USER MOD reduce.3.24.130724 H: found=0, std=0, add=1576, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1576 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 80 GLN : amide:sc= -0.154 K(o=3.9,f=0.68) USER MOD Set 1.2: A 84 GLN : amide:sc= 1.26 K(o=3.9,f=1.4) USER MOD Set 1.3: A 88 TYR OH : rot -112:sc= 2 USER MOD Set 1.4: A 107 THR OG1 : rot 91:sc= 0.854 USER MOD Set 1.5: A 163 SER OG : rot -172:sc= 1.64 USER MOD Set 1.6: A 167 GLN : amide:sc= -1.73! C(o=3.9!,f=1.4!) USER MOD Set 2.1: A 70 MET CE :methyl -161:sc= 0 (180deg=-0.12) USER MOD Set 2.2: A 108 HIS : no HD1:sc= -0.64 K(o=-0.64,f=-8.9!) USER MOD Set 3.1: A 43 GLN : amide:sc= -0.0648 K(o=0.55,f=-2!) USER MOD Set 3.2: A 44 HIS : no HD1:sc= 0 X(o=0.55,f=0.55) USER MOD Set 3.3: A 47 GLN : amide:sc= 0.615 K(o=0.55,f=-2) USER MOD Set 4.1: A 24 THR OG1 : rot 180:sc= 0.782 USER MOD Set 4.2: A 74 THR OG1 : rot -85:sc= 0.886 USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.0601 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot -52:sc= 0.0984 USER MOD Single : A 9 SER OG : rot 180:sc= 0.0674 USER MOD Single : A 15 SER OG : rot -17:sc= 0.863 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 160:sc= -0.188 (180deg=-0.823) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 26 HIS : no HD1:sc= -0.908 X(o=-0.91,f=-1) USER MOD Single : A 32 GLN : amide:sc= 0.559 K(o=0.56,f=-0.054) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0183) USER MOD Single : A 46 LYS NZ :NH3+ 155:sc= 1.28 (180deg=1.05) USER MOD Single : A 49 SER OG : rot 13:sc= 1.35 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= -1.15 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 165:sc= 0.137 (180deg=-0.182) USER MOD Single : A 90 LYS NZ :NH3+ 153:sc= 1.33 (180deg=1.08) USER MOD Single : A 92 LYS NZ :NH3+ 158:sc= 2.3 (180deg=1.72) USER MOD Single : A 95 ASN :FLIP amide:sc= 0 F(o=-0.71,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 165:sc= -0.0372 (180deg=-0.278) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ -148:sc= 0.376 (180deg=0.0516) USER MOD Single : A 126 THR OG1 : rot -170:sc= -0.294 USER MOD Single : A 128 ASN : amide:sc= -0.0183 X(o=-0.018,f=-0.35) USER MOD Single : A 131 GLN :FLIP amide:sc= -0.0928 F(o=-1.5!,f=-0.093) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 THR OG1 : rot -74:sc= 1.38 USER MOD Single : A 144 GLN : amide:sc= -0.789 K(o=-0.79,f=-4.2!) USER MOD Single : A 145 THR OG1 : rot -56:sc= 0.234 USER MOD Single : A 149 ASN : amide:sc= -1.3 K(o=-1.3,f=-2.6) USER MOD Single : A 151 GLN : amide:sc= -0.122 K(o=-0.12,f=-4.3!) USER MOD Single : A 155 LYS NZ :NH3+ -172:sc= -0.0124 (180deg=-0.136) USER MOD Single : A 159 HIS :FLIP no HD1:sc= 0.0687 F(o=-0.97,f=0.069) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 GLN : amide:sc= -0.302 K(o=-0.3,f=-3!) USER MOD Single : A 165 MET CE :methyl 142:sc= -1.08 (180deg=-3.28!) USER MOD Single : A 169 LYS NZ :NH3+ 174:sc= 0.837 (180deg=0.613) USER MOD Single : A 176 GLN :FLIP amide:sc= 0 F(o=-0.99,f=0) USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 179 GLN : amide:sc= -0.0649 X(o=-0.065,f=-0.051) USER MOD Single : A 180 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.39) USER MOD Single : A 181 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 182 GLN : amide:sc= 0 K(o=0,f=-0.98) USER MOD Single : A 183 LYS NZ :NH3+ -150:sc= 1.21 (180deg=0.144) USER MOD Single : A 185 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 186 SER OG : rot 180:sc= 0 USER MOD Single : A 188 GLN : amide:sc= -0.248 X(o=-0.25,f=-0.75) USER MOD Single : A 190 GLN : amide:sc= -0.0527 X(o=-0.053,f=-0.1) USER MOD Single : B 1 G O2' : rot -87:sc= 0.274 USER MOD Single : B 2 C O2' : rot -100:sc= -3.65! USER MOD Single : B 3 A O2' : rot 24:sc= 0.128 USER MOD Single : B 4 C O2' : rot 74:sc= 1.11 USER MOD Single : B 5 A O2' : rot -22:sc= -1.73! USER MOD Single : B 6 C O2' : rot -16:sc= 0.154 USER MOD Single : B 7 C O2' : rot 141:sc= -0.199 USER MOD Single : B 8 C O2' : rot 136:sc= 0.538 USER MOD Single : B 8 C O3' : rot 131:sc= 0.156 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 22.738 21.973 44.392 1.00 0.00 N ATOM 2 CA GLY A 1 23.889 21.805 43.474 1.00 0.00 C ATOM 3 C GLY A 1 24.102 23.029 42.613 1.00 0.00 C ATOM 4 O GLY A 1 23.199 23.855 42.463 1.00 0.00 O ATOM 0 H1 GLY A 1 23.077 21.989 45.375 1.00 0.00 H new ATOM 0 H2 GLY A 1 22.252 22.867 44.179 1.00 0.00 H new ATOM 0 H3 GLY A 1 22.076 21.181 44.267 1.00 0.00 H new ATOM 0 HA2 GLY A 1 24.791 21.607 44.054 1.00 0.00 H new ATOM 0 HA3 GLY A 1 23.722 20.937 42.837 1.00 0.00 H new ATOM 10 N ALA A 2 25.292 23.157 42.042 1.00 0.00 N ATOM 11 CA ALA A 2 25.610 24.292 41.190 1.00 0.00 C ATOM 12 C ALA A 2 25.165 24.031 39.756 1.00 0.00 C ATOM 13 O ALA A 2 25.992 23.893 38.855 1.00 0.00 O ATOM 14 CB ALA A 2 27.101 24.594 41.244 1.00 0.00 C ATOM 0 H ALA A 2 26.053 22.487 42.154 1.00 0.00 H new ATOM 0 HA ALA A 2 25.068 25.163 41.559 1.00 0.00 H new ATOM 0 HB1 ALA A 2 27.323 25.446 40.601 1.00 0.00 H new ATOM 0 HB2 ALA A 2 27.388 24.828 42.269 1.00 0.00 H new ATOM 0 HB3 ALA A 2 27.661 23.724 40.900 1.00 0.00 H new ATOM 20 N MET A 3 23.849 23.950 39.570 1.00 0.00 N ATOM 21 CA MET A 3 23.234 23.715 38.264 1.00 0.00 C ATOM 22 C MET A 3 23.644 22.355 37.693 1.00 0.00 C ATOM 23 O MET A 3 22.984 21.346 37.951 1.00 0.00 O ATOM 24 CB MET A 3 23.577 24.843 37.280 1.00 0.00 C ATOM 25 CG MET A 3 22.844 24.744 35.950 1.00 0.00 C ATOM 26 SD MET A 3 21.063 24.971 36.113 1.00 0.00 S ATOM 27 CE MET A 3 20.545 24.725 34.415 1.00 0.00 C ATOM 0 H MET A 3 23.173 24.046 40.328 1.00 0.00 H new ATOM 0 HA MET A 3 22.153 23.707 38.407 1.00 0.00 H new ATOM 0 HB2 MET A 3 23.341 25.801 37.744 1.00 0.00 H new ATOM 0 HB3 MET A 3 24.651 24.835 37.093 1.00 0.00 H new ATOM 0 HG2 MET A 3 23.240 25.495 35.266 1.00 0.00 H new ATOM 0 HG3 MET A 3 23.042 23.770 35.503 1.00 0.00 H new ATOM 0 HE1 MET A 3 19.463 24.833 34.346 1.00 0.00 H new ATOM 0 HE2 MET A 3 21.025 25.467 33.777 1.00 0.00 H new ATOM 0 HE3 MET A 3 20.832 23.725 34.088 1.00 0.00 H new ATOM 37 N GLY A 4 24.748 22.321 36.953 1.00 0.00 N ATOM 38 CA GLY A 4 25.179 21.091 36.321 1.00 0.00 C ATOM 39 C GLY A 4 24.450 20.837 35.015 1.00 0.00 C ATOM 40 O GLY A 4 23.232 20.643 35.010 1.00 0.00 O ATOM 0 H GLY A 4 25.351 23.125 36.781 1.00 0.00 H new ATOM 0 HA2 GLY A 4 26.252 21.136 36.134 1.00 0.00 H new ATOM 0 HA3 GLY A 4 25.008 20.255 37.000 1.00 0.00 H new ATOM 44 N PRO A 5 25.174 20.837 33.883 1.00 0.00 N ATOM 45 CA PRO A 5 24.590 20.623 32.554 1.00 0.00 C ATOM 46 C PRO A 5 24.244 19.156 32.296 1.00 0.00 C ATOM 47 O PRO A 5 24.633 18.579 31.282 1.00 0.00 O ATOM 48 CB PRO A 5 25.690 21.091 31.586 1.00 0.00 C ATOM 49 CG PRO A 5 26.770 21.679 32.439 1.00 0.00 C ATOM 50 CD PRO A 5 26.619 21.061 33.798 1.00 0.00 C ATOM 0 HA PRO A 5 23.650 21.163 32.440 1.00 0.00 H new ATOM 0 HB2 PRO A 5 26.070 20.257 30.995 1.00 0.00 H new ATOM 0 HB3 PRO A 5 25.303 21.829 30.883 1.00 0.00 H new ATOM 0 HG2 PRO A 5 27.754 21.465 32.022 1.00 0.00 H new ATOM 0 HG3 PRO A 5 26.675 22.764 32.493 1.00 0.00 H new ATOM 0 HD2 PRO A 5 27.180 20.131 33.886 1.00 0.00 H new ATOM 0 HD3 PRO A 5 26.975 21.723 34.587 1.00 0.00 H new ATOM 58 N SER A 6 23.516 18.559 33.221 1.00 0.00 N ATOM 59 CA SER A 6 23.071 17.186 33.083 1.00 0.00 C ATOM 60 C SER A 6 21.569 17.110 33.326 1.00 0.00 C ATOM 61 O SER A 6 21.049 17.803 34.202 1.00 0.00 O ATOM 62 CB SER A 6 23.821 16.293 34.068 1.00 0.00 C ATOM 63 OG SER A 6 25.222 16.424 33.893 1.00 0.00 O ATOM 0 H SER A 6 23.218 19.010 34.086 1.00 0.00 H new ATOM 0 HA SER A 6 23.282 16.836 32.073 1.00 0.00 H new ATOM 0 HB2 SER A 6 23.550 16.561 35.089 1.00 0.00 H new ATOM 0 HB3 SER A 6 23.526 15.254 33.922 1.00 0.00 H new ATOM 0 HG SER A 6 25.687 15.846 34.533 1.00 0.00 H new ATOM 69 N SER A 7 20.882 16.289 32.536 1.00 0.00 N ATOM 70 CA SER A 7 19.430 16.171 32.615 1.00 0.00 C ATOM 71 C SER A 7 18.793 17.533 32.331 1.00 0.00 C ATOM 72 O SER A 7 17.854 17.960 33.005 1.00 0.00 O ATOM 73 CB SER A 7 19.006 15.635 33.992 1.00 0.00 C ATOM 74 OG SER A 7 17.643 15.238 34.000 1.00 0.00 O ATOM 0 H SER A 7 21.312 15.692 31.829 1.00 0.00 H new ATOM 0 HA SER A 7 19.084 15.460 31.865 1.00 0.00 H new ATOM 0 HB2 SER A 7 19.635 14.786 34.262 1.00 0.00 H new ATOM 0 HB3 SER A 7 19.166 16.404 34.748 1.00 0.00 H new ATOM 0 HG SER A 7 17.088 15.968 33.655 1.00 0.00 H new ATOM 80 N VAL A 8 19.334 18.212 31.325 1.00 0.00 N ATOM 81 CA VAL A 8 18.874 19.541 30.957 1.00 0.00 C ATOM 82 C VAL A 8 17.468 19.482 30.365 1.00 0.00 C ATOM 83 O VAL A 8 17.125 18.548 29.634 1.00 0.00 O ATOM 84 CB VAL A 8 19.852 20.207 29.959 1.00 0.00 C ATOM 85 CG1 VAL A 8 19.960 19.402 28.673 1.00 0.00 C ATOM 86 CG2 VAL A 8 19.443 21.644 29.661 1.00 0.00 C ATOM 0 H VAL A 8 20.097 17.858 30.748 1.00 0.00 H new ATOM 0 HA VAL A 8 18.842 20.148 31.862 1.00 0.00 H new ATOM 0 HB VAL A 8 20.835 20.226 30.429 1.00 0.00 H new ATOM 0 HG11 VAL A 8 20.654 19.895 27.992 1.00 0.00 H new ATOM 0 HG12 VAL A 8 20.325 18.400 28.900 1.00 0.00 H new ATOM 0 HG13 VAL A 8 18.979 19.333 28.204 1.00 0.00 H new ATOM 0 HG21 VAL A 8 20.149 22.085 28.957 1.00 0.00 H new ATOM 0 HG22 VAL A 8 18.443 21.655 29.227 1.00 0.00 H new ATOM 0 HG23 VAL A 8 19.444 22.222 30.585 1.00 0.00 H new ATOM 96 N SER A 9 16.652 20.466 30.706 1.00 0.00 N ATOM 97 CA SER A 9 15.289 20.538 30.220 1.00 0.00 C ATOM 98 C SER A 9 15.249 20.983 28.758 1.00 0.00 C ATOM 99 O SER A 9 14.931 22.135 28.447 1.00 0.00 O ATOM 100 CB SER A 9 14.490 21.491 31.103 1.00 0.00 C ATOM 101 OG SER A 9 15.309 22.553 31.574 1.00 0.00 O ATOM 0 H SER A 9 16.917 21.233 31.325 1.00 0.00 H new ATOM 0 HA SER A 9 14.841 19.545 30.268 1.00 0.00 H new ATOM 0 HB2 SER A 9 13.650 21.897 30.540 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.073 20.945 31.949 1.00 0.00 H new ATOM 0 HG SER A 9 14.776 23.153 32.137 1.00 0.00 H new ATOM 107 N GLY A 10 15.594 20.063 27.869 1.00 0.00 N ATOM 108 CA GLY A 10 15.569 20.345 26.452 1.00 0.00 C ATOM 109 C GLY A 10 14.586 19.458 25.718 1.00 0.00 C ATOM 110 O GLY A 10 13.545 19.095 26.274 1.00 0.00 O ATOM 0 H GLY A 10 15.893 19.118 28.109 1.00 0.00 H new ATOM 0 HA2 GLY A 10 15.303 21.390 26.294 1.00 0.00 H new ATOM 0 HA3 GLY A 10 16.567 20.204 26.036 1.00 0.00 H new ATOM 114 N ALA A 11 14.928 19.101 24.479 1.00 0.00 N ATOM 115 CA ALA A 11 14.062 18.283 23.629 1.00 0.00 C ATOM 116 C ALA A 11 12.688 18.934 23.477 1.00 0.00 C ATOM 117 O ALA A 11 11.659 18.252 23.441 1.00 0.00 O ATOM 118 CB ALA A 11 13.936 16.870 24.189 1.00 0.00 C ATOM 0 H ALA A 11 15.808 19.369 24.039 1.00 0.00 H new ATOM 0 HA ALA A 11 14.516 18.215 22.641 1.00 0.00 H new ATOM 0 HB1 ALA A 11 13.288 16.279 23.542 1.00 0.00 H new ATOM 0 HB2 ALA A 11 14.922 16.408 24.235 1.00 0.00 H new ATOM 0 HB3 ALA A 11 13.508 16.912 25.190 1.00 0.00 H new ATOM 124 N ALA A 12 12.686 20.260 23.377 1.00 0.00 N ATOM 125 CA ALA A 12 11.446 21.028 23.338 1.00 0.00 C ATOM 126 C ALA A 12 10.691 20.850 22.014 1.00 0.00 C ATOM 127 O ALA A 12 9.511 20.491 22.028 1.00 0.00 O ATOM 128 CB ALA A 12 11.717 22.500 23.622 1.00 0.00 C ATOM 0 H ALA A 12 13.532 20.826 23.321 1.00 0.00 H new ATOM 0 HA ALA A 12 10.799 20.637 24.123 1.00 0.00 H new ATOM 0 HB1 ALA A 12 10.780 23.056 23.588 1.00 0.00 H new ATOM 0 HB2 ALA A 12 12.165 22.603 24.610 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.401 22.896 22.871 1.00 0.00 H new ATOM 134 N PRO A 13 11.333 21.097 20.846 1.00 0.00 N ATOM 135 CA PRO A 13 10.668 20.947 19.547 1.00 0.00 C ATOM 136 C PRO A 13 10.351 19.488 19.239 1.00 0.00 C ATOM 137 O PRO A 13 9.347 19.178 18.597 1.00 0.00 O ATOM 138 CB PRO A 13 11.684 21.502 18.535 1.00 0.00 C ATOM 139 CG PRO A 13 12.690 22.239 19.352 1.00 0.00 C ATOM 140 CD PRO A 13 12.723 21.551 20.681 1.00 0.00 C ATOM 0 HA PRO A 13 9.711 21.468 19.520 1.00 0.00 H new ATOM 0 HB2 PRO A 13 12.152 20.698 17.966 1.00 0.00 H new ATOM 0 HB3 PRO A 13 11.201 22.163 17.815 1.00 0.00 H new ATOM 0 HG2 PRO A 13 13.671 22.217 18.877 1.00 0.00 H new ATOM 0 HG3 PRO A 13 12.412 23.287 19.462 1.00 0.00 H new ATOM 0 HD2 PRO A 13 13.425 20.717 20.688 1.00 0.00 H new ATOM 0 HD3 PRO A 13 13.025 22.228 21.480 1.00 0.00 H new ATOM 148 N PHE A 14 11.211 18.597 19.712 1.00 0.00 N ATOM 149 CA PHE A 14 11.035 17.169 19.510 1.00 0.00 C ATOM 150 C PHE A 14 11.759 16.383 20.597 1.00 0.00 C ATOM 151 O PHE A 14 12.961 16.544 20.806 1.00 0.00 O ATOM 152 CB PHE A 14 11.517 16.743 18.110 1.00 0.00 C ATOM 153 CG PHE A 14 12.866 17.284 17.717 1.00 0.00 C ATOM 154 CD1 PHE A 14 12.972 18.505 17.068 1.00 0.00 C ATOM 155 CD2 PHE A 14 14.021 16.572 17.985 1.00 0.00 C ATOM 156 CE1 PHE A 14 14.205 19.005 16.699 1.00 0.00 C ATOM 157 CE2 PHE A 14 15.258 17.066 17.619 1.00 0.00 C ATOM 158 CZ PHE A 14 15.349 18.284 16.975 1.00 0.00 C ATOM 0 H PHE A 14 12.046 18.844 20.244 1.00 0.00 H new ATOM 0 HA PHE A 14 9.970 16.946 19.576 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.551 15.654 18.068 1.00 0.00 H new ATOM 0 HB3 PHE A 14 10.782 17.067 17.373 1.00 0.00 H new ATOM 0 HD1 PHE A 14 12.079 19.072 16.849 1.00 0.00 H new ATOM 0 HD2 PHE A 14 13.955 15.618 18.487 1.00 0.00 H new ATOM 0 HE1 PHE A 14 14.274 19.958 16.196 1.00 0.00 H new ATOM 0 HE2 PHE A 14 16.152 16.501 17.836 1.00 0.00 H new ATOM 0 HZ PHE A 14 16.315 18.672 16.687 1.00 0.00 H new ATOM 168 N SER A 15 11.008 15.564 21.315 1.00 0.00 N ATOM 169 CA SER A 15 11.582 14.690 22.325 1.00 0.00 C ATOM 170 C SER A 15 11.836 13.312 21.726 1.00 0.00 C ATOM 171 O SER A 15 12.684 12.554 22.197 1.00 0.00 O ATOM 172 CB SER A 15 10.644 14.579 23.527 1.00 0.00 C ATOM 173 OG SER A 15 10.279 15.861 24.014 1.00 0.00 O ATOM 0 H SER A 15 9.996 15.486 21.217 1.00 0.00 H new ATOM 0 HA SER A 15 12.528 15.112 22.664 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.748 14.027 23.243 1.00 0.00 H new ATOM 0 HB3 SER A 15 11.131 14.011 24.320 1.00 0.00 H new ATOM 0 HG SER A 15 10.902 16.533 23.666 1.00 0.00 H new ATOM 179 N SER A 16 11.090 13.001 20.675 1.00 0.00 N ATOM 180 CA SER A 16 11.248 11.749 19.961 1.00 0.00 C ATOM 181 C SER A 16 11.791 12.022 18.563 1.00 0.00 C ATOM 182 O SER A 16 11.343 12.946 17.879 1.00 0.00 O ATOM 183 CB SER A 16 9.907 11.018 19.888 1.00 0.00 C ATOM 184 OG SER A 16 9.358 10.841 21.186 1.00 0.00 O ATOM 0 H SER A 16 10.363 13.608 20.298 1.00 0.00 H new ATOM 0 HA SER A 16 11.957 11.114 20.493 1.00 0.00 H new ATOM 0 HB2 SER A 16 9.212 11.585 19.268 1.00 0.00 H new ATOM 0 HB3 SER A 16 10.042 10.048 19.410 1.00 0.00 H new ATOM 0 HG SER A 16 8.500 10.373 21.117 1.00 0.00 H new ATOM 190 N PHE A 17 12.765 11.227 18.147 1.00 0.00 N ATOM 191 CA PHE A 17 13.428 11.438 16.869 1.00 0.00 C ATOM 192 C PHE A 17 12.843 10.516 15.808 1.00 0.00 C ATOM 193 O PHE A 17 12.981 9.297 15.902 1.00 0.00 O ATOM 194 CB PHE A 17 14.933 11.189 17.005 1.00 0.00 C ATOM 195 CG PHE A 17 15.567 11.938 18.144 1.00 0.00 C ATOM 196 CD1 PHE A 17 15.786 13.303 18.057 1.00 0.00 C ATOM 197 CD2 PHE A 17 15.937 11.276 19.305 1.00 0.00 C ATOM 198 CE1 PHE A 17 16.362 13.994 19.105 1.00 0.00 C ATOM 199 CE2 PHE A 17 16.514 11.960 20.355 1.00 0.00 C ATOM 200 CZ PHE A 17 16.727 13.321 20.257 1.00 0.00 C ATOM 0 H PHE A 17 13.114 10.428 18.677 1.00 0.00 H new ATOM 0 HA PHE A 17 13.266 12.472 16.563 1.00 0.00 H new ATOM 0 HB2 PHE A 17 15.105 10.122 17.143 1.00 0.00 H new ATOM 0 HB3 PHE A 17 15.425 11.474 16.075 1.00 0.00 H new ATOM 0 HD1 PHE A 17 15.503 13.833 17.159 1.00 0.00 H new ATOM 0 HD2 PHE A 17 15.771 10.212 19.388 1.00 0.00 H new ATOM 0 HE1 PHE A 17 16.527 15.058 19.025 1.00 0.00 H new ATOM 0 HE2 PHE A 17 16.799 11.432 21.253 1.00 0.00 H new ATOM 0 HZ PHE A 17 17.178 13.859 21.078 1.00 0.00 H new ATOM 210 N MET A 18 12.183 11.109 14.810 1.00 0.00 N ATOM 211 CA MET A 18 11.562 10.355 13.717 1.00 0.00 C ATOM 212 C MET A 18 10.491 9.406 14.244 1.00 0.00 C ATOM 213 O MET A 18 10.753 8.226 14.492 1.00 0.00 O ATOM 214 CB MET A 18 12.610 9.574 12.918 1.00 0.00 C ATOM 215 CG MET A 18 13.579 10.456 12.145 1.00 0.00 C ATOM 216 SD MET A 18 14.780 9.498 11.196 1.00 0.00 S ATOM 217 CE MET A 18 13.699 8.563 10.113 1.00 0.00 C ATOM 0 H MET A 18 12.064 12.119 14.736 1.00 0.00 H new ATOM 0 HA MET A 18 11.088 11.077 13.052 1.00 0.00 H new ATOM 0 HB2 MET A 18 13.176 8.941 13.601 1.00 0.00 H new ATOM 0 HB3 MET A 18 12.100 8.912 12.219 1.00 0.00 H new ATOM 0 HG2 MET A 18 13.018 11.101 11.469 1.00 0.00 H new ATOM 0 HG3 MET A 18 14.107 11.107 12.841 1.00 0.00 H new ATOM 0 HE1 MET A 18 14.265 8.208 9.252 1.00 0.00 H new ATOM 0 HE2 MET A 18 13.290 7.711 10.655 1.00 0.00 H new ATOM 0 HE3 MET A 18 12.884 9.202 9.773 1.00 0.00 H new ATOM 227 N PRO A 19 9.264 9.911 14.421 1.00 0.00 N ATOM 228 CA PRO A 19 8.160 9.115 14.949 1.00 0.00 C ATOM 229 C PRO A 19 7.544 8.199 13.892 1.00 0.00 C ATOM 230 O PRO A 19 7.383 8.591 12.732 1.00 0.00 O ATOM 231 CB PRO A 19 7.154 10.178 15.389 1.00 0.00 C ATOM 232 CG PRO A 19 7.385 11.323 14.463 1.00 0.00 C ATOM 233 CD PRO A 19 8.851 11.297 14.113 1.00 0.00 C ATOM 0 HA PRO A 19 8.478 8.445 15.748 1.00 0.00 H new ATOM 0 HB2 PRO A 19 6.131 9.809 15.316 1.00 0.00 H new ATOM 0 HB3 PRO A 19 7.314 10.469 16.427 1.00 0.00 H new ATOM 0 HG2 PRO A 19 6.770 11.229 13.568 1.00 0.00 H new ATOM 0 HG3 PRO A 19 7.115 12.267 14.937 1.00 0.00 H new ATOM 0 HD2 PRO A 19 9.016 11.539 13.063 1.00 0.00 H new ATOM 0 HD3 PRO A 19 9.415 12.022 14.700 1.00 0.00 H new ATOM 241 N PRO A 20 7.204 6.960 14.272 1.00 0.00 N ATOM 242 CA PRO A 20 6.499 6.025 13.396 1.00 0.00 C ATOM 243 C PRO A 20 5.023 6.398 13.277 1.00 0.00 C ATOM 244 O PRO A 20 4.139 5.617 13.634 1.00 0.00 O ATOM 245 CB PRO A 20 6.667 4.663 14.094 1.00 0.00 C ATOM 246 CG PRO A 20 7.602 4.901 15.237 1.00 0.00 C ATOM 247 CD PRO A 20 7.488 6.359 15.576 1.00 0.00 C ATOM 0 HA PRO A 20 6.891 6.026 12.379 1.00 0.00 H new ATOM 0 HB2 PRO A 20 5.708 4.284 14.446 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.071 3.919 13.407 1.00 0.00 H new ATOM 0 HG2 PRO A 20 7.336 4.281 16.093 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.625 4.644 14.963 1.00 0.00 H new ATOM 0 HD2 PRO A 20 6.690 6.549 16.294 1.00 0.00 H new ATOM 0 HD3 PRO A 20 8.408 6.749 16.012 1.00 0.00 H new ATOM 255 N GLU A 21 4.781 7.605 12.777 1.00 0.00 N ATOM 256 CA GLU A 21 3.442 8.176 12.704 1.00 0.00 C ATOM 257 C GLU A 21 2.517 7.347 11.815 1.00 0.00 C ATOM 258 O GLU A 21 1.655 6.617 12.308 1.00 0.00 O ATOM 259 CB GLU A 21 3.526 9.618 12.187 1.00 0.00 C ATOM 260 CG GLU A 21 2.182 10.319 12.095 1.00 0.00 C ATOM 261 CD GLU A 21 2.305 11.746 11.602 1.00 0.00 C ATOM 262 OE1 GLU A 21 2.509 12.649 12.437 1.00 0.00 O ATOM 263 OE2 GLU A 21 2.191 11.973 10.376 1.00 0.00 O1- ATOM 0 H GLU A 21 5.510 8.216 12.410 1.00 0.00 H new ATOM 0 HA GLU A 21 3.017 8.170 13.708 1.00 0.00 H new ATOM 0 HB2 GLU A 21 4.179 10.192 12.844 1.00 0.00 H new ATOM 0 HB3 GLU A 21 3.990 9.613 11.201 1.00 0.00 H new ATOM 0 HG2 GLU A 21 1.530 9.761 11.423 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.707 10.316 13.076 1.00 0.00 H new ATOM 270 N GLN A 22 2.694 7.453 10.508 1.00 0.00 N ATOM 271 CA GLN A 22 1.818 6.766 9.574 1.00 0.00 C ATOM 272 C GLN A 22 2.610 6.067 8.486 1.00 0.00 C ATOM 273 O GLN A 22 3.215 6.709 7.628 1.00 0.00 O ATOM 274 CB GLN A 22 0.821 7.743 8.949 1.00 0.00 C ATOM 275 CG GLN A 22 -0.211 8.262 9.934 1.00 0.00 C ATOM 276 CD GLN A 22 -1.163 9.272 9.322 1.00 0.00 C ATOM 277 OE1 GLN A 22 -1.466 9.220 8.132 1.00 0.00 O ATOM 278 NE2 GLN A 22 -1.643 10.198 10.138 1.00 0.00 N ATOM 0 H GLN A 22 3.432 8.005 10.072 1.00 0.00 H new ATOM 0 HA GLN A 22 1.268 6.010 10.135 1.00 0.00 H new ATOM 0 HB2 GLN A 22 1.366 8.587 8.527 1.00 0.00 H new ATOM 0 HB3 GLN A 22 0.309 7.249 8.123 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -0.785 7.422 10.326 1.00 0.00 H new ATOM 0 HG3 GLN A 22 0.301 8.721 10.780 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -1.366 10.206 11.120 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -2.290 10.903 9.785 1.00 0.00 H new ATOM 287 N GLU A 23 2.615 4.749 8.547 1.00 0.00 N ATOM 288 CA GLU A 23 3.232 3.941 7.509 1.00 0.00 C ATOM 289 C GLU A 23 2.166 3.526 6.502 1.00 0.00 C ATOM 290 O GLU A 23 1.355 2.633 6.766 1.00 0.00 O ATOM 291 CB GLU A 23 3.916 2.718 8.125 1.00 0.00 C ATOM 292 CG GLU A 23 4.702 1.886 7.124 1.00 0.00 C ATOM 293 CD GLU A 23 5.481 0.764 7.782 1.00 0.00 C ATOM 294 OE1 GLU A 23 4.929 -0.345 7.927 1.00 0.00 O1- ATOM 295 OE2 GLU A 23 6.648 0.989 8.151 1.00 0.00 O ATOM 0 H GLU A 23 2.197 4.212 9.307 1.00 0.00 H new ATOM 0 HA GLU A 23 3.997 4.523 6.994 1.00 0.00 H new ATOM 0 HB2 GLU A 23 4.589 3.049 8.916 1.00 0.00 H new ATOM 0 HB3 GLU A 23 3.160 2.088 8.593 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.016 1.465 6.389 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.392 2.533 6.582 1.00 0.00 H new ATOM 302 N THR A 24 2.152 4.204 5.363 1.00 0.00 N ATOM 303 CA THR A 24 1.154 3.960 4.340 1.00 0.00 C ATOM 304 C THR A 24 1.741 3.175 3.173 1.00 0.00 C ATOM 305 O THR A 24 2.629 3.652 2.460 1.00 0.00 O ATOM 306 CB THR A 24 0.569 5.287 3.823 1.00 0.00 C ATOM 307 OG1 THR A 24 0.046 6.048 4.919 1.00 0.00 O ATOM 308 CG2 THR A 24 -0.530 5.039 2.801 1.00 0.00 C ATOM 0 H THR A 24 2.827 4.931 5.126 1.00 0.00 H new ATOM 0 HA THR A 24 0.359 3.369 4.794 1.00 0.00 H new ATOM 0 HB THR A 24 1.369 5.846 3.338 1.00 0.00 H new ATOM 0 HG1 THR A 24 -0.323 6.892 4.585 1.00 0.00 H new ATOM 0 HG21 THR A 24 -0.925 5.993 2.453 1.00 0.00 H new ATOM 0 HG22 THR A 24 -0.122 4.485 1.956 1.00 0.00 H new ATOM 0 HG23 THR A 24 -1.331 4.461 3.261 1.00 0.00 H new ATOM 316 N VAL A 25 1.257 1.963 2.997 1.00 0.00 N ATOM 317 CA VAL A 25 1.648 1.129 1.894 1.00 0.00 C ATOM 318 C VAL A 25 0.382 0.663 1.159 1.00 0.00 C ATOM 319 O VAL A 25 -0.686 0.568 1.762 1.00 0.00 O ATOM 320 CB VAL A 25 2.490 -0.059 2.414 1.00 0.00 C ATOM 321 CG1 VAL A 25 2.648 -1.109 1.341 1.00 0.00 C ATOM 322 CG2 VAL A 25 3.861 0.421 2.914 1.00 0.00 C ATOM 0 H VAL A 25 0.577 1.532 3.623 1.00 0.00 H new ATOM 0 HA VAL A 25 2.269 1.682 1.190 1.00 0.00 H new ATOM 0 HB VAL A 25 1.962 -0.508 3.255 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.243 -1.937 1.727 1.00 0.00 H new ATOM 0 HG12 VAL A 25 1.666 -1.476 1.044 1.00 0.00 H new ATOM 0 HG13 VAL A 25 3.149 -0.673 0.477 1.00 0.00 H new ATOM 0 HG21 VAL A 25 4.436 -0.432 3.275 1.00 0.00 H new ATOM 0 HG22 VAL A 25 4.399 0.901 2.096 1.00 0.00 H new ATOM 0 HG23 VAL A 25 3.723 1.135 3.726 1.00 0.00 H new ATOM 332 N HIS A 26 0.479 0.431 -0.147 1.00 0.00 N ATOM 333 CA HIS A 26 -0.696 0.110 -0.957 1.00 0.00 C ATOM 334 C HIS A 26 -0.665 -1.357 -1.368 1.00 0.00 C ATOM 335 O HIS A 26 0.403 -1.917 -1.595 1.00 0.00 O ATOM 336 CB HIS A 26 -0.758 1.007 -2.202 1.00 0.00 C ATOM 337 CG HIS A 26 -0.890 2.476 -1.903 1.00 0.00 C ATOM 338 ND1 HIS A 26 -1.829 3.287 -2.505 1.00 0.00 N ATOM 339 CD2 HIS A 26 -0.177 3.285 -1.079 1.00 0.00 C ATOM 340 CE1 HIS A 26 -1.688 4.526 -2.068 1.00 0.00 C ATOM 341 NE2 HIS A 26 -0.692 4.552 -1.201 1.00 0.00 N ATOM 0 H HIS A 26 1.356 0.459 -0.667 1.00 0.00 H new ATOM 0 HA HIS A 26 -1.588 0.291 -0.357 1.00 0.00 H new ATOM 0 HB2 HIS A 26 0.143 0.849 -2.794 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -1.603 0.696 -2.817 1.00 0.00 H new ATOM 0 HD2 HIS A 26 0.644 2.987 -0.444 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -2.286 5.374 -2.369 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -0.360 5.378 -0.703 1.00 0.00 H new ATOM 350 N VAL A 27 -1.828 -1.981 -1.474 1.00 0.00 N ATOM 351 CA VAL A 27 -1.886 -3.414 -1.753 1.00 0.00 C ATOM 352 C VAL A 27 -2.653 -3.696 -3.046 1.00 0.00 C ATOM 353 O VAL A 27 -3.733 -3.154 -3.266 1.00 0.00 O ATOM 354 CB VAL A 27 -2.529 -4.190 -0.582 1.00 0.00 C ATOM 355 CG1 VAL A 27 -2.398 -5.689 -0.786 1.00 0.00 C ATOM 356 CG2 VAL A 27 -1.911 -3.778 0.749 1.00 0.00 C ATOM 0 H VAL A 27 -2.736 -1.528 -1.373 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.859 -3.758 -1.874 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.590 -3.939 -0.560 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.859 -6.212 0.052 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.898 -5.975 -1.711 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.343 -5.957 -0.846 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.381 -4.338 1.557 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.842 -3.989 0.735 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.068 -2.711 0.908 1.00 0.00 H new ATOM 366 N PHE A 28 -2.078 -4.546 -3.889 1.00 0.00 N ATOM 367 CA PHE A 28 -2.624 -4.872 -5.196 1.00 0.00 C ATOM 368 C PHE A 28 -3.497 -6.124 -5.102 1.00 0.00 C ATOM 369 O PHE A 28 -2.978 -7.233 -5.006 1.00 0.00 O ATOM 370 CB PHE A 28 -1.420 -5.135 -6.101 1.00 0.00 C ATOM 371 CG PHE A 28 -1.653 -5.136 -7.574 1.00 0.00 C ATOM 372 CD1 PHE A 28 -1.608 -3.956 -8.287 1.00 0.00 C ATOM 373 CD2 PHE A 28 -1.858 -6.324 -8.252 1.00 0.00 C ATOM 374 CE1 PHE A 28 -1.772 -3.955 -9.655 1.00 0.00 C ATOM 375 CE2 PHE A 28 -2.017 -6.333 -9.621 1.00 0.00 C ATOM 376 CZ PHE A 28 -1.976 -5.147 -10.326 1.00 0.00 C ATOM 0 H PHE A 28 -1.207 -5.034 -3.678 1.00 0.00 H new ATOM 0 HA PHE A 28 -3.247 -4.066 -5.584 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -0.663 -4.382 -5.881 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -0.998 -6.102 -5.827 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -1.443 -3.024 -7.768 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.894 -7.254 -7.703 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.741 -3.025 -10.203 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -2.173 -7.266 -10.141 1.00 0.00 H new ATOM 0 HZ PHE A 28 -2.103 -5.150 -11.399 1.00 0.00 H new ATOM 386 N ILE A 29 -4.814 -5.958 -5.128 1.00 0.00 N ATOM 387 CA ILE A 29 -5.710 -7.106 -5.076 1.00 0.00 C ATOM 388 C ILE A 29 -6.707 -7.080 -6.235 1.00 0.00 C ATOM 389 O ILE A 29 -7.416 -6.095 -6.447 1.00 0.00 O ATOM 390 CB ILE A 29 -6.454 -7.193 -3.725 1.00 0.00 C ATOM 391 CG1 ILE A 29 -7.126 -5.861 -3.383 1.00 0.00 C ATOM 392 CG2 ILE A 29 -5.495 -7.608 -2.618 1.00 0.00 C ATOM 393 CD1 ILE A 29 -7.760 -5.833 -2.007 1.00 0.00 C ATOM 0 H ILE A 29 -5.280 -5.052 -5.184 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.092 -7.998 -5.172 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.233 -7.950 -3.813 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.386 -5.064 -3.448 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.891 -5.648 -4.130 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.034 -7.665 -1.672 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -5.069 -8.584 -2.852 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.694 -6.873 -2.536 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.216 -4.858 -1.836 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.525 -6.607 -1.943 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.996 -6.014 -1.251 1.00 0.00 H new ATOM 405 N PRO A 30 -6.737 -8.177 -7.014 1.00 0.00 N ATOM 406 CA PRO A 30 -7.541 -8.307 -8.236 1.00 0.00 C ATOM 407 C PRO A 30 -8.973 -7.825 -8.089 1.00 0.00 C ATOM 408 O PRO A 30 -9.627 -8.085 -7.086 1.00 0.00 O ATOM 409 CB PRO A 30 -7.543 -9.813 -8.518 1.00 0.00 C ATOM 410 CG PRO A 30 -6.865 -10.452 -7.353 1.00 0.00 C ATOM 411 CD PRO A 30 -5.976 -9.400 -6.763 1.00 0.00 C ATOM 0 HA PRO A 30 -7.118 -7.692 -9.030 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -8.561 -10.187 -8.630 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.017 -10.037 -9.446 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -7.594 -10.802 -6.622 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -6.286 -11.321 -7.667 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -5.805 -9.562 -5.699 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.998 -9.377 -7.244 1.00 0.00 H new ATOM 419 N ALA A 31 -9.458 -7.168 -9.137 1.00 0.00 N ATOM 420 CA ALA A 31 -10.789 -6.565 -9.160 1.00 0.00 C ATOM 421 C ALA A 31 -11.906 -7.575 -8.895 1.00 0.00 C ATOM 422 O ALA A 31 -13.022 -7.188 -8.557 1.00 0.00 O ATOM 423 CB ALA A 31 -11.020 -5.872 -10.493 1.00 0.00 C ATOM 0 H ALA A 31 -8.935 -7.037 -10.003 1.00 0.00 H new ATOM 0 HA ALA A 31 -10.822 -5.837 -8.349 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -12.014 -5.425 -10.503 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -10.270 -5.093 -10.633 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -10.942 -6.600 -11.300 1.00 0.00 H new ATOM 429 N GLN A 32 -11.618 -8.860 -9.059 1.00 0.00 N ATOM 430 CA GLN A 32 -12.618 -9.889 -8.802 1.00 0.00 C ATOM 431 C GLN A 32 -12.572 -10.349 -7.348 1.00 0.00 C ATOM 432 O GLN A 32 -13.589 -10.746 -6.782 1.00 0.00 O ATOM 433 CB GLN A 32 -12.431 -11.092 -9.721 1.00 0.00 C ATOM 434 CG GLN A 32 -11.157 -11.853 -9.454 1.00 0.00 C ATOM 435 CD GLN A 32 -11.136 -13.200 -10.142 1.00 0.00 C ATOM 436 OE1 GLN A 32 -10.699 -13.319 -11.284 1.00 0.00 O ATOM 437 NE2 GLN A 32 -11.601 -14.225 -9.447 1.00 0.00 N ATOM 0 H GLN A 32 -10.711 -9.212 -9.365 1.00 0.00 H new ATOM 0 HA GLN A 32 -13.592 -9.443 -9.004 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -13.280 -11.766 -9.604 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -12.434 -10.753 -10.757 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -10.306 -11.262 -9.792 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -11.040 -11.995 -8.380 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -11.955 -14.081 -8.501 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -11.606 -15.159 -9.857 1.00 0.00 H new ATOM 446 N ALA A 33 -11.395 -10.280 -6.737 1.00 0.00 N ATOM 447 CA ALA A 33 -11.217 -10.788 -5.395 1.00 0.00 C ATOM 448 C ALA A 33 -11.347 -9.658 -4.405 1.00 0.00 C ATOM 449 O ALA A 33 -11.841 -9.851 -3.302 1.00 0.00 O ATOM 450 CB ALA A 33 -9.858 -11.453 -5.263 1.00 0.00 C ATOM 0 H ALA A 33 -10.556 -9.877 -7.154 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.986 -11.532 -5.188 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.735 -11.832 -4.248 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.787 -12.280 -5.970 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -9.075 -10.726 -5.476 1.00 0.00 H new ATOM 456 N VAL A 34 -10.956 -8.463 -4.848 1.00 0.00 N ATOM 457 CA VAL A 34 -11.030 -7.264 -4.030 1.00 0.00 C ATOM 458 C VAL A 34 -12.448 -7.088 -3.504 1.00 0.00 C ATOM 459 O VAL A 34 -12.666 -6.560 -2.408 1.00 0.00 O ATOM 460 CB VAL A 34 -10.599 -6.009 -4.833 1.00 0.00 C ATOM 461 CG1 VAL A 34 -11.594 -5.690 -5.937 1.00 0.00 C ATOM 462 CG2 VAL A 34 -10.427 -4.809 -3.917 1.00 0.00 C ATOM 0 H VAL A 34 -10.580 -8.305 -5.783 1.00 0.00 H new ATOM 0 HA VAL A 34 -10.343 -7.378 -3.192 1.00 0.00 H new ATOM 0 HB VAL A 34 -9.638 -6.232 -5.296 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -11.263 -4.805 -6.481 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -11.659 -6.534 -6.623 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -12.574 -5.501 -5.500 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -10.125 -3.943 -4.505 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -11.371 -4.596 -3.416 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -9.662 -5.027 -3.172 1.00 0.00 H new ATOM 472 N GLY A 35 -13.405 -7.572 -4.292 1.00 0.00 N ATOM 473 CA GLY A 35 -14.775 -7.542 -3.878 1.00 0.00 C ATOM 474 C GLY A 35 -14.971 -8.291 -2.594 1.00 0.00 C ATOM 475 O GLY A 35 -15.337 -7.706 -1.581 1.00 0.00 O ATOM 0 H GLY A 35 -13.243 -7.983 -5.211 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -15.097 -6.508 -3.752 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -15.402 -7.978 -4.656 1.00 0.00 H new ATOM 479 N ALA A 36 -14.587 -9.552 -2.607 1.00 0.00 N ATOM 480 CA ALA A 36 -14.810 -10.428 -1.481 1.00 0.00 C ATOM 481 C ALA A 36 -13.804 -10.161 -0.367 1.00 0.00 C ATOM 482 O ALA A 36 -13.978 -10.634 0.758 1.00 0.00 O ATOM 483 CB ALA A 36 -14.764 -11.869 -1.941 1.00 0.00 C ATOM 0 H ALA A 36 -14.114 -9.994 -3.396 1.00 0.00 H new ATOM 0 HA ALA A 36 -15.799 -10.229 -1.068 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -14.933 -12.528 -1.090 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -15.539 -12.037 -2.689 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -13.787 -12.081 -2.376 1.00 0.00 H new ATOM 489 N ILE A 37 -12.741 -9.421 -0.689 1.00 0.00 N ATOM 490 CA ILE A 37 -11.797 -8.970 0.329 1.00 0.00 C ATOM 491 C ILE A 37 -12.519 -8.043 1.309 1.00 0.00 C ATOM 492 O ILE A 37 -12.287 -8.095 2.518 1.00 0.00 O ATOM 493 CB ILE A 37 -10.571 -8.217 -0.264 1.00 0.00 C ATOM 494 CG1 ILE A 37 -9.846 -9.032 -1.354 1.00 0.00 C ATOM 495 CG2 ILE A 37 -9.590 -7.845 0.839 1.00 0.00 C ATOM 496 CD1 ILE A 37 -9.698 -10.503 -1.054 1.00 0.00 C ATOM 0 H ILE A 37 -12.516 -9.125 -1.639 1.00 0.00 H new ATOM 0 HA ILE A 37 -11.419 -9.862 0.829 1.00 0.00 H new ATOM 0 HB ILE A 37 -10.956 -7.312 -0.734 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -10.389 -8.920 -2.292 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -8.855 -8.606 -1.507 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -8.739 -7.319 0.407 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.085 -7.199 1.564 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -9.242 -8.750 1.337 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.177 -10.992 -1.877 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -9.126 -10.631 -0.135 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -10.684 -10.951 -0.933 1.00 0.00 H new ATOM 508 N ILE A 38 -13.402 -7.200 0.769 1.00 0.00 N ATOM 509 CA ILE A 38 -14.209 -6.286 1.581 1.00 0.00 C ATOM 510 C ILE A 38 -15.126 -7.051 2.551 1.00 0.00 C ATOM 511 O ILE A 38 -15.138 -6.774 3.755 1.00 0.00 O ATOM 512 CB ILE A 38 -15.037 -5.340 0.681 1.00 0.00 C ATOM 513 CG1 ILE A 38 -14.094 -4.402 -0.081 1.00 0.00 C ATOM 514 CG2 ILE A 38 -16.048 -4.548 1.498 1.00 0.00 C ATOM 515 CD1 ILE A 38 -14.804 -3.355 -0.911 1.00 0.00 C ATOM 0 H ILE A 38 -13.577 -7.131 -0.234 1.00 0.00 H new ATOM 0 HA ILE A 38 -13.524 -5.685 2.178 1.00 0.00 H new ATOM 0 HB ILE A 38 -15.598 -5.940 -0.036 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -13.440 -3.902 0.634 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -13.456 -4.997 -0.734 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -16.615 -3.892 0.838 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -16.729 -5.236 1.999 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -15.524 -3.949 2.243 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -14.067 -2.732 -1.418 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -15.437 -3.845 -1.651 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -15.420 -2.733 -0.262 1.00 0.00 H new ATOM 527 N GLY A 39 -15.902 -7.995 2.033 1.00 0.00 N ATOM 528 CA GLY A 39 -16.641 -8.897 2.904 1.00 0.00 C ATOM 529 C GLY A 39 -18.089 -8.497 3.160 1.00 0.00 C ATOM 530 O GLY A 39 -18.364 -7.500 3.841 1.00 0.00 O ATOM 0 H GLY A 39 -16.034 -8.154 1.034 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -16.627 -9.895 2.466 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -16.122 -8.961 3.861 1.00 0.00 H new ATOM 534 N LYS A 40 -19.002 -9.310 2.623 1.00 0.00 N ATOM 535 CA LYS A 40 -20.448 -9.199 2.856 1.00 0.00 C ATOM 536 C LYS A 40 -21.032 -7.857 2.432 1.00 0.00 C ATOM 537 O LYS A 40 -21.480 -7.703 1.297 1.00 0.00 O ATOM 538 CB LYS A 40 -20.797 -9.493 4.317 1.00 0.00 C ATOM 539 CG LYS A 40 -20.764 -10.975 4.657 1.00 0.00 C ATOM 540 CD LYS A 40 -21.688 -11.772 3.744 1.00 0.00 C ATOM 541 CE LYS A 40 -23.140 -11.335 3.885 1.00 0.00 C ATOM 542 NZ LYS A 40 -24.016 -11.995 2.883 1.00 0.00 N1+ ATOM 0 H LYS A 40 -18.754 -10.080 2.001 1.00 0.00 H new ATOM 0 HA LYS A 40 -20.908 -9.954 2.218 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -20.098 -8.963 4.964 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -21.791 -9.100 4.532 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -19.745 -11.349 4.563 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -21.062 -11.119 5.695 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -21.370 -11.648 2.709 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -21.604 -12.833 3.979 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -23.494 -11.571 4.888 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -23.207 -10.253 3.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -24.996 -11.671 3.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -23.694 -11.750 1.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -23.973 -13.026 3.010 1.00 0.00 H new ATOM 556 N LYS A 41 -21.043 -6.895 3.344 1.00 0.00 N ATOM 557 CA LYS A 41 -21.627 -5.592 3.062 1.00 0.00 C ATOM 558 C LYS A 41 -20.662 -4.467 3.421 1.00 0.00 C ATOM 559 O LYS A 41 -21.068 -3.333 3.659 1.00 0.00 O ATOM 560 CB LYS A 41 -22.976 -5.428 3.788 1.00 0.00 C ATOM 561 CG LYS A 41 -22.968 -5.798 5.272 1.00 0.00 C ATOM 562 CD LYS A 41 -22.276 -4.745 6.133 1.00 0.00 C ATOM 563 CE LYS A 41 -22.934 -3.377 6.011 1.00 0.00 C ATOM 564 NZ LYS A 41 -24.317 -3.368 6.556 1.00 0.00 N1+ ATOM 0 H LYS A 41 -20.655 -6.992 4.283 1.00 0.00 H new ATOM 0 HA LYS A 41 -21.816 -5.531 1.990 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -23.299 -4.391 3.690 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -23.720 -6.043 3.281 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -23.994 -5.927 5.616 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -22.465 -6.756 5.402 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -22.293 -5.063 7.176 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -21.229 -4.670 5.840 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -22.332 -2.638 6.540 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -22.956 -3.079 4.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -24.707 -2.405 6.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -24.913 -4.016 6.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -24.301 -3.676 7.549 1.00 0.00 H new ATOM 578 N GLY A 42 -19.378 -4.787 3.436 1.00 0.00 N ATOM 579 CA GLY A 42 -18.385 -3.818 3.852 1.00 0.00 C ATOM 580 C GLY A 42 -18.274 -3.769 5.360 1.00 0.00 C ATOM 581 O GLY A 42 -17.931 -2.742 5.941 1.00 0.00 O ATOM 0 H GLY A 42 -19.005 -5.698 3.168 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -17.418 -4.075 3.421 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -18.652 -2.832 3.471 1.00 0.00 H new ATOM 585 N GLN A 43 -18.567 -4.898 5.990 1.00 0.00 N ATOM 586 CA GLN A 43 -18.528 -5.007 7.440 1.00 0.00 C ATOM 587 C GLN A 43 -17.147 -5.464 7.887 1.00 0.00 C ATOM 588 O GLN A 43 -16.540 -4.870 8.775 1.00 0.00 O ATOM 589 CB GLN A 43 -19.616 -5.987 7.914 1.00 0.00 C ATOM 590 CG GLN A 43 -19.823 -6.037 9.423 1.00 0.00 C ATOM 591 CD GLN A 43 -18.808 -6.905 10.143 1.00 0.00 C ATOM 592 OE1 GLN A 43 -18.291 -7.872 9.585 1.00 0.00 O ATOM 593 NE2 GLN A 43 -18.525 -6.569 11.390 1.00 0.00 N ATOM 0 H GLN A 43 -18.837 -5.759 5.513 1.00 0.00 H new ATOM 0 HA GLN A 43 -18.724 -4.032 7.887 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -20.560 -5.715 7.442 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -19.361 -6.987 7.564 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -19.772 -5.024 9.823 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -20.825 -6.413 9.632 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -18.977 -5.759 11.815 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -17.855 -7.120 11.927 1.00 0.00 H new ATOM 602 N HIS A 44 -16.642 -6.502 7.232 1.00 0.00 N ATOM 603 CA HIS A 44 -15.387 -7.128 7.635 1.00 0.00 C ATOM 604 C HIS A 44 -14.196 -6.227 7.344 1.00 0.00 C ATOM 605 O HIS A 44 -13.215 -6.237 8.082 1.00 0.00 O ATOM 606 CB HIS A 44 -15.213 -8.485 6.951 1.00 0.00 C ATOM 607 CG HIS A 44 -16.180 -9.516 7.442 1.00 0.00 C ATOM 608 ND1 HIS A 44 -15.945 -10.297 8.553 1.00 0.00 N ATOM 609 CD2 HIS A 44 -17.404 -9.875 6.984 1.00 0.00 C ATOM 610 CE1 HIS A 44 -16.983 -11.092 8.754 1.00 0.00 C ATOM 611 NE2 HIS A 44 -17.879 -10.852 7.818 1.00 0.00 N ATOM 0 H HIS A 44 -17.083 -6.930 6.418 1.00 0.00 H new ATOM 0 HA HIS A 44 -15.430 -7.286 8.713 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -15.337 -8.362 5.875 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -14.196 -8.841 7.116 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -17.910 -9.467 6.122 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -17.080 -11.815 9.550 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -18.781 -11.319 7.729 1.00 0.00 H new ATOM 620 N ILE A 45 -14.293 -5.447 6.275 1.00 0.00 N ATOM 621 CA ILE A 45 -13.243 -4.502 5.911 1.00 0.00 C ATOM 622 C ILE A 45 -13.028 -3.463 7.015 1.00 0.00 C ATOM 623 O ILE A 45 -11.897 -3.158 7.391 1.00 0.00 O ATOM 624 CB ILE A 45 -13.574 -3.782 4.581 1.00 0.00 C ATOM 625 CG1 ILE A 45 -12.518 -2.719 4.268 1.00 0.00 C ATOM 626 CG2 ILE A 45 -14.965 -3.160 4.631 1.00 0.00 C ATOM 627 CD1 ILE A 45 -12.794 -1.939 3.002 1.00 0.00 C ATOM 0 H ILE A 45 -15.092 -5.450 5.641 1.00 0.00 H new ATOM 0 HA ILE A 45 -12.325 -5.076 5.782 1.00 0.00 H new ATOM 0 HB ILE A 45 -13.564 -4.523 3.782 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.456 -2.024 5.106 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -11.545 -3.202 4.181 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -15.174 -2.660 3.685 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -15.707 -3.941 4.801 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -15.010 -2.434 5.443 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -12.003 -1.205 2.847 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -12.826 -2.622 2.153 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -13.752 -1.427 3.092 1.00 0.00 H new ATOM 639 N LYS A 46 -14.119 -2.936 7.544 1.00 0.00 N ATOM 640 CA LYS A 46 -14.042 -1.902 8.559 1.00 0.00 C ATOM 641 C LYS A 46 -13.791 -2.518 9.926 1.00 0.00 C ATOM 642 O LYS A 46 -13.143 -1.913 10.783 1.00 0.00 O ATOM 643 CB LYS A 46 -15.330 -1.075 8.557 1.00 0.00 C ATOM 644 CG LYS A 46 -15.605 -0.399 7.219 1.00 0.00 C ATOM 645 CD LYS A 46 -17.015 0.163 7.149 1.00 0.00 C ATOM 646 CE LYS A 46 -17.236 1.275 8.158 1.00 0.00 C ATOM 647 NZ LYS A 46 -18.645 1.745 8.155 1.00 0.00 N1+ ATOM 0 H LYS A 46 -15.068 -3.208 7.287 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.206 -1.240 8.332 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -16.170 -1.722 8.810 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -15.268 -0.315 9.335 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -14.885 0.405 7.063 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -15.460 -1.117 6.412 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -17.204 0.542 6.145 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -17.733 -0.637 7.328 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -16.972 0.920 9.154 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -16.573 2.110 7.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -18.874 2.162 9.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -18.771 2.461 7.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -19.279 0.941 7.972 1.00 0.00 H new ATOM 661 N GLN A 47 -14.295 -3.730 10.117 1.00 0.00 N ATOM 662 CA GLN A 47 -13.998 -4.498 11.314 1.00 0.00 C ATOM 663 C GLN A 47 -12.503 -4.791 11.360 1.00 0.00 C ATOM 664 O GLN A 47 -11.895 -4.829 12.429 1.00 0.00 O ATOM 665 CB GLN A 47 -14.811 -5.795 11.327 1.00 0.00 C ATOM 666 CG GLN A 47 -14.545 -6.678 12.531 1.00 0.00 C ATOM 667 CD GLN A 47 -15.520 -7.830 12.628 1.00 0.00 C ATOM 668 OE1 GLN A 47 -16.576 -7.710 13.248 1.00 0.00 O ATOM 669 NE2 GLN A 47 -15.186 -8.949 12.005 1.00 0.00 N ATOM 0 H GLN A 47 -14.912 -4.201 9.456 1.00 0.00 H new ATOM 0 HA GLN A 47 -14.274 -3.923 12.198 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -15.872 -5.547 11.299 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -14.591 -6.359 10.420 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -13.529 -7.069 12.474 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -14.605 -6.078 13.439 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -14.301 -9.008 11.502 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -15.814 -9.753 12.028 1.00 0.00 H new ATOM 678 N LEU A 48 -11.919 -4.969 10.179 1.00 0.00 N ATOM 679 CA LEU A 48 -10.483 -5.137 10.049 1.00 0.00 C ATOM 680 C LEU A 48 -9.780 -3.874 10.528 1.00 0.00 C ATOM 681 O LEU A 48 -8.866 -3.931 11.345 1.00 0.00 O ATOM 682 CB LEU A 48 -10.115 -5.447 8.590 1.00 0.00 C ATOM 683 CG LEU A 48 -8.705 -6.016 8.357 1.00 0.00 C ATOM 684 CD1 LEU A 48 -8.595 -6.608 6.965 1.00 0.00 C ATOM 685 CD2 LEU A 48 -7.636 -4.950 8.541 1.00 0.00 C ATOM 0 H LEU A 48 -12.426 -5.000 9.295 1.00 0.00 H new ATOM 0 HA LEU A 48 -10.158 -5.976 10.665 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -10.842 -6.157 8.196 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -10.216 -4.531 8.008 1.00 0.00 H new ATOM 0 HG LEU A 48 -8.543 -6.798 9.099 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -7.591 -7.006 6.817 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -9.324 -7.411 6.852 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -8.791 -5.833 6.224 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -6.653 -5.387 8.369 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -7.803 -4.141 7.830 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -7.685 -4.557 9.556 1.00 0.00 H new ATOM 697 N SER A 49 -10.239 -2.735 10.033 1.00 0.00 N ATOM 698 CA SER A 49 -9.663 -1.448 10.393 1.00 0.00 C ATOM 699 C SER A 49 -9.673 -1.256 11.915 1.00 0.00 C ATOM 700 O SER A 49 -8.700 -0.773 12.495 1.00 0.00 O ATOM 701 CB SER A 49 -10.442 -0.324 9.695 1.00 0.00 C ATOM 702 OG SER A 49 -9.786 0.925 9.823 1.00 0.00 O ATOM 0 H SER A 49 -11.016 -2.676 9.375 1.00 0.00 H new ATOM 0 HA SER A 49 -8.625 -1.417 10.062 1.00 0.00 H new ATOM 0 HB2 SER A 49 -10.562 -0.566 8.639 1.00 0.00 H new ATOM 0 HB3 SER A 49 -11.443 -0.255 10.122 1.00 0.00 H new ATOM 0 HG SER A 49 -8.874 0.783 10.151 1.00 0.00 H new ATOM 708 N ARG A 50 -10.762 -1.661 12.559 1.00 0.00 N ATOM 709 CA ARG A 50 -10.905 -1.484 13.997 1.00 0.00 C ATOM 710 C ARG A 50 -10.128 -2.537 14.793 1.00 0.00 C ATOM 711 O ARG A 50 -9.510 -2.216 15.806 1.00 0.00 O ATOM 712 CB ARG A 50 -12.383 -1.494 14.387 1.00 0.00 C ATOM 713 CG ARG A 50 -13.194 -0.368 13.753 1.00 0.00 C ATOM 714 CD ARG A 50 -12.858 1.000 14.345 1.00 0.00 C ATOM 715 NE ARG A 50 -11.492 1.430 14.047 1.00 0.00 N ATOM 716 CZ ARG A 50 -11.176 2.623 13.541 1.00 0.00 C ATOM 717 NH1 ARG A 50 -12.115 3.533 13.325 1.00 0.00 N1+ ATOM 718 NH2 ARG A 50 -9.913 2.915 13.275 1.00 0.00 N ATOM 0 H ARG A 50 -11.557 -2.113 12.108 1.00 0.00 H new ATOM 0 HA ARG A 50 -10.475 -0.515 14.250 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -12.819 -2.450 14.098 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -12.464 -1.421 15.472 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -13.008 -0.351 12.679 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -14.257 -0.568 13.890 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -13.559 1.740 13.958 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -12.995 0.966 15.426 1.00 0.00 H new ATOM 0 HE ARG A 50 -10.733 0.776 14.238 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -13.089 3.324 13.546 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -11.864 4.443 12.938 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -9.181 2.228 13.457 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -9.671 3.827 12.888 1.00 0.00 H new ATOM 732 N PHE A 51 -10.144 -3.790 14.349 1.00 0.00 N ATOM 733 CA PHE A 51 -9.458 -4.846 15.088 1.00 0.00 C ATOM 734 C PHE A 51 -7.946 -4.736 14.898 1.00 0.00 C ATOM 735 O PHE A 51 -7.176 -5.076 15.793 1.00 0.00 O ATOM 736 CB PHE A 51 -9.964 -6.247 14.678 1.00 0.00 C ATOM 737 CG PHE A 51 -9.063 -6.999 13.728 1.00 0.00 