USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 917 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 55 SER OG : rot -116:sc= 1.09 USER MOD Set 1.2: A 57 THR OG1 : rot 180:sc= 0.93 USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 CYS SG : rot 140:sc= -0.856! USER MOD Single : A 9 THR OG1 : rot -23:sc= 0.835 USER MOD Single : A -1 GLY N :NH3+ -106:sc= 0.166 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -0.994 K(o=-0.99,f=-2) USER MOD Single : A 17 SER OG : rot 180:sc= 0.176 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0126 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 GLN :FLIP amide:sc= -1.37 F(o=-2.8!,f=-1.4) USER MOD Single : A 29 MET CE :methyl -154:sc= -2.65! (180deg=-5.19!) USER MOD Single : A 32 THR OG1 : rot -89:sc= 0.0285 USER MOD Single : A 33 LYS NZ :NH3+ -171:sc=-0.000675 (180deg=-0.109) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 90:sc= 0.203 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 150:sc= 1.13 (180deg=1.01) USER MOD Single : A 48 LYS NZ :NH3+ 152:sc= 1.18 (180deg=0.674) USER MOD Single : A 49 GLN :FLIP amide:sc= -0.0074 F(o=-1.2,f=-0.0074) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 72:sc= 0.952 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 TYR OH : rot 130:sc= -0.375 USER MOD Single : A 68 GLN : amide:sc= -1.92! C(o=-1.9!,f=-6.8!) USER MOD Single : A 70 MET CE :methyl -163:sc= -0.183 (180deg=-0.678) USER MOD Single : A 72 LYS NZ :NH3+ 154:sc= 1.37 (180deg=0.439) USER MOD Single : A 73 ASN : amide:sc= -0.423 K(o=-0.42,f=-1.2) USER MOD Single : A 75 LYS NZ :NH3+ -176:sc= 1.1 (180deg=1.07) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 178:sc= 0 (180deg=-0.00269) USER MOD Single : A 83 LYS NZ :NH3+ 166:sc= 1.19 (180deg=0.886) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.00939 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.115 USER MOD Single : A 107 SER OG : rot -20:sc= 0.761 USER MOD Single : A 109 SER OG : rot 23:sc= 0.0756 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -7.945 -4.280 -30.459 1.00 33.43 N ATOM 2 CA GLY A -1 -6.588 -4.609 -30.029 1.00 13.01 C ATOM 3 C GLY A -1 -6.138 -3.679 -28.945 1.00 4.32 C ATOM 4 O GLY A -1 -6.784 -2.651 -28.719 1.00 63.03 O ATOM 0 H1 GLY A -1 -8.608 -4.992 -30.091 1.00 33.43 H new ATOM 0 H2 GLY A -1 -8.207 -3.342 -30.094 1.00 33.43 H new ATOM 0 H3 GLY A -1 -7.987 -4.272 -31.498 1.00 33.43 H new ATOM 0 HA2 GLY A -1 -6.554 -5.638 -29.670 1.00 13.01 H new ATOM 0 HA3 GLY A -1 -5.906 -4.544 -30.877 1.00 13.01 H new ATOM 10 N SER A 0 -5.035 -4.032 -28.282 1.00 43.54 N ATOM 11 CA SER A 0 -4.467 -3.268 -27.175 1.00 22.43 C ATOM 12 C SER A 0 -5.385 -3.297 -25.946 1.00 60.53 C ATOM 13 O SER A 0 -6.416 -2.618 -25.888 1.00 5.11 O ATOM 14 CB SER A 0 -4.112 -1.840 -27.601 1.00 52.52 C ATOM 15 OG SER A 0 -3.198 -1.860 -28.700 1.00 65.42 O ATOM 0 H SER A 0 -4.503 -4.873 -28.506 1.00 43.54 H new ATOM 0 HA SER A 0 -3.533 -3.750 -26.884 1.00 22.43 H new ATOM 0 HB2 SER A 0 -5.017 -1.302 -27.883 1.00 52.52 H new ATOM 0 HB3 SER A 0 -3.670 -1.303 -26.762 1.00 52.52 H new ATOM 0 HG SER A 0 -2.982 -0.941 -28.962 1.00 65.42 H new ATOM 21 N MET A 1 -5.008 -4.102 -24.986 1.00 54.41 N ATOM 22 CA MET A 1 -5.792 -4.292 -23.789 1.00 74.32 C ATOM 23 C MET A 1 -5.499 -3.231 -22.758 1.00 52.14 C ATOM 24 O MET A 1 -4.410 -3.186 -22.180 1.00 43.54 O ATOM 25 CB MET A 1 -5.551 -5.679 -23.187 1.00 75.41 C ATOM 26 CG MET A 1 -6.072 -6.842 -24.011 1.00 53.51 C ATOM 27 SD MET A 1 -7.869 -6.810 -24.187 1.00 33.03 S ATOM 28 CE MET A 1 -8.143 -8.312 -25.122 1.00 4.33 C ATOM 0 H MET A 1 -4.146 -4.647 -25.011 1.00 54.41 H new ATOM 0 HA MET A 1 -6.840 -4.209 -24.079 1.00 74.32 H new ATOM 0 HB2 MET A 1 -4.479 -5.811 -23.038 1.00 75.41 H new ATOM 0 HB3 MET A 1 -6.016 -5.716 -22.202 1.00 75.41 H new ATOM 0 HG2 MET A 1 -5.612 -6.818 -24.999 1.00 53.51 H new ATOM 0 HG3 MET A 1 -5.772 -7.779 -23.542 1.00 53.51 H new ATOM 0 HE1 MET A 1 -9.210 -8.433 -25.311 1.00 4.33 H new ATOM 0 HE2 MET A 1 -7.611 -8.252 -26.071 1.00 4.33 H new ATOM 0 HE3 MET A 1 -7.776 -9.167 -24.554 1.00 4.33 H new ATOM 38 N THR A 2 -6.450 -2.363 -22.550 1.00 23.43 N ATOM 39 CA THR A 2 -6.346 -1.385 -21.519 1.00 34.23 C ATOM 40 C THR A 2 -7.116 -1.916 -20.320 1.00 10.24 C ATOM 41 O THR A 2 -8.335 -2.119 -20.400 1.00 34.50 O ATOM 42 CB THR A 2 -6.976 -0.057 -21.968 1.00 24.11 C ATOM 43 OG1 THR A 2 -6.403 0.346 -23.229 1.00 62.54 O ATOM 44 CG2 THR A 2 -6.723 1.032 -20.933 1.00 3.31 C ATOM 0 H THR A 2 -7.313 -2.319 -23.092 1.00 23.43 H new ATOM 0 HA THR A 2 -5.299 -1.203 -21.278 1.00 34.23 H new ATOM 0 HB THR A 2 -8.051 -0.201 -22.076 1.00 24.11 H new ATOM 0 HG1 THR A 2 -6.806 1.192 -23.516 1.00 62.54 H new ATOM 0 HG21 THR A 2 -7.176 1.965 -21.268 1.00 3.31 H new ATOM 0 HG22 THR A 2 -7.162 0.737 -19.980 1.00 3.31 H new ATOM 0 HG23 THR A 2 -5.649 1.174 -20.809 1.00 3.31 H new ATOM 52 N VAL A 3 -6.433 -2.150 -19.233 1.00 72.04 N ATOM 53 CA VAL A 3 -7.077 -2.713 -18.074 1.00 42.45 C ATOM 54 C VAL A 3 -7.217 -1.641 -17.009 1.00 2.54 C ATOM 55 O VAL A 3 -6.307 -0.823 -16.818 1.00 44.31 O ATOM 56 CB VAL A 3 -6.270 -3.885 -17.474 1.00 65.23 C ATOM 57 CG1 VAL A 3 -7.059 -4.600 -16.443 1.00 20.10 C ATOM 58 CG2 VAL A 3 -5.781 -4.867 -18.502 1.00 64.43 C ATOM 0 H VAL A 3 -5.437 -1.962 -19.124 1.00 72.04 H new ATOM 0 HA VAL A 3 -8.050 -3.088 -18.391 1.00 42.45 H new ATOM 0 HB VAL A 3 -5.390 -3.431 -17.020 1.00 65.23 H new ATOM 0 HG11 VAL A 3 -6.468 -5.421 -16.037 1.00 20.10 H new ATOM 0 HG12 VAL A 3 -7.321 -3.909 -15.641 1.00 20.10 H new ATOM 0 HG13 VAL A 3 -7.970 -4.997 -16.892 1.00 20.10 H new ATOM 0 HG21 VAL A 3 -5.223 -5.663 -18.009 1.00 64.43 H new ATOM 0 HG22 VAL A 3 -6.633 -5.295 -19.030 1.00 64.43 H new ATOM 0 HG23 VAL A 3 -5.132 -4.356 -19.214 1.00 64.43 H new ATOM 68 N TYR A 4 -8.343 -1.623 -16.344 1.00 41.34 N ATOM 69 CA TYR A 4 -8.588 -0.682 -15.285 1.00 2.33 C ATOM 70 C TYR A 4 -8.600 -1.404 -13.933 1.00 5.14 C ATOM 71 O TYR A 4 -9.187 -2.484 -13.797 1.00 75.22 O ATOM 72 CB TYR A 4 -9.900 0.040 -15.544 1.00 42.50 C ATOM 73 CG TYR A 4 -9.914 0.790 -16.868 1.00 73.21 C ATOM 74 CD1 TYR A 4 -10.210 0.136 -18.057 1.00 33.44 C ATOM 75 CD2 TYR A 4 -9.632 2.138 -16.923 1.00 42.31 C ATOM 76 CE1 TYR A 4 -10.224 0.808 -19.251 1.00 71.40 C ATOM 77 CE2 TYR A 4 -9.644 2.823 -18.117 1.00 60.15 C ATOM 78 CZ TYR A 4 -9.940 2.153 -19.280 1.00 2.02 C ATOM 79 OH TYR A 4 -9.961 2.833 -20.480 1.00 25.34 O ATOM 0 H TYR A 4 -9.117 -2.263 -16.523 1.00 41.34 H new ATOM 0 HA TYR A 4 -7.789 0.059 -15.257 1.00 2.33 H new ATOM 0 HB2 TYR A 4 -10.715 -0.684 -15.534 1.00 42.50 H new ATOM 0 HB3 TYR A 4 -10.088 0.743 -14.732 1.00 42.50 H new ATOM 0 HD1 TYR A 4 -10.433 -0.921 -18.040 1.00 33.44 H new ATOM 0 HD2 TYR A 4 -9.397 2.667 -16.011 1.00 42.31 H new ATOM 0 HE1 TYR A 4 -10.457 0.283 -20.166 1.00 71.40 H new ATOM 0 HE2 TYR A 4 -9.422 3.880 -18.140 1.00 60.15 H new ATOM 0 HH TYR A 4 -9.739 3.775 -20.326 1.00 25.34 H new ATOM 89 N ILE A 5 -7.931 -0.824 -12.952 1.00 72.54 N ATOM 90 CA ILE A 5 -7.811 -1.426 -11.624 1.00 71.15 C ATOM 91 C ILE A 5 -8.429 -0.495 -10.582 1.00 13.14 C ATOM 92 O ILE A 5 -8.093 0.688 -10.522 1.00 2.20 O ATOM 93 CB ILE A 5 -6.309 -1.624 -11.149 1.00 24.41 C ATOM 94 CG1 ILE A 5 -5.393 -2.438 -12.094 1.00 74.54 C ATOM 95 CG2 ILE A 5 -6.269 -2.276 -9.768 1.00 43.30 C ATOM 96 CD1 ILE A 5 -5.182 -1.898 -13.501 1.00 54.02 C ATOM 0 H ILE A 5 -7.456 0.073 -13.047 1.00 72.54 H new ATOM 0 HA ILE A 5 -8.307 -2.393 -11.703 1.00 71.15 H new ATOM 0 HB ILE A 5 -5.908 -0.611 -11.142 1.00 24.41 H new ATOM 0 HG12 ILE A 5 -4.416 -2.531 -11.619 1.00 74.54 H new ATOM 0 HG13 ILE A 5 -5.804 -3.444 -12.177 1.00 74.54 H new ATOM 0 HG21 ILE A 5 -5.232 -2.405 -9.456 1.00 43.30 H new ATOM 0 HG22 ILE A 5 -6.787 -1.640 -9.050 1.00 43.30 H new ATOM 0 HG23 ILE A 5 -6.759 -3.249 -9.811 1.00 43.30 H new ATOM 0 HD11 ILE A 5 -4.520 -2.566 -14.052 1.00 54.02 H new ATOM 0 HD12 ILE A 5 -6.142 -1.834 -14.014 1.00 54.02 H new ATOM 0 HD13 ILE A 5 -4.733 -0.906 -13.447 1.00 54.02 H new ATOM 108 N CYS A 6 -9.334 -0.999 -9.818 1.00 74.13 N ATOM 109 CA CYS A 6 -9.819 -0.300 -8.673 1.00 15.50 C ATOM 110 C CYS A 6 -9.713 -1.202 -7.462 1.00 74.13 C ATOM 111 O CYS A 6 -10.555 -2.082 -7.267 1.00 14.24 O ATOM 112 CB CYS A 6 -11.232 0.218 -8.836 1.00 13.10 C ATOM 113 SG CYS A 6 -11.832 1.106 -7.385 1.00 20.01 S ATOM 0 H CYS A 6 -9.763 -1.912 -9.968 1.00 74.13 H new ATOM 0 HA CYS A 6 -9.196 0.585 -8.542 1.00 15.50 H new ATOM 0 HB2 CYS A 6 -11.273 0.879 -9.702 1.00 13.10 H new ATOM 0 HB3 CYS A 6 -11.898 -0.620 -9.043 1.00 13.10 H new ATOM 0 HG CYS A 6 -12.513 2.147 -7.764 1.00 20.01 H new ATOM 119 N PRO A 7 -8.666 -1.045 -6.646 1.00 13.15 N ATOM 120 CA PRO A 7 -8.479 -1.844 -5.421 1.00 1.25 C ATOM 121 C PRO A 7 -9.586 -1.627 -4.352 1.00 74.52 C ATOM 122 O PRO A 7 -9.520 -2.201 -3.259 1.00 34.12 O ATOM 123 CB PRO A 7 -7.124 -1.360 -4.878 1.00 13.40 C ATOM 124 CG PRO A 7 -6.445 -0.727 -6.041 1.00 64.50 C ATOM 125 CD PRO A 7 -7.536 -0.124 -6.869 1.00 22.04 C ATOM 0 HA PRO A 7 -8.524 -2.910 -5.646 1.00 1.25 H new ATOM 0 HB2 PRO A 7 -7.257 -0.648 -4.064 1.00 13.40 H new ATOM 0 HB3 PRO A 7 -6.538 -2.190 -4.483 1.00 13.40 H new ATOM 0 HG2 PRO A 7 -5.736 0.034 -5.714 1.00 64.50 H new ATOM 0 HG3 PRO A 7 -5.881 -1.463 -6.613 1.00 64.50 H new ATOM 0 HD2 PRO A 7 -7.773 0.891 -6.549 1.00 22.04 H new ATOM 0 HD3 PRO A 7 -7.261 -0.070 -7.922 1.00 22.04 H new ATOM 133 N GLU A 8 -10.583 -0.803 -4.656 1.00 65.32 N ATOM 134 CA GLU A 8 -11.658 -0.558 -3.715 1.00 45.40 C ATOM 135 C GLU A 8 -12.932 -1.239 -4.150 1.00 20.33 C ATOM 136 O GLU A 8 -13.354 -2.234 -3.568 1.00 10.30 O ATOM 137 CB GLU A 8 -11.949 0.928 -3.559 1.00 63.12 C ATOM 138 CG GLU A 8 -10.753 1.752 -3.252 1.00 42.25 C ATOM 139 CD GLU A 8 -11.110 3.161 -2.877 1.00 63.35 C ATOM 140 OE1 GLU A 8 -11.481 3.397 -1.714 1.00 3.41 O ATOM 141 OE2 GLU A 8 -11.031 4.061 -3.730 1.00 1.43 O ATOM 0 H GLU A 8 -10.665 -0.300 -5.539 1.00 65.32 H new ATOM 0 HA GLU A 8 -11.322 -0.964 -2.761 1.00 45.40 H new ATOM 0 HB2 GLU A 8 -12.404 1.296 -4.478 1.00 63.12 H new ATOM 0 HB3 GLU A 8 -12.683 1.062 -2.764 1.00 63.12 H new ATOM 0 HG2 GLU A 8 -10.198 1.291 -2.435 1.00 42.25 H new ATOM 0 HG3 GLU A 8 -10.092 1.766 -4.119 1.00 42.25 H new ATOM 148 N THR A 9 -13.522 -0.714 -5.190 1.00 51.41 N ATOM 149 CA THR A 9 -14.812 -1.158 -5.637 1.00 72.32 C ATOM 150 C THR A 9 -14.720 -2.074 -6.866 1.00 13.53 C ATOM 151 O THR A 9 -15.744 -2.479 -7.436 1.00 41.30 O ATOM 152 CB THR A 9 -15.746 0.068 -5.881 1.00 54.44 C ATOM 153 OG1 THR A 9 -17.029 -0.325 -6.383 1.00 23.12 O ATOM 154 CG2 THR A 9 -15.097 1.079 -6.814 1.00 65.11 C ATOM 0 H THR A 9 -13.119 0.036 -5.752 1.00 51.41 H new ATOM 0 HA THR A 9 -15.252 -1.768 -4.848 1.00 72.32 H new ATOM 0 HB THR A 9 -15.902 0.542 -4.912 1.00 54.44 H new ATOM 0 HG1 THR A 9 -16.958 -1.204 -6.811 1.00 23.12 H new ATOM 0 HG21 THR A 9 -15.772 1.921 -6.964 1.00 65.11 H new ATOM 0 HG22 THR A 9 -14.166 1.435 -6.374 1.00 65.11 H new ATOM 0 HG23 THR A 9 -14.887 0.606 -7.774 1.00 65.11 H new ATOM 162 N GLY A 10 -13.514 -2.409 -7.273 1.00 65.13 N ATOM 163 CA GLY A 10 -13.391 -3.361 -8.353 1.00 13.53 C ATOM 164 C GLY A 10 -13.101 -4.745 -7.805 1.00 50.25 C ATOM 165 O GLY A 10 -12.960 -4.920 -6.589 1.00 14.15 O ATOM 0 H GLY A 10 -12.638 -2.053 -6.890 1.00 65.13 H new ATOM 0 HA2 GLY A 10 -14.311 -3.379 -8.937 1.00 13.53 H new ATOM 0 HA3 GLY A 10 -12.591 -3.055 -9.027 1.00 13.53 H new ATOM 169 N ASP A 11 -12.965 -5.700 -8.668 1.00 63.20 N ATOM 170 CA ASP A 11 -12.867 -7.099 -8.279 1.00 4.21 C ATOM 171 C ASP A 11 -11.992 -7.829 -9.281 1.00 24.34 C ATOM 172 O ASP A 11 -12.039 -7.538 -10.470 1.00 23.50 O ATOM 173 CB ASP A 11 -14.282 -7.708 -8.257 1.00 60.52 C ATOM 174 CG ASP A 11 -14.325 -9.153 -7.829 1.00 71.32 C ATOM 175 OD1 ASP A 11 -14.144 -10.029 -8.670 1.00 44.24 O ATOM 176 OD2 ASP A 11 -14.571 -9.430 -6.644 1.00 64.33 O ATOM 0 H ASP A 11 -12.917 -5.546 -9.675 1.00 63.20 H new ATOM 0 HA ASP A 11 -12.423 -7.191 -7.288 1.00 4.21 H new ATOM 0 HB2 ASP A 11 -14.907 -7.122 -7.583 1.00 60.52 H new ATOM 0 HB3 ASP A 11 -14.718 -7.622 -9.252 1.00 60.52 H new ATOM 181 N ASP A 12 -11.176 -8.753 -8.807 1.00 40.34 N ATOM 182 CA ASP A 12 -10.233 -9.493 -9.687 1.00 72.10 C ATOM 183 C ASP A 12 -10.937 -10.524 -10.580 1.00 25.54 C ATOM 184 O ASP A 12 -10.323 -11.098 -11.479 1.00 4.31 O ATOM 185 CB ASP A 12 -9.119 -10.178 -8.882 1.00 35.14 C ATOM 186 CG ASP A 12 -9.621 -11.277 -7.974 1.00 32.15 C ATOM 187 OD1 ASP A 12 -10.038 -10.980 -6.842 1.00 54.24 O ATOM 188 OD2 ASP A 12 -9.585 -12.457 -8.380 1.00 45.32 O ATOM 0 H ASP A 12 -11.132 -9.022 -7.824 1.00 40.34 H new ATOM 0 HA ASP A 12 -9.787 -8.740 -10.336 1.00 72.10 H new ATOM 0 HB2 ASP A 12 -8.386 -10.595 -9.573 1.00 35.14 H new ATOM 0 HB3 ASP A 12 -8.602 -9.429 -8.282 1.00 35.14 H new ATOM 193 N GLY A 13 -12.204 -10.756 -10.341 1.00 71.43 N ATOM 194 CA GLY A 13 -12.953 -11.697 -11.144 1.00 25.44 C ATOM 195 C GLY A 13 -13.682 -11.005 -12.272 1.00 33.00 C ATOM 196 O GLY A 13 -14.472 -11.623 -12.986 1.00 4.43 O ATOM 0 H GLY A 13 -12.740 -10.308 -9.598 1.00 71.43 H new ATOM 0 HA2 GLY A 13 -12.276 -12.447 -11.553 1.00 25.44 H new ATOM 0 HA3 GLY A 13 -13.670 -12.224 -10.515 1.00 25.44 H new ATOM 200 N ASN