USER MOD reduce.3.24.130724 H: found=0, std=0, add=1099, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1093 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 67 GLN : amide:sc= 0.776 K(o=2.8,f=-5!) USER MOD Set 1.2: A 120 THR OG1 : rot 101:sc= 2.02 USER MOD Set 2.1: A 21 SER OG : rot 180:sc= 0.003 USER MOD Set 2.2: A 68 LYS NZ :NH3+ -172:sc= 1.7 (180deg=1.61) USER MOD Single : A 1 GLY N :NH3+ 138:sc= 0.0623 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0388 USER MOD Single : A 6 SER OG : rot 180:sc= 0.264 USER MOD Single : A 9 SER OG : rot 25:sc= 0.296 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 85:sc= 0.494 USER MOD Single : A 15 MET CE :methyl -151:sc= -2.97 (180deg=-7.81!) USER MOD Single : A 20 THR OG1 : rot -160:sc= -0.311 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 CYS SG : rot -33:sc= -1.54 USER MOD Single : A 41 SER OG : rot -39:sc= 0.0343 USER MOD Single : A 42 SER OG : rot 87:sc= 1.29 USER MOD Single : A 43 HIS : no HD1:sc= -0.0279 X(o=-0.028,f=-0.21) USER MOD Single : A 45 SER OG : rot 180:sc= -0.115 USER MOD Single : A 48 LYS NZ :NH3+ -162:sc= 1.2 (180deg=0.628) USER MOD Single : A 51 SER OG : rot -28:sc= -0.0978 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -0.319 K(o=-0.32,f=-6.5!) USER MOD Single : A 61 LYS NZ :NH3+ 165:sc=-0.00143 (180deg=-0.121) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 163:sc= 0.937 (180deg=0.772) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 TYR OH : rot 100:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -162:sc= -0.0611 (180deg=-0.38) USER MOD Single : A 80 SER OG : rot -62:sc= -0.065 USER MOD Single : A 82 SER OG : rot 15:sc= 0.0277 USER MOD Single : A 88 MET CE :methyl -179:sc= -0.597 (180deg=-0.601) USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 91 ASN :FLIP amide:sc= -0.247 F(o=-0.95,f=-0.25) USER MOD Single : A 92 SER OG : rot -93:sc= 0.897 USER MOD Single : A 97 ASN : amide:sc=-0.00465 X(o=-0.0047,f=-0.0047) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS :FLIP no HD1:sc= -0.0903 F(o=-0.65,f=-0.09) USER MOD Single : A 109 LYS NZ :NH3+ 173:sc= 0.622 (180deg=0.207) USER MOD Single : A 114 ASN : amide:sc= -0.267 K(o=-0.27,f=-6.5!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 HIS : no HD1:sc= -0.145 X(o=-0.15,f=-0.035) USER MOD Single : A 124 THR OG1 : rot 73:sc= 1.26 USER MOD Single : A 126 SER OG : rot -33:sc= 0.422 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 135 SER OG : rot 180:sc= 0.0616 USER MOD Single : A 138 SER OG : rot 180:sc= 0.145 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.354 26.828 14.077 1.00 0.00 N ATOM 2 CA GLY A 1 23.965 26.497 12.705 1.00 0.00 C ATOM 3 C GLY A 1 24.648 25.232 12.223 1.00 0.00 C ATOM 4 O GLY A 1 25.720 24.866 12.714 1.00 0.00 O ATOM 0 H1 GLY A 1 24.518 27.852 14.154 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.594 26.549 14.730 1.00 0.00 H new ATOM 0 H3 GLY A 1 25.227 26.318 14.323 1.00 0.00 H new ATOM 0 HA2 GLY A 1 22.884 26.370 12.653 1.00 0.00 H new ATOM 0 HA3 GLY A 1 24.221 27.325 12.043 1.00 0.00 H new ATOM 8 N SER A 2 24.026 24.557 11.260 1.00 0.00 N ATOM 9 CA SER A 2 24.521 23.331 10.653 1.00 0.00 C ATOM 10 C SER A 2 23.977 23.221 9.229 1.00 0.00 C ATOM 11 O SER A 2 23.114 24.008 8.837 1.00 0.00 O ATOM 12 CB SER A 2 24.087 22.131 11.509 1.00 0.00 C ATOM 13 OG SER A 2 22.729 22.202 11.912 1.00 0.00 O ATOM 0 H SER A 2 23.134 24.861 10.870 1.00 0.00 H new ATOM 0 HA SER A 2 25.610 23.342 10.606 1.00 0.00 H new ATOM 0 HB2 SER A 2 24.245 21.212 10.944 1.00 0.00 H new ATOM 0 HB3 SER A 2 24.721 22.074 12.394 1.00 0.00 H new ATOM 0 HG SER A 2 22.506 21.415 12.451 1.00 0.00 H new ATOM 19 N SER A 3 24.453 22.237 8.476 1.00 0.00 N ATOM 20 CA SER A 3 23.855 21.769 7.238 1.00 0.00 C ATOM 21 C SER A 3 23.893 20.244 7.278 1.00 0.00 C ATOM 22 O SER A 3 24.667 19.675 8.055 1.00 0.00 O ATOM 23 CB SER A 3 24.611 22.355 6.037 1.00 0.00 C ATOM 24 OG SER A 3 26.026 22.270 6.177 1.00 0.00 O ATOM 0 H SER A 3 25.300 21.725 8.723 1.00 0.00 H new ATOM 0 HA SER A 3 22.821 22.098 7.131 1.00 0.00 H new ATOM 0 HB2 SER A 3 24.308 21.829 5.132 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.326 23.399 5.909 1.00 0.00 H new ATOM 0 HG SER A 3 26.457 22.655 5.385 1.00 0.00 H new ATOM 30 N GLY A 4 23.099 19.583 6.446 1.00 0.00 N ATOM 31 CA GLY A 4 22.980 18.140 6.463 1.00 0.00 C ATOM 32 C GLY A 4 21.778 17.698 5.648 1.00 0.00 C ATOM 33 O GLY A 4 21.231 18.463 4.853 1.00 0.00 O ATOM 0 H GLY A 4 22.520 20.038 5.740 1.00 0.00 H new ATOM 0 HA2 GLY A 4 23.887 17.689 6.059 1.00 0.00 H new ATOM 0 HA3 GLY A 4 22.880 17.789 7.490 1.00 0.00 H new ATOM 37 N SER A 5 21.403 16.441 5.814 1.00 0.00 N ATOM 38 CA SER A 5 20.192 15.836 5.288 1.00 0.00 C ATOM 39 C SER A 5 