C ATOM 738 CD1 PHE A 51 -9.156 -6.806 12.362 1.00 0.00 C ATOM 739 CD2 PHE A 51 -8.121 -7.898 14.206 1.00 0.00 C ATOM 740 CE1 PHE A 51 -8.331 -7.488 11.487 1.00 0.00 C ATOM 741 CE2 PHE A 51 -7.292 -8.585 13.337 1.00 0.00 C ATOM 742 CZ PHE A 51 -7.397 -8.379 11.976 1.00 0.00 C ATOM 0 H PHE A 51 -10.615 -4.096 13.498 1.00 0.00 H new ATOM 0 HA PHE A 51 -9.685 -4.714 16.146 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -10.098 -6.846 15.579 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.946 -6.141 14.217 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -9.885 -6.111 11.972 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -8.034 -8.064 15.270 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -8.417 -7.324 10.423 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -6.563 -9.282 13.723 1.00 0.00 H new ATOM 0 HZ PHE A 51 -6.750 -8.913 11.296 1.00 0.00 H new ATOM 752 N ALA A 52 -7.525 -4.243 13.741 1.00 0.00 N ATOM 753 CA ALA A 52 -6.109 -4.141 13.439 1.00 0.00 C ATOM 754 C ALA A 52 -5.508 -2.860 14.003 1.00 0.00 C ATOM 755 O ALA A 52 -4.290 -2.725 14.061 1.00 0.00 O ATOM 756 CB ALA A 52 -5.870 -4.217 11.940 1.00 0.00 C ATOM 0 H ALA A 52 -8.143 -3.910 13.001 1.00 0.00 H new ATOM 0 HA ALA A 52 -5.612 -4.985 13.917 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -4.802 -4.138 11.737 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -6.242 -5.168 11.560 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -6.394 -3.399 11.446 1.00 0.00 H new ATOM 762 N SER A 53 -6.377 -1.935 14.425 1.00 0.00 N ATOM 763 CA SER A 53 -5.955 -0.647 14.977 1.00 0.00 C ATOM 764 C SER A 53 -5.287 0.214 13.902 1.00 0.00 C ATOM 765 O SER A 53 -4.420 1.038 14.197 1.00 0.00 O ATOM 766 CB SER A 53 -4.992 -0.847 16.158 1.00 0.00 C ATOM 767 OG SER A 53 -5.523 -1.755 17.116 1.00 0.00 O ATOM 0 H SER A 53 -7.389 -2.059 14.393 1.00 0.00 H new ATOM 0 HA SER A 53 -6.846 -0.132 15.335 1.00 0.00 H new ATOM 0 HB2 SER A 53 -4.037 -1.222 15.790 1.00 0.00 H new ATOM 0 HB3 SER A 53 -4.795 0.113 16.635 1.00 0.00 H new ATOM 0 HG SER A 53 -4.886 -1.862 17.853 1.00 0.00 H new ATOM 773 N ALA A 54 -5.705 0.033 12.658 1.00 0.00 N ATOM 774 CA ALA A 54 -5.090 0.734 11.539 1.00 0.00 C ATOM 775 C ALA A 54 -6.156 1.297 10.611 1.00 0.00 C ATOM 776 O ALA A 54 -7.325 0.942 10.716 1.00 0.00 O ATOM 777 CB ALA A 54 -4.165 -0.204 10.778 1.00 0.00 C ATOM 0 H ALA A 54 -6.467 -0.593 12.397 1.00 0.00 H new ATOM 0 HA ALA A 54 -4.502 1.565 11.929 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -3.711 0.331 9.944 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -3.383 -0.565 11.446 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -4.737 -1.050 10.398 1.00 0.00 H new ATOM 783 N SER A 55 -5.749 2.174 9.711 1.00 0.00 N ATOM 784 CA SER A 55 -6.672 2.773 8.764 1.00 0.00 C ATOM 785 C SER A 55 -6.711 1.966 7.470 1.00 0.00 C ATOM 786 O SER A 55 -5.750 1.971 6.697 1.00 0.00 O ATOM 787 CB SER A 55 -6.252 4.212 8.476 1.00 0.00 C ATOM 788 OG SER A 55 -6.104 4.946 9.680 1.00 0.00 O ATOM 0 H SER A 55 -4.783 2.488 9.616 1.00 0.00 H new ATOM 0 HA SER A 55 -7.672 2.772 9.198 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.312 4.217 7.924 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.997 4.693 7.842 1.00 0.00 H new ATOM 0 HG SER A 55 -5.833 5.864 9.472 1.00 0.00 H new ATOM 794 N ILE A 56 -7.815 1.263 7.257 1.00 0.00 N ATOM 795 CA ILE A 56 -7.989 0.441 6.069 1.00 0.00 C ATOM 796 C ILE A 56 -9.048 1.052 5.155 1.00 0.00 C ATOM 797 O ILE A 56 -10.217 1.163 5.531 1.00 0.00 O ATOM 798 CB ILE A 56 -8.376 -1.019 6.438 1.00 0.00 C ATOM 799 CG1 ILE A 56 -7.143 -1.823 6.875 1.00 0.00 C ATOM 800 CG2 ILE A 56 -9.074 -1.722 5.280 1.00 0.00 C ATOM 801 CD1 ILE A 56 -6.578 -1.421 8.220 1.00 0.00 C ATOM 0 H ILE A 56 -8.609 1.246 7.897 1.00 0.00 H new ATOM 0 HA ILE A 56 -7.035 0.411 5.542 1.00 0.00 H new ATOM 0 HB ILE A 56 -9.073 -0.965 7.274 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -7.406 -2.880 6.907 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.365 -1.711 6.120 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -9.330 -2.740 5.574 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -9.983 -1.180 5.020 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -8.409 -1.750 4.417 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -5.710 -2.039 8.450 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -6.279 -0.373 8.191 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -7.337 -1.561 8.990 1.00 0.00 H new ATOM 813 N LYS A 57 -8.628 1.479 3.970 1.00 0.00 N ATOM 814 CA LYS A 57 -9.544 2.053 2.990 1.00 0.00 C ATOM 815 C LYS A 57 -9.223 1.527 1.598 1.00 0.00 C ATOM 816 O LYS A 57 -8.059 1.464 1.211 1.00 0.00 O ATOM 817 CB LYS A 57 -9.447 3.584 2.985 1.00 0.00 C ATOM 818 CG LYS A 57 -9.795 4.235 4.317 1.00 0.00 C ATOM 819 CD LYS A 57 -9.724 5.753 4.241 1.00 0.00 C ATOM 820 CE LYS A 57 -8.331 6.235 3.861 1.00 0.00 C ATOM 821 NZ LYS A 57 -8.252 7.719 3.796 1.00 0.00 N1+ ATOM 0 H LYS A 57 -7.656 1.439 3.663 1.00 0.00 H new ATOM 0 HA LYS A 57 -10.557 1.762 3.266 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -8.433 3.872 2.706 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -10.113 3.977 2.216 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -10.798 3.933 4.618 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -9.110 3.877 5.086 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -10.446 6.115 3.509 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -10.006 6.179 5.204 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -7.609 5.865 4.589 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -8.053 5.815 2.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -7.287 8.004 3.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.922 8.071 3.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -8.491 8.120 4.725 1.00 0.00 H new ATOM 835 N ILE A 58 -10.248 1.154 0.848 1.00 0.00 N ATOM 836 CA ILE A 58 -10.051 0.679 -0.515 1.00 0.00 C ATOM 837 C ILE A 58 -9.875 1.867 -1.456 1.00 0.00 C ATOM 838 O ILE A 58 -10.724 2.756 -1.511 1.00 0.00 O ATOM 839 CB ILE A 58 -11.233 -0.189 -1.006 1.00 0.00 C ATOM 840 CG1 ILE A 58 -11.440 -1.406 -0.099 1.00 0.00 C ATOM 841 CG2 ILE A 58 -11.006 -0.633 -2.442 1.00 0.00 C ATOM 842 CD1 ILE A 58 -10.304 -2.409 -0.127 1.00 0.00 C ATOM 0 H ILE A 58 -11.220 1.170 1.156 1.00 0.00 H new ATOM 0 HA ILE A 58 -9.155 0.058 -0.517 1.00 0.00 H new ATOM 0 HB ILE A 58 -12.136 0.420 -0.965 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -11.578 -1.061 0.926 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -12.361 -1.910 -0.393 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -11.847 -1.243 -2.772 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -10.919 0.243 -3.084 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -10.088 -1.218 -2.501 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -10.534 -3.237 0.543 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -10.177 -2.787 -1.141 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -9.383 -1.925 0.197 1.00 0.00 H new ATOM 854 N ALA A 59 -8.772 1.875 -2.185 1.00 0.00 N ATOM 855 CA ALA A 59 -8.454 2.971 -3.085 1.00 0.00 C ATOM 856 C ALA A 59 -9.029 2.709 -4.475 1.00 0.00 C ATOM 857 O ALA A 59 -8.853 1.624 -5.036 1.00 0.00 O ATOM 858 CB ALA A 59 -6.944 3.162 -3.156 1.00 0.00 C ATOM 0 H ALA A 59 -8.077 1.129 -2.171 1.00 0.00 H new ATOM 0 HA ALA A 59 -8.906 3.885 -2.699 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -6.713 3.985 -3.832 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -6.559 3.390 -2.162 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -6.479 2.248 -3.525 1.00 0.00 H new ATOM 864 N PRO A 60 -9.750 3.694 -5.032 1.00 0.00 N ATOM 865 CA PRO A 60 -10.301 3.610 -6.389 1.00 0.00 C ATOM 866 C PRO A 60 -9.208 3.414 -7.436 1.00 0.00 C ATOM 867 O PRO A 60 -8.129 4.002 -7.337 1.00 0.00 O ATOM 868 CB PRO A 60 -10.989 4.966 -6.586 1.00 0.00 C ATOM 869 CG PRO A 60 -11.226 5.485 -5.210 1.00 0.00 C ATOM 870 CD PRO A 60 -10.093 4.967 -4.376 1.00 0.00 C ATOM 0 HA PRO A 60 -10.973 2.760 -6.505 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -10.361 5.647 -7.161 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -11.926 4.857 -7.133 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -11.251 6.575 -5.202 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -12.185 5.142 -4.823 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -9.249 5.657 -4.369 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -10.392 4.818 -3.338 1.00 0.00 H new ATOM 878 N PRO A 61 -9.474 2.575 -8.448 1.00 0.00 N ATOM 879 CA PRO A 61 -8.512 2.290 -9.517 1.00 0.00 C ATOM 880 C PRO A 61 -8.262 3.507 -10.402 1.00 0.00 C ATOM 881 O PRO A 61 -9.063 4.444 -10.437 1.00 0.00 O ATOM 882 CB PRO A 61 -9.189 1.174 -10.319 1.00 0.00 C ATOM 883 CG PRO A 61 -10.643 1.322 -10.037 1.00 0.00 C ATOM 884 CD PRO A 61 -10.742 1.848 -8.635 1.00 0.00 C ATOM 0 HA PRO A 61 -7.533 2.014 -9.125 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -8.982 1.273 -11.385 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -8.826 0.193 -10.013 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.110 2.007 -10.745 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -11.158 0.366 -10.132 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -11.603 2.505 -8.513 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -10.852 1.041 -7.911 1.00 0.00 H new ATOM 892 N GLU A 62 -7.138 3.489 -11.108 1.00 0.00 N ATOM 893 CA GLU A 62 -6.768 4.588 -11.989 1.00 0.00 C ATOM 894 C GLU A 62 -7.432 4.411 -13.346 1.00 0.00 C ATOM 895 O GLU A 62 -8.013 5.342 -13.901 1.00 0.00 O ATOM 896 CB GLU A 62 -5.253 4.633 -12.182 1.00 0.00 C ATOM 897 CG GLU A 62 -4.455 4.498 -10.900 1.00 0.00 C ATOM 898 CD GLU A 62 -2.975 4.345 -11.172 1.00 0.00 C ATOM 899 OE1 GLU A 62 -2.588 3.348 -11.824 1.00 0.00 O1- ATOM 900 OE2 GLU A 62 -2.196 5.227 -10.762 1.00 0.00 O ATOM 0 H GLU A 62 -6.465 2.722 -11.087 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.101 5.519 -11.531 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.962 3.833 -12.863 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.988 5.574 -12.663 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.621 5.375 -10.275 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.812 3.635 -10.339 1.00 0.00 H new ATOM 907 N THR A 63 -7.336 3.201 -13.874 1.00 0.00 N ATOM 908 CA THR A 63 -7.894 2.882 -15.173 1.00 0.00 C ATOM 909 C THR A 63 -8.757 1.624 -15.098 1.00 0.00 C ATOM 910 O THR A 63 -8.399 0.656 -14.425 1.00 0.00 O ATOM 911 CB THR A 63 -6.774 2.682 -16.217 1.00 0.00 C ATOM 912 OG1 THR A 63 -5.721 1.880 -15.658 1.00 0.00 O ATOM 913 CG2 THR A 63 -6.210 4.017 -16.685 1.00 0.00 C ATOM 0 H THR A 63 -6.871 2.418 -13.415 1.00 0.00 H new ATOM 0 HA THR A 63 -8.518 3.721 -15.481 1.00 0.00 H new ATOM 0 HB THR A 63 -7.204 2.172 -17.079 1.00 0.00 H new ATOM 0 HG1 THR A 63 -5.015 1.756 -16.326 1.00 0.00 H new ATOM 0 HG21 THR A 63 -5.424 3.842 -17.419 1.00 0.00 H new ATOM 0 HG22 THR A 63 -7.005 4.609 -17.138 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.797 4.556 -15.833 1.00 0.00 H new ATOM 921 N PRO A 64 -9.910 1.628 -15.789 1.00 0.00 N ATOM 922 CA PRO A 64 -10.859 0.503 -15.794 1.00 0.00 C ATOM 923 C PRO A 64 -10.307 -0.737 -16.494 1.00 0.00 C ATOM 924 O PRO A 64 -10.917 -1.804 -16.463 1.00 0.00 O ATOM 925 CB PRO A 64 -12.046 1.080 -16.570 1.00 0.00 C ATOM 926 CG PRO A 64 -11.426 2.067 -17.476 1.00 0.00 C ATOM 927 CD PRO A 64 -10.407 2.738 -16.624 1.00 0.00 C ATOM 0 HA PRO A 64 -11.100 0.159 -14.788 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -12.576 0.306 -17.124 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -12.771 1.548 -15.904 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -10.970 1.585 -18.341 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -12.160 2.777 -17.857 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -9.611 3.186 -17.219 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -10.842 3.536 -16.022 1.00 0.00 H new ATOM 935 N ASP A 65 -9.156 -0.579 -17.134 1.00 0.00 N ATOM 936 CA ASP A 65 -8.491 -1.687 -17.806 1.00 0.00 C ATOM 937 C ASP A 65 -7.589 -2.430 -16.836 1.00 0.00 C ATOM 938 O ASP A 65 -6.981 -3.445 -17.180 1.00 0.00 O ATOM 939 CB ASP A 65 -7.658 -1.183 -18.984 1.00 0.00 C ATOM 940 CG ASP A 65 -8.492 -0.463 -20.016 1.00 0.00 C ATOM 941 OD1 ASP A 65 -9.038 -1.130 -20.921 1.00 0.00 O ATOM 942 OD2 ASP A 65 -8.604 0.776 -19.929 1.00 0.00 O1- ATOM 0 H ASP A 65 -8.662 0.311 -17.202 1.00 0.00 H new ATOM 0 HA ASP A 65 -9.260 -2.365 -18.177 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -6.883 -0.511 -18.615 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -7.152 -2.026 -19.454 1.00 0.00 H new ATOM 947 N SER A 66 -7.488 -1.905 -15.627 1.00 0.00 N ATOM 948 CA SER A 66 -6.680 -2.522 -14.598 1.00 0.00 C ATOM 949 C SER A 66 -7.526 -3.545 -13.846 1.00 0.00 C ATOM 950 O SER A 66 -8.506 -3.194 -13.191 1.00 0.00 O ATOM 951 CB SER A 66 -6.137 -1.448 -13.648 1.00 0.00 C ATOM 952 OG SER A 66 -5.043 -1.928 -12.885 1.00 0.00 O ATOM 0 H SER A 66 -7.959 -1.048 -15.336 1.00 0.00 H new ATOM 0 HA SER A 66 -5.829 -3.034 -15.048 1.00 0.00 H new ATOM 0 HB2 SER A 66 -5.825 -0.577 -14.224 1.00 0.00 H new ATOM 0 HB3 SER A 66 -6.932 -1.119 -12.978 1.00 0.00 H new ATOM 0 HG SER A 66 -4.721 -1.217 -12.292 1.00 0.00 H new ATOM 958 N LYS A 67 -7.144 -4.810 -13.954 1.00 0.00 N ATOM 959 CA LYS A 67 -7.895 -5.915 -13.359 1.00 0.00 C ATOM 960 C LYS A 67 -7.614 -6.009 -11.852 1.00 0.00 C ATOM 961 O LYS A 67 -7.602 -7.090 -11.260 1.00 0.00 O ATOM 962 CB LYS A 67 -7.529 -7.216 -14.085 1.00 0.00 C ATOM 963 CG LYS A 67 -8.631 -8.270 -14.108 1.00 0.00 C ATOM 964 CD LYS A 67 -8.502 -9.251 -12.957 1.00 0.00 C ATOM 965 CE LYS A 67 -7.157 -9.947 -13.001 1.00 0.00 C ATOM 966 NZ LYS A 67 -7.092 -10.972 -14.076 1.00 0.00 N1+ ATOM 0 H LYS A 67 -6.306 -5.103 -14.456 1.00 0.00 H new ATOM 0 HA LYS A 67 -8.964 -5.739 -13.475 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -7.254 -6.977 -15.112 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -6.646 -7.644 -13.610 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -9.603 -7.779 -14.059 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -8.595 -8.812 -15.053 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -8.615 -8.725 -12.009 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -9.302 -9.989 -13.009 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.372 -9.208 -13.158 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.962 -10.419 -12.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -6.155 -11.423 -14.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -7.824 -11.693 -13.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.252 -10.519 -14.998 1.00 0.00 H new ATOM 980 N VAL A 68 -7.395 -4.865 -11.229 1.00 0.00 N ATOM 981 CA VAL A 68 -7.028 -4.812 -9.827 1.00 0.00 C ATOM 982 C VAL A 68 -7.606 -3.568 -9.163 1.00 0.00 C ATOM 983 O VAL A 68 -7.880 -2.566 -9.822 1.00 0.00 O ATOM 984 CB VAL A 68 -5.491 -4.805 -9.665 1.00 0.00 C ATOM 985 CG1 VAL A 68 -4.904 -3.519 -10.214 1.00 0.00 C ATOM 986 CG2 VAL A 68 -5.082 -4.993 -8.215 1.00 0.00 C ATOM 0 H VAL A 68 -7.466 -3.952 -11.678 1.00 0.00 H new ATOM 0 HA VAL A 68 -7.438 -5.699 -9.345 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.096 -5.646 -10.235 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.821 -3.532 -10.091 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.148 -3.430 -11.273 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.320 -2.669 -9.673 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.995 -4.983 -8.139 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -5.495 -4.184 -7.613 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.462 -5.947 -7.851 1.00 0.00 H new ATOM 996 N ARG A 69 -7.800 -3.647 -7.863 1.00 0.00 N ATOM 997 CA ARG A 69 -8.147 -2.492 -7.074 1.00 0.00 C ATOM 998 C ARG A 69 -7.193 -2.466 -5.893 1.00 0.00 C ATOM 999 O ARG A 69 -6.999 -3.484 -5.232 1.00 0.00 O ATOM 1000 CB ARG A 69 -9.603 -2.557 -6.606 1.00 0.00 C ATOM 1001 CG ARG A 69 -10.208 -1.190 -6.319 1.00 0.00 C ATOM 1002 CD ARG A 69 -11.585 -1.295 -5.678 1.00 0.00 C ATOM 1003 NE ARG A 69 -12.535 -2.075 -6.474 1.00 0.00 N ATOM 1004 CZ ARG A 69 -13.861 -2.026 -6.304 1.00 0.00 C ATOM 1005 NH1 ARG A 69 -14.398 -1.158 -5.453 1.00 0.00 N1+ ATOM 1006 NH2 ARG A 69 -14.658 -2.819 -7.001 1.00 0.00 N ATOM 0 H ARG A 69 -7.721 -4.512 -7.329 1.00 0.00 H new ATOM 0 HA ARG A 69 -8.056 -1.581 -7.665 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -10.200 -3.057 -7.369 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -9.660 -3.168 -5.705 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -9.544 -0.631 -5.660 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -10.284 -0.625 -7.248 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -11.486 -1.751 -4.693 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -11.985 -0.293 -5.526 1.00 0.00 H new ATOM 0 HE ARG A 69 -12.165 -2.690 -7.199 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -13.798 -0.524 -4.925 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -15.410 -1.126 -5.328 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -14.263 -3.475 -7.675 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -15.668 -2.775 -6.865 1.00 0.00 H new ATOM 1020 N MET A 70 -6.563 -1.336 -5.655 1.00 0.00 N ATOM 1021 CA MET A 70 -5.526 -1.272 -4.640 1.00 0.00 C ATOM 1022 C MET A 70 -6.101 -0.756 -3.334 1.00 0.00 C ATOM 1023 O MET A 70 -6.860 0.199 -3.325 1.00 0.00 O ATOM 1024 CB MET A 70 -4.366 -0.381 -5.103 1.00 0.00 C ATOM 1025 CG MET A 70 -3.857 -0.719 -6.494 1.00 0.00 C ATOM 1026 SD MET A 70 -2.419 0.263 -6.972 1.00 0.00 S ATOM 1027 CE MET A 70 -2.289 -0.156 -8.708 1.00 0.00 C ATOM 0 H MET A 70 -6.745 -0.458 -6.141 1.00 0.00 H new ATOM 0 HA MET A 70 -5.139 -2.278 -4.479 1.00 0.00 H new ATOM 0 HB2 MET A 70 -4.689 0.660 -5.087 1.00 0.00 H new ATOM 0 HB3 MET A 70 -3.544 -0.471 -4.393 1.00 0.00 H new ATOM 0 HG2 MET A 70 -3.598 -1.777 -6.534 1.00 0.00 H new ATOM 0 HG3 MET A 70 -4.657 -0.559 -7.217 1.00 0.00 H new ATOM 0 HE1 MET A 70 -1.288 0.084 -9.066 1.00 0.00 H new ATOM 0 HE2 MET A 70 -2.476 -1.222 -8.840 1.00 0.00 H new ATOM 0 HE3 MET A 70 -3.024 0.415 -9.276 1.00 0.00 H new ATOM 1037 N VAL A 71 -5.759 -1.405 -2.236 1.00 0.00 N ATOM 1038 CA VAL A 71 -6.205 -0.968 -0.929 1.00 0.00 C ATOM 1039 C VAL A 71 -5.095 -0.188 -0.229 1.00 0.00 C ATOM 1040 O VAL A 71 -3.918 -0.528 -0.345 1.00 0.00 O ATOM 1041 CB VAL A 71 -6.661 -2.171 -0.063 1.00 0.00 C ATOM 1042 CG1 VAL A 71 -5.591 -3.245 0.000 1.00 0.00 C ATOM 1043 CG2 VAL A 71 -7.039 -1.726 1.337 1.00 0.00 C ATOM 0 H VAL A 71 -5.172 -2.239 -2.225 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.064 -0.311 -1.062 1.00 0.00 H new ATOM 0 HB VAL A 71 -7.544 -2.596 -0.541 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -5.943 -4.074 0.615 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.377 -3.605 -1.006 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.683 -2.829 0.437 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -7.355 -2.591 1.921 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.178 -1.260 1.816 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -7.857 -1.007 1.282 1.00 0.00 H new ATOM 1053 N VAL A 72 -5.470 0.878 0.458 1.00 0.00 N ATOM 1054 CA VAL A 72 -4.515 1.696 1.183 1.00 0.00 C ATOM 1055 C VAL A 72 -4.564 1.367 2.663 1.00 0.00 C ATOM 1056 O VAL A 72 -5.615 1.486 3.301 1.00 0.00 O ATOM 1057 CB VAL A 72 -4.788 3.207 0.996 1.00 0.00 C ATOM 1058 CG1 VAL A 72 -3.774 4.041 1.769 1.00 0.00 C ATOM 1059 CG2 VAL A 72 -4.773 3.579 -0.475 1.00 0.00 C ATOM 0 H VAL A 72 -6.436 1.198 0.528 1.00 0.00 H new ATOM 0 HA VAL A 72 -3.528 1.472 0.778 1.00 0.00 H new ATOM 0 HB VAL A 72 -5.780 3.422 1.393 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -3.986 5.100 1.622 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -3.839 3.802 2.830 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -2.770 3.819 1.408 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -4.967 4.646 -0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -3.797 3.343 -0.900 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.544 3.015 -1.001 1.00 0.00 H new ATOM 1069 N ILE A 73 -3.441 0.934 3.203 1.00 0.00 N ATOM 1070 CA ILE A 73 -3.354 0.663 4.620 1.00 0.00 C ATOM 1071 C ILE A 73 -2.380 1.625 5.289 1.00 0.00 C ATOM 1072 O ILE A 73 -1.250 1.818 4.834 1.00 0.00 O ATOM 1073 CB ILE A 73 -3.000 -0.820 4.931 1.00 0.00 C ATOM 1074 CG1 ILE A 73 -1.794 -1.326 4.121 1.00 0.00 C ATOM 1075 CG2 ILE A 73 -4.207 -1.712 4.676 1.00 0.00 C ATOM 1076 CD1 ILE A 73 -0.452 -1.032 4.756 1.00 0.00 C ATOM 0 H ILE A 73 -2.581 0.764 2.682 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.346 0.828 5.040 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.722 -0.865 5.984 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -1.890 -2.403 3.983 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -1.821 -0.874 3.130 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -3.947 -2.747 4.897 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -5.032 -1.400 5.317 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -4.507 -1.628 3.631 1.00 0.00 H new ATOM 0 HD11 ILE A 73 0.344 -1.422 4.121 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.331 0.045 4.869 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.401 -1.508 5.735 1.00 0.00 H new ATOM 1088 N THR A 74 -2.855 2.272 6.332 1.00 0.00 N ATOM 1089 CA THR A 74 -2.049 3.205 7.095 1.00 0.00 C ATOM 1090 C THR A 74 -2.065 2.813 8.564 1.00 0.00 C ATOM 1091 O THR A 74 -3.111 2.864 9.212 1.00 0.00 O ATOM 1092 CB THR A 74 -2.575 4.647 6.940 1.00 0.00 C ATOM 1093 OG1 THR A 74 -2.551 5.038 5.560 1.00 0.00 O ATOM 1094 CG2 THR A 74 -1.747 5.624 7.757 1.00 0.00 C ATOM 0 H THR A 74 -3.810 2.167 6.676 1.00 0.00 H new ATOM 0 HA THR A 74 -1.029 3.167 6.713 1.00 0.00 H new ATOM 0 HB THR A 74 -3.601 4.669 7.308 1.00 0.00 H new ATOM 0 HG1 THR A 74 -1.663 5.387 5.334 1.00 0.00 H new ATOM 0 HG21 THR A 74 -2.141 6.632 7.628 1.00 0.00 H new ATOM 0 HG22 THR A 74 -1.794 5.348 8.811 1.00 0.00 H new ATOM 0 HG23 THR A 74 -0.711 5.594 7.420 1.00 0.00 H new ATOM 1102 N GLY A 75 -0.923 2.395 9.082 1.00 0.00 N ATOM 1103 CA GLY A 75 -0.871 1.981 10.461 1.00 0.00 C ATOM 1104 C GLY A 75 0.526 1.866 10.988 1.00 0.00 C ATOM 1105 O GLY A 75 1.483 1.796 10.216 1.00 0.00 O ATOM 0 H GLY A 75 -0.039 2.336 8.576 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -1.425 2.696 11.070 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.372 1.019 10.564 1.00 0.00 H new ATOM 1109 N PRO A 76 0.672 1.873 12.314 1.00 0.00 N ATOM 1110 CA PRO A 76 1.927 1.540 12.962 1.00 0.00 C ATOM 1111 C PRO A 76 2.248 0.052 12.802 1.00 0.00 C ATOM 1112 O PRO A 76 1.344 -0.767 12.625 1.00 0.00 O ATOM 1113 CB PRO A 76 1.686 1.899 14.431 1.00 0.00 C ATOM 1114 CG PRO A 76 0.210 1.848 14.605 1.00 0.00 C ATOM 1115 CD PRO A 76 -0.382 2.231 13.282 1.00 0.00 C ATOM 0 HA PRO A 76 2.777 2.072 12.535 1.00 0.00 H new ATOM 0 HB2 PRO A 76 2.186 1.195 15.096 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.076 2.890 14.664 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.113 0.850 14.901 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -0.113 2.533 15.389 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -1.308 1.690 13.085 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -0.619 3.294 13.242 1.00 0.00 H new ATOM 1123 N PRO A 77 3.541 -0.291 12.832 1.00 0.00 N ATOM 1124 CA PRO A 77 4.054 -1.653 12.614 1.00 0.00 C ATOM 1125 C PRO A 77 3.194 -2.771 13.220 1.00 0.00 C ATOM 1126 O PRO A 77 2.821 -3.709 12.512 1.00 0.00 O ATOM 1127 CB PRO A 77 5.421 -1.587 13.286 1.00 0.00 C ATOM 1128 CG