A 14 -13.419 -9.722 -12.424 1.00 25.33 N ATOM 201 CA ASN A 14 -14.026 -8.930 -13.481 1.00 53.44 C ATOM 202 C ASN A 14 -13.247 -9.039 -14.785 1.00 14.43 C ATOM 203 O ASN A 14 -12.189 -9.681 -14.849 1.00 34.55 O ATOM 204 CB ASN A 14 -14.123 -7.452 -13.088 1.00 35.54 C ATOM 205 CG ASN A 14 -15.097 -7.161 -11.963 1.00 3.33 C ATOM 206 OD1 ASN A 14 -16.088 -7.859 -11.783 1.00 33.24 O ATOM 207 ND2 ASN A 14 -14.832 -6.120 -11.221 1.00 21.34 N ATOM 0 H ASN A 14 -12.782 -9.199 -11.823 1.00 25.33 H new ATOM 0 HA ASN A 14 -15.028 -9.333 -13.628 1.00 53.44 H new ATOM 0 HB2 ASN A 14 -13.133 -7.102 -12.794 1.00 35.54 H new ATOM 0 HB3 ASN A 14 -14.418 -6.875 -13.965 1.00 35.54 H new ATOM 0 HD21 ASN A 14 -15.460 -5.863 -10.460 1.00 21.34 H new ATOM 0 HD22 ASN A 14 -13.997 -5.564 -11.402 1.00 21.34 H new ATOM 214 N ASP A 15 -13.792 -8.404 -15.813 1.00 23.11 N ATOM 215 CA ASP A 15 -13.181 -8.320 -17.152 1.00 44.54 C ATOM 216 C ASP A 15 -12.005 -7.344 -17.137 1.00 71.41 C ATOM 217 O ASP A 15 -11.101 -7.411 -17.970 1.00 14.12 O ATOM 218 CB ASP A 15 -14.244 -7.821 -18.151 1.00 55.31 C ATOM 219 CG ASP A 15 -13.737 -7.672 -19.576 1.00 61.32 C ATOM 220 OD1 ASP A 15 -13.255 -6.579 -19.945 1.00 52.42 O ATOM 221 OD2 ASP A 15 -13.839 -8.648 -20.360 1.00 1.14 O ATOM 0 H ASP A 15 -14.688 -7.920 -15.749 1.00 23.11 H new ATOM 0 HA ASP A 15 -12.817 -9.305 -17.446 1.00 44.54 H new ATOM 0 HB2 ASP A 15 -15.085 -8.515 -18.147 1.00 55.31 H new ATOM 0 HB3 ASP A 15 -14.624 -6.858 -17.810 1.00 55.31 H new ATOM 226 N GLY A 16 -12.017 -6.469 -16.153 1.00 0.02 N ATOM 227 CA GLY A 16 -11.019 -5.448 -16.048 1.00 43.45 C ATOM 228 C GLY A 16 -11.270 -4.289 -16.964 1.00 53.35 C ATOM 229 O GLY A 16 -10.337 -3.696 -17.514 1.00 23.15 O ATOM 0 H GLY A 16 -12.718 -6.453 -15.412 1.00 0.02 H new ATOM 0 HA2 GLY A 16 -10.980 -5.090 -15.019 1.00 43.45 H new ATOM 0 HA3 GLY A 16 -10.043 -5.877 -16.273 1.00 43.45 H new ATOM 233 N SER A 17 -12.514 -3.969 -17.137 1.00 72.01 N ATOM 234 CA SER A 17 -12.908 -2.864 -17.941 1.00 54.04 C ATOM 235 C SER A 17 -13.003 -1.632 -17.051 1.00 52.01 C ATOM 236 O SER A 17 -12.716 -1.711 -15.859 1.00 65.34 O ATOM 237 CB SER A 17 -14.254 -3.178 -18.586 1.00 44.33 C ATOM 238 OG SER A 17 -15.239 -3.485 -17.603 1.00 41.42 O ATOM 0 H SER A 17 -13.292 -4.477 -16.716 1.00 72.01 H new ATOM 0 HA SER A 17 -12.182 -2.675 -18.731 1.00 54.04 H new ATOM 0 HB2 SER A 17 -14.583 -2.325 -19.180 1.00 44.33 H new ATOM 0 HB3 SER A 17 -14.145 -4.020 -19.270 1.00 44.33 H new ATOM 0 HG SER A 17 -16.092 -3.680 -18.044 1.00 41.42 H new ATOM 244 N GLU A 18 -13.390 -0.499 -17.605 1.00 13.02 N ATOM 245 CA GLU A 18 -13.548 0.677 -16.807 1.00 64.10 C ATOM 246 C GLU A 18 -14.760 0.503 -15.880 1.00 14.32 C ATOM 247 O GLU A 18 -14.756 0.952 -14.741 1.00 40.32 O ATOM 248 CB GLU A 18 -13.710 1.907 -17.702 1.00 14.31 C ATOM 249 CG GLU A 18 -13.853 3.193 -16.937 1.00 0.44 C ATOM 250 CD GLU A 18 -13.993 4.401 -17.824 1.00 55.04 C ATOM 251 OE1 GLU A 18 -15.059 4.577 -18.444 1.00 70.03 O ATOM 252 OE2 GLU A 18 -13.041 5.186 -17.927 1.00 52.43 O ATOM 0 H GLU A 18 -13.597 -0.379 -18.597 1.00 13.02 H new ATOM 0 HA GLU A 18 -12.658 0.826 -16.195 1.00 64.10 H new ATOM 0 HB2 GLU A 18 -12.847 1.981 -18.363 1.00 14.31 H new ATOM 0 HB3 GLU A 18 -14.586 1.772 -18.336 1.00 14.31 H new ATOM 0 HG2 GLU A 18 -14.725 3.126 -16.286 1.00 0.44 H new ATOM 0 HG3 GLU A 18 -12.984 3.323 -16.292 1.00 0.44 H new ATOM 259 N LEU A 19 -15.771 -0.193 -16.383 1.00 73.42 N ATOM 260 CA LEU A 19 -16.992 -0.442 -15.643 1.00 4.24 C ATOM 261 C LEU A 19 -16.795 -1.541 -14.611 1.00 41.22 C ATOM 262 O LEU A 19 -17.483 -1.579 -13.584 1.00 65.01 O ATOM 263 CB LEU A 19 -18.141 -0.823 -16.590 1.00 24.13 C ATOM 264 CG LEU A 19 -18.625 0.244 -17.588 1.00 63.53 C ATOM 265 CD1 LEU A 19 -19.052 1.523 -16.882 1.00 42.03 C ATOM 266 CD2 LEU A 19 -17.615 0.521 -18.703 1.00 54.50 C ATOM 0 H LEU A 19 -15.763 -0.600 -17.318 1.00 73.42 H new ATOM 0 HA LEU A 19 -17.251 0.481 -15.125 1.00 4.24 H new ATOM 0 HB2 LEU A 19 -17.831 -1.699 -17.159 1.00 24.13 H new ATOM 0 HB3 LEU A 19 -18.993 -1.124 -15.980 1.00 24.13 H new ATOM 0 HG LEU A 19 -19.507 -0.173 -18.075 1.00 63.53 H new ATOM 0 HD11 LEU A 19 -19.387 2.252 -17.620 1.00 42.03 H new ATOM 0 HD12 LEU A 19 -19.867 1.303 -16.193 1.00 42.03 H new ATOM 0 HD13 LEU A 19 -18.208 1.931 -16.327 1.00 42.03 H new ATOM 0 HD21 LEU A 19 -18.014 1.282 -19.374 1.00 54.50 H new ATOM 0 HD22 LEU A 19 -16.680 0.875 -18.268 1.00 54.50 H new ATOM 0 HD23 LEU A 19 -17.430 -0.396 -19.263 1.00 54.50 H new ATOM 278 N LYS A 20 -15.855 -2.424 -14.875 1.00 75.03 N ATOM 279 CA LYS A 20 -15.537 -3.521 -13.968 1.00 23.31 C ATOM 280 C LYS A 20 -14.062 -3.566 -13.763 1.00 35.24 C ATOM 281 O LYS A 20 -13.374 -4.391 -14.368 1.00 72.24 O ATOM 282 CB LYS A 20 -15.972 -4.858 -14.546 1.00 21.40 C ATOM 283 CG LYS A 20 -17.424 -4.945 -14.974 1.00 43.15 C ATOM 284 CD LYS A 20 -17.702 -6.287 -15.600 1.00 25.02 C ATOM 285 CE LYS A 20 -19.152 -6.444 -15.988 1.00 30.54 C ATOM 286 NZ LYS A 20 -19.415 -7.757 -16.610 1.00 24.01 N ATOM 0 H LYS A 20 -15.287 -2.407 -15.722 1.00 75.03 H new ATOM 0 HA LYS A 20 -16.064 -3.350 -13.030 1.00 23.31 H new ATOM 0 HB2 LYS A 20 -15.344 -5.083 -15.408 1.00 21.40 H new ATOM 0 HB3 LYS A 20 -15.784 -5.633 -13.803 1.00 21.40 H new ATOM 0 HG2 LYS A 20 -18.074 -4.796 -14.112 1.00 43.15 H new ATOM 0 HG3 LYS A 20 -17.650 -4.150 -15.685 1.00 43.15 H new ATOM 0 HD2 LYS A 20 -17.076 -6.411 -16.483 1.00 25.02 H new ATOM 0 HD3 LYS A 20 -17.427 -7.077 -14.901 1.00 25.02 H new ATOM 0 HE2 LYS A 20 -19.779 -6.329 -15.104 1.00 30.54 H new ATOM 0 HE3 LYS A 20 -19.430 -5.651 -16.682 1.00 30.54 H new ATOM 0 HZ1 LYS A 20 -20.422 -7.826 -16.862 1.00 24.01 H new ATOM 0 HZ2 LYS A 20 -18.835 -7.857 -17.468 1.00 24.01 H new ATOM 0 HZ3 LYS A 20 -19.174 -8.514 -15.939 1.00 24.01 H new ATOM 300 N PRO A 21 -13.534 -2.671 -12.958 1.00 22.31 N ATOM 301 CA PRO A 21 -12.130 -2.633 -12.706 1.00 62.54 C ATOM 302 C PRO A 21 -11.701 -3.827 -11.869 1.00 21.03 C ATOM 303 O PRO A 21 -12.503 -4.407 -11.109 1.00 60.32 O ATOM 304 CB PRO A 21 -11.923 -1.318 -11.956 1.00 41.43 C ATOM 305 CG PRO A 21 -13.243 -1.002 -11.348 1.00 12.25 C ATOM 306 CD PRO A 21 -14.271 -1.618 -12.227 1.00 52.55 C ATOM 0 HA PRO A 21 -11.534 -2.684 -13.617 1.00 62.54 H new ATOM 0 HB2 PRO A 21 -11.152 -1.418 -11.192 1.00 41.43 H new ATOM 0 HB3 PRO A 21 -11.601 -0.526 -12.632 1.00 41.43 H new ATOM 0 HG2 PRO A 21 -13.309 -1.400 -10.336 1.00 12.25 H new ATOM 0 HG3 PRO A 21 -13.389 0.076 -11.277 1.00 12.25 H new ATOM 0 HD2 PRO A 21 -15.093 -2.036 -11.647 1.00 52.55 H new ATOM 0 HD3 PRO A 21 -14.703 -0.886 -12.910 1.00 52.55 H new ATOM 314 N LEU A 22 -10.488 -4.221 -12.031 1.00 53.23 N ATOM 315 CA LEU A 22 -9.944 -5.322 -11.288 1.00 51.12 C ATOM 316 C LEU A 22 -9.514 -4.838 -9.950 1.00 1.45 C ATOM 317 O LEU A 22 -9.272 -3.667 -9.776 1.00 21.43 O ATOM 318 CB LEU A 22 -8.773 -5.909 -12.031 1.00 14.40 C ATOM 319 CG LEU A 22 -9.100 -6.460 -13.398 1.00 23.52 C ATOM 320 CD1 LEU A 22 -7.858 -6.906 -14.084 1.00 73.15 C ATOM 321 CD2 LEU A 22 -10.102 -7.596 -13.302 1.00 12.35 C ATOM 0 H LEU A 22 -9.834 -3.791 -12.685 1.00 53.23 H new ATOM 0 HA LEU A 22 -10.702 -6.096 -11.166 1.00 51.12 H new ATOM 0 HB2 LEU A 22 -8.007 -5.141 -12.138 1.00 14.40 H new ATOM 0 HB3 LEU A 22 -8.341 -6.707 -11.427 1.00 14.40 H new ATOM 0 HG LEU A 22 -9.555 -5.665 -13.988 1.00 23.52 H new ATOM 0 HD11 LEU A 22 -8.108 -7.301 -15.069 1.00 73.15 H new ATOM 0 HD12 LEU A 22 -7.179 -6.060 -14.194 1.00 73.15 H new ATOM 0 HD13 LEU A 22 -7.375 -7.684 -13.493 1.00 73.15 H new ATOM 0 HD21 LEU A 22 -10.320 -7.974 -14.301 1.00 12.35 H new ATOM 0 HD22 LEU A 22 -9.685 -8.398 -12.693 1.00 12.35 H new ATOM 0 HD23 LEU A 22 -11.021 -7.232 -12.843 1.00 12.35 H new ATOM 333 N ARG A 23 -9.423 -5.711 -8.999 1.00 4.12 N ATOM 334 CA ARG A 23 -9.018 -5.273 -7.690 1.00 12.33 C ATOM 335 C ARG A 23 -7.510 -5.435 -7.521 1.00 71.14 C ATOM 336 O ARG A 23 -6.928 -4.969 -6.543 1.00 35.24 O ATOM 337 CB ARG A 23 -9.769 -6.010 -6.583 1.00 43.44 C ATOM 338 CG ARG A 23 -9.447 -7.470 -6.460 1.00 14.02 C ATOM 339 CD ARG A 23 -9.983 -8.058 -5.167 1.00 54.45 C ATOM 340 NE ARG A 23 -11.423 -7.843 -4.966 1.00 21.24 N ATOM 341 CZ ARG A 23 -12.225 -8.708 -4.321 1.00 11.21 C ATOM 342 NH1 ARG A 23 -11.760 -9.900 -3.944 1.00 52.41 N ATOM 343 NH2 ARG A 23 -13.483 -8.382 -4.066 1.00 33.02 N ATOM 0 H ARG A 23 -9.617 -6.708 -9.092 1.00 4.12 H new ATOM 0 HA ARG A 23 -9.272 -4.217 -7.602 1.00 12.33 H new ATOM 0 HB2 ARG A 23 -9.551 -5.524 -5.632 1.00 43.44 H new ATOM 0 HB3 ARG A 23 -10.840 -5.903 -6.758 1.00 43.44 H new ATOM 0 HG2 ARG A 23 -9.871 -8.008 -7.308 1.00 14.02 H new ATOM 0 HG3 ARG A 23 -8.367 -7.609 -6.502 1.00 14.02 H new ATOM 0 HD2 ARG A 23 -9.781 -9.129 -5.155 1.00 54.45 H new ATOM 0 HD3 ARG A 23 -9.440 -7.622 -4.329 1.00 54.45 H new ATOM 0 HE ARG A 23 -11.838 -6.988 -5.337 1.00 21.24 H new ATOM 0 HH11 ARG A 23 -10.794 -10.157 -4.145 1.00 52.41 H new ATOM 0 HH12 ARG A 23 -12.371 -10.554 -3.455 1.00 52.41 H new ATOM 0 HH21 ARG A 23 -13.844 -7.474 -4.359 1.00 33.02 H new ATOM 0 HH22 ARG A 23 -14.091 -9.039 -3.577 1.00 33.02 H new ATOM 357 N THR A 24 -6.882 -6.097 -8.477 1.00 33.34 N ATOM 358 CA THR A 24 -5.467 -6.328 -8.434 1.00 60.24 C ATOM 359 C THR A 24 -4.812 -5.958 -9.747 1.00 33.34 C ATOM 360 O THR A 24 -5.407 -6.120 -10.824 1.00 62.53 O ATOM 361 CB THR A 24 -5.125 -7.805 -8.086 1.00 13.11 C ATOM 362 OG1 THR A 24 -5.836 -8.701 -8.952 1.00 10.44 O ATOM 363 CG2 THR A 24 -5.442 -8.129 -6.638 1.00 14.43 C ATOM 0 H THR A 24 -7.346 -6.485 -9.299 1.00 33.34 H new ATOM 0 HA THR A 24 -5.075 -5.689 -7.643 1.00 60.24 H new ATOM 0 HB THR A 24 -4.053 -7.934 -8.233 1.00 13.11 H new ATOM 0 HG1 THR A 24 -5.610 -9.626 -8.722 1.00 10.44 H new ATOM 0 HG21 THR A 24 -5.189 -9.170 -6.434 1.00 14.43 H new ATOM 0 HG22 THR A 24 -4.860 -7.479 -5.984 1.00 14.43 H new ATOM 0 HG23 THR A 24 -6.505 -7.971 -6.454 1.00 14.43 H new ATOM 371 N LEU A 25 -3.599 -5.465 -9.659 1.00 12.44 N ATOM 372 CA LEU A 25 -2.814 -5.137 -10.821 1.00 44.21 C ATOM 373 C LEU A 25 -2.270 -6.439 -11.399 1.00 74.10 C ATOM 374 O LEU A 25 -1.973 -6.548 -12.593 1.00 4.41 O ATOM 375 CB LEU A 25 -1.690 -4.176 -10.428 1.00 30.03 C ATOM 376 CG LEU A 25 -0.772 -3.690 -11.548 1.00 44.31 C ATOM 377 CD1 LEU A 25 -1.580 -3.027 -12.656 1.00 75.32 C ATOM 378 CD2 LEU A 25 0.244 -2.716 -10.984 1.00 3.41 C ATOM 0 H LEU A 25 -3.128 -5.280 -8.773 1.00 12.44 H new ATOM 0 HA LEU A 25 -3.418 -4.636 -11.578 1.00 44.21 H new ATOM 0 HB2 LEU A 25 -2.140 -3.303 -9.956 1.00 30.03 H new ATOM 0 HB3 LEU A 25 -1.074 -4.665 -9.673 1.00 30.03 H new ATOM 0 HG LEU A 25 -0.251 -4.547 -11.974 1.00 44.31 H new ATOM 0 HD11 LEU A 25 -0.907 -2.688 -13.444 1.00 75.32 H new ATOM 0 HD12 LEU A 25 -2.289 -3.745 -13.068 1.00 75.32 H new ATOM 0 HD13 LEU A 25 -2.122 -2.173 -12.250 1.00 75.32 H new ATOM 0 HD21 LEU A 25 0.899 -2.370 -11.784 1.00 3.41 H new ATOM 0 HD22 LEU A 25 -0.274 -1.864 -10.544 1.00 3.41 H new ATOM 0 HD23 LEU A 25 0.839 -3.214 -10.218 1.00 3.41 H new ATOM 390 N TYR A 26 -2.168 -7.429 -10.523 1.00 31.42 N ATOM 391 CA TYR A 26 -1.795 -8.772 -10.891 1.00 74.44 C ATOM 392 C TYR A 26 -2.782 -9.351 -11.919 1.00 70.25 C ATOM 393 O TYR A 26 -2.367 -9.898 -12.939 1.00 32.10 O ATOM 394 CB TYR A 26 -1.704 -9.658 -9.625 1.00 41.44 C ATOM 395 CG TYR A 26 -1.429 -11.116 -9.905 1.00 3.14 C ATOM 396 CD1 TYR A 26 -0.437 -11.487 -10.778 1.00 71.14 C ATOM 397 CD2 TYR A 26 -2.164 -12.117 -9.285 1.00 31.40 C ATOM 398 CE1 TYR A 26 -0.180 -12.794 -11.050 1.00 24.30 C ATOM 399 CE2 TYR A 26 -1.908 -13.446 -9.548 1.00 51.40 C ATOM 400 CZ TYR A 26 -0.914 -13.780 -10.442 1.00 31.40 C ATOM 401 OH TYR A 26 -0.650 -15.100 -10.721 1.00 44.33 O ATOM 0 H TYR A 26 -2.346 -7.312 -9.526 1.00 31.42 H new ATOM 0 HA TYR A 26 -0.813 -8.752 -11.363 1.00 74.44 H new ATOM 0 HB2 TYR A 26 -0.916 -9.269 -8.980 1.00 41.44 H new ATOM 0 HB3 TYR A 26 -2.639 -9.577 -9.071 1.00 41.44 H new ATOM 0 HD1 TYR A 26 0.154 -10.722 -11.260 1.00 71.14 H new ATOM 0 HD2 TYR A 26 -2.946 -11.852 -8.588 1.00 31.40 H new ATOM 0 HE1 TYR A 26 0.603 -13.056 -11.746 1.00 24.30 H new ATOM 0 HE2 TYR A 26 -2.482 -14.219 -9.058 1.00 51.40 H new ATOM 0 HH TYR A 26 -1.258 -15.671 -10.207 1.00 44.33 H new ATOM 411 N GLN A 27 -4.080 -9.195 -11.668 1.00 10.34 N ATOM 412 CA GLN A 27 -5.087 -9.706 -12.593 1.00 65.20 C ATOM 413 C GLN A 27 -5.038 -8.960 -13.932 1.00 45.54 C ATOM 414 O GLN A 27 -5.324 -9.532 -14.971 1.00 3.24 O ATOM 415 CB GLN A 27 -6.499 -9.693 -11.957 1.00 72.33 C ATOM 416 CG GLN A 27 -7.641 -10.146 -12.883 1.00 14.22 C ATOM 417 CD GLN A 27 -7.415 -11.508 -13.505 1.00 55.22 C ATOM 418 OE1 GLN A 27 -7.940 -11.679 -14.681 1.00 71.11 O flip ATOM 419 NE2 GLN A 27 -6.772 -12.376 -12.935 1.00 12.01 N flip ATOM 0 H GLN A 27 -4.455 -8.726 -10.844 1.00 10.34 H new ATOM 0 HA GLN A 27 -4.852 -10.749 -12.804 1.00 65.20 H new ATOM 0 HB2 GLN A 27 -6.489 -10.337 -11.078 1.00 72.33 H new ATOM 0 HB3 GLN A 27 -6.714 -8.682 -11.610 1.00 72.33 H new ATOM 0 HG2 GLN A 27 -8.571 -10.165 -12.315 1.00 14.22 H new ATOM 0 HG3 GLN A 27 -7.767 -9.410 -13.677 1.00 14.22 H new ATOM 0 HE21 GLN A 27 -6.378 -12.196 -12.011 1.00 12.01 H new ATOM 0 HE22 GLN A 27 -6.628 -13.281 -13.383 1.00 12.01 H