19.724 14.832 6.351 1.00 0.00 C ATOM 40 O SER A 5 20.266 14.793 7.460 1.00 0.00 O ATOM 41 CB SER A 5 20.517 15.238 3.909 1.00 0.00 C ATOM 42 OG SER A 5 19.415 14.587 3.307 1.00 0.00 O ATOM 0 H SER A 5 21.966 15.780 6.349 1.00 0.00 H new ATOM 0 HA SER A 5 19.371 16.531 5.113 1.00 0.00 H new ATOM 0 HB2 SER A 5 20.865 16.033 3.249 1.00 0.00 H new ATOM 0 HB3 SER A 5 21.337 14.528 4.013 1.00 0.00 H new ATOM 0 HG SER A 5 19.683 14.230 2.435 1.00 0.00 H new ATOM 48 N SER A 6 18.695 14.052 6.056 1.00 0.00 N ATOM 49 CA SER A 6 18.384 12.801 6.727 1.00 0.00 C ATOM 50 C SER A 6 17.736 11.906 5.669 1.00 0.00 C ATOM 51 O SER A 6 17.773 12.229 4.476 1.00 0.00 O ATOM 52 CB SER A 6 17.520 13.047 7.973 1.00 0.00 C ATOM 53 OG SER A 6 16.193 13.391 7.633 1.00 0.00 O ATOM 0 H SER A 6 18.031 14.282 5.317 1.00 0.00 H new ATOM 0 HA SER A 6 19.270 12.301 7.119 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.515 12.151 8.594 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.961 13.846 8.569 1.00 0.00 H new ATOM 0 HG SER A 6 15.673 13.538 8.451 1.00 0.00 H new ATOM 59 N GLY A 7 17.145 10.779 6.061 1.00 0.00 N ATOM 60 CA GLY A 7 16.342 10.006 5.127 1.00 0.00 C ATOM 61 C GLY A 7 14.991 10.660 4.853 1.00 0.00 C ATOM 62 O GLY A 7 14.331 10.315 3.871 1.00 0.00 O ATOM 0 H GLY A 7 17.207 10.389 7.002 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.886 9.893 4.189 1.00 0.00 H new ATOM 0 HA3 GLY A 7 16.185 9.004 5.527 1.00 0.00 H new ATOM 66 N GLU A 8 14.560 11.582 5.715 1.00 0.00 N ATOM 67 CA GLU A 8 13.203 12.090 5.685 1.00 0.00 C ATOM 68 C GLU A 8 13.051 13.136 4.586 1.00 0.00 C ATOM 69 O GLU A 8 13.980 13.908 4.315 1.00 0.00 O ATOM 70 CB GLU A 8 12.816 12.648 7.059 1.00 0.00 C ATOM 71 CG GLU A 8 12.760 11.548 8.132 1.00 0.00 C ATOM 72 CD GLU A 8 12.737 12.144 9.535 1.00 0.00 C ATOM 73 OE1 GLU A 8 13.820 12.583 10.000 1.00 0.00 O ATOM 74 OE2 GLU A 8 11.671 12.181 10.199 1.00 0.00 O ATOM 0 H GLU A 8 15.143 11.990 6.446 1.00 0.00 H new ATOM 0 HA GLU A 8 12.520 11.272 5.455 1.00 0.00 H new ATOM 0 HB2 GLU A 8 13.537 13.409 7.357 1.00 0.00 H new ATOM 0 HB3 GLU A 8 11.845 13.138 6.991 1.00 0.00 H new ATOM 0 HG2 GLU A 8 11.872 10.934 7.981 1.00 0.00 H new ATOM 0 HG3 GLU A 8 13.623 10.891 8.028 1.00 0.00 H new ATOM 81 N SER A 9 11.873 13.156 3.969 1.00 0.00 N ATOM 82 CA SER A 9 11.389 14.198 3.084 1.00 0.00 C ATOM 83 C SER A 9 9.871 14.097 3.096 1.00 0.00 C ATOM 84 O SER A 9 9.333 13.111 2.597 1.00 0.00 O ATOM 85 CB SER A 9 11.866 13.982 1.640 1.00 0.00 C ATOM 86 OG SER A 9 13.214 14.346 1.422 1.00 0.00 O ATOM 0 H SER A 9 11.197 12.401 4.083 1.00 0.00 H new ATOM 0 HA SER A 9 11.759 15.166 3.421 1.00 0.00 H new ATOM 0 HB2 SER A 9 11.737 12.932 1.378 1.00 0.00 H new ATOM 0 HB3 SER A 9 11.231 14.559 0.968 1.00 0.00 H new ATOM 0 HG SER A 9 13.706 14.300 2.268 1.00 0.00 H new ATOM 92 N TYR A 10 9.184 15.149 3.535 1.00 0.00 N ATOM 93 CA TYR A 10 7.742 15.303 3.368 1.00 0.00 C ATOM 94 C TYR A 10 7.292 14.937 1.948 1.00 0.00 C ATOM 95 O TYR A 10 6.308 14.220 1.763 1.00 0.00 O ATOM 96 CB TYR A 10 7.394 16.758 3.684 1.00 0.00 C ATOM 97 CG TYR A 10 5.962 17.138 3.391 1.00 0.00 C ATOM 98 CD1 TYR A 10 4.972 16.961 4.372 1.00 0.00 C ATOM 99 CD2 TYR A 10 5.627 17.689 2.141 1.00 0.00 C ATOM 100 CE1 TYR A 10 3.652 17.364 4.122 1.00 0.00 C ATOM 101 CE2 TYR A 10 4.312 18.107 1.888 1.00 0.00 C ATOM 102 CZ TYR A 10 3.324 17.963 2.886 1.00 0.00 C ATOM 103 OH TYR A 10 2.060 18.417 2.666 1.00 0.00 O ATOM 0 H TYR A 10 9.621 15.930 4.024 1.00 0.00 H new ATOM 0 HA TYR A 10 7.221 14.625 4.043 1.00 0.00 H new ATOM 0 HB2 TYR A 10 7.598 16.946 4.738 1.00 0.00 H new ATOM 0 HB3 TYR A 10 8.054 17.409 3.110 1.00 0.00 H new ATOM 0 HD1 TYR A 10 5.228 16.514 5.321 1.00 0.00 H new ATOM 0 HD2 TYR A 10 6.382 17.790 1.376 1.00 0.00 H new ATOM 0 HE1 TYR A 10 2.889 17.217 4.872 1.00 0.00 H new ATOM 0 HE2 TYR A 10 4.056 18.538 0.931 1.00 0.00 H new ATOM 0 HH TYR A 10 2.003 18.802 1.767 1.00 0.00 H new ATOM 113 N TRP A 11 8.040 15.372 0.924 1.00 0.00 N ATOM 114 CA TRP A 11 7.678 15.113 -0.466 1.00 0.00 C ATOM 115 C TRP A 11 7.604 13.612 -0.805 1.00 0.00 C ATOM 116 O TRP A 11 6.910 13.210 -1.735 1.00 0.00 O ATOM 117 CB TRP A 11 8.628 15.859 -1.408 1.00 0.00 C ATOM 118 CG TRP A 11 7.945 16.424 -2.611 1.00 0.00 C ATOM 119 CD1 TRP A 11 7.438 17.675 -2.691 1.00 0.00 C ATOM 120 CD2 TRP A 11 7.639 15.783 -3.888 1.00 0.00 C ATOM 121 NE1 TRP A 11 6.891 17.866 -3.939 1.00 0.00 N ATOM 122 CE2 TRP A 11 6.953 16.725 -4.710 1.00 0.00 C ATOM 123 CE3 TRP A 11 7.869 14.504 -4.437 1.00 0.00 C ATOM 124 CZ2 TRP A 11 6.514 16.411 -6.005 1.00 0.00 C ATOM 125 CZ3 TRP A 11 7.428 14.177 -5.732 1.00 0.00 C ATOM 126 CH2 TRP A 11 6.755 15.126 -6.518 1.00 0.00 C ATOM 0 H TRP A 11 8.901 15.906 1.039 1.00 0.00 H new ATOM 0 