PRO A 77 5.878 -0.189 13.029 1.00 0.00 C ATOM 1129 CD PRO A 77 4.636 0.669 13.035 1.00 0.00 C ATOM 0 HA PRO A 77 4.067 -1.912 11.555 1.00 0.00 H new ATOM 0 HB2 PRO A 77 5.352 -1.795 14.354 1.00 0.00 H new ATOM 0 HB3 PRO A 77 6.110 -2.317 12.863 1.00 0.00 H new ATOM 0 HG2 PRO A 77 6.580 0.138 13.796 1.00 0.00 H new ATOM 0 HG3 PRO A 77 6.395 -0.118 12.072 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.526 1.206 13.977 1.00 0.00 H new ATOM 0 HD3 PRO A 77 4.663 1.417 12.243 1.00 0.00 H new ATOM 1137 N GLU A 78 2.859 -2.664 14.504 1.00 0.00 N ATOM 1138 CA GLU A 78 2.088 -3.711 15.183 1.00 0.00 C ATOM 1139 C GLU A 78 0.672 -3.803 14.616 1.00 0.00 C ATOM 1140 O GLU A 78 0.098 -4.889 14.500 1.00 0.00 O ATOM 1141 CB GLU A 78 2.015 -3.444 16.690 1.00 0.00 C ATOM 1142 CG GLU A 78 3.365 -3.435 17.387 1.00 0.00 C ATOM 1143 CD GLU A 78 3.239 -3.146 18.867 1.00 0.00 C ATOM 1144 OE1 GLU A 78 3.062 -4.102 19.653 1.00 0.00 O1- ATOM 1145 OE2 GLU A 78 3.295 -1.959 19.252 1.00 0.00 O ATOM 0 H GLU A 78 3.106 -1.870 15.095 1.00 0.00 H new ATOM 0 HA GLU A 78 2.601 -4.657 15.012 1.00 0.00 H new ATOM 0 HB2 GLU A 78 1.528 -2.483 16.854 1.00 0.00 H new ATOM 0 HB3 GLU A 78 1.385 -4.204 17.152 1.00 0.00 H new ATOM 0 HG2 GLU A 78 3.852 -4.400 17.247 1.00 0.00 H new ATOM 0 HG3 GLU A 78 4.006 -2.685 16.925 1.00 0.00 H new ATOM 1152 N ALA A 79 0.116 -2.655 14.259 1.00 0.00 N ATOM 1153 CA ALA A 79 -1.241 -2.582 13.734 1.00 0.00 C ATOM 1154 C ALA A 79 -1.300 -3.131 12.315 1.00 0.00 C ATOM 1155 O ALA A 79 -2.127 -3.990 11.994 1.00 0.00 O ATOM 1156 CB ALA A 79 -1.738 -1.142 13.770 1.00 0.00 C ATOM 0 H ALA A 79 0.588 -1.753 14.324 1.00 0.00 H new ATOM 0 HA ALA A 79 -1.890 -3.194 14.361 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -2.753 -1.098 13.376 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.732 -0.781 14.798 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.085 -0.516 13.162 1.00 0.00 H new ATOM 1162 N GLN A 80 -0.392 -2.647 11.483 1.00 0.00 N ATOM 1163 CA GLN A 80 -0.330 -3.038 10.083 1.00 0.00 C ATOM 1164 C GLN A 80 -0.020 -4.527 9.945 1.00 0.00 C ATOM 1165 O GLN A 80 -0.478 -5.181 9.007 1.00 0.00 O ATOM 1166 CB GLN A 80 0.746 -2.217 9.376 1.00 0.00 C ATOM 1167 CG GLN A 80 0.773 -2.392 7.872 1.00 0.00 C ATOM 1168 CD GLN A 80 2.109 -1.994 7.288 1.00 0.00 C ATOM 1169 OE1 GLN A 80 2.996 -2.829 7.146 1.00 0.00 O ATOM 1170 NE2 GLN A 80 2.269 -0.722 6.967 1.00 0.00 N ATOM 0 H GLN A 80 0.322 -1.973 11.758 1.00 0.00 H new ATOM 0 HA GLN A 80 -1.300 -2.849 9.624 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.592 -1.163 9.605 1.00 0.00 H new ATOM 0 HB3 GLN A 80 1.720 -2.491 9.780 1.00 0.00 H new ATOM 0 HG2 GLN A 80 0.562 -3.432 7.623 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -0.016 -1.790 7.421 1.00 0.00 H new ATOM 0 HE21 GLN A 80 1.503 -0.062 7.102 1.00 0.00 H new ATOM 0 HE22 GLN A 80 3.158 -0.401 6.584 1.00 0.00 H new ATOM 1179 N PHE A 81 0.750 -5.049 10.897 1.00 0.00 N ATOM 1180 CA PHE A 81 1.182 -6.445 10.885 1.00 0.00 C ATOM 1181 C PHE A 81 -0.006 -7.398 10.768 1.00 0.00 C ATOM 1182 O PHE A 81 -0.058 -8.228 9.860 1.00 0.00 O ATOM 1183 CB PHE A 81 1.973 -6.741 12.162 1.00 0.00 C ATOM 1184 CG PHE A 81 2.591 -8.107 12.205 1.00 0.00 C ATOM 1185 CD1 PHE A 81 3.804 -8.349 11.584 1.00 0.00 C ATOM 1186 CD2 PHE A 81 1.966 -9.143 12.881 1.00 0.00 C ATOM 1187 CE1 PHE A 81 4.384 -9.600 11.635 1.00 0.00 C ATOM 1188 CE2 PHE A 81 2.540 -10.397 12.932 1.00 0.00 C ATOM 1189 CZ PHE A 81 3.751 -10.626 12.309 1.00 0.00 C ATOM 0 H PHE A 81 1.092 -4.517 11.698 1.00 0.00 H new ATOM 0 HA PHE A 81 1.816 -6.602 10.013 1.00 0.00 H new ATOM 0 HB2 PHE A 81 2.761 -5.995 12.268 1.00 0.00 H new ATOM 0 HB3 PHE A 81 1.310 -6.628 13.020 1.00 0.00 H new ATOM 0 HD1 PHE A 81 4.302 -7.550 11.054 1.00 0.00 H new ATOM 0 HD2 PHE A 81 1.021 -8.967 13.373 1.00 0.00 H new ATOM 0 HE1 PHE A 81 5.332 -9.777 11.148 1.00 0.00 H new ATOM 0 HE2 PHE A 81 2.043 -11.198 13.458 1.00 0.00 H new ATOM 0 HZ PHE A 81 4.203 -11.606 12.349 1.00 0.00 H new ATOM 1199 N LYS A 82 -0.967 -7.261 11.673 1.00 0.00 N ATOM 1200 CA LYS A 82 -2.133 -8.133 11.675 1.00 0.00 C ATOM 1201 C LYS A 82 -3.077 -7.802 10.523 1.00 0.00 C ATOM 1202 O LYS A 82 -3.731 -8.691 9.971 1.00 0.00 O ATOM 1203 CB LYS A 82 -2.859 -8.081 13.016 1.00 0.00 C ATOM 1204 CG LYS A 82 -3.014 -6.695 13.609 1.00 0.00 C ATOM 1205 CD LYS A 82 -3.578 -6.799 15.009 1.00 0.00 C ATOM 1206 CE LYS A 82 -3.579 -5.463 15.737 1.00 0.00 C ATOM 1207 NZ LYS A 82 -2.207 -4.981 16.046 1.00 0.00 N1+ ATOM 0 H LYS A 82 -0.962 -6.558 12.412 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.780 -9.154 11.528 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.849 -8.520 12.893 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -2.320 -8.706 13.728 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.049 -6.189 13.632 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.674 -6.094 12.984 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.597 -7.183 14.959 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.993 -7.520 15.580 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.092 -4.721 15.126 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.144 -5.559 16.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -2.243 -3.974 16.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -1.817 -5.528 16.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -1.600 -5.103 15.210 1.00 0.00 H new ATOM 1221 N ALA A 83 -3.142 -6.524 10.160 1.00 0.00 N ATOM 1222 CA ALA A 83 -3.966 -6.082 9.039 1.00 0.00 C ATOM 1223 C ALA A 83 -3.567 -6.791 7.746 1.00 0.00 C ATOM 1224 O ALA A 83 -4.408 -7.387 7.070 1.00 0.00 O ATOM 1225 CB ALA A 83 -3.857 -4.575 8.865 1.00 0.00 C ATOM 0 H ALA A 83 -2.632 -5.774 10.627 1.00 0.00 H new ATOM 0 HA ALA A 83 -5.001 -6.340 9.262 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.477 -4.260 8.025 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.197 -4.078 9.774 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -2.819 -4.305 8.671 1.00 0.00 H new ATOM 1231 N GLN A 84 -2.284 -6.737 7.411 1.00 0.00 N ATOM 1232 CA GLN A 84 -1.798 -7.363 6.189 1.00 0.00 C ATOM 1233 C GLN A 84 -1.777 -8.879 6.313 1.00 0.00 C ATOM 1234 O GLN A 84 -1.960 -9.588 5.322 1.00 0.00 O ATOM 1235 CB GLN A 84 -0.417 -6.838 5.805 1.00 0.00 C ATOM 1236 CG GLN A 84 -0.445 -5.413 5.282 1.00 0.00 C ATOM 1237 CD GLN A 84 0.804 -5.053 4.507 1.00 0.00 C ATOM 1238 OE1 GLN A 84 0.881 -5.277 3.302 1.00 0.00 O ATOM 1239 NE2 GLN A 84 1.789 -4.497 5.187 1.00 0.00 N ATOM 0 H GLN A 84 -1.566 -6.269 7.964 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.494 -7.098 5.393 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.238 -6.886 6.675 1.00 0.00 H new ATOM 0 HB3 GLN A 84 0.014 -7.489 5.045 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -1.316 -5.282 4.640 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -0.560 -4.725 6.119 1.00 0.00 H new ATOM 0 HE21 GLN A 84 1.686 -4.327 6.187 1.00 0.00 H new ATOM 0 HE22 GLN A 84 2.653 -4.237 4.712 1.00 0.00 H new ATOM 1248 N GLY A 85 -1.553 -9.375 7.523 1.00 0.00 N ATOM 1249 CA GLY A 85 -1.580 -10.806 7.753 1.00 0.00 C ATOM 1250 C GLY A 85 -2.877 -11.433 7.276 1.00 0.00 C ATOM 1251 O GLY A 85 -2.875 -12.500 6.658 1.00 0.00 O ATOM 0 H GLY A 85 -1.353 -8.812 8.349 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.741 -11.272 7.237 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.451 -11.005 8.817 1.00 0.00 H new ATOM 1255 N ARG A 86 -3.988 -10.760 7.554 1.00 0.00 N ATOM 1256 CA ARG A 86 -5.297 -11.230 7.116 1.00 0.00 C ATOM 1257 C ARG A 86 -5.578 -10.864 5.658 1.00 0.00 C ATOM 1258 O ARG A 86 -6.311 -11.575 4.972 1.00 0.00 O ATOM 1259 CB ARG A 86 -6.400 -10.675 8.020 1.00 0.00 C ATOM 1260 CG ARG A 86 -6.417 -11.301 9.405 1.00 0.00 C ATOM 1261 CD ARG A 86 -6.592 -12.807 9.330 1.00 0.00 C ATOM 1262 NE ARG A 86 -7.815 -13.191 8.617 1.00 0.00 N ATOM 1263 CZ ARG A 86 -7.912 -14.255 7.813 1.00 0.00 C ATOM 1264 NH1 ARG A 86 -6.849 -15.012 7.571 1.00 0.00 N1+ ATOM 1265 NH2 ARG A 86 -9.072 -14.556 7.242 1.00 0.00 N ATOM 0 H ARG A 86 -4.008 -9.887 8.081 1.00 0.00 H new ATOM 0 HA ARG A 86 -5.289 -12.318 7.189 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -6.271 -9.597 8.118 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -7.367 -10.838 7.544 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -5.487 -11.067 9.923 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -7.227 -10.868 9.992 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -5.729 -13.246 8.829 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -6.618 -13.218 10.339 1.00 0.00 H new ATOM 0 HE ARG A 86 -8.644 -12.610 8.742 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -5.952 -14.783 7.999 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -6.929 -15.822 6.957 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -9.892 -13.975 7.416 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -9.143 -15.368 6.629 1.00 0.00 H new ATOM 1279 N ILE A 87 -4.996 -9.764 5.181 1.00 0.00 N ATOM 1280 CA ILE A 87 -5.273 -9.294 3.826 1.00 0.00 C ATOM 1281 C ILE A 87 -4.759 -10.306 2.790 1.00 0.00 C ATOM 1282 O ILE A 87 -5.452 -10.610 1.822 1.00 0.00 O ATOM 1283 CB ILE A 87 -4.705 -7.858 3.581 1.00 0.00 C ATOM 1284 CG1 ILE A 87 -5.654 -7.036 2.695 1.00 0.00 C ATOM 1285 CG2 ILE A 87 -3.310 -7.884 2.965 1.00 0.00 C ATOM 1286 CD1 ILE A 87 -5.767 -7.530 1.266 1.00 0.00 C ATOM 0 H ILE A 87 -4.338 -9.188 5.706 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.354 -9.219 3.708 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.626 -7.383 4.559 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -6.646 -7.039 3.147 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -5.313 -6.001 2.682 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -2.960 -6.863 2.814 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -2.627 -8.407 3.634 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.345 -8.401 2.006 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.457 -6.892 0.714 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -4.786 -7.500 0.792 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.140 -8.554 1.264 1.00 0.00 H new ATOM 1298 N TYR A 88 -3.570 -10.870 3.021 1.00 0.00 N ATOM 1299 CA TYR A 88 -3.032 -11.908 2.137 1.00 0.00 C ATOM 1300 C TYR A 88 -3.870 -13.173 2.240 1.00 0.00 C ATOM 1301 O TYR A 88 -4.005 -13.930 1.278 1.00 0.00 O ATOM 1302 CB TYR A 88 -1.583 -12.242 2.492 1.00 0.00 C ATOM 1303 CG TYR A 88 -0.573 -11.197 2.076 1.00 0.00 C ATOM 1304 CD1 TYR A 88 -0.519 -9.958 2.700 1.00 0.00 C ATOM 1305 CD2 TYR A 88 0.339 -11.460 1.065 1.00 0.00 C ATOM 1306 CE1 TYR A 88 0.412 -9.013 2.326 1.00 0.00 C ATOM 1307 CE2 TYR A 88 1.277 -10.523 0.686 1.00 0.00 C ATOM 1308 CZ TYR A 88 1.306 -9.297 1.321 1.00 0.00 C ATOM 1309 OH TYR A 88 2.240 -8.360 0.961 1.00 0.00 O ATOM 0 H TYR A 88 -2.966 -10.628 3.806 1.00 0.00 H new ATOM 0 HA TYR A 88 -3.066 -11.522 1.118 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -1.512 -12.388 3.570 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -1.318 -13.190 2.024 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -1.218 -9.731 3.491 1.00 0.00 H new ATOM 0 HD2 TYR A 88 0.314 -12.417 0.565 1.00 0.00 H new ATOM 0 HE1 TYR A 88 0.439 -8.053 2.820 1.00 0.00 H new ATOM 0 HE2 TYR A 88 1.983 -10.746 -0.101 1.00 0.00 H new ATOM 0 HH TYR A 88 2.045 -8.034 0.058 1.00 0.00 H new ATOM 1319 N GLY A 89 -4.419 -13.394 3.422 1.00 0.00 N ATOM 1320 CA GLY A 89 -5.300 -14.518 3.643 1.00 0.00 C ATOM 1321 C GLY A 89 -6.553 -14.428 2.799 1.00 0.00 C ATOM 1322 O GLY A 89 -7.122 -15.446 2.412 1.00 0.00 O ATOM 0 H GLY A 89 -4.267 -12.807 4.242 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.773 -15.443 3.412 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.575 -14.562 4.697 1.00 0.00 H new ATOM 1326 N LYS A 90 -6.978 -13.211 2.491 1.00 0.00 N ATOM 1327 CA LYS A 90 -8.145 -13.022 1.666 1.00 0.00 C ATOM 1328 C LYS A 90 -7.808 -13.271 0.199 1.00 0.00 C ATOM 1329 O LYS A 90 -8.690 -13.560 -0.606 1.00 0.00 O ATOM 1330 CB LYS A 90 -8.736 -11.635 1.894 1.00 0.00 C ATOM 1331 CG LYS A 90 -9.541 -11.532 3.177 1.00 0.00 C ATOM 1332 CD LYS A 90 -10.760 -12.438 3.118 1.00 0.00 C ATOM 1333 CE LYS A 90 -11.556 -12.411 4.410 1.00 0.00 C ATOM 1334 NZ LYS A 90 -12.730 -13.317 4.345 1.00 0.00 N1+ ATOM 0 H LYS A 90 -6.530 -12.349 2.802 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.905 -13.750 1.950 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -7.929 -10.903 1.919 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.375 -11.376 1.050 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.917 -11.808 4.027 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.855 -10.500 3.334 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.401 -12.129 2.292 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.442 -13.460 2.910 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -10.914 -12.705 5.240 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.891 -11.393 4.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -12.977 -13.635 5.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -13.538 -12.810 3.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -12.500 -14.142 3.755 1.00 0.00 H new ATOM 1348 N LEU A 91 -6.527 -13.180 -0.149 1.00 0.00 N ATOM 1349 CA LEU A 91 -6.068 -13.653 -1.446 1.00 0.00 C ATOM 1350 C LEU A 91 -6.225 -15.168 -1.530 1.00 0.00 C ATOM 1351 O LEU A 91 -6.493 -15.726 -2.599 1.00 0.00 O ATOM 1352 CB LEU A 91 -4.607 -13.272 -1.682 1.00 0.00 C ATOM 1353 CG LEU A 91 -4.362 -11.850 -2.187 1.00 0.00 C ATOM 1354 CD1 LEU A 91 -5.196 -11.574 -3.425 1.00 0.00 C ATOM 1355 CD2 LEU A 91 -4.652 -10.824 -1.105 1.00 0.00 C ATOM 0 H LEU A 91 -5.797 -12.787 0.445 1.00 0.00 H new ATOM 0 HA LEU A 91 -6.676 -13.180 -2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -4.062 -13.404 -0.748 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -4.181 -13.971 -2.402 1.00 0.00 H new ATOM 0 HG LEU A 91 -3.308 -11.765 -2.453 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -5.009 -10.557 -3.771 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -4.926 -12.280 -4.211 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -6.253 -11.687 -3.184 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -4.469 -9.823 -1.495 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -5.693 -10.907 -0.794 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -4.002 -11.005 -0.249 1.00 0.00 H new ATOM 1367 N LYS A 92 -6.052 -15.833 -0.392 1.00 0.00 N ATOM 1368 CA LYS A 92 -6.241 -17.275 -0.314 1.00 0.00 C ATOM 1369 C LYS A 92 -7.727 -17.609 -0.308 1.00 0.00 C ATOM 1370 O LYS A 92 -8.124 -18.717 -0.661 1.00 0.00 O ATOM 1371 CB LYS A 92 -5.575 -17.865 0.935 1.00 0.00 C ATOM 1372 CG LYS A 92 -4.074 -17.619 1.030 1.00 0.00 C ATOM 1373 CD LYS A 92 -3.393 -17.779 -0.316 1.00 0.00 C ATOM 1374 CE LYS A 92 -1.962 -18.286 -0.176 1.00 0.00 C ATOM 1375 NZ LYS A 92 -1.910 -19.679 0.347 1.00 0.00 N1+ ATOM 0 H LYS A 92 -5.781 -15.395 0.488 1.00 0.00 H new ATOM 0 HA LYS A 92 -5.769 -17.718 -1.191 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.055 -17.446 1.819 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.756 -18.940 0.954 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -3.893 -16.614 1.412 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -3.636 -18.315 1.745 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -3.965 -18.474 -0.931 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -3.389 -16.821 -0.836 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -1.467 -18.245 -1.146 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.408 -17.627 0.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -1.002 -20.114 0.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -2.002 -19.665 1.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -2.690 -20.233 -0.062 1.00 0.00 H new ATOM 1389 N GLU A 93 -8.537 -16.626 0.077 1.00 0.00 N ATOM 1390 CA GLU A 93 -9.987 -16.791 0.153 1.00 0.00 C ATOM 1391 C GLU A 93 -10.573 -17.087 -1.230 1.00 0.00 C ATOM 1392 O GLU A 93 -11.552 -17.823 -1.351 1.00 0.00 O ATOM 1393 CB GLU A 93 -10.627 -15.524 0.732 1.00 0.00 C ATOM 1394 CG GLU A 93 -12.033 -15.723 1.277 1.00 0.00 C ATOM 1395 CD GLU A 93 -12.046 -16.453 2.606 1.00 0.00 C ATOM 1396 OE1 GLU A 93 -11.948 -15.782 3.658 1.00 0.00 O ATOM 1397 OE2 GLU A 93 -12.156 -17.697 2.608 1.00 0.00 O1- ATOM 0 H GLU A 93 -8.210 -15.698 0.344 1.00 0.00 H new ATOM 0 HA GLU A 93 -10.204 -17.636 0.807 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -9.991 -15.143 1.531 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -10.656 -14.759 -0.044 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -12.513 -14.752 1.396 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -12.623 -16.284 0.553 1.00 0.00 H new ATOM 1404 N GLU A 94 -9.966 -16.519 -2.273 1.00 0.00 N ATOM 1405 CA GLU A 94 -10.408 -16.749 -3.634 1.00 0.00 C ATOM 1406 C GLU A 94 -9.692 -17.980 -4.207 1.00 0.00 C ATOM 1407 O GLU A 94 -9.925 -18.401 -5.343 1.00 0.00 O ATOM 1408 CB GLU A 94 -10.118 -15.492 -4.456 1.00 0.00 C ATOM 1409 CG GLU A 94 -10.420 -15.624 -5.929 1.00 0.00 C ATOM 1410 CD GLU A 94 -11.896 -15.576 -6.264 1.00 0.00 C ATOM 1411 OE1 GLU A 94 -12.562 -16.630 -6.206 1.00 0.00 O1- ATOM 1412 OE2 GLU A 94 -12.388 -14.488 -6.624 1.00 0.00 O ATOM 0 H GLU A 94 -9.164 -15.895 -2.192 1.00 0.00 H new ATOM 0 HA GLU A 94 -11.479 -16.948 -3.666 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -10.702 -14.666 -4.051 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.067 -15.229 -4.336 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -9.910 -14.825 -6.467 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -10.007 -16.565 -6.291 1.00 0.00 H new ATOM 1419 N ASN A 95 -8.817 -18.554 -3.382 1.00 0.00 N ATOM 1420 CA ASN A 95 -8.065 -19.762 -3.724 1.00 0.00 C ATOM 1421 C ASN A 95 -7.090 -19.506 -4.871 1.00 0.00 C ATOM 1422 O ASN A 95 -6.767 -20.416 -5.635 1.00 0.00 O ATOM 1423 CB ASN A 95 -9.005 -20.927 -4.082 1.00 0.00 C ATOM 1424 CG ASN A 95 -9.962 -21.306 -2.962 1.00 0.00 C ATOM 1425 OD1 ASN A 95 -9.551 -21.105 -1.717 1.00 0.00 O flip ATOM 1426 ND2 ASN A 95 -11.070 -21.779 -3.219 1.00 0.00 N flip ATOM 0 H ASN A 95 -8.608 -18.192 -2.452 1.00 0.00 H new ATOM 0 HA ASN A 95 -7.492 -20.040 -2.840 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -9.583 -20.658 -4.966 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -8.405 -21.798 -4.346 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -11.352 -21.919 -4.189 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -11.705 -22.030 -2.462 1.00 0.00 H new ATOM 1433 N PHE A 96 -6.612 -18.269 -4.985 1.00 0.00 N ATOM 1434 CA PHE A 96 -5.647 -17.917 -6.026 1.00 0.00 C ATOM 1435 C PHE A 96 -4.327 -18.651 -5.823 1.00 0.00 C ATOM 1436 O PHE A 96 -3.812 -19.294 -6.735 1.00 0.00 O ATOM 1437 CB PHE A 96 -5.377 -16.409 -6.046 1.00 0.00 C ATOM 1438 CG PHE A 96 -6.425 -15.592 -6.735 1.00 0.00 C ATOM 1439 CD1 PHE A 96 -6.861 -15.930 -8.003 1.00 0.00 C ATOM 1440 CD2 PHE A 96 -6.961 -14.477 -6.120 1.00 0.00 C ATOM 1441 CE1 PHE A 96 -7.815 -15.170 -8.647 1.00 0.00 C ATOM 1442 CE2 PHE A 96 -7.914 -13.710 -6.758 1.00 0.00 C ATOM 1443 CZ PHE A 96 -8.342 -14.057 -8.023 1.00 0.00 C ATOM 0 H PHE A 96 -6.875 -17.496 -4.373 1.00 0.00 H new ATOM 0 HA PHE A 96 -6.085 -18.217 -6.978 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -5.280 -16.058 -5.019 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -4.419 -16.232 -6.535 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -6.450 -16.799 -8.495 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -6.630 -14.203 -5.129 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -8.149 -15.445 -9.637 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -8.324 -12.839 -6.268 1.00 0.00 H new ATOM 0 HZ PHE A 96 -9.088 -13.459 -8.524 1.00 0.00 H new ATOM 1453 N PHE A 97 -3.792 -18.558 -4.615 1.00 0.00 N ATOM 1454 CA PHE A 97 -2.463 -19.080 -4.324 1.00 0.00 C ATOM 1455 C PHE A 97 -2.550 -20.361 -3.513 1.00 0.00 C ATOM 1456 O PHE A 97 -1.716 -20.610 -2.649 1.00 0.00 O ATOM 1457 CB PHE A 97 -1.654 -18.035 -3.552 1.00 0.00 C ATOM 1458 CG PHE A 97 -1.748 -16.658 -4.138 1.00 0.00 C ATOM 1459 CD1 PHE A 97 -2.751 -15.791 -3.735 1.00 0.00 C ATOM 1460 CD2 PHE A 97 -0.844 -16.231 -5.092 1.00 0.00 C ATOM 1461 CE1 PHE A 97 -2.851 -14.526 -4.273 1.00 0.00 C ATOM 1462 CE2 PHE A 97 -0.938 -14.965 -5.633 1.00 0.00 C ATOM 1463 CZ PHE A 97 -1.942 -14.110 -5.223 1.00 0.00 C ATOM 0 H PHE A 97 -4.258 -18.125 -3.818 1.00 0.00 H new ATOM 0 HA PHE A 97 -1.967 -19.302 -5.269 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -2.002 -18.007 -2.519 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -0.608 -18.341 -3.528 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -3.464 -16.111 -2.989 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -0.056 -16.894 -5.417 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -3.640 -13.862 -3.951 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -0.226 -14.642 -6.378 1.00 0.00 H new ATOM 0 HZ PHE A 97 -2.015 -13.119 -5.645 1.00 0.00 H new ATOM 1473 N GLY A 98 -3.577 -21.153 -3.787 1.00 0.00 N ATOM 1474 CA GLY A 98 -3.759 -22.422 -3.103 1.00 0.00 C ATOM 1475 C GLY A 98 -3.827 -22.296 -1.585 1.00 0.00 C ATOM 1476 O GLY A 98 -3.873 -21.187 -1.043 1.00 0.00 O ATOM 0 H GLY A 98 -4.296 -20.938 -4.478 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -4.676 -22.889 -3.461 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -2.938 -23.088 -3.367 1.00 0.00 H new ATOM 1480 N PRO A 99 -3.858 -23.430 -0.870 1.00 0.00 N ATOM 1481 CA PRO A 99 -3.820 -23.453 0.587 1.00 0.00 C ATOM 1482 C PRO A 99 -2.391 -23.406 1.122 1.00 0.00 C ATOM 1483 O PRO A 99 -1.976 -22.421 1.732 1.00 0.00 O ATOM 1484 CB PRO A 99 -4.483 -24.791 0.948 1.00 0.00 C ATOM 1485 CG PRO A 99 -4.775 -25.485 -0.351 1.00 0.00 C ATOM 1486 CD PRO A 99 -3.976 -24.783 -1.414 1.00 0.00 C ATOM 0 HA PRO A 99 -4.322 -22.588 1.021 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -3.824 -25.395 1.571 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -5.399 -24.629 1.516 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -4.501 -26.539 -0.295 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -5.840 -25.444 -0.579 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -3.002 -25.248 -1.564 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -4.485 -24.791 -2.378 1.00 0.00 H new ATOM 1494 N LYS A 100 -1.637 -24.472 0.860 1.00 0.00 N ATOM 1495 CA LYS A 100 -0.272 -24.596 1.358 1.00 0.00 C ATOM 1496 C LYS A 100 0.687 -23.733 0.546 1.00 0.00 C ATOM 1497 O LYS A 100 1.729 -23.306 1.048 1.00 0.00 O ATOM 1498 CB LYS A 100 0.170 -26.058 1.292 1.00 0.00 C ATOM 1499 CG LYS A 100 1.483 -26.331 2.003 1.00 0.00 C ATOM 1500 CD LYS A 100 1.372 -26.012 3.480 1.00 0.00 C ATOM 1501 CE LYS A 100 2.653 -26.324 4.225 1.00 0.00 C ATOM 1502 NZ LYS A 100 2.511 -26.059 5.679 1.00 0.00 N1+ ATOM 0 H LYS A 100 -1.952 -25.266 0.302 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.252 -24.252 2.392 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -0.607 -26.684 1.731 1.00 0.00 H new ATOM 0 HB3 LYS A 100 0.265 -26.353 0.247 1.00 0.00 H new ATOM 0 HG2 LYS A 100 1.762 -27.377 1.872 1.00 0.00 H new ATOM 0 HG3 LYS A 100 2.276 -25.731 1.555 1.00 0.00 H new ATOM 0 HD2 LYS A 100 1.127 -24.957 3.606 1.00 0.00 H new ATOM 0 HD3 LYS A 100 0.552 -26.584 3.914 1.00 0.00 H new ATOM 0 HE2 LYS A 100 2.922 -27.369 4.068 1.00 0.00 H new ATOM 0 HE3 LYS A 100 3.467 -25.721 3.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 3.405 -26.282 6.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 2.278 -25.056 5.