new ATOM 428 N ALA A 28 -4.640 -7.692 -13.900 1.00 72.13 N ATOM 429 CA ALA A 28 -4.502 -6.900 -15.094 1.00 73.22 C ATOM 430 C ALA A 28 -3.452 -7.512 -16.006 1.00 14.20 C ATOM 431 O ALA A 28 -3.609 -7.555 -17.234 1.00 23.31 O ATOM 432 CB ALA A 28 -4.161 -5.465 -14.728 1.00 40.54 C ATOM 0 H ALA A 28 -4.407 -7.195 -13.041 1.00 72.13 H new ATOM 0 HA ALA A 28 -5.447 -6.890 -15.636 1.00 73.22 H new ATOM 0 HB1 ALA A 28 -4.058 -4.872 -15.637 1.00 40.54 H new ATOM 0 HB2 ALA A 28 -4.957 -5.048 -14.111 1.00 40.54 H new ATOM 0 HB3 ALA A 28 -3.223 -5.444 -14.173 1.00 40.54 H new ATOM 438 N MET A 29 -2.390 -8.005 -15.409 1.00 74.11 N ATOM 439 CA MET A 29 -1.390 -8.700 -16.142 1.00 64.22 C ATOM 440 C MET A 29 -1.863 -10.055 -16.610 1.00 30.13 C ATOM 441 O MET A 29 -1.444 -10.511 -17.640 1.00 14.12 O ATOM 442 CB MET A 29 -0.076 -8.792 -15.408 1.00 13.52 C ATOM 443 CG MET A 29 0.750 -7.525 -15.453 1.00 32.54 C ATOM 444 SD MET A 29 2.361 -7.777 -14.762 1.00 63.23 S ATOM 445 CE MET A 29 3.115 -6.235 -15.186 1.00 33.03 C ATOM 0 H MET A 29 -2.208 -7.929 -14.408 1.00 74.11 H new ATOM 0 HA MET A 29 -1.203 -8.097 -17.031 1.00 64.22 H new ATOM 0 HB2 MET A 29 -0.272 -9.048 -14.367 1.00 13.52 H new ATOM 0 HB3 MET A 29 0.508 -9.608 -15.833 1.00 13.52 H new ATOM 0 HG2 MET A 29 0.844 -7.187 -16.485 1.00 32.54 H new ATOM 0 HG3 MET A 29 0.237 -6.735 -14.904 1.00 32.54 H new ATOM 0 HE1 MET A 29 4.195 -6.366 -15.260 1.00 33.03 H new ATOM 0 HE2 MET A 29 2.725 -5.890 -16.144 1.00 33.03 H new ATOM 0 HE3 MET A 29 2.891 -5.497 -14.416 1.00 33.03 H new ATOM 455 N ILE A 30 -2.730 -10.689 -15.855 1.00 32.32 N ATOM 456 CA ILE A 30 -3.287 -11.980 -16.263 1.00 62.31 C ATOM 457 C ILE A 30 -4.217 -11.810 -17.472 1.00 65.13 C ATOM 458 O ILE A 30 -4.266 -12.662 -18.362 1.00 1.43 O ATOM 459 CB ILE A 30 -4.022 -12.701 -15.098 1.00 34.04 C ATOM 460 CG1 ILE A 30 -3.054 -12.902 -13.923 1.00 2.03 C ATOM 461 CG2 ILE A 30 -4.577 -14.053 -15.559 1.00 50.52 C ATOM 462 CD1 ILE A 30 -3.655 -13.627 -12.745 1.00 61.21 C ATOM 0 H ILE A 30 -3.070 -10.343 -14.958 1.00 32.32 H new ATOM 0 HA ILE A 30 -2.449 -12.615 -16.551 1.00 62.31 H new ATOM 0 HB ILE A 30 -4.859 -12.081 -14.776 1.00 34.04 H new ATOM 0 HG12 ILE A 30 -2.185 -13.459 -14.274 1.00 2.03 H new ATOM 0 HG13 ILE A 30 -2.695 -11.928 -13.591 1.00 2.03 H new ATOM 0 HG21 ILE A 30 -5.087 -14.540 -14.728 1.00 50.52 H new ATOM 0 HG22 ILE A 30 -5.282 -13.898 -16.376 1.00 50.52 H new ATOM 0 HG23 ILE A 30 -3.758 -14.685 -15.902 1.00 50.52 H new ATOM 0 HD11 ILE A 30 -2.906 -13.728 -11.959 1.00 61.21 H new ATOM 0 HD12 ILE A 30 -4.506 -13.061 -12.365 1.00 61.21 H new ATOM 0 HD13 ILE A 30 -3.988 -14.617 -13.058 1.00 61.21 H new ATOM 474 N ILE A 31 -4.944 -10.704 -17.503 1.00 42.43 N ATOM 475 CA ILE A 31 -5.816 -10.390 -18.615 1.00 72.10 C ATOM 476 C ILE A 31 -4.994 -10.197 -19.905 1.00 64.52 C ATOM 477 O ILE A 31 -5.353 -10.707 -20.974 1.00 2.15 O ATOM 478 CB ILE A 31 -6.629 -9.078 -18.353 1.00 33.03 C ATOM 479 CG1 ILE A 31 -7.537 -9.188 -17.125 1.00 51.43 C ATOM 480 CG2 ILE A 31 -7.483 -8.770 -19.547 1.00 23.44 C ATOM 481 CD1 ILE A 31 -8.674 -10.177 -17.282 1.00 3.41 C ATOM 0 H ILE A 31 -4.944 -10.005 -16.761 1.00 42.43 H new ATOM 0 HA ILE A 31 -6.506 -11.226 -18.726 1.00 72.10 H new ATOM 0 HB ILE A 31 -5.904 -8.284 -18.171 1.00 33.03 H new ATOM 0 HG12 ILE A 31 -6.933 -9.479 -16.265 1.00 51.43 H new ATOM 0 HG13 ILE A 31 -7.953 -8.205 -16.905 1.00 51.43 H new ATOM 0 HG21 ILE A 31 -8.049 -7.856 -19.364 1.00 23.44 H new ATOM 0 HG22 ILE A 31 -6.849 -8.634 -20.423 1.00 23.44 H new ATOM 0 HG23 ILE A 31 -8.173 -9.595 -19.723 1.00 23.44 H new ATOM 0 HD11 ILE A 31 -9.269 -10.195 -16.369 1.00 3.41 H new ATOM 0 HD12 ILE A 31 -9.304 -9.878 -18.120 1.00 3.41 H new ATOM 0 HD13 ILE A 31 -8.268 -11.171 -17.470 1.00 3.41 H new ATOM 493 N THR A 32 -3.891 -9.491 -19.782 1.00 65.32 N ATOM 494 CA THR A 32 -3.097 -9.108 -20.917 1.00 32.42 C ATOM 495 C THR A 32 -2.037 -10.175 -21.281 1.00 75.25 C ATOM 496 O THR A 32 -1.902 -10.560 -22.443 1.00 54.43 O ATOM 497 CB THR A 32 -2.412 -7.753 -20.620 1.00 5.35 C ATOM 498 OG1 THR A 32 -1.637 -7.871 -19.411 1.00 53.52 O ATOM 499 CG2 THR A 32 -3.458 -6.657 -20.415 1.00 52.53 C ATOM 0 H THR A 32 -3.523 -9.168 -18.887 1.00 65.32 H new ATOM 0 HA THR A 32 -3.760 -9.016 -21.777 1.00 32.42 H new ATOM 0 HB THR A 32 -1.775 -7.492 -21.465 1.00 5.35 H new ATOM 0 HG1 THR A 32 -2.199 -7.649 -18.639 1.00 53.52 H new ATOM 0 HG21 THR A 32 -2.958 -5.711 -20.207 1.00 52.53 H new ATOM 0 HG22 THR A 32 -4.062 -6.558 -21.317 1.00 52.53 H new ATOM 0 HG23 THR A 32 -4.101 -6.920 -19.575 1.00 52.53 H new ATOM 507 N LYS A 33 -1.311 -10.647 -20.257 1.00 62.20 N ATOM 508 CA LYS A 33 -0.190 -11.613 -20.360 1.00 63.43 C ATOM 509 C LYS A 33 1.009 -10.983 -21.049 1.00 62.51 C ATOM 510 O LYS A 33 2.009 -11.636 -21.314 1.00 53.24 O ATOM 511 CB LYS A 33 -0.602 -12.902 -21.073 1.00 30.51 C ATOM 512 CG LYS A 33 -1.748 -13.636 -20.404 1.00 55.41 C ATOM 513 CD LYS A 33 -2.129 -14.899 -21.161 1.00 14.45 C ATOM 514 CE LYS A 33 -2.518 -14.599 -22.606 1.00 41.41 C ATOM 515 NZ LYS A 33 -3.615 -13.602 -22.709 1.00 70.11 N ATOM 0 H LYS A 33 -1.490 -10.360 -19.295 1.00 62.20 H new ATOM 0 HA LYS A 33 0.093 -11.880 -19.342 1.00 63.43 H new ATOM 0 HB2 LYS A 33 -0.886 -12.664 -22.098 1.00 30.51 H new ATOM 0 HB3 LYS A 33 0.260 -13.567 -21.127 1.00 30.51 H new ATOM 0 HG2 LYS A 33 -1.467 -13.895 -19.383 1.00 55.41 H new ATOM 0 HG3 LYS A 33 -2.613 -12.976 -20.339 1.00 55.41 H new ATOM 0 HD2 LYS A 33 -1.292 -15.597 -21.148 1.00 14.45 H new ATOM 0 HD3 LYS A 33 -2.961 -15.389 -20.655 1.00 14.45 H new ATOM 0 HE2 LYS A 33 -1.645 -14.229 -23.144 1.00 41.41 H new ATOM 0 HE3 LYS A 33 -2.826 -15.523 -23.095 1.00 41.41 H new ATOM 0 HZ1 LYS A 33 -3.943 -13.548 -23.694 1.00 70.11 H new ATOM 0 HZ2 LYS A 33 -4.404 -13.890 -22.096 1.00 70.11 H new ATOM 0 HZ3 LYS A 33 -3.266 -12.670 -22.409 1.00 70.11 H new ATOM 529 N SER A 34 0.913 -9.702 -21.298 1.00 21.22 N ATOM 530 CA SER A 34 1.942 -8.984 -22.007 1.00 1.24 C ATOM 531 C SER A 34 2.991 -8.394 -21.055 1.00 4.10 C ATOM 532 O SER A 34 4.005 -7.876 -21.500 1.00 23.42 O ATOM 533 CB SER A 34 1.297 -7.892 -22.853 1.00 51.32 C ATOM 534 OG SER A 34 0.347 -8.456 -23.760 1.00 11.11 O ATOM 0 H SER A 34 0.119 -9.127 -21.015 1.00 21.22 H new ATOM 0 HA SER A 34 2.469 -9.684 -22.655 1.00 1.24 H new ATOM 0 HB2 SER A 34 0.804 -7.166 -22.206 1.00 51.32 H new ATOM 0 HB3 SER A 34 2.065 -7.354 -23.409 1.00 51.32 H new ATOM 0 HG SER A 34 -0.059 -7.742 -24.294 1.00 11.11 H new ATOM 540 N SER A 35 2.713 -8.459 -19.739 1.00 71.21 N ATOM 541 CA SER A 35 3.632 -7.961 -18.678 1.00 62.45 C ATOM 542 C SER A 35 3.795 -6.404 -18.747 1.00 55.15 C ATOM 543 O SER A 35 4.554 -5.798 -17.990 1.00 34.54 O ATOM 544 CB SER A 35 5.009 -8.698 -18.773 1.00 1.52 C ATOM 545 OG SER A 35 5.877 -8.393 -17.681 1.00 60.24 O ATOM 0 H SER A 35 1.848 -8.857 -19.374 1.00 71.21 H new ATOM 0 HA SER A 35 3.195 -8.185 -17.705 1.00 62.45 H new ATOM 0 HB2 SER A 35 4.838 -9.774 -18.806 1.00 1.52 H new ATOM 0 HB3 SER A 35 5.499 -8.424 -19.708 1.00 1.52 H new ATOM 0 HG SER A 35 5.723 -9.031 -16.953 1.00 60.24 H new ATOM 551 N LYS A 36 3.030 -5.788 -19.617 1.00 61.43 N ATOM 552 CA LYS A 36 3.043 -4.397 -19.859 1.00 24.02 C ATOM 553 C LYS A 36 1.896 -4.117 -20.793 1.00 4.20 C ATOM 554 O LYS A 36 1.514 -4.977 -21.581 1.00 61.40 O ATOM 555 CB LYS A 36 4.368 -3.931 -20.501 1.00 60.15 C ATOM 556 CG LYS A 36 4.419 -2.426 -20.727 1.00 22.52 C ATOM 557 CD LYS A 36 5.704 -1.980 -21.387 1.00 1.31 C ATOM 558 CE LYS A 36 5.700 -0.481 -21.629 1.00 64.43 C ATOM 559 NZ LYS A 36 6.932 -0.014 -22.306 1.00 14.21 N ATOM 0 H LYS A 36 2.353 -6.285 -20.196 1.00 61.43 H new ATOM 0 HA LYS A 36 2.948 -3.856 -18.918 1.00 24.02 H new ATOM 0 HB2 LYS A 36 5.200 -4.226 -19.861 1.00 60.15 H new ATOM 0 HB3 LYS A 36 4.503 -4.441 -21.455 1.00 60.15 H new ATOM 0 HG2 LYS A 36 3.574 -2.127 -21.347 1.00 22.52 H new ATOM 0 HG3 LYS A 36 4.310 -1.915 -19.770 1.00 22.52 H new ATOM 0 HD2 LYS A 36 6.552 -2.248 -20.757 1.00 1.31 H new ATOM 0 HD3 LYS A 36 5.832 -2.504 -22.334 1.00 1.31 H new ATOM 0 HE2 LYS A 36 4.833 -0.216 -22.235 1.00 64.43 H new ATOM 0 HE3 LYS A 36 5.594 0.038 -20.676 1.00 64.43 H new ATOM 0 HZ1 LYS A 36 6.881 1.015 -22.449 1.00 14.21 H new ATOM 0 HZ2 LYS A 36 7.759 -0.241 -21.718 1.00 14.21 H new ATOM 0 HZ3 LYS A 36 7.022 -0.487 -23.228 1.00 14.21 H new ATOM 573 N GLY A 37 1.351 -2.979 -20.668 1.00 10.32 N ATOM 574 CA GLY A 37 0.260 -2.546 -21.464 1.00 23.11 C ATOM 575 C GLY A 37 -0.267 -1.334 -20.823 1.00 74.33 C ATOM 576 O GLY A 37 0.451 -0.726 -20.013 1.00 52.21 O ATOM 0 H GLY A 37 1.657 -2.287 -19.984 1.00 10.32 H new ATOM 0 HA2 GLY A 37 0.583 -2.337 -22.484 1.00 23.11 H new ATOM 0 HA3 GLY A 37 -0.507 -3.318 -21.524 1.00 23.11 H new ATOM 580 N ASP A 38 -1.456 -0.937 -21.128 1.00 14.22 N ATOM 581 CA ASP A 38 -1.991 0.196 -20.431 1.00 12.20 C ATOM 582 C ASP A 38 -2.800 -0.272 -19.271 1.00 44.45 C ATOM 583 O ASP A 38 -3.850 -0.899 -19.433 1.00 22.23 O ATOM 584 CB ASP A 38 -2.782 1.149 -21.338 1.00 71.22 C ATOM 585 CG ASP A 38 -1.910 1.804 -22.387 1.00 34.13 C ATOM 586 OD1 ASP A 38 -1.132 2.737 -22.049 1.00 42.24 O ATOM 587 OD2 ASP A 38 -1.957 1.386 -23.556 1.00 72.22 O ATOM 0 H ASP A 38 -2.063 -1.359 -21.830 1.00 14.22 H new ATOM 0 HA ASP A 38 -1.152 0.788 -20.066 1.00 12.20 H new ATOM 0 HB2 ASP A 38 -3.584 0.597 -21.829 1.00 71.22 H new ATOM 0 HB3 ASP A 38 -3.253 1.920 -20.728 1.00 71.22 H new ATOM 592 N PHE A 39 -2.301 0.011 -18.107 1.00 64.30 N ATOM 593 CA PHE A 39 -2.930 -0.372 -16.888 1.00 4.42 C ATOM 594 C PHE A 39 -3.250 0.870 -16.131 1.00 1.12 C ATOM 595 O PHE A 39 -2.347 1.581 -15.672 1.00 31.54 O ATOM 596 CB PHE A 39 -2.010 -1.275 -16.059 1.00 0.15 C ATOM 597 CG PHE A 39 -1.577 -2.531 -16.765 1.00 62.42 C ATOM 598 CD1 PHE A 39 -2.494 -3.497 -17.088 1.00 3.21 C ATOM 599 CD2 PHE A 39 -0.254 -2.746 -17.094 1.00 51.24 C ATOM 600 CE1 PHE A 39 -2.111 -4.657 -17.724 1.00 50.44 C ATOM 601 CE2 PHE A 39 0.137 -3.903 -17.729 1.00 2.13 C ATOM 602 CZ PHE A 39 -0.793 -4.859 -18.044 1.00 22.13 C ATOM 0 H PHE A 39 -1.429 0.524 -17.979 1.00 64.30 H new ATOM 0 HA PHE A 39 -3.838 -0.936 -17.100 1.00 4.42 H new ATOM 0 HB2 PHE A 39 -1.124 -0.708 -15.774 1.00 0.15 H new ATOM 0 HB3 PHE A 39 -2.523 -1.549 -15.137 1.00 0.15 H new ATOM 0 HD1 PHE A 39 -3.534 -3.346 -16.840 1.00 3.21 H new ATOM 0 HD2 PHE A 39 0.484 -1.997 -16.850 1.00 51.24 H new ATOM 0 HE1 PHE A 39 -2.848 -5.407 -17.970 1.00 50.44 H new ATOM 0 HE2 PHE A 39 1.176 -4.057 -17.979 1.00 2.13 H new ATOM 0 HZ PHE A 39 -0.489 -5.768 -18.542 1.00 22.13 H new ATOM 612 N LEU A 40 -4.502 1.158 -16.018 1.00 52.04 N ATOM 613 CA LEU A 40 -4.923 2.368 -15.382 1.00 51.34 C ATOM 614 C LEU A 40 -5.627 2.060 -14.095 1.00 33.42 C ATOM 615 O LEU A 40 -6.597 1.307 -14.066 1.00 11.55 O ATOM 616 CB LEU A 40 -5.821 3.187 -16.300 1.00 45.13 C ATOM 617 CG LEU A 40 -5.234 3.594 -17.661 1.00 14.13 C ATOM 618 CD1 LEU A 40 -6.265 4.347 -18.484 1.00 73.20 C ATOM 619 CD2 LEU A 40 -3.987 4.445 -17.477 1.00 64.32 C ATOM 0 H LEU A 40 -5.261 0.569 -16.360 1.00 52.04 H new ATOM 0 HA LEU A 40 -4.037 2.963 -15.163 1.00 51.34 H new ATOM 0 HB2 LEU A 40 -6.733 2.617 -16.480 1.00 45.13 H new ATOM 0 HB3 LEU A 40 -6.111 4.094 -15.770 1.00 45.13 H new ATOM 0 HG LEU A 40 -4.957 2.685 -18.195 1.00 14.13 H new ATOM 0 HD11 LEU A 40 -5.831 4.627 -19.444 1.00 73.20 H new ATOM 0 HD12 LEU A 40 -7.134 3.710 -18.651 1.00 73.20 H new ATOM 0 HD13 LEU A 40 -6.572 5.246 -17.949 1.00 73.20 H new ATOM 0 HD21 LEU A 40 -3.588 4.722 -18.453 1.00 64.32 H new ATOM 0 HD22 LEU A 40 -4.241 5.347 -16.920 1.00 64.32 H new ATOM 0 HD23 LEU A 40 -3.237 3.877 -16.926 1.00 64.32 H new ATOM 631 N ILE A 41 -5.146 2.624 -13.040 1.00 22.22 N ATOM 632 CA ILE A 41 -5.693 2.387 -11.747 1.00 31.22 C ATOM 633 C ILE A 41 -6.411 3.630 -11.266 1.00 41.21 C ATOM 634 O ILE A 41 -5.912 4.743 -11.440 1.00 12.53 O ATOM 635 CB ILE A 41 -4.594 1.965 -10.738 1.00 14.54 C ATOM 636 CG1 ILE A 41 -3.820 0.760 -11.315 1.00 31.24 C ATOM 637 CG2 ILE A 41 -5.205 1.647 -9.376 1.00 50.03 C ATOM 638 CD1 ILE A 41 -2.922 0.026 -10.351 1.00 2.15 C ATOM 0 H ILE A 41 -4.355 3.268 -13.050 1.00 22.22 H new ATOM 0 HA ILE A 41 -6.405 1.564 -11.816 1.00 31.22 H new ATOM 0 HB ILE A 41 -3.896 2.788 -10.586 1.00 14.54 H new ATOM 0 HG12 ILE A 41 -4.542 0.051 -11.720 1.00 31.24 H new ATOM 0 HG13 ILE A 41 -3.214 1.110 -12.151 1.00 31.24 H new ATOM 0 HG21 ILE A 41 -4.417 1.353 -8.683 1.00 50.03 H new ATOM 0 HG22 ILE A 41 -5.716 2.530 -8.991 1.00 50.03 H new ATOM 0 HG23 ILE A 41 -5.920 0.831 -9.480 1.00 50.03 H new ATOM 0 HD11 ILE A 41 -2.431 -0.799 -10.867 1.00 2.15 H new ATOM 0 HD12 ILE A 41 -2.168 0.711 -9.963 1.00 2.15 H new ATOM 0 HD13 ILE A 41 -3.517 -0.365 -9.525 1.00 2.15 H new ATOM 650 N ARG A 42 -7.599 3.446 -10.708 1.00 62.12 N ATOM 651 CA ARG A 42 -8.373 4.529 -10.208 1.00 42.22 C ATOM 652 C ARG A 42 -7.672 5.124 -9.003 1.00 34.20 C ATOM 653 O ARG A 42 -7.324 4.412 -8.062 1.00 62.54 O ATOM 654 CB ARG A 42 -9.777 4.071 -9.791 1.00 70.54 C ATOM 655 CG ARG A 42 -10.686 5.242 -9.493 1.00 55.41 C ATOM 656 CD ARG A 42 -11.171 5.907 -10.770 1.00 60.32 C ATOM 657 NE ARG A 42 -12.351 5.252 -11.341 1.00 23.02 N ATOM 658 CZ ARG A 42 -13.177 5.817 -12.253 1.00 21.42 C ATOM 659 NH1 ARG A 42 -12.939 7.046 -12.711 1.00 53.04 N ATOM 660 NH2 ARG A 42 -14.230 5.145 -12.703 1.00 52.25 N ATOM 0 H ARG A 42 -8.038 2.532 -10.598 1.00 62.12 H new ATOM 0 HA ARG A 42 -8.475 5.270 -11.001 1.00 42.22 H new ATOM 0 HB2 ARG A 42 -10.213 3.466 -10.586 1.00 70.54 H new ATOM 0 HB3 ARG A 42 -9.704 3.434 -8.909 1.00 70.54 H new ATOM 0 HG2 ARG A 42 -11.542 4.901 -8.911 1.00 55.41 H new ATOM 0 HG3 ARG A 42 -10.154 5.971 -8.881 1.00 55.41 H new ATOM 0 HD2 ARG A 42 -11.406 6.951 -10.563 1.00 60.32 H new ATOM 0 HD3 ARG A 42 -10.366 5.900 -11.505 1.00 60.32 H new ATOM 0 HE ARG A 42 -12.565 4.305 -11.030 1.00 23.02 H new ATOM 0 HH11 ARG A 42 -12.130 7.568 -12.374 1.00 53.04 H new ATOM 0 HH12 ARG A 42 -13.566 7.465 -13.398 1.00 53.04 H new ATOM 0 HH21 ARG A 42 -14.417 4.202 -12.362 1.00 52.25 H new ATOM 0 HH22 ARG A 42 -14.852 5.572 -13.390 1.00 52.25 H new ATOM 674 N THR A 43 -7.462 6.385 -9.043 1.00 32.10 N ATOM 675 CA THR A 43 -6.851 7.081 -7.976 1.00 1.12 C ATOM 676 C THR A 43 -7.667 8.332 -7.731 1.00 51.24 C ATOM 677 O THR A 43 -8.343 8.813 -8.642 1.00 73.53 O ATOM 678 CB THR A 43 -5.369 7.445 -8.310 1.00 2.55 C ATOM 679 OG1 THR A 43 -4.706 7.976 -7.159 1.00 63.24 O ATOM 680 CG2 THR A 43 -5.281 8.471 -9.428 1.00 12.04 C ATOM 0 H THR A 43 -7.715 6.975 -9.835 1.00 32.10 H new ATOM 0 HA THR A 43 -6.826 6.455 -7.084 1.00 1.12 H new ATOM 0 HB THR A 43 -4.884 6.523 -8.631 1.00 2.55 H new ATOM 0 HG1 THR A 43 -3.779 8.196 -7.388 1.00 63.24 H new ATOM 0 HG21 THR A 43 -4.235 8.699 -9.632 1.00 12.04 H new ATOM 0 HG22 THR A 43 -5.747 8.069 -10.328 1.00 12.04 H new ATOM 0 HG23 THR A 43 -5.799 9.382 -9.127 1.00 12.04 H new ATOM 688 N LYS A 44 -7.643 8.835 -6.544 1.00 72.42 N ATOM 689 CA LYS A 44 -8.369 10.037 -6.254 1.00 73.42 C ATOM 690 C LYS A 44 -7.386 11.152 -6.076 1.00 54.21 C ATOM 691 O LYS A 44 -6.572 11.163 -5.143 1.00 52.45 O ATOM 692 CB LYS A 44 -9.378 9.910 -5.058 1.00 73.34 C ATOM 693 CG LYS A 44 -8.809 9.603 -3.655 1.00 4.41 C ATOM 694 CD LYS A 44 -8.105 8.265 -3.585 1.00 50.24 C ATOM 695 CE LYS A 44 -7.637 7.956 -2.184 1.00 52.21 C ATOM 696 NZ LYS A 44 -6.889 6.680 -2.126 1.00 41.34 N ATOM 0 H LYS A 44 -7.131 8.438 -5.756 1.00 72.42 H new ATOM 0 HA LYS A 44 -9.019 10.255 -7.102 1.00 73.42 H new ATOM 0 HB2 LYS A 44 -9.938 10.843 -4.994 1.00 73.34 H new ATOM 0 HB3 LYS A 44 -10.093 9.126 -5.307 1.00 73.34 H new ATOM 0 HG2 LYS A 44 -8.111 10.391 -3.371 1.00 4.41 H new ATOM 0 HG3 LYS A 44 -9.621 9.619 -2.928 1.00 4.41 H new ATOM 0 HD2 LYS A 44 -8.780 7.480 -3.925 1.00 50.24 H new ATOM 0 HD3 LYS A 44 -7.251 8.267 -4.262 1.00 50.24 H new ATOM 0 HE2 LYS A 44 -7.003 8.766 -1.825 1.00 52.21 H new ATOM 0 HE3 LYS A 44 -8.497 7.905 -1.516 1.00 52.21 H new ATOM 0 HZ1 LYS A 44 -6.583 6.501 -1.148 1.00 41.34 H new ATOM 0 HZ2 LYS A 44 -7.503 5.903 -2.445 1.00 41.34 H new ATOM 0 HZ3 LYS A 44 -6.055 6.738 -2.744 1.00 41.34 H new ATOM 710 N LYS A 45 -7.417 12.047 -7.011 1.00 65.03 N ATOM 711 CA LYS A 45 -6.493 13.120 -7.079 1.00 53.40 C ATOM 712 C LYS A 45 -7.259 14.394 -7.337 1.00 14.32 C ATOM 713 O LYS A 45 -8.111 14.426 -8.221 1.00 54.04 O ATOM 714 CB LYS A 45 -5.495 12.818 -8.203 1.00 32.12 C ATOM 715 CG LYS A 45 -4.364 13.797 -8.375 1.00 3.22 C ATOM 716 CD LYS A 45 -3.330 13.229 -9.335 1.00 15.40 C ATOM 717 CE LYS A 45 -2.590 12.027 -8.729 1.00 62.11 C ATOM 718 NZ LYS A 45 -1.570 11.469 -9.644 1.00 43.14 N ATOM 0 H LYS A 45 -8.105 12.047 -7.764 1.00 65.03 H new ATOM 0 HA LYS A 45 -5.940 13.239 -6.147 1.00 53.40 H new ATOM 0 HB2 LYS A 45 -5.068 11.831 -8.025 1.00 32.12 H new ATOM 0 HB3 LYS A 45 -6.045 12.763 -9.142 1.00 32.12 H new ATOM 0 HG2 LYS A 45 -4.746 14.744 -8.757 1.00 3.22 H new ATOM 0 HG3 LYS A 45 -3.902 14.005 -7.410 1.00 3.22 H new ATOM 0 HD2 LYS A 45 -3.820 12.925 -10.260 1.00 15.40 H new ATOM 0 HD3 LYS A 45 -2.611 14.005 -9.596 1.00 15.40 H new ATOM 0 HE2 LYS A 45 -2.111 12.331 -7.798 1.00 62.11 H new ATOM 0 HE3 LYS A 45 -3.311 11.250 -8.477 1.00 62.11 H new ATOM 0 HZ1 LYS A 45 -0.795 11.054 -9.088 1.00 43.14 H new ATOM 0 HZ2 LYS A 45 -2.002 10.733 -10.238 1.00 43.14 H new ATOM 0 HZ3 LYS A 45 -1.195 12.227 -10.249 1.00 43.14 H new ATOM 732 N ASP A 46 -6.986 15.425 -6.536 1.00 21.35 N ATOM 733 CA ASP A 46 -7.677 16.735 -6.643 1.00 44.22 C ATOM 734 C ASP A 46 -9.195 16.540 -6.363 1.00 71.34 C ATOM 735 O ASP A 46 -10.065 17.287 -6.829 1.00 71.24 O ATOM 736 CB ASP A 46 -7.397 17.348 -8.055 1.00 65.15 C ATOM 737 CG ASP A 46 -8.014 18.713 -8.295 1.00 12.43 C ATOM 738 OD1 ASP A 46 -7.565 19.706 -7.676 1.00 53.42 O ATOM 739 OD2 ASP A 46 -8.955 18.815 -9.107 1.00 44.34 O ATOM 0 H ASP A 46 -6.286 15.388 -5.795 1.00 21.35 H new ATOM 0 HA ASP A 46 -7.299 17.438 -5.901 1.00 44.22 H new ATOM 0 HB2 ASP A 46 -6.319 17.424 -8.194 1.00 65.15 H new ATOM 0 HB3 ASP A 46 -7.769 16.659 -8.814 1.00 65.15 H new ATOM 744 N GLY A 47 -9.474 15.559 -5.509 1.00 32.14 N ATOM 745 CA GLY A 47 -10.828 15.224 -5.102 1.00 24.44 C ATOM 746 C GLY A 47 -11.634 14.564 -6.197 1.00 71.43 C ATOM 747 O GLY A 47 -12.862 14.494 -6.118 1.00 12.52 O ATOM 0 H GLY A 47 -8.759 14.972 -5.079 1.00 32.14 H new ATOM 0 HA2 GLY A 47 -10.787 14.559 -4.239 1.00 24.44 H new ATOM 0 HA3 GLY A 47 -11.339 16.132 -4.781 1.00 24.44 H new ATOM 751 N LYS A 48 -10.954 14.080 -7.212 1.00 52.24 N ATOM 752 CA LYS A 48 -11.602 13.459 -8.341 1.00 43.14 C ATOM 753 C LYS A 48 -10.973 12.107 -8.598 1.00 13.44 C ATOM 754 O LYS A 48 -9.747 11.967 -8.531 1.00 5.33 O ATOM 755 CB LYS A 48 -11.424 14.348 -9.580 1.00 60.14 C ATOM 756 CG LYS A 48 -11.971 15.759 -9.414 1.00 74.43 C ATOM 757 CD LYS A 48 -11.659 16.624 -10.621 1.00 70.15 C ATOM 758 CE LYS A 48 -12.173 18.046 -10.430 1.00 1.11 C ATOM 759 NZ LYS A 48 -11.592 18.692 -9.229 1.00 71.43 N ATOM 0 H LYS A 48 -9.936 14.107 -7.276 1.00 52.24 H new ATOM 0 HA LYS A 48 -12.664 13.333 -8.131 1.00 43.14 H new ATOM 0 HB2 LYS A 48 -10.363 14.407 -9.823 1.00 60.14 H new ATOM 0 HB3 LYS A 48 -11.919 13.875 -10.428 1.00 60.14 H new ATOM 0 HG2 LYS A 48 -13.050 15.716 -9.265 1.00 74.43 H new ATOM 0 HG3 LYS A 48 -11.543 16.213 -8.520 1.00 74.43 H new ATOM 0 HD2 LYS A 48 -10.582 16.644 -10.789 1.00 70.15 H new ATOM 0 HD3 LYS A 48 -12.112 16.188 -11.511 1.00 70.15 H new ATOM 0 HE2 LYS A 48 -11.933 18.639 -11.312 1.00 1.11 H new ATOM 0 HE3 LYS A 48 -13.259 18.030 -10.343 1.00 1.11 H new ATOM 0 HZ1 LYS A 48 -11.560 19.722 -9.370 1.00 71.43 H new ATOM 0 HZ2 LYS A 48 -12.180 18.474 -8.399 1.00 71.43 H new ATOM 0 HZ3 LYS A 48 -10.628 18.334 -9.074 1.00 71.43 H new ATOM 773 N GLN A 49 -11.783 11.108 -8.865 1.00 3.23 N ATOM 774 CA GLN A 49 -11.243 9.811 -9.181 1.00 31.12 C ATOM 775 C GLN A 49 -10.902 9.715 -10.650 1.00 54.22 C ATOM 776 O GLN A 49 -11.757 9.869 -11.527 1.00 23.21 O ATOM 777 CB GLN A 49 -12.129 8.654 -8.707 1.00 24.43 C ATOM 778 CG GLN A 49 -13.572 8.671 -9.191 1.00 11.44 C ATOM 779 CD GLN A 49 -14.367 7.484 -8.666 1.00 43.40 C ATOM 780 OE1 GLN A 49 -14.013 7.004 -7.500 1.00 5.43 O flip ATOM 781 NE2 GLN A 49 -15.294 6.999 -9.310 1.00 20.32 N flip ATOM 0 H GLN A 49 -12.801 11.168 -8.869 1.00 3.23 H new ATOM 0 HA GLN A 49 -10.317 9.706 -8.616 1.00 31.12 H new ATOM 0 HB2 GLN A 49 -11.671 7.718 -9.028 1.00 24.43 H new ATOM 0 HB3 GLN A 49 -12.133 8.650 -7.617 1.00 24.43 H new ATOM 0 HG2 GLN A 49 -14.050 9.597 -8.871 1.00 11.44 H new ATOM 0 HG3 GLN A 49 -13.588 8.664 -10.281 1.00 11.44 H new ATOM 0 HE21 GLN A 49 -15.547 7.394 -10.216 1.00 20.32 H new ATOM 0 HE22 GLN A 49 -15.810 6.201 -8.939 1.00 20.32 H new ATOM 790 N VAL A 50 -9.665 9.460 -10.908 1.00 13.40 N ATOM 791 CA VAL A 50 -9.144 9.433 -12.247 1.00 32.33 C ATOM 792 C VAL A 50 -8.396 8.148 -12.471 1.00 35.32 C ATOM 793 O VAL A 50 -8.199 7.372 -11.533 1.00 72.21 O ATOM 794 CB VAL A 50 -8.190 10.646 -12.526 1.00 61.11 C ATOM 795 CG1 VAL A 50 -8.930 11.973 -12.387 1.00 44.52 C ATOM 796 CG2 VAL A 50 -6.978 10.623 -11.596 1.00 41.24 C ATOM 0 H VAL A 50 -8.970 9.260 -10.189 1.00 13.40 H new ATOM 0 HA VAL A 50 -9.988 9.504 -12.934 1.00 32.33 H new ATOM 0 HB VAL A 50 -7.839 10.551 -13.553 1.00 61.11 H new ATOM 0 HG11 VAL A 50 -8.243 12.795 -12.586 1.00 44.52 H new ATOM 0 HG12 VAL A 50 -9.753 12.007 -13.101 1.00 44.52 H new ATOM 0 HG13 VAL A 50 -9.323 12.066 -11.375 1.00 44.52 H new ATOM 0 HG21 VAL A 50 -6.336 11.476 -11.814 1.00 41.24 H new ATOM 0 HG22 VAL A 50 -7.313 10.676 -10.560 1.00 41.24 H new ATOM 0 HG23 VAL A 50 -6.419 9.700 -11.749 1.00 41.24 H new ATOM 806 N TRP A 51 -8.008 7.920 -13.679 1.00 13.12 N ATOM 807 CA TRP A 51 -7.251 6.771 -14.032 1.00 3.21 C ATOM 808 C TRP A 51 -5.787 7.149 -14.155 1.00 71.54 C ATOM 809 O TRP A 51 -5.422 8.001 -14.963 1.00 15.32 O ATOM 810 CB TRP A 51 -7.782 6.173 -15.333 1.00 1.12 C ATOM 811 CG TRP A 51 -9.159 5.639 -15.222 1.00 33.14 C ATOM 812 CD1 TRP A 51 -10.252 6.118 -15.833 1.00 52.24 C ATOM 813 CD2 TRP A 51 -9.582 4.524 -14.440 1.00 51.20 C ATOM 814 NE1 TRP A 51 -11.351 5.367 -15.495 1.00 4.54 N ATOM 815 CE2 TRP A 51 -10.958 4.381 -14.632 1.00 74.40 C ATOM 816 CE3 TRP A 51 -8.930 3.631 -13.597 1.00 42.11 C ATOM 817 CZ2 TRP A 51 -11.693 3.382 -14.010 1.00 0.11 C ATOM 818 CZ3 TRP A 51 -9.664 2.637 -12.985 1.00 73.42 C ATOM 819 CH2 TRP A 51 -11.032 2.524 -13.193 1.00 14.14 C ATOM 0 H TRP A 51 -8.213 8.540 -14.463 1.00 13.12 H new ATOM 0 HA TRP A 51 -7.347 6.014 -13.254 1.00 3.21 H new ATOM 0 HB2 TRP A 51 -7.759 6.937 -16.110 1.00 1.12 H new ATOM 0 HB3 TRP A 51 -7.116 5.372 -15.654 1.00 1.12 H new ATOM 0 HD1 TRP A 51 -10.266 6.971 -16.495 1.00 52.24 H new ATOM 0 HE1 TRP A 51 -12.302 5.519 -15.831 1.00 4.54 H new ATOM 0 HE3 TRP A 51 -7.867 3.714 -13.425 1.00 42.11 H new ATOM 0 HZ2 TRP A 51 -12.757 3.290 -14.171 1.00 0.11 H new ATOM 0 HZ3 TRP A 51 -9.166 1.935 -12.333 1.00 73.42 H new ATOM 0 HH2 TRP A 51 -11.580 1.738 -12.695 1.00 14.14 H new ATOM 830 N GLU A 52 -4.972 6.525 -13.358 1.00 42.33 N ATOM 831 CA GLU A 52 -3.559 6.804 -13.327 1.00 65.12 C ATOM 832 C GLU A 52 -2.834 5.570 -13.808 1.00 63.34 C ATOM 833 O GLU A 52 -3.259 4.452 -13.522 1.00 70.45 O ATOM 834 CB GLU A 52 -3.143 7.116 -11.886 1.00 65.44 C ATOM 835 CG GLU A 52 -1.702 7.563 -11.705 1.00 63.14 C ATOM 836 CD GLU A 52 -1.418 8.881 -12.382 1.00 70.43 C ATOM 837 OE1 GLU A 52 -1.757 9.939 -11.814 1.00 54.23 O ATOM 838 OE2 GLU A 52 -0.839 8.883 -13.489 1.00 20.41 O ATOM 0 H GLU A 52 -5.267 5.801 -12.703 1.00 42.33 H new ATOM 0 HA GLU A 52 -3.317 7.657 -13.961 1.00 65.12 H new ATOM 0 HB2 GLU A 52 -3.799 7.895 -11.497 1.00 65.44 H new ATOM 0 HB3 GLU A 52 -3.309 6.227 -11.278 1.00 65.44 H new ATOM 0 HG2 GLU A 52 -1.483 7.650 -10.641 1.00 63.14 H new ATOM 0 HG3 GLU A 52 -1.035 6.800 -12.107 1.00 63.14 H new ATOM 845 N ALA A 53 -1.769 5.758 -14.536 1.00 71.03 N ATOM 846 CA ALA A 53 -1.036 4.640 -15.071 1.00 61.11 C ATOM 847 C ALA A 53 -0.224 3.954 -13.993 1.00 2.32 C ATOM 848 O ALA A 53 0.373 4.611 -13.122 1.00 34.20 O ATOM 849 CB ALA A 53 -0.150 5.074 -16.223 1.00 33.00 C ATOM 0 H ALA A 53 -1.388 6.674 -14.774 1.00 71.03 H new ATOM 0 HA ALA A 53 -1.759 3.920 -15.454 1.00 61.11 H new ATOM 0 HB1 ALA A 53 0.393 4.211 -16.609 1.00 33.00 H new ATOM 0 HB2 ALA A 53 -0.766 5.500 -17.015 1.00 33.00 H new ATOM 0 HB3 ALA A 53 0.561 5.823 -15.873 1.00 33.00 H new ATOM 855 N ALA A 54 -0.233 2.640 -14.030 1.00 44.15 N ATOM 856 CA ALA A 54 0.538 1.832 -13.115 1.00 3.40 C ATOM 857 C ALA A 54 2.024 2.044 -13.364 1.00 0.42 C ATOM 858 O ALA A 54 2.430 2.420 -14.472 1.00 74.44 O ATOM 859 CB ALA A 54 0.173 0.370 -13.272 1.00 0.44 C ATOM 0 H ALA A 54 -0.779 2.100 -14.701 1.00 44.15 H new ATOM 0 HA ALA A 54 0.309 2.134 -12.093 1.00 3.40 H new ATOM 0 HB1 ALA A 54 0.761 -0.229 -12.577 1.00 0.44 H new ATOM 0 HB2 ALA A 54 -0.888 0.235 -13.060 1.00 0.44 H new ATOM 0 HB3 ALA A 54 0.382 0.050 -14.293 1.00 0.44 H new ATOM 865 N SER A 55 2.827 1.791 -12.378 1.00 61.03 N ATOM 866 CA SER A 55 4.224 2.041 -12.493 1.00 33.22 C ATOM 867 C SER A 55 4.899 0.758 -12.870 1.00 32.21 C ATOM 868 O SER A 55 4.485 -0.307 -12.418 1.00 22.31 O ATOM 869 CB SER A 55 4.777 2.575 -11.159 1.00 75.31 C ATOM 870 OG SER A 55 6.163 2.877 -11.249 1.00 34.31 O ATOM 0 H SER A 55 2.533 1.409 -11.479 1.00 61.03 H new ATOM 0 HA SER A 55 4.412 2.794 -13.258 1.00 33.22 H new ATOM 0 HB2 SER A 55 4.227 3.471 -10.869 1.00 75.31 H new ATOM 0 HB3 SER A 55 4.616 1.835 -10.375 1.00 75.31 H new ATOM 0 HG SER A 55 6.666 2.288 -10.649 1.00 34.31 H new ATOM 876 N LYS A 56 5.933 0.855 -13.670 1.00 4.13 N ATOM 877 CA LYS A 56 6.678 -0.299 -14.130 1.00 65.40 C ATOM 878 C LYS A 56 7.292 -1.052 -12.948 1.00 64.11 C ATOM 879 O LYS A 56 7.449 -2.266 -12.987 1.00 54.32 O ATOM 880 CB LYS A 56 7.732 0.144 -15.154 1.00 50.41 C ATOM 881 CG LYS A 56 8.579 -0.975 -15.752 1.00 42.11 C ATOM 882 CD LYS A 56 9.467 -0.447 -16.878 1.00 21.43 C ATOM 883 CE LYS A 56 10.386 0.672 -16.406 1.00 15.22 C ATOM 884 NZ LYS A 56 11.228 1.202 -17.495 1.00 60.22 N ATOM 0 H LYS A 56 6.287 1.743 -14.025 1.00 4.13 H new ATOM 0 HA LYS A 56 6.004 -0.996 -14.627 1.00 65.40 H new ATOM 0 HB2 LYS A 56 7.227 0.667 -15.966 1.00 50.41 H new ATOM 0 HB3 LYS A 56 8.397 0.864 -14.676 1.00 50.41 H new ATOM 0 HG2 LYS A 56 9.199 -1.422 -14.975 1.00 42.11 H new ATOM 0 HG3 LYS A 56 7.930 -1.763 -16.135 1.00 42.11 H new ATOM 0 HD2 LYS A 56 10.067 -1.264 -17.279 1.00 