HA TRP A 11 6.667 15.495 -0.611 1.00 0.00 H new ATOM 0 HB2 TRP A 11 9.111 16.668 -0.860 1.00 0.00 H new ATOM 0 HB3 TRP A 11 9.416 15.179 -1.732 1.00 0.00 H new ATOM 0 HD1 TRP A 11 7.459 18.409 -1.899 1.00 0.00 H new ATOM 0 HE1 TRP A 11 6.487 18.747 -4.256 1.00 0.00 H new ATOM 0 HE3 TRP A 11 8.393 13.762 -3.852 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 5.997 17.149 -6.600 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 7.609 13.187 -6.125 1.00 0.00 H new ATOM 0 HH2 TRP A 11 6.424 14.869 -7.513 1.00 0.00 H new ATOM 137 N ARG A 12 8.298 12.754 -0.058 1.00 0.00 N ATOM 138 CA ARG A 12 8.242 11.304 -0.226 1.00 0.00 C ATOM 139 C ARG A 12 6.830 10.783 0.077 1.00 0.00 C ATOM 140 O ARG A 12 6.430 9.768 -0.488 1.00 0.00 O ATOM 141 CB ARG A 12 9.293 10.688 0.713 1.00 0.00 C ATOM 142 CG ARG A 12 9.928 9.369 0.258 1.00 0.00 C ATOM 143 CD ARG A 12 11.293 9.592 -0.413 1.00 0.00 C ATOM 144 NE ARG A 12 12.278 10.182 0.517 1.00 0.00 N ATOM 145 CZ ARG A 12 13.534 10.532 0.214 1.00 0.00 C ATOM 146 NH1 ARG A 12 13.987 10.442 -1.029 1.00 0.00 N ATOM 147 NH2 ARG A 12 14.352 10.981 1.150 1.00 0.00 N ATOM 0 H ARG A 12 8.923 13.052 0.691 1.00 0.00 H new ATOM 0 HA ARG A 12 8.463 11.022 -1.255 1.00 0.00 H new ATOM 0 HB2 ARG A 12 10.090 11.418 0.859 1.00 0.00 H new ATOM 0 HB3 ARG A 12 8.828 10.525 1.685 1.00 0.00 H new ATOM 0 HG2 ARG A 12 10.049 8.709 1.117 1.00 0.00 H new ATOM 0 HG3 ARG A 12 9.259 8.865 -0.439 1.00 0.00 H new ATOM 0 HD2 ARG A 12 11.672 8.641 -0.787 1.00 0.00 H new ATOM 0 HD3 ARG A 12 11.170 10.248 -1.275 1.00 0.00 H new ATOM 0 HE ARG A 12 11.973 10.337 1.478 1.00 0.00 H new ATOM 0 HH11 ARG A 12 13.376 10.102 -1.771 1.00 0.00 H new ATOM 0 HH12 ARG A 12 14.947 10.713 -1.243 1.00 0.00 H new ATOM 0 HH21 ARG A 12 14.028 11.063 2.114 1.00 0.00 H new ATOM 0 HH22 ARG A 12 15.307 11.245 0.909 1.00 0.00 H new ATOM 161 N SER A 13 6.077 11.452 0.957 1.00 0.00 N ATOM 162 CA SER A 13 4.706 11.101 1.296 1.00 0.00 C ATOM 163 C SER A 13 3.784 11.558 0.171 1.00 0.00 C ATOM 164 O SER A 13 2.824 10.866 -0.163 1.00 0.00 O ATOM 165 CB SER A 13 4.375 11.774 2.636 1.00 0.00 C ATOM 166 OG SER A 13 3.174 11.322 3.232 1.00 0.00 O ATOM 0 H SER A 13 6.418 12.270 1.461 1.00 0.00 H new ATOM 0 HA SER A 13 4.572 10.025 1.404 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.198 11.602 3.329 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.308 12.851 2.482 1.00 0.00 H new ATOM 0 HG SER A 13 3.353 10.513 3.756 1.00 0.00 H new ATOM 172 N ARG A 14 4.110 12.682 -0.473 1.00 0.00 N ATOM 173 CA ARG A 14 3.314 13.279 -1.540 1.00 0.00 C ATOM 174 C ARG A 14 3.144 12.337 -2.719 1.00 0.00 C ATOM 175 O ARG A 14 2.079 12.359 -3.334 1.00 0.00 O ATOM 176 CB ARG A 14 3.922 14.621 -1.987 1.00 0.00 C ATOM 177 CG ARG A 14 4.073 15.610 -0.817 1.00 0.00 C ATOM 178 CD ARG A 14 2.721 16.113 -0.319 1.00 0.00 C ATOM 179 NE ARG A 14 2.261 17.197 -1.193 1.00 0.00 N ATOM 180 CZ ARG A 14 1.211 17.997 -1.024 1.00 0.00 C ATOM 181 NH1 ARG A 14 0.326 17.817 -0.051 1.00 0.00 N ATOM 182 NH2 ARG A 14 1.081 19.010 -1.863 1.00 0.00 N ATOM 0 H ARG A 14 4.955 13.212 -0.259 1.00 0.00 H new ATOM 0 HA ARG A 14 2.319 13.469 -1.137 1.00 0.00 H new ATOM 0 HB2 ARG A 14 4.898 14.443 -2.438 1.00 0.00 H new ATOM 0 HB3 ARG A 14 3.291 15.065 -2.757 1.00 0.00 H new ATOM 0 HG2 ARG A 14 4.604 15.125 0.002 1.00 0.00 H new ATOM 0 HG3 ARG A 14 4.681 16.457 -1.134 1.00 0.00 H new ATOM 0 HD2 ARG A 14 1.995 15.300 -0.315 1.00 0.00 H new ATOM 0 HD3 ARG A 14 2.807 16.469 0.708 1.00 0.00 H new ATOM 0 HE ARG A 14 2.814 17.358 -2.035 1.00 0.00 H new ATOM 0 HH11 ARG A 14 0.437 17.042 0.603 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -0.465 18.454 0.043 1.00 0.00 H new ATOM 0 HH21 ARG A 14 1.770 19.152 -2.602 1.00 0.00 H new ATOM 0 HH22 ARG A 14 0.292 19.650 -1.772 1.00 0.00 H new ATOM 196 N MET A 15 4.130 11.474 -2.990 1.00 0.00 N ATOM 197 CA MET A 15 4.010 10.489 -4.064 1.00 0.00 C ATOM 198 C MET A 15 2.935 9.464 -3.735 1.00 0.00 C ATOM 199 O MET A 15 2.205 9.034 -4.628 1.00 0.00 O ATOM 200 CB MET A 15 5.336 9.772 -4.295 1.00 0.00 C ATOM 201 CG MET A 15 6.452 10.713 -4.766 1.00 0.00 C ATOM 202 SD MET A 15 7.283 10.209 -6.298 1.00 0.00 S ATOM 203 CE MET A 15 7.567 8.449 -5.965 1.00 0.00 C ATOM 0 H MET A 15 5.014 11.440 -2.482 1.00 0.00 H new ATOM 0 HA MET A 15 3.732 11.023 -4.972 1.00 0.00 H new ATOM 0 HB2 MET A 15 5.645 9.285 -3.370 1.00 0.00 H new ATOM 0 HB3 MET A 15 5.193 8.986 -5.037 1.00 0.00 H new ATOM 0 HG2 MET A 15 6.031 11.708 -4.909 1.00 0.00 H new ATOM 0 HG3 MET A 15 7.198 10.793 -3.975 1.00 0.00 H new ATOM 0 HE1 MET A 15 8.458 8.117 -6.498 1.00 0.00 H new ATOM 0 HE2 MET A 15 7.708 8.299 -4.895 1.00 0.00 H new ATOM 0 HE3 MET A 15 6.706 7.871 -6.302 1.00 0.00 H new ATOM 213 N ILE A 16 2.843 