new ATOM 0 HB2 LEU A 19 -3.184 4.488 9.352 1.00 74.01 H new ATOM 0 HB3 LEU A 19 -4.360 4.987 10.551 1.00 74.01 H new ATOM 0 HG LEU A 19 -4.128 2.639 11.573 1.00 13.13 H new ATOM 0 HD11 LEU A 19 -2.022 1.416 11.152 1.00 40.21 H new ATOM 0 HD12 LEU A 19 -3.076 1.471 9.719 1.00 40.21 H new ATOM 0 HD13 LEU A 19 -1.653 2.535 9.818 1.00 40.21 H new ATOM 0 HD21 LEU A 19 -2.072 3.221 12.827 1.00 34.45 H new ATOM 0 HD22 LEU A 19 -1.718 4.490 11.630 1.00 34.45 H new ATOM 0 HD23 LEU A 19 -3.173 4.608 12.648 1.00 34.45 H new ATOM 306 N GLU A 20 -6.891 3.780 10.755 1.00 11.45 N ATOM 307 CA GLU A 20 -7.900 3.402 11.755 1.00 72.53 C ATOM 308 C GLU A 20 -9.064 2.628 11.110 1.00 23.10 C ATOM 309 O GLU A 20 -9.656 1.764 11.746 1.00 52.42 O ATOM 310 CB GLU A 20 -8.407 4.678 12.466 1.00 44.10 C ATOM 311 CG GLU A 20 -7.278 5.522 13.084 1.00 54.42 C ATOM 312 CD GLU A 20 -7.783 6.860 13.646 1.00 53.23 C ATOM 313 OE1 GLU A 20 -7.981 7.808 12.852 1.00 41.01 O ATOM 314 OE2 GLU A 20 -8.007 6.965 14.872 1.00 21.24 O ATOM 0 H GLU A 20 -6.806 4.788 10.628 1.00 11.45 H new ATOM 0 HA GLU A 20 -7.444 2.737 12.488 1.00 72.53 H new ATOM 0 HB2 GLU A 20 -8.958 5.289 11.751 1.00 44.10 H new ATOM 0 HB3 GLU A 20 -9.109 4.394 13.250 1.00 44.10 H new ATOM 0 HG2 GLU A 20 -6.799 4.954 13.882 1.00 54.42 H new ATOM 0 HG3 GLU A 20 -6.517 5.713 12.328 1.00 54.42 H new ATOM 321 N VAL A 21 -9.355 2.953 9.832 1.00 34.55 N ATOM 322 CA VAL A 21 -10.377 2.261 9.029 1.00 72.11 C ATOM 323 C VAL A 21 -10.040 0.766 8.868 1.00 31.32 C ATOM 324 O VAL A 21 -10.849 -0.100 9.230 1.00 1.35 O ATOM 325 CB VAL A 21 -10.517 2.940 7.610 1.00 50.41 C ATOM 326 CG1 VAL A 21 -11.393 2.110 6.646 1.00 54.42 C ATOM 327 CG2 VAL A 21 -11.061 4.381 7.747 1.00 44.13 C ATOM 0 H VAL A 21 -8.884 3.706 9.330 1.00 34.55 H new ATOM 0 HA VAL A 21 -11.327 2.342 9.557 1.00 72.11 H new ATOM 0 HB VAL A 21 -9.519 2.983 7.174 1.00 50.41 H new ATOM 0 HG11 VAL A 21 -11.458 2.619 5.684 1.00 54.42 H new ATOM 0 HG12 VAL A 21 -10.947 1.125 6.506 1.00 54.42 H new ATOM 0 HG13 VAL A 21 -12.392 1.999 7.067 1.00 54.42 H new ATOM 0 HG21 VAL A 21 -11.150 4.832 6.759 1.00 44.13 H new ATOM 0 HG22 VAL A 21 -12.041 4.356 8.224 1.00 44.13 H new ATOM 0 HG23 VAL A 21 -10.376 4.972 8.355 1.00 44.13 H new ATOM 337 N VAL A 22 -8.819 0.489 8.380 1.00 34.45 N ATOM 338 CA VAL A 22 -8.357 -0.881 8.091 1.00 2.11 C ATOM 339 C VAL A 22 -8.029 -1.647 9.394 1.00 22.14 C ATOM 340 O VAL A 22 -8.358 -2.833 9.523 1.00 51.41 O ATOM 341 CB VAL A 22 -7.091 -0.872 7.155 1.00 63.52 C ATOM 342 CG1 VAL A 22 -6.761 -2.293 6.653 1.00 2.14 C ATOM 343 CG2 VAL A 22 -7.273 0.091 5.970 1.00 32.45 C ATOM 0 H VAL A 22 -8.124 1.207 8.175 1.00 34.45 H new ATOM 0 HA VAL A 22 -9.172 -1.391 7.576 1.00 2.11 H new ATOM 0 HB VAL A 22 -6.250 -0.515 7.750 1.00 63.52 H new ATOM 0 HG11 VAL A 22 -5.882 -2.256 6.009 1.00 2.14 H new ATOM 0 HG12 VAL A 22 -6.560 -2.942 7.505 1.00 2.14 H new ATOM 0 HG13 VAL A 22 -7.608 -2.686 6.090 1.00 2.14 H new ATOM 0 HG21 VAL A 22 -6.380 0.072 5.345 1.00 32.45 H new ATOM 0 HG22 VAL A 22 -8.136 -0.217 5.380 1.00 32.45 H new ATOM 0 HG23 VAL A 22 -7.432 1.102 6.344 1.00 32.45 H new ATOM 353 N LEU A 23 -7.389 -0.937 10.352 1.00 62.51 N ATOM 354 CA LEU A 23 -6.943 -1.505 11.646 1.00 20.31 C ATOM 355 C LEU A 23 -8.141 -2.044 12.455 1.00 60.44 C ATOM 356 O LEU A 23 -8.063 -3.122 13.065 1.00 30.32 O ATOM 357 CB LEU A 23 -6.134 -0.429 12.472 1.00 63.02 C ATOM 358 CG LEU A 23 -4.783 -0.903 13.106 1.00 62.42 C ATOM 359 CD1 LEU A 23 -4.050 0.272 13.787 1.00 44.03 C ATOM 360 CD2 LEU A 23 -4.972 -2.086 14.082 1.00 35.13 C ATOM 0 H LEU A 23 -7.166 0.053 10.248 1.00 62.51 H new ATOM 0 HA LEU A 23 -6.279 -2.345 11.441 1.00 20.31 H new ATOM 0 HB2 LEU A 23 -5.925 0.417 11.817 1.00 63.02 H new ATOM 0 HB3 LEU A 23 -6.776 -0.061 13.273 1.00 63.02 H new ATOM 0 HG LEU A 23 -4.160 -1.268 12.290 1.00 62.42 H new ATOM 0 HD11 LEU A 23 -3.115 -0.084 14.219 1.00 44.03 H new ATOM 0 HD12 LEU A 23 -3.837 1.045 13.049 1.00 44.03 H new ATOM 0 HD13 LEU A 23 -4.679 0.686 14.575 1.00 44.03 H new ATOM 0 HD21 LEU A 23 -4.005 -2.376 14.494 1.00 35.13 H new ATOM 0 HD22 LEU A 23 -5.636 -1.786 14.892 1.00 35.13 H new ATOM 0 HD23 LEU A 23 -5.408 -2.931 13.549 1.00 35.13 H new ATOM 372 N LYS A 24 -9.254 -1.278 12.459 1.00 71.21 N ATOM 373 CA LYS A 24 -10.480 -1.673 13.185 1.00 43.42 C ATOM 374 C LYS A 24 -11.293 -2.708 12.379 1.00 13.22 C ATOM 375 O LYS A 24 -12.061 -3.480 12.961 1.00 44.51 O ATOM 376 CB LYS A 24 -11.358 -0.439 13.530 1.00 23.24 C ATOM 377 CG LYS A 24 -12.249 0.084 12.388 1.00 61.11 C ATOM 378 CD LYS A 24 -13.055 1.335 12.792 1.00 30.53 C ATOM 379 CE LYS A 24 -14.084 1.724 11.730 1.00 53.53 C ATOM 380 NZ LYS A 24 -13.468 1.974 10.405 1.00 1.23 N ATOM 0 H LYS A 24 -9.328 -0.386 11.970 1.00 71.21 H new ATOM 0 HA LYS A 24 -10.169 -2.136 14.122 1.00 43.42 H new ATOM 0 HB2 LYS A 24 -11.996 -0.694 14.376 1.00 23.24 H new ATOM 0 HB3 LYS A 24 -10.704 0.370 13.856 1.00 23.24 H new ATOM 0 HG2 LYS A 24 -11.626 0.320 11.525 1.00 61.11 H new ATOM 0 HG3 LYS A 24 -12.937 -0.703 12.079 1.00 61.11 H new ATOM 0 HD2 LYS A 24 -13.564 1.148 13.738 1.00 30.53 H new ATOM 0 HD3 LYS A 24 -12.372 2.168 12.957 1.00 30.53 H new ATOM 0 HE2 LYS A 24 -14.824 0.929 11.638 1.00 53.53 H new ATOM 0 HE3 LYS A 24 -14.615 2.619 12.054 1.00 53.53 H new ATOM 0 HZ1 LYS A 24 -14.215 2.151 9.703 1.00 1.23 H new ATOM 0 HZ2 LYS A 24 -12.844 2.804 10.463 1.00 1.23 H new ATOM 0 HZ3 LYS A 24 -12.913 1.143 10.118 1.00 1.23 H new ATOM 394 N SER A 25 -11.128 -2.690 11.033 1.00 5.32 N ATOM 395 CA SER A 25 -11.801 -3.632 10.121 1.00 63.42 C ATOM 396 C SER A 25 -11.259 -5.055 10.324 1.00 75.42 C ATOM 397 O SER A 25 -12.013 -6.028 10.213 1.00 22.41 O ATOM 398 CB SER A 25 -11.625 -3.177 8.653 1.00 32.11 C ATOM 399 OG SER A 25 -12.304 -4.028 7.736 1.00 71.11 O ATOM 0 H SER A 25 -10.524 -2.021 10.556 1.00 5.32 H new ATOM 0 HA SER A 25 -12.867 -3.640 10.350 1.00 63.42 H new ATOM 0 HB2 SER A 25 -11.998 -2.159 8.544 1.00 32.11 H new ATOM 0 HB3 SER A 25 -10.563 -3.156 8.407 1.00 32.11 H new ATOM 0 HG SER A 25 -11.914 -3.924 6.843 1.00 71.11 H new ATOM 405 N ASP A 26 -9.948 -5.152 10.626 1.00 12.14 N ATOM 406 CA ASP A 26 -9.280 -6.422 10.950 1.00 60.32 C ATOM 407 C ASP A 26 -7.877 -6.122 11.546 1.00 73.44 C ATOM 408 O ASP A 26 -7.037 -5.529 10.859 1.00 2.13 O ATOM 409 CB ASP A 26 -9.161 -7.329 9.688 1.00 42.21 C ATOM 410 CG ASP A 26 -8.810 -8.794 10.021 1.00 24.31 C ATOM 411 OD1 ASP A 26 -7.650 -9.072 10.391 1.00 33.51 O ATOM 412 OD2 ASP A 26 -9.694 -9.678 9.926 1.00 33.14 O ATOM 0 H ASP A 26 -9.323 -4.346 10.651 1.00 12.14 H new ATOM 0 HA ASP A 26 -9.877 -6.962 11.685 1.00 60.32 H new ATOM 0 HB2 ASP A 26 -10.103 -7.304 9.141 1.00 42.21 H new ATOM 0 HB3 ASP A 26 -8.397 -6.921 9.026 1.00 42.21 H new ATOM 417 N PRO A 27 -7.601 -6.536 12.836 1.00 5.31 N ATOM 418 CA PRO A 27 -6.307 -6.252 13.520 1.00 54.45 C ATOM 419 C PRO A 27 -5.162 -7.228 13.141 1.00 5.25 C ATOM 420 O PRO A 27 -4.003 -7.014 13.532 1.00 51.43 O ATOM 421 CB PRO A 27 -6.693 -6.391 15.011 1.00 40.31 C ATOM 422 CG PRO A 27 -7.750 -7.457 15.028 1.00 34.41 C ATOM 423 CD PRO A 27 -8.530 -7.286 13.736 1.00 13.22 C ATOM 0 HA PRO A 27 -5.901 -5.280 13.241 1.00 54.45 H new ATOM 0 HB2 PRO A 27 -5.834 -6.674 15.619 1.00 40.31 H new ATOM 0 HB3 PRO A 27 -7.071 -5.451 15.412 1.00 40.31 H new ATOM 0 HG2 PRO A 27 -7.304 -8.450 15.087 1.00 34.41 H new ATOM 0 HG3 PRO A 27 -8.401 -7.348 15.895 1.00 34.41 H new ATOM 0 HD2 PRO A 27 -8.806 -8.250 13.308 1.00 13.22 H new ATOM 0 HD3 PRO A 27 -9.455 -6.734 13.901 1.00 13.22 H new ATOM 431 N ASN A 28 -5.494 -8.295 12.394 1.00 10.33 N ATOM 432 CA ASN A 28 -4.512 -9.317 11.959 1.00 1.44 C ATOM 433 C ASN A 28 -3.959 -8.981 10.562 1.00 33.50 C ATOM 434 O ASN A 28 -2.865 -9.434 10.195 1.00 60.41 O ATOM 435 CB ASN A 28 -5.147 -10.733 12.002 1.00 23.31 C ATOM 436 CG ASN A 28 -5.255 -11.297 13.429 1.00 34.23 C ATOM 437 OD1 ASN A 28 -4.357 -11.995 13.900 1.00 11.11 O ATOM 438 ND2 ASN A 28 -6.324 -10.974 14.141 1.00 14.32 N ATOM 0 H ASN A 28 -6.445 -8.478 12.073 1.00 10.33 H new ATOM 0 HA ASN A 28 -3.670 -9.312 12.652 1.00 1.44 H new ATOM 0 HB2 ASN A 28 -6.141 -10.694 11.556 1.00 23.31 H new ATOM 0 HB3 ASN A 28 -4.551 -11.412 11.392 1.00 23.31 H new ATOM 0 HD21 ASN A 28 -6.416 -11.305 15.101 1.00 14.32 H new ATOM 0 HD22 ASN A 28 -7.055 -10.394 13.729 1.00 14.32 H new ATOM 445 N VAL A 29 -4.729 -8.194 9.791 1.00 42.42 N ATOM 446 CA VAL A 29 -4.249 -7.556 8.555 1.00 61.02 C ATOM 447 C VAL A 29 -3.279 -6.425 8.957 1.00 63.23 C ATOM 448 O VAL A 29 -3.716 -5.396 9.489 1.00 1.13 O ATOM 449 CB VAL A 29 -5.451 -6.993 7.698 1.00 45.14 C ATOM 450 CG1 VAL A 29 -4.970 -6.238 6.444 1.00 65.42 C ATOM 451 CG2 VAL A 29 -6.413 -8.129 7.300 1.00 43.42 C ATOM 0 H VAL A 29 -5.703 -7.983 10.008 1.00 42.42 H new ATOM 0 HA VAL A 29 -3.737 -8.289 7.931 1.00 61.02 H new ATOM 0 HB VAL A 29 -5.983 -6.278 8.326 1.00 45.14 H new ATOM 0 HG11 VAL A 29 -5.832 -5.870 5.888 1.00 65.42 H new ATOM 0 HG12 VAL A 29 -4.345 -5.396 6.743 1.00 65.42 H new ATOM 0 HG13 VAL A 29 -4.392 -6.913 5.813 1.00 65.42 H new ATOM 0 HG21 VAL A 29 -7.234 -7.721 6.710 1.00 43.42 H new ATOM 0 HG22 VAL A 29 -5.876 -8.871 6.709 1.00 43.42 H new ATOM 0 HG23 VAL A 29 -6.811 -8.600 8.199 1.00 43.42 H new ATOM 461 N LYS A 30 -1.964 -6.649 8.736 1.00 50.34 N ATOM 462 CA LYS A 30 -0.895 -5.801 9.302 1.00 4.04 C ATOM 463 C LYS A 30 -0.799 -4.437 8.611 1.00 43.31 C ATOM 464 O LYS A 30 -0.186 -4.297 7.551 1.00 1.14 O ATOM 465 CB LYS A 30 0.475 -6.533 9.283 1.00 22.12 C ATOM 466 CG LYS A 30 0.532 -7.789 10.186 1.00 52.24 C ATOM 467 CD LYS A 30 0.112 -7.506 11.666 1.00 74.53 C ATOM 468 CE LYS A 30 1.023 -6.484 12.391 1.00 61.42 C ATOM 469 NZ LYS A 30 2.411 -6.980 12.571 1.00 41.03 N ATOM 0 H LYS A 30 -1.617 -7.419 8.163 1.00 50.34 H new ATOM 0 HA LYS A 30 -1.166 -5.611 10.340 1.00 4.04 H new ATOM 0 HB2 LYS A 30 0.705 -6.825 8.258 1.00 22.12 H new ATOM 0 HB3 LYS A 30 1.252 -5.836 9.598 1.00 22.12 H new ATOM 0 HG2 LYS A 30 -0.121 -8.557 9.771 1.00 52.24 H new ATOM 0 HG3 LYS A 30 1.545 -8.191 10.174 1.00 52.24 H new ATOM 0 HD2 LYS A 30 -0.914 -7.137 11.678 1.00 74.53 H new ATOM 0 HD3 LYS A 30 0.120 -8.444 12.222 1.00 74.53 H new ATOM 0 HE2 LYS A 30 1.045 -5.555 11.822 1.00 61.42 H new ATOM 0 HE3 LYS A 30 0.596 -6.250 13.366 1.00 61.42 H new ATOM 0 HZ1 LYS A 30 2.977 -6.258 13.061 1.00 41.03 H new ATOM 0 HZ2 LYS A 30 2.397 -7.852 13.138 1.00 41.03 H new ATOM 0 HZ3 LYS A 30 2.832 -7.178 11.641 1.00 41.03 H new ATOM 483 N THR A 31 -1.434 -3.450 9.237 1.00 23.32 N ATOM 484 CA THR A 31 -1.390 -2.057 8.818 1.00 72.33 C ATOM 485 C THR A 31 -0.140 -1.377 9.402 1.00 45.41 C ATOM 486 O THR A 31 -0.116 -0.980 10.576 1.00 63.11 O ATOM 487 CB THR A 31 -2.674 -1.337 9.295 1.00 74.32 C ATOM 488 OG1 THR A 31 -2.789 -1.445 10.716 1.00 13.35 O ATOM 489 CG2 THR A 31 -3.926 -1.930 8.653 1.00 63.40 C ATOM 0 H THR A 31 -2.006 -3.602 10.068 1.00 23.32 H new ATOM 0 HA THR A 31 -1.337 -2.001 7.731 1.00 72.33 H new ATOM 0 HB THR A 31 -2.595 -0.292 8.997 1.00 74.32 H new ATOM 0 HG1 THR A 31 -1.907 -1.322 11.126 1.00 13.35 H new ATOM 0 HG21 THR A 31 -4.806 -1.398 9.013 1.00 63.40 H new ATOM 0 HG22 THR A 31 -3.861 -1.832 7.569 1.00 63.40 H new ATOM 0 HG23 THR A 31 -4.006 -2.984 8.918 1.00 63.40 H new ATOM 497 N VAL A 32 0.901 -1.247 8.578 1.00 61.31 N ATOM 498 CA VAL A 32 2.207 -0.765 9.038 1.00 13.32 C ATOM 499 C VAL A 32 2.501 0.608 8.404 1.00 61.43 C ATOM 500 O VAL A 32 2.665 0.729 7.185 1.00 45.43 O ATOM 501 CB VAL A 32 3.350 -1.794 8.658 1.00 44.44 C ATOM 502 CG1 VAL A 32 4.723 -1.359 9.229 1.00 43.44 C ATOM 503 CG2 VAL A 32 2.988 -3.234 9.115 1.00 73.41 C ATOM 0 H VAL A 32 0.866 -1.470 7.583 1.00 61.31 H new ATOM 0 HA VAL A 32 2.183 -0.667 10.123 1.00 13.32 H new ATOM 0 HB VAL A 32 3.432 -1.798 7.571 1.00 44.44 H new ATOM 0 HG11 VAL A 32 5.482 -2.089 8.948 1.00 43.44 H new ATOM 0 HG12 VAL A 32 4.992 -0.383 8.826 1.00 43.44 H new ATOM 0 HG13 VAL A 32 4.663 -1.299 10.316 1.00 43.44 H new ATOM 0 HG21 VAL A 32 3.792 -3.916 8.840 1.00 73.41 H new ATOM 0 HG22 VAL A 32 2.853 -3.249 10.197 1.00 73.41 H new ATOM 0 HG23 VAL A 32 2.064 -3.548 8.630 1.00 73.41 H new ATOM 513 N ARG A 33 2.524 1.642 9.268 1.00 21.13 N ATOM 514 CA ARG A 33 3.060 2.965 8.937 1.00 31.13 C ATOM 515 C ARG A 33 4.562 2.931 9.243 1.00 40.42 C ATOM 516 O ARG A 33 4.957 2.749 10.402 1.00 41.32 O ATOM 517 CB ARG A 33 2.338 4.071 9.769 1.00 14.05 C ATOM 518 CG ARG A 33 0.873 4.382 9.313 1.00 72.34 C ATOM 519 CD ARG A 33 0.692 5.819 8.780 1.00 21.23 C ATOM 520 NE ARG A 33 1.684 6.184 7.739 1.00 35.13 N ATOM 521 CZ ARG A 33 1.919 7.435 7.300 1.00 40.00 C ATOM 522 NH1 ARG A 33 1.251 8.475 7.782 1.00 52.14 N ATOM 523 NH2 ARG A 33 2.822 7.653 6.365 1.00 1.13 N ATOM 0 H ARG A 33 2.167 1.576 10.221 1.00 21.13 H new ATOM 0 HA ARG A 33 2.894 3.202 7.886 1.00 31.13 H new ATOM 0 HB2 ARG A 33 2.321 3.766 10.815 1.00 14.05 H new ATOM 0 HB3 ARG A 33 2.924 4.989 9.714 1.00 14.05 H new ATOM 0 HG2 ARG A 33 0.584 3.674 8.536 1.00 72.34 H new ATOM 0 HG3 ARG A 33 0.197 4.226 10.154 1.00 72.34 H new ATOM 0 HD2 ARG A 33 -0.312 5.924 8.369 1.00 21.23 H new ATOM 0 HD3 ARG A 33 0.771 6.521 9.610 1.00 21.23 H new ATOM 0 HE ARG A 33 2.230 5.429 7.324 1.00 35.13 H new ATOM 0 HH11 ARG A 33 0.541 8.336 8.501 1.00 52.14 H new ATOM 0 HH12 ARG A 33 1.447 9.413 7.433 1.00 52.14 H new ATOM 0 HH21 ARG A 33 3.346 6.872 5.971 1.00 1.13 H new ATOM 0 HH22 ARG A 33 2.996 8.603 6.036 1.00 1.13 H new ATOM 537 N THR A 34 5.387 3.083 8.203 1.00 12.10 N ATOM 538 CA THR A 34 6.846 2.909 8.301 1.00 20.34 C ATOM 539 C THR A 34 7.554 3.811 7.283 1.00 64.32 C ATOM 540 O THR A 34 8.582 4.427 7.600 1.00 60.44 O ATOM 541 CB THR A 34 7.263 1.401 8.106 1.00 54.44 C ATOM 542 OG1 THR A 34 8.690 1.265 8.070 1.00 5.42 O ATOM 543 CG2 THR A 34 6.660 0.766 6.838 1.00 44.01 C ATOM 0 H THR A 34 5.066 3.330 7.267 1.00 12.10 H new ATOM 0 HA THR A 34 7.157 3.203 9.304 1.00 20.34 H new ATOM 0 HB THR A 34 6.860 0.867 8.966 1.00 54.44 H new ATOM 0 HG1 THR