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 1.750 -26.652 6.067 1.00 0.00 H new ATOM 1516 N GLU A 101 0.323 -23.487 -0.707 1.00 0.00 N ATOM 1517 CA GLU A 101 1.144 -22.700 -1.614 1.00 0.00 C ATOM 1518 C GLU A 101 1.386 -21.311 -1.031 1.00 0.00 C ATOM 1519 O GLU A 101 0.461 -20.672 -0.522 1.00 0.00 O ATOM 1520 CB GLU A 101 0.452 -22.601 -2.979 1.00 0.00 C ATOM 1521 CG GLU A 101 1.315 -21.988 -4.069 1.00 0.00 C ATOM 1522 CD GLU A 101 2.547 -22.817 -4.367 1.00 0.00 C ATOM 1523 OE1 GLU A 101 2.430 -23.825 -5.102 1.00 0.00 O1- ATOM 1524 OE2 GLU A 101 3.632 -22.478 -3.863 1.00 0.00 O ATOM 0 H GLU A 101 -0.546 -23.826 -1.120 1.00 0.00 H new ATOM 0 HA GLU A 101 2.109 -23.189 -1.744 1.00 0.00 H new ATOM 0 HB2 GLU A 101 0.145 -23.599 -3.292 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -0.456 -22.007 -2.872 1.00 0.00 H new ATOM 0 HG2 GLU A 101 0.724 -21.881 -4.979 1.00 0.00 H new ATOM 0 HG3 GLU A 101 1.619 -20.986 -3.767 1.00 0.00 H new ATOM 1531 N GLU A 102 2.634 -20.861 -1.085 1.00 0.00 N ATOM 1532 CA GLU A 102 3.001 -19.569 -0.516 1.00 0.00 C ATOM 1533 C GLU A 102 2.245 -18.451 -1.215 1.00 0.00 C ATOM 1534 O GLU A 102 2.217 -18.389 -2.444 1.00 0.00 O ATOM 1535 CB GLU A 102 4.507 -19.301 -0.643 1.00 0.00 C ATOM 1536 CG GLU A 102 5.404 -20.328 0.030 1.00 0.00 C ATOM 1537 CD GLU A 102 5.681 -21.535 -0.843 1.00 0.00 C ATOM 1538 OE1 GLU A 102 6.283 -21.363 -1.923 1.00 0.00 O ATOM 1539 OE2 GLU A 102 5.322 -22.661 -0.443 1.00 0.00 O1- ATOM 0 H GLU A 102 3.407 -21.369 -1.515 1.00 0.00 H new ATOM 0 HA GLU A 102 2.738 -19.597 0.541 1.00 0.00 H new ATOM 0 HB2 GLU A 102 4.764 -19.255 -1.701 1.00 0.00 H new ATOM 0 HB3 GLU A 102 4.723 -18.320 -0.220 1.00 0.00 H new ATOM 0 HG2 GLU A 102 6.349 -19.856 0.299 1.00 0.00 H new ATOM 0 HG3 GLU A 102 4.937 -20.657 0.958 1.00 0.00 H new ATOM 1546 N VAL A 103 1.622 -17.574 -0.438 1.00 0.00 N ATOM 1547 CA VAL A 103 0.963 -16.413 -1.007 1.00 0.00 C ATOM 1548 C VAL A 103 2.004 -15.492 -1.626 1.00 0.00 C ATOM 1549 O VAL A 103 2.955 -15.075 -0.970 1.00 0.00 O ATOM 1550 CB VAL A 103 0.121 -15.639 0.045 1.00 0.00 C ATOM 1551 CG1 VAL A 103 0.972 -15.167 1.220 1.00 0.00 C ATOM 1552 CG2 VAL A 103 -0.600 -14.467 -0.607 1.00 0.00 C ATOM 0 H VAL A 103 1.561 -17.646 0.578 1.00 0.00 H new ATOM 0 HA VAL A 103 0.272 -16.764 -1.774 1.00 0.00 H new ATOM 0 HB VAL A 103 -0.623 -16.329 0.443 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.344 -14.631 1.932 1.00 0.00 H new ATOM 0 HG12 VAL A 103 1.423 -16.029 1.712 1.00 0.00 H new ATOM 0 HG13 VAL A 103 1.757 -14.504 0.857 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -1.185 -13.936 0.144 1.00 0.00 H new ATOM 0 HG22 VAL A 103 0.132 -13.787 -1.044 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -1.264 -14.837 -1.388 1.00 0.00 H new ATOM 1562 N LYS A 104 1.843 -15.228 -2.903 1.00 0.00 N ATOM 1563 CA LYS A 104 2.693 -14.285 -3.592 1.00 0.00 C ATOM 1564 C LYS A 104 1.841 -13.132 -4.071 1.00 0.00 C ATOM 1565 O LYS A 104 1.343 -13.136 -5.193 1.00 0.00 O ATOM 1566 CB LYS A 104 3.375 -14.965 -4.777 1.00 0.00 C ATOM 1567 CG LYS A 104 4.406 -16.016 -4.394 1.00 0.00 C ATOM 1568 CD LYS A 104 5.604 -15.396 -3.702 1.00 0.00 C ATOM 1569 CE LYS A 104 6.679 -16.432 -3.412 1.00 0.00 C ATOM 1570 NZ LYS A 104 7.219 -17.049 -4.654 1.00 0.00 N1+ ATOM 0 H LYS A 104 1.126 -15.657 -3.488 1.00 0.00 H new ATOM 0 HA LYS A 104 3.466 -13.918 -2.917 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.612 -15.433 -5.400 1.00 0.00 H new ATOM 0 HB3 LYS A 104 3.861 -14.203 -5.387 1.00 0.00 H new ATOM 0 HG2 LYS A 104 3.947 -16.754 -3.736 1.00 0.00 H new ATOM 0 HG3 LYS A 104 4.735 -16.546 -5.288 1.00 0.00 H new ATOM 0 HD2 LYS A 104 6.018 -14.606 -4.328 1.00 0.00 H new ATOM 0 HD3 LYS A 104 5.286 -14.930 -2.770 1.00 0.00 H new ATOM 0 HE2 LYS A 104 7.493 -15.963 -2.859 1.00 0.00 H new ATOM 0 HE3 LYS A 104 6.266 -17.211 -2.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.105 -17.548 -4.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 6.526 -17.724 -5.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.404 -16.307 -5.358 1.00 0.00 H new ATOM 1584 N LEU A 105 1.683 -12.143 -3.222 1.00 0.00 N ATOM 1585 CA LEU A 105 0.782 -11.057 -3.515 1.00 0.00 C ATOM 1586 C LEU A 105 1.566 -9.780 -3.738 1.00 0.00 C ATOM 1587 O LEU A 105 2.375 -9.374 -2.902 1.00 0.00 O ATOM 1588 CB LEU A 105 -0.244 -10.913 -2.384 1.00 0.00 C ATOM 1589 CG LEU A 105 -1.456 -10.021 -2.677 1.00 0.00 C ATOM 1590 CD1 LEU A 105 -1.198 -8.591 -2.251 1.00 0.00 C ATOM 1591 CD2 LEU A 105 -1.836 -10.086 -4.147 1.00 0.00 C ATOM 0 H LEU A 105 2.166 -12.070 -2.326 1.00 0.00 H new ATOM 0 HA LEU A 105 0.234 -11.269 -4.433 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -0.606 -11.907 -2.122 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.267 -10.518 -1.506 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.295 -10.399 -2.093 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.075 -7.982 -2.471 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -0.995 -8.561 -1.180 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.338 -8.199 -2.794 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -2.698 -9.445 -4.329 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.997 -9.747 -4.755 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -2.085 -11.113 -4.413 1.00 0.00 H new ATOM 1603 N GLU A 106 1.335 -9.182 -4.892 1.00 0.00 N ATOM 1604 CA GLU A 106 2.017 -7.973 -5.289 1.00 0.00 C ATOM 1605 C GLU A 106 1.642 -6.818 -4.369 1.00 0.00 C ATOM 1606 O GLU A 106 0.477 -6.435 -4.268 1.00 0.00 O ATOM 1607 CB GLU A 106 1.658 -7.640 -6.733 1.00 0.00 C ATOM 1608 CG GLU A 106 2.414 -6.440 -7.282 1.00 0.00 C ATOM 1609 CD GLU A 106 2.189 -6.218 -8.763 1.00 0.00 C ATOM 1610 OE1 GLU A 106 2.762 -6.969 -9.573 1.00 0.00 O ATOM 1611 OE2 GLU A 106 1.466 -5.265 -9.122 1.00 0.00 O1- ATOM 0 H GLU A 106 0.665 -9.526 -5.580 1.00 0.00 H new ATOM 0 HA GLU A 106 3.093 -8.130 -5.212 1.00 0.00 H new ATOM 0 HB2 GLU A 106 1.864 -8.508 -7.360 1.00 0.00 H new ATOM 0 HB3 GLU A 106 0.587 -7.446 -6.798 1.00 0.00 H new ATOM 0 HG2 GLU A 106 2.109 -5.547 -6.737 1.00 0.00 H new ATOM 0 HG3 GLU A 106 3.480 -6.576 -7.100 1.00 0.00 H new ATOM 1618 N THR A 107 2.627 -6.281 -3.686 1.00 0.00 N ATOM 1619 CA THR A 107 2.397 -5.155 -2.810 1.00 0.00 C ATOM 1620 C THR A 107 3.038 -3.906 -3.404 1.00 0.00 C ATOM 1621 O THR A 107 4.152 -3.961 -3.924 1.00 0.00 O ATOM 1622 CB THR A 107 2.952 -5.435 -1.408 1.00 0.00 C ATOM 1623 OG1 THR A 107 2.813 -6.835 -1.119 1.00 0.00 O ATOM 1624 CG2 THR A 107 2.200 -4.624 -0.361 1.00 0.00 C ATOM 0 H THR A 107 3.594 -6.605 -3.720 1.00 0.00 H new ATOM 0 HA THR A 107 1.323 -4.993 -2.717 1.00 0.00 H new ATOM 0 HB THR A 107 4.003 -5.148 -1.380 1.00 0.00 H new ATOM 0 HG1 THR A 107 3.623 -7.309 -1.402 1.00 0.00 H new ATOM 0 HG21 THR A 107 2.609 -4.837 0.627 1.00 0.00 H new ATOM 0 HG22 THR A 107 2.308 -3.561 -0.577 1.00 0.00 H new ATOM 0 HG23 THR A 107 1.144 -4.893 -0.382 1.00 0.00 H new ATOM 1632 N HIS A 108 2.331 -2.792 -3.355 1.00 0.00 N ATOM 1633 CA HIS A 108 2.799 -1.577 -3.998 1.00 0.00 C ATOM 1634 C HIS A 108 3.252 -0.557 -2.973 1.00 0.00 C ATOM 1635 O HIS A 108 2.466 -0.080 -2.156 1.00 0.00 O ATOM 1636 CB HIS A 108 1.698 -0.970 -4.872 1.00 0.00 C ATOM 1637 CG HIS A 108 1.543 -1.644 -6.199 1.00 0.00 C ATOM 1638 ND1 HIS A 108 1.080 -0.995 -7.326 1.00 0.00 N ATOM 1639 CD2 HIS A 108 1.805 -2.914 -6.584 1.00 0.00 C ATOM 1640 CE1 HIS A 108 1.068 -1.837 -8.341 1.00 0.00 C ATOM 1641 NE2 HIS A 108 1.504 -3.005 -7.917 1.00 0.00 N ATOM 0 H HIS A 108 1.434 -2.703 -2.879 1.00 0.00 H new ATOM 0 HA HIS A 108 3.649 -1.844 -4.626 1.00 0.00 H new ATOM 0 HB2 HIS A 108 0.751 -1.022 -4.335 1.00 0.00 H new ATOM 0 HB3 HIS A 108 1.916 0.086 -5.034 1.00 0.00 H new ATOM 0 HD2 HIS A 108 2.182 -3.709 -5.957 1.00 0.00 H new ATOM 0 HE1 HIS A 108 0.754 -1.608 -9.349 1.00 0.00 H new ATOM 0 HE2 HIS A 108 1.602 -3.843 -8.490 1.00 0.00 H new ATOM 1650 N ILE A 109 4.514 -0.200 -3.043 1.00 0.00 N ATOM 1651 CA ILE A 109 5.045 0.835 -2.184 1.00 0.00 C ATOM 1652 C ILE A 109 5.378 2.066 -3.011 1.00 0.00 C ATOM 1653 O ILE A 109 6.259 2.041 -3.873 1.00 0.00 O ATOM 1654 CB ILE A 109 6.281 0.355 -1.387 1.00 0.00 C ATOM 1655 CG1 ILE A 109 7.294 -0.320 -2.312 1.00 0.00 C ATOM 1656 CG2 ILE A 109 5.855 -0.597 -0.280 1.00 0.00 C ATOM 1657 CD1 ILE A 109 8.530 -0.824 -1.602 1.00 0.00 C ATOM 0 H ILE A 109 5.192 -0.610 -3.685 1.00 0.00 H new ATOM 0 HA ILE A 109 4.279 1.089 -1.451 1.00 0.00 H new ATOM 0 HB ILE A 109 6.759 1.225 -0.936 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.810 -1.156 -2.816 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.594 0.388 -3.085 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.734 -0.928 0.274 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.171 -0.085 0.397 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.354 -1.461 -0.716 1.00 0.00 H new ATOM 0 HD11 ILE A 109 9.200 -1.290 -2.325 1.00 0.00 H new ATOM 0 HD12 ILE A 109 9.039 0.011 -1.121 1.00 0.00 H new ATOM 0 HD13 ILE A 109 8.243 -1.557 -0.848 1.00 0.00 H new ATOM 1669 N ARG A 110 4.630 3.130 -2.779 1.00 0.00 N ATOM 1670 CA ARG A 110 4.833 4.363 -3.509 1.00 0.00 C ATOM 1671 C ARG A 110 6.044 5.085 -2.929 1.00 0.00 C ATOM 1672 O ARG A 110 6.050 5.453 -1.754 1.00 0.00 O ATOM 1673 CB ARG A 110 3.579 5.236 -3.404 1.00 0.00 C ATOM 1674 CG ARG A 110 3.422 6.244 -4.530 1.00 0.00 C ATOM 1675 CD ARG A 110 3.033 5.574 -5.838 1.00 0.00 C ATOM 1676 NE ARG A 110 2.861 6.539 -6.926 1.00 0.00 N ATOM 1677 CZ ARG A 110 1.918 6.451 -7.868 1.00 0.00 C ATOM 1678 NH1 ARG A 110 0.986 5.511 -7.803 1.00 0.00 N1+ ATOM 1679 NH2 ARG A 110 1.894 7.328 -8.862 1.00 0.00 N ATOM 0 H ARG A 110 3.878 3.163 -2.091 1.00 0.00 H new ATOM 0 HA ARG A 110 5.015 4.151 -4.563 1.00 0.00 H new ATOM 0 HB2 ARG A 110 2.701 4.590 -3.386 1.00 0.00 H new ATOM 0 HB3 ARG A 110 3.601 5.770 -2.454 1.00 0.00 H new ATOM 0 HG2 ARG A 110 2.663 6.978 -4.258 1.00 0.00 H new ATOM 0 HG3 ARG A 110 4.357 6.788 -4.664 1.00 0.00 H new ATOM 0 HD2 ARG A 110 3.799 4.850 -6.115 1.00 0.00 H new ATOM 0 HD3 ARG A 110 2.106 5.019 -5.698 1.00 0.00 H new ATOM 0 HE ARG A 110 3.503 7.330 -6.967 1.00 0.00 H new ATOM 0 HH11 ARG A 110 0.985 4.847 -7.029 1.00 0.00 H new ATOM 0 HH12 ARG A 110 0.270 5.452 -8.527 1.00 0.00 H new ATOM 0 HH21 ARG A 110 2.595 8.068 -8.906 1.00 0.00 H new ATOM 0 HH22 ARG A 110 1.175 7.263 -9.582 1.00 0.00 H new ATOM 1693 N VAL A 111 7.071 5.266 -3.741 1.00 0.00 N ATOM 1694 CA VAL A 111 8.303 5.889 -3.284 1.00 0.00 C ATOM 1695 C VAL A 111 8.529 7.199 -4.025 1.00 0.00 C ATOM 1696 O VAL A 111 8.087 7.351 -5.160 1.00 0.00 O ATOM 1697 CB VAL A 111 9.539 4.972 -3.496 1.00 0.00 C ATOM 1698 CG1 VAL A 111 9.333 3.596 -2.882 1.00 0.00 C ATOM 1699 CG2 VAL A 111 9.883 4.846 -4.969 1.00 0.00 C ATOM 0 H VAL A 111 7.077 4.990 -4.723 1.00 0.00 H new ATOM 0 HA VAL A 111 8.192 6.069 -2.215 1.00 0.00 H new ATOM 0 HB VAL A 111 10.377 5.445 -2.984 1.00 0.00 H new ATOM 0 HG11 VAL A 111 10.220 2.985 -3.052 1.00 0.00 H new ATOM 0 HG12 VAL A 111 9.162 3.698 -1.810 1.00 0.00 H new ATOM 0 HG13 VAL A 111 8.469 3.117 -3.343 1.00 0.00 H new ATOM 0 HG21 VAL A 111 10.752 4.198 -5.086 1.00 0.00 H new ATOM 0 HG22 VAL A 111 9.036 4.417 -5.505 1.00 0.00 H new ATOM 0 HG23 VAL A 111 10.108 5.832 -5.376 1.00 0.00 H new ATOM 1709 N PRO A 112 9.206 8.167 -3.388 1.00 0.00 N ATOM 1710 CA PRO A 112 9.578 9.431 -4.029 1.00 0.00 C ATOM 1711 C PRO A 112 10.248 9.196 -5.380 1.00 0.00 C ATOM 1712 O PRO A 112 10.820 8.129 -5.604 1.00 0.00 O ATOM 1713 CB PRO A 112 10.571 10.051 -3.048 1.00 0.00 C ATOM 1714 CG PRO A 112 10.215 9.468 -1.723 1.00 0.00 C ATOM 1715 CD PRO A 112 9.662 8.096 -1.996 1.00 0.00 C ATOM 0 HA PRO A 112 8.713 10.063 -4.230 1.00 0.00 H new ATOM 0 HB2 PRO A 112 11.599 9.812 -3.322 1.00 0.00 H new ATOM 0 HB3 PRO A 112 10.489 11.138 -3.036 1.00 0.00 H new ATOM 0 HG2 PRO A 112 11.090 9.412 -1.076 1.00 0.00 H new ATOM 0 HG3 PRO A 112 9.479 10.088 -1.211 1.00 0.00 H new ATOM 0 HD2 PRO A 112 10.422 7.326 -1.864 1.00 0.00 H new ATOM 0 HD3 PRO A 112 8.842 7.854 -1.319 1.00 0.00 H new ATOM 1723 N ALA A 113 10.192 10.179 -6.265 1.00 0.00 N ATOM 1724 CA ALA A 113 10.650 9.990 -7.639 1.00 0.00 C ATOM 1725 C ALA A 113 12.073 9.434 -7.684 1.00 0.00 C ATOM 1726 O ALA A 113 12.344 8.429 -8.346 1.00 0.00 O ATOM 1727 CB ALA A 113 10.569 11.297 -8.414 1.00 0.00 C ATOM 0 H ALA A 113 9.836 11.113 -6.061 1.00 0.00 H new ATOM 0 HA ALA A 113 9.991 9.260 -8.109 1.00 0.00 H new ATOM 0 HB1 ALA A 113 10.914 11.136 -9.435 1.00 0.00 H new ATOM 0 HB2 ALA A 113 9.537 11.647 -8.431 1.00 0.00 H new ATOM 0 HB3 ALA A 113 11.198 12.045 -7.932 1.00 0.00 H new ATOM 1733 N SER A 114 12.964 10.071 -6.940 1.00 0.00 N ATOM 1734 CA SER A 114 14.368 9.686 -6.916 1.00 0.00 C ATOM 1735 C SER A 114 14.609 8.456 -6.033 1.00 0.00 C ATOM 1736 O SER A 114 15.702 7.891 -6.027 1.00 0.00 O ATOM 1737 CB SER A 114 15.202 10.861 -6.406 1.00 0.00 C ATOM 1738 OG SER A 114 14.882 12.053 -7.103 1.00 0.00 O ATOM 0 H SER A 114 12.737 10.864 -6.340 1.00 0.00 H new ATOM 0 HA SER A 114 14.665 9.424 -7.931 1.00 0.00 H new ATOM 0 HB2 SER A 114 15.025 11.001 -5.340 1.00 0.00 H new ATOM 0 HB3 SER A 114 16.262 10.638 -6.527 1.00 0.00 H new ATOM 0 HG SER A 114 15.427 12.790 -6.758 1.00 0.00 H new ATOM 1744 N ALA A 115 13.586 8.028 -5.300 1.00 0.00 N ATOM 1745 CA ALA A 115 13.738 6.930 -4.351 1.00 0.00 C ATOM 1746 C ALA A 115 13.839 5.589 -5.063 1.00 0.00 C ATOM 1747 O ALA A 115 14.501 4.676 -4.576 1.00 0.00 O ATOM 1748 CB ALA A 115 12.594 6.915 -3.347 1.00 0.00 C ATOM 0 H ALA A 115 12.646 8.423 -5.344 1.00 0.00 H new ATOM 0 HA ALA A 115 14.670 7.094 -3.810 1.00 0.00 H new ATOM 0 HB1 ALA A 115 12.731 6.087 -2.651 1.00 0.00 H new ATOM 0 HB2 ALA A 115 12.582 7.855 -2.795 1.00 0.00 H new ATOM 0 HB3 ALA A 115 11.648 6.792 -3.875 1.00 0.00 H new ATOM 1754 N ALA A 116 13.202 5.474 -6.224 1.00 0.00 N ATOM 1755 CA ALA A 116 13.237 4.229 -6.984 1.00 0.00 C ATOM 1756 C ALA A 116 14.655 3.931 -7.466 1.00 0.00 C ATOM 1757 O ALA A 116 15.100 2.786 -7.465 1.00 0.00 O ATOM 1758 CB ALA A 116 12.283 4.283 -8.164 1.00 0.00 C ATOM 0 H ALA A 116 12.659 6.221 -6.657 1.00 0.00 H new ATOM 0 HA ALA A 116 12.917 3.425 -6.321 1.00 0.00 H new ATOM 0 HB1 ALA A 116 12.329 3.342 -8.713 1.00 0.00 H new ATOM 0 HB2 ALA A 116 11.267 4.443 -7.803 1.00 0.00 H new ATOM 0 HB3 ALA A 116 12.567 5.103 -8.824 1.00 0.00 H new ATOM 1764 N GLY A 117 15.373 4.976 -7.854 1.00 0.00 N ATOM 1765 CA GLY A 117 16.741 4.805 -8.304 1.00 0.00 C ATOM 1766 C GLY A 117 17.664 4.417 -7.170 1.00 0.00 C ATOM 1767 O GLY A 117 18.668 3.733 -7.375 1.00 0.00 O ATOM 0 H GLY A 117 15.034 5.938 -7.865 1.00 0.00 H new ATOM 0 HA2 GLY A 117 16.775 4.039 -9.078 1.00 0.00 H new ATOM 0 HA3 GLY A 117 17.093 5.732 -8.757 1.00 0.00 H new ATOM 1771 N ARG A 118 17.311 4.839 -5.964 1.00 0.00 N ATOM 1772 CA ARG A 118 18.134 4.569 -4.796 1.00 0.00 C ATOM 1773 C ARG A 118 17.713 3.279 -4.100 1.00 0.00 C ATOM 1774 O ARG A 118 18.480 2.717 -3.318 1.00 0.00 O ATOM 1775 CB ARG A 118 18.088 5.748 -3.825 1.00 0.00 C ATOM 1776 CG ARG A 118 18.731 7.002 -4.390 1.00 0.00 C ATOM 1777 CD ARG A 118 18.714 8.149 -3.395 1.00 0.00 C ATOM 1778 NE ARG A 118 19.375 7.806 -2.135 1.00 0.00 N ATOM 1779 CZ ARG A 118 20.461 8.421 -1.670 1.00 0.00 C ATOM 1780 NH1 ARG A 118 21.060 9.366 -2.389 1.00 0.00 N1+ ATOM 1781 NH2 ARG A 118 20.959 8.073 -0.494 1.00 0.00 N ATOM 0 H ARG A 118 16.461 5.369 -5.770 1.00 0.00 H new ATOM 0 HA ARG A 118 19.161 4.438 -5.136 1.00 0.00 H new ATOM 0 HB2 ARG A 118 17.050 5.961 -3.569 1.00 0.00 H new ATOM 0 HB3 ARG A 118 18.594 5.471 -2.900 1.00 0.00 H new ATOM 0 HG2 ARG A 118 19.760 6.785 -4.675 1.00 0.00 H new ATOM 0 HG3 ARG A 118 18.206 7.301 -5.297 1.00 0.00 H new ATOM 0 HD2 ARG A 118 19.206 9.016 -3.836 1.00 0.00 H new ATOM 0 HD3 ARG A 118 17.682 8.436 -3.194 1.00 0.00 H new ATOM 0 HE ARG A 118 18.979 7.049 -1.578 1.00 0.00 H new ATOM 0 HH11 ARG A 118 20.688 9.624 -3.303 1.00 0.00 H new ATOM 0 HH12 ARG A 118 21.891 9.833 -2.026 1.00 0.00 H new ATOM 0 HH21 ARG A 118 20.511 7.337 0.052 1.00 0.00 H new ATOM 0 HH22 ARG A 118 21.791 8.541 -0.134 1.00 0.00 H new ATOM 1795 N VAL A 119 16.502 2.805 -4.383 1.00 0.00 N ATOM 1796 CA VAL A 119 16.054 1.526 -3.843 1.00 0.00 C ATOM 1797 C VAL A 119 16.708 0.389 -4.621 1.00 0.00 C ATOM 1798 O VAL A 119 16.945 -0.693 -4.087 1.00 0.00 O ATOM 1799 CB VAL A 119 14.511 1.377 -3.853 1.00 0.00 C ATOM 1800 CG1 VAL A 119 13.960 1.143 -5.252 1.00 0.00 C ATOM 1801 CG2 VAL A 119 14.081 0.260 -2.923 1.00 0.00 C ATOM 0 H VAL A 119 15.822 3.281 -4.976 1.00 0.00 H new ATOM 0 HA VAL A 119 16.360 1.485 -2.798 1.00 0.00 H new ATOM 0 HB VAL A 119 14.096 2.320 -3.498 1.00 0.00 H new ATOM 0 HG11 VAL A 119 12.875 1.045 -5.204 1.00 0.00 H new ATOM 0 HG12 VAL A 119 14.221 1.986 -5.891 1.00 0.00 H new ATOM 0 HG13 VAL A 119 14.389 0.229 -5.664 1.00 0.00 H new ATOM 0 HG21 VAL A 119 12.995 0.169 -2.942 1.00 0.00 H new ATOM 0 HG22 VAL A 119 14.530 -0.678 -3.249 1.00 0.00 H new ATOM 0 HG23 VAL A 119 14.409 0.485 -1.908 1.00 0.00 H new ATOM 1811 N ILE A 120 17.008 0.652 -5.892 1.00 0.00 N ATOM 1812 CA ILE A 120 17.817 -0.258 -6.681 1.00 0.00 C ATOM 1813 C ILE A 120 19.222 -0.292 -6.089 1.00 0.00 C ATOM 1814 O ILE A 120 19.848 -1.345 -5.973 1.00 0.00 O ATOM 1815 CB ILE A 120 17.887 0.175 -8.164 1.00 0.00 C ATOM 1816 CG1 ILE A 120 16.480 0.278 -8.758 1.00 0.00 C ATOM 1817 CG2 ILE A 120 18.729 -0.803 -8.970 1.00 0.00 C ATOM 1818 CD1 ILE A 120 16.448 0.805 -10.178 1.00 0.00 C ATOM 0 H ILE A 120 16.701 1.487 -6.391 1.00 0.00 H new ATOM 0 HA ILE A 120 17.360 -1.247 -6.651 1.00 0.00 H new ATOM 0 HB ILE A 120 18.359 1.157 -8.211 1.00 0.00 H new ATOM 0 HG12 ILE A 120 16.015 -0.707 -8.736 1.00 0.00 H new ATOM 0 HG13 ILE A 120 15.877 0.929 -8.126 1.00 0.00 H new ATOM 0 HG21 ILE A 120 18.765 -0.480 -10.010 1.00 0.00 H new ATOM 0 HG22 ILE A 120 19.740 -0.833 -8.564 1.00 0.00 H new ATOM 0 HG23 ILE A 120 18.285 -1.797 -8.914 1.00 0.00 H new ATOM 0 HD11 ILE A 120 15.416 0.848 -10.527 1.00 0.00 H new ATOM 0 HD12 ILE A 120 16.882 1.804 -10.205 1.00 0.00 H new ATOM 0 HD13 ILE A 120 17.022 0.142 -10.825 1.00 0.00 H new ATOM 1830 N GLY A 121 19.699 0.880 -5.695 1.00 0.00 N ATOM 1831 CA GLY A 121 20.962 0.969 -5.006 1.00 0.00 C ATOM 1832 C GLY A 121 21.989 1.769 -5.764 1.00 0.00 C ATOM 1833 O GLY A 121 21.701 2.274 -6.847 1.00 0.00 O ATOM 0 H GLY A 121 19.228 1.773 -5.843 1.00 0.00 H new ATOM 0 HA2 GLY A 121 20.805 1.423 -4.028 1.00 0.00 H new ATOM 0 HA3 GLY A 121 21.347 -0.036 -4.833 1.00 0.00 H new ATOM 1837 N ASP A 122 23.181 1.872 -5.182 1.00 0.00 N ATOM 1838 CA ASP A 122 24.319 2.578 -5.784 1.00 0.00 C ATOM 1839 C ASP A 122 24.449 2.269 -7.277 1.00 0.00 C ATOM 1840 O ASP A 122 24.135 3.108 -8.125 1.00 0.00 O ATOM 1841 CB ASP A 122 25.607 2.195 -5.040 1.00 0.00 C ATOM 1842 CG ASP A 122 25.650 0.717 -4.680 1.00 0.00 C ATOM 1843 OD1 ASP A 122 26.068 -0.100 -5.525 1.00 0.00 O ATOM 1844 OD2 ASP A 122 25.235 0.366 -3.558 1.00 0.00 O1- ATOM 0 H ASP A 122 23.391 1.465 -4.270 1.00 0.00 H new ATOM 0 HA ASP A 122 24.148 3.650 -5.690 1.00 0.00 H new ATOM 0 HB2 ASP A 122 26.469 2.440 -5.661 1.00 0.00 H new ATOM 0 HB3 ASP A 122 25.689 2.790 -4.131 1.00 0.00 H new ATOM 1849 N ASP A 123 24.909 1.071 -7.592 1.00 0.00 N ATOM 1850 CA ASP A 123 24.915 0.587 -8.965 1.00 0.00 C ATOM 1851 C ASP A 123 23.916 -0.558 -9.079 1.00 0.00 C ATOM 1852 O ASP A 123 24.029 -1.441 -9.924 1.00 0.00 O ATOM 1853 CB ASP A 123 26.327 0.137 -9.374 1.00 0.00 C ATOM 1854 CG ASP A 123 26.417 -0.302 -10.827 1.00 0.00 C ATOM 1855 OD1 ASP A 123 26.235 0.547 -11.726 1.00 0.00 O ATOM 1856 OD2 ASP A 123 26.675 -1.498 -11.080 1.00 0.00 O1- ATOM 0 H ASP A 123 25.286 0.410 -6.912 1.00 0.00 H new ATOM 0 HA ASP A 123 24.624 1.389 -9.643 1.00 0.00 H new ATOM 0 HB2 ASP A 123 27.026 0.956 -9.204 1.00 0.00 H new ATOM 0 HB3 ASP A 123 26.639 -0.687 -8.732 1.00 0.00 H new ATOM 1861 N GLY A 124 22.920 -0.527 -8.211 1.00 0.00 N ATOM 1862 CA GLY A 124 21.938 -1.589 -8.181 1.00 0.00 C ATOM 1863 C GLY A 124 22.342 -2.726 -7.268 1.00 0.00 C ATOM 1864 O GLY A 124 21.857 -3.842 -7.411 1.00 0.00 O ATOM 0 H GLY A 124 22.773 0.214 -7.526 1.00 0.00 H new ATOM 0 HA2 GLY A 124 20.981 -1.185 -7.851 1.00 0.00 H new ATOM 0 HA3 GLY A 124 21.791 -1.973 -9.191 1.00 0.00 H new ATOM 1868 N LYS A 125 23.234 -2.441 -6.329 1.00 0.00 N ATOM 1869 CA LYS A 125 23.707 -3.447 -5.386 1.00 0.00 C ATOM 1870 C LYS A 125 22.741 -3.582 -4.207 1.00 0.00 C ATOM 1871 O LYS A 125 22.560 -4.670 -3.656 1.00 0.00 O ATOM 1872 CB LYS A 125 25.100 -3.064 -4.878 1.00 0.00 C ATOM 1873 CG LYS A 125 25.761 -4.133 -4.022 1.00 0.00 C ATOM 1874 CD LYS A 125 27.099 -3.675 -3.451 1.00 0.00 C ATOM 1875 CE LYS A 125 28.094 -3.298 -4.542 1.00 0.00 C ATOM 1876 NZ LYS A 125 28.036 -1.851 -4.895 1.00 0.00 N1+ ATOM 0 H LYS A 125 23.647 -1.517 -6.199 1.00 0.00 H new ATOM 0 HA LYS A 125 23.759 -4.407 -5.899 1.00 0.00 H new ATOM 0 HB2 LYS A 125 25.741 -2.850 -5.733 1.00 0.00 H new ATOM 0 HB3 LYS A 125 25.024 -2.144 -4.298 1.00 0.00 H new ATOM 0 HG2 LYS A 125 25.093 -4.404 -3.204 1.00 0.00 H new ATOM 0 HG3 LYS A 125 25.913 -5.031 -4.620 1.00 0.00 H new ATOM 0 HD2 LYS A 125 26.938 -2.818 -2.797 1.00 0.00 H new ATOM 0 HD3 LYS A 125 27.521 -4.470 -2.837 1.00 0.00 H new ATOM 0 HE2 LYS A 125 29.102 -3.547 -4.211 1.00 0.00 H new ATOM 0 HE3 LYS A 125 27.894 -3.894 -5.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 28.266 -1.730 -5.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 27.079 -1.487 -4.