9.059 -2.467 1.00 0.00 N ATOM 214 CA ILE A 16 1.804 8.163 -1.994 1.00 0.00 C ATOM 215 C ILE A 16 0.470 8.919 -2.070 1.00 0.00 C ATOM 216 O ILE A 16 -0.476 8.428 -2.679 1.00 0.00 O ATOM 217 CB ILE A 16 2.150 7.627 -0.580 1.00 0.00 C ATOM 218 CG1 ILE A 16 3.602 7.093 -0.429 1.00 0.00 C ATOM 219 CG2 ILE A 16 1.155 6.517 -0.187 1.00 0.00 C ATOM 220 CD1 ILE A 16 4.022 6.077 -1.485 1.00 0.00 C ATOM 0 H ILE A 16 3.496 9.350 -1.739 1.00 0.00 H new ATOM 0 HA ILE A 16 1.722 7.273 -2.618 1.00 0.00 H new ATOM 0 HB ILE A 16 2.072 8.485 0.088 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.290 7.938 -0.463 1.00 0.00 H new ATOM 0 HG13 ILE A 16 3.706 6.637 0.556 1.00 0.00 H new ATOM 0 HG21 ILE A 16 1.401 6.143 0.807 1.00 0.00 H new ATOM 0 HG22 ILE A 16 0.143 6.921 -0.182 1.00 0.00 H new ATOM 0 HG23 ILE A 16 1.217 5.701 -0.907 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.049 5.762 -1.299 1.00 0.00 H new ATOM 0 HD12 ILE A 16 3.362 5.210 -1.439 1.00 0.00 H new ATOM 0 HD13 ILE A 16 3.956 6.531 -2.474 1.00 0.00 H new ATOM 232 N ASP A 17 0.402 10.137 -1.521 1.00 0.00 N ATOM 233 CA ASP A 17 -0.814 10.953 -1.499 1.00 0.00 C ATOM 234 C ASP A 17 -1.340 11.266 -2.905 1.00 0.00 C ATOM 235 O ASP A 17 -2.549 11.447 -3.081 1.00 0.00 O ATOM 236 CB ASP A 17 -0.604 12.242 -0.686 1.00 0.00 C ATOM 237 CG ASP A 17 -1.187 12.094 0.717 1.00 0.00 C ATOM 238 OD1 ASP A 17 -2.420 12.269 0.881 1.00 0.00 O ATOM 239 OD2 ASP A 17 -0.430 11.738 1.653 1.00 0.00 O ATOM 0 H ASP A 17 1.200 10.588 -1.074 1.00 0.00 H new ATOM 0 HA ASP A 17 -1.580 10.357 -1.003 1.00 0.00 H new ATOM 0 HB2 ASP A 17 0.460 12.468 -0.621 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -1.078 13.081 -1.196 1.00 0.00 H new ATOM 244 N ALA A 18 -0.464 11.300 -3.914 1.00 0.00 N ATOM 245 CA ALA A 18 -0.819 11.500 -5.313 1.00 0.00 C ATOM 246 C ALA A 18 -1.634 10.331 -5.864 1.00 0.00 C ATOM 247 O ALA A 18 -2.506 10.551 -6.706 1.00 0.00 O ATOM 248 CB ALA A 18 0.446 11.713 -6.150 1.00 0.00 C ATOM 0 H ALA A 18 0.539 11.185 -3.770 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.444 12.391 -5.375 1.00 0.00 H new ATOM 0 HB1 ALA A 18 0.171 11.862 -7.194 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.979 12.592 -5.787 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.090 10.838 -6.066 1.00 0.00 H new ATOM 254 N VAL A 19 -1.408 9.102 -5.388 1.00 0.00 N ATOM 255 CA VAL A 19 -2.152 7.924 -5.832 1.00 0.00 C ATOM 256 C VAL A 19 -3.255 7.525 -4.864 1.00 0.00 C ATOM 257 O VAL A 19 -4.134 6.766 -5.272 1.00 0.00 O ATOM 258 CB VAL A 19 -1.216 6.740 -6.143 1.00 0.00 C ATOM 259 CG1 VAL A 19 -0.477 7.044 -7.438 1.00 0.00 C ATOM 260 CG2 VAL A 19 -0.204 6.392 -5.043 1.00 0.00 C ATOM 0 H VAL A 19 -0.701 8.898 -4.682 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.644 8.208 -6.762 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.854 5.860 -6.223 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.192 6.218 -7.678 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -1.197 7.174 -8.246 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.104 7.959 -7.319 1.00 0.00 H new ATOM 0 HG21 VAL A 19 0.404 5.546 -5.363 1.00 0.00 H new ATOM 0 HG22 VAL A 19 0.440 7.252 -4.856 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.736 6.131 -4.128 1.00 0.00 H new ATOM 270 N THR A 20 -3.272 8.041 -3.630 1.00 0.00 N ATOM 271 CA THR A 20 -4.250 7.630 -2.630 1.00 0.00 C ATOM 272 C THR A 20 -5.406 8.617 -2.461 1.00 0.00 C ATOM 273 O THR A 20 -6.240 8.354 -1.608 1.00 0.00 O ATOM 274 CB THR A 20 -3.571 7.270 -1.295 1.00 0.00 C ATOM 275 OG1 THR A 20 -2.863 8.362 -0.753 1.00 0.00 O ATOM 276 CG2 THR A 20 -2.607 6.084 -1.441 1.00 0.00 C ATOM 0 H THR A 20 -2.613 8.748 -3.304 1.00 0.00 H new ATOM 0 HA THR A 20 -4.716 6.721 -3.011 1.00 0.00 H new ATOM 0 HB THR A 20 -4.379 6.993 -0.618 1.00 0.00 H new ATOM 0 HG1 THR A 20 -2.204 8.036 -0.106 1.00 0.00 H new ATOM 0 HG21 THR A 20 -2.151 5.865 -0.476 1.00 0.00 H new ATOM 0 HG22 THR A 20 -3.156 5.209 -1.790 1.00 0.00 H new ATOM 0 HG23 THR A 20 -1.828 6.334 -2.162 1.00 0.00 H new ATOM 284 N SER A 21 -5.473 9.729 -3.204 1.00 0.00 N ATOM 285 CA SER A 21 -6.406 10.814 -2.892 1.00 0.00 C ATOM 286 C SER A 21 -7.870 10.350 -2.914 1.00 0.00 C ATOM 287 O SER A 21 -8.232 9.432 -3.654 1.00 0.00 O ATOM 288 CB SER A 21 -6.164 12.013 -3.822 1.00 0.00 C ATOM 289 OG SER A 21 -5.982 11.648 -5.181 1.00 0.00 O ATOM 0 H SER A 21 -4.892 9.899 -4.025 1.00 0.00 H new ATOM 0 HA SER A 21 -6.211 11.137 -1.869 1.00 0.00 H new ATOM 0 HB2 SER A 21 -7.010 12.697 -3.748 1.00 0.00 H new ATOM 0 HB3 SER A 21 -5.284 12.557 -3.479 1.00 0.00 H new ATOM 0 HG SER A 21 -5.835 12.454 -5.719 1.00 0.00 H new ATOM 295 N ASP A 22 -8.724 10.985 -2.113 1.00 0.00 N ATOM 296 CA ASP A 22 -10.165 10.758 -2.137 1.00 