A 34 9.087 1.786 8.799 1.00 5.42 H new ATOM 0 HG21 THR A 34 6.985 -0.272 6.761 1.00 44.01 H new ATOM 0 HG22 THR A 34 5.572 0.803 6.895 1.00 44.01 H new ATOM 0 HG23 THR A 34 6.996 1.317 5.960 1.00 44.01 H new ATOM 551 N ASP A 35 6.982 3.870 6.055 1.00 34.32 N ATOM 552 CA ASP A 35 7.460 4.733 4.951 1.00 52.42 C ATOM 553 C ASP A 35 8.931 4.418 4.577 1.00 0.31 C ATOM 554 O ASP A 35 9.622 5.220 3.937 1.00 33.32 O ATOM 555 CB ASP A 35 7.251 6.229 5.302 1.00 32.02 C ATOM 556 CG ASP A 35 5.782 6.604 5.575 1.00 71.41 C ATOM 557 OD1 ASP A 35 5.178 6.061 6.536 1.00 4.32 O ATOM 558 OD2 ASP A 35 5.234 7.466 4.859 1.00 41.52 O ATOM 0 H ASP A 35 6.166 3.312 5.803 1.00 34.32 H new ATOM 0 HA ASP A 35 6.864 4.516 4.065 1.00 52.42 H new ATOM 0 HB2 ASP A 35 7.848 6.473 6.181 1.00 32.02 H new ATOM 0 HB3 ASP A 35 7.626 6.841 4.482 1.00 32.02 H new ATOM 563 N ASP A 36 9.356 3.194 4.937 1.00 14.03 N ATOM 564 CA ASP A 36 10.751 2.738 4.840 1.00 63.34 C ATOM 565 C ASP A 36 10.923 1.856 3.585 1.00 1.01 C ATOM 566 O ASP A 36 9.972 1.636 2.838 1.00 55.43 O ATOM 567 CB ASP A 36 11.105 1.958 6.143 1.00 31.15 C ATOM 568 CG ASP A 36 12.613 1.788 6.370 1.00 44.33 C ATOM 569 OD1 ASP A 36 13.254 2.727 6.885 1.00 44.23 O ATOM 570 OD2 ASP A 36 13.170 0.726 6.020 1.00 60.40 O ATOM 0 H ASP A 36 8.727 2.483 5.310 1.00 14.03 H new ATOM 0 HA ASP A 36 11.430 3.585 4.742 1.00 63.34 H new ATOM 0 HB2 ASP A 36 10.675 2.481 6.997 1.00 31.15 H new ATOM 0 HB3 ASP A 36 10.639 0.973 6.104 1.00 31.15 H new ATOM 575 N LYS A 37 12.142 1.355 3.368 1.00 11.33 N ATOM 576 CA LYS A 37 12.507 0.530 2.210 1.00 71.34 C ATOM 577 C LYS A 37 12.710 -0.930 2.640 1.00 23.24 C ATOM 578 O LYS A 37 12.015 -1.827 2.148 1.00 34.24 O ATOM 579 CB LYS A 37 13.765 1.107 1.467 1.00 10.12 C ATOM 580 CG LYS A 37 15.016 1.474 2.326 1.00 34.25 C ATOM 581 CD LYS A 37 14.848 2.741 3.225 1.00 64.11 C ATOM 582 CE LYS A 37 14.539 4.037 2.454 1.00 70.31 C ATOM 583 NZ LYS A 37 15.507 4.303 1.369 1.00 71.43 N ATOM 0 H LYS A 37 12.921 1.515 4.006 1.00 11.33 H new ATOM 0 HA LYS A 37 11.685 0.556 1.494 1.00 71.34 H new ATOM 0 HB2 LYS A 37 14.075 0.378 0.719 1.00 10.12 H new ATOM 0 HB3 LYS A 37 13.454 2.003 0.929 1.00 10.12 H new ATOM 0 HG2 LYS A 37 15.263 0.625 2.963 1.00 34.25 H new ATOM 0 HG3 LYS A 37 15.864 1.630 1.659 1.00 34.25 H new ATOM 0 HD2 LYS A 37 14.046 2.559 3.940 1.00 64.11 H new ATOM 0 HD3 LYS A 37 15.762 2.886 3.801 1.00 64.11 H new ATOM 0 HE2 LYS A 37 13.536 3.973 2.032 1.00 70.31 H new ATOM 0 HE3 LYS A 37 14.539 4.877 3.149 1.00 70.31 H new ATOM 0 HZ1 LYS A 37 15.271 5.204 0.906 1.00 71.43 H new ATOM 0 HZ2 LYS A 37 16.467 4.359 1.766 1.00 71.43 H new ATOM 0 HZ3 LYS A 37 15.466 3.534 0.670 1.00 71.43 H new ATOM 597 N GLU A 38 13.636 -1.157 3.588 1.00 14.32 N ATOM 598 CA GLU A 38 13.988 -2.512 4.039 1.00 12.22 C ATOM 599 C GLU A 38 12.902 -3.092 4.959 1.00 24.43 C ATOM 600 O GLU A 38 12.580 -4.277 4.849 1.00 15.43 O ATOM 601 CB GLU A 38 15.370 -2.524 4.752 1.00 0.45 C ATOM 602 CG GLU A 38 15.464 -1.628 6.003 1.00 52.33 C ATOM 603 CD GLU A 38 16.761 -1.812 6.804 1.00 61.10 C ATOM 604 OE1 GLU A 38 17.820 -1.333 6.351 1.00 64.41 O ATOM 605 OE2 GLU A 38 16.730 -2.433 7.887 1.00 60.24 O ATOM 0 H GLU A 38 14.155 -0.415 4.057 1.00 14.32 H new ATOM 0 HA GLU A 38 14.056 -3.144 3.154 1.00 12.22 H new ATOM 0 HB2 GLU A 38 15.605 -3.549 5.039 1.00 0.45 H new ATOM 0 HB3 GLU A 38 16.133 -2.209 4.040 1.00 0.45 H new ATOM 0 HG2 GLU A 38 15.382 -0.585 5.698 1.00 52.33 H new ATOM 0 HG3 GLU A 38 14.614 -1.838 6.653 1.00 52.33 H new ATOM 612 N LYS A 39 12.327 -2.238 5.843 1.00 63.21 N ATOM 613 CA LYS A 39 11.361 -2.687 6.860 1.00 0.15 C ATOM 614 C LYS A 39 10.103 -3.270 6.211 1.00 14.20 C ATOM 615 O LYS A 39 9.657 -4.337 6.616 1.00 13.10 O ATOM 616 CB LYS A 39 10.986 -1.567 7.874 1.00 33.45 C ATOM 617 CG LYS A 39 9.926 -2.029 8.905 1.00 1.24 C ATOM 618 CD LYS A 39 9.718 -1.061 10.085 1.00 71.42 C ATOM 619 CE LYS A 39 8.650 -1.588 11.058 1.00 13.11 C ATOM 620 NZ LYS A 39 8.991 -2.948 11.572 1.00 25.13 N ATOM 0 H LYS A 39 12.520 -1.237 5.866 1.00 63.21 H new ATOM 0 HA LYS A 39 11.859 -3.474 7.426 1.00 0.15 H new ATOM 0 HB2 LYS A 39 11.884 -1.243 8.401 1.00 33.45 H new ATOM 0 HB3 LYS A 39 10.606 -0.702 7.330 1.00 33.45 H new ATOM 0 HG2 LYS A 39 8.974 -2.166 8.392 1.00 1.24 H new ATOM 0 HG3 LYS A 39 10.220 -3.003 9.298 1.00 1.24 H new ATOM 0 HD2 LYS A 39 10.660 -0.923 10.616 1.00 71.42 H new ATOM 0 HD3 LYS A 39 9.419 -0.083 9.708 1.00 71.42 H new ATOM 0 HE2 LYS A 39 8.549 -0.898 11.895 1.00 13.11 H new ATOM 0 HE3 LYS A 39 7.684 -1.621 10.554 1.00 13.11 H new ATOM 0 HZ1 LYS A 39 8.248 -3.269 12.225 1.00 25.13 H new ATOM 0 HZ2 LYS A 39 9.063 -3.612 10.775 1.00 25.13 H new ATOM 0 HZ3 LYS A 39 9.901 -2.911 12.075 1.00 25.13 H new ATOM 634 N VAL A 40 9.573 -2.583 5.176 1.00 21.44 N ATOM 635 CA VAL A 40 8.382 -3.042 4.432 1.00 31.50 C ATOM 636 C VAL A 40 8.595 -4.480 3.911 1.00 22.11 C ATOM 637 O VAL A 40 7.723 -5.332 4.062 1.00 22.31 O ATOM 638 CB VAL A 40 8.044 -2.086 3.228 1.00 31.51 C ATOM 639 CG1 VAL A 40 6.816 -2.587 2.425 1.00 4.24 C ATOM 640 CG2 VAL A 40 7.824 -0.638 3.719 1.00 14.12 C ATOM 0 H VAL A 40 9.956 -1.701 4.835 1.00 21.44 H new ATOM 0 HA VAL A 40 7.540 -3.027 5.123 1.00 31.50 H new ATOM 0 HB VAL A 40 8.901 -2.094 2.555 1.00 31.51 H new ATOM 0 HG11 VAL A 40 6.614 -1.901 1.603 1.00 4.24 H new ATOM 0 HG12 VAL A 40 7.023 -3.580 2.026 1.00 4.24 H new ATOM 0 HG13 VAL A 40 5.947 -2.633 3.081 1.00 4.24 H new ATOM 0 HG21 VAL A 40 7.592 0.003 2.869 1.00 14.12 H new ATOM 0 HG22 VAL A 40 6.996 -0.616 4.427 1.00 14.12 H new ATOM 0 HG23 VAL A 40 8.729 -0.278 4.208 1.00 14.12 H new ATOM 650 N LYS A 41 9.806 -4.731 3.375 1.00 13.21 N ATOM 651 CA LYS A 41 10.225 -6.049 2.853 1.00 11.23 C ATOM 652 C LYS A 41 10.223 -7.122 3.969 1.00 25.31 C ATOM 653 O LYS A 41 9.822 -8.270 3.745 1.00 34.20 O ATOM 654 CB LYS A 41 11.644 -5.940 2.229 1.00 25.54 C ATOM 655 CG LYS A 41 11.772 -4.889 1.104 1.00 55.52 C ATOM 656 CD LYS A 41 13.234 -4.733 0.614 1.00 51.33 C ATOM 657 CE LYS A 41 13.406 -3.628 -0.446 1.00 73.41 C ATOM 658 NZ LYS A 41 14.829 -3.465 -0.866 1.00 64.15 N ATOM 0 H LYS A 41 10.529 -4.017 3.291 1.00 13.21 H new ATOM 0 HA LYS A 41 9.511 -6.354 2.089 1.00 11.23 H new ATOM 0 HB2 LYS A 41 12.356 -5.697 3.018 1.00 25.54 H new ATOM 0 HB3 LYS A 41 11.928 -6.915 1.832 1.00 25.54 H new ATOM 0 HG2 LYS A 41 11.138 -5.177 0.265 1.00 55.52 H new ATOM 0 HG3 LYS A 41 11.406 -3.927 1.464 1.00 55.52 H new ATOM 0 HD2 LYS A 41 13.874 -4.511 1.468 1.00 51.33 H new ATOM 0 HD3 LYS A 41 13.574 -5.682 0.199 1.00 51.33 H new ATOM 0 HE2 LYS A 41 12.797 -3.866 -1.318 1.00 73.41 H new ATOM 0 HE3 LYS A 41 13.036 -2.683 -0.047 1.00 73.41 H new ATOM 0 HZ1 LYS A 41 15.007 -2.470 -1.109 1.00 64.15 H new ATOM 0 HZ2 LYS A 41 15.456 -3.749 -0.086 1.00 64.15 H new ATOM 0 HZ3 LYS A 41 15.017 -4.063 -1.696 1.00 64.15 H new ATOM 672 N GLU A 42 10.687 -6.719 5.167 1.00 44.32 N ATOM 673 CA GLU A 42 10.738 -7.593 6.356 1.00 2.31 C ATOM 674 C GLU A 42 9.316 -7.944 6.836 1.00 31.11 C ATOM 675 O GLU A 42 9.060 -9.074 7.266 1.00 2.10 O ATOM 676 CB GLU A 42 11.525 -6.899 7.499 1.00 42.33 C ATOM 677 CG GLU A 42 12.970 -6.497 7.148 1.00 42.24 C ATOM 678 CD GLU A 42 13.876 -7.673 6.757 1.00 34.01 C ATOM 679 OE1 GLU A 42 14.127 -8.552 7.613 1.00 64.44 O ATOM 680 OE2 GLU A 42 14.348 -7.727 5.601 1.00 14.34 O ATOM 0 H GLU A 42 11.038 -5.777 5.339 1.00 44.32 H new ATOM 0 HA GLU A 42 11.249 -8.515 6.080 1.00 2.31 H new ATOM 0 HB2 GLU A 42 10.980 -6.006 7.804 1.00 42.33 H new ATOM 0 HB3 GLU A 42 11.549 -7.567 8.360 1.00 42.33 H new ATOM 0 HG2 GLU A 42 12.946 -5.783 6.325 1.00 42.24 H new ATOM 0 HG3 GLU A 42 13.410 -5.984 8.003 1.00 42.24 H new ATOM 687 N GLU A 43 8.401 -6.954 6.746 1.00 11.51 N ATOM 688 CA GLU A 43 6.990 -7.122 7.140 1.00 63.34 C ATOM 689 C GLU A 43 6.239 -8.000 6.107 1.00 4.25 C ATOM 690 O GLU A 43 5.303 -8.717 6.466 1.00 63.10 O ATOM 691 CB GLU A 43 6.264 -5.747 7.307 1.00 54.14 C ATOM 692 CG GLU A 43 6.987 -4.680 8.166 1.00 22.31 C ATOM 693 CD GLU A 43 7.504 -5.177 9.530 1.00 42.32 C ATOM 694 OE1 GLU A 43 6.698 -5.323 10.475 1.00 3.03 O ATOM 695 OE2 GLU A 43 8.733 -5.395 9.680 1.00 15.53 O ATOM 0 H GLU A 43 8.621 -6.020 6.399 1.00 11.51 H new ATOM 0 HA GLU A 43 6.981 -7.622 8.109 1.00 63.34 H new ATOM 0 HB2 GLU A 43 6.095 -5.328 6.315 1.00 54.14 H new ATOM 0 HB3 GLU A 43 5.284 -5.931 7.746 1.00 54.14 H new ATOM 0 HG2 GLU A 43 7.830 -4.288 7.597 1.00 22.31 H new ATOM 0 HG3 GLU A 43 6.303 -3.849 8.336 1.00 22.31 H new ATOM 702 N ILE A 44 6.666 -7.916 4.824 1.00 44.14 N ATOM 703 CA ILE A 44 6.117 -8.736 3.716 1.00 10.11 C ATOM 704 C ILE A 44 6.420 -10.240 3.950 1.00 71.33 C ATOM 705 O ILE A 44 5.571 -11.103 3.674 1.00 41.11 O ATOM 706 CB ILE A 44 6.678 -8.253 2.305 1.00 45.31 C ATOM 707 CG1 ILE A 44 6.087 -6.861 1.893 1.00 35.03 C ATOM 708 CG2 ILE A 44 6.420 -9.284 1.182 1.00 22.15 C ATOM 709 CD1 ILE A 44 6.666 -6.291 0.598 1.00 54.04 C ATOM 0 H ILE A 44 7.403 -7.276 4.527 1.00 44.14 H new ATOM 0 HA ILE A 44 5.035 -8.602 3.702 1.00 10.11 H new ATOM 0 HB ILE A 44 7.756 -8.155 2.430 1.00 45.31 H new ATOM 0 HG12 ILE A 44 5.007 -6.956 1.784 1.00 35.03 H new ATOM 0 HG13 ILE A 44 6.264 -6.151 2.700 1.00 35.03 H new ATOM 0 HG21 ILE A 44 6.822 -8.906 0.242 1.00 22.15 H new ATOM 0 HG22 ILE A 44 6.909 -10.225 1.433 1.00 22.15 H new ATOM 0 HG23 ILE A 44 5.347 -9.448 1.078 1.00 22.15 H new ATOM 0 HD11 ILE A 44 6.203 -5.327 0.386 1.00 54.04 H new ATOM 0 HD12 ILE A 44 7.743 -6.161 0.707 1.00 54.04 H new ATOM 0 HD13 ILE A 44 6.465 -6.978 -0.224 1.00 54.04 H new ATOM 721 N GLU A 45 7.628 -10.535 4.483 1.00 74.30 N ATOM 722 CA GLU A 45 8.028 -11.907 4.878 1.00 64.51 C ATOM 723 C GLU A 45 7.072 -12.420 5.987 1.00 74.15 C ATOM 724 O GLU A 45 6.603 -13.549 5.925 1.00 4.25 O ATOM 725 CB GLU A 45 9.524 -11.910 5.342 1.00 12.40 C ATOM 726 CG GLU A 45 10.289 -13.264 5.248 1.00 75.41 C ATOM 727 CD GLU A 45 9.815 -14.374 6.218 1.00 1.31 C ATOM 728 OE1 GLU A 45 10.216 -14.353 7.411 1.00 51.14 O ATOM 729 OE2 GLU A 45 9.058 -15.284 5.792 1.00 62.34 O ATOM 0 H GLU A 45 8.350 -9.834 4.651 1.00 74.30 H new ATOM 0 HA GLU A 45 7.949 -12.584 4.027 1.00 64.51 H new ATOM 0 HB2 GLU A 45 10.065 -11.173 4.748 1.00 12.40 H new ATOM 0 HB3 GLU A 45 9.559 -11.572 6.378 1.00 12.40 H new ATOM 0 HG2 GLU A 45 10.203 -13.638 4.228 1.00 75.41 H new ATOM 0 HG3 GLU A 45 11.347 -13.076 5.431 1.00 75.41 H new ATOM 736 N LYS A 46 6.757 -11.542 6.962 1.00 72.04 N ATOM 737 CA LYS A 46 5.805 -11.843 8.064 1.00 70.32 C ATOM 738 C LYS A 46 4.370 -12.074 7.530 1.00 11.22 C ATOM 739 O LYS A 46 3.638 -12.934 8.029 1.00 63.41 O ATOM 740 CB LYS A 46 5.789 -10.674 9.088 1.00 4.34 C ATOM 741 CG LYS A 46 7.170 -10.309 9.670 1.00 21.34 C ATOM 742 CD LYS A 46 7.106 -9.066 10.584 1.00 32.14 C ATOM 743 CE LYS A 46 8.490 -8.618 11.067 1.00 52.35 C ATOM 744 NZ LYS A 46 8.400 -7.416 11.936 1.00 14.42 N ATOM 0 H LYS A 46 7.153 -10.603 7.012 1.00 72.04 H new ATOM 0 HA LYS A 46 6.142 -12.759 8.550 1.00 70.32 H new ATOM 0 HB2 LYS A 46 5.368 -9.792 8.605 1.00 4.34 H new ATOM 0 HB3 LYS A 46 5.122 -10.937 9.909 1.00 4.34 H new ATOM 0 HG2 LYS A 46 7.559 -11.155 10.236 1.00 21.34 H new ATOM 0 HG3 LYS A 46 7.869 -10.123 8.854 1.00 21.34 H new ATOM 0 HD2 LYS A 46 6.631 -8.247 10.044 1.00 32.14 H new ATOM 0 HD3 LYS A 46 6.478 -9.286 11.447 1.00 32.14 H new ATOM 0 HE2 LYS A 46 8.966 -9.431 11.616 1.00 52.35 H new ATOM 0 HE3 LYS A 46 9.124 -8.400 10.207 1.00 52.35 H new ATOM 0 HZ1 LYS A 46 9.316 -6.923 11.942 1.00 14.42 H new ATOM 0 HZ2 LYS A 46 7.665 -6.777 11.570 1.00 14.42 H new ATOM 0 HZ3 LYS A 46 8.156 -7.705 12.905 1.00 14.42 H new ATOM 758 N ALA A 47 3.995 -11.295 6.500 1.00 22.14 N ATOM 759 CA ALA A 47 2.639 -11.302 5.908 1.00 22.44 C ATOM 760 C ALA A 47 2.348 -12.611 5.175 1.00 21.31 C ATOM 761 O ALA A 47 1.286 -13.224 5.358 1.00 2.33 O ATOM 762 CB ALA A 47 2.493 -10.120 4.948 1.00 42.12 C ATOM 0 H ALA A 47 4.629 -10.635 6.048 1.00 22.14 H new ATOM 0 HA ALA A 47 1.916 -11.211 6.719 1.00 22.44 H new ATOM 0 HB1 ALA A 47 1.494 -10.126 4.513 1.00 42.12 H new ATOM 0 HB2 ALA A 47 2.646 -9.188 5.492 1.00 42.12 H new ATOM 0 HB3 ALA A 47 3.235 -10.202 4.154 1.00 42.12 H new ATOM 768 N ARG A 48 3.315 -13.025 4.340 1.00 2.54 N ATOM 769 CA ARG A 48 3.228 -14.269 3.559 1.00 43.31 C ATOM 770 C ARG A 48 3.301 -15.496 4.503 1.00 61.51 C ATOM 771 O ARG A 48 2.739 -16.550 4.215 1.00 42.05 O ATOM 772 CB ARG A 48 4.377 -14.323 2.496 1.00 70.02 C ATOM 773 CG ARG A 48 5.777 -14.669 3.072 1.00 35.43 C ATOM 774 CD ARG A 48 6.907 -14.761 2.026 1.00 21.32 C ATOM 775 NE ARG A 48 8.036 -15.560 2.549 1.00 42.25 N ATOM 776 CZ ARG A 48 9.324 -15.454 2.203 1.00 63.34 C ATOM 777 NH1 ARG A 48 9.737 -14.558 1.308 1.00 53.03 N ATOM 778 NH2 ARG A 48 10.202 -16.279 2.751 1.00 63.12 N ATOM 0 H ARG A 48 4.180 -12.506 4.188 1.00 2.54 H new ATOM 0 HA ARG A 48 2.273 -14.291 3.034 1.00 43.31 H new ATOM 0 HB2 ARG A 48 4.118 -15.062 1.738 1.00 70.02 H new ATOM 0 HB3 ARG A 48 4.434 -13.358 1.993 1.00 70.02 H new ATOM 0 HG2 ARG A 48 6.046 -13.914 3.810 1.00 35.43 H new ATOM 0 HG3 ARG A 48 5.712 -15.621 3.599 1.00 35.43 H new ATOM 0 HD2 ARG A 48 6.527 -15.214 1.111 1.00 21.32 H new ATOM 0 HD3 ARG A 48 7.252 -13.760 1.766 1.00 21.32 H new ATOM 0 HE ARG A 48 7.809 -16.267 3.248 1.00 42.25 H new ATOM 0 HH11 ARG A 48 9.065 -13.930 0.867 1.00 53.03 H new ATOM 0 HH12 ARG A 48 10.726 -14.500 1.063 1.00 53.03 H new ATOM 0 HH21 ARG A 48 9.892 -16.980 3.424 1.00 63.12 H new ATOM 0 HH22 ARG A 48 11.189 -16.214 2.500 1.00 63.12 H new ATOM 792 N LYS A 49 3.999 -15.300 5.645 1.00 60.02 N ATOM 793 CA LYS A 49 4.280 -16.343 6.657 1.00 63.00 C ATOM 794 C LYS A 49 2.983 -16.724 7.384 1.00 41.45 C ATOM 795 O LYS A 49 2.649 -17.907 7.521 1.00 50.44 O ATOM 796 CB LYS A 49 5.353 -15.791 7.650 1.00 70.43 C ATOM 797 CG LYS A 49 6.273 -16.833 8.319 1.00 72.35 C ATOM 798 CD LYS A 49 7.499 -16.146 8.984 1.00 55.42 C ATOM 799 CE LYS A 49 8.604 -17.126 9.392 1.00 22.53 C ATOM 800 NZ LYS A 49 9.849 -16.414 9.807 