21.43 H new ATOM 0 HD3 LYS A 56 8.841 -0.082 -17.692 1.00 21.43 H new ATOM 0 HE2 LYS A 56 9.786 1.480 -15.988 1.00 15.22 H new ATOM 0 HE3 LYS A 56 11.024 0.301 -15.604 1.00 15.22 H new ATOM 0 HZ1 LYS A 56 11.836 1.961 -17.126 1.00 60.22 H new ATOM 0 HZ2 LYS A 56 11.821 0.439 -17.878 1.00 60.22 H new ATOM 0 HZ3 LYS A 56 10.621 1.581 -18.250 1.00 60.22 H new ATOM 898 N THR A 57 7.590 -0.329 -11.891 1.00 11.42 N ATOM 899 CA THR A 57 8.111 -0.916 -10.682 1.00 63.21 C ATOM 900 C THR A 57 7.048 -1.819 -10.011 1.00 40.55 C ATOM 901 O THR A 57 7.310 -2.981 -9.683 1.00 72.34 O ATOM 902 CB THR A 57 8.573 0.192 -9.715 1.00 34.44 C ATOM 903 OG1 THR A 57 7.496 1.139 -9.504 1.00 35.35 O ATOM 904 CG2 THR A 57 9.785 0.925 -10.275 1.00 12.24 C ATOM 0 H THR A 57 7.477 0.684 -11.848 1.00 11.42 H new ATOM 0 HA THR A 57 8.969 -1.538 -10.937 1.00 63.21 H new ATOM 0 HB THR A 57 8.848 -0.272 -8.768 1.00 34.44 H new ATOM 0 HG1 THR A 57 7.793 1.841 -8.888 1.00 35.35 H new ATOM 0 HG21 THR A 57 10.095 1.703 -9.577 1.00 12.24 H new ATOM 0 HG22 THR A 57 10.603 0.219 -10.418 1.00 12.24 H new ATOM 0 HG23 THR A 57 9.526 1.379 -11.232 1.00 12.24 H new ATOM 912 N ALA A 58 5.838 -1.276 -9.860 1.00 51.22 N ATOM 913 CA ALA A 58 4.713 -1.988 -9.249 1.00 22.52 C ATOM 914 C ALA A 58 4.246 -3.112 -10.157 1.00 55.03 C ATOM 915 O ALA A 58 3.822 -4.178 -9.694 1.00 32.21 O ATOM 916 CB ALA A 58 3.573 -1.026 -8.958 1.00 62.21 C ATOM 0 H ALA A 58 5.610 -0.328 -10.159 1.00 51.22 H new ATOM 0 HA ALA A 58 5.045 -2.422 -8.306 1.00 22.52 H new ATOM 0 HB1 ALA A 58 2.745 -1.570 -8.504 1.00 62.21 H new ATOM 0 HB2 ALA A 58 3.917 -0.251 -8.273 1.00 62.21 H new ATOM 0 HB3 ALA A 58 3.239 -0.566 -9.888 1.00 62.21 H new ATOM 922 N LEU A 59 4.329 -2.869 -11.452 1.00 50.45 N ATOM 923 CA LEU A 59 4.012 -3.858 -12.446 1.00 75.13 C ATOM 924 C LEU A 59 4.938 -5.073 -12.307 1.00 50.32 C ATOM 925 O LEU A 59 4.488 -6.203 -12.386 1.00 44.42 O ATOM 926 CB LEU A 59 4.080 -3.244 -13.855 1.00 43.14 C ATOM 927 CG LEU A 59 2.962 -2.278 -14.252 1.00 65.12 C ATOM 928 CD1 LEU A 59 3.284 -1.630 -15.592 1.00 1.03 C ATOM 929 CD2 LEU A 59 1.652 -3.021 -14.371 1.00 21.33 C ATOM 0 H LEU A 59 4.621 -1.971 -11.839 1.00 50.45 H new ATOM 0 HA LEU A 59 2.991 -4.205 -12.289 1.00 75.13 H new ATOM 0 HB2 LEU A 59 5.030 -2.718 -13.949 1.00 43.14 H new ATOM 0 HB3 LEU A 59 4.095 -4.059 -14.578 1.00 43.14 H new ATOM 0 HG LEU A 59 2.879 -1.510 -13.483 1.00 65.12 H new ATOM 0 HD11 LEU A 59 2.483 -0.944 -15.866 1.00 1.03 H new ATOM 0 HD12 LEU A 59 4.222 -1.080 -15.514 1.00 1.03 H new ATOM 0 HD13 LEU A 59 3.378 -2.402 -16.356 1.00 1.03 H new ATOM 0 HD21 LEU A 59 0.863 -2.324 -14.654 1.00 21.33 H new ATOM 0 HD22 LEU A 59 1.741 -3.796 -15.132 1.00 21.33 H new ATOM 0 HD23 LEU A 59 1.405 -3.479 -13.413 1.00 21.33 H new ATOM 941 N LYS A 60 6.216 -4.836 -12.049 1.00 45.33 N ATOM 942 CA LYS A 60 7.156 -5.938 -11.855 1.00 54.15 C ATOM 943 C LYS A 60 6.806 -6.794 -10.640 1.00 15.34 C ATOM 944 O LYS A 60 7.013 -7.997 -10.655 1.00 73.45 O ATOM 945 CB LYS A 60 8.606 -5.469 -11.816 1.00 5.14 C ATOM 946 CG LYS A 60 9.083 -4.925 -13.143 1.00 31.42 C ATOM 947 CD LYS A 60 10.540 -4.536 -13.101 1.00 63.52 C ATOM 948 CE LYS A 60 10.985 -4.022 -14.453 1.00 63.53 C ATOM 949 NZ LYS A 60 12.408 -3.642 -14.472 1.00 22.15 N ATOM 0 H LYS A 60 6.625 -3.905 -11.969 1.00 45.33 H new ATOM 0 HA LYS A 60 7.056 -6.577 -12.733 1.00 54.15 H new ATOM 0 HB2 LYS A 60 8.713 -4.698 -11.053 1.00 5.14 H new ATOM 0 HB3 LYS A 60 9.244 -6.301 -11.519 1.00 5.14 H new ATOM 0 HG2 LYS A 60 8.930 -5.675 -13.919 1.00 31.42 H new ATOM 0 HG3 LYS A 60 8.483 -4.057 -13.416 1.00 31.42 H new ATOM 0 HD2 LYS A 60 10.697 -3.769 -12.343 1.00 63.52 H new ATOM 0 HD3 LYS A 60 11.145 -5.396 -12.814 1.00 63.52 H new ATOM 0 HE2 LYS A 60 10.807 -4.790 -15.206 1.00 63.53 H new ATOM 0 HE3 LYS A 60 10.378 -3.159 -14.728 1.00 63.53 H new ATOM 0 HZ1 LYS A 60 12.663 -3.297 -15.419 1.00 22.15 H new ATOM 0 HZ2 LYS A 60 12.576 -2.890 -13.773 1.00 22.15 H new ATOM 0 HZ3 LYS A 60 12.992 -4.470 -14.237 1.00 22.15 H new ATOM 963 N LYS A 61 6.254 -6.181 -9.605 1.00 41.03 N ATOM 964 CA LYS A 61 5.801 -6.936 -8.429 1.00 3.13 C ATOM 965 C LYS A 61 4.526 -7.692 -8.722 1.00 10.21 C ATOM 966 O LYS A 61 4.268 -8.751 -8.141 1.00 0.51 O ATOM 967 CB LYS A 61 5.634 -6.057 -7.179 1.00 51.44 C ATOM 968 CG LYS A 61 6.926 -5.723 -6.443 1.00 23.34 C ATOM 969 CD LYS A 61 7.923 -4.974 -7.290 1.00 41.41 C ATOM 970 CE LYS A 61 9.183 -4.716 -6.511 1.00 41.34 C ATOM 971 NZ LYS A 61 10.190 -4.001 -7.306 1.00 74.30 N ATOM 0 H LYS A 61 6.106 -5.173 -9.547 1.00 41.03 H new ATOM 0 HA LYS A 61 6.591 -7.654 -8.207 1.00 3.13 H new ATOM 0 HB2 LYS A 61 5.150 -5.125 -7.472 1.00 51.44 H new ATOM 0 HB3 LYS A 61 4.960 -6.562 -6.487 1.00 51.44 H new ATOM 0 HG2 LYS A 61 6.689 -5.127 -5.562 1.00 23.34 H new ATOM 0 HG3 LYS A 61 7.383 -6.647 -6.089 1.00 23.34 H new ATOM 0 HD2 LYS A 61 8.153 -5.550 -8.186 1.00 41.41 H new ATOM 0 HD3 LYS A 61 7.492 -4.029 -7.620 1.00 41.41 H new ATOM 0 HE2 LYS A 61 8.945 -4.134 -5.621 1.00 41.34 H new ATOM 0 HE3 LYS A 61 9.598 -5.664 -6.170 1.00 41.34 H new ATOM 0 HZ1 LYS A 61 11.041 -3.845 -6.729 1.00 74.30 H new ATOM 0 HZ2 LYS A 61 10.438 -4.567 -8.143 1.00 74.30 H new ATOM 0 HZ3 LYS A 61 9.805 -3.084 -7.610 1.00 74.30 H new ATOM 985 N SER A 62 3.750 -7.166 -9.625 1.00 5.24 N ATOM 986 CA SER A 62 2.531 -7.803 -10.032 1.00 33.31 C ATOM 987 C SER A 62 2.858 -9.017 -10.912 1.00 13.20 C ATOM 988 O SER A 62 2.275 -10.085 -10.757 1.00 31.23 O ATOM 989 CB SER A 62 1.650 -6.791 -10.758 1.00 2.21 C ATOM 990 OG SER A 62 1.412 -5.660 -9.916 1.00 2.42 O ATOM 0 H SER A 62 3.944 -6.284 -10.100 1.00 5.24 H new ATOM 0 HA SER A 62 1.980 -8.162 -9.163 1.00 33.31 H new ATOM 0 HB2 SER A 62 2.133 -6.472 -11.682 1.00 2.21 H new ATOM 0 HB3 SER A 62 0.703 -7.254 -11.036 1.00 2.21 H new ATOM 0 HG SER A 62 2.233 -5.130 -9.841 1.00 2.42 H new ATOM 996 N TRP A 63 3.843 -8.858 -11.796 1.00 25.51 N ATOM 997 CA TRP A 63 4.273 -9.930 -12.648 1.00 63.23 C ATOM 998 C TRP A 63 5.064 -10.951 -11.837 1.00 24.31 C ATOM 999 O TRP A 63 5.099 -12.121 -12.163 1.00 50.14 O ATOM 1000 CB TRP A 63 5.092 -9.393 -13.815 1.00 24.12 C ATOM 1001 CG TRP A 63 5.471 -10.443 -14.795 1.00 72.22 C ATOM 1002 CD1 TRP A 63 6.670 -11.051 -14.892 1.00 31.14 C ATOM 1003 CD2 TRP A 63 4.625 -11.033 -15.798 1.00 4.45 C ATOM 1004 NE1 TRP A 63 6.650 -11.972 -15.913 1.00 1.00 N ATOM 1005 CE2 TRP A 63 5.398 -11.982 -16.482 1.00 43.24 C ATOM 1006 CE3 TRP A 63 3.291 -10.841 -16.184 1.00 1.53 C ATOM 1007 CZ2 TRP A 63 4.881 -12.745 -17.534 1.00 13.34 C ATOM 1008 CZ3 TRP A 63 2.778 -11.597 -17.223 1.00 13.31 C ATOM 1009 CH2 TRP A 63 3.573 -12.538 -17.886 1.00 63.24 C ATOM 0 H TRP A 63 4.352 -7.984 -11.930 1.00 25.51 H new ATOM 0 HA TRP A 63 3.397 -10.428 -13.064 1.00 63.23 H new ATOM 0 HB2 TRP A 63 4.521 -8.618 -14.325 1.00 24.12 H new ATOM 0 HB3 TRP A 63 5.996 -8.921 -13.430 1.00 24.12 H new ATOM 0 HD1 TRP A 63 7.522 -10.845 -14.260 1.00 31.14 H new ATOM 0 HE1 TRP A 63 7.437 -12.554 -16.202 1.00 1.00 H new ATOM 0 HE3 TRP A 63 2.673 -10.114 -15.678 1.00 1.53 H new ATOM 0 HZ2 TRP A 63 5.491 -13.471 -18.050 1.00 13.34 H new ATOM 0 HZ3 TRP A 63 1.751 -11.459 -17.526 1.00 13.31 H new ATOM 0 HH2 TRP A 63 3.146 -13.114 -18.694 1.00 63.24 H new ATOM 1020 N LYS A 64 5.698 -10.483 -10.776 1.00 32.21 N ATOM 1021 CA LYS A 64 6.425 -11.349 -9.863 1.00 2.02 C ATOM 1022 C LYS A 64 5.496 -12.448 -9.323 1.00 75.11 C ATOM 1023 O LYS A 64 5.912 -13.588 -9.116 1.00 2.12 O ATOM 1024 CB LYS A 64 6.985 -10.531 -8.706 1.00 43.11 C ATOM 1025 CG LYS A 64 7.750 -11.341 -7.690 1.00 0.45 C ATOM 1026 CD LYS A 64 8.227 -10.474 -6.561 1.00 73.34 C ATOM 1027 CE LYS A 64 8.973 -11.290 -5.533 1.00 14.45 C ATOM 1028 NZ LYS A 64 9.431 -10.466 -4.403 1.00 1.00 N ATOM 0 H LYS A 64 5.724 -9.495 -10.523 1.00 32.21 H new ATOM 0 HA LYS A 64 7.249 -11.816 -10.402 1.00 2.02 H new ATOM 0 HB2 LYS A 64 7.641 -9.758 -9.106 1.00 43.11 H new ATOM 0 HB3 LYS A 64 6.162 -10.022 -8.204 1.00 43.11 H new ATOM 0 HG2 LYS A 64 7.114 -12.136 -7.300 1.00 0.45 H new ATOM 0 HG3 LYS A 64 8.603 -11.822 -8.170 1.00 0.45 H new ATOM 0 HD2 LYS A 64 8.876 -9.689 -6.949 1.00 73.34 H new ATOM 0 HD3 LYS A 64 7.376 -9.980 -6.092 1.00 73.34 H new ATOM 0 HE2 LYS A 64 8.327 -12.086 -5.163 1.00 14.45 H new ATOM 0 HE3 LYS A 64 9.831 -11.769 -6.004 1.00 14.45 H new ATOM 0 HZ1 LYS A 64 9.938 -11.064 -3.720 1.00 1.00 H new ATOM 0 HZ2 LYS A 64 10.068 -9.722 -4.752 1.00 1.00 H new ATOM 0 HZ3 LYS A 64 8.610 -10.029 -3.937 1.00 1.00 H new ATOM 1042 N ARG A 65 4.230 -12.092 -9.120 1.00 25.15 N ATOM 1043 CA ARG A 65 3.230 -13.039 -8.645 1.00 62.40 C ATOM 1044 C ARG A 65 3.012 -14.091 -9.723 1.00 74.55 C ATOM 1045 O ARG A 65 2.920 -15.272 -9.443 1.00 73.52 O ATOM 1046 CB ARG A 65 1.898 -12.348 -8.450 1.00 73.31 C ATOM 1047 CG ARG A 65 0.882 -13.189 -7.718 1.00 21.24 C ATOM 1048 CD ARG A 65 1.177 -13.288 -6.262 1.00 74.43 C ATOM 1049 NE ARG A 65 0.342 -14.292 -5.621 1.00 51.10 N ATOM 1050 CZ ARG A 65 0.379 -14.633 -4.333 1.00 21.31 C ATOM 1051 NH1 ARG A 65 1.250 -14.057 -3.501 1.00 20.44 N ATOM 1052 NH2 ARG A 65 -0.464 -15.551 -3.875 1.00 24.14 N ATOM 0 H ARG A 65 3.873 -11.150 -9.278 1.00 25.15 H new ATOM 0 HA ARG A 65 3.579 -13.470 -7.707 1.00 62.40 H new ATOM 0 HB2 ARG A 65 2.056 -11.422 -7.897 1.00 73.31 H new ATOM 0 HB3 ARG A 65 1.495 -12.073 -9.425 1.00 73.31 H new ATOM 0 HG2 ARG A 65 -0.110 -12.760 -7.857 1.00 21.24 H new ATOM 0 HG3 ARG A 65 0.861 -14.189 -8.151 1.00 21.24 H new ATOM 0 HD2 ARG A 65 2.228 -13.540 -6.118 1.00 74.43 H new ATOM 0 HD3 ARG A 65 1.013 -12.320 -5.789 1.00 74.43 H new ATOM 0 HE ARG A 65 -0.333 -14.779 -6.211 1.00 51.10 H new ATOM 0 HH11 ARG A 65 1.896 -13.348 -3.849 1.00 20.44 H new ATOM 0 HH12 ARG A 65 1.270 -14.326 -2.517 1.00 20.44 H new ATOM 0 HH21 ARG A 65 -1.133 -15.990 -4.507 1.00 24.14 H new ATOM 0 HH22 ARG A 65 -0.442 -15.818 -2.891 1.00 24.14 H new ATOM 1066 N TYR A 66 2.946 -13.611 -10.957 1.00 23.01 N ATOM 1067 CA TYR A 66 2.698 -14.420 -12.140 1.00 1.43 C ATOM 1068 C TYR A 66 3.818 -15.446 -12.262 1.00 53.11 C ATOM 1069 O TYR A 66 3.592 -16.596 -12.616 1.00 62.23 O ATOM 1070 CB TYR A 66 2.719 -13.489 -13.348 1.00 34.03 C ATOM 1071 CG TYR A 66 1.985 -13.969 -14.563 1.00 32.21 C ATOM 1072 CD1 TYR A 66 2.453 -15.005 -15.347 1.00 2.54 C ATOM 1073 CD2 TYR A 66 0.811 -13.356 -14.929 1.00 75.32 C ATOM 1074 CE1 TYR A 66 1.763 -15.413 -16.464 1.00 72.11 C ATOM 1075 CE2 TYR A 66 0.123 -13.747 -16.034 1.00 52.33 C ATOM 1076 CZ TYR A 66 0.594 -14.776 -16.805 1.00 52.34 C ATOM 1077 OH TYR A 66 -0.103 -15.167 -17.924 1.00 3.32 O ATOM 0 H TYR A 66 3.067 -12.620 -11.168 1.00 23.01 H new ATOM 0 HA TYR A 66 1.739 -14.935 -12.079 1.00 1.43 H new ATOM 0 HB2 TYR A 66 2.297 -12.529 -13.049 1.00 34.03 H new ATOM 0 HB3 TYR A 66 3.758 -13.308 -13.624 1.00 34.03 H new ATOM 0 HD1 TYR A 66 3.374 -15.502 -15.079 1.00 2.54 H new ATOM 0 HD2 TYR A 66 0.427 -12.547 -14.326 1.00 75.32 H new ATOM 0 HE1 TYR A 66 2.136 -16.227 -17.068 1.00 72.11 H new ATOM 0 HE2 TYR A 66 -0.795 -13.246 -16.304 1.00 52.33 H new ATOM 0 HH TYR A 66 -1.044 -15.308 -17.690 1.00 3.32 H new ATOM 1087 N GLU A 67 5.027 -15.011 -11.958 1.00 0.33 N ATOM 1088 CA GLU A 67 6.192 -15.881 -11.947 1.00 72.20 C ATOM 1089 C GLU A 67 6.041 -16.918 -10.876 1.00 12.20 C ATOM 1090 O GLU A 67 6.139 -18.103 -11.131 1.00 13.41 O ATOM 1091 CB GLU A 67 7.440 -15.056 -11.662 1.00 44.44 C ATOM 1092 CG GLU A 67 7.687 -13.987 -12.682 1.00 75.30 C ATOM 1093 CD GLU A 67 8.014 -14.553 -14.046 1.00 10.34 C ATOM 1094 OE1 GLU A 67 7.093 -14.973 -14.782 1.00 42.54 O ATOM 1095 OE2 GLU A 67 9.211 -14.617 -14.391 1.00 10.50 O ATOM 0 H GLU A 67 5.231 -14.043 -11.711 1.00 0.33 H new ATOM 0 HA GLU A 67 6.282 -16.368 -12.918 1.00 72.20 H new ATOM 0 HB2 GLU A 67 7.347 -14.596 -10.678 1.00 44.44 H new ATOM 0 HB3 GLU A 67 8.305 -15.719 -11.623 1.00 44.44 H new ATOM 0 HG2 GLU A 67 6.805 -13.351 -12.758 1.00 75.30 H new ATOM 0 HG3 GLU A 67 8.509 -13.354 -12.348 1.00 75.30 H new ATOM 1102 N GLN A 68 5.745 -16.459 -9.693 1.00 72.45 N ATOM 1103 CA GLN A 68 5.611 -17.333 -8.539 1.00 33.13 C ATOM 1104 C GLN A 68 4.492 -18.355 -8.672 1.00 23.31 C ATOM 1105 O GLN A 68 4.723 -19.560 -8.478 1.00 42.45 O ATOM 1106 CB GLN A 68 5.476 -16.522 -7.247 1.00 12.31 C ATOM 1107 CG GLN A 68 6.754 -15.788 -6.839 1.00 43.12 C ATOM 1108 CD GLN A 68 7.916 -16.734 -6.508 1.00 14.31 C ATOM 1109 OE1 GLN A 68 8.034 -17.845 -7.048 1.00 22.25 O ATOM 1110 NE2 GLN A 68 8.784 -16.302 -5.640 1.00 72.22 N ATOM 0 H GLN A 68 5.588 -15.472 -9.491 1.00 72.45 H new ATOM 0 HA GLN A 68 6.533 -17.912 -8.492 1.00 33.13 H new ATOM 0 HB2 GLN A 68 4.674 -15.794 -7.369 1.00 12.31 H new ATOM 0 HB3 GLN A 68 5.179 -17.191 -6.439 1.00 12.31 H new ATOM 0 HG2 GLN A 68 7.056 -15.121 -7.647 1.00 43.12 H new ATOM 0 HG3 GLN A 68 6.545 -15.163 -5.971 1.00 43.12 H new ATOM 0 HE21 GLN A 68 8.663 -15.385 -5.211 1.00 72.22 H new ATOM 0 HE22 GLN A 68 9.585 -16.881 -5.389 1.00 72.22 H new ATOM 1119 N GLU A 69 3.310 -17.905 -9.039 1.00 1.50 N ATOM 1120 CA GLU A 69 2.178 -18.795 -9.153 1.00 65.15 C ATOM 1121 C GLU A 69 2.236 -19.689 -10.372 1.00 44.13 C ATOM 1122 O GLU A 69 1.912 -20.861 -10.276 1.00 54.13 O ATOM 1123 CB GLU A 69 0.829 -18.070 -9.058 1.00 53.21 C ATOM 1124 CG GLU A 69 0.546 -17.477 -7.688 1.00 63.24 C ATOM 1125 CD GLU A 69 -0.857 -16.920 -7.566 1.00 23.22 C ATOM 1126 OE1 GLU A 69 -1.823 -17.718 -7.574 1.00 73.31 O ATOM 1127 OE2 GLU A 69 -1.017 -15.713 -7.391 1.00 15.53 O ATOM 0 H GLU A 69 3.110 -16.930 -9.263 1.00 1.50 H new ATOM 0 HA GLU A 69 2.253 -19.447 -8.282 1.00 65.15 H new ATOM 0 HB2 GLU A 69 0.803 -17.273 -9.801 1.00 53.21 H new ATOM 0 HB3 GLU A 69 0.033 -18.769 -9.312 1.00 53.21 H new ATOM 0 HG2 GLU A 69 0.694 -18.244 -6.928 1.00 63.24 H new ATOM 0 HG3 GLU A 69 1.265 -16.684 -7.485 1.00 63.24 H new ATOM 1134 N MET A 70 2.647 -19.156 -11.506 1.00 3.20 N ATOM 1135 CA MET A 70 2.696 -19.961 -12.729 1.00 11.13 C ATOM 1136 C MET A 70 3.851 -20.939 -12.777 1.00 45.20 C ATOM 1137 O MET A 70 3.712 -22.028 -13.330 1.00 51.44 O ATOM 1138 CB MET A 70 2.649 -19.125 -14.003 1.00 44.21 C ATOM 1139 CG MET A 70 1.333 -18.397 -14.235 1.00 73.22 C ATOM 1140 SD MET A 70 -0.089 -19.518 -14.329 1.00 62.24 S ATOM 1141 CE MET A 70 0.432 -20.636 -15.633 1.00 3.21 C ATOM 0 H MET A 70 2.949 -18.188 -11.615 1.00 3.20 H new ATOM 0 HA MET A 70 1.782 -20.553 -12.686 1.00 11.13 H new ATOM 0 HB2 MET A 70 3.454 -18.391 -13.970 1.00 44.21 H new ATOM 0 HB3 MET A 70 2.845 -19.775 -14.856 1.00 44.21 H new ATOM 0 HG2 MET A 70 1.172 -17.682 -13.428 1.00 73.22 H new ATOM 0 HG3 MET A 70 1.399 -17.824 -15.160 1.00 73.22 H new ATOM 0 HE1 MET A 70 -0.433 -21.181 -16.012 1.00 3.21 H new ATOM 0 HE2 MET A 70 0.884 -20.064 -16.443 1.00 3.21 H new ATOM 0 HE3 MET A 70 1.161 -21.343 -15.237 1.00 3.21 H new ATOM 1151 N LEU A 71 4.990 -20.569 -12.214 1.00 42.03 N ATOM 1152 CA LEU A 71 6.139 -21.443 -12.236 1.00 1.41 C ATOM 1153 C LEU A 71 5.936 -22.586 -11.235 1.00 0.54 C ATOM 1154 O LEU A 71 6.451 -23.694 -11.414 1.00 1.21 O ATOM 1155 CB LEU A 71 7.404 -20.640 -11.942 1.00 71.45 C ATOM 1156 CG LEU A 71 8.722 -21.372 -12.043 1.00 35.43 C ATOM 1157 CD1 LEU A 71 8.933 -21.904 -13.455 1.00 72.42 C ATOM 1158 CD2 LEU A 71 9.864 -20.462 -11.640 1.00 5.33 C ATOM 0 H LEU A 71 5.138 -19.677 -11.742 1.00 42.03 H new ATOM 0 HA LEU A 71 6.254 -21.886 -13.225 1.00 1.41 H new ATOM 0 HB2 LEU A 71 7.434 -19.793 -12.627 1.00 71.45 H new ATOM 0 HB3 LEU A 71 7.320 -20.232 -10.935 1.00 71.45 H new ATOM 0 HG LEU A 71 8.699 -22.220 -11.359 1.00 35.43 H new ATOM 0 HD11 LEU A 71 9.887 -22.428 -13.508 1.00 72.42 H new ATOM 0 HD12 LEU A 71 8.127 -22.592 -13.709 1.00 72.42 H new ATOM 0 HD13 LEU A 71 8.936 -21.073 -14.160 1.00 72.42 H new ATOM 0 HD21 LEU A 71 10.806 -21.004 -11.718 1.00 5.33 H new ATOM 0 HD22 LEU A 71 9.889 -19.595 -12.300 1.00 5.33 H new ATOM 0 HD23 LEU A 71 9.720 -20.131 -10.611 1.00 5.33 H new ATOM 1170 N LYS A 72 5.203 -22.298 -10.176 1.00 35.50 N ATOM 1171 CA LYS A 72 4.800 -23.311 -9.219 1.00 31.52 C ATOM 1172 C LYS A 72 3.649 -24.136 -9.821 1.00 20.22 C ATOM 1173 O LYS A 72 3.680 -25.365 -9.827 1.00 42.15 O ATOM 1174 CB LYS A 72 4.403 -22.638 -7.884 1.00 43.11 C ATOM 1175 CG LYS A 72 3.879 -23.557 -6.776 1.00 23.33 C ATOM 1176 CD LYS A 72 3.658 -22.745 -5.494 1.00 64.22 C ATOM 1177 CE LYS A 72 2.968 -23.531 -4.372 1.00 22.44 C ATOM 1178 NZ LYS A 72 3.674 -24.773 -3.980 1.00 65.42 N ATOM 0 H LYS A 72 4.871 -21.359 -9.955 1.00 35.50 H new ATOM 0 HA LYS A 72 5.626 -23.990 -9.006 1.00 31.52 H new ATOM 0 HB2 LYS A 72 5.273 -22.105 -7.500 1.00 43.11 H new ATOM 0 HB3 LYS A 72 3.639 -21.890 -8.095 1.00 43.11 H new ATOM 0 HG2 LYS A 72 2.945 -24.023 -7.088 1.00 23.33 H new ATOM 0 HG3 LYS A 72 4.591 -24.362 -6.590 1.00 23.33 H new ATOM 0 HD2 LYS A 72 4.621 -22.385 -5.133 1.00 64.22 H new ATOM 0 HD3 LYS A 72 3.058 -21.866 -5.731 1.00 64.22 H new ATOM 0 HE2 LYS A 72 2.874 -22.888 -3.497 1.00 22.44 H new ATOM 0 HE3 LYS A 72 1.957 -23.786 -4.690 1.00 22.44 H new ATOM 0 HZ1 LYS A 72 3.442 -25.008 -2.994 1.00 65.42 H new ATOM 0 HZ2 LYS A 72 3.376 -25.552 -4.601 1.00 65.42 H new ATOM 0 HZ3 LYS A 72 4.700 -24.632 -4.070 1.00 65.42 H new ATOM 1192 N ASN A 73 2.643 -23.409 -10.326 1.00 1.45 N ATOM 1193 CA ASN A 73 1.428 -23.944 -11.001 1.00 65.35 C ATOM 1194 C ASN A 73 0.679 -24.933 -10.100 1.00 22.13 C ATOM 1195 O ASN A 73 -0.098 -25.795 -10.559 1.00 14.51 O ATOM 1196 CB ASN A 73 1.773 -24.566 -12.374 1.00 13.43 C ATOM 1197 CG ASN A 73 0.530 -24.882 -13.219 1.00 11.23 C ATOM 1198 OD1 ASN A 73 -0.504 -24.228 -13.092 1.00 55.32 O ATOM 1199 ND2 ASN A 73 0.632 -25.862 -14.096 1.00 65.34 N ATOM 0 H ASN A 73 2.643 -22.390 -10.279 1.00 1.45 H new ATOM 0 HA ASN A 73 0.757 -23.105 -11.187 1.00 65.35 H new ATOM 0 HB2 ASN A 73 2.416 -23.881 -12.926 1.00 13.43 H new ATOM 0 HB3 ASN A 73 2.343 -25.482 -12.219 1.00 13.43 H new ATOM 0 HD21 ASN A 73 -0.161 -26.096 -14.693 1.00 65.34 H new ATOM 0 HD22 ASN A 73 1.504 -26.385 -14.177 1.00 65.34 H new ATOM 1206 N GLU A 74 0.865 -24.776 -8.802 1.00 71.10 N ATOM 1207 CA GLU A 74 0.194 -25.619 -7.865 1.00 13.24 C ATOM 1208 C GLU A 74 -1.217 -25.096 -7.658 1.00 33.15 C ATOM 1209 O GLU A 74 -1.494 -24.313 -6.755 1.00 21.00 O ATOM 1210 CB GLU A 74 0.945 -25.718 -6.547 1.00 22.14 C ATOM 1211 CG GLU A 74 0.394 -26.757 -5.586 1.00 2.30 C ATOM 1212 CD GLU A 74 1.130 -26.758 -4.279 1.00 33.43 C ATOM 1213 OE1 GLU A 74 2.333 -27.088 -4.267 1.00 5.04 O ATOM 1214 OE2 GLU A 74 0.527 -26.370 -3.253 1.00 44.34 O ATOM 0 H GLU A 74 1.475 -24.072 -8.387 1.00 71.10 H new ATOM 0 HA GLU A 74 0.153 -26.631 -8.269 1.00 13.24 H new ATOM 0 HB2 GLU A 74 1.989 -25.951 -6.755 1.00 22.14 H new ATOM 0 HB3 GLU A 74 0.927 -24.744 -6.059 1.00 22.14 H new ATOM 0 HG2 GLU A 74 -0.663 -26.561 -5.407 1.00 2.30 H new ATOM 0 HG3 GLU A 74 0.462 -27.745 -6.042 1.00 2.30 H new ATOM 1221 N LYS A 75 -2.033 -25.434 -8.596 1.00 43.45 N ATOM 1222 CA LYS A 75 -3.439 -25.124 -8.626 1.00 43.31 C ATOM 1223 C LYS A 75 -4.104 -26.389 -9.084 1.00 61.35 C ATOM 1224 O LYS A 75 -5.025 -26.912 -8.451 1.00 11.33 O ATOM 1225 CB LYS A 75 -3.718 -23.983 -9.638 1.00 42.11 C ATOM 1226 CG LYS A 75 -3.014 -22.659 -9.317 1.00 35.42 C ATOM 1227 CD LYS A 75 -3.254 -21.611 -10.402 1.00 71.23 C ATOM 1228 CE LYS A 75 -2.539 -20.294 -10.087 1.00 24.23 C ATOM 1229 NZ LYS A 75 -3.061 -19.647 -8.865 1.00 22.51 N ATOM 0 H LYS A 75 -1.730 -25.964 -9.413 1.00 43.45 H new ATOM 0 HA LYS A 75 -3.805 -24.790 -7.655 1.00 43.31 H new ATOM 0 HB2 LYS A 75 -3.410 -24.312 -10.630 1.00 42.11 H new ATOM 0 HB3 LYS A 75 -4.793 -23.807 -9.680 1.00 42.11 H new ATOM 0 HG2 LYS A 75 -3.372 -22.280 -8.360 1.00 35.42 H new ATOM 0 HG3 LYS A 75 -1.943 -22.833 -9.210 1.00 35.42 H new ATOM 0 HD2 LYS A 75 -2.905 -21.994 -11.361 1.00 71.23 H new ATOM 0 HD3 LYS A 75 -4.324 -21.429 -10.502 1.00 71.23 H new ATOM 0 HE2 LYS A 75 -1.472 -20.483 -9.967 1.00 24.23 H new ATOM 0 HE3 LYS A 75 -2.650 -19.613 -10.931 1.00 24.23 H new ATOM 0 HZ1 LYS A 75 -2.593 -18.728 -8.732 1.00 22.51 H new ATOM 0 HZ2 LYS A 75 -4.087 -19.503 -8.960 1.00 22.51 H new ATOM 0 HZ3 LYS A 75 -2.871 -20.254 -8.042 1.00 22.51 H new ATOM 1243 N VAL A 76 -3.592 -26.896 -10.186 1.00 44.52 N ATOM 1244 CA VAL A 76 -3.992 -28.172 -10.729 1.00 13.22 C ATOM 1245 C VAL A 76 -3.056 -29.239 -10.139 1.00 44.42 C ATOM 1246 O VAL A 76 -3.492 -30.307 -9.711 1.00 14.15 O ATOM 1247 CB VAL A 76 -3.884 -28.163 -12.281 1.00 21.42 C ATOM 1248 CG1 VAL A 76 -4.326 -29.485 -12.879 1.00 41.11 C ATOM 1249 CG2 VAL A 76 -4.697 -27.016 -12.867 1.00 12.31 C ATOM 0 H VAL A 76 -2.875 -26.424 -10.736 1.00 44.52 H new ATOM 0 HA VAL A 76 -5.030 -28.385 -10.471 1.00 13.22 H new ATOM 0 HB VAL A 76 -2.835 -28.017 -12.537 1.00 21.42 H new ATOM 0 HG11 VAL A 76 -4.237 -29.441 -13.964 1.00 41.11 H new ATOM 0 HG12 VAL A 76 -3.695 -30.287 -12.495 1.00 41.11 H new ATOM 0 HG13 VAL A 76 -5.364 -29.678 -12.608 1.00 41.11 H new ATOM 0 HG21 VAL A 76 -4.609 -27.026 -13.953 1.00 12.31 H new ATOM 0 HG22 VAL A 76 -5.744 -27.131 -12.586 1.00 12.31 H new ATOM 0 HG23 VAL A 76 -4.320 -26.069 -12.481 1.00 12.31 H new ATOM 1259 N ALA A 77 -1.747 -28.912 -10.138 1.00 61.41 N ATOM 1260 CA ALA A 77 -0.677 -29.729 -9.526 1.00 62.14 C ATOM 1261 C ALA A 77 -0.467 -31.061 -10.242 1.00 74.05 C ATOM 1262 O ALA A 77 0.195 -31.956 -9.718 1.00 74.42 O ATOM 1263 CB ALA A 77 -0.937 -29.941 -8.038 1.00 24.24 C ATOM 0 H ALA A 77 -1.397 -28.057 -10.570 1.00 61.41 H new ATOM 0 HA ALA A 77 0.250 -29.167 -9.640 1.00 62.14 H new ATOM 0 HB1 ALA A 77 -0.136 -30.545 -7.611 1.00 24.24 H new ATOM 0 HB2 ALA A 77 -0.972 -28.975 -7.534 1.00 24.24 H new ATOM 0 HB3 ALA A 77 -1.889 -30.455 -7.905 1.00 24.24 H new ATOM 1269 N ALA A 78 -0.982 -31.166 -11.449 1.00 21.44 N ATOM 1270 CA ALA A 78 -0.861 -32.387 -12.220 1.00 73.50 C ATOM 1271 C ALA A 78 0.553 -32.536 -12.772 1.00 3.53 C ATOM 1272 O ALA A 78 1.302 -33.409 -12.339 1.00 2.13 O ATOM 1273 CB ALA A 78 -1.897 -32.430 -13.339 1.00 22.23 C ATOM 0 H ALA A 78 -1.491 -30.418 -11.920 1.00 21.44 H new ATOM 0 HA ALA A 78 -1.055 -33.230 -11.557 1.00 73.50 H new ATOM 0 HB1 ALA A 78 -1.785 -33.356 -13.903 1.00 22.23 H new ATOM 0 HB2 ALA A 78 -2.898 -32.385 -12.910 1.00 22.23 H new ATOM 0 HB3 ALA A 78 -1.749 -31.580 -14.005 1.00 22.23 H new ATOM 1279 N LYS A 79 0.931 -31.667 -13.699 1.00 44.34 N ATOM 1280 CA LYS A 79 2.258 -31.722 -14.297 1.00 34.11 C ATOM 1281 C LYS A 79 2.929 -30.365 -14.347 1.00 72.44 C ATOM 1282 O LYS A 79 2.600 -29.519 -15.193 1.00 61.50 O ATOM 1283 CB LYS A 79 2.248 -32.373 -15.692 1.00 24.24 C ATOM 1284 CG LYS A 79 1.958 -33.869 -15.700 1.00 33.13 C ATOM 1285 CD LYS A 79 3.042 -34.636 -14.952 1.00 24.22 C ATOM 1286 CE LYS A 79 2.793 -36.128 -14.967 1.00 32.41 C ATOM 1287 NZ LYS A 79 3.843 -36.857 -14.227 1.00 35.44 N ATOM 0 H LYS A 79 0.338 -30.916 -14.053 1.00 44.34 H new ATOM 0 HA LYS A 79 2.849 -32.358 -13.638 1.00 34.11 H new ATOM 0 HB2 LYS A 79 1.501 -31.870 -16.306 1.00 24.24 H new ATOM 0 HB3 LYS A 79 3.216 -32.203 -16.163 1.00 24.24 H new ATOM 0 HG2 LYS A 79 0.989 -34.058 -15.239 1.00 33.13 H new ATOM 0 HG3 LYS A 79 1.897 -34.226 -16.728 1.00 33.13 H new ATOM 0 HD2 LYS A 79 4.012 -34.426 -15.403 1.00 24.22 H new ATOM 0 HD3 LYS A 79 3.088 -34.286 -13.921 1.00 24.22 H new ATOM 0 HE2 LYS A 79 1.820 -36.340 -14.525 1.00 32.41 H new ATOM 0 HE3 LYS A 79 2.759 -36.482 -15.997 1.00 32.41 H new ATOM 0 HZ1 LYS A 79 3.643 -37.877 -14.256 1.00 35.44 H new ATOM 0 HZ2 LYS A 79 4.768 -36.673 -14.665 1.00 35.44 H new ATOM 0 HZ3 LYS A 79 3.858 -36.535 -13.238 1.00 35.44 H new ATOM 1301 N MET A 80 3.849 -30.170 -13.428 1.00 50.33 N ATOM 1302 CA MET A 80 4.685 -28.976 -13.336 1.00 3.22 C ATOM 1303 C MET A 80 5.636 -29.173 -12.174 1.00 45.21 C ATOM 1304 O MET A 80 6.840 -29.295 -12.352 1.00 63.02 O ATOM 1305 CB MET A 80 3.864 -27.694 -13.112 1.00 13.11 C ATOM 1306 CG MET A 80 4.705 -26.423 -13.184 1.00 61.13 C ATOM 1307 SD MET A 80 5.424 -26.174 -14.820 1.00 40.24 S ATOM 1308 CE MET A 80 6.312 -24.646 -14.567 1.00 2.41 C ATOM 0 H MET A 80 4.048 -30.854 -12.698 1.00 50.33 H new ATOM 0 HA MET A 80 5.216 -28.849 -14.280 1.00 3.22 H new ATOM 0 HB2 MET A 80 3.073 -27.641 -13.860 1.00 13.11 H new ATOM 0 HB3 MET A 80 3.379 -27.746 -12.137 1.00 13.11 H new ATOM 0 HG2 MET A 80 4.085 -25.564 -12.927 1.00 61.13 H new ATOM 0 HG3 MET A 80 5.502 -26.474 -12.442 1.00 61.13 H new ATOM 0 HE1 MET A 80 6.841 -24.377 -15.481 1.00 2.41 H new ATOM 0 HE2 MET A 80 5.608 -23.855 -14.309 1.00 2.41 H new ATOM 0 HE3 MET A 80 7.030 -24.772 -13.756 1.00 2.41 H new ATOM 1318 N LEU A 81 5.066 -29.237 -10.984 1.00 22.52 N ATOM 1319 CA LEU A 81 5.803 -29.487 -9.762 1.00 10.31 C ATOM 1320 C LEU A 81 4.981 -30.348 -8.859 1.00 71.15 C ATOM 1321 O LEU A 81 3.762 -30.487 -9.051 1.00 3.32 O ATOM 1322 CB LEU A 81 6.166 -28.194 -9.006 1.00 63.32 C ATOM 1323 CG LEU A 81 7.173 -27.253 -9.653 1.00 54.35 C ATOM 1324 CD1 LEU A 81 7.399 -26.052 -8.750 1.00 23.14 C ATOM 1325 CD2 LEU A 81 8.490 -27.978 -9.892 1.00 2.12 C ATOM 0 H LEU A 81 4.064 -29.115 -10.839 1.00 22.52 H new ATOM 0 HA LEU A 81 6.733 -29.979 -10.046 1.00 10.31 H new ATOM 0 HB2 LEU A 81 5.246 -27.635 -8.837 1.00 63.32 H new ATOM 0 HB3 LEU A 81 6.552 -28.476 -8.026 1.00 63.32 H new ATOM 0 HG LEU A 81 6.781 -26.915 -10.612 1.00 54.35 H new ATOM 0 HD11 LEU A 81 8.120 -25.379 -9.214 1.00 23.14 H new ATOM 0 HD12 LEU A 81 6.456 -25.527 -8.601 1.00 23.14 H new ATOM 0 HD13 LEU A 81 7.784 -26.388 -7.787 1.00 23.14 H new ATOM 0 HD21 LEU A 81 9.202 -27.295 -10.355 1.00 2.12 H new ATOM 0 HD22 LEU A 81 8.890 -28.329 -8.941 1.00 2.12 H new ATOM 0 HD23 LEU A 81 8.322 -28.829 -10.552 1.00 2.12 H new ATOM 1337 N GLU A 82 5.634 -30.921 -7.891 1.00 72.00 N ATOM 1338 CA GLU A 82 5.012 -31.741 -6.896 1.00 61.14 C ATOM 1339 C GLU A 82 5.914 -31.789 -5.705 1.00 5.50 C ATOM 1340 O GLU A 82 7.103 -31.459 -5.819 1.00 34.23 O ATOM 1341 CB GLU A 82 4.779 -33.158 -7.406 1.00 1.01 C ATOM 1342 CG GLU A 82 6.032 -33.856 -7.894 1.00 61.05 C ATOM 1343 CD GLU A 82 5.785 -35.288 -8.231 1.00 15.24 C ATOM 1344 OE1 GLU A 82 5.025 -35.572 -9.178 1.00 74.12 O ATOM 1345 OE2 GLU A 82 6.321 -36.168 -7.535 1.00 74.21 O ATOM 0 H GLU A 82 6.642 -30.827 -7.769 1.00 72.00 H new ATOM 0 HA GLU A 82 4.042 -31.314 -6.641 1.00 61.14 H new ATOM 0 HB2 GLU A 82 4.334 -33.751 -6.607 1.00 1.01 H new ATOM 0 HB3 GLU A 82 4.055 -33.125 -8.220 1.00 1.01 H new ATOM 0 HG2 GLU A 82 6.415 -33.338 -8.774 1.00 61.05 H new ATOM 0 HG3 GLU A 82 6.803 -33.793 -7.126 1.00 61.05 H new ATOM 1352 N LYS A 83 5.359 -32.176 -4.570 1.00 63.45 N ATOM 1353 CA LYS A 83 6.106 -32.342 -3.324 1.00 71.34 C ATOM 1354 C LYS A 83 6.770 -31.043 -2.869 1.00 64.33 C ATOM 1355 O LYS A 83 7.703 -31.060 -2.078 1.00 62.41 O ATOM 1356 CB LYS A 83 7.129 -33.486 -3.462 1.00 63.55 C ATOM 1357 CG LYS A 83 6.487 -34.849 -3.695 1.00 52.21 C ATOM 1358 CD LYS A 83 7.528 -35.932 -3.929 1.00 45.34 C ATOM 1359 CE LYS A 83 6.886 -37.305 -4.107 1.00 62.11 C ATOM 1360 NZ LYS A 83 5.899 -37.323 -5.205 1.00 63.12 N ATOM 0 H LYS A 83 4.365 -32.388 -4.481 1.00 63.45 H new ATOM 0 HA LYS A 83 5.394 -32.610 -2.544 1.00 71.34 H new ATOM 0 HB2 LYS A 83 7.802 -33.264 -4.290 1.00 63.55 H new ATOM 0 HB3 LYS A 83 7.738 -33.529 -2.559 1.00 63.55 H new ATOM 0 HG2 LYS A 83 5.874 -35.114 -2.833 1.00 52.21 H new ATOM 0 HG3 LYS A 83 5.820 -34.794 -4.555 1.00 52.21 H new ATOM 0 HD2 LYS A 83 8.115 -35.687 -4.815 1.00 45.34 H new ATOM 0 HD3 LYS A 83 8.219 -35.960 -3.087 1.00 45.34 H new ATOM 0 HE2 LYS A 83 7.662 -38.044 -4.307 1.00 62.11 H new ATOM 0 HE3 LYS A 83 6.398 -37.599 -3.178 1.00 62.11 H new ATOM 0 HZ1 LYS A 83 5.666 -38.307 -5.446 1.00 63.12 H new ATOM 0 HZ2 LYS A 83 5.036 -36.827 -4.904 1.00 63.12 H new ATOM 0 HZ3 LYS A 83 6.299 -36.848 -6.039 1.00 63.12 H new ATOM 1374 N ASP A 84 6.257 -29.916 -3.342 1.00 32.21 N ATOM 1375 CA ASP A 84 6.767 -28.621 -2.913 1.00 50.10 C ATOM 1376 C ASP A 84 6.240 -28.356 -1.522 1.00 4.25 C ATOM 1377 O ASP A 84 6.912 -27.756 -0.673 1.00 22.03 O ATOM 1378 CB ASP A 84 6.362 -27.500 -3.893 1.00 43.10 C ATOM 1379 CG ASP A 84 6.881 -26.128 -3.480 1.00 75.43 C ATOM 1380 OD1 ASP A 84 8.099 -25.893 -3.551 1.00 53.44 O ATOM 1381 OD2 ASP A 84 6.069 -25.265 -3.067 1.00 74.12 O ATOM 0 H ASP A 84 5.494 -29.871 -4.018 1.00 32.21 H new ATOM 0 HA ASP A 84 7.857 -28.635 -2.903 1.00 50.10 H new ATOM 0 HB2 ASP A 84 6.740 -27.741 -4.887 1.00 43.10 H new ATOM 0 HB3 ASP A 84 5.275 -27.464 -3.965 1.00 43.10 H new ATOM 1386 N ALA A 85 5.038 -28.819 -1.286 1.00 61.01 N ATOM 1387 CA ALA A 85 4.443 -28.784 0.020 1.00 25.11 C ATOM 1388 C ALA A 85 4.642 -30.154 0.658 1.00 2.01 C ATOM 1389 O ALA A 85 3.935 -31.110 0.336 1.00 22.31 O ATOM 1390 CB ALA A 85 2.963 -28.440 -0.073 1.00 3.32 C ATOM 0 H ALA A 85 4.443 -29.234 -2.003 1.00 61.01 H new ATOM 0 HA ALA A 85 4.915 -28.014 0.630 1.00 25.11 H new ATOM 0 HB1 ALA A 85 2.531 -28.419 0.927 1.00 3.32 H new ATOM 0 HB2 ALA A 85 2.845 -27.462 -0.540 1.00 3.32 H new ATOM 0 HB3 ALA A 85 2.452 -29.193 -0.673 1.00 3.32 H new ATOM 1396 N THR A 86 5.633 -30.263 1.498 1.00 21.01 N ATOM 1397 CA THR A 86 5.975 -31.526 2.116 1.00 75.41 C ATOM 1398 C THR A 86 5.322 -31.688 3.473 1.00 33.40 C ATOM 1399 O THR A 86 5.101 -30.703 4.184 1.00 74.31 O ATOM 1400 CB THR A 86 7.495 -31.654 2.269 1.00 34.42 C ATOM 1401 OG1 THR A 86 8.012 -30.484 2.921 1.00 61.15 O ATOM 1402 CG2 THR A 86 8.171 -31.832 0.929 1.00 72.34 C ATOM 0 H THR A 86 6.229 -29.484 1.777 1.00 21.01 H new ATOM 0 HA THR A 86 5.601 -32.313 1.460 1.00 75.41 H new ATOM 0 HB THR A 86 7.703 -32.538 2.872 1.00 34.42 H new ATOM 0 HG1 THR A 86 8.983 -30.567 3.020 1.00 61.15 H new ATOM 0 HG21 THR A 86 9.248 -31.920 1.073 1.00 72.34 H new ATOM 0 HG22 THR A 86 7.795 -32.735 0.449 1.00 72.34 H new ATOM 0 HG23 THR A 86 7.959 -30.970 0.297 1.00 72.34 H new ATOM 1410 N GLU A 87 5.023 -32.917 3.828 1.00 61.21 N ATOM 1411 CA GLU A 87 4.431 -33.228 5.105 1.00 73.23 C ATOM 1412 C GLU A 87 5.550 -33.278 6.142 1.00 1.23 C ATOM 1413 O GLU A 87 6.400 -34.188 6.129 1.00 75.33 O ATOM 1414 CB GLU A 87 3.667 -34.579 5.006 1.00 0.44 C ATOM 1415 CG GLU A 87 2.776 -34.977 6.209 1.00 32.31 C ATOM 1416 CD GLU A 87 3.518 -35.304 7.492 1.00 50.22 C ATOM 1417 OE1 GLU A 87 3.961 -36.462 7.653 1.00 23.32 O ATOM 1418 OE2 GLU A 87 3.642 -34.423 8.364 1.00 72.23 O ATOM 0 H GLU A 87 5.185 -33.731 3.235 1.00 61.21 H new ATOM 0 HA GLU A 87 3.708 -32.469 5.404 1.00 73.23 H new ATOM 0 HB2 GLU A 87 3.039 -34.548 4.116 1.00 0.44 H new ATOM 0 HB3 GLU A 87 4.400 -35.371 4.851 1.00 0.44 H new ATOM 0 HG2 GLU A 87 2.081 -34.162 6.410 1.00 32.31 H new ATOM 0 HG3 GLU A 87 2.178 -35.843 5.925 1.00 32.31 H new ATOM 1425 N VAL A 88 5.589 -32.267 6.980 1.00 13.24 N ATOM 1426 CA VAL A 88 6.575 -32.169 8.036 1.00 71.14 C ATOM 1427 C VAL A 88 5.863 -31.874 9.347 1.00 32.22 C ATOM 1428 O VAL A 88 5.062 -30.916 9.430 1.00 40.14 O ATOM 1429 CB VAL A 88 7.625 -31.041 7.752 1.00 72.13 C ATOM 1430 CG1 VAL A 88 8.666 -30.960 8.865 1.00 73.31 C ATOM 1431 CG2 VAL A 88 8.307 -31.252 6.406 1.00 74.34 C ATOM 0 H VAL A 88 4.935 -31.485 6.949 1.00 13.24 H new ATOM 0 HA VAL A 88 7.111 -33.116 8.090 1.00 71.14 H new ATOM 0 HB VAL A 88 7.085 -30.095 7.720 1.00 72.13 H new ATOM 0 HG11 VAL A 88 9.380 -30.168 8.638 1.00 73.31 H new ATOM 0 HG12 VAL A 88 8.171 -30.742 9.811 1.00 73.31 H new ATOM 0 HG13 VAL A 88 9.192 -31.912 8.941 1.00 73.31 H new ATOM 0 HG21 VAL A 88 9.030 -30.455 6.236 1.00 74.34 H new ATOM 0 HG22 VAL A 88 8.820 -32.214 6.405 1.00 74.34 H new ATOM 0 HG23 VAL A 88 7.559 -31.239 5.613 1.00 74.34 H new ATOM 1441 N GLY A 89 6.119 -32.679 10.349 1.00 1.43 N ATOM 1442 CA GLY A 89 5.492 -32.502 11.631 1.00 52.02 C ATOM 1443 C GLY A 89 5.570 -33.757 12.460 1.00 54.22 C ATOM 1444 O GLY A 89 6.206 -34.738 12.044 1.00 62.42 O ATOM 0 H GLY A 89 6.763 -33.468 10.298 1.00 1.43 H new ATOM 0 HA2 GLY A 89 5.974 -31.682 12.163 1.00 52.02 H new ATOM 0 HA3 GLY A 89 4.448 -32.221 11.491 1.00 52.02 H new ATOM 1448 N VAL A 90 4.937 -33.748 13.612 1.00 72.20 N ATOM 1449 CA VAL A 90 4.960 -34.887 14.502 1.00 14.33 C ATOM 1450 C VAL A 90 3.791 -34.825 15.490 1.00 1.41 C ATOM 1451 O VAL A 90 3.402 -33.748 15.952 1.00 23.15 O ATOM 1452 CB VAL A 90 6.321 -34.992 15.269 1.00 0.10 C ATOM 1453 CG1 VAL A 90 6.580 -33.765 16.119 1.00 51.45 C ATOM 1454 CG2 VAL A 90 6.395 -36.264 16.113 1.00 33.25 C ATOM 0 H VAL A 90 4.395 -32.956 13.957 1.00 72.20 H new ATOM 0 HA VAL A 90 4.854 -35.783 13.891 1.00 14.33 H new ATOM 0 HB VAL A 90 7.107 -35.046 14.515 1.00 0.10 H new ATOM 0 HG11 VAL A 90 7.533 -33.875 16.636 1.00 51.45 H new ATOM 0 HG12 VAL A 90 6.612 -32.881 15.482 1.00 51.45 H new ATOM 0 HG13 VAL A 90 5.781 -33.655 16.852 1.00 51.45 H new ATOM 0 HG21 VAL A 90 7.354 -36.302 16.630 1.00 33.25 H new ATOM 0 HG22 VAL A 90 5.587 -36.262 16.845 1.00 33.25 H new ATOM 0 HG23 VAL A 90 6.297 -37.136 15.466 1.00 33.25 H new ATOM 1464 N LYS A 91 3.241 -35.973 15.773 1.00 61.11 N ATOM 1465 CA LYS A 91 2.168 -36.138 16.711 1.00 64.34 C ATOM 1466 C LYS A 91 2.739 -36.633 18.034 1.00 64.31 C ATOM 1467 O LYS A 91 3.595 -37.530 18.040 1.00 64.10 O ATOM 1468 CB LYS A 91 1.207 -37.171 16.142 1.00 73.30 C ATOM 1469 CG LYS A 91 0.035 -37.528 17.024 1.00 61.52 C ATOM 1470 CD LYS A 91 -0.848 -38.501 16.303 1.00 74.24 C ATOM 1471 CE LYS A 91 -2.005 -38.983 17.159 1.00 40.12 C ATOM 1472 NZ LYS A 91 -2.865 -39.944 16.429 1.00 71.20 N ATOM 0 H LYS A 91 3.538 -36.848 15.342 1.00 61.11 H new ATOM 0 HA LYS A 91 1.647 -35.195 16.880 1.00 64.34 H new ATOM 0 HB2 LYS A 91 0.824 -36.799 15.192 1.00 73.30 H new ATOM 0 HB3 LYS A 91 1.767 -38.081 15.926 1.00 73.30 H new ATOM 0 HG2 LYS A 91 0.388 -37.963 17.959 1.00 61.52 H new ATOM 0 HG3 LYS A 91 -0.527 -36.631 17.282 1.00 61.52 H new ATOM 0 HD2 LYS A 91 -1.239 -38.031 15.401 1.00 74.24 H new ATOM 0 HD3 LYS A 91 -0.254 -39.358 15.985 1.00 74.24 H new ATOM 0 HE2 LYS A 91 -1.618 -39.455 18.062 1.00 40.12 H new ATOM 0 HE3 LYS A 91 -2.603 -38.129 17.477 1.00 40.12 H new ATOM 0 HZ1 LYS A 91 -3.644 -40.251 17.046 1.00 71.20 H new ATOM 0 HZ2 LYS A 91 -3.255 -39.486 15.581 1.00 71.20 H new ATOM 0 HZ3 LYS A 91 -2.300 -40.771 16.147 1.00 71.20 H new ATOM 1486 N ALA A 92 2.303 -36.046 19.140 1.00 25.12 N ATOM 1487 CA ALA A 92 2.750 -36.473 20.465 1.00 13.32 C ATOM 1488 C ALA A 92 2.360 -37.912 20.699 1.00 2.24 C ATOM 1489 O ALA A 92 1.193 -38.295 20.488 1.00 53.31 O ATOM 1490 CB ALA A 92 2.160 -35.592 21.560 1.00 25.22 C ATOM 0 H ALA A 92 1.639 -35.272 19.149 1.00 25.12 H new ATOM 0 HA ALA A 92 3.835 -36.378 20.502 1.00 13.32 H new ATOM 0 HB1 ALA A 92 2.512 -35.936 22.533 1.00 25.22 H new ATOM 0 HB2 ALA A 92 2.474 -34.560 21.405 1.00 25.22 H new ATOM 0 HB3 ALA A 92 1.072 -35.650 21.527 1.00 25.22 H new ATOM 1496 N ALA A 93 3.312 -38.707 21.111 1.00 43.22 N ATOM 1497 CA ALA A 93 3.083 -40.105 21.330 1.00 13.11 C ATOM 1498 C ALA A 93 2.438 -40.358 22.676 1.00 63.32 C ATOM 1499 O ALA A 93 3.122 -40.506 23.699 1.00 45.22 O ATOM 1500 CB ALA A 93 4.366 -40.905 21.181 1.00 44.41 C ATOM 0 H ALA A 93 4.266 -38.401 21.303 1.00 43.22 H new ATOM 0 HA ALA A 93 2.387 -40.444 20.562 1.00 13.11 H new ATOM 0 HB1 ALA A 93 4.158 -41.961 21.353 1.00 44.41 H new ATOM 0 HB2 ALA A 93 4.763 -40.773 20.174 1.00 44.41 H new ATOM 0 HB3 ALA A 93 5.099 -40.556 21.908 1.00 44.41 H new ATOM 1506 N LEU A 94 1.130 -40.338 22.687 1.00 14.24 N ATOM 1507 CA LEU A 94 0.375 -40.655 23.874 1.00 45.42 C ATOM 1508 C LEU A 94 0.061 -42.139 23.857 1.00 61.41 C ATOM 1509 O LEU A 94 -0.155 -42.723 22.782 1.00 64.41 O ATOM 1510 CB LEU A 94 -0.930 -39.808 24.003 1.00 23.52 C ATOM 1511 CG LEU A 94 -2.091 -40.041 22.990 1.00 22.41 C ATOM 1512 CD1 LEU A 94 -3.274 -39.164 23.353 1.00 71.35 C ATOM 1513 CD2 LEU A 94 -1.677 -39.770 21.546 1.00 22.55 C ATOM 0 H LEU A 94 0.558 -40.102 21.876 1.00 14.24 H new ATOM 0 HA LEU A 94 0.978 -40.404 24.747 1.00 45.42 H new ATOM 0 HB2 LEU A 94 -1.330 -39.972 25.004 1.00 23.52 H new ATOM 0 HB3 LEU A 94 -0.647 -38.757 23.941 1.00 23.52 H new ATOM 0 HG LEU A 94 -2.366 -41.094 23.056 1.00 22.41 H new ATOM 0 HD11 LEU A 94 -4.083 -39.331 22.641 1.00 71.35 H new ATOM 0 HD12 LEU A 94 -3.617 -39.413 24.357 1.00 71.35 H new ATOM 0 HD13 LEU A 94 -2.974 -38.117 23.322 1.00 71.35 H new ATOM 0 HD21 LEU A 94 -2.525 -39.948 20.885 1.00 22.55 H new ATOM 0 HD22 LEU A 94 -1.353 -38.734 21.449 1.00 22.55 H new ATOM 0 HD23 LEU A 94 -0.857 -40.434 21.272 1.00 22.55 H new ATOM 1525 N GLU A 95 0.056 -42.752 25.002 1.00 5.13 N ATOM 1526 CA GLU A 95 -0.149 -44.180 25.098 1.00 3.22 C ATOM 1527 C GLU A 95 -1.343 -44.504 25.961 1.00 64.21 C ATOM 1528 O GLU A 95 -1.597 -43.831 26.971 1.00 21.13 O ATOM 1529 CB GLU A 95 1.110 -44.843 25.640 1.00 14.52 C ATOM 1530 CG GLU A 95 2.298 -44.708 24.709 1.00 51.23 C ATOM 1531 CD GLU A 95 3.582 -45.145 25.340 1.00 23.41 C ATOM 1532 OE1 GLU A 95 3.886 -46.350 25.337 1.00 63.54 O ATOM 1533 OE2 GLU A 95 4.321 -44.277 25.840 1.00 4.32 O ATOM 0 H GLU A 95 0.193 -42.285 25.898 1.00 5.13 H new ATOM 0 HA GLU A 95 -0.354 -44.570 24.101 1.00 3.22 H new ATOM 0 HB2 GLU A 95 1.360 -44.402 26.605 1.00 14.52 H new ATOM 0 HB3 GLU A 95 0.911 -45.900 25.815 1.00 14.52 H new ATOM 0 HG2 GLU A 95 2.120 -45.300 23.812 1.00 51.23 H new ATOM 0 HG3 GLU A 95 2.389 -43.669 24.392 1.00 51.23 H new ATOM 1540 N GLU A 96 -2.078 -45.509 25.558 1.00 70.42 N ATOM 1541 CA GLU A 96 -3.250 -45.944 26.276 1.00 1.44 C ATOM 1542 C GLU A 96 -2.821 -46.966 27.309 1.00 44.42 C ATOM 1543 O GLU A 96 -2.229 -47.997 26.950 1.00 55.23 O ATOM 1544 CB GLU A 96 -4.245 -46.593 25.311 1.00 53.43 C ATOM 1545 CG GLU A 96 -4.590 -45.748 24.097 1.00 65.32 C ATOM 1546 CD GLU A 96 -5.192 -44.406 24.442 1.00 20.02 C ATOM 1547 OE1 GLU A 96 -6.425 -44.309 24.541 1.00 41.34 O ATOM 1548 OE2 GLU A 96 -4.442 -43.418 24.590 1.00 35.32 O ATOM 0 H GLU A 96 -1.879 -46.052 24.718 1.00 70.42 H new ATOM 0 HA GLU A 96 -3.728 -45.090 26.755 1.00 1.44 H new ATOM 0 HB2 GLU A 96 -3.834 -47.544 24.971 1.00 53.43 H new ATOM 0 HB3 GLU A 96 -5.163 -46.818 25.853 1.00 53.43 H new ATOM 0 HG2 GLU A 96 -3.687 -45.590 23.507 1.00 65.32 H new ATOM 0 HG3 GLU A 96 -5.290 -46.299 23.469 1.00 65.32 H new ATOM 1555 N ALA A 97 -3.084 -46.689 28.565 1.00 73.21 N ATOM 1556 CA ALA A 97 -2.707 -47.591 29.627 1.00 13.22 C ATOM 1557 C ALA A 97 -3.773 -47.637 30.705 1.00 32.25 C ATOM 1558 O ALA A 97 -3.808 -46.779 31.614 1.00 34.24 O ATOM 1559 CB ALA A 97 -1.349 -47.219 30.214 1.00 44.12 C ATOM 0 H ALA A 97 -3.560 -45.842 28.877 1.00 73.21 H new ATOM 0 HA ALA A 97 -2.619 -48.589 29.199 1.00 13.22 H new ATOM 0 HB1 ALA A 97 -1.094 -47.917 31.011 1.00 44.12 H new ATOM 0 HB2 ALA A 97 -0.590 -47.266 29.433 1.00 44.12 H new ATOM 0 HB3 ALA A 97 -1.392 -46.207 30.618 1.00 44.12 H new ATOM 1565 N LYS A 98 -4.665 -48.598 30.562 1.00 25.43 N ATOM 1566 CA LYS A 98 -5.751 -48.864 31.490 1.00 12.43 C ATOM 1567 C LYS A 98 -6.420 -50.173 31.098 1.00 1.23 C ATOM 1568 O LYS A 98 -6.867 -50.328 29.956 1.00 63.21 O ATOM 1569 CB LYS A 98 -6.797 -47.732 31.489 1.00 52.42 C ATOM 1570 CG LYS A 98 -7.963 -47.996 32.428 1.00 73.14 C ATOM 1571 CD LYS A 98 -8.992 -46.885 32.395 1.00 75.31 C ATOM 1572 CE LYS A 98 -10.177 -47.229 33.278 1.00 31.40 C ATOM 1573 NZ LYS A 98 -11.206 -46.175 33.270 1.00 34.34 N ATOM 0 H LYS A 98 -4.654 -49.239 29.768 1.00 25.43 H new ATOM 0 HA LYS A 98 -5.335 -48.928 32.496 1.00 12.43 H new ATOM 0 HB2 LYS A 98 -6.313 -46.798 31.774 1.00 52.42 H new ATOM 0 HB3 LYS A 98 -7.177 -47.598 30.476 1.00 52.42 H new ATOM 0 HG2 LYS A 98 -8.440 -48.938 32.156 1.00 73.14 H new ATOM 0 HG3 LYS A 98 -7.588 -48.111 33.445 1.00 73.14 H new ATOM 0 HD2 LYS A 98 -8.539 -45.952 32.732 1.00 75.31 H new ATOM 0 HD3 LYS A 98 -9.329 -46.724 31.371 1.00 75.31 H new ATOM 0 HE2 LYS A 98 -10.618 -48.167 32.941 1.00 