0.00 C ATOM 297 C ASP A 22 -10.750 11.212 -3.468 1.00 0.00 C ATOM 298 O ASP A 22 -10.771 12.402 -3.774 1.00 0.00 O ATOM 299 CB ASP A 22 -10.884 11.432 -0.955 1.00 0.00 C ATOM 300 CG ASP A 22 -10.477 12.875 -0.640 1.00 0.00 C ATOM 301 OD1 ASP A 22 -9.389 13.047 -0.043 1.00 0.00 O ATOM 302 OD2 ASP A 22 -11.325 13.789 -0.739 1.00 0.00 O ATOM 0 H ASP A 22 -8.431 11.677 -1.424 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.329 9.686 -2.030 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -11.956 11.415 -1.153 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -10.715 10.828 -0.064 1.00 0.00 H new ATOM 307 N GLU A 23 -11.172 10.239 -4.278 1.00 0.00 N ATOM 308 CA GLU A 23 -11.836 10.396 -5.562 1.00 0.00 C ATOM 309 C GLU A 23 -12.784 9.209 -5.740 1.00 0.00 C ATOM 310 O GLU A 23 -12.714 8.237 -4.991 1.00 0.00 O ATOM 311 CB GLU A 23 -10.808 10.363 -6.703 1.00 0.00 C ATOM 312 CG GLU A 23 -9.752 11.461 -6.618 1.00 0.00 C ATOM 313 CD GLU A 23 -8.918 11.483 -7.887 1.00 0.00 C ATOM 314 OE1 GLU A 23 -8.057 10.581 -8.048 1.00 0.00 O ATOM 315 OE2 GLU A 23 -9.153 12.374 -8.738 1.00 0.00 O ATOM 0 H GLU A 23 -11.048 9.257 -4.033 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.368 11.347 -5.587 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -10.310 9.393 -6.702 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -11.333 10.451 -7.654 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -10.233 12.428 -6.473 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -9.109 11.292 -5.754 1.00 0.00 H new ATOM 322 N ASP A 24 -13.597 9.209 -6.794 1.00 0.00 N ATOM 323 CA ASP A 24 -14.452 8.061 -7.108 1.00 0.00 C ATOM 324 C ASP A 24 -13.680 6.900 -7.756 1.00 0.00 C ATOM 325 O ASP A 24 -14.134 5.752 -7.723 1.00 0.00 O ATOM 326 CB ASP A 24 -15.586 8.506 -8.040 1.00 0.00 C ATOM 327 CG ASP A 24 -16.903 7.846 -7.644 1.00 0.00 C ATOM 328 OD1 ASP A 24 -17.115 6.649 -7.913 1.00 0.00 O ATOM 329 OD2 ASP A 24 -17.744 8.537 -7.019 1.00 0.00 O ATOM 0 H ASP A 24 -13.683 9.989 -7.446 1.00 0.00 H new ATOM 0 HA ASP A 24 -14.853 7.692 -6.164 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -15.691 9.590 -8.000 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -15.339 8.247 -9.070 1.00 0.00 H new ATOM 334 N LYS A 25 -12.534 7.184 -8.398 1.00 0.00 N ATOM 335 CA LYS A 25 -11.881 6.293 -9.361 1.00 0.00 C ATOM 336 C LYS A 25 -10.437 6.006 -8.955 1.00 0.00 C ATOM 337 O LYS A 25 -9.799 6.815 -8.273 1.00 0.00 O ATOM 338 CB LYS A 25 -11.955 6.953 -10.751 1.00 0.00 C ATOM 339 CG LYS A 25 -11.755 5.981 -11.924 1.00 0.00 C ATOM 340 CD LYS A 25 -11.706 6.729 -13.266 1.00 0.00 C ATOM 341 CE LYS A 25 -10.301 7.286 -13.555 1.00 0.00 C ATOM 342 NZ LYS A 25 -9.578 6.489 -14.569 1.00 0.00 N ATOM 0 H LYS A 25 -12.029 8.059 -8.256 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.393 5.331 -9.384 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -12.925 7.439 -10.858 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.198 7.735 -10.810 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.830 5.422 -11.783 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.567 5.254 -11.940 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -12.003 6.055 -14.070 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.426 7.547 -13.254 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.385 8.317 -13.899 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.723 7.304 -12.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.637 6.903 -14.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.473 5.511 -14.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.114 6.492 -15.460 1.00 0.00 H new ATOM 356 N VAL A 26 -9.915 4.864 -9.398 1.00 0.00 N ATOM 357 CA VAL A 26 -8.548 4.424 -9.153 1.00 0.00 C ATOM 358 C VAL A 26 -7.538 5.323 -9.888 1.00 0.00 C ATOM 359 O VAL A 26 -7.883 6.029 -10.840 1.00 0.00 O ATOM 360 CB VAL A 26 -8.405 2.936 -9.550 1.00 0.00 C ATOM 361 CG1 VAL A 26 -9.404 2.051 -8.789 1.00 0.00 C ATOM 362 CG2 VAL A 26 -8.586 2.688 -11.053 1.00 0.00 C ATOM 0 H VAL A 26 -10.452 4.199 -9.955 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.325 4.513 -8.090 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.383 2.670 -9.280 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.275 1.012 -9.093 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.226 2.140 -7.717 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -10.421 2.372 -9.016 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -8.473 1.624 -11.262 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -9.580 3.015 -11.359 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.834 3.249 -11.607 1.00 0.00 H new ATOM 372 N ALA A 27 -6.280 5.283 -9.443 1.00 0.00 N ATOM 373 CA ALA A 27 -5.148 5.912 -10.118 1.00 0.00 C ATOM 374 C ALA A 27 -4.544 4.944 -11.155 1.00 0.00 C ATOM 375 O ALA A 27 -4.726 3.727 -11.020 1.00 0.00 O ATOM 376 CB ALA A 27 -4.119 6.288 -9.048 1.00 0.00 C ATOM 0 H ALA A 27 -6.017 4.801 -8.584 1.00 0.00 H new ATOM 0 HA ALA A 27 -5.465 6.806 -10.655 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -3.259 6.761 -9.521 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -4.570 6.981 -8.338 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -3.795 5.389 -8.523 1.00 0.00 H new ATOM 382 N PRO A 28 -3.825 5.447 -12.176 1.00 0.00 N ATOM 383 CA PRO A 28 -3.220 4.611 -13.206 1.00 0.00 C ATOM 384 C PRO A 28 -1.994 3.890 -12.662 1.00 0.00 C ATOM 385 O PRO A 28 -1.406 4.294 -11.658 1.00 0.00 O ATOM 386 CB PRO A 28 -2.800 5.568 -14.320 1.00 0.00 C ATOM 387 CG PRO A 28 -2.488 6.845 -13.555 1.00 0.00 C ATOM 388 CD PRO A 28 -3.527 6.846 -12.443 1.00 0.00 C ATOM 0 HA PRO A 28 -3.917 3.850 -13.556 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -1.932 5.199 -14.866 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -3.596 5.716 -15.050 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.473 6.839 -13.158 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -2.577 7.727 -14.190 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -3.144 7.341 -11.551 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -4.424 7.386 -12.747 1.00 0.00 H new ATOM 396 N VAL A 29 -1.562 2.849 -13.372 1.00 0.00 N ATOM 397 CA VAL A 29 -0.418 2.062 -12.934 1.00 0.00 C ATOM 398 C VAL A 29 0.862 2.905 -12.927 1.00 0.00 C ATOM 399 O VAL A 29 1.690 2.726 -12.035 1.00 0.00 O ATOM 400 CB VAL A 29 -0.243 0.789 -13.783 1.00 0.00 C ATOM 401 CG1 VAL A 29 0.666 -0.184 -13.026 1.00 0.00 C ATOM 402 CG2 VAL A 29 -1.567 0.075 -14.090 1.00 0.00 C ATOM 0 H VAL A 29 -1.985 2.535 -14.246 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.615 1.743 -11.910 1.00 0.00 H new ATOM 0 HB VAL A 29 0.188 1.097 -14.736 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.799 -1.091 -13.616 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.636 0.283 -12.854 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.211 -0.437 -12.069 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.371 -0.813 -14.691 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -2.048 -0.218 -13.156 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.224 0.748 -14.641 1.00 0.00 H new ATOM 412 N TYR A 30 1.026 3.834 -13.878 1.00 0.00 N ATOM 413 CA TYR A 30 2.276 4.582 -13.992 1.00 0.00 C ATOM 414 C TYR A 30 2.532 5.508 -12.800 1.00 0.00 C ATOM 415 O TYR A 30 3.682 5.844 -12.526 1.00 0.00 O ATOM 416 CB TYR A 30 2.362 5.335 -15.323 1.00 0.00 C ATOM 417 CG TYR A 30 1.514 6.591 -15.406 1.00 0.00 C ATOM 418 CD1 TYR A 30 2.019 7.804 -14.896 1.00 0.00 C ATOM 419 CD2 TYR A 30 0.240 6.560 -16.006 1.00 0.00 C ATOM 420 CE1 TYR A 30 1.247 8.973 -14.952 1.00 0.00 C ATOM 421 CE2 TYR A 30 -0.539 7.731 -16.067 1.00 0.00 C ATOM 422 CZ TYR A 30 -0.044 8.936 -15.519 1.00 0.00 C ATOM 423 OH TYR A 30 -0.791 10.071 -15.541 1.00 0.00 O ATOM 0 H TYR A 30 0.317 4.080 -14.569 1.00 0.00 H new ATOM 0 HA TYR A 30 3.076 3.842 -13.976 1.00 0.00 H new ATOM 0 HB2 TYR A 30 3.402 5.605 -15.504 1.00 0.00 H new ATOM 0 HB3 TYR A 30 2.064 4.660 -16.125 1.00 0.00 H new ATOM 0 HD1 TYR A 30 3.006 7.833 -14.460 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -0.139 5.637 -16.420 1.00 0.00 H new ATOM 0 HE1 TYR A 30 1.640 9.900 -14.562 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -1.514 7.709 -16.532 1.00 0.00 H new ATOM 0 HH TYR A 30 -1.655 9.886 -15.964 1.00 0.00 H new ATOM 433 N LYS A 31 1.493 5.904 -12.060 1.00 0.00 N ATOM 434 CA LYS A 31 1.701 6.673 -10.841 1.00 0.00 C ATOM 435 C LYS A 31 2.041 5.774 -9.656 1.00 0.00 C ATOM 436 O LYS A 31 2.545 6.293 -8.665 1.00 0.00 O ATOM 437 CB LYS A 31 0.497 7.566 -10.540 1.00 0.00 C ATOM 438 CG LYS A 31 0.282 8.649 -11.598 1.00 0.00 C ATOM 439 CD LYS A 31 -0.626 9.753 -11.058 1.00 0.00 C ATOM 440 CE LYS A 31 -0.919 10.714 -12.209 1.00 0.00 C ATOM 441 NZ LYS A 31 -1.310 12.051 -11.733 1.00 0.00 N ATOM 0 H LYS A 31 0.517 5.707 -12.282 1.00 0.00 H new ATOM 0 HA LYS A 31 2.561 7.321 -11.007 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -0.399 6.949 -10.471 1.00 0.00 H new ATOM 0 HB3 LYS A 31 0.635 8.038 -9.567 1.00 0.00 H new ATOM 0 HG2 LYS A 31 1.242 9.072 -11.894 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -0.162 8.210 -12.491 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -1.552 9.330 -10.667 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.142 10.278 -10.234 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -0.036 10.800 -12.842 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -1.716 10.303 -12.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -1.499 12.668 -12.