1.00 64.12 N ATOM 0 H LYS A 49 4.391 -14.392 5.894 1.00 60.02 H new ATOM 0 HA LYS A 49 4.668 -17.245 6.183 1.00 63.00 H new ATOM 0 HB2 LYS A 49 5.979 -15.078 7.114 1.00 70.43 H new ATOM 0 HB3 LYS A 49 4.838 -15.237 8.435 1.00 70.43 H new ATOM 0 HG2 LYS A 49 5.712 -17.390 9.069 1.00 72.35 H new ATOM 0 HG3 LYS A 49 6.614 -17.553 7.575 1.00 72.35 H new ATOM 0 HD2 LYS A 49 7.913 -15.412 8.293 1.00 55.42 H new ATOM 0 HD3 LYS A 49 7.165 -15.600 9.866 1.00 55.42 H new ATOM 0 HE2 LYS A 49 8.251 -17.751 10.213 1.00 22.53 H new ATOM 0 HE3 LYS A 49 8.826 -17.791 8.558 1.00 22.53 H new ATOM 0 HZ1 LYS A 49 10.631 -17.096 9.880 1.00 64.12 H new ATOM 0 HZ2 LYS A 49 10.086 -15.689 9.100 1.00 64.12 H new ATOM 0 HZ3 LYS A 49 9.698 -15.961 10.731 1.00 64.12 H new ATOM 814 N GLN A 50 2.263 -15.680 7.834 1.00 24.15 N ATOM 815 CA GLN A 50 0.936 -15.807 8.461 1.00 44.43 C ATOM 816 C GLN A 50 -0.117 -16.210 7.416 1.00 12.53 C ATOM 817 O GLN A 50 -1.082 -16.916 7.730 1.00 74.20 O ATOM 818 CB GLN A 50 0.529 -14.459 9.128 1.00 22.44 C ATOM 819 CG GLN A 50 1.447 -13.998 10.274 1.00 33.42 C ATOM 820 CD GLN A 50 1.437 -14.948 11.474 1.00 64.20 C ATOM 821 OE1 GLN A 50 0.527 -14.720 12.405 1.00 21.24 O flip ATOM 822 NE2 GLN A 50 2.230 -15.886 11.555 1.00 22.32 N flip ATOM 0 H GLN A 50 2.590 -14.716 7.772 1.00 24.15 H new ATOM 0 HA GLN A 50 0.987 -16.584 9.224 1.00 44.43 H new ATOM 0 HB2 GLN A 50 0.511 -13.683 8.363 1.00 22.44 H new ATOM 0 HB3 GLN A 50 -0.487 -14.553 9.512 1.00 22.44 H new ATOM 0 HG2 GLN A 50 2.467 -13.907 9.900 1.00 33.42 H new ATOM 0 HG3 GLN A 50 1.138 -13.006 10.602 1.00 33.42 H new ATOM 0 HE21 GLN A 50 2.921 -16.035 10.819 1.00 22.32 H new ATOM 0 HE22 GLN A 50 2.196 -16.514 12.358 1.00 22.32 H new ATOM 831 N GLY A 51 0.103 -15.762 6.169 1.00 11.34 N ATOM 832 CA GLY A 51 -0.848 -15.969 5.084 1.00 54.50 C ATOM 833 C GLY A 51 -1.987 -14.954 5.114 1.00 21.40 C ATOM 834 O GLY A 51 -3.108 -15.242 4.682 1.00 14.43 O ATOM 0 H GLY A 51 0.942 -15.250 5.894 1.00 11.34 H new ATOM 0 HA2 GLY A 51 -0.327 -15.900 4.129 1.00 54.50 H new ATOM 0 HA3 GLY A 51 -1.259 -16.976 5.151 1.00 54.50 H new ATOM 838 N ARG A 52 -1.679 -13.749 5.614 1.00 2.21 N ATOM 839 CA ARG A 52 -2.651 -12.653 5.791 1.00 71.11 C ATOM 840 C ARG A 52 -2.274 -11.479 4.870 1.00 33.20 C ATOM 841 O ARG A 52 -1.082 -11.291 4.584 1.00 10.24 O ATOM 842 CB ARG A 52 -2.651 -12.192 7.279 1.00 12.12 C ATOM 843 CG ARG A 52 -3.043 -13.293 8.288 1.00 41.32 C ATOM 844 CD ARG A 52 -2.907 -12.842 9.748 1.00 71.41 C ATOM 845 NE ARG A 52 -3.161 -13.946 10.695 1.00 3.30 N ATOM 846 CZ ARG A 52 -2.715 -13.993 11.955 1.00 71.15 C ATOM 847 NH1 ARG A 52 -1.984 -13.001 12.465 1.00 14.21 N ATOM 848 NH2 ARG A 52 -2.976 -15.052 12.709 1.00 10.12 N ATOM 0 H ARG A 52 -0.735 -13.502 5.912 1.00 2.21 H new ATOM 0 HA ARG A 52 -3.650 -13.002 5.529 1.00 71.11 H new ATOM 0 HB2 ARG A 52 -1.658 -11.822 7.532 1.00 12.12 H new ATOM 0 HB3 ARG A 52 -3.341 -11.355 7.387 1.00 12.12 H new ATOM 0 HG2 ARG A 52 -4.073 -13.599 8.102 1.00 41.32 H new ATOM 0 HG3 ARG A 52 -2.416 -14.169 8.124 1.00 41.32 H new ATOM 0 HD2 ARG A 52 -1.905 -12.446 9.913 1.00 71.41 H new ATOM 0 HD3 ARG A 52 -3.607 -12.029 9.943 1.00 71.41 H new ATOM 0 HE ARG A 52 -3.719 -14.733 10.363 1.00 3.30 H new ATOM 0 HH11 ARG A 52 -1.756 -12.189 11.892 1.00 14.21 H new ATOM 0 HH12 ARG A 52 -1.653 -13.055 13.428 1.00 14.21 H new ATOM 0 HH21 ARG A 52 -3.516 -15.829 12.328 1.00 10.12 H new ATOM 0 HH22 ARG A 52 -2.637 -15.090 13.670 1.00 10.12 H new ATOM 862 N PRO A 53 -3.272 -10.671 4.373 1.00 43.31 N ATOM 863 CA PRO A 53 -2.974 -9.437 3.616 1.00 30.51 C ATOM 864 C PRO A 53 -2.281 -8.382 4.510 1.00 54.31 C ATOM 865 O PRO A 53 -2.496 -8.339 5.733 1.00 13.14 O ATOM 866 CB PRO A 53 -4.363 -8.960 3.113 1.00 53.42 C ATOM 867 CG PRO A 53 -5.360 -9.592 4.039 1.00 5.12 C ATOM 868 CD PRO A 53 -4.745 -10.906 4.486 1.00 34.33 C ATOM 0 HA PRO A 53 -2.278 -9.603 2.794 1.00 30.51 H new ATOM 0 HB2 PRO A 53 -4.438 -7.873 3.138 1.00 53.42 H new ATOM 0 HB3 PRO A 53 -4.534 -9.268 2.082 1.00 53.42 H new ATOM 0 HG2 PRO A 53 -5.563 -8.946 4.893 1.00 5.12 H new ATOM 0 HG3 PRO A 53 -6.311 -9.759 3.533 1.00 5.12 H new ATOM 0 HD2 PRO A 53 -5.033 -11.155 5.508 1.00 34.33 H new ATOM 0 HD3 PRO A 53 -5.067 -11.733 3.854 1.00 34.33 H new ATOM 876 N ILE A 54 -1.442 -7.550 3.890 1.00 41.11 N ATOM 877 CA ILE A 54 -0.650 -6.532 4.586 1.00 63.04 C ATOM 878 C ILE A 54 -0.887 -5.172 3.921 1.00 23.13 C ATOM 879 O ILE A 54 -0.893 -5.066 2.690 1.00 61.03 O ATOM 880 CB ILE A 54 0.875 -6.914 4.580 1.00 10.42 C ATOM 881 CG1 ILE A 54 1.720 -5.878 5.381 1.00 55.34 C ATOM 882 CG2 ILE A 54 1.429 -7.097 3.136 1.00 11.31 C ATOM 883 CD1 ILE A 54 3.186 -6.229 5.509 1.00 63.44 C ATOM 0 H ILE A 54 -1.291 -7.563 2.881 1.00 41.11 H new ATOM 0 HA ILE A 54 -0.964 -6.475 5.628 1.00 63.04 H new ATOM 0 HB ILE A 54 0.963 -7.879 5.080 1.00 10.42 H new ATOM 0 HG12 ILE A 54 1.633 -4.905 4.897 1.00 55.34 H new ATOM 0 HG13 ILE A 54 1.295 -5.776 6.380 1.00 55.34 H new ATOM 0 HG21 ILE A 54 2.486 -7.360 3.182 1.00 11.31 H new ATOM 0 HG22 ILE A 54 0.879 -7.892 2.633 1.00 11.31 H new ATOM 0 HG23 ILE A 54 1.311 -6.167 2.580 1.00 11.31 H new ATOM 0 HD11 ILE A 54 3.697 -5.454 6.080 1.00 63.44 H new ATOM 0 HD12 ILE A 54 3.288 -7.185 6.022 1.00 63.44 H new ATOM 0 HD13 ILE A 54 3.631 -6.301 4.517 1.00 63.44 H new ATOM 895 N VAL A 55 -1.121 -4.139 4.745 1.00 53.01 N ATOM 896 CA VAL A 55 -1.454 -2.793 4.266 1.00 34.11 C ATOM 897 C VAL A 55 -0.344 -1.824 4.690 1.00 13.23 C ATOM 898 O VAL A 55 -0.213 -1.501 5.865 1.00 34.11 O ATOM 899 CB VAL A 55 -2.851 -2.314 4.819 1.00 13.14 C ATOM 900 CG1 VAL A 55 -3.340 -1.058 4.078 1.00 41.41 C ATOM 901 CG2 VAL A 55 -3.898 -3.436 4.720 1.00 22.22 C ATOM 0 H VAL A 55 -1.084 -4.216 5.761 1.00 53.01 H new ATOM 0 HA VAL A 55 -1.528 -2.814 3.179 1.00 34.11 H new ATOM 0 HB VAL A 55 -2.719 -2.060 5.871 1.00 13.14 H new ATOM 0 HG11 VAL A 55 -4.305 -0.751 4.480 1.00 41.41 H new ATOM 0 HG12 VAL A 55 -2.618 -0.252 4.212 1.00 41.41 H new ATOM 0 HG13 VAL A 55 -3.444 -1.279 3.016 1.00 41.41 H new ATOM 0 HG21 VAL A 55 -4.852 -3.079 5.108 1.00 22.22 H new ATOM 0 HG22 VAL A 55 -4.018 -3.731 3.678 1.00 22.22 H new ATOM 0 HG23 VAL A 55 -3.567 -4.295 5.304 1.00 22.22 H new ATOM 911 N ILE A 56 0.459 -1.378 3.721 1.00 0.03 N ATOM 912 CA ILE A 56 1.630 -0.528 3.978 1.00 10.44 C ATOM 913 C ILE A 56 1.288 0.937 3.644 1.00 41.11 C ATOM 914 O ILE A 56 1.021 1.266 2.492 1.00 5.51 O ATOM 915 CB ILE A 56 2.864 -1.033 3.139 1.00 34.11 C ATOM 916 CG1 ILE A 56 3.245 -2.499 3.538 1.00 32.54 C ATOM 917 CG2 ILE A 56 4.081 -0.098 3.305 1.00 31.30 C ATOM 918 CD1 ILE A 56 3.788 -2.655 4.961 1.00 1.22 C ATOM 0 H ILE A 56 0.318 -1.595 2.734 1.00 0.03 H new ATOM 0 HA ILE A 56 1.899 -0.587 5.033 1.00 10.44 H new ATOM 0 HB ILE A 56 2.573 -1.022 2.089 1.00 34.11 H new ATOM 0 HG12 ILE A 56 2.364 -3.131 3.429 1.00 32.54 H new ATOM 0 HG13 ILE A 56 3.992 -2.869 2.836 1.00 32.54 H new ATOM 0 HG21 ILE A 56 4.914 -0.476 2.713 1.00 31.30 H new ATOM 0 HG22 ILE A 56 3.819 0.904 2.965 1.00 31.30 H new ATOM 0 HG23 ILE A 56 4.370 -0.060 4.355 1.00 31.30 H new ATOM 0 HD11 ILE A 56 4.024 -3.703 5.147 1.00 1.22 H new ATOM 0 HD12 ILE A 56 4.690 -2.054 5.074 1.00 1.22 H new ATOM 0 HD13 ILE A 56 3.037 -2.320 5.676 1.00 1.22 H new ATOM 930 N PHE A 57 1.300 1.804 4.667 1.00 21.35 N ATOM 931 CA PHE A 57 0.948 3.226 4.518 1.00 64.24 C ATOM 932 C PHE A 57 2.218 4.057 4.282 1.00 52.35 C ATOM 933 O PHE A 57 3.027 4.256 5.200 1.00 51.42 O ATOM 934 CB PHE A 57 0.208 3.730 5.780 1.00 33.30 C ATOM 935 CG PHE A 57 -1.190 3.146 5.972 1.00 61.42 C ATOM 936 CD1 PHE A 57 -1.370 1.846 6.440 1.00 73.13 C ATOM 937 CD2 PHE A 57 -2.326 3.904 5.673 1.00 75.51 C ATOM 938 CE1 PHE A 57 -2.639 1.324 6.599 1.00 70.15 C ATOM 939 CE2 PHE A 57 -3.588 3.375 5.828 1.00 23.00 C ATOM 940 CZ PHE A 57 -3.742 2.088 6.288 1.00 34.33 C ATOM 0 H PHE A 57 1.553 1.541 5.619 1.00 21.35 H new ATOM 0 HA PHE A 57 0.286 3.337 3.659 1.00 64.24 H new ATOM 0 HB2 PHE A 57 0.810 3.493 6.657 1.00 33.30 H new ATOM 0 HB3 PHE A 57 0.130 4.816 5.730 1.00 33.30 H new ATOM 0 HD1 PHE A 57 -0.509 1.240 6.681 1.00 73.13 H new ATOM 0 HD2 PHE A 57 -2.212 4.917 5.316 1.00 75.51 H new ATOM 0 HE1 PHE A 57 -2.766 0.317 6.967 1.00 70.15 H new ATOM 0 HE2 PHE A 57 -4.457 3.971 5.588 1.00 23.00 H new ATOM 0 HZ PHE A 57 -4.733 1.674 6.406 1.00 34.33 H new ATOM 950 N ILE A 58 2.372 4.504 3.030 1.00 30.41 N ATOM 951 CA ILE A 58 3.482 5.359 2.574 1.00 2.42 C ATOM 952 C ILE A 58 2.921 6.756 2.214 1.00 1.25 C ATOM 953 O ILE A 58 1.793 6.866 1.745 1.00 52.55 O ATOM 954 CB ILE A 58 4.184 4.739 1.301 1.00 43.33 C ATOM 955 CG1 ILE A 58 4.536 3.223 1.494 1.00 1.14 C ATOM 956 CG2 ILE A 58 5.446 5.545 0.927 1.00 20.12 C ATOM 957 CD1 ILE A 58 5.674 2.933 2.454 1.00 2.40 C ATOM 0 H ILE A 58 1.713 4.277 2.285 1.00 30.41 H new ATOM 0 HA ILE A 58 4.219 5.436 3.373 1.00 2.42 H new ATOM 0 HB ILE A 58 3.469 4.801 0.481 1.00 43.33 H new ATOM 0 HG12 ILE A 58 3.645 2.703 1.847 1.00 1.14 H new ATOM 0 HG13 ILE A 58 4.788 2.800 0.521 1.00 1.14 H new ATOM 0 HG21 ILE A 58 5.914 5.101 0.048 1.00 20.12 H new ATOM 0 HG22 ILE A 58 5.168 6.576 0.708 1.00 20.12 H new ATOM 0 HG23 ILE A 58 6.149 5.528 1.760 1.00 20.12 H new ATOM 0 HD11 ILE A 58 5.834 1.856 2.514 1.00 2.40 H new ATOM 0 HD12 ILE A 58 6.583 3.416 2.097 1.00 2.40 H new ATOM 0 HD13 ILE A 58 5.423 3.318 3.442 1.00 2.40 H new ATOM 969 N ARG A 59 3.711 7.812 2.428 1.00 71.35 N ATOM 970 CA ARG A 59 3.319 9.199 2.101 1.00 11.35 C ATOM 971 C ARG A 59 3.700 9.525 0.636 1.00 44.32 C ATOM 972 O ARG A 59 4.490 8.801 0.043 1.00 33.13 O ATOM 973 CB ARG A 59 4.015 10.147 3.112 1.00 3.31 C ATOM 974 CG ARG A 59 3.492 11.593 3.140 1.00 23.02 C ATOM 975 CD ARG A 59 4.304 12.477 4.108 1.00 10.54 C ATOM 976 NE ARG A 59 3.851 13.879 4.132 1.00 50.54 N ATOM 977 CZ ARG A 59 4.205 14.784 5.065 1.00 12.33 C ATOM 978 NH1 ARG A 59 5.009 14.451 6.080 1.00 24.01 N ATOM 979 NH2 ARG A 59 3.728 16.020 4.991 1.00 65.25 N ATOM 0 H ARG A 59 4.644 7.736 2.834 1.00 71.35 H new ATOM 0 HA ARG A 59 2.240 9.330 2.183 1.00 11.35 H new ATOM 0 HB2 ARG A 59 3.910 9.723 4.111 1.00 3.31 H new ATOM 0 HB3 ARG A 59 5.081 10.170 2.886 1.00 3.31 H new ATOM 0 HG2 ARG A 59 3.538 12.016 2.136 1.00 23.02 H new ATOM 0 HG3 ARG A 59 2.444 11.595 3.439 1.00 23.02 H new ATOM 0 HD2 ARG A 59 4.235 12.062 5.114 1.00 10.54 H new ATOM 0 HD3 ARG A 59 5.355 12.446 3.822 1.00 10.54 H new ATOM 0 HE ARG A 59 3.224 14.186 3.388 1.00 50.54 H new ATOM 0 HH11 ARG A 59 5.365 13.498 6.157 1.00 24.01 H new ATOM 0 HH12 ARG A 59 5.266 15.150 6.777 1.00 24.01 H new ATOM 0 HH21 ARG A 59 3.098 16.279 4.232 1.00 65.25 H new ATOM 0 HH22 ARG A 59 3.991 16.711 5.693 1.00 65.25 H new ATOM 993 N GLY A 60 3.130 10.615 0.077 1.00 34.51 N ATOM 994 CA GLY A 60 3.382 11.029 -1.320 1.00 13.31 C ATOM 995 C GLY A 60 4.855 11.301 -1.644 1.00 73.34 C ATOM 996 O GLY A 60 5.341 10.904 -2.706 1.00 14.34 O ATOM 0 H GLY A 60 2.487 11.228 0.578 1.00 34.51 H new ATOM 0 HA2 GLY A 60 3.013 10.251 -1.989 1.00 13.31 H new ATOM 0 HA3 GLY A 60 2.804 11.929 -1.529 1.00 13.31 H new ATOM 1000 N ALA A 61 5.562 11.970 -0.713 1.00 11.15 N ATOM 1001 CA ALA A 61 7.012 12.263 -0.843 1.00 64.21 C ATOM 1002 C ALA A 61 7.854 10.987 -0.666 1.00 51.23 C ATOM 1003 O ALA A 61 8.855 10.773 -1.361 1.00 14.22 O ATOM 1004 CB ALA A 61 7.420 13.314 0.195 1.00 61.42 C ATOM 0 H ALA A 61 5.150 12.324 0.150 1.00 11.15 H new ATOM 0 HA ALA A 61 7.198 12.651 -1.845 1.00 64.21 H new ATOM 0 HB1 ALA A 61 8.484 13.527 0.098 1.00 61.42 H new ATOM 0 HB2 ALA A 61 6.850 14.228 0.030 1.00 61.42 H new ATOM 0 HB3 ALA A 61 7.216 12.935 1.196 1.00 61.42 H new ATOM 1010 N TYR A 62 7.411 10.152 0.282 1.00 23.31 N ATOM 1011 CA TYR A 62 8.025 8.856 0.601 1.00 21.42 C ATOM 1012 C TYR A 62 7.780 7.812 -0.500 1.00 22.11 C ATOM 1013 O TYR A 62 8.493 6.815 -0.551 1.00 12.42 O ATOM 1014 CB TYR A 62 7.551 8.332 1.978 1.00 21.22 C ATOM 1015 CG TYR A 62 8.231 9.026 3.167 1.00 55.42 C ATOM 1016 CD1 TYR A 62 9.472 8.579 3.637 1.00 4.33 C ATOM 1017 CD2 TYR A 62 7.644 10.114 3.811 1.00 5.34 C ATOM 1018 CE1 TYR A 62 10.089 9.191 4.710 1.00 24.11 C ATOM 1019 CE2 TYR A 62 8.260 10.725 4.883 1.00 65.20 C ATOM 1020 CZ TYR A 62 9.481 10.264 5.327 1.00 24.23 C ATOM 1021 OH TYR A 62 10.090 10.874 6.400 1.00 53.42 O ATOM 0 H TYR A 62 6.598 10.363 0.861 1.00 23.31 H new ATOM 0 HA TYR A 62 9.101 9.021 0.654 1.00 21.42 H new ATOM 0 HB2 TYR A 62 6.472 8.468 2.057 1.00 21.22 H new ATOM 0 HB3 TYR A 62 7.743 7.261 2.035 1.00 21.22 H new ATOM 0 HD1 TYR A 62 9.954 7.743 3.153 1.00 4.33 H new ATOM 0 HD2 TYR A 62 6.691 10.485 3.465 1.00 5.34 H new ATOM 0 HE1 TYR A 62 11.044 8.831 5.064 1.00 24.11 H new ATOM 0 HE2 TYR A 62 7.787 11.563 5.374 1.00 65.20 H new ATOM 0 HH TYR A 62 9.530 11.613 6.717 1.00 53.42 H new ATOM 1031 N GLU A 63 6.700 7.996 -1.296 1.00 32.13 N ATOM 1032 CA GLU A 63 6.280 7.037 -2.344 1.00 52.00 C ATOM 1033 C GLU A 63 7.429 6.687 -3.307 1.00 63.20 C ATOM 1034 O GLU A 63 7.487 5.575 -3.820 1.00 23.14 O ATOM 1035 CB GLU A 63 5.062 7.565 -3.143 1.00 53.24 C ATOM 1036 CG GLU A 63 4.414 6.488 -4.045 1.00 53.02 C ATOM 1037 CD GLU A 63 3.343 7.025 -5.011 1.00 11.31 C ATOM 1038 OE1 GLU A 63 3.617 8.013 -5.736 1.00 5.53 O ATOM 1039 OE2 GLU A 63 2.229 6.446 -5.081 1.00 41.30 O ATOM 0 H GLU A 63 6.095 8.815 -1.229 1.00 32.13 H new ATOM 0 HA GLU A 63 5.988 6.125 -1.824 1.00 52.00 H new ATOM 0 HB2 GLU A 63 4.315 7.944 -2.446 1.00 53.24 H new ATOM 0 HB3 GLU A 63 5.377 8.406 -3.761 1.00 53.24 H new ATOM 0 HG2 GLU A 63 5.197 5.999 -4.625 1.00 53.02 H new ATOM 0 HG3 GLU A 63 3.963 5.724 -3.411 1.00 53.02 H new ATOM 1046 N GLU A 64 8.360 7.639 -3.485 1.00 73.44 N ATOM 1047 CA GLU A 64 9.577 7.459 -4.296 1.00 52.24 C ATOM 1048 C GLU A 64 10.386 6.197 -3.852 1.00 51.11 C ATOM 1049 O GLU A 64 10.949 5.478 -4.685 1.00 60.10 O ATOM 1050 CB GLU A 64 10.438 8.743 -4.181 1.00 54.24 C ATOM 1051 CG GLU A 64 11.713 8.770 -5.044 1.00 74.15 C ATOM 1052 CD GLU A 64 11.430 8.817 -6.557 1.00 64.12 C ATOM 1053 