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 28.723 -1.325 -4.318 1.00 0.00 H new ATOM 1890 N THR A 126 22.118 -2.472 -3.840 1.00 0.00 N ATOM 1891 CA THR A 126 21.251 -2.419 -2.673 1.00 0.00 C ATOM 1892 C THR A 126 20.016 -3.310 -2.844 1.00 0.00 C ATOM 1893 O THR A 126 19.581 -3.960 -1.894 1.00 0.00 O ATOM 1894 CB THR A 126 20.809 -0.970 -2.395 1.00 0.00 C ATOM 1895 OG1 THR A 126 21.953 -0.102 -2.428 1.00 0.00 O ATOM 1896 CG2 THR A 126 20.121 -0.850 -1.044 1.00 0.00 C ATOM 0 H THR A 126 22.199 -1.587 -4.340 1.00 0.00 H new ATOM 0 HA THR A 126 21.825 -2.792 -1.825 1.00 0.00 H new ATOM 0 HB THR A 126 20.097 -0.679 -3.168 1.00 0.00 H new ATOM 0 HG1 THR A 126 21.700 0.785 -2.098 1.00 0.00 H new ATOM 0 HG21 THR A 126 19.822 0.185 -0.879 1.00 0.00 H new ATOM 0 HG22 THR A 126 19.239 -1.490 -1.027 1.00 0.00 H new ATOM 0 HG23 THR A 126 20.809 -1.159 -0.257 1.00 0.00 H new ATOM 1904 N VAL A 127 19.471 -3.355 -4.059 1.00 0.00 N ATOM 1905 CA VAL A 127 18.279 -4.155 -4.330 1.00 0.00 C ATOM 1906 C VAL A 127 18.563 -5.642 -4.109 1.00 0.00 C ATOM 1907 O VAL A 127 17.697 -6.390 -3.652 1.00 0.00 O ATOM 1908 CB VAL A 127 17.736 -3.918 -5.761 1.00 0.00 C ATOM 1909 CG1 VAL A 127 18.724 -4.390 -6.818 1.00 0.00 C ATOM 1910 CG2 VAL A 127 16.384 -4.590 -5.949 1.00 0.00 C ATOM 0 H VAL A 127 19.834 -2.849 -4.867 1.00 0.00 H new ATOM 0 HA VAL A 127 17.509 -3.834 -3.628 1.00 0.00 H new ATOM 0 HB VAL A 127 17.604 -2.843 -5.887 1.00 0.00 H new ATOM 0 HG11 VAL A 127 18.310 -4.208 -7.810 1.00 0.00 H new ATOM 0 HG12 VAL A 127 19.661 -3.844 -6.710 1.00 0.00 H new ATOM 0 HG13 VAL A 127 18.910 -5.457 -6.692 1.00 0.00 H new ATOM 0 HG21 VAL A 127 16.025 -4.408 -6.962 1.00 0.00 H new ATOM 0 HG22 VAL A 127 16.485 -5.663 -5.787 1.00 0.00 H new ATOM 0 HG23 VAL A 127 15.672 -4.181 -5.233 1.00 0.00 H new ATOM 1920 N ASN A 128 19.792 -6.059 -4.401 1.00 0.00 N ATOM 1921 CA ASN A 128 20.198 -7.438 -4.173 1.00 0.00 C ATOM 1922 C ASN A 128 20.202 -7.729 -2.682 1.00 0.00 C ATOM 1923 O ASN A 128 19.734 -8.777 -2.242 1.00 0.00 O ATOM 1924 CB ASN A 128 21.584 -7.714 -4.760 1.00 0.00 C ATOM 1925 CG ASN A 128 21.619 -7.586 -6.269 1.00 0.00 C ATOM 1926 OD1 ASN A 128 21.945 -6.531 -6.804 1.00 0.00 O ATOM 1927 ND2 ASN A 128 21.277 -8.655 -6.967 1.00 0.00 N ATOM 0 H ASN A 128 20.520 -5.462 -4.794 1.00 0.00 H new ATOM 0 HA ASN A 128 19.484 -8.091 -4.674 1.00 0.00 H new ATOM 0 HB2 ASN A 128 22.303 -7.020 -4.324 1.00 0.00 H new ATOM 0 HB3 ASN A 128 21.900 -8.718 -4.478 1.00 0.00 H new ATOM 0 HD21 ASN A 128 21.278 -8.620 -7.986 1.00 0.00 H new ATOM 0 HD22 ASN A 128 21.012 -9.515 -6.486 1.00 0.00 H new ATOM 1934 N GLU A 129 20.717 -6.779 -1.909 1.00 0.00 N ATOM 1935 CA GLU A 129 20.734 -6.898 -0.459 1.00 0.00 C ATOM 1936 C GLU A 129 19.308 -6.928 0.085 1.00 0.00 C ATOM 1937 O GLU A 129 18.997 -7.705 0.985 1.00 0.00 O ATOM 1938 CB GLU A 129 21.503 -5.732 0.166 1.00 0.00 C ATOM 1939 CG GLU A 129 21.702 -5.869 1.668 1.00 0.00 C ATOM 1940 CD GLU A 129 22.676 -6.972 2.029 1.00 0.00 C ATOM 1941 OE1 GLU A 129 22.283 -8.160 2.010 1.00 0.00 O ATOM 1942 OE2 GLU A 129 23.843 -6.652 2.333 1.00 0.00 O1- ATOM 0 H GLU A 129 21.129 -5.917 -2.265 1.00 0.00 H new ATOM 0 HA GLU A 129 21.235 -7.830 -0.197 1.00 0.00 H new ATOM 0 HB2 GLU A 129 22.478 -5.651 -0.315 1.00 0.00 H new ATOM 0 HB3 GLU A 129 20.969 -4.804 -0.038 1.00 0.00 H new ATOM 0 HG2 GLU A 129 22.065 -4.923 2.070 1.00 0.00 H new ATOM 0 HG3 GLU A 129 20.741 -6.069 2.141 1.00 0.00 H new ATOM 1949 N LEU A 130 18.444 -6.086 -0.482 1.00 0.00 N ATOM 1950 CA LEU A 130 17.049 -6.016 -0.060 1.00 0.00 C ATOM 1951 C LEU A 130 16.365 -7.366 -0.197 1.00 0.00 C ATOM 1952 O LEU A 130 15.765 -7.859 0.756 1.00 0.00 O ATOM 1953 CB LEU A 130 16.285 -4.978 -0.887 1.00 0.00 C ATOM 1954 CG LEU A 130 16.638 -3.518 -0.604 1.00 0.00 C ATOM 1955 CD1 LEU A 130 15.903 -2.606 -1.574 1.00 0.00 C ATOM 1956 CD2 LEU A 130 16.296 -3.154 0.835 1.00 0.00 C ATOM 0 H LEU A 130 18.688 -5.443 -1.235 1.00 0.00 H new ATOM 0 HA LEU A 130 17.041 -5.721 0.989 1.00 0.00 H new ATOM 0 HB2 LEU A 130 16.464 -5.178 -1.943 1.00 0.00 H new ATOM 0 HB3 LEU A 130 15.218 -5.115 -0.713 1.00 0.00 H new ATOM 0 HG LEU A 130 17.711 -3.385 -0.743 1.00 0.00 H new ATOM 0 HD11 LEU A 130 16.161 -1.568 -1.364 1.00 0.00 H new ATOM 0 HD12 LEU A 130 16.192 -2.853 -2.596 1.00 0.00 H new ATOM 0 HD13 LEU A 130 14.828 -2.743 -1.458 1.00 0.00 H new ATOM 0 HD21 LEU A 130 16.554 -2.111 1.018 1.00 0.00 H new ATOM 0 HD22 LEU A 130 15.229 -3.298 1.003 1.00 0.00 H new ATOM 0 HD23 LEU A 130 16.860 -3.792 1.516 1.00 0.00 H new ATOM 1968 N GLN A 131 16.487 -7.976 -1.366 1.00 0.00 N ATOM 1969 CA GLN A 131 15.830 -9.250 -1.629 1.00 0.00 C ATOM 1970 C GLN A 131 16.452 -10.364 -0.796 1.00 0.00 C ATOM 1971 O GLN A 131 15.759 -11.274 -0.336 1.00 0.00 O ATOM 1972 CB GLN A 131 15.900 -9.599 -3.115 1.00 0.00 C ATOM 1973 CG GLN A 131 15.184 -8.598 -4.009 1.00 0.00 C ATOM 1974 CD GLN A 131 14.969 -9.114 -5.421 1.00 0.00 C ATOM 1975 OE1 GLN A 131 14.744 -10.414 -5.555 1.00 0.00 O flip ATOM 1976 NE2 GLN A 131 14.975 -8.346 -6.380 1.00 0.00 N flip ATOM 0 H GLN A 131 17.033 -7.612 -2.147 1.00 0.00 H new ATOM 0 HA GLN A 131 14.782 -9.151 -1.345 1.00 0.00 H new ATOM 0 HB2 GLN A 131 16.946 -9.660 -3.417 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.466 -10.587 -3.269 1.00 0.00 H new ATOM 0 HG2 GLN A 131 14.219 -8.350 -3.568 1.00 0.00 H new ATOM 0 HG3 GLN A 131 15.763 -7.675 -4.049 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.152 -7.352 -6.236 1.00 0.00 H new ATOM 0 HE22 GLN A 131 14.803 -8.703 -7.320 1.00 0.00 H new ATOM 1985 N ASN A 132 17.759 -10.274 -0.597 1.00 0.00 N ATOM 1986 CA ASN A 132 18.494 -11.252 0.198 1.00 0.00 C ATOM 1987 C ASN A 132 18.096 -11.184 1.673 1.00 0.00 C ATOM 1988 O ASN A 132 18.001 -12.211 2.347 1.00 0.00 O ATOM 1989 CB ASN A 132 20.002 -11.018 0.037 1.00 0.00 C ATOM 1990 CG ASN A 132 20.841 -11.794 1.032 1.00 0.00 C ATOM 1991 OD1 ASN A 132 21.150 -12.970 0.829 1.00 0.00 O ATOM 1992 ND2 ASN A 132 21.249 -11.126 2.099 1.00 0.00 N ATOM 0 H ASN A 132 18.339 -9.526 -0.979 1.00 0.00 H new ATOM 0 HA ASN A 132 18.243 -12.249 -0.164 1.00 0.00 H new ATOM 0 HB2 ASN A 132 20.300 -11.297 -0.974 1.00 0.00 H new ATOM 0 HB3 ASN A 132 20.211 -9.954 0.148 1.00 0.00 H new ATOM 0 HD21 ASN A 132 21.842 -11.584 2.791 1.00 0.00 H new ATOM 0 HD22 ASN A 132 20.970 -10.153 2.229 1.00 0.00 H new ATOM 1999 N LEU A 133 17.848 -9.975 2.159 1.00 0.00 N ATOM 2000 CA LEU A 133 17.548 -9.766 3.570 1.00 0.00 C ATOM 2001 C LEU A 133 16.060 -9.988 3.856 1.00 0.00 C ATOM 2002 O LEU A 133 15.702 -10.695 4.798 1.00 0.00 O ATOM 2003 CB LEU A 133 17.972 -8.344 3.981 1.00 0.00 C ATOM 2004 CG LEU A 133 18.208 -8.099 5.482 1.00 0.00 C ATOM 2005 CD1 LEU A 133 16.906 -8.103 6.270 1.00 0.00 C ATOM 2006 CD2 LEU A 133 19.172 -9.132 6.045 1.00 0.00 C ATOM 0 H LEU A 133 17.849 -9.124 1.597 1.00 0.00 H new ATOM 0 HA LEU A 133 18.109 -10.492 4.158 1.00 0.00 H new ATOM 0 HB2 LEU A 133 18.889 -8.095 3.447 1.00 0.00 H new ATOM 0 HB3 LEU A 133 17.206 -7.648 3.639 1.00 0.00 H new ATOM 0 HG LEU A 133 18.650 -7.108 5.585 1.00 0.00 H new ATOM 0 HD11 LEU A 133 17.118 -7.927 7.324 1.00 0.00 H new ATOM 0 HD12 LEU A 133 16.251 -7.316 5.895 1.00 0.00 H new ATOM 0 HD13 LEU A 133 16.414 -9.069 6.156 1.00 0.00 H new ATOM 0 HD21 LEU A 133 19.327 -8.944 7.107 1.00 0.00 H new ATOM 0 HD22 LEU A 133 18.755 -10.130 5.911 1.00 0.00 H new ATOM 0 HD23 LEU A 133 20.125 -9.064 5.521 1.00 0.00 H new ATOM 2018 N THR A 134 15.202 -9.394 3.039 1.00 0.00 N ATOM 2019 CA THR A 134 13.767 -9.409 3.301 1.00 0.00 C ATOM 2020 C THR A 134 13.118 -10.724 2.882 1.00 0.00 C ATOM 2021 O THR A 134 12.039 -11.075 3.369 1.00 0.00 O ATOM 2022 CB THR A 134 13.055 -8.252 2.578 1.00 0.00 C ATOM 2023 OG1 THR A 134 13.252 -8.363 1.162 1.00 0.00 O ATOM 2024 CG2 THR A 134 13.580 -6.911 3.067 1.00 0.00 C ATOM 0 H THR A 134 15.472 -8.896 2.191 1.00 0.00 H new ATOM 0 HA THR A 134 13.656 -9.292 4.379 1.00 0.00 H new ATOM 0 HB THR A 134 11.989 -8.311 2.799 1.00 0.00 H new ATOM 0 HG1 THR A 134 14.170 -8.103 0.938 1.00 0.00 H new ATOM 0 HG21 THR A 134 13.064 -6.106 2.544 1.00 0.00 H new ATOM 0 HG22 THR A 134 13.403 -6.820 4.139 1.00 0.00 H new ATOM 0 HG23 THR A 134 14.650 -6.845 2.869 1.00 0.00 H new ATOM 2032 N ALA A 135 13.796 -11.445 1.984 1.00 0.00 N ATOM 2033 CA ALA A 135 13.272 -12.672 1.385 1.00 0.00 C ATOM 2034 C ALA A 135 12.061 -12.365 0.509 1.00 0.00 C ATOM 2035 O ALA A 135 11.239 -13.238 0.223 1.00 0.00 O ATOM 2036 CB ALA A 135 12.933 -13.711 2.448 1.00 0.00 C ATOM 0 H ALA A 135 14.727 -11.192 1.652 1.00 0.00 H new ATOM 0 HA ALA A 135 14.052 -13.097 0.753 1.00 0.00 H new ATOM 0 HB1 ALA A 135 12.546 -14.610 1.968 1.00 0.00 H new ATOM 0 HB2 ALA A 135 13.831 -13.959 3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 135 12.179 -13.308 3.124 1.00 0.00 H new ATOM 2042 N ALA A 136 11.965 -11.111 0.084 1.00 0.00 N ATOM 2043 CA ALA A 136 10.903 -10.670 -0.804 1.00 0.00 C ATOM 2044 C ALA A 136 11.497 -10.125 -2.096 1.00 0.00 C ATOM 2045 O ALA A 136 12.697 -9.851 -2.167 1.00 0.00 O ATOM 2046 CB ALA A 136 10.054 -9.611 -0.121 1.00 0.00 C ATOM 0 H ALA A 136 12.621 -10.375 0.346 1.00 0.00 H new ATOM 0 HA ALA A 136 10.266 -11.521 -1.045 1.00 0.00 H new ATOM 0 HB1 ALA A 136 9.262 -9.289 -0.796 1.00 0.00 H new ATOM 0 HB2 ALA A 136 9.612 -10.027 0.784 1.00 0.00 H new ATOM 0 HB3 ALA A 136 10.678 -8.757 0.140 1.00 0.00 H new ATOM 2052 N GLU A 137 10.670 -9.987 -3.122 1.00 0.00 N ATOM 2053 CA GLU A 137 11.125 -9.501 -4.405 1.00 0.00 C ATOM 2054 C GLU A 137 10.770 -8.039 -4.590 1.00 0.00 C ATOM 2055 O GLU A 137 9.600 -7.675 -4.682 1.00 0.00 O ATOM 2056 CB GLU A 137 10.521 -10.359 -5.507 1.00 0.00 C ATOM 2057 CG GLU A 137 10.933 -11.818 -5.408 1.00 0.00 C ATOM 2058 CD GLU A 137 10.297 -12.679 -6.472 1.00 0.00 C ATOM 2059 OE1 GLU A 137 9.102 -13.014 -6.335 1.00 0.00 O ATOM 2060 OE2 GLU A 137 10.994 -13.042 -7.444 1.00 0.00 O1- ATOM 0 H GLU A 137 9.675 -10.208 -3.084 1.00 0.00 H new ATOM 0 HA GLU A 137 12.211 -9.575 -4.452 1.00 0.00 H new ATOM 0 HB2 GLU A 137 9.434 -10.289 -5.462 1.00 0.00 H new ATOM 0 HB3 GLU A 137 10.826 -9.965 -6.477 1.00 0.00 H new ATOM 0 HG2 GLU A 137 12.018 -11.891 -5.489 1.00 0.00 H new ATOM 0 HG3 GLU A 137 10.660 -12.202 -4.425 1.00 0.00 H new ATOM 2067 N VAL A 138 11.803 -7.215 -4.630 1.00 0.00 N ATOM 2068 CA VAL A 138 11.651 -5.777 -4.762 1.00 0.00 C ATOM 2069 C VAL A 138 12.006 -5.345 -6.182 1.00 0.00 C ATOM 2070 O VAL A 138 13.176 -5.341 -6.559 1.00 0.00 O ATOM 2071 CB VAL A 138 12.570 -5.051 -3.749 1.00 0.00 C ATOM 2072 CG1 VAL A 138 12.436 -3.540 -3.851 1.00 0.00 C ATOM 2073 CG2 VAL A 138 12.277 -5.521 -2.332 1.00 0.00 C ATOM 0 H VAL A 138 12.773 -7.526 -4.572 1.00 0.00 H new ATOM 0 HA VAL A 138 10.614 -5.511 -4.556 1.00 0.00 H new ATOM 0 HB VAL A 138 13.600 -5.306 -3.997 1.00 0.00 H new ATOM 0 HG11 VAL A 138 13.096 -3.066 -3.125 1.00 0.00 H new ATOM 0 HG12 VAL A 138 12.711 -3.217 -4.855 1.00 0.00 H new ATOM 0 HG13 VAL A 138 11.405 -3.252 -3.646 1.00 0.00 H new ATOM 0 HG21 VAL A 138 12.932 -5.000 -1.633 1.00 0.00 H new ATOM 0 HG22 VAL A 138 11.238 -5.305 -2.085 1.00 0.00 H new ATOM 0 HG23 VAL A 138 12.451 -6.595 -2.261 1.00 0.00 H new ATOM 2083 N VAL A 139 11.000 -5.000 -6.973 1.00 0.00 N ATOM 2084 CA VAL A 139 11.233 -4.580 -8.349 1.00 0.00 C ATOM 2085 C VAL A 139 10.546 -3.248 -8.642 1.00 0.00 C ATOM 2086 O VAL A 139 9.372 -3.055 -8.324 1.00 0.00 O ATOM 2087 CB VAL A 139 10.771 -5.657 -9.365 1.00 0.00 C ATOM 2088 CG1 VAL A 139 9.293 -5.985 -9.197 1.00 0.00 C ATOM 2089 CG2 VAL A 139 11.063 -5.218 -10.794 1.00 0.00 C ATOM 0 H VAL A 139 10.020 -5.002 -6.689 1.00 0.00 H new ATOM 0 HA VAL A 139 12.309 -4.449 -8.464 1.00 0.00 H new ATOM 0 HB VAL A 139 11.339 -6.564 -9.161 1.00 0.00 H new ATOM 0 HG11 VAL A 139 9.004 -6.743 -9.925 1.00 0.00 H new ATOM 0 HG12 VAL A 139 9.116 -6.363 -8.190 1.00 0.00 H new ATOM 0 HG13 VAL A 139 8.700 -5.084 -9.356 1.00 0.00 H new ATOM 0 HG21 VAL A 139 10.730 -5.990 -11.487 1.00 0.00 H new ATOM 0 HG22 VAL A 139 10.534 -4.289 -11.004 1.00 0.00 H new ATOM 0 HG23 VAL A 139 12.135 -5.060 -10.914 1.00 0.00 H new ATOM 2099 N VAL A 140 11.292 -2.323 -9.224 1.00 0.00 N ATOM 2100 CA VAL A 140 10.757 -1.021 -9.588 1.00 0.00 C ATOM 2101 C VAL A 140 11.020 -0.747 -11.070 1.00 0.00 C ATOM 2102 O VAL A 140 12.129 -0.961 -11.561 1.00 0.00 O ATOM 2103 CB VAL A 140 11.355 0.100 -8.708 1.00 0.00 C ATOM 2104 CG1 VAL A 140 12.868 0.177 -8.843 1.00 0.00 C ATOM 2105 CG2 VAL A 140 10.710 1.434 -9.036 1.00 0.00 C ATOM 0 H VAL A 140 12.277 -2.451 -9.456 1.00 0.00 H new ATOM 0 HA VAL A 140 9.681 -1.031 -9.415 1.00 0.00 H new ATOM 0 HB VAL A 140 11.137 -0.143 -7.668 1.00 0.00 H new ATOM 0 HG11 VAL A 140 13.250 0.977 -8.209 1.00 0.00 H new ATOM 0 HG12 VAL A 140 13.309 -0.771 -8.536 1.00 0.00 H new ATOM 0 HG13 VAL A 140 13.131 0.380 -9.881 1.00 0.00 H new ATOM 0 HG21 VAL A 140 11.143 2.212 -8.407 1.00 0.00 H new ATOM 0 HG22 VAL A 140 10.886 1.675 -10.084 1.00 0.00 H new ATOM 0 HG23 VAL A 140 9.637 1.374 -8.852 1.00 0.00 H new ATOM 2115 N PRO A 141 9.985 -0.324 -11.812 1.00 0.00 N ATOM 2116 CA PRO A 141 10.105 -0.027 -13.239 1.00 0.00 C ATOM 2117 C PRO A 141 11.104 1.090 -13.497 1.00 0.00 C ATOM 2118 O PRO A 141 10.924 2.210 -13.023 1.00 0.00 O ATOM 2119 CB PRO A 141 8.693 0.415 -13.645 1.00 0.00 C ATOM 2120 CG PRO A 141 7.800 -0.107 -12.578 1.00 0.00 C ATOM 2121 CD PRO A 141 8.617 -0.100 -11.321 1.00 0.00 C ATOM 0 HA PRO A 141 10.467 -0.885 -13.806 1.00 0.00 H new ATOM 0 HB2 PRO A 141 8.626 1.500 -13.719 1.00 0.00 H new ATOM 0 HB3 PRO A 141 8.419 0.012 -14.620 1.00 0.00 H new ATOM 0 HG2 PRO A 141 6.913 0.517 -12.471 1.00 0.00 H new ATOM 0 HG3 PRO A 141 7.455 -1.114 -12.815 1.00 0.00 H new ATOM 0 HD2 PRO A 141 8.530 0.847 -10.789 1.00 0.00 H new ATOM 0 HD3 PRO A 141 8.303 -0.883 -10.631 1.00 0.00 H new ATOM 2129 N ARG A 142 12.134 0.791 -14.279 1.00 0.00 N ATOM 2130 CA ARG A 142 13.217 1.740 -14.518 1.00 0.00 C ATOM 2131 C ARG A 142 12.827 2.712 -15.626 1.00 0.00 C ATOM 2132 O ARG A 142 13.664 3.413 -16.192 1.00 0.00 O ATOM 2133 CB ARG A 142 14.518 1.008 -14.881 1.00 0.00 C ATOM 2134 CG ARG A 142 14.921 -0.070 -13.881 1.00 0.00 C ATOM 2135 CD ARG A 142 14.200 -1.380 -14.156 1.00 0.00 C ATOM 2136 NE ARG A 142 14.388 -2.359 -13.085 1.00 0.00 N ATOM 2137 CZ ARG A 142 14.261 -3.675 -13.249 1.00 0.00 C ATOM 2138 NH1 ARG A 142 13.996 -4.175 -14.449 1.00 0.00 N1+ ATOM 2139 NH2 ARG A 142 14.400 -4.491 -12.212 1.00 0.00 N ATOM 0 H ARG A 142 12.243 -0.102 -14.760 1.00 0.00 H new ATOM 0 HA ARG A 142 13.390 2.302 -13.600 1.00 0.00 H new ATOM 0 HB2 ARG A 142 14.405 0.553 -15.865 1.00 0.00 H new ATOM 0 HB3 ARG A 142 15.324 1.737 -14.958 1.00 0.00 H new ATOM 0 HG2 ARG A 142 15.998 -0.229 -13.930 1.00 0.00 H new ATOM 0 HG3 ARG A 142 14.694 0.267 -12.870 1.00 0.00 H new ATOM 0 HD2 ARG A 142 13.135 -1.185 -14.283 1.00 0.00 H new ATOM 0 HD3 ARG A 142 14.561 -1.800 -15.095 1.00 0.00 H new ATOM 0 HE ARG A 142 14.631 -2.013 -12.157 1.00 0.00 H new ATOM 0 HH11 ARG A 142 13.889 -3.551 -15.249 1.00 0.00 H new ATOM 0 HH12 ARG A 142 13.899 -5.183 -14.572 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.604 -4.111 -11.288 1.00 0.00 H new ATOM 0 HH22 ARG A 142 14.302 -5.498 -12.339 1.00 0.00 H new ATOM 2153 N ASP A 143 11.538 2.726 -15.931 1.00 0.00 N ATOM 2154 CA ASP A 143 10.978 3.636 -16.918 1.00 0.00 C ATOM 2155 C ASP A 143 9.972 4.550 -16.245 1.00 0.00 C ATOM 2156 O ASP A 143 9.386 5.432 -16.876 1.00 0.00 O ATOM 2157 CB ASP A 143 10.275 2.857 -18.035 1.00 0.00 C ATOM 2158 CG ASP A 143 11.209 1.974 -18.835 1.00 0.00 C ATOM 2159 OD1 ASP A 143 11.568 0.882 -18.346 1.00 0.00 O1- ATOM 2160 OD2 ASP A 143 11.568 2.353 -19.969 1.00 0.00 O ATOM 0 H ASP A 143 10.851 2.107 -15.501 1.00 0.00 H new ATOM 0 HA ASP A 143 11.789 4.221 -17.351 1.00 0.00 H new ATOM 0 HB2 ASP A 143 9.490 2.240 -17.598 1.00 0.00 H new ATOM 0 HB3 ASP A 143 9.789 3.562 -18.709 1.00 0.00 H new ATOM 2165 N GLN A 144 9.774 4.333 -14.953 1.00 0.00 N ATOM 2166 CA GLN A 144 8.731 5.021 -14.212 1.00 0.00 C ATOM 2167 C GLN A 144 9.295 6.216 -13.454 1.00 0.00 C ATOM 2168 O GLN A 144 10.118 6.057 -12.556 1.00 0.00 O ATOM 2169 CB GLN A 144 8.051 4.049 -13.244 1.00 0.00 C ATOM 2170 CG GLN A 144 6.834 4.633 -12.553 1.00 0.00 C ATOM 2171 CD GLN A 144 5.738 5.018 -13.527 1.00 0.00 C ATOM 2172 OE1 GLN A 144 5.706 6.140 -14.029 1.00 0.00 O ATOM 2173 NE2 GLN A 144 4.828 4.096 -13.798 1.00 0.00 N ATOM 0 H GLN A 144 10.326 3.682 -14.395 1.00 0.00 H new ATOM 0 HA GLN A 144 7.993 5.392 -14.923 1.00 0.00 H new ATOM 0 HB2 GLN A 144 7.754 3.154 -13.790 1.00 0.00 H new ATOM 0 HB3 GLN A 144 8.772 3.737 -12.489 1.00 0.00 H new ATOM 0 HG2 GLN A 144 6.443 3.907 -11.840 1.00 0.00 H new ATOM 0 HG3 GLN A 144 7.132 5.512 -11.982 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.888 3.176 -13.362 1.00 0.00 H new ATOM 0 HE22 GLN A 144 4.066 4.305 -14.443 1.00 0.00 H new ATOM 2182 N THR A 145 8.858 7.411 -13.840 1.00 0.00 N ATOM 2183 CA THR A 145 9.252 8.641 -13.162 1.00 0.00 C ATOM 2184 C THR A 145 8.501 9.843 -13.755 1.00 0.00 C ATOM 2185 O THR A 145 9.083 10.679 -14.451 1.00 0.00 O ATOM 2186 CB THR A 145 10.790 8.863 -13.225 1.00 0.00 C ATOM 2187 OG1 THR A 145 11.139 10.156 -12.711 1.00 0.00 O ATOM 2188 CG2 THR A 145 11.316 8.717 -14.645 1.00 0.00 C ATOM 0 H THR A 145 8.225 7.554 -14.627 1.00 0.00 H new ATOM 0 HA THR A 145 8.981 8.544 -12.111 1.00 0.00 H new ATOM 0 HB THR A 145 11.253 8.095 -12.606 1.00 0.00 H new ATOM 0 HG1 THR A 145 10.653 10.847 -13.207 1.00 0.00 H new ATOM 0 HG21 THR A 145 12.394 8.879 -14.652 1.00 0.00 H new ATOM 0 HG22 THR A 145 11.097 7.715 -15.013 1.00 0.00 H new ATOM 0 HG23 THR A 145 10.835 9.453 -15.289 1.00 0.00 H new ATOM 2196 N PRO A 146 7.182 9.942 -13.502 1.00 0.00 N ATOM 2197 CA PRO A 146 6.365 11.022 -14.035 1.00 0.00 C ATOM 2198 C PRO A 146 6.283 12.217 -13.088 1.00 0.00 C ATOM 2199 O PRO A 146 6.231 12.063 -11.862 1.00 0.00 O ATOM 2200 CB PRO A 146 5.003 10.353 -14.172 1.00 0.00 C ATOM 2201 CG PRO A 146 4.938 9.400 -13.024 1.00 0.00 C ATOM 2202 CD PRO A 146 6.369 9.016 -12.690 1.00 0.00 C ATOM 0 HA PRO A 146 6.764 11.434 -14.962 1.00 0.00 H new ATOM 0 HB2 PRO A 146 4.195 11.084 -14.128 1.00 0.00 H new ATOM 0 HB3 PRO A 146 4.910 9.833 -15.125 1.00 0.00 H new ATOM 0 HG2 PRO A 146 4.451 9.862 -12.165 1.00 0.00 H new ATOM 0 HG3 PRO A 146 4.352 8.519 -13.286 1.00 0.00 H new ATOM 0 HD2 PRO A 146 6.576 9.130 -11.626 1.00 0.00 H new ATOM 0 HD3 PRO A 146 6.574 7.976 -12.944 1.00 0.00 H new ATOM 2210 N ASP A 147 6.255 13.407 -13.671 1.00 0.00 N ATOM 2211 CA ASP A 147 6.150 14.647 -12.908 1.00 0.00 C ATOM 2212 C ASP A 147 4.762 14.764 -12.294 1.00 0.00 C ATOM 2213 O ASP A 147 4.539 15.554 -11.377 1.00 0.00 O ATOM 2214 CB ASP A 147 6.407 15.863 -13.806 1.00 0.00 C ATOM 2215 CG ASP A 147 7.776 15.846 -14.458 1.00 0.00 C ATOM 2216 OD1 ASP A 147 8.738 16.347 -13.842 1.00 0.00 O1- ATOM 2217 OD2 ASP A 147 7.888 15.345 -15.599 1.00 0.00 O ATOM 0 H ASP A 147 6.304 13.542 -14.681 1.00 0.00 H new ATOM 0 HA ASP A 147 6.902 14.624 -12.119 1.00 0.00 H new ATOM 0 HB2 ASP A 147 5.643 15.901 -14.582 1.00 0.00 H new ATOM 0 HB3 ASP A 147 6.305 16.772 -13.213 1.00 0.00 H new ATOM 2222 N GLU A 148 3.844 13.959 -12.823 1.00 0.00 N ATOM 2223 CA GLU A 148 2.447 13.950 -12.402 1.00 0.00 C ATOM 2224 C GLU A 148 2.301 13.793 -10.891 1.00 0.00 C ATOM 2225 O GLU A 148 1.571 14.543 -10.245 1.00 0.00 O ATOM 2226 CB GLU A 148 1.725 12.795 -13.100 1.00 0.00 C ATOM 2227 CG GLU A 148 0.245 12.700 -12.765 1.00 0.00 C ATOM 2228 CD GLU A 148 -0.415 11.490 -13.389 1.00 0.00 C ATOM 2229 OE1 GLU A 148 -0.300 10.389 -12.819 1.00 0.00 O ATOM 2230 OE2 GLU A 148 -1.053 11.633 -14.451 1.00 0.00 O1- ATOM 0 H GLU A 148 4.052 13.288 -13.563 1.00 0.00 H new ATOM 0 HA GLU A 148 2.008 14.909 -12.678 1.00 0.00 H new ATOM 0 HB2 GLU A 148 1.837 12.909 -14.178 1.00 0.00 H new ATOM 0 HB3 GLU A 148 2.210 11.858 -12.826 1.00 0.00 H new ATOM 0 HG2 GLU A 148 0.123 12.658 -11.683 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -0.260 13.603 -13.108 1.00 0.00 H new ATOM 2237 N ASN A 149 3.002 12.819 -10.331 1.00 0.00 N ATOM 2238 CA ASN A 149 2.858 12.508 -8.915 1.00 0.00 C ATOM 2239 C ASN A 149 4.182 12.681 -8.180 1.00 0.00 C ATOM 2240 O ASN A 149 4.222 12.667 -6.953 1.00 0.00 O ATOM 2241 CB ASN A 149 2.348 11.071 -8.747 1.00 0.00 C ATOM 2242 CG ASN A 149 1.948 10.734 -7.318 1.00 0.00 C ATOM 2243 OD1 ASN A 149 2.171 9.617 -6.852 1.00 0.00 O ATOM 2244 ND2 ASN A 149 1.315 11.671 -6.629 1.00 0.00 N ATOM 0 H ASN A 149 3.672 12.234 -10.830 1.00 0.00 H new ATOM 0 HA ASN A 149 2.136 13.201 -8.483 1.00 0.00 H new ATOM 0 HB2 ASN A 149 1.490 10.919 -9.402 1.00 0.00 H new ATOM 0 HB3 ASN A 149 3.124 10.378 -9.072 1.00 0.00 H new ATOM 0 HD21 ASN A 149 0.995 11.478 -5.680 1.00 0.00 H new ATOM 0 HD22 ASN A 149 1.147 12.586 -7.047 1.00 0.00 H new ATOM 2251 N GLU A 150 5.255 12.862 -8.972 1.00 0.00 N ATOM 2252 CA GLU A 150 6.645 12.920 -8.482 1.00 0.00 C ATOM 2253 C GLU A 150 6.936 11.772 -7.515 1.00 0.00 C ATOM 2254 O GLU A 150 7.782 11.877 -6.627 1.00 0.00 O ATOM 2255 CB GLU A 150 6.980 14.287 -7.849 1.00 0.00 C ATOM 2256 CG GLU A 150 6.313 14.561 -6.510 1.00 0.00 C ATOM 2257 CD GLU A 150 6.685 15.910 -5.939 1.00 0.00 C ATOM 2258 OE1 GLU A 150 7.706 15.999 -5.223 1.00 0.00 O ATOM 2259 OE2 GLU A 150 5.955 16.888 -6.200 1.00 0.00 O1- ATOM 0 H GLU A 150 5.180 12.974 -9.983 1.00 0.00 H new ATOM 0 HA GLU A 150 7.297 12.803 -9.348 1.00 0.00 H new ATOM 0 HB2 GLU A 150 8.060 14.355 -7.719 1.00 0.00 H new ATOM 0 HB3 GLU A 150 6.693 15.073 -8.547 1.00 0.00 H new ATOM 0 HG2 GLU A 150 5.231 14.508 -6.630 1.00 0.00 H new ATOM 0 HG3 GLU A 150 6.594 13.781 -5.802 1.00 0.00 H new ATOM 2266 N GLN A 151 6.241 10.663 -7.731 1.00 0.00 N ATOM 2267 CA GLN A 151 6.308 9.517 -6.847 1.00 0.00 C ATOM 2268 C GLN A 151 5.924 8.257 -7.628 1.00 0.00 C ATOM 2269 O GLN A 151 4.884 8.221 -8.292 1.00 0.00 O ATOM 2270 CB GLN A 151 5.367 9.749 -5.659 1.00 0.00 C ATOM 2271 CG GLN A 151 5.589 8.809 -4.491 1.00 0.00 C ATOM 2272 CD GLN A 151 4.847 9.243 -3.241 1.00 0.00 C ATOM 2273 OE1 GLN A 151 3.706 8.848 -3.008 1.00 0.00 O ATOM 2274 NE2 GLN A 151 5.490 10.066 -2.427 1.00 0.00 N ATOM 0 H GLN A 151 5.615 10.537 -8.527 1.00 0.00 H new ATOM 0 HA GLN A 151 7.320 9.384 -6.463 1.00 0.00 H new ATOM 0 HB2 GLN A 151 5.487 10.775 -5.311 1.00 0.00 H new ATOM 0 HB3 GLN A 151 4.337 9.646 -6.001 1.00 0.00 H new ATOM 0 HG2 GLN A 151 5.266 7.806 -4.771 1.00 0.00 H new ATOM 0 HG3 GLN A 151 6.656 8.751 -4.274 1.00 0.00 H new ATOM 0 HE21 GLN A 151 6.436 10.372 -2.654 1.00 0.00 H new ATOM 0 HE22 GLN A 151 5.039 10.394 -1.573 1.00 0.00 H new ATOM 2283 N VAL A 152 6.769 7.239 -7.556 1.00 0.00 N ATOM 2284 CA VAL A 152 6.621 6.048 -8.383 1.00 0.00 C ATOM 2285 C VAL A 152 6.310 4.817 -7.534 1.00 0.00 C ATOM 2286 O VAL A 152 6.162 4.918 -6.318 1.00 0.00 O ATOM 2287 CB VAL A 152 7.896 5.799 -9.212 1.00 0.00 C ATOM 2288 CG1 VAL A 152 8.174 6.984 -10.122 1.00 0.00 C ATOM 2289 CG2 VAL A 152 9.088 5.530 -8.309 1.00 0.00 C ATOM 0 H VAL A 152 7.572 7.214 -6.927 1.00 0.00 H new ATOM 0 HA VAL A 152 5.784 6.222 -9.059 1.00 0.00 H new ATOM 0 HB VAL A 152 7.734 4.915 -9.829 1.00 0.00 H new ATOM 0 HG11 VAL A 152 9.078 6.794 -10.701 1.00 0.00 H new ATOM 0 HG12 VAL A 152 7.332 7.128 -10.799 1.00 0.00 H new ATOM 0 HG13 VAL A 152 8.312 7.881 -9.519 1.00 0.00 H new ATOM 0 HG21 VAL A 152 9.975 5.357 -8.919 1.00 0.00 H new ATOM 0 HG22 VAL A 152 9.255 6.390 -7.661 1.00 0.00 H new ATOM 0 HG23 VAL A 152 8.890 4.649 -7.699 1.00 0.00 H new ATOM 2299 N ILE A 153 6.212 3.656 -8.176 1.00 0.00 N ATOM 2300 CA ILE A 153 5.786 2.441 -7.488 1.00 0.00 C ATOM 2301 C ILE A 153 6.826 1.326 -7.586 1.00 0.00 C ATOM 2302 O ILE A 153 7.325 1.023 -8.667 1.00 0.00 O ATOM 2303 CB ILE A 153 4.465 1.891 -8.069 1.00 0.00 C ATOM 2304 CG1 ILE A 153 3.378 2.967 -8.093 1.00 0.00 C ATOM 2305 CG2 ILE A 153 4.002 0.689 -7.260 1.00 0.00 C ATOM 2306 CD1 ILE A 153 2.081 2.502 -8.720 1.00 0.00 C ATOM 0 H ILE A 153 6.421 3.531 -9.167 1.00 0.00 H new ATOM 0 HA ILE A 153 5.652 2.731 -6.446 1.00 0.00 H new ATOM 0 HB ILE A 153 4.649 1.581 -9.098 1.00 0.00 H new ATOM 0 HG12 ILE A 153 3.181 3.296 -7.073 1.00 0.00 H new ATOM 0 HG13 ILE A 153 3.748 3.833 -8.642 1.00 0.00 H new ATOM 0 HG21 ILE A 153 3.070 0.307 -7.676 1.00 0.00 H new ATOM 0 HG22 ILE A 153 4.763 -0.091 -7.299 1.00 0.00 H new ATOM 0 HG23 ILE A 153 3.841 0.988 -6.224 1.00 0.00 H new ATOM 0 HD11 ILE A 153 1.356 3.316 -8.703 1.00 0.00 H new ATOM 0 HD12 ILE A 153 2.263 2.200 -9.751 1.00 0.00 H new ATOM 0 HD13 ILE A 153 1.688 1.655 -8.158 1.00 0.00 H new ATOM 2318 N VAL A 154 7.134 0.724 -6.448 1.00 0.00 N ATOM 2319 CA VAL A 154 7.911 -0.510 -6.403 1.00 0.00 C ATOM 2320 C VAL A 154 6.983 -1.661 -6.034 1.00 0.00 C ATOM 2321 O VAL A 154 6.078 -1.493 -5.209 1.00 0.00 O ATOM 2322 CB VAL A 154 9.040 -0.443 -5.360 1.00 0.00 C ATOM 2323 CG1 VAL A 154 9.896 -1.708 -5.385 1.00 0.00 C ATOM 2324 CG2 VAL A 154 9.897 0.798 -5.560 1.00 0.00 C ATOM 0 H VAL A 154 6.855 1.073 -5.531 1.00 0.00 H new ATOM 0 HA VAL A 154 8.361 -0.658 -7.385 1.00 0.00 H new ATOM 0 HB VAL A 154 8.576 -0.376 -4.376 1.00 0.00 H new ATOM 0 HG11 VAL A 154 10.684 -1.629 -4.637 1.00 0.00 H new ATOM 0 HG12 VAL A 154 9.272 -2.574 -5.164 1.00 0.00 H new ATOM 0 HG13 VAL A 154 10.343 -1.825 -6.372 1.00 0.00 H new ATOM 0 HG21 VAL A 154 10.687 0.820 -4.809 1.00 0.00 H new ATOM 0 HG22 VAL A 154 10.342 0.776 -6.555 1.00 0.00 H new ATOM 0 HG23 VAL A 154 9.277 1.689 -5.460 1.00 0.00 H new ATOM 2334 N LYS A 155 7.173 -2.810 -6.652 1.00 0.00 N ATOM 2335 CA LYS A 155 6.350 -3.965 -6.344 1.00 0.00 C ATOM 2336 C LYS A 155 7.129 -4.946 -5.487 1.00 0.00 C ATOM 2337 O LYS A 155 8.211 -5.392 -5.874 1.00 0.00 O ATOM 2338 CB LYS A 155 5.878 -4.665 -7.621 1.00 0.00 C ATOM 2339 CG LYS A 155 5.470 -3.712 -8.725 1.00 0.00 C ATOM 2340 CD LYS A 155 6.580 -3.561 -9.747 1.00 0.00 C ATOM 2341 CE LYS A 155 6.232 -2.512 -10.779 1.00 0.00 C ATOM 2342 NZ LYS A 155 5.013 -2.877 -11.556 1.00 0.00 N1+ ATOM 0 H LYS A 155 7.884 -2.969 -7.365 1.00 0.00 H new ATOM 0 HA LYS A 155 5.474 -3.616 -5.797 1.00 0.00 H new ATOM 0 HB2 LYS A 155 6.677 -5.310 -7.987 1.00 0.00 H new ATOM 0 HB3 LYS A 155 5.033 -5.310 -7.380 1.00 0.00 H new ATOM 0 HG2 LYS A 155 4.568 -4.080 -9.214 1.00 0.00 H new ATOM 0 HG3 LYS A 155 5.227 -2.738 -8.299 1.00 0.00 H new ATOM 0 HD2 LYS A 155 7.507 -3.287 -9.244 1.00 0.00 H new ATOM 0 HD3 LYS A 155 6.756 -4.517 -10.241 1.00 0.00 H new ATOM 0 HE2 LYS A 155 6.073 -1.554 -10.283 1.00 0.00 H new ATOM 0 HE3 LYS A 155 7.072 -2.382 -11.