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -2.168 11.975 -11.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -0.540 12.456 -11.163 1.00 0.00 H new ATOM 455 N LEU A 32 1.740 4.470 -9.711 1.00 0.00 N ATOM 456 CA LEU A 32 1.998 3.524 -8.634 1.00 0.00 C ATOM 457 C LEU A 32 3.421 2.987 -8.747 1.00 0.00 C ATOM 458 O LEU A 32 4.095 2.832 -7.733 1.00 0.00 O ATOM 459 CB LEU A 32 1.001 2.347 -8.701 1.00 0.00 C ATOM 460 CG LEU A 32 -0.484 2.743 -8.590 1.00 0.00 C ATOM 461 CD1 LEU A 32 -1.383 1.539 -8.878 1.00 0.00 C ATOM 462 CD2 LEU A 32 -0.852 3.245 -7.198 1.00 0.00 C ATOM 0 H LEU A 32 1.301 4.041 -10.526 1.00 0.00 H new ATOM 0 HA LEU A 32 1.876 4.041 -7.682 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.151 1.817 -9.642 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.235 1.646 -7.900 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.634 3.540 -9.318 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.428 1.837 -8.795 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.189 1.173 -9.886 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.173 0.748 -8.158 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.909 3.510 -7.175 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.658 2.461 -6.466 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.252 4.123 -6.957 1.00 0.00 H new ATOM 474 N GLU A 33 3.866 2.666 -9.966 1.00 0.00 N ATOM 475 CA GLU A 33 5.180 2.064 -10.192 1.00 0.00 C ATOM 476 C GLU A 33 6.323 2.988 -9.772 1.00 0.00 C ATOM 477 O GLU A 33 7.335 2.511 -9.278 1.00 0.00 O ATOM 478 CB GLU A 33 5.357 1.633 -11.646 1.00 0.00 C ATOM 479 CG GLU A 33 5.164 2.763 -12.655 1.00 0.00 C ATOM 480 CD GLU A 33 6.337 2.877 -13.610 1.00 0.00 C ATOM 481 OE1 GLU A 33 6.423 2.004 -14.502 1.00 0.00 O ATOM 482 OE2 GLU A 33 7.194 3.765 -13.436 1.00 0.00 O ATOM 0 H GLU A 33 3.327 2.816 -10.819 1.00 0.00 H new ATOM 0 HA GLU A 33 5.222 1.177 -9.560 1.00 0.00 H new ATOM 0 HB2 GLU A 33 6.355 1.214 -11.771 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.647 0.836 -11.867 1.00 0.00 H new ATOM 0 HG2 GLU A 33 4.250 2.590 -13.223 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.036 3.706 -12.124 1.00 0.00 H new ATOM 489 N GLU A 34 6.131 4.297 -9.906 1.00 0.00 N ATOM 490 CA GLU A 34 7.121 5.323 -9.584 1.00 0.00 C ATOM 491 C GLU A 34 7.541 5.279 -8.107 1.00 0.00 C ATOM 492 O GLU A 34 8.671 5.618 -7.759 1.00 0.00 O ATOM 493 CB GLU A 34 6.509 6.672 -9.976 1.00 0.00 C ATOM 494 CG GLU A 34 7.227 7.898 -9.401 1.00 0.00 C ATOM 495 CD GLU A 34 6.725 9.171 -10.074 1.00 0.00 C ATOM 496 OE1 GLU A 34 5.494 9.388 -10.081 1.00 0.00 O ATOM 497 OE2 GLU A 34 7.512 9.973 -10.624 1.00 0.00 O ATOM 0 H GLU A 34 5.254 4.687 -10.253 1.00 0.00 H new ATOM 0 HA GLU A 34 8.042 5.151 -10.141 1.00 0.00 H new ATOM 0 HB2 GLU A 34 6.503 6.749 -11.063 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.469 6.692 -9.649 1.00 0.00 H new ATOM 0 HG2 GLU A 34 7.057 7.956 -8.326 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.302 7.800 -9.549 1.00 0.00 H new ATOM 504 N ILE A 35 6.649 4.851 -7.218 1.00 0.00 N ATOM 505 CA ILE A 35 6.981 4.687 -5.811 1.00 0.00 C ATOM 506 C ILE A 35 7.925 3.492 -5.677 1.00 0.00 C ATOM 507 O ILE A 35 8.872 3.540 -4.893 1.00 0.00 O ATOM 508 CB ILE A 35 5.675 4.538 -5.007 1.00 0.00 C ATOM 509 CG1 ILE A 35 4.934 5.892 -4.920 1.00 0.00 C ATOM 510 CG2 ILE A 35 5.924 4.026 -3.578 1.00 0.00 C ATOM 511 CD1 ILE A 35 4.143 6.337 -6.145 1.00 0.00 C ATOM 0 H ILE A 35 5.686 4.611 -7.452 1.00 0.00 H new ATOM 0 HA ILE A 35 7.501 5.555 -5.406 1.00 0.00 H new ATOM 0 HB ILE A 35 5.068 3.805 -5.538 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.248 5.847 -4.074 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.669 6.665 -4.694 1.00 0.00 H new ATOM 0 HG21 ILE A 35 4.973 3.938 -3.052 1.00 0.00 H new ATOM 0 HG22 ILE A 35 6.407 3.050 -3.620 1.00 0.00 H new ATOM 0 HG23 ILE A 35 6.568 4.727 -3.047 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.675 7.301 -5.946 1.00 0.00 H new ATOM 0 HD12 ILE A 35 4.815 6.429 -6.998 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.372 5.599 -6.368 1.00 0.00 H new ATOM 523 N CYS A 36 7.649 2.412 -6.413 1.00 0.00 N ATOM 524 CA CYS A 36 8.531 1.264 -6.464 1.00 0.00 C ATOM 525 C CYS A 36 9.895 1.662 -7.021 1.00 0.00 C ATOM 526 O CYS A 36 10.902 1.169 -6.518 1.00 0.00 O ATOM 527 CB CYS A 36 7.920 0.139 -7.294 1.00 0.00 C ATOM 528 SG CYS A 36 8.814 -1.354 -6.822 1.00 0.00 S ATOM 0 H CYS A 36 6.809 2.318 -6.985 1.00 0.00 H new ATOM 0 HA CYS A 36 8.666 0.896 -5.447 1.00 0.00 H new ATOM 0 HB2 CYS A 36 6.854 0.038 -7.092 1.00 0.00 H new ATOM 0 HB3 CYS A 36 8.025 0.338 -8.361 1.00 0.00 H new ATOM 0 HG CYS A 36 10.044 -1.050 -6.533 1.00 0.00 H new ATOM 534 N