OE1 GLU A 64 11.197 9.924 -7.099 1.00 33.01 O ATOM 1054 OE2 GLU A 64 11.448 7.750 -7.208 1.00 43.41 O ATOM 0 H GLU A 64 8.288 8.566 -3.065 1.00 73.44 H new ATOM 0 HA GLU A 64 9.294 7.295 -5.336 1.00 52.24 H new ATOM 0 HB2 GLU A 64 9.820 9.599 -4.452 1.00 54.24 H new ATOM 0 HB3 GLU A 64 10.725 8.874 -3.138 1.00 54.24 H new ATOM 0 HG2 GLU A 64 12.311 9.638 -4.767 1.00 74.15 H new ATOM 0 HG3 GLU A 64 12.311 7.887 -4.822 1.00 74.15 H new ATOM 1061 N VAL A 65 10.373 5.926 -2.533 1.00 3.24 N ATOM 1062 CA VAL A 65 11.029 4.752 -1.919 1.00 44.20 C ATOM 1063 C VAL A 65 10.377 3.403 -2.371 1.00 20.11 C ATOM 1064 O VAL A 65 11.085 2.400 -2.532 1.00 4.23 O ATOM 1065 CB VAL A 65 11.016 4.865 -0.337 1.00 54.53 C ATOM 1066 CG1 VAL A 65 11.611 3.619 0.314 1.00 75.34 C ATOM 1067 CG2 VAL A 65 11.747 6.148 0.149 1.00 52.40 C ATOM 0 H VAL A 65 9.901 6.523 -1.854 1.00 3.24 H new ATOM 0 HA VAL A 65 12.062 4.748 -2.268 1.00 44.20 H new ATOM 0 HB VAL A 65 9.974 4.940 -0.027 1.00 54.53 H new ATOM 0 HG11 VAL A 65 11.587 3.728 1.398 1.00 75.34 H new ATOM 0 HG12 VAL A 65 11.029 2.744 0.025 1.00 75.34 H new ATOM 0 HG13 VAL A 65 12.642 3.494 -0.016 1.00 75.34 H new ATOM 0 HG21 VAL A 65 11.719 6.193 1.238 1.00 52.40 H new ATOM 0 HG22 VAL A 65 12.784 6.125 -0.186 1.00 52.40 H new ATOM 0 HG23 VAL A 65 11.252 7.027 -0.263 1.00 52.40 H new ATOM 1077 N VAL A 66 9.044 3.412 -2.619 1.00 32.13 N ATOM 1078 CA VAL A 66 8.239 2.184 -2.897 1.00 10.23 C ATOM 1079 C VAL A 66 8.801 1.347 -4.075 1.00 12.34 C ATOM 1080 O VAL A 66 8.713 0.123 -4.047 1.00 60.13 O ATOM 1081 CB VAL A 66 6.706 2.518 -3.132 1.00 33.53 C ATOM 1082 CG1 VAL A 66 5.854 1.252 -3.442 1.00 54.41 C ATOM 1083 CG2 VAL A 66 6.133 3.259 -1.907 1.00 73.42 C ATOM 0 H VAL A 66 8.491 4.269 -2.633 1.00 32.13 H new ATOM 0 HA VAL A 66 8.320 1.571 -1.999 1.00 10.23 H new ATOM 0 HB VAL A 66 6.650 3.160 -4.011 1.00 33.53 H new ATOM 0 HG11 VAL A 66 4.814 1.541 -3.594 1.00 54.41 H new ATOM 0 HG12 VAL A 66 6.232 0.771 -4.344 1.00 54.41 H new ATOM 0 HG13 VAL A 66 5.919 0.556 -2.606 1.00 54.41 H new ATOM 0 HG21 VAL A 66 5.080 3.484 -2.078 1.00 73.42 H new ATOM 0 HG22 VAL A 66 6.231 2.630 -1.022 1.00 73.42 H new ATOM 0 HG23 VAL A 66 6.682 4.188 -1.754 1.00 73.42 H new ATOM 1093 N ARG A 67 9.405 2.006 -5.081 1.00 75.50 N ATOM 1094 CA ARG A 67 9.947 1.314 -6.286 1.00 25.14 C ATOM 1095 C ARG A 67 11.110 0.354 -5.926 1.00 35.21 C ATOM 1096 O ARG A 67 11.258 -0.716 -6.526 1.00 51.34 O ATOM 1097 CB ARG A 67 10.387 2.355 -7.346 1.00 33.44 C ATOM 1098 CG ARG A 67 10.726 1.789 -8.741 1.00 22.34 C ATOM 1099 CD ARG A 67 10.806 2.895 -9.813 1.00 1.41 C ATOM 1100 NE ARG A 67 11.796 3.945 -9.487 1.00 14.14 N ATOM 1101 CZ ARG A 67 11.566 5.277 -9.488 1.00 50.42 C ATOM 1102 NH1 ARG A 67 10.369 5.772 -9.782 1.00 64.41 N ATOM 1103 NH2 ARG A 67 12.554 6.108 -9.208 1.00 12.11 N ATOM 0 H ARG A 67 9.535 3.018 -5.092 1.00 75.50 H new ATOM 0 HA ARG A 67 9.151 0.701 -6.709 1.00 25.14 H new ATOM 0 HB2 ARG A 67 9.591 3.092 -7.457 1.00 33.44 H new ATOM 0 HB3 ARG A 67 11.261 2.885 -6.967 1.00 33.44 H new ATOM 0 HG2 ARG A 67 11.678 1.260 -8.695 1.00 22.34 H new ATOM 0 HG3 ARG A 67 9.969 1.060 -9.029 1.00 22.34 H new ATOM 0 HD2 ARG A 67 11.063 2.446 -10.772 1.00 1.41 H new ATOM 0 HD3 ARG A 67 9.824 3.353 -9.929 1.00 1.41 H new ATOM 0 HE ARG A 67 12.736 3.636 -9.239 1.00 14.14 H new ATOM 0 HH11 ARG A 67 9.600 5.143 -10.013 1.00 64.41 H new ATOM 0 HH12 ARG A 67 10.219 6.781 -9.776 1.00 64.41 H new ATOM 0 HH21 ARG A 67 13.482 5.743 -8.993 1.00 12.11 H new ATOM 0 HH22 ARG A 67 12.389 7.115 -9.207 1.00 12.11 H new ATOM 1117 N ASP A 68 11.901 0.748 -4.908 1.00 40.42 N ATOM 1118 CA ASP A 68 12.976 -0.092 -4.325 1.00 32.23 C ATOM 1119 C ASP A 68 12.379 -1.397 -3.729 1.00 71.12 C ATOM 1120 O ASP A 68 12.948 -2.490 -3.859 1.00 2.33 O ATOM 1121 CB ASP A 68 13.735 0.717 -3.226 1.00 62.22 C ATOM 1122 CG ASP A 68 14.890 -0.068 -2.581 1.00 35.12 C ATOM 1123 OD1 ASP A 68 15.945 -0.225 -3.236 1.00 4.30 O ATOM 1124 OD2 ASP A 68 14.752 -0.551 -1.432 1.00 54.42 O ATOM 0 H ASP A 68 11.815 1.661 -4.462 1.00 40.42 H new ATOM 0 HA ASP A 68 13.680 -0.368 -5.110 1.00 32.23 H new ATOM 0 HB2 ASP A 68 14.129 1.633 -3.666 1.00 62.22 H new ATOM 0 HB3 ASP A 68 13.029 1.014 -2.450 1.00 62.22 H new ATOM 1129 N ILE A 69 11.199 -1.242 -3.107 1.00 61.24 N ATOM 1130 CA ILE A 69 10.451 -2.331 -2.447 1.00 14.31 C ATOM 1131 C ILE A 69 9.753 -3.248 -3.483 1.00 11.01 C ATOM 1132 O ILE A 69 9.637 -4.466 -3.262 1.00 55.33 O ATOM 1133 CB ILE A 69 9.367 -1.739 -1.474 1.00 53.10 C ATOM 1134 CG1 ILE A 69 9.980 -0.611 -0.580 1.00 23.04 C ATOM 1135 CG2 ILE A 69 8.726 -2.855 -0.608 1.00 71.14 C ATOM 1136 CD1 ILE A 69 8.948 0.184 0.193 1.00 73.55 C ATOM 0 H ILE A 69 10.727 -0.340 -3.046 1.00 61.24 H new ATOM 0 HA ILE A 69 11.171 -2.924 -1.883 1.00 14.31 H new ATOM 0 HB ILE A 69 8.576 -1.295 -2.079 1.00 53.10 H new ATOM 0 HG12 ILE A 69 10.682 -1.059 0.124 1.00 23.04 H new ATOM 0 HG13 ILE A 69 10.552 0.070 -1.211 1.00 23.04 H new ATOM 0 HG21 ILE A 69 7.980 -2.417 0.056 1.00 71.14 H new ATOM 0 HG22 ILE A 69 8.249 -3.590 -1.256 1.00 71.14 H new ATOM 0 HG23 ILE A 69 9.498 -3.343 -0.014 1.00 71.14 H new ATOM 0 HD11 ILE A 69 9.448 0.947 0.789 1.00 73.55 H new ATOM 0 HD12 ILE A 69 8.260 0.662 -0.504 1.00 73.55 H new ATOM 0 HD13 ILE A 69 8.392 -0.484 0.851 1.00 73.55 H new ATOM 1148 N VAL A 70 9.292 -2.636 -4.605 1.00 22.33 N ATOM 1149 CA VAL A 70 8.555 -3.330 -5.685 1.00 50.15 C ATOM 1150 C VAL A 70 9.324 -4.566 -6.187 1.00 24.30 C ATOM 1151 O VAL A 70 8.730 -5.638 -6.324 1.00 54.42 O ATOM 1152 CB VAL A 70 8.226 -2.347 -6.889 1.00 32.23 C ATOM 1153 CG1 VAL A 70 7.789 -3.103 -8.171 1.00 61.03 C ATOM 1154 CG2 VAL A 70 7.138 -1.324 -6.472 1.00 34.35 C ATOM 0 H VAL A 70 9.424 -1.640 -4.783 1.00 22.33 H new ATOM 0 HA VAL A 70 7.610 -3.671 -5.261 1.00 50.15 H new ATOM 0 HB VAL A 70 9.148 -1.817 -7.127 1.00 32.23 H new ATOM 0 HG11 VAL A 70 7.576 -2.384 -8.962 1.00 61.03 H new ATOM 0 HG12 VAL A 70 8.590 -3.769 -8.491 1.00 61.03 H new ATOM 0 HG13 VAL A 70 6.893 -3.687 -7.961 1.00 61.03 H new ATOM 0 HG21 VAL A 70 6.925 -0.658 -7.308 1.00 34.35 H new ATOM 0 HG22 VAL A 70 6.229 -1.855 -6.190 1.00 34.35 H new ATOM 0 HG23 VAL A 70 7.495 -0.739 -5.624 1.00 34.35 H new ATOM 1164 N GLU A 71 10.653 -4.404 -6.390 1.00 3.13 N ATOM 1165 CA GLU A 71 11.533 -5.489 -6.873 1.00 35.15 C ATOM 1166 C GLU A 71 11.422 -6.740 -5.982 1.00 33.04 C ATOM 1167 O GLU A 71 11.157 -7.839 -6.479 1.00 42.12 O ATOM 1168 CB GLU A 71 13.014 -5.025 -6.946 1.00 71.44 C ATOM 1169 CG GLU A 71 13.961 -6.076 -7.566 1.00 4.23 C ATOM 1170 CD GLU A 71 15.440 -5.699 -7.439 1.00 62.40 C ATOM 1171 OE1 GLU A 71 15.929 -4.892 -8.260 1.00 44.02 O ATOM 1172 OE2 GLU A 71 16.113 -6.195 -6.511 1.00 21.41 O ATOM 0 H GLU A 71 11.140 -3.523 -6.224 1.00 3.13 H new ATOM 0 HA GLU A 71 11.198 -5.747 -7.878 1.00 35.15 H new ATOM 0 HB2 GLU A 71 13.070 -4.107 -7.531 1.00 71.44 H new ATOM 0 HB3 GLU A 71 13.360 -4.784 -5.941 1.00 71.44 H new ATOM 0 HG2 GLU A 71 13.794 -7.038 -7.081 1.00 4.23 H new ATOM 0 HG3 GLU A 71 13.713 -6.203 -8.620 1.00 4.23 H new ATOM 1179 N TYR A 72 11.552 -6.521 -4.658 1.00 24.00 N ATOM 1180 CA TYR A 72 11.462 -7.588 -3.649 1.00 42.51 C ATOM 1181 C TYR A 72 10.094 -8.300 -3.715 1.00 64.44 C ATOM 1182 O TYR A 72 10.041 -9.525 -3.769 1.00 11.24 O ATOM 1183 CB TYR A 72 11.705 -7.009 -2.227 1.00 52.14 C ATOM 1184 CG TYR A 72 11.477 -8.024 -1.087 1.00 1.13 C ATOM 1185 CD1 TYR A 72 12.474 -8.927 -0.704 1.00 51.20 C ATOM 1186 CD2 TYR A 72 10.253 -8.087 -0.407 1.00 60.33 C ATOM 1187 CE1 TYR A 72 12.253 -9.851 0.303 1.00 60.34 C ATOM 1188 CE2 TYR A 72 10.039 -9.005 0.598 1.00 14.22 C ATOM 1189 CZ TYR A 72 11.038 -9.882 0.950 1.00 34.25 C ATOM 1190 OH TYR A 72 10.811 -10.813 1.949 1.00 44.33 O ATOM 0 H TYR A 72 11.722 -5.597 -4.261 1.00 24.00 H new ATOM 0 HA TYR A 72 12.236 -8.325 -3.865 1.00 42.51 H new ATOM 0 HB2 TYR A 72 12.727 -6.636 -2.168 1.00 52.14 H new ATOM 0 HB3 TYR A 72 11.045 -6.155 -2.076 1.00 52.14 H new ATOM 0 HD1 TYR A 72 13.432 -8.903 -1.202 1.00 51.20 H new ATOM 0 HD2 TYR A 72 9.462 -7.403 -0.676 1.00 60.33 H new ATOM 0 HE1 TYR A 72 13.032 -10.546 0.580 1.00 60.34 H new ATOM 0 HE2 TYR A 72 9.088 -9.036 1.109 1.00 14.22 H new ATOM 0 HH TYR A 72 10.025 -11.352 1.721 1.00 44.33 H new ATOM 1200 N ALA A 73 9.006 -7.503 -3.717 1.00 41.03 N ATOM 1201 CA ALA A 73 7.618 -8.001 -3.764 1.00 22.45 C ATOM 1202 C ALA A 73 7.334 -8.844 -5.034 1.00 74.33 C ATOM 1203 O ALA A 73 6.490 -9.758 -5.012 1.00 75.11 O ATOM 1204 CB ALA A 73 6.648 -6.820 -3.647 1.00 31.21 C ATOM 0 H ALA A 73 9.068 -6.485 -3.686 1.00 41.03 H new ATOM 0 HA ALA A 73 7.470 -8.672 -2.918 1.00 22.45 H new ATOM 0 HB1 ALA A 73 5.622 -7.187 -3.682 1.00 31.21 H new ATOM 0 HB2 ALA A 73 6.817 -6.303 -2.702 1.00 31.21 H new ATOM 0 HB3 ALA A 73 6.814 -6.129 -4.474 1.00 31.21 H new ATOM 1210 N GLN A 74 8.032 -8.512 -6.138 1.00 23.22 N ATOM 1211 CA GLN A 74 7.981 -9.298 -7.390 1.00 43.35 C ATOM 1212 C GLN A 74 8.722 -10.638 -7.217 1.00 73.22 C ATOM 1213 O GLN A 74 8.244 -11.683 -7.663 1.00 63.33 O ATOM 1214 CB GLN A 74 8.622 -8.512 -8.557 1.00 31.23 C ATOM 1215 CG GLN A 74 7.915 -7.200 -8.909 1.00 33.42 C ATOM 1216 CD GLN A 74 8.562 -6.467 -10.080 1.00 74.44 C ATOM 1217 OE1 GLN A 74 9.767 -6.568 -10.304 1.00 3.13 O ATOM 1218 NE2 GLN A 74 7.778 -5.728 -10.830 1.00 5.44 N ATOM 0 H GLN A 74 8.644 -7.697 -6.189 1.00 23.22 H new ATOM 0 HA GLN A 74 6.933 -9.490 -7.620 1.00 43.35 H new ATOM 0 HB2 GLN A 74 9.659 -8.293 -8.303 1.00 31.23 H new ATOM 0 HB3 GLN A 74 8.638 -9.149 -9.441 1.00 31.23 H new ATOM 0 HG2 GLN A 74 6.873 -7.409 -9.150 1.00 33.42 H new ATOM 0 HG3 GLN A 74 7.915 -6.548 -8.035 1.00 33.42 H new ATOM 0 HE21 GLN A 74 6.782 -5.664 -10.619 1.00 5.44 H new ATOM 0 HE22 GLN A 74 8.165 -5.218 -11.624 1.00 5.44 H new ATOM 1227 N LYS A 75 9.901 -10.574 -6.557 1.00 41.43 N ATOM 1228 CA LYS A 75 10.765 -11.750 -6.293 1.00 40.30 C ATOM 1229 C LYS A 75 10.073 -12.746 -5.335 1.00 52.11 C ATOM 1230 O LYS A 75 10.369 -13.940 -5.352 1.00 4.00 O ATOM 1231 CB LYS A 75 12.134 -11.299 -5.711 1.00 1.51 C ATOM 1232 CG LYS A 75 12.991 -10.413 -6.647 1.00 15.05 C ATOM 1233 CD LYS A 75 13.444 -11.118 -7.940 1.00 22.54 C ATOM 1234 CE LYS A 75 14.349 -12.332 -7.682 1.00 5.43 C ATOM 1235 NZ LYS A 75 14.746 -13.000 -8.949 1.00 24.44 N ATOM 0 H LYS A 75 10.282 -9.702 -6.191 1.00 41.43 H new ATOM 0 HA LYS A 75 10.939 -12.259 -7.241 1.00 40.30 H new ATOM 0 HB2 LYS A 75 11.954 -10.753 -4.785 1.00 1.51 H new ATOM 0 HB3 LYS A 75 12.710 -12.187 -5.451 1.00 1.51 H new ATOM 0 HG2 LYS A 75 12.419 -9.524 -6.912 1.00 15.05 H new ATOM 0 HG3 LYS A 75 13.873 -10.074 -6.103 1.00 15.05 H new ATOM 0 HD2 LYS A 75 12.565 -11.440 -8.498 1.00 22.54 H new ATOM 0 HD3 LYS A 75 13.976 -10.404 -8.569 1.00 22.54 H new ATOM 0 HE2 LYS A 75 15.241 -12.013 -7.144 1.00 5.43 H new ATOM 0 HE3 LYS A 75 13.829 -13.045 -7.042 1.00 5.43 H new ATOM 0 HZ1 LYS A 75 15.356 -13.815 -8.736 1.00 24.44 H new ATOM 0 HZ2 LYS A 75 13.895 -13.326 -9.451 1.00 24.44 H new ATOM 0 HZ3 LYS A 75 15.265 -12.327 -9.549 1.00 24.44 H new ATOM 1249 N GLU A 76 9.170 -12.212 -4.494 1.00 74.05 N ATOM 1250 CA GLU A 76 8.251 -13.009 -3.668 1.00 23.22 C ATOM 1251 C GLU A 76 7.303 -13.815 -4.569 1.00 72.42 C ATOM 1252 O GLU A 76 7.103 -15.018 -4.375 1.00 45.52 O ATOM 1253 CB GLU A 76 7.407 -12.068 -2.759 1.00 15.54 C ATOM 1254 CG GLU A 76 8.202 -11.219 -1.758 1.00 4.53 C ATOM 1255 CD GLU A 76 8.831 -12.038 -0.624 1.00 43.31 C ATOM 1256 OE1 GLU A 76 9.936 -12.579 -0.808 1.00 65.41 O ATOM 1257 OE2 GLU A 76 8.229 -12.137 0.465 1.00 21.54 O ATOM 0 H GLU A 76 9.058 -11.206 -4.369 1.00 74.05 H new ATOM 0 HA GLU A 76 8.836 -13.690 -3.050 1.00 23.22 H new ATOM 0 HB2 GLU A 76 6.830 -11.399 -3.397 1.00 15.54 H new ATOM 0 HB3 GLU A 76 6.691 -12.675 -2.204 1.00 15.54 H new ATOM 0 HG2 GLU A 76 8.990 -10.686 -2.291 1.00 4.53 H new ATOM 0 HG3 GLU A 76 7.542 -10.465 -1.328 1.00 4.53 H new ATOM 1264 N GLY A 77 6.747 -13.113 -5.571 1.00 61.32 N ATOM 1265 CA GLY A 77 5.691 -13.648 -6.422 1.00 34.01 C ATOM 1266 C GLY A 77 4.310 -13.389 -5.829 1.00 31.11 C ATOM 1267 O GLY A 77 3.399 -14.212 -5.962 1.00 23.02 O ATOM 0 H GLY A 77 7.023 -12.160 -5.807 1.00 61.32 H new ATOM 0 HA2 GLY A 77 5.754 -13.194 -7.411 1.00 34.01 H new ATOM 0 HA3 GLY A 77 5.836 -14.720 -6.553 1.00 34.01 H new ATOM 1271 N LEU A 78 4.174 -12.234 -5.144 1.00 2.13 N ATOM 1272 CA LEU A 78 2.915 -11.815 -4.495 1.00 64.02 C ATOM 1273 C LEU A 78 2.123 -10.865 -5.399 1.00 4.13 C ATOM 1274 O LEU A 78 2.674 -10.270 -6.334 1.00 44.24 O ATOM 1275 CB LEU A 78 3.216 -11.117 -3.141 1.00 12.44 C ATOM 1276 CG LEU A 78 3.891 -12.004 -2.051 1.00 5.43 C ATOM 1277 CD1 LEU A 78 4.232 -11.178 -0.803 1.00 42.41 C ATOM 1278 CD2 LEU A 78 3.015 -13.220 -1.685 1.00 30.12 C ATOM 0 H LEU A 78 4.935 -11.565 -5.026 1.00 2.13 H new ATOM 0 HA LEU A 78 2.314 -12.707 -4.316 1.00 64.02 H new ATOM 0 HB2 LEU A 78 3.860 -10.258 -3.333 1.00 12.44 H new ATOM 0 HB3 LEU A 78 2.280 -10.730 -2.738 1.00 12.44 H new ATOM 0 HG LEU A 78 4.822 -12.385 -2.471 1.00 5.43 H new ATOM 0 HD11 LEU A 78 4.702 -11.821 -0.058 1.00 42.41 H new ATOM 0 HD12 LEU A 78 4.918 -10.375 -1.074 1.00 42.41 H new ATOM 0 HD13 LEU A 78 3.319 -10.750 -0.389 1.00 42.41 H new ATOM 0 HD21 LEU A 78 3.518 -13.815 -0.923 1.00 30.12 H new ATOM 0 HD22 LEU A 78 2.055 -12.875 -1.301 1.00 30.12 H new ATOM 0 HD23 LEU A 78 2.852 -13.831 -2.573 1.00 30.12 H new ATOM 1290 N ARG A 79 0.823 -10.736 -5.096 1.00 5.31 N ATOM 1291 CA ARG A 79 -0.067 -9.754 -5.725 1.00 21.23 C ATOM 1292 C ARG A 79 0.221 -8.369 -5.114 1.00 31.20 C ATOM 1293 O ARG A 79 -0.030 -8.156 -3.926 1.00 53.01 O ATOM 1294 CB ARG A 79 -1.547 -10.167 -5.494 1.00 23.14 C ATOM 1295 CG ARG A 79 -2.611 -9.199 -6.063 1.00 62.44 C ATOM 1296 CD ARG A 79 -2.522 -9.017 -7.591 1.00 54.22 C ATOM 1297 NE ARG A 79 -3.656 -8.230 -8.112 1.00 32.44 N ATOM 1298 CZ ARG A 79 -3.613 -7.398 -9.168 1.00 72.44 C ATOM 1299 NH1 ARG A 79 -2.488 -7.222 -9.844 1.00 11.05 N ATOM 1300 NH2 ARG A 79 -4.713 -6.771 -9.555 1.00 31.04 N ATOM 0 H ARG A 79 0.357 -11.318 -4.400 1.00 5.31 H new ATOM 0 HA ARG A 79 0.108 -9.714 -6.800 1.00 21.23 H new ATOM 0 HB2 ARG A 79 -1.704 -11.151 -5.937 1.00 23.14 H new ATOM 0 HB3 ARG A 79 -1.713 -10.270 -4.422 1.00 23.14 H new ATOM 0 HG2 ARG A 79 -3.603 -9.571 -5.807 1.00 62.44 H new ATOM 0 HG3 ARG A 79 -2.501 -8.227 -5.582 1.00 62.44 H new ATOM 0 HD2 ARG A 79 -1.586 -8.519 -7.845 1.00 54.22 H new ATOM 0 HD3 ARG A 79 -2.504 -9.994 -8.074 1.00 54.22 H new ATOM 0 HE ARG A 79 -4.550 -8.325 -7.630 1.00 32.44 H new ATOM 0 HH11 ARG A 79 -1.642 -7.720 -9.566 1.00 11.05 H new ATOM 0 HH12 ARG A 79 -2.467 -6.589 -10.643 1.00 11.05 H new ATOM 0 HH21 ARG A 79 -5.588 -6.920 -9.053 1.00 31.04 H new ATOM 0 HH22 ARG A 79 -4.685 -6.139 -10.355 1.00 31.04 H new ATOM 1314 N VAL A 80 0.769 -7.452 -5.926 1.00 14.44 N ATOM 1315 CA VAL A 80 1.166 -6.105 -5.480 1.00 25.50 C ATOM 1316 C VAL A 80 0.155 -5.106 -6.054 1.00 40.42 C ATOM 1317 O VAL A 80 -0.003 -4.998 -7.279 1.00 52.34 O ATOM 1318 CB VAL A 80 2.634 -5.737 -5.940 1.00 72.34 C ATOM 1319 CG1 VAL A 80 3.109 -4.410 -5.293 1.00 43.01 C ATOM 1320 CG2 VAL A 80 3.617 -6.891 -5.625 1.00 43.55 C ATOM 0 H VAL A 80 0.951 -7.623 -6.915 1.00 14.44 H new ATOM 0 HA VAL A 80 1.167 -6.071 -4.391 1.00 25.50 H new ATOM 0 HB VAL A 80 2.618 -5.592 -7.020 1.00 72.34 H new ATOM 0 HG11 VAL A 80 4.121 -4.184 -5.628 1.00 43.01 H new ATOM 0 HG12 VAL A 80 2.440 -3.602 -5.588 1.00 43.01 H new ATOM 0 HG13 VAL A 80 3.100 -4.511 -4.208 1.00 43.01 H new ATOM 0 HG21 VAL A 80 4.620 -6.614 -5.951 1.00 43.55 H new ATOM 0 HG22 VAL A 80 3.624 -7.081 -4.552 1.00 43.55 H new ATOM 0 HG23 VAL A 80 3.301 -7.792 -6.151 1.00 43.55 H new ATOM 1330 N LEU A 81 -0.529 -4.400 -5.161 1.00 5.01 N ATOM 1331 CA LEU A 81 -1.650 -3.526 -5.496 1.00 53.00 C ATOM 1332 C LEU A 81 -1.479 -2.225 -4.716 1.00 11.21 C ATOM 1333 O LEU A 81 -1.626 -2.213 -3.499 1.00 4.31 O ATOM 1334 CB LEU A 81 -2.969 -4.246 -5.100 1.00 62.45 C ATOM 1335 CG LEU A 81 -4.303 -3.555 -5.517 1.00 13.33 C ATOM 1336 CD1 LEU A 81 -4.475 -3.592 -7.041 1.00 3.02 C ATOM 1337 CD2 LEU A 81 -5.513 -4.198 -4.803 1.00 12.33 C ATOM 0 H LEU A 81 -0.317 -4.419 -4.164 1.00 5.01 H new ATOM 0 HA LEU A 81 -1.683 -3.302 -6.562 1.00 53.00 H new ATOM 0 HB2 LEU A 81 -2.954 -5.245 -5.536 1.00 62.45 H new ATOM 0 HB3 LEU A 81 -2.976 -4.370 -4.017 1.00 62.45 H new ATOM 0 HG LEU A 81 -4.256 -2.512 -5.205 1.00 13.33 H new ATOM 0 HD11 LEU A 81 -5.411 -3.105 -7.313 1.00 3.02 H new ATOM 0 HD12 LEU A 81 -3.643 -3.069 -7.514 1.00 3.02 H new ATOM 0 HD13 LEU A 81 -4.492 -4.628 -7.380 1.00 3.02 H new ATOM 0 HD21 LEU A 81 -6.429 -3.695 -5.114 1.00 12.33 H new ATOM 0 HD22 LEU A 81 -5.572 -5.254 -5.066 1.00 12.33 H new ATOM 0 HD23 LEU A 81 -5.393 -4.099 -3.724 1.00 12.33 H new ATOM 1349 N VAL A 82 -1.154 -1.134 -5.400 1.00 23.23 N ATOM 1350 CA VAL A 82 -0.928 0.163 -4.748 1.00 65.54 C ATOM 1351 C VAL A 82 -2.227 0.974 -4.796 1.00 22.22 C ATOM 1352 O VAL A 82 -2.708 1.321 -5.869 1.00 14.10 O ATOM 1353 CB VAL A 82 0.260 0.952 -5.419 1.00 73.42 C ATOM 1354 CG1 VAL A 82 0.505 2.325 -4.731 1.00 23.43 C ATOM 1355 CG2 VAL A 82 1.547 0.087 -5.422 1.00 55.44 C ATOM 0 H VAL A 82 -1.039 -1.116 -6.413 1.00 23.23 H new ATOM 0 HA VAL A 82 -0.642 -0.007 -3.710 1.00 65.54 H new ATOM 0 HB VAL A 82 -0.019 1.161 -6.452 1.00 73.42 H new ATOM 0 HG11 VAL A 82 1.332 2.836 -5.224 1.00 23.43 H new ATOM 0 HG12 VAL A 82 -0.395 2.935 -4.806 1.00 23.43 H new ATOM 0 HG13 VAL A 82 0.750 2.167 -3.681 1.00 23.43 H new ATOM 0 HG21 VAL A 82 2.359 0.645 -5.888 1.00 55.44 H new ATOM 0 HG22 VAL A 82 1.820 -0.162 -4.397 1.00 55.44 H new ATOM 0 HG23 VAL A 82 1.368 -0.830 -5.983 1.00 55.44 H new ATOM 1365 N ILE A 83 -2.800 1.247 -3.622 1.00 53.14 N ATOM 1366 CA ILE A 83 -4.034 2.019 -3.485 1.00 14.10 C ATOM 1367 C ILE A 83 -3.620 3.463 -3.195 1.00 31.43 C ATOM 1368 O ILE A 83 -3.115 3.778 -2.123 1.00 72.11 O ATOM 1369 CB ILE A 83 -4.924 1.435 -2.332 1.00 2.21 C ATOM 1370 CG1 ILE A 83 -5.171 -0.090 -2.583 1.00 2.33 C ATOM 1371 CG2 ILE A 83 -6.263 2.213 -2.200 1.00 65.33 C ATOM 1372 CD1 ILE A 83 -5.829 -0.816 -1.434 1.00 53.41 C ATOM 0 H ILE A 83 -2.415 0.934 -2.731 1.00 53.14 H new ATOM 0 HA ILE A 83 -4.633 1.971 -4.394 1.00 14.10 H new ATOM 0 HB ILE A 83 -4.396 1.554 -1.386 1.00 2.21 H new ATOM 0 HG12 ILE A 83 -5.793 -0.203 -3.471 1.00 2.33 H new ATOM 0 HG13 ILE A 83 -4.216 -0.569 -2.799 1.00 2.33 H new ATOM 0 HG21 ILE A 83 -6.856 1.783 -1.393 1.00 65.33 H new ATOM 0 HG22 ILE A 83 -6.055 3.260 -1.980 1.00 65.33 H new ATOM 0 HG23 ILE A 83 -6.819 2.142 -3.135 1.00 65.33 H new ATOM 0 HD11 ILE A 83 -5.961 -1.866 -1.695 1.00 53.41 H new ATOM 0 HD12 ILE A 83 -5.200 -0.739 -0.547 1.00 53.41 H new ATOM 0 HD13 ILE A 83 -6.801 -0.368 -1.229 1.00 53.41 H new ATOM 1384 N LYS A 84 -3.835 4.324 -4.169 1.00 53.02 N ATOM 1385 CA LYS A 84 -3.177 5.618 -4.276 1.00 34.25 C ATOM 1386 C LYS A 84 -4.231 6.704 -4.489 1.00 62.22 C ATOM 1387 O LYS A 84 -5.089 6.583 -5.373 1.00 70.20 O ATOM 1388 CB LYS A 84 -2.195 5.526 -5.474 1.00 14.35 C ATOM 1389 CG LYS A 84 -1.445 6.818 -5.835 1.00 1.51 C ATOM 1390 CD LYS A 84 -0.622 6.656 -7.134 1.00 74.34 C ATOM 1391 CE LYS A 84 0.010 7.969 -7.591 1.00 74.00 C ATOM 1392 NZ LYS A 84 0.981 8.513 -6.616 1.00 11.31 N ATOM 0 H LYS A 84 -4.489 4.142 -4.930 1.00 53.02 H new ATOM 0 HA LYS A 84 -2.627 5.875 -3.371 1.00 34.25 H new ATOM 0 HB2 LYS A 84 -1.459 4.752 -5.256 1.00 14.35 H new ATOM 0 HB3 LYS A 84 -2.753 5.197 -6.351 1.00 14.35 H new ATOM 0 HG2 LYS A 84 -2.160 7.632 -5.956 1.00 1.51 H new ATOM 0 HG3 LYS A 84 -0.782 7.095 -5.016 1.00 1.51 H new ATOM 0 HD2 LYS A 84 0.161 5.915 -6.974 1.00 74.34 H new ATOM 0 HD3 LYS A 84 -1.267 6.272 -7.924 1.00 74.34 H new ATOM 0 HE2 LYS A 84 0.512 7.811 -8.546 1.00 74.00 H new ATOM 0 HE3 LYS A 84 -0.776 8.704 -7.761 1.00 74.00 H new ATOM 0 HZ1 LYS A 84 1.569 9.236 -7.078 1.00 11.31 H new ATOM 0 HZ2 LYS A 84 0.469 8.941 -5.818 1.00 11.31 H new ATOM 0 HZ3 LYS A 84 1.589 7.745 -6.266 1.00 11.31 H new ATOM 1406 N VAL A 85 -4.168 7.747 -3.661 1.00 51.35 N ATOM 1407 CA VAL A 85 -5.040 8.911 -3.773 1.00 0.03 C ATOM 1408 C VAL A 85 -4.415 9.898 -4.772 1.00 42.32 C ATOM 1409 O VAL A 85 -3.426 10.568 -4.455 1.00 2.11 O ATOM 1410 CB VAL A 85 -5.250 9.599 -2.372 1.00 55.23 C ATOM 1411 CG1 VAL A 85 -6.141 10.856 -2.491 1.00 44.13 C ATOM 1412 CG2 VAL A 85 -5.830 8.596 -1.340 1.00 70.53 C ATOM 0 H VAL A 85 -3.504 7.806 -2.889 1.00 51.35 H new ATOM 0 HA VAL A 85 -6.020 8.595 -4.129 1.00 0.03 H new ATOM 0 HB VAL A 85 -4.273 9.922 -2.012 1.00 55.23 H new ATOM 0 HG11 VAL A 85 -6.267 11.307 -1.507 1.00 44.13 H new ATOM 0 HG12 VAL A 85 -5.670 11.574 -3.162 1.00 44.13 H new ATOM 0 HG13 VAL A 85 -7.116 10.574 -2.888 1.00 44.13 H new ATOM 0 HG21 VAL A 85 -5.965 9.097 -0.382 1.00 70.53 H new ATOM 0 HG22 VAL A 85 -6.792 8.225 -1.694 1.00 70.53 H new ATOM 0 HG23 VAL A 85 -5.141 7.760 -1.218 1.00 70.53 H new ATOM 1422 N ALA A 86 -4.970 9.928 -5.993 1.00 42.55 N ATOM 1423 CA ALA A 86 -4.584 10.897 -7.025 1.00 31.23 C ATOM 1424 C ALA A 86 -5.307 12.234 -6.764 1.00 31.34 C ATOM 1425 O ALA A 86 -6.412 12.238 -6.219 1.00 12.13 O ATOM 1426 CB ALA A 86 -4.918 10.337 -8.415 1.00 41.11 C ATOM 0 H ALA A 86 -5.699 9.280 -6.291 1.00 42.55 H new ATOM 0 HA ALA A 86 -3.509 11.076 -6.988 1.00 31.23 H new ATOM 0 HB1 ALA A 86 -4.629 11.060 -9.178 1.00 41.11 H new ATOM 0 HB2 ALA A 86 -4.373 9.406 -8.573 1.00 41.11 H new ATOM 0 HB3 ALA A 86 -5.989 10.146 -8.483 1.00 41.11 H new ATOM 1432 N GLN A 87 -4.670 13.359 -7.133 1.00 64.32 N ATOM 1433 CA GLN A 87 -5.211 14.714 -6.867 1.00 53.45 C ATOM 1434 C GLN A 87 -4.492 15.769 -7.723 1.00 71.03 C ATOM 1435 O GLN A 87 -4.221 16.883 -7.258 1.00 11.44 O ATOM 1436 CB GLN A 87 -5.167 15.032 -5.329 1.00 72.03 C ATOM 1437 CG GLN A 87 -3.820 14.755 -4.622 1.00 72.22 C ATOM 1438 CD GLN A 87 -3.851 14.909 -3.089 1.00 73.20 C ATOM 1439 OE1 GLN A 87 -4.972 14.569 -2.452 1.00 51.34 O flip ATOM 1440 NE2 GLN A 87 -2.850 15.292 -2.474 1.00 65.13 N flip ATOM 0 H GLN A 87 -3.774 13.361 -7.620 1.00 64.32 H new ATOM 0 HA GLN A 87 -6.260 14.744 -7.163 1.00 53.45 H new ATOM 0 HB2 GLN A 87 -5.421 16.083 -5.187 1.00 72.03 H new ATOM 0 HB3 GLN A 87 -5.942 14.447 -4.834 1.00 72.03 H new ATOM 0 HG2 GLN A 87 -3.500 13.742 -4.865 1.00 72.22 H new ATOM 0 HG3 GLN A 87 -3.068 15.432 -5.026 1.00 72.22 H new ATOM 0 HE21 GLN A 87 -2.004 15.546 -2.984 1.00 65.13 H new ATOM 0 HE22 GLN A 87 -2.869 15.354 -1.456 1.00 65.13 H new ATOM 1449 N ASP A 88 -4.233 15.395 -8.998 1.00 24.12 N ATOM 1450 CA ASP A 88 -3.636 16.273 -10.035 1.00 50.55 C ATOM 1451 C ASP A 88 -2.291 16.887 -9.568 1.00 72.52 C ATOM 1452 O ASP A 88 -2.231 18.047 -9.152 1.00 54.50 O ATOM 1453 CB ASP A 88 -4.664 17.367 -10.493 1.00 1.42 C ATOM 1454 CG ASP A 88 -4.123 18.318 -11.590 1.00 74.51 C ATOM 1455 OD1 ASP A 88 -4.065 17.904 -12.771 1.00 72.21 O ATOM 1456 OD2 ASP A 88 -3.756 19.476 -11.277 1.00 33.33 O ATOM 0 H ASP A 88 -4.437 14.457 -9.342 1.00 24.12 H new ATOM 0 HA ASP A 88 -3.403 15.658 -10.904 1.00 50.55 H new ATOM 0 HB2 ASP A 88 -5.563 16.874 -10.864 1.00 1.42 H new ATOM 0 HB3 ASP A 88 -4.960 17.959 -9.627 1.00 1.42 H new ATOM 1461 N GLN A 89 -1.219 16.069 -9.577 1.00 14.53 N ATOM 1462 CA GLN A 89 0.146 16.507 -9.199 1.00 20.25 C ATOM 1463 C GLN A 89 1.178 15.809 -10.090 1.00 3.45 C ATOM 1464 O GLN A 89 1.101 14.596 -10.306 1.00 71.55 O ATOM 1465 CB GLN A 89 0.449 16.216 -7.699 1.00 73.20 C ATOM 1466 CG GLN A 89 -0.336 17.087 -6.700 1.00 22.11 C ATOM 1467 CD GLN A 89 -0.017 16.783 -5.241 1.00 60.33 C ATOM 1468 OE1 GLN A 89 -0.740 15.843 -4.658 1.00 42.14 O flip ATOM 1469 NE2 GLN A 89 0.890 17.371 -4.651 1.00 33.20 N flip ATOM 0 H GLN A 89 -1.272 15.086 -9.846 1.00 14.53 H new ATOM 0 HA GLN A 89 0.206 17.586 -9.344 1.00 20.25 H new ATOM 0 HB2 GLN A 89 0.230 15.168 -7.496 1.00 73.20 H new ATOM 0 HB3 GLN A 89 1.515 16.359 -7.524 1.00 73.20 H new ATOM 0 HG2 GLN A 89 -0.120 18.137 -6.899 1.00 22.11 H new ATOM 0 HG3 GLN A 89 -1.404 16.944 -6.867 1.00 22.11 H new ATOM 0 HE21 GLN A 89 1.428 18.092 -5.132 1.00 33.20 H new ATOM 0 HE22 GLN A 89 1.103 17.137 -3.681 1.00 33.20 H new ATOM 1478 N GLU A 90 2.149 16.598 -10.573 1.00 62.43 N ATOM 1479 CA GLU A 90 3.222 16.147 -11.479 1.00 61.43 C ATOM 1480 C GLU A 90 4.168 15.125 -10.805 1.00 41.23 C ATOM 1481 O GLU A 90 4.606 14.178 -11.450 1.00 44.22 O ATOM 1482 CB GLU A 90 4.009 17.384 -11.996 1.00 33.03 C ATOM 1483 CG GLU A 90 4.586 18.279 -10.879 1.00 44.30 C ATOM 1484 CD GLU A 90 5.277 19.543 -11.398 1.00 23.22 C ATOM 1485 OE1 GLU A 90 6.410 19.436 -11.905 1.00 73.23 O ATOM 1486 OE2 GLU A 90 4.697 20.645 -11.295 1.00 21.44 O ATOM 0 H GLU A 90 2.214 17.589 -10.341 1.00 62.43 H new ATOM 0 HA GLU A 90 2.764 15.629 -12.322 1.00 61.43 H new ATOM 0 HB2 GLU A 90 4.827 17.041 -12.630 1.00 33.03 H new ATOM 0 HB3 GLU A 90 3.349 17.984 -12.623 1.00 33.03 H new ATOM 0 HG2 GLU A 90 3.780 18.567 -10.204 1.00 44.30 H new ATOM 0 HG3 GLU A 90 5.300 17.700 -10.294 1.00 44.30 H new ATOM 1493 N LEU A 91 4.463 15.330 -9.502 1.00 22.23 N ATOM 1494 CA LEU A 91 5.325 14.424 -8.697 1.00 54.24 C ATOM 1495 C LEU A 91 4.605 13.083 -8.485 1.00 61.41 C ATOM 1496 O LEU A 91 5.181 12.002 -8.681 1.00 13.42 O ATOM 1497 CB LEU A 91 5.654 15.125 -7.343 1.00 11.00 C ATOM 1498 CG LEU A 91 6.854 14.569 -6.485 1.00 4.25 C ATOM 1499 CD1 LEU A 91 7.296 15.614 -5.439 1.00 3.24 C ATOM 1500 CD2 LEU A 91 6.534 13.220 -5.786 1.00 64.42 C ATOM 0 H LEU A 91 4.111 16.129 -8.974 1.00 22.23 H new ATOM 0 HA LEU A 91 6.261 14.216 -9.216 1.00 54.24 H new ATOM 0 HB2 LEU A 91 5.854 16.176 -7.553 1.00 11.00 H new ATOM 0 HB3 LEU A 91 4.758 15.089 -6.724 1.00 11.00 H new ATOM 0 HG LEU A 91 7.668 14.376 -7.183 1.00 4.25 H new ATOM 0 HD11 LEU A 91 8.125 15.215 -4.854 1.00 3.24 H new ATOM 0 HD12 LEU A 91 7.614 16.525 -5.946 1.00 3.24 H new ATOM 0 HD13 LEU A 91 6.461 15.841 -4.776 1.00 3.24 H new ATOM 0 HD21 LEU A 91 7.401 12.893 -5.212 1.00 64.42 H new ATOM 0 HD22 LEU A 91 5.684 13.350 -5.116 1.00 64.42 H new ATOM 0 HD23 LEU A 91 6.292 12.469 -6.538 1.00 64.42 H new ATOM 1512 N LEU A 92 3.330 13.200 -8.087 1.00 52.01 N ATOM 1513 CA LEU A 92 2.430 12.067 -7.849 1.00 52.43 C ATOM 1514 C LEU A 92 2.279 11.212 -9.126 1.00 3.11 C ATOM 1515 O LEU A 92 2.228 9.984 -9.042 1.00 14.44 O ATOM 1516 CB LEU A 92 1.069 12.641 -7.330 1.00 43.24 C ATOM 1517 CG LEU A 92 -0.134 11.656 -7.061 1.00 12.51 C ATOM 1518 CD1 LEU A 92 -1.105 12.223 -5.999 1.00 62.45 C ATOM 1519 CD2 LEU A 92 -0.921 11.334 -8.360 1.00 1.21 C ATOM 0 H LEU A 92 2.889 14.104 -7.919 1.00 52.01 H new ATOM 0 HA LEU A 92 2.836 11.394 -7.093 1.00 52.43 H new ATOM 0 HB2 LEU A 92 1.271 13.172 -6.400 1.00 43.24 H new ATOM 0 HB3 LEU A 92 0.729 13.382 -8.053 1.00 43.24 H new ATOM 0 HG LEU A 92 0.305 10.733 -6.683 1.00 12.51 H new ATOM 0 HD11 LEU A 92 -1.921 11.518 -5.839 1.00 62.45 H new ATOM 0 HD12 LEU A 92 -0.570 12.377 -5.062 1.00 62.45 H new ATOM 0 HD13 LEU A 92 -1.509 13.174 -6.346 1.00 62.45 H new ATOM 0 HD21 LEU A 92 -1.740 10.653 -8.130 1.00 1.21 H new ATOM 0 HD22 LEU A 92 -1.323 12.256 -8.780 1.00 1.21 H new ATOM 0 HD23 LEU A 92 -0.253 10.867 -9.084 1.00 1.21 H new ATOM 1531 N GLU A 93 2.209 11.883 -10.295 1.00 35.41 N ATOM 1532 CA GLU A 93 2.057 11.224 -11.608 1.00 20.22 C ATOM 1533 C GLU A 93 3.392 10.588 -12.032 1.00 55.55 C ATOM 1534 O GLU A 93 3.406 9.481 -12.586 1.00 64.43 O ATOM 1535 CB GLU A 93 1.571 12.266 -12.663 1.00 4.33 C ATOM 1536 CG GLU A 93 1.040 11.702 -14.017 1.00 41.33 C ATOM 1537 CD GLU A 93 2.116 11.126 -14.967 1.00 21.24 C ATOM 1538 OE1 GLU A 93 2.941 11.915 -15.482 1.00 74.14 O ATOM 1539 OE2 GLU A 93 2.140 9.901 -15.211 1.00 34.12 O ATOM 0 H GLU A 93 2.257 12.900 -10.354 1.00 35.41 H new ATOM 0 HA GLU A 93 1.312 10.432 -11.537 1.00 20.22 H new ATOM 0 HB2 GLU A 93 0.780 12.864 -12.210 1.00 4.33 H new ATOM 0 HB3 GLU A 93 2.398 12.943 -12.878 1.00 4.33 H new ATOM 0 HG2 GLU A 93 0.312 10.919 -13.804 1.00 41.33 H new ATOM 0 HG3 GLU A 93 0.509 12.498 -14.539 1.00 41.33 H new ATOM 1546 