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 4.886 -2.204 -12.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 5.120 -3.838 -11.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 4.181 -2.843 -10.933 1.00 0.00 H new ATOM 2356 N ILE A 156 6.591 -5.252 -4.320 1.00 0.00 N ATOM 2357 CA ILE A 156 7.158 -6.276 -3.461 1.00 0.00 C ATOM 2358 C ILE A 156 6.326 -7.547 -3.572 1.00 0.00 C ATOM 2359 O ILE A 156 5.155 -7.573 -3.186 1.00 0.00 O ATOM 2360 CB ILE A 156 7.236 -5.823 -1.982 1.00 0.00 C ATOM 2361 CG1 ILE A 156 8.189 -4.629 -1.839 1.00 0.00 C ATOM 2362 CG2 ILE A 156 7.683 -6.977 -1.092 1.00 0.00 C ATOM 2363 CD1 ILE A 156 8.377 -4.160 -0.409 1.00 0.00 C ATOM 0 H ILE A 156 5.756 -4.802 -3.944 1.00 0.00 H new ATOM 0 HA ILE A 156 8.178 -6.464 -3.795 1.00 0.00 H new ATOM 0 HB ILE A 156 6.242 -5.511 -1.662 1.00 0.00 H new ATOM 0 HG12 ILE A 156 9.160 -4.900 -2.253 1.00 0.00 H new ATOM 0 HG13 ILE A 156 7.809 -3.800 -2.436 1.00 0.00 H new ATOM 0 HG21 ILE A 156 7.732 -6.640 -0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 156 6.969 -7.797 -1.173 1.00 0.00 H new ATOM 0 HG23 ILE A 156 8.668 -7.320 -1.409 1.00 0.00 H new ATOM 0 HD11 ILE A 156 9.064 -3.314 -0.391 1.00 0.00 H new ATOM 0 HD12 ILE A 156 7.415 -3.856 0.004 1.00 0.00 H new ATOM 0 HD13 ILE A 156 8.787 -4.973 0.190 1.00 0.00 H new ATOM 2375 N ILE A 157 6.923 -8.582 -4.143 1.00 0.00 N ATOM 2376 CA ILE A 157 6.247 -9.857 -4.313 1.00 0.00 C ATOM 2377 C ILE A 157 6.752 -10.851 -3.277 1.00 0.00 C ATOM 2378 O ILE A 157 7.964 -11.016 -3.105 1.00 0.00 O ATOM 2379 CB ILE A 157 6.453 -10.451 -5.734 1.00 0.00 C ATOM 2380 CG1 ILE A 157 5.905 -9.514 -6.820 1.00 0.00 C ATOM 2381 CG2 ILE A 157 5.792 -11.818 -5.847 1.00 0.00 C ATOM 2382 CD1 ILE A 157 6.837 -8.377 -7.187 1.00 0.00 C ATOM 0 H ILE A 157 7.879 -8.562 -4.498 1.00 0.00 H new ATOM 0 HA ILE A 157 5.181 -9.676 -4.179 1.00 0.00 H new ATOM 0 HB ILE A 157 7.526 -10.561 -5.889 1.00 0.00 H new ATOM 0 HG12 ILE A 157 5.693 -10.098 -7.715 1.00 0.00 H new ATOM 0 HG13 ILE A 157 4.957 -9.097 -6.480 1.00 0.00 H new ATOM 0 HG21 ILE A 157 5.948 -12.216 -6.850 1.00 0.00 H new ATOM 0 HG22 ILE A 157 6.231 -12.496 -5.115 1.00 0.00 H new ATOM 0 HG23 ILE A 157 4.723 -11.722 -5.657 1.00 0.00 H new ATOM 0 HD11 ILE A 157 6.375 -7.763 -7.960 1.00 0.00 H new ATOM 0 HD12 ILE A 157 7.030 -7.766 -6.305 1.00 0.00 H new ATOM 0 HD13 ILE A 157 7.777 -8.783 -7.560 1.00 0.00 H new ATOM 2394 N GLY A 158 5.831 -11.498 -2.580 1.00 0.00 N ATOM 2395 CA GLY A 158 6.215 -12.471 -1.582 1.00 0.00 C ATOM 2396 C GLY A 158 5.101 -12.763 -0.602 1.00 0.00 C ATOM 2397 O GLY A 158 3.969 -12.312 -0.784 1.00 0.00 O ATOM 0 H GLY A 158 4.825 -11.366 -2.688 1.00 0.00 H new ATOM 0 HA2 GLY A 158 6.512 -13.396 -2.076 1.00 0.00 H new ATOM 0 HA3 GLY A 158 7.086 -12.106 -1.039 1.00 0.00 H new ATOM 2401 N HIS A 159 5.426 -13.520 0.438 1.00 0.00 N ATOM 2402 CA HIS A 159 4.455 -13.871 1.467 1.00 0.00 C ATOM 2403 C HIS A 159 4.438 -12.813 2.564 1.00 0.00 C ATOM 2404 O HIS A 159 5.443 -12.142 2.798 1.00 0.00 O ATOM 2405 CB HIS A 159 4.729 -15.275 2.038 1.00 0.00 C ATOM 2406 CG HIS A 159 6.163 -15.547 2.385 1.00 0.00 C ATOM 2407 ND1 HIS A 159 7.230 -15.818 1.594 1.00 0.00 N flip ATOM 2408 CD2 HIS A 159 6.632 -15.592 3.678 1.00 0.00 C flip ATOM 2409 CE1 HIS A 159 8.308 -16.015 2.415 1.00 0.00 C flip ATOM 2410 NE2 HIS A 159 7.923 -15.873 3.666 1.00 0.00 N flip ATOM 0 H HIS A 159 6.358 -13.904 0.592 1.00 0.00 H new ATOM 0 HA HIS A 159 3.466 -13.899 1.010 1.00 0.00 H new ATOM 0 HB2 HIS A 159 4.122 -15.412 2.933 1.00 0.00 H new ATOM 0 HB3 HIS A 159 4.399 -16.018 1.311 1.00 0.00 H new ATOM 0 HD2 HIS A 159 6.038 -15.424 4.564 1.00 0.00 H new ATOM 0 HE1 HIS A 159 9.311 -16.249 2.089 1.00 0.00 H new ATOM 0 HE2 HIS A 159 8.521 -15.964 4.487 1.00 0.00 H new ATOM 2419 N PHE A 160 3.296 -12.694 3.242 1.00 0.00 N ATOM 2420 CA PHE A 160 2.999 -11.546 4.103 1.00 0.00 C ATOM 2421 C PHE A 160 4.097 -11.214 5.114 1.00 0.00 C ATOM 2422 O PHE A 160 4.462 -10.051 5.233 1.00 0.00 O ATOM 2423 CB PHE A 160 1.640 -11.712 4.804 1.00 0.00 C ATOM 2424 CG PHE A 160 1.405 -13.047 5.457 1.00 0.00 C ATOM 2425 CD1 PHE A 160 1.026 -14.148 4.703 1.00 0.00 C ATOM 2426 CD2 PHE A 160 1.537 -13.197 6.827 1.00 0.00 C ATOM 2427 CE1 PHE A 160 0.789 -15.369 5.302 1.00 0.00 C ATOM 2428 CE2 PHE A 160 1.303 -14.416 7.430 1.00 0.00 C ATOM 2429 CZ PHE A 160 0.928 -15.504 6.668 1.00 0.00 C ATOM 0 H PHE A 160 2.551 -13.390 3.211 1.00 0.00 H new ATOM 0 HA PHE A 160 2.952 -10.690 3.430 1.00 0.00 H new ATOM 0 HB2 PHE A 160 1.545 -10.935 5.562 1.00 0.00 H new ATOM 0 HB3 PHE A 160 0.850 -11.541 4.072 1.00 0.00 H new ATOM 0 HD1 PHE A 160 0.915 -14.049 3.633 1.00 0.00 H new ATOM 0 HD2 PHE A 160 1.827 -12.350 7.431 1.00 0.00 H new ATOM 0 HE1 PHE A 160 0.495 -16.218 4.702 1.00 0.00 H new ATOM 0 HE2 PHE A 160 1.413 -14.519 8.499 1.00 0.00 H new ATOM 0 HZ PHE A 160 0.744 -16.458 7.140 1.00 0.00 H new ATOM 2439 N TYR A 161 4.635 -12.203 5.827 1.00 0.00 N ATOM 2440 CA TYR A 161 5.666 -11.924 6.834 1.00 0.00 C ATOM 2441 C TYR A 161 6.888 -11.259 6.203 1.00 0.00 C ATOM 2442 O TYR A 161 7.369 -10.224 6.679 1.00 0.00 O ATOM 2443 CB TYR A 161 6.085 -13.202 7.573 1.00 0.00 C ATOM 2444 CG TYR A 161 5.043 -13.719 8.544 1.00 0.00 C ATOM 2445 CD1 TYR A 161 4.391 -12.857 9.418 1.00 0.00 C ATOM 2446 CD2 TYR A 161 4.711 -15.068 8.589 1.00 0.00 C ATOM 2447 CE1 TYR A 161 3.440 -13.323 10.306 1.00 0.00 C ATOM 2448 CE2 TYR A 161 3.760 -15.541 9.476 1.00 0.00 C ATOM 2449 CZ TYR A 161 3.128 -14.664 10.331 1.00 0.00 C ATOM 2450 OH TYR A 161 2.181 -15.130 11.213 1.00 0.00 O ATOM 0 H TYR A 161 4.383 -13.187 5.732 1.00 0.00 H new ATOM 0 HA TYR A 161 5.231 -11.235 7.558 1.00 0.00 H new ATOM 0 HB2 TYR A 161 6.302 -13.979 6.840 1.00 0.00 H new ATOM 0 HB3 TYR A 161 7.010 -13.009 8.116 1.00 0.00 H new ATOM 0 HD1 TYR A 161 4.632 -11.804 9.403 1.00 0.00 H new ATOM 0 HD2 TYR A 161 5.204 -15.759 7.920 1.00 0.00 H new ATOM 0 HE1 TYR A 161 2.944 -12.638 10.978 1.00 0.00 H new ATOM 0 HE2 TYR A 161 3.514 -16.592 9.498 1.00 0.00 H new ATOM 0 HH TYR A 161 2.078 -16.098 11.101 1.00 0.00 H new ATOM 2460 N ALA A 162 7.366 -11.844 5.115 1.00 0.00 N ATOM 2461 CA ALA A 162 8.522 -11.312 4.410 1.00 0.00 C ATOM 2462 C ALA A 162 8.195 -9.963 3.787 1.00 0.00 C ATOM 2463 O ALA A 162 8.982 -9.019 3.866 1.00 0.00 O ATOM 2464 CB ALA A 162 8.985 -12.290 3.341 1.00 0.00 C ATOM 0 H ALA A 162 6.971 -12.688 4.701 1.00 0.00 H new ATOM 0 HA ALA A 162 9.329 -11.172 5.129 1.00 0.00 H new ATOM 0 HB1 ALA A 162 9.851 -11.879 2.822 1.00 0.00 H new ATOM 0 HB2 ALA A 162 9.258 -13.237 3.807 1.00 0.00 H new ATOM 0 HB3 ALA A 162 8.179 -12.457 2.627 1.00 0.00 H new ATOM 2470 N SER A 163 7.013 -9.881 3.190 1.00 0.00 N ATOM 2471 CA SER A 163 6.580 -8.681 2.496 1.00 0.00 C ATOM 2472 C SER A 163 6.446 -7.501 3.454 1.00 0.00 C ATOM 2473 O SER A 163 6.995 -6.434 3.195 1.00 0.00 O ATOM 2474 CB SER A 163 5.252 -8.937 1.784 1.00 0.00 C ATOM 2475 OG SER A 163 4.842 -7.796 1.052 1.00 0.00 O ATOM 0 H SER A 163 6.333 -10.641 3.174 1.00 0.00 H new ATOM 0 HA SER A 163 7.340 -8.427 1.757 1.00 0.00 H new ATOM 0 HB2 SER A 163 5.354 -9.788 1.111 1.00 0.00 H new ATOM 0 HB3 SER A 163 4.487 -9.199 2.515 1.00 0.00 H new ATOM 0 HG SER A 163 3.935 -7.937 0.707 1.00 0.00 H new ATOM 2481 N GLN A 164 5.737 -7.697 4.566 1.00 0.00 N ATOM 2482 CA GLN A 164 5.512 -6.614 5.527 1.00 0.00 C ATOM 2483 C GLN A 164 6.838 -6.073 6.065 1.00 0.00 C ATOM 2484 O GLN A 164 6.976 -4.870 6.292 1.00 0.00 O ATOM 2485 CB GLN A 164 4.581 -7.071 6.670 1.00 0.00 C ATOM 2486 CG GLN A 164 5.115 -8.216 7.525 1.00 0.00 C ATOM 2487 CD GLN A 164 5.979 -7.755 8.681 1.00 0.00 C ATOM 2488 OE1 GLN A 164 5.765 -6.686 9.244 1.00 0.00 O ATOM 2489 NE2 GLN A 164 6.978 -8.551 9.026 1.00 0.00 N ATOM 0 H GLN A 164 5.311 -8.587 4.823 1.00 0.00 H new ATOM 0 HA GLN A 164 5.013 -5.798 5.005 1.00 0.00 H new ATOM 0 HB2 GLN A 164 4.382 -6.217 7.318 1.00 0.00 H new ATOM 0 HB3 GLN A 164 3.626 -7.375 6.240 1.00 0.00 H new ATOM 0 HG2 GLN A 164 4.275 -8.789 7.916 1.00 0.00 H new ATOM 0 HG3 GLN A 164 5.695 -8.890 6.894 1.00 0.00 H new ATOM 0 HE21 GLN A 164 7.122 -9.432 8.533 1.00 0.00 H new ATOM 0 HE22 GLN A 164 7.604 -8.284 9.785 1.00 0.00 H new ATOM 2498 N MET A 165 7.824 -6.950 6.243 1.00 0.00 N ATOM 2499 CA MET A 165 9.134 -6.510 6.698 1.00 0.00 C ATOM 2500 C MET A 165 9.885 -5.791 5.577 1.00 0.00 C ATOM 2501 O MET A 165 10.648 -4.858 5.825 1.00 0.00 O ATOM 2502 CB MET A 165 9.961 -7.687 7.214 1.00 0.00 C ATOM 2503 CG MET A 165 11.303 -7.263 7.787 1.00 0.00 C ATOM 2504 SD MET A 165 12.329 -8.659 8.283 1.00 0.00 S ATOM 2505 CE MET A 165 12.473 -9.514 6.718 1.00 0.00 C ATOM 0 H MET A 165 7.740 -7.954 6.081 1.00 0.00 H new ATOM 0 HA MET A 165 8.981 -5.811 7.520 1.00 0.00 H new ATOM 0 HB2 MET A 165 9.394 -8.213 7.982 1.00 0.00 H new ATOM 0 HB3 MET A 165 10.126 -8.393 6.400 1.00 0.00 H new ATOM 0 HG2 MET A 165 11.838 -6.671 7.044 1.00 0.00 H new ATOM 0 HG3 MET A 165 11.136 -6.617 8.649 1.00 0.00 H new ATOM 0 HE1 MET A 165 13.479 -9.922 6.617 1.00 0.00 H new ATOM 0 HE2 MET A 165 11.747 -10.326 6.679 1.00 0.00 H new ATOM 0 HE3 MET A 165 12.281 -8.816 5.903 1.00 0.00 H new ATOM 2515 N ALA A 166 9.660 -6.231 4.345 1.00 0.00 N ATOM 2516 CA ALA A 166 10.305 -5.633 3.182 1.00 0.00 C ATOM 2517 C ALA A 166 9.765 -4.236 2.914 1.00 0.00 C ATOM 2518 O ALA A 166 10.529 -3.311 2.642 1.00 0.00 O ATOM 2519 CB ALA A 166 10.105 -6.512 1.959 1.00 0.00 C ATOM 0 H ALA A 166 9.032 -7.004 4.125 1.00 0.00 H new ATOM 0 HA ALA A 166 11.371 -5.552 3.393 1.00 0.00 H new ATOM 0 HB1 ALA A 166 10.592 -6.054 1.098 1.00 0.00 H new ATOM 0 HB2 ALA A 166 10.541 -7.494 2.142 1.00 0.00 H new ATOM 0 HB3 ALA A 166 9.039 -6.620 1.759 1.00 0.00 H new ATOM 2525 N GLN A 167 8.448 -4.091 3.004 1.00 0.00 N ATOM 2526 CA GLN A 167 7.782 -2.819 2.741 1.00 0.00 C ATOM 2527 C GLN A 167 8.413 -1.697 3.551 1.00 0.00 C ATOM 2528 O GLN A 167 8.819 -0.672 3.002 1.00 0.00 O ATOM 2529 CB GLN A 167 6.298 -2.929 3.078 1.00 0.00 C ATOM 2530 CG GLN A 167 5.551 -3.927 2.212 1.00 0.00 C ATOM 2531 CD GLN A 167 4.161 -4.210 2.732 1.00 0.00 C ATOM 2532 OE1 GLN A 167 3.541 -3.360 3.362 1.00 0.00 O ATOM 2533 NE2 GLN A 167 3.664 -5.409 2.475 1.00 0.00 N ATOM 0 H GLN A 167 7.814 -4.847 3.260 1.00 0.00 H new ATOM 0 HA GLN A 167 7.897 -2.586 1.682 1.00 0.00 H new ATOM 0 HB2 GLN A 167 6.192 -3.217 4.124 1.00 0.00 H new ATOM 0 HB3 GLN A 167 5.835 -1.948 2.969 1.00 0.00 H new ATOM 0 HG2 GLN A 167 5.484 -3.543 1.194 1.00 0.00 H new ATOM 0 HG3 GLN A 167 6.116 -4.858 2.165 1.00 0.00 H new ATOM 0 HE21 GLN A 167 4.214 -6.087 1.947 1.00 0.00 H new ATOM 0 HE22 GLN A 167 2.731 -5.656 2.805 1.00 0.00 H new ATOM 2542 N ARG A 168 8.512 -1.911 4.854 1.00 0.00 N ATOM 2543 CA ARG A 168 9.130 -0.942 5.745 1.00 0.00 C ATOM 2544 C ARG A 168 10.637 -0.877 5.538 1.00 0.00 C ATOM 2545 O ARG A 168 11.244 0.155 5.786 1.00 0.00 O ATOM 2546 CB ARG A 168 8.780 -1.214 7.210 1.00 0.00 C ATOM 2547 CG ARG A 168 8.975 -2.647 7.661 1.00 0.00 C ATOM 2548 CD ARG A 168 8.317 -2.868 9.012 1.00 0.00 C ATOM 2549 NE ARG A 168 6.930 -2.403 9.000 1.00 0.00 N ATOM 2550 CZ ARG A 168 5.921 -3.034 9.586 1.00 0.00 C ATOM 2551 NH1 ARG A 168 6.136 -4.124 10.313 1.00 0.00 N1+ ATOM 2552 NH2 ARG A 168 4.694 -2.554 9.450 1.00 0.00 N ATOM 0 H ARG A 168 8.170 -2.752 5.319 1.00 0.00 H new ATOM 0 HA ARG A 168 8.720 0.035 5.491 1.00 0.00 H new ATOM 0 HB2 ARG A 168 9.389 -0.565 7.840 1.00 0.00 H new ATOM 0 HB3 ARG A 168 7.740 -0.935 7.377 1.00 0.00 H new ATOM 0 HG2 ARG A 168 8.548 -3.328 6.925 1.00 0.00 H new ATOM 0 HG3 ARG A 168 10.039 -2.874 7.726 1.00 0.00 H new ATOM 0 HD2 ARG A 168 8.347 -3.927 9.267 1.00 0.00 H new ATOM 0 HD3 ARG A 168 8.876 -2.339 9.784 1.00 0.00 H new ATOM 0 HE ARG A 168 6.725 -1.534 8.507 1.00 0.00 H new ATOM 0 HH11 ARG A 168 7.084 -4.484 10.425 1.00 0.00 H new ATOM 0 HH12 ARG A 168 5.353 -4.602 10.759 1.00 0.00 H new ATOM 0 HH21 ARG A 168 4.535 -1.710 8.900 1.00 0.00 H new ATOM 0 HH22 ARG A 168 3.908 -3.029 9.895 1.00 0.00 H new ATOM 2566 N LYS A 169 11.245 -1.970 5.082 1.00 0.00 N ATOM 2567 CA LYS A 169 12.691 -1.983 4.889 1.00 0.00 C ATOM 2568 C LYS A 169 13.068 -1.039 3.750 1.00 0.00 C ATOM 2569 O LYS A 169 14.087 -0.354 3.804 1.00 0.00 O ATOM 2570 CB LYS A 169 13.203 -3.397 4.594 1.00 0.00 C ATOM 2571 CG LYS A 169 14.706 -3.569 4.810 1.00 0.00 C ATOM 2572 CD LYS A 169 15.044 -3.939 6.256 1.00 0.00 C ATOM 2573 CE LYS A 169 14.585 -2.883 7.257 1.00 0.00 C ATOM 2574 NZ LYS A 169 15.371 -1.623 7.161 1.00 0.00 N1+ ATOM 0 H LYS A 169 10.770 -2.841 4.844 1.00 0.00 H new ATOM 0 HA LYS A 169 13.161 -1.645 5.813 1.00 0.00 H new ATOM 0 HB2 LYS A 169 12.671 -4.105 5.229 1.00 0.00 H new ATOM 0 HB3 LYS A 169 12.963 -3.652 3.562 1.00 0.00 H new ATOM 0 HG2 LYS A 169 15.081 -4.344 4.141 1.00 0.00 H new ATOM 0 HG3 LYS A 169 15.218 -2.644 4.544 1.00 0.00 H new ATOM 0 HD2 LYS A 169 14.577 -4.893 6.501 1.00 0.00 H new ATOM 0 HD3 LYS A 169 16.121 -4.078 6.349 1.00 0.00 H new ATOM 0 HE2 LYS A 169 13.531 -2.663 7.089 1.00 0.00 H new ATOM 0 HE3 LYS A 169 14.670 -3.284 8.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 14.955 -0.906 7.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 16.354 -1.805 7.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 15.353 -1.277 6.181 1.00 0.00 H new ATOM 2588 N ILE A 170 12.233 -1.011 2.716 1.00 0.00 N ATOM 2589 CA ILE A 170 12.401 -0.058 1.626 1.00 0.00 C ATOM 2590 C ILE A 170 11.950 1.330 2.087 1.00 0.00 C ATOM 2591 O ILE A 170 12.585 2.338 1.779 1.00 0.00 O ATOM 2592 CB ILE A 170 11.632 -0.490 0.348 1.00 0.00 C ATOM 2593 CG1 ILE A 170 12.377 -1.616 -0.389 1.00 0.00 C ATOM 2594 CG2 ILE A 170 11.432 0.696 -0.587 1.00 0.00 C ATOM 2595 CD1 ILE A 170 12.448 -2.932 0.361 1.00 0.00 C ATOM 0 H ILE A 170 11.434 -1.637 2.611 1.00 0.00 H new ATOM 0 HA ILE A 170 13.458 -0.029 1.362 1.00 0.00 H new ATOM 0 HB ILE A 170 10.656 -0.864 0.658 1.00 0.00 H new ATOM 0 HG12 ILE A 170 11.889 -1.787 -1.349 1.00 0.00 H new ATOM 0 HG13 ILE A 170 13.392 -1.281 -0.603 1.00 0.00 H new ATOM 0 HG21 ILE A 170 10.891 0.371 -1.476 1.00 0.00 H new ATOM 0 HG22 ILE A 170 10.859 1.470 -0.076 1.00 0.00 H new ATOM 0 HG23 ILE A 170 12.403 1.097 -0.879 1.00 0.00 H new ATOM 0 HD11 ILE A 170 12.991 -3.663 -0.238 1.00 0.00 H new ATOM 0 HD12 ILE A 170 12.965 -2.783 1.309 1.00 0.00 H new ATOM 0 HD13 ILE A 170 11.439 -3.297 0.552 1.00 0.00 H new ATOM 2607 N ARG A 171 10.854 1.367 2.850 1.00 0.00 N ATOM 2608 CA ARG A 171 10.400 2.582 3.512 1.00 0.00 C ATOM 2609 C ARG A 171 11.539 3.229 4.325 1.00 0.00 C ATOM 2610 O ARG A 171 11.566 4.447 4.510 1.00 0.00 O ATOM 2611 CB ARG A 171 9.211 2.233 4.421 1.00 0.00 C ATOM 2612 CG ARG A 171 7.843 2.630 3.868 1.00 0.00 C ATOM 2613 CD ARG A 171 7.616 2.212 2.426 1.00 0.00 C ATOM 2614 NE ARG A 171 6.281 2.618 1.988 1.00 0.00 N ATOM 2615 CZ ARG A 171 6.044 3.480 1.002 1.00 0.00 C ATOM 2616 NH1 ARG A 171 7.032 3.897 0.226 1.00 0.00 N1+ ATOM 2617 NH2 ARG A 171 4.810 3.914 0.783 1.00 0.00 N ATOM 0 H ARG A 171 10.261 0.555 3.023 1.00 0.00 H new ATOM 0 HA ARG A 171 10.087 3.307 2.761 1.00 0.00 H new ATOM 0 HB2 ARG A 171 9.215 1.159 4.604 1.00 0.00 H new ATOM 0 HB3 ARG A 171 9.353 2.721 5.385 1.00 0.00 H new ATOM 0 HG2 ARG A 171 7.067 2.185 4.491 1.00 0.00 H new ATOM 0 HG3 ARG A 171 7.731 3.712 3.944 1.00 0.00 H new ATOM 0 HD2 ARG A 171 8.371 2.666 1.785 1.00 0.00 H new ATOM 0 HD3 ARG A 171 7.725 1.132 2.331 1.00 0.00 H new ATOM 0 HE ARG A 171 5.478 2.214 2.470 1.00 0.00 H new ATOM 0 HH11 ARG A 171 7.981 3.558 0.382 1.00 0.00 H new ATOM 0 HH12 ARG A 171 6.844 4.558 -0.528 1.00 0.00 H new ATOM 0 HH21 ARG A 171 4.043 3.587 1.370 1.00 0.00 H new ATOM 0 HH22 ARG A 171 4.628 4.575 0.027 1.00 0.00 H new ATOM 2631 N ASP A 172 12.480 2.403 4.787 1.00 0.00 N ATOM 2632 CA ASP A 172 13.645 2.874 5.546 1.00 0.00 C ATOM 2633 C ASP A 172 14.594 3.679 4.669 1.00 0.00 C ATOM 2634 O ASP A 172 14.909 4.831 4.969 1.00 0.00 O ATOM 2635 CB ASP A 172 14.430 1.694 6.139 1.00 0.00 C ATOM 2636 CG ASP A 172 14.066 1.368 7.574 1.00 0.00 C ATOM 2637 OD1 ASP A 172 14.327 2.206 8.464 1.00 0.00 O ATOM 2638 OD2 ASP A 172 13.582 0.244 7.831 1.00 0.00 O1- ATOM 0 H ASP A 172 12.458 1.393 4.647 1.00 0.00 H new ATOM 0 HA ASP A 172 13.260 3.507 6.345 1.00 0.00 H new ATOM 0 HB2 ASP A 172 14.259 0.811 5.523 1.00 0.00 H new ATOM 0 HB3 ASP A 172 15.496 1.918 6.087 1.00 0.00 H new ATOM 2643 N ILE A 173 15.047 3.071 3.574 1.00 0.00 N ATOM 2644 CA ILE A 173 16.045 3.693 2.711 1.00 0.00 C ATOM 2645 C ILE A 173 15.490 4.937 2.018 1.00 0.00 C ATOM 2646 O ILE A 173 16.248 5.782 1.536 1.00 0.00 O ATOM 2647 CB ILE A 173 16.626 2.696 1.672 1.00 0.00 C ATOM 2648 CG1 ILE A 173 15.534 2.097 0.778 1.00 0.00 C ATOM 2649 CG2 ILE A 173 17.391 1.588 2.380 1.00 0.00 C ATOM 2650 CD1 ILE A 173 15.327 2.853 -0.516 1.00 0.00 C ATOM 0 H ILE A 173 14.738 2.149 3.265 1.00 0.00 H new ATOM 0 HA ILE A 173 16.865 4.003 3.358 1.00 0.00 H new ATOM 0 HB ILE A 173 17.307 3.253 1.028 1.00 0.00 H new ATOM 0 HG12 ILE A 173 15.792 1.063 0.548 1.00 0.00 H new ATOM 0 HG13 ILE A 173 14.595 2.076 1.331 1.00 0.00 H new ATOM 0 HG21 ILE A 173 17.794 0.895 1.642 1.00 0.00 H new ATOM 0 HG22 ILE A 173 18.209 2.021 2.956 1.00 0.00 H new ATOM 0 HG23 ILE A 173 16.719 1.053 3.051 1.00 0.00 H new ATOM 0 HD11 ILE A 173 14.540 2.372 -1.097 1.00 0.00 H new ATOM 0 HD12 ILE A 173 15.038 3.881 -0.295 1.00 0.00 H new ATOM 0 HD13 ILE A 173 16.254 2.852 -1.090 1.00 0.00 H new ATOM 2662 N LEU A 174 14.168 5.044 1.977 1.00 0.00 N ATOM 2663 CA LEU A 174 13.507 6.232 1.452 1.00 0.00 C ATOM 2664 C LEU A 174 13.771 7.442 2.337 1.00 0.00 C ATOM 2665 O LEU A 174 13.881 8.564 1.847 1.00 0.00 O ATOM 2666 CB LEU A 174 12.009 6.005 1.336 1.00 0.00 C ATOM 2667 CG LEU A 174 11.521 5.596 -0.050 1.00 0.00 C ATOM 2668 CD1 LEU A 174 12.244 4.362 -0.555 1.00 0.00 C ATOM 2669 CD2 LEU A 174 10.034 5.349 -0.010 1.00 0.00 C ATOM 0 H LEU A 174 13.530 4.318 2.303 1.00 0.00 H new ATOM 0 HA LEU A 174 13.918 6.426 0.461 1.00 0.00 H new ATOM 0 HB2 LEU A 174 11.718 5.233 2.049 1.00 0.00 H new ATOM 0 HB3 LEU A 174 11.495 6.920 1.630 1.00 0.00 H new ATOM 0 HG LEU A 174 11.739 6.410 -0.741 1.00 0.00 H new ATOM 0 HD11 LEU A 174 11.870 4.101 -1.545 1.00 0.00 H new ATOM 0 HD12 LEU A 174 13.313 4.565 -0.613 1.00 0.00 H new ATOM 0 HD13 LEU A 174 12.069 3.532 0.130 1.00 0.00 H new ATOM 0 HD21 LEU A 174 9.687 5.057 -1.001 1.00 0.00 H new ATOM 0 HD22 LEU A 174 9.817 4.551 0.700 1.00 0.00 H new ATOM 0 HD23 LEU A 174 9.522 6.260 0.300 1.00 0.00 H new ATOM 2681 N ALA A 175 13.880 7.209 3.642 1.00 0.00 N ATOM 2682 CA ALA A 175 14.162 8.283 4.585 1.00 0.00 C ATOM 2683 C ALA A 175 15.548 8.861 4.328 1.00 0.00 C ATOM 2684 O ALA A 175 15.787 10.052 4.526 1.00 0.00 O ATOM 2685 CB ALA A 175 14.045 7.783 6.018 1.00 0.00 C ATOM 0 H ALA A 175 13.777 6.288 4.068 1.00 0.00 H new ATOM 0 HA ALA A 175 13.426 9.074 4.441 1.00 0.00 H new ATOM 0 HB1 ALA A 175 14.259 8.600 6.707 1.00 0.00 H new ATOM 0 HB2 ALA A 175 13.034 7.416 6.194 1.00 0.00 H new ATOM 0 HB3 ALA A 175 14.758 6.975 6.181 1.00 0.00 H new ATOM 2691 N GLN A 176 16.454 8.004 3.867 1.00 0.00 N ATOM 2692 CA GLN A 176 17.800 8.429 3.507 1.00 0.00 C ATOM 2693 C GLN A 176 17.754 9.291 2.249 1.00 0.00 C ATOM 2694 O GLN A 176 18.534 10.229 2.092 1.00 0.00 O ATOM 2695 CB GLN A 176 18.697 7.210 3.283 1.00 0.00 C ATOM 2696 CG GLN A 176 18.706 6.249 4.462 1.00 0.00 C ATOM 2697 CD GLN A 176 19.586 5.034 4.235 1.00 0.00 C ATOM 2698 OE1 GLN A 176 19.722 4.618 2.985 1.00 0.00 O flip ATOM 2699 NE2 GLN A 176 20.138 4.470 5.180 1.00 0.00 N flip ATOM 0 H GLN A 176 16.278 7.008 3.734 1.00 0.00 H new ATOM 0 HA GLN A 176 18.215 9.020 4.324 1.00 0.00 H new ATOM 0 HB2 GLN A 176 18.362 6.679 2.392 1.00 0.00 H new ATOM 0 HB3 GLN A 176 19.715 7.547 3.089 1.00 0.00 H new ATOM 0 HG2 GLN A 176 19.050 6.778 5.351 1.00 0.00 H new ATOM 0 HG3 GLN A 176 17.686 5.919 4.662 1.00 0.00 H new ATOM 0 HE21 GLN A 176 20.009 4.821 6.129 1.00 0.00 H new ATOM 0 HE22 GLN A 176 20.724 3.652 5.014 1.00 0.00 H new ATOM 2708 N VAL A 177 16.815 8.973 1.363 1.00 0.00 N ATOM 2709 CA VAL A 177 16.598 9.758 0.157 1.00 0.00 C ATOM 2710 C VAL A 177 16.090 11.146 0.529 1.00 0.00 C ATOM 2711 O VAL A 177 16.579 12.158 0.029 1.00 0.00 O ATOM 2712 CB VAL A 177 15.578 9.084 -0.789 1.00 0.00 C ATOM 2713 CG1 VAL A 177 15.415 9.887 -2.071 1.00 0.00 C ATOM 2714 CG2 VAL A 177 15.988 7.653 -1.102 1.00 0.00 C ATOM 0 H VAL A 177 16.190 8.173 1.461 1.00 0.00 H new ATOM 0 HA VAL A 177 17.553 9.831 -0.364 1.00 0.00 H new ATOM 0 HB VAL A 177 14.615 9.057 -0.278 1.00 0.00 H new ATOM 0 HG11 VAL A 177 14.692 9.393 -2.720 1.00 0.00 H new ATOM 0 HG12 VAL A 177 15.060 10.889 -1.830 1.00 0.00 H new ATOM 0 HG13 VAL A 177 16.375 9.955 -2.582 1.00 0.00 H new ATOM 0 HG21 VAL A 177 15.254 7.202 -1.769 1.00 0.00 H new ATOM 0 HG22 VAL A 177 16.966 7.652 -1.584 1.00 0.00 H new ATOM 0 HG23 VAL A 177 16.039 7.079 -0.177 1.00 0.00 H new ATOM 2724 N LYS A 178 15.112 11.177 1.430 1.00 0.00 N ATOM 2725 CA LYS A 178 14.535 12.431 1.906 1.00 0.00 C ATOM 2726 C LYS A 178 15.591 13.288 2.590 1.00 0.00 C ATOM 2727 O LYS A 178 15.631 14.504 2.406 1.00 0.00 O ATOM 2728 CB LYS A 178 13.386 12.162 2.883 1.00 0.00 C ATOM 2729 CG LYS A 178 12.241 11.358 2.285 1.00 0.00 C ATOM 2730 CD LYS A 178 11.133 11.121 3.301 1.00 0.00 C ATOM 2731 CE LYS A 178 10.499 12.427 3.755 1.00 0.00 C ATOM 2732 NZ LYS A 178 9.485 12.213 4.820 1.00 0.00 N1+ ATOM 0 H LYS A 178 14.700 10.342 1.847 1.00 0.00 H new ATOM 0 HA LYS A 178 14.149 12.968 1.039 1.00 0.00 H new ATOM 0 HB2 LYS A 178 13.777 11.629 3.750 1.00 0.00 H new ATOM 0 HB3 LYS A 178 12.998 13.115 3.243 1.00 0.00 H new ATOM 0 HG2 LYS A 178 11.837 11.886 1.421 1.00 0.00 H new ATOM 0 HG3 LYS A 178 12.617 10.400 1.926 1.00 0.00 H new ATOM 0 HD2 LYS A 178 10.369 10.478 2.863 1.00 0.00 H new ATOM 0 HD3 LYS A 178 11.538 10.593 4.165 1.00 0.00 H new ATOM 0 HE2 LYS A 178 11.275 13.098 4.123 1.00 0.00 H new ATOM 0 HE3 LYS A 178 10.031 12.918 2.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 9.078 13.128 5.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 8.731 11.593 4.