31.40 H new ATOM 0 HE3 LYS A 98 -9.832 -47.389 34.299 1.00 31.40 H new ATOM 0 HZ1 LYS A 98 -11.995 -46.455 33.887 1.00 34.34 H new ATOM 0 HZ2 LYS A 98 -10.794 -45.285 33.617 1.00 34.34 H new ATOM 0 HZ3 LYS A 98 -11.556 -46.039 32.300 1.00 34.34 H new ATOM 1587 N LYS A 99 -6.486 -51.097 32.013 1.00 31.12 N ATOM 1588 CA LYS A 99 -7.089 -52.381 31.735 1.00 70.45 C ATOM 1589 C LYS A 99 -8.518 -52.399 32.253 1.00 62.12 C ATOM 1590 O LYS A 99 -8.860 -51.652 33.172 1.00 63.42 O ATOM 1591 CB LYS A 99 -6.293 -53.517 32.411 1.00 31.42 C ATOM 1592 CG LYS A 99 -6.287 -53.448 33.941 1.00 63.41 C ATOM 1593 CD LYS A 99 -5.548 -54.619 34.578 1.00 62.34 C ATOM 1594 CE LYS A 99 -4.077 -54.631 34.205 1.00 11.32 C ATOM 1595 NZ LYS A 99 -3.356 -55.741 34.858 1.00 45.23 N ATOM 0 H LYS A 99 -6.130 -50.990 32.963 1.00 31.12 H new ATOM 0 HA LYS A 99 -7.081 -52.537 30.656 1.00 70.45 H new ATOM 0 HB2 LYS A 99 -6.713 -54.474 32.102 1.00 31.42 H new ATOM 0 HB3 LYS A 99 -5.264 -53.489 32.052 1.00 31.42 H new ATOM 0 HG2 LYS A 99 -5.822 -52.514 34.257 1.00 63.41 H new ATOM 0 HG3 LYS A 99 -7.315 -53.431 34.304 1.00 63.41 H new ATOM 0 HD2 LYS A 99 -5.647 -54.564 35.662 1.00 62.34 H new ATOM 0 HD3 LYS A 99 -6.010 -55.555 34.263 1.00 62.34 H new ATOM 0 HE2 LYS A 99 -3.977 -54.719 33.123 1.00 11.32 H new ATOM 0 HE3 LYS A 99 -3.621 -53.683 34.491 1.00 11.32 H new ATOM 0 HZ1 LYS A 99 -2.354 -55.716 34.579 1.00 45.23 H new ATOM 0 HZ2 LYS A 99 -3.430 -55.643 35.891 1.00 45.23 H new ATOM 0 HZ3 LYS A 99 -3.775 -56.647 34.565 1.00 45.23 H new ATOM 1609 N VAL A 100 -9.344 -53.219 31.663 1.00 13.40 N ATOM 1610 CA VAL A 100 -10.670 -53.424 32.174 1.00 45.43 C ATOM 1611 C VAL A 100 -10.695 -54.713 32.998 1.00 13.34 C ATOM 1612 O VAL A 100 -10.821 -55.826 32.472 1.00 52.03 O ATOM 1613 CB VAL A 100 -11.787 -53.388 31.071 1.00 21.12 C ATOM 1614 CG1 VAL A 100 -11.897 -51.988 30.483 1.00 34.22 C ATOM 1615 CG2 VAL A 100 -11.516 -54.392 29.948 1.00 72.24 C ATOM 0 H VAL A 100 -9.121 -53.757 30.826 1.00 13.40 H new ATOM 0 HA VAL A 100 -10.914 -52.581 32.821 1.00 45.43 H new ATOM 0 HB VAL A 100 -12.726 -53.665 31.551 1.00 21.12 H new ATOM 0 HG11 VAL A 100 -12.674 -51.974 29.719 1.00 34.22 H new ATOM 0 HG12 VAL A 100 -12.151 -51.281 31.272 1.00 34.22 H new ATOM 0 HG13 VAL A 100 -10.944 -51.705 30.036 1.00 34.22 H new ATOM 0 HG21 VAL A 100 -12.313 -54.333 29.207 1.00 72.24 H new ATOM 0 HG22 VAL A 100 -10.562 -54.159 29.474 1.00 72.24 H new ATOM 0 HG23 VAL A 100 -11.479 -55.400 30.362 1.00 72.24 H new ATOM 1625 N GLN A 101 -10.483 -54.563 34.277 1.00 2.24 N ATOM 1626 CA GLN A 101 -10.411 -55.692 35.159 1.00 35.31 C ATOM 1627 C GLN A 101 -11.720 -55.872 35.893 1.00 55.15 C ATOM 1628 O GLN A 101 -11.997 -55.199 36.904 1.00 64.01 O ATOM 1629 CB GLN A 101 -9.251 -55.546 36.146 1.00 53.33 C ATOM 1630 CG GLN A 101 -9.050 -56.750 37.055 1.00 55.43 C ATOM 1631 CD GLN A 101 -7.915 -56.545 38.031 1.00 52.31 C ATOM 1632 OE1 GLN A 101 -6.766 -56.864 37.740 1.00 63.55 O ATOM 1633 NE2 GLN A 101 -8.223 -56.016 39.188 1.00 51.54 N ATOM 0 H GLN A 101 -10.356 -53.660 34.734 1.00 2.24 H new ATOM 0 HA GLN A 101 -10.227 -56.582 34.558 1.00 35.31 H new ATOM 0 HB2 GLN A 101 -8.332 -55.370 35.586 1.00 53.33 H new ATOM 0 HB3 GLN A 101 -9.422 -54.664 36.763 1.00 53.33 H new ATOM 0 HG2 GLN A 101 -9.970 -56.945 37.606 1.00 55.43 H new ATOM 0 HG3 GLN A 101 -8.850 -57.632 36.447 1.00 55.43 H new ATOM 0 HE21 GLN A 101 -9.190 -55.764 39.392 1.00 51.54 H new ATOM 0 HE22 GLN A 101 -7.496 -55.856 39.885 1.00 51.54 H new ATOM 1642 N ILE A 102 -12.541 -56.722 35.364 1.00 22.32 N ATOM 1643 CA ILE A 102 -13.799 -57.032 35.969 1.00 25.25 C ATOM 1644 C ILE A 102 -13.742 -58.478 36.458 1.00 43.02 C ATOM 1645 O ILE A 102 -13.693 -59.431 35.666 1.00 71.53 O ATOM 1646 CB ILE A 102 -15.013 -56.731 34.978 1.00 30.35 C ATOM 1647 CG1 ILE A 102 -16.435 -56.923 35.621 1.00 15.14 C ATOM 1648 CG2 ILE A 102 -14.888 -57.490 33.655 1.00 1.51 C ATOM 1649 CD1 ILE A 102 -16.854 -58.351 35.955 1.00 74.00 C ATOM 0 H ILE A 102 -12.358 -57.224 34.495 1.00 22.32 H new ATOM 0 HA ILE A 102 -13.985 -56.389 36.829 1.00 25.25 H new ATOM 0 HB ILE A 102 -14.931 -55.666 34.760 1.00 30.35 H new ATOM 0 HG12 ILE A 102 -16.475 -56.334 36.538 1.00 15.14 H new ATOM 0 HG13 ILE A 102 -17.175 -56.503 34.940 1.00 15.14 H new ATOM 0 HG21 ILE A 102 -15.738 -57.251 33.017 1.00 1.51 H new ATOM 0 HG22 ILE A 102 -13.965 -57.199 33.154 1.00 1.51 H new ATOM 0 HG23 ILE A 102 -14.872 -58.562 33.851 1.00 1.51 H new ATOM 0 HD11 ILE A 102 -17.853 -58.344 36.392 1.00 74.00 H new ATOM 0 HD12 ILE A 102 -16.860 -58.951 35.045 1.00 74.00 H new ATOM 0 HD13 ILE A 102 -16.149 -58.780 36.667 1.00 74.00 H new ATOM 1661 N GLU A 103 -13.670 -58.632 37.743 1.00 42.23 N ATOM 1662 CA GLU A 103 -13.603 -59.937 38.346 1.00 0.22 C ATOM 1663 C GLU A 103 -14.965 -60.307 38.856 1.00 71.45 C ATOM 1664 O GLU A 103 -15.780 -59.422 39.153 1.00 15.22 O ATOM 1665 CB GLU A 103 -12.605 -59.942 39.492 1.00 63.02 C ATOM 1666 CG GLU A 103 -11.198 -59.555 39.088 1.00 12.12 C ATOM 1667 CD GLU A 103 -10.267 -59.569 40.259 1.00 30.54 C ATOM 1668 OE1 GLU A 103 -10.155 -58.534 40.951 1.00 73.43 O ATOM 1669 OE2 GLU A 103 -9.649 -60.622 40.524 1.00 52.32 O ATOM 0 H GLU A 103 -13.656 -57.859 38.409 1.00 42.23 H new ATOM 0 HA GLU A 103 -13.275 -60.662 37.601 1.00 0.22 H new ATOM 0 HB2 GLU A 103 -12.952 -59.255 40.264 1.00 63.02 H new ATOM 0 HB3 GLU A 103 -12.583 -60.937 39.936 1.00 63.02 H new ATOM 0 HG2 GLU A 103 -10.835 -60.244 38.325 1.00 12.12 H new ATOM 0 HG3 GLU A 103 -11.207 -58.561 38.641 1.00 12.12 H new ATOM 1676 N LEU A 104 -15.227 -61.575 38.957 1.00 14.10 N ATOM 1677 CA LEU A 104 -16.503 -62.024 39.412 1.00 55.55 C ATOM 1678 C LEU A 104 -16.374 -63.373 40.083 1.00 1.43 C ATOM 1679 O LEU A 104 -16.242 -64.405 39.421 1.00 32.41 O ATOM 1680 CB LEU A 104 -17.500 -62.087 38.239 1.00 31.35 C ATOM 1681 CG LEU A 104 -18.943 -62.469 38.579 1.00 40.00 C ATOM 1682 CD1 LEU A 104 -19.561 -61.449 39.524 1.00 14.33 C ATOM 1683 CD2 LEU A 104 -19.769 -62.584 37.315 1.00 33.43 C ATOM 0 H LEU A 104 -14.568 -62.319 38.728 1.00 14.10 H new ATOM 0 HA LEU A 104 -16.885 -61.313 40.144 1.00 55.55 H new ATOM 0 HB2 LEU A 104 -17.513 -61.112 37.751 1.00 31.35 H new ATOM 0 HB3 LEU A 104 -17.122 -62.803 37.510 1.00 31.35 H new ATOM 0 HG LEU A 104 -18.933 -63.437 39.079 1.00 40.00 H new ATOM 0 HD11 LEU A 104 -20.586 -61.739 39.753 1.00 14.33 H new ATOM 0 HD12 LEU A 104 -18.981 -61.409 40.446 1.00 14.33 H new ATOM 0 HD13 LEU A 104 -19.559 -60.467 39.051 1.00 14.33 H new ATOM 0 HD21 LEU A 104 -20.793 -62.856 37.573 1.00 33.43 H new ATOM 0 HD22 LEU A 104 -19.769 -61.628 36.792 1.00 33.43 H new ATOM 0 HD23 LEU A 104 -19.341 -63.351 36.669 1.00 33.43 H new ATOM 1695 N ASP A 105 -16.346 -63.362 41.390 1.00 60.34 N ATOM 1696 CA ASP A 105 -16.306 -64.594 42.152 1.00 64.42 C ATOM 1697 C ASP A 105 -17.705 -65.130 42.301 1.00 3.42 C ATOM 1698 O ASP A 105 -17.927 -66.339 42.244 1.00 51.11 O ATOM 1699 CB ASP A 105 -15.687 -64.373 43.531 1.00 3.43 C ATOM 1700 CG ASP A 105 -15.676 -65.640 44.362 1.00 53.43 C ATOM 1701 OD1 ASP A 105 -14.735 -66.447 44.228 1.00 62.30 O ATOM 1702 OD2 ASP A 105 -16.622 -65.856 45.155 1.00 1.53 O ATOM 0 H ASP A 105 -16.350 -62.513 41.956 1.00 60.34 H new ATOM 0 HA ASP A 105 -15.685 -65.313 41.617 1.00 64.42 H new ATOM 0 HB2 ASP A 105 -14.667 -64.007 43.415 1.00 3.43 H new ATOM 0 HB3 ASP A 105 -16.245 -63.599 44.058 1.00 3.43 H new ATOM 1707 N THR A 106 -18.643 -64.191 42.460 1.00 44.43 N ATOM 1708 CA THR A 106 -20.075 -64.439 42.626 1.00 1.31 C ATOM 1709 C THR A 106 -20.374 -65.559 43.668 1.00 62.55 C ATOM 1710 O THR A 106 -20.466 -66.753 43.343 1.00 65.32 O ATOM 1711 CB THR A 106 -20.844 -64.593 41.239 1.00 43.40 C ATOM 1712 OG1 THR A 106 -22.252 -64.675 41.428 1.00 55.43 O ATOM 1713 CG2 THR A 106 -20.379 -65.783 40.403 1.00 12.50 C ATOM 0 H THR A 106 -18.414 -63.197 42.477 1.00 44.43 H new ATOM 0 HA THR A 106 -20.500 -63.537 43.067 1.00 1.31 H new ATOM 0 HB THR A 106 -20.597 -63.689 40.682 1.00 43.40 H new ATOM 0 HG1 THR A 106 -22.694 -64.767 40.558 1.00 55.43 H new ATOM 0 HG21 THR A 106 -20.949 -65.821 39.475 1.00 12.50 H new ATOM 0 HG22 THR A 106 -19.319 -65.674 40.174 1.00 12.50 H new ATOM 0 HG23 THR A 106 -20.536 -66.705 40.963 1.00 12.50 H new ATOM 1721 N SER A 107 -20.478 -65.160 44.928 1.00 50.34 N ATOM 1722 CA SER A 107 -20.639 -66.108 46.012 1.00 4.02 C ATOM 1723 C SER A 107 -22.122 -66.360 46.349 1.00 74.33 C ATOM 1724 O SER A 107 -22.551 -67.517 46.436 1.00 74.32 O ATOM 1725 CB SER A 107 -19.905 -65.582 47.256 1.00 24.10 C ATOM 1726 OG SER A 107 -18.532 -65.275 46.972 1.00 3.41 O ATOM 0 H SER A 107 -20.453 -64.183 45.221 1.00 50.34 H new ATOM 0 HA SER A 107 -20.213 -67.059 45.693 1.00 4.02 H new ATOM 0 HB2 SER A 107 -20.409 -64.689 47.625 1.00 24.10 H new ATOM 0 HB3 SER A 107 -19.955 -66.327 48.050 1.00 24.10 H new ATOM 0 HG SER A 107 -18.252 -65.748 46.161 1.00 3.41 H new ATOM 1732 N LEU A 108 -22.895 -65.270 46.498 1.00 74.44 N ATOM 1733 CA LEU A 108 -24.325 -65.318 46.902 1.00 41.34 C ATOM 1734 C LEU A 108 -24.530 -66.028 48.250 1.00 73.43 C ATOM 1735 O LEU A 108 -23.569 -66.403 48.940 1.00 52.12 O ATOM 1736 CB LEU A 108 -25.256 -65.957 45.825 1.00 62.32 C ATOM 1737 CG LEU A 108 -25.457 -65.209 44.496 1.00 40.24 C ATOM 1738 CD1 LEU A 108 -25.941 -63.790 44.717 1.00 71.51 C ATOM 1739 CD2 LEU A 108 -24.221 -65.240 43.643 1.00 2.31 C ATOM 0 H LEU A 108 -22.550 -64.323 46.342 1.00 74.44 H new ATOM 0 HA LEU A 108 -24.614 -64.272 47.008 1.00 41.34 H new ATOM 0 HB2 LEU A 108 -24.864 -66.947 45.593 1.00 62.32 H new ATOM 0 HB3 LEU A 108 -26.237 -66.100 46.277 1.00 62.32 H new ATOM 0 HG LEU A 108 -26.239 -65.738 43.951 1.00 40.24 H new ATOM 0 HD11 LEU A 108 -26.071 -63.296 43.754 1.00 71.51 H new ATOM 0 HD12 LEU A 108 -26.894 -63.809 45.246 1.00 71.51 H new ATOM 0 HD13 LEU A 108 -25.207 -63.243 45.310 1.00 71.51 H new ATOM 0 HD21 LEU A 108 -24.406 -64.700 42.714 1.00 2.31 H new ATOM 0 HD22 LEU A 108 -23.397 -64.768 44.179 1.00 2.31 H new ATOM 0 HD23 LEU A 108 -23.961 -66.274 43.416 1.00 2.31 H new ATOM 1751 N SER A 109 -25.770 -66.164 48.623 1.00 24.14 N ATOM 1752 CA SER A 109 -26.166 -66.861 49.812 1.00 33.05 C ATOM 1753 C SER A 109 -27.561 -67.406 49.593 1.00 51.23 C ATOM 1754 O SER A 109 -28.439 -66.675 49.108 1.00 4.45 O ATOM 1755 CB SER A 109 -26.119 -65.906 51.015 1.00 0.43 C ATOM 1756 OG SER A 109 -26.866 -64.717 50.755 1.00 23.44 O ATOM 0 H SER A 109 -26.554 -65.783 48.094 1.00 24.14 H new ATOM 0 HA SER A 109 -25.487 -67.687 50.023 1.00 33.05 H new ATOM 0 HB2 SER A 109 -26.520 -66.406 51.897 1.00 0.43 H new ATOM 0 HB3 SER A 109 -25.084 -65.648 51.238 1.00 0.43 H new ATOM 0 HG SER A 109 -27.529 -64.894 50.055 1.00 23.44 H new ATOM 1762 N TYR A 110 -27.776 -68.665 49.903 1.00 2.30 N ATOM 1763 CA TYR A 110 -29.071 -69.247 49.693 1.00 33.15 C ATOM 1764 C TYR A 110 -30.017 -68.966 50.847 1.00 42.12 C ATOM 1765 O TYR A 110 -30.039 -69.657 51.864 1.00 31.51 O ATOM 1766 CB TYR A 110 -29.021 -70.744 49.274 1.00 34.22 C ATOM 1767 CG TYR A 110 -28.290 -71.689 50.216 1.00 45.50 C ATOM 1768 CD1 TYR A 110 -26.926 -71.891 50.104 1.00 21.41 C ATOM 1769 CD2 TYR A 110 -28.971 -72.387 51.200 1.00 64.20 C ATOM 1770 CE1 TYR A 110 -26.255 -72.758 50.946 1.00 61.02 C ATOM 1771 CE2 TYR A 110 -28.315 -73.252 52.043 1.00 63.24 C ATOM 1772 CZ TYR A 110 -26.959 -73.436 51.915 1.00 15.03 C ATOM 1773 OH TYR A 110 -26.302 -74.304 52.762 1.00 3.21 O ATOM 0 H TYR A 110 -27.076 -69.294 50.296 1.00 2.30 H new ATOM 0 HA TYR A 110 -29.495 -68.741 48.826 1.00 33.15 H new ATOM 0 HB2 TYR A 110 -30.045 -71.101 49.160 1.00 34.22 H new ATOM 0 HB3 TYR A 110 -28.550 -70.808 48.293 1.00 34.22 H new ATOM 0 HD1 TYR A 110 -26.374 -71.360 49.343 1.00 21.41 H new ATOM 0 HD2 TYR A 110 -30.037 -72.249 51.307 1.00 64.20 H new ATOM 0 HE1 TYR A 110 -25.189 -72.902 50.845 1.00 61.02 H new ATOM 0 HE2 TYR A 110 -28.864 -73.786 52.804 1.00 63.24 H new ATOM 0 HH TYR A 110 -26.944 -74.700 53.388 1.00 3.21 H new ATOM 1783 N ILE A 111 -30.748 -67.910 50.691 1.00 42.42 N ATOM 1784 CA ILE A 111 -31.725 -67.493 51.641 1.00 34.12 C ATOM 1785 C ILE A 111 -33.050 -68.177 51.390 1.00 64.30 C ATOM 1786 O ILE A 111 -33.631 -68.727 52.335 1.00 38.79 O ATOM 1787 CB ILE A 111 -31.826 -65.923 51.792 1.00 45.24 C ATOM 1788 CG1 ILE A 111 -31.988 -65.164 50.439 1.00 75.24 C ATOM 1789 CG2 ILE A 111 -30.618 -65.394 52.542 1.00 24.50 C ATOM 1790 CD1 ILE A 111 -33.313 -65.344 49.740 1.00 52.41 C ATOM 1791 OXT ILE A 111 -33.454 -68.278 50.210 1.00 38.79 O ATOM 0 H ILE A 111 -30.679 -67.298 49.878 1.00 42.42 H new ATOM 0 HA ILE A 111 -31.386 -67.824 52.623 1.00 34.12 H new ATOM 0 HB ILE A 111 -32.738 -65.732 52.357 1.00 45.24 H new ATOM 0 HG12 ILE A 111 -31.836 -64.100 50.620 1.00 75.24 H new ATOM 0 HG13 ILE A 111 -31.196 -65.489 49.765 1.00 75.24 H new ATOM 0 HG21 ILE A 111 -30.697 -64.311 52.641 1.00 24.50 H new ATOM 0 HG22 ILE A 111 -30.578 -65.847 53.533 1.00 24.50 H new ATOM 0 HG23 ILE A 111 -29.711 -65.643 51.992 1.00 24.50 H new ATOM 0 HD11 ILE A 111 -33.315 -64.773 48.812 1.00 52.41 H new ATOM 0 HD12 ILE A 111 -33.466 -66.400 49.517 1.00 52.41 H new ATOM 0 HD13 ILE A 111 -34.116 -64.989 50.386 1.00 52.41 H new TER 1803 ILE A 111