N ARG A 94 4.502 11.302 -11.750 1.00 31.52 N ATOM 1547 CA ARG A 94 5.857 10.912 -12.188 1.00 52.03 C ATOM 1548 C ARG A 94 6.173 9.478 -11.762 1.00 62.31 C ATOM 1549 O ARG A 94 6.508 8.636 -12.597 1.00 73.50 O ATOM 1550 CB ARG A 94 6.918 11.876 -11.597 1.00 64.03 C ATOM 1551 CG ARG A 94 8.367 11.637 -12.087 1.00 23.22 C ATOM 1552 CD ARG A 94 9.389 12.440 -11.266 1.00 53.24 C ATOM 1553 NE ARG A 94 9.418 11.998 -9.856 1.00 1.14 N ATOM 1554 CZ ARG A 94 9.447 12.796 -8.776 1.00 63.22 C ATOM 1555 NH1 ARG A 94 9.439 14.126 -8.893 1.00 70.41 N ATOM 1556 NH2 ARG A 94 9.496 12.245 -7.571 1.00 4.15 N ATOM 0 H ARG A 94 4.483 12.167 -11.211 1.00 31.52 H new ATOM 0 HA ARG A 94 5.887 10.971 -13.276 1.00 52.03 H new ATOM 0 HB2 ARG A 94 6.633 12.899 -11.841 1.00 64.03 H new ATOM 0 HB3 ARG A 94 6.899 11.790 -10.511 1.00 64.03 H new ATOM 0 HG2 ARG A 94 8.602 10.575 -12.021 1.00 23.22 H new ATOM 0 HG3 ARG A 94 8.446 11.916 -13.138 1.00 23.22 H new ATOM 0 HD2 ARG A 94 10.380 12.326 -11.705 1.00 53.24 H new ATOM 0 HD3 ARG A 94 9.141 13.500 -11.311 1.00 53.24 H new ATOM 0 HE ARG A 94 9.416 10.992 -9.687 1.00 1.14 H new ATOM 0 HH11 ARG A 94 9.410 14.556 -9.817 1.00 70.41 H new ATOM 0 HH12 ARG A 94 9.462 14.712 -8.058 1.00 70.41 H new ATOM 0 HH21 ARG A 94 9.511 11.230 -7.475 1.00 4.15 H new ATOM 0 HH22 ARG A 94 9.519 12.836 -6.740 1.00 4.15 H new ATOM 1570 N PHE A 95 5.968 9.213 -10.462 1.00 64.43 N ATOM 1571 CA PHE A 95 6.229 7.907 -9.860 1.00 34.23 C ATOM 1572 C PHE A 95 5.185 6.865 -10.323 1.00 62.02 C ATOM 1573 O PHE A 95 5.528 5.722 -10.628 1.00 35.22 O ATOM 1574 CB PHE A 95 6.241 8.020 -8.317 1.00 23.53 C ATOM 1575 CG PHE A 95 6.693 6.727 -7.656 1.00 22.32 C ATOM 1576 CD1 PHE A 95 8.044 6.424 -7.567 1.00 3.43 C ATOM 1577 CD2 PHE A 95 5.772 5.793 -7.181 1.00 4.33 C ATOM 1578 CE1 PHE A 95 8.458 5.239 -7.010 1.00 54.51 C ATOM 1579 CE2 PHE A 95 6.193 4.602 -6.630 1.00 72.01 C ATOM 1580 CZ PHE A 95 7.531 4.327 -6.548 1.00 20.00 C ATOM 0 H PHE A 95 5.615 9.905 -9.801 1.00 64.43 H new ATOM 0 HA PHE A 95 7.210 7.568 -10.192 1.00 34.23 H new ATOM 0 HB2 PHE A 95 6.904 8.832 -8.018 1.00 23.53 H new ATOM 0 HB3 PHE A 95 5.242 8.278 -7.964 1.00 23.53 H new ATOM 0 HD1 PHE A 95 8.776 7.126 -7.939 1.00 3.43 H new ATOM 0 HD2 PHE A 95 4.715 6.006 -7.246 1.00 4.33 H new ATOM 0 HE1 PHE A 95 9.513 5.020 -6.933 1.00 54.51 H new ATOM 0 HE2 PHE A 95 5.470 3.888 -6.264 1.00 72.01 H new ATOM 0 HZ PHE A 95 7.863 3.393 -6.120 1.00 20.00 H new ATOM 1590 N TYR A 96 3.923 7.312 -10.389 1.00 61.24 N ATOM 1591 CA TYR A 96 2.740 6.501 -10.780 1.00 32.03 C ATOM 1592 C TYR A 96 2.930 5.772 -12.124 1.00 12.15 C ATOM 1593 O TYR A 96 2.469 4.627 -12.289 1.00 1.15 O ATOM 1594 CB TYR A 96 1.534 7.473 -10.843 1.00 74.12 C ATOM 1595 CG TYR A 96 0.286 7.015 -11.602 1.00 31.30 C ATOM 1596 CD1 TYR A 96 -0.566 6.029 -11.097 1.00 72.31 C ATOM 1597 CD2 TYR A 96 -0.065 7.622 -12.816 1.00 3.14 C ATOM 1598 CE1 TYR A 96 -1.708 5.666 -11.778 1.00 32.42 C ATOM 1599 CE2 TYR A 96 -1.201 7.251 -13.495 1.00 54.43 C ATOM 1600 CZ TYR A 96 -2.022 6.277 -12.969 1.00 23.52 C ATOM 1601 OH TYR A 96 -3.178 5.917 -13.630 1.00 23.12 O ATOM 0 H TYR A 96 3.680 8.277 -10.166 1.00 61.24 H new ATOM 0 HA TYR A 96 2.581 5.711 -10.046 1.00 32.03 H new ATOM 0 HB2 TYR A 96 1.237 7.705 -9.820 1.00 74.12 H new ATOM 0 HB3 TYR A 96 1.877 8.404 -11.294 1.00 74.12 H new ATOM 0 HD1 TYR A 96 -0.327 5.545 -10.161 1.00 72.31 H new ATOM 0 HD2 TYR A 96 0.569 8.395 -13.225 1.00 3.14 H new ATOM 0 HE1 TYR A 96 -2.356 4.901 -11.376 1.00 32.42 H new ATOM 0 HE2 TYR A 96 -1.449 7.720 -14.436 1.00 54.43 H new ATOM 0 HH TYR A 96 -3.259 6.439 -14.455 1.00 23.12 H new ATOM 1611 N GLU A 97 3.630 6.435 -13.053 1.00 3.22 N ATOM 1612 CA GLU A 97 3.850 5.926 -14.412 1.00 33.51 C ATOM 1613 C GLU A 97 4.727 4.659 -14.380 1.00 40.23 C ATOM 1614 O GLU A 97 4.496 3.716 -15.147 1.00 52.41 O ATOM 1615 CB GLU A 97 4.482 7.049 -15.280 1.00 32.54 C ATOM 1616 CG GLU A 97 4.954 6.631 -16.698 1.00 2.12 C ATOM 1617 CD GLU A 97 3.828 6.106 -17.620 1.00 42.24 C ATOM 1618 OE1 GLU A 97 3.059 6.931 -18.162 1.00 53.53 O ATOM 1619 OE2 GLU A 97 3.727 4.874 -17.830 1.00 23.12 O ATOM 0 H GLU A 97 4.061 7.343 -12.882 1.00 3.22 H new ATOM 0 HA GLU A 97 2.898 5.641 -14.859 1.00 33.51 H new ATOM 0 HB2 GLU A 97 3.754 7.853 -15.384 1.00 32.54 H new ATOM 0 HB3 GLU A 97 5.336 7.460 -14.741 1.00 32.54 H new ATOM 0 HG2 GLU A 97 5.428 7.488 -17.177 1.00 2.12 H new ATOM 0 HG3 GLU A 97 5.716 5.858 -16.600 1.00 2.12 H new ATOM 1626 N GLN A 98 5.690 4.632 -13.440 1.00 4.31 N ATOM 1627 CA GLN A 98 6.596 3.486 -13.249 1.00 44.21 C ATOM 1628 C GLN A 98 5.826 2.178 -12.934 1.00 32.14 C ATOM 1629 O GLN A 98 6.214 1.109 -13.402 1.00 60.43 O ATOM 1630 CB GLN A 98 7.648 3.787 -12.133 1.00 32.41 C ATOM 1631 CG GLN A 98 8.841 4.674 -12.571 1.00 22.15 C ATOM 1632 CD GLN A 98 8.514 6.160 -12.699 1.00 72.33 C ATOM 1633 OE1 GLN A 98 8.706 6.926 -11.758 1.00 64.43 O ATOM 1634 NE2 GLN A 98 7.977 6.572 -13.834 1.00 40.12 N ATOM 0 H GLN A 98 5.861 5.402 -12.794 1.00 4.31 H new ATOM 0 HA GLN A 98 7.121 3.334 -14.192 1.00 44.21 H new ATOM 0 HB2 GLN A 98 7.141 4.274 -11.300 1.00 32.41 H new ATOM 0 HB3 GLN A 98 8.038 2.840 -11.759 1.00 32.41 H new ATOM 0 HG2 GLN A 98 9.650 4.554 -11.850 1.00 22.15 H new ATOM 0 HG3 GLN A 98 9.212 4.313 -13.530 1.00 22.15 H new ATOM 0 HE21 GLN A 98 7.830 5.912 -14.598 1.00 40.12 H new ATOM 0 HE22 GLN A 98 7.710 7.550 -13.946 1.00 40.12 H new ATOM 1643 N LEU A 99 4.725 2.292 -12.170 1.00 1.31 N ATOM 1644 CA LEU A 99 3.924 1.128 -11.699 1.00 15.15 C ATOM 1645 C LEU A 99 3.237 0.423 -12.880 1.00 43.43 C ATOM 1646 O LEU A 99 3.308 -0.806 -13.019 1.00 40.43 O ATOM 1647 CB LEU A 99 2.851 1.578 -10.650 1.00 34.32 C ATOM 1648 CG LEU A 99 3.365 1.950 -9.215 1.00 22.02 C ATOM 1649 CD1 LEU A 99 4.426 3.061 -9.239 1.00 32.33 C ATOM 1650 CD2 LEU A 99 2.188 2.354 -8.305 1.00 24.12 C ATOM 0 H LEU A 99 4.358 3.191 -11.857 1.00 1.31 H new ATOM 0 HA LEU A 99 4.608 0.426 -11.222 1.00 15.15 H new ATOM 0 HB2 LEU A 99 2.324 2.442 -11.055 1.00 34.32 H new ATOM 0 HB3 LEU A 99 2.119 0.776 -10.550 1.00 34.32 H new ATOM 0 HG LEU A 99 3.843 1.058 -8.810 1.00 22.02 H new ATOM 0 HD11 LEU A 99 4.747 3.279 -8.221 1.00 32.33 H new ATOM 0 HD12 LEU A 99 5.283 2.733 -9.827 1.00 32.33 H new ATOM 0 HD13 LEU A 99 4.002 3.960 -9.686 1.00 32.33 H new ATOM 0 HD21 LEU A 99 2.565 2.608 -7.314 1.00 24.12 H new ATOM 0 HD22 LEU A 99 1.678 3.217 -8.732 1.00 24.12 H new ATOM 0 HD23 LEU A 99 1.488 1.522 -8.225 1.00 24.12 H new ATOM 1662 N LYS A 100 2.597 1.234 -13.733 1.00 2.35 N ATOM 1663 CA LYS A 100 1.796 0.750 -14.868 1.00 40.24 C ATOM 1664 C LYS A 100 2.678 0.265 -16.028 1.00 62.52 C ATOM 1665 O LYS A 100 2.363 -0.739 -16.675 1.00 45.15 O ATOM 1666 CB LYS A 100 0.837 1.868 -15.342 1.00 2.41 C ATOM 1667 CG LYS A 100 -0.138 2.338 -14.244 1.00 1.22 C ATOM 1668 CD LYS A 100 -1.180 3.381 -14.714 1.00 5.22 C ATOM 1669 CE LYS A 100 -2.146 2.870 -15.805 1.00 54.34 C ATOM 1670 NZ LYS A 100 -1.546 2.903 -17.166 1.00 13.13 N ATOM 0 H LYS A 100 2.620 2.251 -13.655 1.00 2.35 H new ATOM 0 HA LYS A 100 1.214 -0.108 -14.530 1.00 40.24 H new ATOM 0 HB2 LYS A 100 1.424 2.719 -15.686 1.00 2.41 H new ATOM 0 HB3 LYS A 100 0.265 1.509 -16.197 1.00 2.41 H new ATOM 0 HG2 LYS A 100 -0.665 1.470 -13.848 1.00 1.22 H new ATOM 0 HG3 LYS A 100 0.438 2.764 -13.422 1.00 1.22 H new ATOM 0 HD2 LYS A 100 -1.763 3.707 -13.853 1.00 5.22 H new ATOM 0 HD3 LYS A 100 -0.654 4.257 -15.093 1.00 5.22 H new ATOM 0 HE2 LYS A 100 -2.446 1.849 -15.569 1.00 54.34 H new ATOM 0 HE3 LYS A 100 -3.051 3.478 -15.797 1.00 54.34 H new ATOM 0 HZ1 LYS A 100 -2.184 3.407 -17.815 1.00 13.13 H new ATOM 0 HZ2 LYS A 100 -0.630 3.395 -17.130 1.00 13.13 H new ATOM 0 HZ3 LYS A 100 -1.404 1.931 -17.506 1.00 13.13 H new ATOM 1684 N LYS A 101 3.784 0.993 -16.275 1.00 5.31 N ATOM 1685 CA LYS A 101 4.752 0.659 -17.339 1.00 1.02 C ATOM 1686 C LYS A 101 5.452 -0.678 -17.030 1.00 12.03 C ATOM 1687 O LYS A 101 5.774 -1.454 -17.935 1.00 54.04 O ATOM 1688 CB LYS A 101 5.791 1.804 -17.490 1.00 63.21 C ATOM 1689 CG LYS A 101 6.731 1.653 -18.709 1.00 75.32 C ATOM 1690 CD LYS A 101 7.743 2.816 -18.861 1.00 34.50 C ATOM 1691 CE LYS A 101 7.069 4.200 -18.954 1.00 14.41 C ATOM 1692 NZ LYS A 101 6.037 4.267 -20.023 1.00 70.10 N ATOM 0 H LYS A 101 4.032 1.828 -15.744 1.00 5.31 H new ATOM 0 HA LYS A 101 4.217 0.550 -18.282 1.00 1.02 H new ATOM 0 HB2 LYS A 101 5.260 2.752 -17.571 1.00 63.21 H new ATOM 0 HB3 LYS A 101 6.395 1.853 -16.584 1.00 63.21 H new ATOM 0 HG2 LYS A 101 7.279 0.715 -18.620 1.00 75.32 H new ATOM 0 HG3 LYS A 101 6.129 1.586 -19.615 1.00 75.32 H new ATOM 0 HD2 LYS A 101 8.426 2.808 -18.011 1.00 34.50 H new ATOM 0 HD3 LYS A 101 8.344 2.651 -19.755 1.00 34.50 H new ATOM 0 HE2 LYS A 101 6.609 4.440 -17.995 1.00 14.41 H new ATOM 0 HE3 LYS A 101 7.830 4.958 -19.141 1.00 14.41 H new ATOM 0 HZ1 LYS A 101 6.142 5.157 -20.551 1.00 70.10 H new ATOM 0 HZ2 LYS A 101 6.156 3.463 -20.672 1.00 70.10 H new ATOM 0 HZ3 LYS A 101 5.090 4.228 -19.594 1.00 70.10 H new ATOM 1706 N ASP A 102 5.666 -0.924 -15.727 1.00 63.20 N ATOM 1707 CA ASP A 102 6.256 -2.171 -15.222 1.00 51.45 C ATOM 1708 C ASP A 102 5.252 -3.333 -15.362 1.00 53.43 C ATOM 1709 O ASP A 102 5.503 -4.304 -16.082 1.00 72.55 O ATOM 1710 CB ASP A 102 6.677 -1.973 -13.742 1.00 51.03 C ATOM 1711 CG ASP A 102 7.137 -3.263 -13.040 1.00 23.30 C ATOM 1712 OD1 ASP A 102 8.336 -3.622 -13.138 1.00 62.13 O ATOM 1713 OD2 ASP A 102 6.296 -3.917 -12.383 1.00 41.34 O ATOM 0 H ASP A 102 5.432 -0.258 -14.991 1.00 63.20 H new ATOM 0 HA ASP A 102 7.139 -2.423 -15.809 1.00 51.45 H new ATOM 0 HB2 ASP A 102 7.484 -1.242 -13.700 1.00 51.03 H new ATOM 0 HB3 ASP A 102 5.837 -1.552 -13.190 1.00 51.03 H new ATOM 1718 N GLY A 103 4.115 -3.206 -14.653 1.00 24.04 N ATOM 1719 CA GLY A 103 3.089 -4.251 -14.618 1.00 15.45 C ATOM 1720 C GLY A 103 2.419 -4.374 -13.258 1.00 13.23 C ATOM 1721 O GLY A 103 1.427 -5.103 -13.128 1.00 45.13 O ATOM 0 H GLY A 103 3.888 -2.383 -14.095 1.00 24.04 H new ATOM 0 HA2 GLY A 103 2.332 -4.036 -15.373 1.00 15.45 H new ATOM 0 HA3 GLY A 103 3.541 -5.207 -14.883 1.00 15.45 H new ATOM 1725 N VAL A 104 2.970 -3.689 -12.237 1.00 22.44 N ATOM 1726 CA VAL A 104 2.349 -3.604 -10.903 1.00 41.44 C ATOM 1727 C VAL A 104 1.017 -2.828 -10.982 1.00 11.20 C ATOM 1728 O VAL A 104 0.954 -1.739 -11.568 1.00 50.32 O ATOM 1729 CB VAL A 104 3.328 -2.944 -9.852 1.00 63.12 C ATOM 1730 CG1 VAL A 104 2.606 -2.554 -8.535 1.00 41.43 C ATOM 1731 CG2 VAL A 104 4.511 -3.896 -9.562 1.00 24.15 C ATOM 0 H VAL A 104 3.852 -3.183 -12.314 1.00 22.44 H new ATOM 0 HA VAL A 104 2.140 -4.618 -10.561 1.00 41.44 H new ATOM 0 HB VAL A 104 3.705 -2.020 -10.291 1.00 63.12 H new ATOM 0 HG11 VAL A 104 3.322 -2.105 -7.847 1.00 41.43 H new ATOM 0 HG12 VAL A 104 1.814 -1.838 -8.753 1.00 41.43 H new ATOM 0 HG13 VAL A 104 2.174 -3.445 -8.079 1.00 41.43 H new ATOM 0 HG21 VAL A 104 5.181 -3.434 -8.837 1.00 24.15 H new ATOM 0 HG22 VAL A 104 4.132 -4.835 -9.159 1.00 24.15 H new ATOM 0 HG23 VAL A 104 5.056 -4.092 -10.486 1.00 24.15 H new ATOM 1741 N ASP A 105 -0.042 -3.412 -10.400 1.00 14.42 N ATOM 1742 CA ASP A 105 -1.394 -2.844 -10.429 1.00 61.32 C ATOM 1743 C ASP A 105 -1.485 -1.682 -9.423 1.00 2.42 C ATOM 1744 O ASP A 105 -0.962 -1.781 -8.309 1.00 73.22 O ATOM 1745 CB ASP A 105 -2.440 -3.940 -10.082 1.00 11.31 C ATOM 1746 CG ASP A 105 -3.826 -3.685 -10.704 1.00 70.24 C ATOM 1747 OD1 ASP A 105 -4.443 -2.640 -10.394 1.00 35.54 O ATOM 1748 OD2 ASP A 105 -4.314 -4.540 -11.491 1.00 31.23 O ATOM 0 H ASP A 105 0.018 -4.296 -9.894 1.00 14.42 H new ATOM 0 HA ASP A 105 -1.606 -2.467 -11.430 1.00 61.32 H new ATOM 0 HB2 ASP A 105 -2.069 -4.906 -10.424 1.00 11.31 H new ATOM 0 HB3 ASP A 105 -2.543 -4.003 -8.999 1.00 11.31 H new ATOM 1753 N VAL A 106 -2.151 -0.597 -9.824 1.00 55.14 N ATOM 1754 CA VAL A 106 -2.351 0.589 -8.984 1.00 50.24 C ATOM 1755 C VAL A 106 -3.802 1.058 -9.113 1.00 2.22 C ATOM 1756 O VAL A 106 -4.266 1.408 -10.210 1.00 73.31 O ATOM 1757 CB VAL A 106 -1.342 1.748 -9.356 1.00 22.05 C ATOM 1758 CG1 VAL A 106 -1.317 2.035 -10.873 1.00 5.34 C ATOM 1759 CG2 VAL A 106 -1.619 3.043 -8.544 1.00 1.41 C ATOM 0 H VAL A 106 -2.571 -0.515 -10.750 1.00 55.14 H new ATOM 0 HA VAL A 106 -2.149 0.320 -7.947 1.00 50.24 H new ATOM 0 HB VAL A 106 -0.350 1.393 -9.078 1.00 22.05 H new ATOM 0 HG11 VAL A 106 -0.610 2.838 -11.080 1.00 5.34 H new ATOM 0 HG12 VAL A 106 -1.012 1.136 -11.408 1.00 5.34 H new ATOM 0 HG13 VAL A 106 -2.312 2.334 -11.203 1.00 5.34 H new ATOM 0 HG21 VAL A 106 -0.903 3.813 -8.831 1.00 1.41 H new ATOM 0 HG22 VAL A 106 -2.630 3.393 -8.751 1.00 1.41 H new ATOM 0 HG23 VAL A 106 -1.518 2.833 -7.479 1.00 1.41 H new ATOM 1769 N ARG A 107 -4.528 1.044 -7.988 1.00 62.42 N ATOM 1770 CA ARG A 107 -5.874 1.605 -7.924 1.00 73.21 C ATOM 1771 C ARG A 107 -5.763 3.089 -7.567 1.00 62.12 C ATOM 1772 O ARG A 107 -5.445 3.424 -6.426 1.00 74.23 O ATOM 1773 CB ARG A 107 -6.735 0.863 -6.856 1.00 3.00 C ATOM 1774 CG ARG A 107 -6.981 -0.646 -7.102 1.00 24.42 C ATOM 1775 CD ARG A 107 -7.705 -0.952 -8.438 1.00 43.04 C ATOM 1776 NE ARG A 107 -6.786 -1.008 -9.595 1.00 35.45 N ATOM 1777 CZ ARG A 107 -6.904 -0.322 -10.744 1.00 63.22 C ATOM 1778 NH1 ARG A 107 -7.899 0.533 -10.952 1.00 4.43 N ATOM 1779 NH2 ARG A 107 -6.019 -0.536 -11.711 1.00 60.45 N ATOM 0 H ARG A 107 -4.199 0.647 -7.108 1.00 62.42 H new ATOM 0 HA ARG A 107 -6.363 1.484 -8.890 1.00 73.21 H new ATOM 0 HB2 ARG A 107 -6.251 0.977 -5.886 1.00 3.00 H new ATOM 0 HB3 ARG A 107 -7.702 1.361 -6.790 1.00 3.00 H new ATOM 0 HG2 ARG A 107 -6.024 -1.167 -7.091 1.00 24.42 H new ATOM 0 HG3 ARG A 107 -7.572 -1.047 -6.279 1.00 24.42 H new ATOM 0 HD2 ARG A 107 -8.229 -1.904 -8.351 1.00 43.04 H new ATOM 0 HD3 ARG A 107 -8.461 -0.188 -8.618 1.00 43.04 H new ATOM 0 HE ARG A 107 -5.982 -1.630 -9.512 1.00 35.45 H new ATOM 0 HH11 ARG A 107 -8.601 0.684 -10.228 1.00 4.43 H new ATOM 0 HH12 ARG A 107 -7.961 1.039 -11.836 1.00 4.43 H new ATOM 0 HH21 ARG A 107 -5.267 -1.211 -11.574 1.00 