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 9.936 11.768 5.644 1.00 0.00 H new ATOM 2746 N GLN A 179 16.446 12.640 3.376 1.00 0.00 N ATOM 2747 CA GLN A 179 17.506 13.327 4.106 1.00 0.00 C ATOM 2748 C GLN A 179 18.438 14.070 3.149 1.00 0.00 C ATOM 2749 O GLN A 179 18.760 15.241 3.359 1.00 0.00 O ATOM 2750 CB GLN A 179 18.307 12.318 4.938 1.00 0.00 C ATOM 2751 CG GLN A 179 19.399 12.947 5.788 1.00 0.00 C ATOM 2752 CD GLN A 179 18.853 13.917 6.816 1.00 0.00 C ATOM 2753 OE1 GLN A 179 18.709 15.107 6.548 1.00 0.00 O ATOM 2754 NE2 GLN A 179 18.547 13.416 8.000 1.00 0.00 N ATOM 0 H GLN A 179 16.424 11.631 3.524 1.00 0.00 H new ATOM 0 HA GLN A 179 17.045 14.058 4.770 1.00 0.00 H new ATOM 0 HB2 GLN A 179 17.622 11.774 5.589 1.00 0.00 H new ATOM 0 HB3 GLN A 179 18.758 11.587 4.268 1.00 0.00 H new ATOM 0 HG2 GLN A 179 19.956 12.160 6.297 1.00 0.00 H new ATOM 0 HG3 GLN A 179 20.103 13.469 5.140 1.00 0.00 H new ATOM 0 HE21 GLN A 179 18.681 12.422 8.183 1.00 0.00 H new ATOM 0 HE22 GLN A 179 18.177 14.024 8.731 1.00 0.00 H new ATOM 2763 N GLN A 180 18.854 13.387 2.093 1.00 0.00 N ATOM 2764 CA GLN A 180 19.768 13.970 1.123 1.00 0.00 C ATOM 2765 C GLN A 180 19.048 15.012 0.272 1.00 0.00 C ATOM 2766 O GLN A 180 19.618 16.039 -0.094 1.00 0.00 O ATOM 2767 CB GLN A 180 20.354 12.873 0.230 1.00 0.00 C ATOM 2768 CG GLN A 180 21.548 13.332 -0.589 1.00 0.00 C ATOM 2769 CD GLN A 180 22.735 13.688 0.286 1.00 0.00 C ATOM 2770 OE1 GLN A 180 22.879 14.828 0.727 1.00 0.00 O ATOM 2771 NE2 GLN A 180 23.591 12.713 0.542 1.00 0.00 N ATOM 0 H GLN A 180 18.573 12.429 1.886 1.00 0.00 H new ATOM 0 HA GLN A 180 20.580 14.461 1.659 1.00 0.00 H new ATOM 0 HB2 GLN A 180 20.653 12.030 0.853 1.00 0.00 H new ATOM 0 HB3 GLN A 180 19.578 12.512 -0.445 1.00 0.00 H new ATOM 0 HG2 GLN A 180 21.834 12.544 -1.285 1.00 0.00 H new ATOM 0 HG3 GLN A 180 21.266 14.198 -1.187 1.00 0.00 H new ATOM 0 HE21 GLN A 180 23.434 11.782 0.156 1.00 0.00 H new ATOM 0 HE22 GLN A 180 24.408 12.892 1.125 1.00 0.00 H new ATOM 2780 N HIS A 181 17.782 14.747 -0.017 1.00 0.00 N ATOM 2781 CA HIS A 181 17.001 15.601 -0.896 1.00 0.00 C ATOM 2782 C HIS A 181 16.613 16.908 -0.204 1.00 0.00 C ATOM 2783 O HIS A 181 16.879 17.990 -0.722 1.00 0.00 O ATOM 2784 CB HIS A 181 15.751 14.858 -1.373 1.00 0.00 C ATOM 2785 CG HIS A 181 15.010 15.548 -2.479 1.00 0.00 C ATOM 2786 ND1 HIS A 181 15.164 15.216 -3.806 1.00 0.00 N ATOM 2787 CD2 HIS A 181 14.087 16.536 -2.447 1.00 0.00 C ATOM 2788 CE1 HIS A 181 14.364 15.968 -4.539 1.00 0.00 C ATOM 2789 NE2 HIS A 181 13.696 16.778 -3.740 1.00 0.00 N ATOM 0 H HIS A 181 17.273 13.942 0.348 1.00 0.00 H new ATOM 0 HA HIS A 181 17.618 15.854 -1.759 1.00 0.00 H new ATOM 0 HB2 HIS A 181 16.040 13.863 -1.710 1.00 0.00 H new ATOM 0 HB3 HIS A 181 15.077 14.724 -0.527 1.00 0.00 H new ATOM 0 HD2 HIS A 181 13.724 17.042 -1.565 1.00 0.00 H new ATOM 0 HE1 HIS A 181 14.272 15.927 -5.614 1.00 0.00 H new ATOM 0 HE2 HIS A 181 13.005 17.468 -4.034 1.00 0.00 H new ATOM 2798 N GLN A 182 15.994 16.812 0.969 1.00 0.00 N ATOM 2799 CA GLN A 182 15.505 18.000 1.667 1.00 0.00 C ATOM 2800 C GLN A 182 16.650 18.810 2.266 1.00 0.00 C ATOM 2801 O GLN A 182 16.743 20.021 2.039 1.00 0.00 O ATOM 2802 CB GLN A 182 14.507 17.627 2.766 1.00 0.00 C ATOM 2803 CG GLN A 182 13.197 17.054 2.247 1.00 0.00 C ATOM 2804 CD GLN A 182 12.186 16.836 3.357 1.00 0.00 C ATOM 2805 OE1 GLN A 182 12.185 17.549 4.362 1.00 0.00 O ATOM 2806 NE2 GLN A 182 11.315 15.857 3.186 1.00 0.00 N ATOM 0 H GLN A 182 15.819 15.932 1.454 1.00 0.00 H new ATOM 0 HA GLN A 182 14.997 18.616 0.925 1.00 0.00 H new ATOM 0 HB2 GLN A 182 14.971 16.899 3.432 1.00 0.00 H new ATOM 0 HB3 GLN A 182 14.292 18.513 3.363 1.00 0.00 H new ATOM 0 HG2 GLN A 182 12.776 17.730 1.503 1.00 0.00 H new ATOM 0 HG3 GLN A 182 13.391 16.107 1.744 1.00 0.00 H new ATOM 0 HE21 GLN A 182 11.347 15.288 2.340 1.00 0.00 H new ATOM 0 HE22 GLN A 182 10.611 15.671 3.900 1.00 0.00 H new ATOM 2815 N LYS A 183 17.519 18.126 3.020 1.00 0.00 N ATOM 2816 CA LYS A 183 18.653 18.752 3.710 1.00 0.00 C ATOM 2817 C LYS A 183 18.184 19.638 4.866 1.00 0.00 C ATOM 2818 O LYS A 183 18.507 19.380 6.026 1.00 0.00 O ATOM 2819 CB LYS A 183 19.520 19.557 2.730 1.00 0.00 C ATOM 2820 CG LYS A 183 20.246 18.693 1.708 1.00 0.00 C ATOM 2821 CD LYS A 183 20.972 19.537 0.671 1.00 0.00 C ATOM 2822 CE LYS A 183 20.003 20.190 -0.304 1.00 0.00 C ATOM 2823 NZ LYS A 183 19.302 19.186 -1.152 1.00 0.00 N1+ ATOM 0 H LYS A 183 17.455 17.119 3.169 1.00 0.00 H new ATOM 0 HA LYS A 183 19.263 17.951 4.128 1.00 0.00 H new ATOM 0 HB2 LYS A 183 18.889 20.274 2.205 1.00 0.00 H new ATOM 0 HB3 LYS A 183 20.254 20.132 3.295 1.00 0.00 H new ATOM 0 HG2 LYS A 183 20.962 18.049 2.219 1.00 0.00 H new ATOM 0 HG3 LYS A 183 19.530 18.040 1.209 1.00 0.00 H new ATOM 0 HD2 LYS A 183 21.556 20.308 1.174 1.00 0.00 H new ATOM 0 HD3 LYS A 183 21.675 18.912 0.121 1.00 0.00 H new ATOM 0 HE2 LYS A 183 19.268 20.772 0.251 1.00 0.00 H new ATOM 0 HE3 LYS A 183 20.546 20.887 -0.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 19.075 19.609 -2.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 19.918 18.360 -1.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 18.423 18.888 -0.682 1.00 0.00 H new ATOM 2837 N GLY A 184 17.417 20.667 4.550 1.00 0.00 N ATOM 2838 CA GLY A 184 16.927 21.570 5.566 1.00 0.00 C ATOM 2839 C GLY A 184 16.584 22.927 5.000 1.00 0.00 C ATOM 2840 O GLY A 184 15.534 23.101 4.381 1.00 0.00 O ATOM 0 H GLY A 184 17.123 20.894 3.600 1.00 0.00 H new ATOM 0 HA2 GLY A 184 16.043 21.140 6.037 1.00 0.00 H new ATOM 0 HA3 GLY A 184 17.681 21.682 6.345 1.00 0.00 H new ATOM 2844 N GLN A 185 17.478 23.884 5.187 1.00 0.00 N ATOM 2845 CA GLN A 185 17.261 25.240 4.712 1.00 0.00 C ATOM 2846 C GLN A 185 18.500 25.741 3.979 1.00 0.00 C ATOM 2847 O GLN A 185 19.322 26.470 4.537 1.00 0.00 O ATOM 2848 CB GLN A 185 16.921 26.160 5.884 1.00 0.00 C ATOM 2849 CG GLN A 185 16.433 27.535 5.460 1.00 0.00 C ATOM 2850 CD GLN A 185 16.185 28.456 6.638 1.00 0.00 C ATOM 2851 OE1 GLN A 185 15.850 28.006 7.734 1.00 0.00 O ATOM 2852 NE2 GLN A 185 16.335 29.752 6.420 1.00 0.00 N ATOM 0 H GLN A 185 18.367 23.745 5.668 1.00 0.00 H new ATOM 0 HA GLN A 185 16.422 25.243 4.017 1.00 0.00 H new ATOM 0 HB2 GLN A 185 16.155 25.685 6.497 1.00 0.00 H new ATOM 0 HB3 GLN A 185 17.804 26.275 6.512 1.00 0.00 H new ATOM 0 HG2 GLN A 185 17.170 27.989 4.798 1.00 0.00 H new ATOM 0 HG3 GLN A 185 15.512 27.428 4.887 1.00 0.00 H new ATOM 0 HE21 GLN A 185 16.614 30.085 5.497 1.00 0.00 H new ATOM 0 HE22 GLN A 185 16.172 30.418 7.175 1.00 0.00 H new ATOM 2861 N SER A 186 18.640 25.326 2.732 1.00 0.00 N ATOM 2862 CA SER A 186 19.787 25.703 1.928 1.00 0.00 C ATOM 2863 C SER A 186 19.432 26.814 0.944 1.00 0.00 C ATOM 2864 O SER A 186 18.639 26.606 0.022 1.00 0.00 O ATOM 2865 CB SER A 186 20.310 24.487 1.166 1.00 0.00 C ATOM 2866 OG SER A 186 20.644 23.428 2.049 1.00 0.00 O ATOM 0 H SER A 186 17.969 24.725 2.253 1.00 0.00 H new ATOM 0 HA SER A 186 20.561 26.076 2.598 1.00 0.00 H new ATOM 0 HB2 SER A 186 19.555 24.147 0.457 1.00 0.00 H new ATOM 0 HB3 SER A 186 21.188 24.769 0.585 1.00 0.00 H new ATOM 0 HG SER A 186 20.974 22.663 1.533 1.00 0.00 H new ATOM 2872 N GLY A 187 20.010 27.991 1.151 1.00 0.00 N ATOM 2873 CA GLY A 187 19.824 29.081 0.215 1.00 0.00 C ATOM 2874 C GLY A 187 19.197 30.311 0.839 1.00 0.00 C ATOM 2875 O GLY A 187 18.123 30.229 1.434 1.00 0.00 O ATOM 0 H GLY A 187 20.604 28.209 1.951 1.00 0.00 H new ATOM 0 HA2 GLY A 187 20.790 29.352 -0.212 1.00 0.00 H new ATOM 0 HA3 GLY A 187 19.196 28.740 -0.608 1.00 0.00 H new ATOM 2879 N GLN A 188 19.888 31.443 0.702 1.00 0.00 N ATOM 2880 CA GLN A 188 19.391 32.748 1.145 1.00 0.00 C ATOM 2881 C GLN A 188 18.901 32.723 2.591 1.00 0.00 C ATOM 2882 O GLN A 188 17.699 32.806 2.856 1.00 0.00 O ATOM 2883 CB GLN A 188 18.281 33.266 0.220 1.00 0.00 C ATOM 2884 CG GLN A 188 18.743 33.576 -1.201 1.00 0.00 C ATOM 2885 CD GLN A 188 18.825 32.351 -2.093 1.00 0.00 C ATOM 2886 OE1 GLN A 188 19.854 31.677 -2.163 1.00 0.00 O ATOM 2887 NE2 GLN A 188 17.740 32.061 -2.789 1.00 0.00 N ATOM 0 H GLN A 188 20.815 31.482 0.278 1.00 0.00 H new ATOM 0 HA GLN A 188 20.238 33.432 1.095 1.00 0.00 H new ATOM 0 HB2 GLN A 188 17.484 32.524 0.177 1.00 0.00 H new ATOM 0 HB3 GLN A 188 17.853 34.169 0.656 1.00 0.00 H new ATOM 0 HG2 GLN A 188 18.057 34.296 -1.648 1.00 0.00 H new ATOM 0 HG3 GLN A 188 19.723 34.052 -1.160 1.00 0.00 H new ATOM 0 HE21 GLN A 188 16.908 32.644 -2.703 1.00 0.00 H new ATOM 0 HE22 GLN A 188 17.735 31.254 -3.412 1.00 0.00 H new ATOM 2896 N LEU A 189 19.838 32.626 3.522 1.00 0.00 N ATOM 2897 CA LEU A 189 19.512 32.641 4.940 1.00 0.00 C ATOM 2898 C LEU A 189 19.374 34.082 5.416 1.00 0.00 C ATOM 2899 O LEU A 189 20.370 34.761 5.674 1.00 0.00 O ATOM 2900 CB LEU A 189 20.585 31.911 5.766 1.00 0.00 C ATOM 2901 CG LEU A 189 20.607 30.380 5.647 1.00 0.00 C ATOM 2902 CD1 LEU A 189 21.077 29.939 4.267 1.00 0.00 C ATOM 2903 CD2 LEU A 189 21.498 29.784 6.728 1.00 0.00 C ATOM 0 H LEU A 189 20.834 32.536 3.320 1.00 0.00 H new ATOM 0 HA LEU A 189 18.567 32.117 5.082 1.00 0.00 H new ATOM 0 HB2 LEU A 189 21.563 32.292 5.470 1.00 0.00 H new ATOM 0 HB3 LEU A 189 20.445 32.171 6.815 1.00 0.00 H new ATOM 0 HG LEU A 189 19.589 30.015 5.784 1.00 0.00 H new ATOM 0 HD11 LEU A 189 21.081 28.850 4.215 1.00 0.00 H new ATOM 0 HD12 LEU A 189 20.402 30.336 3.509 1.00 0.00 H new ATOM 0 HD13 LEU A 189 22.084 30.315 4.088 1.00 0.00 H new ATOM 0 HD21 LEU A 189 21.507 28.698 6.635 1.00 0.00 H new ATOM 0 HD22 LEU A 189 22.513 30.166 6.615 1.00 0.00 H new ATOM 0 HD23 LEU A 189 21.114 30.061 7.710 1.00 0.00 H new ATOM 2915 N GLN A 190 18.139 34.549 5.507 1.00 0.00 N ATOM 2916 CA GLN A 190 17.866 35.930 5.862 1.00 0.00 C ATOM 2917 C GLN A 190 16.996 36.005 7.114 1.00 0.00 C ATOM 2918 O GLN A 190 17.350 36.666 8.092 1.00 0.00 O ATOM 2919 CB GLN A 190 17.171 36.637 4.693 1.00 0.00 C ATOM 2920 CG GLN A 190 16.925 38.119 4.924 1.00 0.00 C ATOM 2921 CD GLN A 190 18.210 38.908 5.068 1.00 0.00 C ATOM 2922 OE1 GLN A 190 18.737 39.069 6.170 1.00 0.00 O ATOM 2923 NE2 GLN A 190 18.716 39.417 3.959 1.00 0.00 N ATOM 0 H GLN A 190 17.305 33.986 5.338 1.00 0.00 H new ATOM 0 HA GLN A 190 18.812 36.429 6.074 1.00 0.00 H new ATOM 0 HB2 GLN A 190 17.778 36.516 3.796 1.00 0.00 H new ATOM 0 HB3 GLN A 190 16.217 36.147 4.501 1.00 0.00 H new ATOM 0 HG2 GLN A 190 16.347 38.522 4.092 1.00 0.00 H new ATOM 0 HG3 GLN A 190 16.322 38.247 5.823 1.00 0.00 H new ATOM 0 HE21 GLN A 190 18.248 39.260 3.066 1.00 0.00 H new ATOM 0 HE22 GLN A 190 19.574 39.967 3.996 1.00 0.00 H new ATOM 2932 N ALA A 191 15.866 35.309 7.078 1.00 0.00 N ATOM 2933 CA ALA A 191 14.917 35.312 8.185 1.00 0.00 C ATOM 2934 C ALA A 191 13.926 34.167 8.036 1.00 0.00 C ATOM 2935 O ALA A 191 13.537 33.830 6.915 1.00 0.00 O ATOM 2936 CB ALA A 191 14.182 36.645 8.251 1.00 0.00 C ATOM 0 H ALA A 191 15.583 34.731 6.287 1.00 0.00 H new ATOM 0 HA ALA A 191 15.469 35.174 9.115 1.00 0.00 H new ATOM 0 HB1 ALA A 191 13.477 36.631 9.082 1.00 0.00 H new ATOM 0 HB2 ALA A 191 14.902 37.450 8.399 1.00 0.00 H new ATOM 0 HB3 ALA A 191 13.641 36.808 7.319 1.00 0.00 H new TER 2942 ALA A 191 ATOM 2943 P G B 1 -25.754 -19.342 -6.829 1.00 0.00 P ATOM 2944 OP1 G B 1 -26.266 -20.315 -5.831 1.00 0.00 O ATOM 2945 OP2 G B 1 -24.528 -19.668 -7.603 1.00 0.00 O ATOM 2946 O5' G B 1 -25.514 -17.951 -6.089 1.00 0.00 O ATOM 2947 C5' G B 1 -25.264 -17.880 -4.684 1.00 0.00 C ATOM 2948 C4' G B 1 -23.778 -17.813 -4.404 1.00 0.00 C ATOM 2949 O4' G B 1 -23.070 -18.203 -5.607 1.00 0.00 O ATOM 2950 C3' G B 1 -23.256 -16.436 -4.009 1.00 0.00 C ATOM 2951 O3' G B 1 -22.512 -16.495 -2.794 1.00 0.00 O ATOM 2952 C2' G B 1 -22.367 -15.963 -5.156 1.00 0.00 C ATOM 2953 O2' G B 1 -21.072 -15.625 -4.715 1.00 0.00 O ATOM 2954 C1' G B 1 -22.246 -17.162 -6.089 1.00 0.00 C ATOM 2955 N9 G B 1 -22.658 -16.823 -7.446 1.00 0.00 N ATOM 2956 C8 G B 1 -23.944 -16.700 -7.876 1.00 0.00 C ATOM 2957 N7 G B 1 -24.046 -16.261 -9.101 1.00 0.00 N ATOM 2958 C5 G B 1 -22.728 -16.078 -9.500 1.00 0.00 C ATOM 2959 C6 G B 1 -22.196 -15.618 -10.731 1.00 0.00 C ATOM 2960 O6 G B 1 -22.809 -15.270 -11.749 1.00 0.00 O ATOM 2961 N1 G B 1 -20.805 -15.583 -10.716 1.00 0.00 N ATOM 2962 C2 G B 1 -20.029 -15.953 -9.643 1.00 0.00 C ATOM 2963 N2 G B 1 -18.702 -15.860 -9.813 1.00 0.00 N ATOM 2964 N3 G B 1 -20.510 -16.382 -8.488 1.00 0.00 N ATOM 2965 C4 G B 1 -21.858 -16.423 -8.487 1.00 0.00 C ATOM 0 H5' G B 1 -25.693 -18.752 -4.190 1.00 0.00 H new ATOM 0 H5'' G B 1 -25.757 -17.002 -4.266 1.00 0.00 H new ATOM 0 H4' G B 1 -23.609 -18.475 -3.555 1.00 0.00 H new ATOM 0 H3' G B 1 -24.083 -15.747 -3.837 1.00 0.00 H new ATOM 0 H2' G B 1 -22.797 -15.077 -5.624 1.00 0.00 H new ATOM 0 HO2' G B 1 -21.060 -14.690 -4.422 1.00 0.00 H new ATOM 0 H1' G B 1 -21.202 -17.474 -6.114 1.00 0.00 H new ATOM 0 H8 G B 1 -24.799 -16.943 -7.262 1.00 0.00 H new ATOM 0 H1 G B 1 -20.329 -15.261 -11.558 1.00 0.00 H new ATOM 0 H21 G B 1 -18.071 -16.120 -9.055 1.00 0.00 H new ATOM 0 H22 G B 1 -18.324 -15.530 -10.701 1.00 0.00 H new ATOM 2977 P C B 2 -22.338 -15.180 -1.880 1.00 0.00 P ATOM 2978 OP1 C B 2 -21.941 -15.618 -0.516 1.00 0.00 O ATOM 2979 OP2 C B 2 -23.551 -14.339 -2.050 1.00 0.00 O ATOM 2980 O5' C B 2 -21.108 -14.397 -2.526 1.00 0.00 O ATOM 2981 C5' C B 2 -19.760 -14.762 -2.227 1.00 0.00 C ATOM 2982 C4' C B 2 -18.788 -13.882 -2.981 1.00 0.00 C ATOM 2983 O4' C B 2 -19.006 -14.028 -4.411 1.00 0.00 O ATOM 2984 C3' C B 2 -18.922 -12.386 -2.740 1.00 0.00 C ATOM 2985 O3' C B 2 -18.226 -11.982 -1.568 1.00 0.00 O ATOM 2986 C2' C B 2 -18.297 -11.807 -4.002 1.00 0.00 C ATOM 2987 O2' C B 2 -16.887 -11.894 -3.990 1.00 0.00 O ATOM 2988 C1' C B 2 -18.850 -12.771 -5.050 1.00 0.00 C ATOM 2989 N1 C B 2 -20.146 -12.341 -5.600 1.00 0.00 N ATOM 2990 C2 C B 2 -20.217 -11.121 -6.283 1.00 0.00 C ATOM 2991 O2 C B 2 -19.176 -10.480 -6.480 1.00 0.00 O ATOM 2992 N3 C B 2 -21.415 -10.679 -6.726 1.00 0.00 N ATOM 2993 C4 C B 2 -22.513 -11.406 -6.513 1.00 0.00 C ATOM 2994 N4 C B 2 -23.675 -10.922 -6.947 1.00 0.00 N ATOM 2995 C5 C B 2 -22.470 -12.656 -5.832 1.00 0.00 C ATOM 2996 C6 C B 2 -21.276 -13.082 -5.400 1.00 0.00 C ATOM 0 H5' C B 2 -19.594 -15.806 -2.492 1.00 0.00 H new ATOM 0 H5'' C B 2 -19.583 -14.673 -1.155 1.00 0.00 H new ATOM 0 H4' C B 2 -17.815 -14.215 -2.620 1.00 0.00 H new ATOM 0 H3' C B 2 -19.947 -12.055 -2.571 1.00 0.00 H new ATOM 0 H2' C B 2 -18.519 -10.750 -4.151 1.00 0.00 H new ATOM 0 HO2' C B 2 -16.508 -11.027 -3.735 1.00 0.00 H new ATOM 0 H1' C B 2 -18.158 -12.812 -5.891 1.00 0.00 H new ATOM 0 H41 C B 2 -24.534 -11.452 -6.801 1.00 0.00 H new ATOM 0 H42 C B 2 -23.706 -10.022 -7.425 1.00 0.00 H new ATOM 0 H5 C B 2 -23.365 -13.238 -5.670 1.00 0.00 H new ATOM 0 H6 C B 2 -21.205 -14.028 -4.884 1.00 0.00 H new ATOM 3008 P A B 3 -18.904 -10.927 -0.565 1.00 0.00 P ATOM 3009 OP1 A B 3 -18.025 -10.829 0.629 1.00 0.00 O ATOM 3010 OP2 A B 3 -20.333 -11.293 -0.389 1.00 0.00 O ATOM 3011 O5' A B 3 -18.842 -9.539 -1.346 1.00 0.00 O ATOM 3012 C5' A B 3 -18.011 -8.482 -0.877 1.00 0.00 C ATOM 3013 C4' A B 3 -18.252 -7.210 -1.663 1.00 0.00 C ATOM 3014 O4' A B 3 -17.591 -7.204 -2.963 1.00 0.00 O ATOM 3015 C3' A B 3 -19.714 -6.907 -1.959 1.00 0.00 C ATOM 3016 O3' A B 3 -20.087 -5.598 -1.536 1.00 0.00 O ATOM 3017 C2' A B 3 -19.840 -7.115 -3.464 1.00 0.00 C ATOM 3018 O2' A B 3 -20.853 -6.322 -4.053 1.00 0.00 O ATOM 3019 C1' A B 3 -18.473 -6.640 -3.915 1.00 0.00 C ATOM 3020 N9 A B 3 -18.113 -7.079 -5.253 1.00 0.00 N ATOM 3021 C8 A B 3 -17.672 -8.296 -5.659 1.00 0.00 C ATOM 3022 N7 A B 3 -17.490 -8.375 -6.961 1.00 0.00 N ATOM 3023 C5 A B 3 -17.842 -7.111 -7.424 1.00 0.00 C ATOM 3024 C6 A B 3 -17.877 -6.522 -8.703 1.00 0.00 C ATOM 3025 N6 A B 3 -17.550 -7.167 -9.824 1.00 0.00 N ATOM 3026 N1 A B 3 -18.278 -5.230 -8.790 1.00 0.00 N ATOM 3027 C2 A B 3 -18.621 -4.581 -7.663 1.00 0.00 C ATOM 3028 N3 A B 3 -18.632 -5.028 -6.421 1.00 0.00 N ATOM 3029 C4 A B 3 -18.229 -6.307 -6.373 1.00 0.00 C ATOM 0 H5' A B 3 -16.964 -8.773 -0.962 1.00 0.00 H new ATOM 0 H5'' A B 3 -18.207 -8.303 0.180 1.00 0.00 H new ATOM 0 H4' A B 3 -17.840 -6.456 -0.992 1.00 0.00 H new ATOM 0 H3' A B 3 -20.398 -7.554 -1.409 1.00 0.00 H new ATOM 0 H2' A B 3 -20.111 -8.134 -3.740 1.00 0.00 H new ATOM 0 HO2' A B 3 -21.020 -5.535 -3.493 1.00 0.00 H new ATOM 0 H1' A B 3 -18.440 -5.552 -3.968 1.00 0.00 H new ATOM 0 H8 A B 3 -17.489 -9.118 -4.982 1.00 0.00 H new ATOM 0 H61 A B 3 -17.596 -6.685 -10.722 1.00 0.00 H new ATOM 0 H62 A B 3 -17.254 -8.142 -9.783 1.00 0.00 H new ATOM 0 H2 A B 3 -18.930 -3.554 -7.792 1.00 0.00 H new ATOM 3041 P C B 4 -20.007 -5.141 0.004 1.00 0.00 P ATOM 3042 OP1 C B 4 -19.275 -6.184 0.767 1.00 0.00 O ATOM 3043 OP2 C B 4 -21.372 -4.741 0.423 1.00 0.00 O ATOM 3044 O5' C B 4 -19.091 -3.837 -0.033 1.00 0.00 O ATOM 3045 C5' C B 4 -19.473 -2.630 0.630 1.00 0.00 C ATOM 3046 C4' C B 4 -19.913 -1.600 -0.381 1.00 0.00 C ATOM 3047 O4' C B 4 -18.864 -1.313 -1.337 1.00 0.00 O ATOM 3048 C3' C B 4 -21.147 -1.967 -1.182 1.00 0.00 C ATOM 3049 O3' C B 4 -22.131 -0.933 -1.114 1.00 0.00 O ATOM 3050 C2' C B 4 -20.637 -2.311 -2.580 1.00 0.00 C ATOM 3051 O2' C B 4 -21.464 -1.780 -3.594 1.00 0.00 O ATOM 3052 C1' C B 4 -19.257 -1.655 -2.647 1.00 0.00 C ATOM 3053 N1 C B 4 -18.198 -2.530 -3.153 1.00 0.00 N ATOM 3054 C2 C B 4 -17.429 -2.117 -4.242 1.00 0.00 C ATOM 3055 O2 C B 4 -17.685 -1.037 -4.796 1.00 0.00 O ATOM 3056 N3 C B 4 -16.405 -2.895 -4.650 1.00 0.00 N ATOM 3057 C4 C B 4 -16.144 -4.041 -4.018 1.00 0.00 C ATOM 3058 N4 C B 4 -15.057 -4.706 -4.394 1.00 0.00 N ATOM 3059 C5 C B 4 -16.931 -4.493 -2.913 1.00 0.00 C ATOM 3060 C6 C B 4 -17.928 -3.708 -2.518 1.00 0.00 C ATOM 0 H5' C B 4 -18.636 -2.245 1.212 1.00 0.00 H new ATOM 0 H5'' C B 4 -20.283 -2.832 1.331 1.00 0.00 H new ATOM 0 H4' C B 4 -20.154 -0.735 0.237 1.00 0.00 H new ATOM 0 H3' C B 4 -21.682 -2.830 -0.786 1.00 0.00 H new ATOM 0 H2' C B 4 -20.619 -3.389 -2.741 1.00 0.00 H new ATOM 0 HO2' C B 4 -21.323 -0.812 -3.658 1.00 0.00 H new ATOM 0 H1' C B 4 -19.365 -0.808 -3.325 1.00 0.00 H new ATOM 0 H41 C B 4 -14.816 -5.587 -3.940 1.00 0.00 H new ATOM 0 H42 C B 4 -14.464 -4.335 -5.136 1.00 0.00 H new ATOM 0 H5 C B 4 -16.724 -5.432 -2.421 1.00 0.00 H new ATOM 0 H6 C B 4 -18.537 -4.008 -1.678 1.00 0.00 H new ATOM 3072 P A B 5 -21.758 0.612 -1.388 1.00 0.00 P ATOM 3073 OP1 A B 5 -22.981 1.427 -1.172 1.00 0.00 O ATOM 3074 OP2 A B 5 -21.068 0.685 -2.699 1.00 0.00 O ATOM 3075 O5' A B 5 -20.702 1.005 -0.258 1.00 0.00 O ATOM 3076 C5' A B 5 -21.106 1.434 1.046 1.00 0.00 C ATOM 3077 C4' A B 5 -20.104 0.966 2.079 1.00 0.00 C ATOM 3078 O4' A B 5 -19.262 -0.033 1.451 1.00 0.00 O ATOM 3079 C3' A B 5 -19.123 2.011 2.601 1.00 0.00 C ATOM 3080 O3' A B 5 -19.631 2.693 3.745 1.00 0.00 O ATOM 3081 C2' A B 5 -17.897 1.178 2.955 1.00 0.00 C ATOM 3082 O2' A B 5 -18.027 0.544 4.213 1.00 0.00 O ATOM 3083 C1' A B 5 -17.917 0.125 1.849 1.00 0.00 C ATOM 3084 N9 A B 5 -17.097 0.519 0.705 1.00 0.00 N ATOM 3085 C8 A B 5 -17.478 0.699 -0.602 1.00 0.00 C ATOM 3086 N7 A B 5 -16.510 1.111 -1.384 1.00 0.00 N ATOM 3087 C5 A B 5 -15.415 1.205 -0.536 1.00 0.00 C ATOM 3088 C6 A B 5 -14.080 1.589 -0.750 1.00 0.00 C ATOM 3089 N6 A B 5 -13.597 1.965 -1.936 1.00 0.00 N ATOM 3090 N1 A B 5 -13.244 1.574 0.312 1.00 0.00 N ATOM 3091 C2 A B 5 -13.726 1.198 1.501 1.00 0.00 C ATOM 3092 N3 A B 5 -14.957 0.816 1.827 1.00 0.00 N ATOM 3093 C4 A B 5 -15.762 0.842 0.750 1.00 0.00 C ATOM 0 H5' A B 5 -22.094 1.036 1.279 1.00 0.00 H new ATOM 0 H5'' A B 5 -21.186 2.521 1.072 1.00 0.00 H new ATOM 0 H4' A B 5 -20.714 0.635 2.919 1.00 0.00 H new ATOM 0 H3' A B 5 -18.919 2.799 1.876 1.00 0.00 H new ATOM 0 H2' A B 5 -16.985 1.771 3.022 1.00 0.00 H new ATOM 0 HO2' A B 5 -18.687 1.025 4.755 1.00 0.00 H new ATOM 0 H1' A B 5 -17.499 -0.809 2.224 1.00 0.00 H new ATOM 0 H8 A B 5 -18.483 0.518 -0.953 1.00 0.00 H new ATOM 0 H61 A B 5 -12.617 2.233 -2.026 1.00 0.00 H new ATOM 0 H62 A B 5 -14.208 1.985 -2.752 1.00 0.00 H new ATOM 0 H2 A B 5 -13.014 1.206 2.313 1.00 0.00 H new ATOM 3105 P C B 6 -18.728 3.777 4.526 1.00 0.00 P ATOM 3106 OP1 C B 6 -18.778 3.455 5.977 1.00 0.00 O ATOM 3107 OP2 C B 6 -19.157 5.121 4.064 1.00 0.00 O ATOM 3108 O5' C B 6 -17.239 3.538 4.009 1.00 0.00 O ATOM 3109 C5' C B 6 -16.181 3.189 4.905 1.00 0.00 C ATOM 3110 C4' C B 6 -14.919 3.941 4.546 1.00 0.00 C ATOM 3111 O4' C B 6 -14.420 3.431 3.283 1.00 0.00 O ATOM 3112 C3' C B 6 -15.100 5.442 4.351 1.00 0.00 C ATOM 3113 O3' C B 6 -14.731 6.151 5.529 1.00 0.00 O ATOM 3114 C2' C B 6 -14.185 5.805 3.184 1.00 0.00 C ATOM 3115 O2' C B 6 -12.908 6.216 3.629 1.00 0.00 O ATOM 3116 C1' C B 6 -14.055 4.488 2.419 1.00 0.00 C ATOM 3117 N1 C B 6 -14.904 4.420 1.222 1.00 0.00 N ATOM 3118 C2 C B 6 -14.402 4.891 0.004 1.00 0.00 C ATOM 3119 O2 C B 6 -13.263 5.383 -0.030 1.00 0.00 O ATOM 3120 N3 C B 6 -15.173 4.800 -1.105 1.00 0.00 N ATOM 3121 C4 C B 6 -16.396 4.268 -1.025 1.00 0.00 C ATOM 3122 N4 C B 6 -17.126 4.206 -2.141 1.00 0.00 N ATOM 3123 C5 C B 6 -16.930 3.781 0.203 1.00 0.00 C ATOM 3124 C6 C B 6 -16.159 3.884 1.291 1.00 0.00 C ATOM 0 H5' C B 6 -15.998 2.115 4.861 1.00 0.00 H new ATOM 0 H5'' C B 6 -16.472 3.421 5.930 1.00 0.00 H new ATOM 0 H4' C B 6 -14.244 3.791 5.389 1.00 0.00 H new ATOM 0 H3' C B 6 -16.138 5.706 4.148 1.00 0.00 H new ATOM 0 H2' C B 6 -14.582 6.630 2.593 1.00 0.00 H new ATOM 0 HO2' C B 6 -12.946 6.422 4.586 1.00 0.00 H new ATOM 0 H1' C B 6 -13.020 4.412 2.085 1.00 0.00 H new ATOM 0 H41 C B 6 -18.064 3.806 -2.115 1.00 0.00 H new ATOM 0 H42 C B 6 -16.746 4.559 -3.019 1.00 0.00 H new ATOM 0 H5 C B 6 -17.917 3.346 0.253 1.00 0.00 H new ATOM 0 H6 C B 6 -16.535 3.537 2.242 1.00 0.00 H new ATOM 3136 P C B 7 -15.839 6.953 6.378 1.00 0.00 P ATOM 3137 OP1 C B 7 -15.904 6.361 7.739 1.00 0.00 O ATOM 3138 OP2 C B 7 -17.074 7.029 5.557 1.00 0.00 O ATOM 3139 O5' C B 7 -15.244 8.426 6.499 1.00 0.00 O ATOM 3140 C5' C B 7 -13.857 8.641 6.755 1.00 0.00 C ATOM 3141 C4' C B 7 -13.488 10.078 6.463 1.00 0.00 C ATOM 3142 O4' C B 7 -13.637 10.320 5.038 1.00 0.00 O ATOM 3143 C3' C B 7 -14.355 11.135 7.137 1.00 0.00 C ATOM 3144 O3' C B 7 -13.610 12.322 7.389 1.00 0.00 O ATOM 3145 C2' C B 7 -15.468 11.373 6.123 1.00 0.00 C ATOM 3146 O2' C B 7 -15.982 12.686 6.202 1.00 0.00 O ATOM 3147 C1' C B 7 -14.713 11.209 4.803 1.00 0.00 C ATOM 3148 N1 C B 7 -15.547 10.665 3.719 1.00 0.00 N ATOM 3149 C2 C B 7 -16.253 11.550 2.894 1.00 0.00 C ATOM 3150 O2 C B 7 -16.163 12.771 3.098 1.00 0.00 O ATOM 3151 N3 C B 7 -17.025 11.052 1.903 1.00 0.00 N ATOM 3152 C4 C B 7 -17.112 9.732 1.724 1.00 0.00 C ATOM 3153 N4 C B 7 -17.886 9.288 0.732 1.00 0.00 N ATOM 3154 C5 C B 7 -16.406 8.809 2.548 1.00 0.00 C ATOM 3155 C6 C B 7 -15.643 9.315 3.523 1.00 0.00 C ATOM 0 H5' C B 7 -13.258 7.972 6.138 1.00 0.00 H new ATOM 0 H5'' C B 7 -13.631 8.404 7.795 1.00 0.00 H new ATOM 0 H4' C B 7 -12.472 10.178 6.846 1.00 0.00 H new ATOM 0 H3' C B 7 -14.734 10.825 8.111 1.00 0.00 H new ATOM 0 H2' C B 7 -16.322 10.711 6.264 1.00 0.00 H new ATOM 0 HO2' C B 7 -16.172 13.018 5.300 1.00 0.00 H new ATOM 0 H1' C B 7 -14.381 12.195 4.479 1.00 0.00 H new ATOM 0 H41 C B 7 -17.977 8.286 0.565 1.00 0.00 H new ATOM 0 H42 C B 7 -18.387 9.951 0.140 1.00 0.00 H new ATOM 0 H5 C B 7 -16.484 7.743 2.392 1.00 0.00 H new ATOM 0 H6 C B 7 -15.093 8.645 4.167 1.00 0.00 H new ATOM 3167 P C B 8 -14.112 13.378 8.494 1.00 0.00 P ATOM 3168 OP1 C B 8 -14.699 14.530 7.764 1.00 0.00 O ATOM 3169 OP2 C B 8 -13.000 13.607 9.451 1.00 0.00 O ATOM 3170 O5' C B 8 -15.294 12.627 9.259 1.00 0.00 O ATOM 3171 C5' C B 8 -15.249 12.416 10.670 1.00 0.00 C ATOM 3172 C4' C B 8 -16.637 12.488 11.269 1.00 0.00 C ATOM 3173 O4' C B 8 -17.603 12.030 10.281 1.00 0.00 O ATOM 3174 C3' C B 8 -16.860 11.598 12.489 1.00 0.00 C ATOM 3175 O3' C B 8 -17.788 12.180 13.408 1.00 0.00 O ATOM 3176 C2' C B 8 -17.419 10.319 11.878 1.00 0.00 C ATOM 3177 O2' C B 8 -18.212 9.593 12.797 1.00 0.00 O ATOM 3178 C1' C B 8 -18.310 10.918 10.793 1.00 0.00 C ATOM 3179 N1 C B 8 -18.616 9.993 9.690 1.00 0.00 N ATOM 3180 C2 C B 8 -19.695 9.111 9.825 1.00 0.00 C ATOM 3181 O2 C B 8 -20.362 9.126 10.871 1.00 0.00 O ATOM 3182 N3 C B 8 -19.986 8.261 8.813 1.00 0.00 N ATOM 3183 C4 C B 8 -19.248 8.273 7.701 1.00 0.00 C ATOM 3184 N4 C B 8 -19.569 7.420 6.725 1.00 0.00 N ATOM 3185 C5 C B 8 -18.146 9.160 7.537 1.00 0.00 C ATOM 3186 C6 C B 8 -17.869 9.995 8.545 1.00 0.00 C ATOM 0 H5' C B 8 -14.608 13.166 11.134 1.00 0.00 H new ATOM 0 H5'' C B 8 -14.806 11.443 10.883 1.00 0.00 H new ATOM 0 H4' C B 8 -16.755 13.528 11.572 1.00 0.00 H new ATOM 0 H3' C B 8 -15.952 11.441 13.071 1.00 0.00 H new ATOM 0 H2' C B 8 -16.657 9.615 11.545 1.00 0.00 H new ATOM 0 HO2' C B 8 -19.028 9.283 12.351 1.00 0.00 H new ATOM 0 HO3' C B 8 -18.462 11.514 13.658 1.00 0.00 H new ATOM 0 H1' C B 8 -19.273 11.176 11.234 1.00 0.00 H new ATOM 0 H41 C B 8 -19.025 7.404 5.862 1.00 0.00 H new ATOM 0 H42 C B 8 -20.358 6.785 6.842 1.00 0.00 H new ATOM 0 H5 C B 8 -17.556 9.159 6.633 1.00 0.00 H new ATOM 0 H6 C B 8 -17.041 10.682 8.453 1.00 0.00 H new TER 3199 C B 8