60.45 H new ATOM 0 HH22 ARG A 107 -6.091 -0.025 -12.591 1.00 60.45 H new ATOM 1793 N VAL A 108 -6.006 3.977 -8.550 1.00 64.11 N ATOM 1794 CA VAL A 108 -6.165 5.411 -8.275 1.00 14.30 C ATOM 1795 C VAL A 108 -7.625 5.652 -7.883 1.00 62.23 C ATOM 1796 O VAL A 108 -8.547 5.482 -8.689 1.00 65.15 O ATOM 1797 CB VAL A 108 -5.726 6.347 -9.481 1.00 72.42 C ATOM 1798 CG1 VAL A 108 -4.184 6.450 -9.548 1.00 42.20 C ATOM 1799 CG2 VAL A 108 -6.307 5.871 -10.843 1.00 70.43 C ATOM 0 H VAL A 108 -6.095 3.725 -9.534 1.00 64.11 H new ATOM 0 HA VAL A 108 -5.493 5.682 -7.460 1.00 14.30 H new ATOM 0 HB VAL A 108 -6.140 7.337 -9.290 1.00 72.42 H new ATOM 0 HG11 VAL A 108 -3.898 7.095 -10.379 1.00 42.20 H new ATOM 0 HG12 VAL A 108 -3.807 6.871 -8.616 1.00 42.20 H new ATOM 0 HG13 VAL A 108 -3.759 5.457 -9.696 1.00 42.20 H new ATOM 0 HG21 VAL A 108 -5.977 6.544 -11.634 1.00 70.43 H new ATOM 0 HG22 VAL A 108 -5.955 4.861 -11.056 1.00 70.43 H new ATOM 0 HG23 VAL A 108 -7.396 5.873 -10.795 1.00 70.43 H new ATOM 1809 N THR A 109 -7.816 5.992 -6.610 1.00 73.11 N ATOM 1810 CA THR A 109 -9.127 6.328 -6.055 1.00 74.23 C ATOM 1811 C THR A 109 -9.519 7.751 -6.484 1.00 23.34 C ATOM 1812 O THR A 109 -10.685 8.032 -6.768 1.00 62.51 O ATOM 1813 CB THR A 109 -9.084 6.229 -4.508 1.00 21.32 C ATOM 1814 OG1 THR A 109 -8.688 4.905 -4.122 1.00 11.24 O ATOM 1815 CG2 THR A 109 -10.435 6.562 -3.884 1.00 13.45 C ATOM 0 H THR A 109 -7.059 6.043 -5.928 1.00 73.11 H new ATOM 0 HA THR A 109 -9.870 5.625 -6.432 1.00 74.23 H new ATOM 0 HB THR A 109 -8.359 6.957 -4.145 1.00 21.32 H new ATOM 0 HG1 THR A 109 -8.659 4.844 -3.144 1.00 11.24 H new ATOM 0 HG21 THR A 109 -10.364 6.482 -2.799 1.00 13.45 H new ATOM 0 HG22 THR A 109 -10.720 7.579 -4.155 1.00 13.45 H new ATOM 0 HG23 THR A 109 -11.187 5.864 -4.251 1.00 13.45 H new ATOM 1823 N ASP A 110 -8.494 8.623 -6.498 1.00 73.30 N ATOM 1824 CA ASP A 110 -8.588 10.052 -6.868 1.00 13.54 C ATOM 1825 C ASP A 110 -9.303 10.901 -5.776 1.00 74.11 C ATOM 1826 O ASP A 110 -9.516 12.095 -5.963 1.00 20.31 O ATOM 1827 CB ASP A 110 -9.201 10.257 -8.302 1.00 51.54 C ATOM 1828 CG ASP A 110 -9.014 11.686 -8.875 1.00 23.51 C ATOM 1829 OD1 ASP A 110 -7.857 12.085 -9.131 1.00 24.41 O ATOM 1830 OD2 ASP A 110 -10.017 12.411 -9.075 1.00 33.21 O ATOM 0 H ASP A 110 -7.546 8.346 -6.244 1.00 73.30 H new ATOM 0 HA ASP A 110 -7.567 10.430 -6.920 1.00 13.54 H new ATOM 0 HB2 ASP A 110 -8.745 9.541 -8.986 1.00 51.54 H new ATOM 0 HB3 ASP A 110 -10.266 10.029 -8.266 1.00 51.54 H new ATOM 1835 N ASN A 111 -9.625 10.283 -4.613 1.00 14.32 N ATOM 1836 CA ASN A 111 -10.180 10.980 -3.427 1.00 34.05 C ATOM 1837 C ASN A 111 -9.764 10.246 -2.155 1.00 54.31 C ATOM 1838 O ASN A 111 -9.318 9.098 -2.205 1.00 35.42 O ATOM 1839 CB ASN A 111 -11.733 11.096 -3.478 1.00 1.22 C ATOM 1840 CG ASN A 111 -12.227 12.131 -4.488 1.00 24.32 C ATOM 1841 OD1 ASN A 111 -12.598 11.802 -5.615 1.00 0.55 O ATOM 1842 ND2 ASN A 111 -12.181 13.396 -4.103 1.00 71.41 N ATOM 0 H ASN A 111 -9.506 9.280 -4.471 1.00 14.32 H new ATOM 0 HA ASN A 111 -9.776 11.992 -3.428 1.00 34.05 H new ATOM 0 HB2 ASN A 111 -12.155 10.123 -3.729 1.00 1.22 H new ATOM 0 HB3 ASN A 111 -12.104 11.359 -2.487 1.00 1.22 H new ATOM 0 HD21 ASN A 111 -12.458 14.136 -4.748 1.00 71.41 H new ATOM 0 HD22 ASN A 111 -11.868 13.631 -3.161 1.00 71.41 H new ATOM 1849 N GLU A 112 -9.915 10.944 -1.022 1.00 34.41 N ATOM 1850 CA GLU A 112 -9.623 10.410 0.325 1.00 4.41 C ATOM 1851 C GLU A 112 -10.877 9.745 0.923 1.00 22.33 C ATOM 1852 O GLU A 112 -10.773 8.719 1.613 1.00 74.14 O ATOM 1853 CB GLU A 112 -9.125 11.539 1.272 1.00 13.14 C ATOM 1854 CG GLU A 112 -7.924 12.368 0.740 1.00 42.22 C ATOM 1855 CD GLU A 112 -8.296 13.478 -0.258 1.00 71.21 C ATOM 1856 OE1 GLU A 112 -9.035 14.409 0.129 1.00 74.21 O ATOM 1857 OE2 GLU A 112 -7.829 13.447 -1.411 1.00 64.42 O ATOM 0 H GLU A 112 -10.247 11.908 -1.009 1.00 34.41 H new ATOM 0 HA GLU A 112 -8.835 9.663 0.227 1.00 4.41 H new ATOM 0 HB2 GLU A 112 -9.955 12.218 1.470 1.00 13.14 H new ATOM 0 HB3 GLU A 112 -8.844 11.093 2.226 1.00 13.14 H new ATOM 0 HG2 GLU A 112 -7.409 12.819 1.588 1.00 42.22 H new ATOM 0 HG3 GLU A 112 -7.217 11.691 0.261 1.00 42.22 H new ATOM 1864 N ASP A 113 -12.060 10.352 0.640 1.00 25.11 N ATOM 1865 CA ASP A 113 -13.377 9.879 1.134 1.00 73.41 C ATOM 1866 C ASP A 113 -13.671 8.447 0.657 1.00 73.04 C ATOM 1867 O ASP A 113 -14.098 7.591 1.441 1.00 35.55 O ATOM 1868 CB ASP A 113 -14.518 10.828 0.652 1.00 54.11 C ATOM 1869 CG ASP A 113 -14.380 12.277 1.157 1.00 43.41 C ATOM 1870 OD1 ASP A 113 -14.338 12.478 2.379 1.00 32.31 O ATOM 1871 OD2 ASP A 113 -14.336 13.218 0.338 1.00 71.53 O ATOM 0 H ASP A 113 -12.125 11.188 0.059 1.00 25.11 H new ATOM 0 HA ASP A 113 -13.337 9.884 2.223 1.00 73.41 H new ATOM 0 HB2 ASP A 113 -14.536 10.834 -0.438 1.00 54.11 H new ATOM 0 HB3 ASP A 113 -15.475 10.427 0.985 1.00 54.11 H new ATOM 1876 N GLU A 114 -13.448 8.214 -0.641 1.00 4.22 N ATOM 1877 CA GLU A 114 -13.645 6.897 -1.258 1.00 2.41 C ATOM 1878 C GLU A 114 -12.477 5.939 -0.916 1.00 33.02 C ATOM 1879 O GLU A 114 -12.680 4.729 -0.876 1.00 34.51 O ATOM 1880 CB GLU A 114 -13.832 7.024 -2.797 1.00 20.41 C ATOM 1881 CG GLU A 114 -14.098 5.669 -3.504 1.00 14.32 C ATOM 1882 CD GLU A 114 -14.209 5.772 -5.027 1.00 0.22 C ATOM 1883 OE1 GLU A 114 -13.157 5.805 -5.700 1.00 32.30 O ATOM 1884 OE2 GLU A 114 -15.339 5.790 -5.559 1.00 30.31 O ATOM 0 H GLU A 114 -13.127 8.931 -1.292 1.00 4.22 H new ATOM 0 HA GLU A 114 -14.558 6.469 -0.844 1.00 2.41 H new ATOM 0 HB2 GLU A 114 -14.664 7.699 -2.999 1.00 20.41 H new ATOM 0 HB3 GLU A 114 -12.940 7.480 -3.227 1.00 20.41 H new ATOM 0 HG2 GLU A 114 -13.294 4.977 -3.255 1.00 14.32 H new ATOM 0 HG3 GLU A 114 -15.020 5.241 -3.111 1.00 14.32 H new ATOM 1891 N ALA A 115 -11.260 6.493 -0.684 1.00 52.52 N ATOM 1892 CA ALA A 115 -10.033 5.687 -0.435 1.00 1.31 C ATOM 1893 C ALA A 115 -10.204 4.740 0.745 1.00 41.53 C ATOM 1894 O ALA A 115 -9.942 3.542 0.628 1.00 41.15 O ATOM 1895 CB ALA A 115 -8.824 6.599 -0.210 1.00 33.30 C ATOM 0 H ALA A 115 -11.100 7.500 -0.664 1.00 52.52 H new ATOM 0 HA ALA A 115 -9.860 5.080 -1.324 1.00 1.31 H new ATOM 0 HB1 ALA A 115 -7.938 5.991 -0.030 1.00 33.30 H new ATOM 0 HB2 ALA A 115 -8.666 7.218 -1.093 1.00 33.30 H new ATOM 0 HB3 ALA A 115 -9.007 7.239 0.653 1.00 33.30 H new ATOM 1901 N LYS A 116 -10.688 5.287 1.865 1.00 73.53 N ATOM 1902 CA LYS A 116 -10.935 4.514 3.087 1.00 71.22 C ATOM 1903 C LYS A 116 -12.028 3.451 2.881 1.00 31.32 C ATOM 1904 O LYS A 116 -11.928 2.337 3.415 1.00 53.24 O ATOM 1905 CB LYS A 116 -11.292 5.468 4.247 1.00 3.21 C ATOM 1906 CG LYS A 116 -12.477 6.413 3.986 1.00 34.42 C ATOM 1907 CD LYS A 116 -12.687 7.401 5.149 1.00 11.33 C ATOM 1908 CE LYS A 116 -13.839 8.376 4.894 1.00 21.13 C ATOM 1909 NZ LYS A 116 -13.998 9.320 6.025 1.00 3.32 N ATOM 0 H LYS A 116 -10.919 6.277 1.950 1.00 73.53 H new ATOM 0 HA LYS A 116 -10.021 3.977 3.342 1.00 71.22 H new ATOM 0 HB2 LYS A 116 -11.514 4.870 5.131 1.00 3.21 H new ATOM 0 HB3 LYS A 116 -10.414 6.070 4.482 1.00 3.21 H new ATOM 0 HG2 LYS A 116 -12.303 6.968 3.064 1.00 34.42 H new ATOM 0 HG3 LYS A 116 -13.384 5.827 3.839 1.00 34.42 H new ATOM 0 HD2 LYS A 116 -12.885 6.842 6.064 1.00 11.33 H new ATOM 0 HD3 LYS A 116 -11.768 7.965 5.312 1.00 11.33 H new ATOM 0 HE2 LYS A 116 -13.652 8.932 3.975 1.00 21.13 H new ATOM 0 HE3 LYS A 116 -14.765 7.820 4.747 1.00 21.13 H new ATOM 0 HZ1 LYS A 116 -14.571 10.133 5.721 1.00 3.32 H new ATOM 0 HZ2 LYS A 116 -14.473 8.838 6.815 1.00 3.32 H new ATOM 0 HZ3 LYS A 116 -13.062 9.652 6.334 1.00 3.32 H new ATOM 1923 N LYS A 117 -13.054 3.803 2.077 1.00 32.35 N ATOM 1924 CA LYS A 117 -14.143 2.875 1.712 1.00 22.42 C ATOM 1925 C LYS A 117 -13.595 1.689 0.906 1.00 71.13 C ATOM 1926 O LYS A 117 -13.931 0.533 1.176 1.00 21.41 O ATOM 1927 CB LYS A 117 -15.238 3.604 0.899 1.00 70.52 C ATOM 1928 CG LYS A 117 -16.020 4.679 1.676 1.00 10.45 C ATOM 1929 CD LYS A 117 -17.104 5.393 0.815 1.00 74.33 C ATOM 1930 CE LYS A 117 -18.244 4.466 0.312 1.00 45.41 C ATOM 1931 NZ LYS A 117 -17.825 3.529 -0.781 1.00 55.43 N ATOM 0 H LYS A 117 -13.150 4.732 1.666 1.00 32.35 H new ATOM 0 HA LYS A 117 -14.586 2.499 2.634 1.00 22.42 H new ATOM 0 HB2 LYS A 117 -14.774 4.071 0.030 1.00 70.52 H new ATOM 0 HB3 LYS A 117 -15.944 2.863 0.523 1.00 70.52 H new ATOM 0 HG2 LYS A 117 -16.498 4.218 2.540 1.00 10.45 H new ATOM 0 HG3 LYS A 117 -15.321 5.423 2.058 1.00 10.45 H new ATOM 0 HD2 LYS A 117 -17.542 6.200 1.402 1.00 74.33 H new ATOM 0 HD3 LYS A 117 -16.620 5.852 -0.047 1.00 74.33 H new ATOM 0 HE2 LYS A 117 -18.623 3.883 1.152 1.00 45.41 H new ATOM 0 HE3 LYS A 117 -19.069 5.082 -0.047 1.00 45.41 H new ATOM 0 HZ1 LYS A 117 -18.554 3.512 -1.522 1.00 55.43 H new ATOM 0 HZ2 LYS A 117 -16.924 3.852 -1.188 1.00 55.43 H new ATOM 0 HZ3 LYS A 117 -17.706 2.572 -0.391 1.00 55.43 H new ATOM 1945 N ARG A 118 -12.704 2.025 -0.054 1.00 54.22 N ATOM 1946 CA ARG A 118 -12.054 1.076 -0.968 1.00 3.31 C ATOM 1947 C ARG A 118 -11.296 0.012 -0.154 1.00 72.14 C ATOM 1948 O ARG A 118 -11.460 -1.183 -0.380 1.00 35.55 O ATOM 1949 CB ARG A 118 -11.059 1.850 -1.897 1.00 3.24 C ATOM 1950 CG ARG A 118 -10.407 1.003 -3.022 1.00 22.52 C ATOM 1951 CD ARG A 118 -11.322 0.803 -4.243 1.00 60.11 C ATOM 1952 NE ARG A 118 -11.585 2.085 -4.946 1.00 24.43 N ATOM 1953 CZ ARG A 118 -11.295 2.355 -6.234 1.00 72.31 C ATOM 1954 NH1 ARG A 118 -10.728 1.445 -7.022 1.00 53.13 N ATOM 1955 NH2 ARG A 118 -11.584 3.547 -6.727 1.00 34.44 N ATOM 0 H ARG A 118 -12.414 2.990 -0.213 1.00 54.22 H new ATOM 0 HA ARG A 118 -12.808 0.582 -1.581 1.00 3.31 H new ATOM 0 HB2 ARG A 118 -11.590 2.685 -2.355 1.00 3.24 H new ATOM 0 HB3 ARG A 118 -10.268 2.275 -1.280 1.00 3.24 H new ATOM 0 HG2 ARG A 118 -9.485 1.487 -3.343 1.00 22.52 H new ATOM 0 HG3 ARG A 118 -10.132 0.028 -2.620 1.00 22.52 H new ATOM 0 HD2 ARG A 118 -10.859 0.097 -4.933 1.00 60.11 H new ATOM 0 HD3 ARG A 118 -12.266 0.363 -3.922 1.00 60.11 H new ATOM 0 HE ARG A 118 -12.025 2.829 -4.404 1.00 24.43 H new ATOM 0 HH11 ARG A 118 -10.504 0.520 -6.654 1.00 53.13 H new ATOM 0 HH12 ARG A 118 -10.518 1.672 -7.994 1.00 53.13 H new ATOM 0 HH21 ARG A 118 -12.022 4.252 -6.134 1.00 34.44 H new ATOM 0 HH22 ARG A 118 -11.369 3.762 -7.701 1.00 34.44 H new ATOM 1969 N LEU A 119 -10.523 0.499 0.842 1.00 72.35 N ATOM 1970 CA LEU A 119 -9.679 -0.327 1.726 1.00 11.33 C ATOM 1971 C LEU A 119 -10.496 -1.420 2.437 1.00 41.41 C ATOM 1972 O LEU A 119 -10.181 -2.608 2.336 1.00 5.33 O ATOM 1973 CB LEU A 119 -8.994 0.583 2.783 1.00 72.54 C ATOM 1974 CG LEU A 119 -8.014 1.651 2.221 1.00 65.52 C ATOM 1975 CD1 LEU A 119 -7.467 2.565 3.334 1.00 5.10 C ATOM 1976 CD2 LEU A 119 -6.877 0.984 1.442 1.00 54.55 C ATOM 0 H LEU A 119 -10.469 1.495 1.056 1.00 72.35 H new ATOM 0 HA LEU A 119 -8.928 -0.821 1.110 1.00 11.33 H new ATOM 0 HB2 LEU A 119 -9.770 1.093 3.353 1.00 72.54 H new ATOM 0 HB3 LEU A 119 -8.449 -0.051 3.482 1.00 72.54 H new ATOM 0 HG LEU A 119 -8.573 2.285 1.533 1.00 65.52 H new ATOM 0 HD11 LEU A 119 -6.786 3.298 2.901 1.00 5.10 H new ATOM 0 HD12 LEU A 119 -8.295 3.082 3.820 1.00 5.10 H new ATOM 0 HD13 LEU A 119 -6.933 1.963 4.069 1.00 5.10 H new ATOM 0 HD21 LEU A 119 -6.202 1.749 1.057 1.00 54.55 H new ATOM 0 HD22 LEU A 119 -6.327 0.314 2.103 1.00 54.55 H new ATOM 0 HD23 LEU A 119 -7.291 0.414 0.611 1.00 54.55 H new ATOM 1988 N LYS A 120 -11.571 -0.986 3.113 1.00 62.23 N ATOM 1989 CA LYS A 120 -12.427 -1.869 3.922 1.00 5.23 C ATOM 1990 C LYS A 120 -13.192 -2.860 3.011 1.00 5.24 C ATOM 1991 O LYS A 120 -13.366 -4.035 3.360 1.00 43.14 O ATOM 1992 CB LYS A 120 -13.405 -1.000 4.783 1.00 34.34 C ATOM 1993 CG LYS A 120 -13.982 -1.710 6.055 1.00 3.23 C ATOM 1994 CD LYS A 120 -15.526 -1.874 6.080 1.00 12.32 C ATOM 1995 CE LYS A 120 -16.073 -2.713 4.914 1.00 23.20 C ATOM 1996 NZ LYS A 120 -17.509 -3.050 5.090 1.00 33.40 N ATOM 0 H LYS A 120 -11.872 -0.011 3.114 1.00 62.23 H new ATOM 0 HA LYS A 120 -11.810 -2.461 4.598 1.00 5.23 H new ATOM 0 HB2 LYS A 120 -12.883 -0.096 5.096 1.00 34.34 H new ATOM 0 HB3 LYS A 120 -14.237 -0.685 4.153 1.00 34.34 H new ATOM 0 HG2 LYS A 120 -13.527 -2.697 6.138 1.00 3.23 H new ATOM 0 HG3 LYS A 120 -13.679 -1.144 6.936 1.00 3.23 H new ATOM 0 HD2 LYS A 120 -15.819 -2.340 7.021 1.00 12.32 H new ATOM 0 HD3 LYS A 120 -15.989 -0.887 6.055 1.00 12.32 H new ATOM 0 HE2 LYS A 120 -15.942 -2.164 3.981 1.00 23.20 H new ATOM 0 HE3 LYS A 120 -15.494 -3.632 4.827 1.00 23.20 H new ATOM 0 HZ1 LYS A 120 -17.778 -3.788 4.409 1.00 33.40 H new ATOM 0 HZ2 LYS A 120 -17.668 -3.397 6.057 1.00 33.40 H new ATOM 0 HZ3 LYS A 120 -18.087 -2.201 4.927 1.00 33.40 H new ATOM 2010 N GLU A 121 -13.621 -2.365 1.828 1.00 74.10 N ATOM 2011 CA GLU A 121 -14.338 -3.164 0.806 1.00 12.33 C ATOM 2012 C GLU A 121 -13.435 -4.244 0.179 1.00 34.43 C ATOM 2013 O GLU A 121 -13.923 -5.294 -0.259 1.00 53.14 O ATOM 2014 CB GLU A 121 -14.969 -2.248 -0.277 1.00 63.11 C ATOM 2015 CG GLU A 121 -16.200 -1.473 0.236 1.00 51.43 C ATOM 2016 CD GLU A 121 -16.809 -0.514 -0.799 1.00 52.12 C ATOM 2017 OE1 GLU A 121 -17.385 -1.000 -1.800 1.00 35.15 O ATOM 2018 OE2 GLU A 121 -16.720 0.728 -0.617 1.00 4.11 O ATOM 0 H GLU A 121 -13.479 -1.393 1.553 1.00 74.10 H new ATOM 0 HA GLU A 121 -15.149 -3.687 1.313 1.00 12.33 H new ATOM 0 HB2 GLU A 121 -14.219 -1.539 -0.627 1.00 63.11 H new ATOM 0 HB3 GLU A 121 -15.259 -2.855 -1.135 1.00 63.11 H new ATOM 0 HG2 GLU A 121 -16.962 -2.187 0.548 1.00 51.43 H new ATOM 0 HG3 GLU A 121 -15.916 -0.904 1.121 1.00 51.43 H new ATOM 2025 N LEU A 122 -12.126 -3.966 0.122 1.00 1.51 N ATOM 2026 CA LEU A 122 -11.127 -4.937 -0.343 1.00 32.22 C ATOM 2027 C LEU A 122 -10.846 -5.996 0.749 1.00 72.54 C ATOM 2028 O LEU A 122 -10.597 -7.153 0.427 1.00 25.44 O ATOM 2029 CB LEU A 122 -9.836 -4.205 -0.812 1.00 42.33 C ATOM 2030 CG LEU A 122 -9.994 -3.315 -2.104 1.00 64.24 C ATOM 2031 CD1 LEU A 122 -8.645 -2.707 -2.533 1.00 22.30 C ATOM 2032 CD2 LEU A 122 -10.647 -4.094 -3.279 1.00 35.31 C ATOM 0 H LEU A 122 -11.731 -3.066 0.395 1.00 1.51 H new ATOM 0 HA LEU A 122 -11.523 -5.472 -1.206 1.00 32.22 H new ATOM 0 HB2 LEU A 122 -9.481 -3.573 0.002 1.00 42.33 H new ATOM 0 HB3 LEU A 122 -9.063 -4.951 -0.998 1.00 42.33 H new ATOM 0 HG LEU A 122 -10.669 -2.500 -1.842 1.00 64.24 H new ATOM 0 HD11 LEU A 122 -8.788 -2.099 -3.426 1.00 22.30 H new ATOM 0 HD12 LEU A 122 -8.255 -2.084 -1.728 1.00 22.30 H new ATOM 0 HD13 LEU A 122 -7.937 -3.507 -2.748 1.00 22.30 H new ATOM 0 HD21 LEU A 122 -10.734 -3.439 -4.146 1.00 35.31 H new ATOM 0 HD22 LEU A 122 -10.027 -4.953 -3.535 1.00 35.31 H new ATOM 0 HD23 LEU A 122 -11.638 -4.437 -2.982 1.00 35.31 H new ATOM 2044 N LEU A 123 -10.938 -5.598 2.042 1.00 4.43 N ATOM 2045 CA LEU A 123 -10.806 -6.535 3.199 1.00 24.43 C ATOM 2046 C LEU A 123 -12.017 -7.494 3.317 1.00 44.43 C ATOM 2047 O LEU A 123 -11.904 -8.555 3.947 1.00 74.25 O ATOM 2048 CB LEU A 123 -10.575 -5.765 4.551 1.00 74.13 C ATOM 2049 CG LEU A 123 -9.080 -5.539 4.986 1.00 75.55 C ATOM 2050 CD1 LEU A 123 -8.321 -4.591 4.031 1.00 60.34 C ATOM 2051 CD2 LEU A 123 -9.010 -5.049 6.452 1.00 42.22 C ATOM 0 H LEU A 123 -11.104 -4.630 2.317 1.00 4.43 H new ATOM 0 HA LEU A 123 -9.923 -7.143 3.002 1.00 24.43 H new ATOM 0 HB2 LEU A 123 -11.059 -4.791 4.475 1.00 74.13 H new ATOM 0 HB3 LEU A 123 -11.082 -6.312 5.346 1.00 74.13 H new ATOM 0 HG LEU A 123 -8.574 -6.502 4.921 1.00 75.55 H new ATOM 0 HD11 LEU A 123 -7.295 -4.470 4.378 1.00 60.34 H new ATOM 0 HD12 LEU A 123 -8.317 -5.014 3.026 1.00 60.34 H new ATOM 0 HD13 LEU A 123 -8.815 -3.620 4.014 1.00 60.34 H new ATOM 0 HD21 LEU A 123 -7.968 -4.898 6.736 1.00 42.22 H new ATOM 0 HD22 LEU A 123 -9.552 -4.108 6.547 1.00 42.22 H new ATOM 0 HD23 LEU A 123 -9.460 -5.795 7.107 1.00 42.22 H new ATOM 2063 N GLU A 124 -13.168 -7.108 2.716 1.00 11.14 N ATOM 2064 CA GLU A 124 -14.371 -7.980 2.632 1.00 12.34 C ATOM 2065 C GLU A 124 -14.049 -9.315 1.920 1.00 22.32 C ATOM 2066 O GLU A 124 -14.666 -10.350 2.204 1.00 3.14 O ATOM 2067 CB GLU A 124 -15.524 -7.254 1.877 1.00 42.34 C ATOM 2068 CG GLU A 124 -15.979 -5.912 2.491 1.00 31.45 C ATOM 2069 CD GLU A 124 -16.731 -6.027 3.834 1.00 41.32 C ATOM 2070 OE1 GLU A 124 -16.097 -6.303 4.875 1.00 43.23 O ATOM 2071 OE2 GLU A 124 -17.959 -5.791 3.861 1.00 63.21 O ATOM 0 H GLU A 124 -13.292 -6.194 2.279 1.00 11.14 H new ATOM 0 HA GLU A 124 -14.688 -8.197 3.652 1.00 12.34 H new ATOM 0 HB2 GLU A 124 -15.206 -7.074 0.850 1.00 42.34 H new ATOM 0 HB3 GLU A 124 -16.383 -7.923 1.832 1.00 42.34 H new ATOM 0 HG2 GLU A 124 -15.102 -5.281 2.636 1.00 31.45 H new ATOM 0 HG3 GLU A 124 -16.623 -5.402 1.774 1.00 31.45 H new ATOM 2078 N LYS A 125 -13.050 -9.270 1.015 1.00 54.31 N ATOM 2079 CA LYS A 125 -12.661 -10.408 0.174 1.00 53.20 C ATOM 2080 C LYS A 125 -11.146 -10.684 0.310 1.00 54.31 C ATOM 2081 O LYS A 125 -10.751 -11.641 0.974 1.00 14.12 O ATOM 2082 CB LYS A 125 -13.060 -10.106 -1.294 1.00 35.11 C ATOM 2083 CG LYS A 125 -12.838 -11.270 -2.288 1.00 4.31 C ATOM 2084 CD LYS A 125 -13.263 -10.903 -3.727 1.00 13.41 C ATOM 2085 CE LYS A 125 -14.753 -10.522 -3.827 1.00 2.34 C ATOM 2086 NZ LYS A 125 -15.121 -10.078 -5.192 1.00 3.53 N ATOM 0 H LYS A 125 -12.490 -8.434 0.850 1.00 54.31 H new ATOM 0 HA LYS A 125 -13.182 -11.309 0.499 1.00 53.20 H new ATOM 0 HB2 LYS A 125 -14.113 -9.825 -1.317 1.00 35.11 H new ATOM 0 HB3 LYS A 125 -12.492 -9.242 -1.638 1.00 35.11 H new ATOM 0 HG2 LYS A 125 -11.785 -11.552 -2.284 1.00 4.31 H new ATOM 0 HG3 LYS A 125 -13.403 -12.141 -1.956 1.00 4.31 H new ATOM 0 HD2 LYS A 125 -12.655 -10.070 -4.080 1.00 13.41 H new ATOM 0 HD3 LYS A 125 -13.063 -11.747 -4.387 1.00 13.41 H new ATOM 0 HE2 LYS A 125 -15.366 -11.379 -3.547 1.00 2.34 H new ATOM 0 HE3 LYS A 125 -14.972 -9.726 -3.115 1.00 2.34 H new ATOM 0 HZ1 LYS A 125 -16.131 -9.831 -5.216 1.00 3.53 H new ATOM 0 HZ2 LYS A 125 -14.555 -9.245 -5.451 1.00 3.53 H new ATOM 0 HZ3 LYS A 125 -14.936 -10.846 -5.869 1.00 3.53 H new ATOM 2100 N VAL A 126 -10.311 -9.809 -0.293 1.00 60.41 N ATOM 2101 CA VAL A 126 -8.843 -10.001 -0.338 1.00 71.52 C ATOM 2102 C VAL A 126 -8.116 -8.713 -0.802 1.00 5.24 C ATOM 2103 O VAL A 126 -7.066 -8.346 -0.252 1.00 40.32 O ATOM 2104 CB VAL A 126 -8.434 -11.213 -1.274 1.00 40.02 C ATOM 2105 CG1 VAL A 126 -8.932 -11.024 -2.732 1.00 52.24 C ATOM 2106 CG2 VAL A 126 -6.908 -11.461 -1.231 1.00 75.25 C ATOM 0 H VAL A 126 -10.630 -8.959 -0.758 1.00 60.41 H new ATOM 0 HA VAL A 126 -8.530 -10.233 0.680 1.00 71.52 H new ATOM 0 HB VAL A 126 -8.932 -12.100 -0.882 1.00 40.02 H new ATOM 0 HG11 VAL A 126 -8.627 -11.880 -3.334 1.00 52.24 H new ATOM 0 HG12 VAL A 126 -10.019 -10.945 -2.738 1.00 52.24 H new ATOM 0 HG13 VAL A 126 -8.500 -10.114 -3.149 1.00 52.24 H new ATOM 0 HG21 VAL A 126 -6.657 -12.298 -1.882 1.00 75.25 H new ATOM 0 HG22 VAL A 126 -6.384 -10.567 -1.570 1.00 75.25 H new ATOM 0 HG23 VAL A 126 -6.606 -11.693 -0.210 1.00 75.25 H new ATOM 2116 N GLY A 127 -8.696 -8.026 -1.808 1.00 21.01 N ATOM 2117 CA GLY A 127 -8.046 -6.880 -2.445 1.00 62.23 C ATOM 2118 C GLY A 127 -7.032 -7.309 -3.493 1.00 4.53 C ATOM 2119 O GLY A 127 -5.827 -7.376 -3.217 1.00 31.13 O ATOM 0 H GLY A 127 -9.614 -8.251 -2.191 1.00 21.01 H new ATOM 0 HA2 GLY A 127 -8.802 -6.247 -2.910 1.00 62.23 H new ATOM 0 HA3 GLY A 127 -7.549 -6.277 -1.685 1.00 62.23 H new ATOM 2123 N SER A 128 -7.530 -7.609 -4.706 1.00 60.31 N ATOM 2124 CA SER A 128 -6.699 -8.096 -5.820 1.00 40.33 C ATOM 2125 C SER A 128 -7.280 -7.668 -7.192 1.00 52.34 C ATOM 2126 O SER A 128 -6.781 -8.108 -8.233 1.00 24.34 O ATOM 2127 CB SER A 128 -6.569 -9.644 -5.722 1.00 32.22 C ATOM 2128 OG SER A 128 -5.694 -10.175 -6.713 1.00 22.20 O ATOM 0 H SER A 128 -8.519 -7.521 -4.941 1.00 60.31 H new ATOM 0 HA SER A 128 -5.709 -7.647 -5.744 1.00 40.33 H new ATOM 0 HB2 SER A 128 -6.200 -9.914 -4.732 1.00 32.22 H new ATOM 0 HB3 SER A 128 -7.555 -10.097 -5.830 1.00 32.22 H new ATOM 0 HG SER A 128 -5.848 -9.716 -7.565 1.00 22.20 H new ATOM 2134 N LEU A 129 -8.299 -6.776 -7.196 1.00 65.41 N ATOM 2135 CA LEU A 129 -8.990 -6.355 -8.443 1.00 54.13 C ATOM 2136 C LEU A 129 -9.878 -5.113 -8.190 1.00 4.22 C ATOM 2137 O LEU A 129 -10.218 -4.808 -7.037 1.00 64.52 O ATOM 2138 CB LEU A 129 -9.849 -7.536 -9.012 1.00 62.43 C ATOM 2139 CG LEU A 129 -10.513 -7.330 -10.420 1.00 1.22 C ATOM 2140 CD1 LEU A 129 -9.460 -7.010 -11.512 1.00 64.42 C ATOM 2141 CD2 LEU A 129 -11.371 -8.556 -10.813 1.00 34.14 C ATOM 0 H LEU A 129 -8.662 -6.333 -6.352 1.00 65.41 H new ATOM 0 HA LEU A 129 -8.233 -6.085 -9.179 1.00 54.13 H new ATOM 0 HB2 LEU A 129 -9.214 -8.420 -9.065 1.00 62.43 H new ATOM 0 HB3 LEU A 129 -10.640 -7.754 -8.295 1.00 62.43 H new ATOM 0 HG LEU A 129 -11.173 -6.466 -10.346 1.00 1.22 H new ATOM 0 HD11 LEU A 129 -9.960 -6.875 -12.471 1.00 64.42 H new ATOM 0 HD12 LEU A 129 -8.928 -6.096 -11.248 1.00 64.42 H new ATOM 0 HD13 LEU A 129 -8.751 -7.834 -11.586 1.00 64.42 H new ATOM 0 HD21 LEU A 129 -11.819 -8.387 -11.792 1.00 34.14 H new ATOM 0 HD22 LEU A 129 -10.740 -9.444 -10.851 1.00 34.14 H new ATOM 0 HD23 LEU A 129 -12.158 -8.701 -10.073 1.00 34.14 H new ATOM 2153 N GLU A 130 -10.203 -4.397 -9.293 1.00 53.41 N ATOM 2154 CA GLU A 130 -11.250 -3.352 -9.347 1.00 21.13 C ATOM 2155 C GLU A 130 -12.612 -3.864 -8.832 1.00 40.23 C ATOM 2156 O GLU A 130 -13.001 -5.010 -9.094 1.00 55.42 O ATOM 2157 CB GLU A 130 -11.411 -2.857 -10.822 1.00 24.00 C ATOM 2158 CG GLU A 130 -10.405 -1.770 -11.255 1.00 22.31 C ATOM 2159 CD GLU A 130 -10.811 -0.344 -10.806 1.00 34.23 C ATOM 2160 OE1 GLU A 130 -10.779 -0.055 -9.589 1.00 64.21 O ATOM 2161 OE2 GLU A 130 -11.147 0.494 -11.673 1.00 64.40 O ATOM 0 H GLU A 130 -9.734 -4.534 -10.188 1.00 53.41 H new ATOM 0 HA GLU A 130 -10.935 -2.535 -8.698 1.00 21.13 H new ATOM 0 HB2 GLU A 130 -11.310 -3.712 -11.490 1.00 24.00 H new ATOM 0 HB3 GLU A 130 -12.421 -2.469 -10.952 1.00 24.00 H new ATOM 0 HG2 GLU A 130 -9.424 -2.008 -10.843 1.00 22.31 H new ATOM 0 HG3 GLU A 130 -10.307 -1.787 -12.340 1.00 22.31 H new ATOM 2168 N HIS A 131 -13.334 -2.984 -8.126 1.00 32.44 N ATOM 2169 CA HIS A 131 -14.714 -3.252 -7.662 1.00 55.11 C ATOM 2170 C HIS A 131 -15.749 -2.566 -8.605 1.00 33.54 C ATOM 2171 O HIS A 131 -16.964 -2.647 -8.388 1.00 2.41 O ATOM 2172 CB HIS A 131 -14.856 -2.796 -6.177 1.00 52.35 C ATOM 2173 CG HIS A 131 -16.186 -3.111 -5.542 1.00 20.13 C ATOM 2174 ND1 HIS A 131 -16.626 -4.398 -5.320 1.00 3.41 N ATOM 2175 CD2 HIS A 131 -17.183 -2.302 -5.101 1.00 20.23 C ATOM 2176 CE1 HIS A 131 -17.825 -4.368 -4.791 1.00 1.20 C ATOM 2177 NE2 HIS A 131 -18.188 -3.112 -4.647 1.00 43.54 N ATOM 0 H HIS A 131 -12.984 -2.065 -7.857 1.00 32.44 H new ATOM 0 HA HIS A 131 -14.922 -4.321 -7.702 1.00 55.11 H new ATOM 0 HB2 HIS A 131 -14.068 -3.268 -5.590 1.00 52.35 H new ATOM 0 HB3 HIS A 131 -14.691 -1.720 -6.125 1.00 52.35 H new ATOM 0 HD2 HIS A 131 -17.183 -1.222 -5.107 1.00 20.23 H new ATOM 0 HE1 HIS A 131 -18.416 -5.230 -4.519 1.00 1.20 H new ATOM 0 HE2 HIS A 131 -19.076 -2.793 -4.259 1.00 43.54 H new ATOM 2186 N HIS A 132 -15.246 -1.913 -9.673 1.00 3.42 N ATOM 2187 CA HIS A 132 -16.082 -1.295 -10.728 1.00 1.40 C ATOM 2188 C HIS A 132 -15.430 -1.529 -12.101 1.00 23.12 C ATOM 2189 O HIS A 132 -14.198 -1.459 -12.231 1.00 14.44 O ATOM 2190 CB HIS A 132 -16.305 0.225 -10.459 1.00 51.21 C ATOM 2191 CG HIS A 132 -15.045 1.052 -10.345 1.00 41.21 C ATOM 2192 ND1 HIS A 132 -14.476 1.396 -9.138 1.00 72.00 N ATOM 2193 CD2 HIS A 132 -14.257 1.618 -11.291 1.00 60.31 C ATOM 2194 CE1 HIS A 132 -13.400 2.128 -9.351 1.00 51.20 C ATOM 2195 NE2 HIS A 132 -13.239 2.272 -10.645 1.00 54.31 N ATOM 0 H HIS A 132 -14.245 -1.798 -9.830 1.00 3.42 H new ATOM 0 HA HIS A 132 -17.065 -1.766 -10.719 1.00 1.40 H new ATOM 0 HB2 HIS A 132 -16.917 0.634 -11.263 1.00 51.21 H new ATOM 0 HB3 HIS A 132 -16.876 0.334 -9.537 1.00 51.21 H new ATOM 0 HD2 HIS A 132 -14.404 1.564 -12.360 1.00 60.31 H new ATOM 0 HE1 HIS A 132 -12.758 2.541 -8.587 1.00 51.20 H new ATOM 0 HE2 HIS A 132 -12.482 2.785 -11.096 1.00 54.31 H new ATOM 2204 N HIS A 133 -16.263 -1.828 -13.115 1.00 51.42 N ATOM 2205 CA HIS A 133 -15.806 -2.046 -14.494 1.00 50.13 C ATOM 2206 C HIS A 133 -15.455 -0.683 -15.116 1.00 62.44 C ATOM 2207 O HIS A 133 -16.345 0.069 -15.525 1.00 55.11 O ATOM 2208 CB HIS A 133 -16.894 -2.792 -15.317 1.00 15.43 C ATOM 2209 CG HIS A 133 -16.466 -3.222 -16.702 1.00 40.03 C ATOM 2210 ND1 HIS A 133 -17.300 -3.171 -17.798 1.00 21.13 N ATOM 2211 CD2 HIS A 133 -15.297 -3.744 -17.155 1.00 44.34 C ATOM 2212 CE1 HIS A 133 -16.668 -3.643 -18.854 1.00 14.53 C ATOM 2213 NE2 HIS A 133 -15.453 -3.993 -18.493 1.00 52.13 N ATOM 0 H HIS A 133 -17.272 -1.925 -12.998 1.00 51.42 H new ATOM 0 HA HIS A 133 -14.917 -2.676 -14.500 1.00 50.13 H new ATOM 0 HB2 HIS A 133 -17.208 -3.675 -14.760 1.00 15.43 H new ATOM 0 HB3 HIS A 133 -17.767 -2.145 -15.407 1.00 15.43 H new ATOM 0 HD2 HIS A 133 -14.409 -3.929 -16.569 1.00 44.34 H new ATOM 0 HE1 HIS A 133 -17.079 -3.728 -19.849 1.00 14.53 H new ATOM 0 HE2 HIS A 133 -14.742 -4.386 -19.109 1.00 52.13 H new ATOM 2222 N HIS A 134 -14.147 -0.383 -15.146 1.00 53.14 N ATOM 2223 CA HIS A 134 -13.608 0.944 -15.491 1.00 11.42 C ATOM 2224 C HIS A 134 -13.650 1.145 -17.023 1.00 63.42 C ATOM 2225 O HIS A 134 -12.702 0.787 -17.730 1.00 12.44 O ATOM 2226 CB HIS A 134 -12.157 1.060 -14.926 1.00 62.21 C ATOM 2227 CG HIS A 134 -11.629 2.457 -14.725 1.00 13.00 C ATOM 2228 ND1 HIS A 134 -10.874 2.800 -13.627 1.00 74.45 N ATOM 2229 CD2 HIS A 134 -11.724 3.586 -15.475 1.00 45.42 C ATOM 2230 CE1 HIS A 134 -10.520 4.062 -13.708 1.00 25.10 C ATOM 2231 NE2 HIS A 134 -11.023 4.565 -14.818 1.00 4.43 N ATOM 0 H HIS A 134 -13.422 -1.066 -14.928 1.00 53.14 H new ATOM 0 HA HIS A 134 -14.215 1.732 -15.044 1.00 11.42 H new ATOM 0 HB2 HIS A 134 -12.120 0.539 -13.969 1.00 62.21 H new ATOM 0 HB3 HIS A 134 -11.483 0.534 -15.602 1.00 62.21 H new ATOM 0 HD1 HIS A 134 -10.627 2.169 -12.865 1.00 74.45 H new ATOM 0 HD2 HIS A 134 -12.252 3.692 -16.411 1.00 45.42 H new ATOM 0 HE1 HIS A 134 -9.919 4.597 -12.988 1.00 25.10 H new ATOM 2240 N HIS A 135 -14.794 1.656 -17.522 1.00 45.45 N ATOM 2241 CA HIS A 135 -14.977 2.004 -18.944 1.00 44.43 C ATOM 2242 C HIS A 135 -14.236 3.328 -19.232 1.00 31.11 C ATOM 2243 O HIS A 135 -13.433 3.417 -20.168 1.00 45.11 O ATOM 2244 CB HIS A 135 -16.500 2.128 -19.290 1.00 23.23 C ATOM 2245 CG HIS A 135 -16.815 2.206 -20.771 1.00 64.01 C ATOM 2246 ND1 HIS A 135 -17.659 1.316 -21.406 1.00 60.10 N ATOM 2247 CD2 HIS A 135 -16.418 3.077 -21.731 1.00 44.14 C ATOM 2248 CE1 HIS A 135 -17.761 1.635 -22.682 1.00 65.15 C ATOM 2249 NE2 HIS A 135 -17.018 2.701 -22.903 1.00 64.34 N ATOM 0 H HIS A 135 -15.618 1.839 -16.949 1.00 45.45 H new ATOM 0 HA HIS A 135 -14.562 1.215 -19.571 1.00 44.43 H new ATOM 0 HB2 HIS A 135 -17.025 1.271 -18.867 1.00 23.23 H new ATOM 0 HB3 HIS A 135 -16.897 3.018 -18.802 1.00 23.23 H new ATOM 0 HD2 HIS A 135 -15.750 3.915 -21.596 1.00 44.14 H new ATOM 0 HE1 HIS A 135 -18.352 1.112 -23.419 1.00 65.15 H new ATOM 0 HE2 HIS A 135 -16.908 3.170 -23.802 1.00 64.34 H new ATOM 2258 N HIS A 136 -14.524 4.337 -18.394 1.00 2.24 N ATOM 2259 CA HIS A 136 -13.929 5.678 -18.476 1.00 1.31 C ATOM 2260 C HIS A 136 -14.066 6.362 -17.092 1.00 5.02 C ATOM 2261 O HIS A 136 -13.055 6.478 -16.373 1.00 33.41 O ATOM 2262 CB HIS A 136 -14.613 6.519 -19.598 1.00 51.14 C ATOM 2263 CG HIS A 136 -14.044 7.906 -19.760 1.00 53.05 C ATOM 2264 ND1 HIS A 136 -12.863 8.159 -20.429 1.00 52.55 N ATOM 2265 CD2 HIS A 136 -14.490 9.116 -19.333 1.00 22.15 C ATOM 2266 CE1 HIS A 136 -12.611 9.450 -20.401 1.00 34.53 C ATOM 2267 NE2 HIS A 136 -13.579 10.052 -19.746 1.00 22.11 N ATOM 2268 OXT HIS A 136 -15.198 6.729 -16.717 1.00 37.52 O ATOM 0 H HIS A 136 -15.189 4.240 -17.627 1.00 2.24 H new ATOM 0 HA HIS A 136 -12.873 5.601 -18.736 1.00 1.31 H new ATOM 0 HB2 HIS A 136 -14.520 5.987 -20.545 1.00 51.14 H new ATOM 0 HB3 HIS A 136 -15.678 6.598 -19.380 1.00 51.14 H new ATOM 0 HD2 HIS A 136 -15.394 9.305 -18.773 1.00 22.15 H new ATOM 0 HE1 HIS A 136 -11.752 9.934 -20.842 1.00 34.53 H new ATOM 0 HE2 HIS A 136 -13.642 11.055 -19.573 1.00 22.11 H new TER 2277 HIS A 136