ASP A 37 9.917 2.534 -8.031 1.00 0.00 N ATOM 535 CA ASP A 37 11.140 3.040 -8.640 1.00 0.00 C ATOM 536 C ASP A 37 12.007 3.709 -7.586 1.00 0.00 C ATOM 537 O ASP A 37 13.165 3.334 -7.399 1.00 0.00 O ATOM 538 CB ASP A 37 10.835 4.037 -9.766 1.00 0.00 C ATOM 539 CG ASP A 37 12.112 4.377 -10.529 1.00 0.00 C ATOM 540 OD1 ASP A 37 12.576 3.519 -11.309 1.00 0.00 O ATOM 541 OD2 ASP A 37 12.669 5.481 -10.351 1.00 0.00 O ATOM 0 H ASP A 37 9.069 2.912 -8.453 1.00 0.00 H new ATOM 0 HA ASP A 37 11.674 2.193 -9.071 1.00 0.00 H new ATOM 0 HB2 ASP A 37 10.098 3.613 -10.447 1.00 0.00 H new ATOM 0 HB3 ASP A 37 10.399 4.945 -9.349 1.00 0.00 H new ATOM 546 N LEU A 38 11.414 4.648 -6.840 1.00 0.00 N ATOM 547 CA LEU A 38 12.133 5.345 -5.792 1.00 0.00 C ATOM 548 C LEU A 38 12.669 4.377 -4.752 1.00 0.00 C ATOM 549 O LEU A 38 13.855 4.453 -4.436 1.00 0.00 O ATOM 550 CB LEU A 38 11.324 6.449 -5.132 1.00 0.00 C ATOM 551 CG LEU A 38 11.258 7.720 -6.004 1.00 0.00 C ATOM 552 CD1 LEU A 38 10.842 8.968 -5.224 1.00 0.00 C ATOM 553 CD2 LEU A 38 12.506 8.133 -6.804 1.00 0.00 C ATOM 0 H LEU A 38 10.441 4.935 -6.949 1.00 0.00 H new ATOM 0 HA LEU A 38 12.974 5.833 -6.285 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.313 6.090 -4.937 1.00 0.00 H new ATOM 0 HB3 LEU A 38 11.767 6.695 -4.167 1.00 0.00 H new ATOM 0 HG LEU A 38 10.508 7.384 -6.720 1.00 0.00 H new ATOM 0 HD11 LEU A 38 10.816 9.825 -5.897 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.853 8.815 -4.793 1.00 0.00 H new ATOM 0 HD13 LEU A 38 11.561 9.155 -4.426 1.00 0.00 H new ATOM 0 HD21 LEU A 38 12.295 9.045 -7.363 1.00 0.00 H new ATOM 0 HD22 LEU A 38 13.335 8.311 -6.119 1.00 0.00 H new ATOM 0 HD23 LEU A 38 12.774 7.336 -7.498 1.00 0.00 H new ATOM 565 N LEU A 39 11.835 3.473 -4.229 1.00 0.00 N ATOM 566 CA LEU A 39 12.268 2.506 -3.231 1.00 0.00 C ATOM 567 C LEU A 39 13.434 1.652 -3.748 1.00 0.00 C ATOM 568 O LEU A 39 14.401 1.462 -3.011 1.00 0.00 O ATOM 569 CB LEU A 39 11.107 1.611 -2.792 1.00 0.00 C ATOM 570 CG LEU A 39 9.927 2.255 -2.047 1.00 0.00 C ATOM 571 CD1 LEU A 39 8.598 1.526 -2.309 1.00 0.00 C ATOM 572 CD2 LEU A 39 10.178 2.138 -0.553 1.00 0.00 C ATOM 0 H LEU A 39 10.851 3.396 -4.486 1.00 0.00 H new ATOM 0 HA LEU A 39 12.617 3.068 -2.365 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.710 1.122 -3.682 1.00 0.00 H new ATOM 0 HB3 LEU A 39 11.515 0.828 -2.153 1.00 0.00 H new ATOM 0 HG LEU A 39 9.854 3.285 -2.396 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.797 2.021 -1.760 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.374 1.549 -3.376 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.679 0.491 -1.978 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.349 2.591 -0.008 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.261 1.086 -0.279 1.00 0.00 H new ATOM 0 HD23 LEU A 39 11.104 2.653 -0.298 1.00 0.00 H new ATOM 584 N ARG A 40 13.394 1.149 -4.996 1.00 0.00 N ATOM 585 CA ARG A 40 14.513 0.384 -5.556 1.00 0.00 C ATOM 586 C ARG A 40 15.785 1.229 -5.597 1.00 0.00 C ATOM 587 O ARG A 40 16.879 0.693 -5.415 1.00 0.00 O ATOM 588 CB ARG A 40 14.213 -0.123 -6.980 1.00 0.00 C ATOM 589 CG ARG A 40 13.254 -1.323 -7.071 1.00 0.00 C ATOM 590 CD ARG A 40 13.452 -2.134 -8.368 1.00 0.00 C ATOM 591 NE ARG A 40 13.372 -1.311 -9.587 1.00 0.00 N ATOM 592 CZ ARG A 40 13.319 -1.730 -10.858 1.00 0.00 C ATOM 593 NH1 ARG A 40 13.310 -3.019 -11.183 1.00 0.00 N ATOM 594 NH2 ARG A 40 13.260 -0.828 -11.823 1.00 0.00 N ATOM 0 H ARG A 40 12.602 1.260 -5.629 1.00 0.00 H new ATOM 0 HA ARG A 40 14.657 -0.475 -4.901 1.00 0.00 H new ATOM 0 HB2 ARG A 40 13.792 0.700 -7.558 1.00 0.00 H new ATOM 0 HB3 ARG A 40 15.155 -0.397 -7.455 1.00 0.00 H new ATOM 0 HG2 ARG A 40 13.408 -1.974 -6.211 1.00 0.00 H new ATOM 0 HG3 ARG A 40 12.225 -0.967 -7.021 1.00 0.00 H new ATOM 0 HD2 ARG A 40 14.423 -2.628 -8.335 1.00 0.00 H new ATOM 0 HD3 ARG A 40 12.697 -2.918 -8.417 1.00 0.00 H new ATOM 0 HE ARG A 40 13.355 -0.301 -9.446 1.00 0.00 H new ATOM 0 HH11 ARG A 40 13.344 -3.730 -10.452 1.00 0.00 H new ATOM 0 HH12 ARG A 40 13.269 -3.297 -12.163 1.00 0.00 H new ATOM 0 HH21 ARG A 40 13.256 0.166 -11.593 1.00 0.00 H new ATOM 0 HH22 ARG A 40 13.219 -1.126 -12.798 1.00 0.00 H new ATOM 608 N SER A 41 15.660 2.534 -5.824 1.00 0.00 N ATOM 609 CA SER A 41 16.777 3.457 -5.892 1.00 0.00 C ATOM 610 C SER A 41 17.363 3.804 -4.511 1.00 0.00 C ATOM 611 O SER A 41 18.384 4.498 -4.467 1.00 0.00 O ATOM 612 CB SER A 41 16.296 4.721 -6.622 1.00 0.00 C ATOM 613 OG SER A 41 17.386 5.426 -7.184 1.00 0.00 O ATOM 0 H SER A 41 14.756 2.984 -5.968 1.00 0.00 H new ATOM 0 HA SER A 41 17.592 2.980 -6.436 1.00 0.00 H new ATOM 0 HB2 SER A 41 15.592 4.446 -7.407 1.00 0.00 H new ATOM 0 HB3 SER A 41 15.761 5.366 -5.926 1.00 0.00 H new ATOM 0 HG SER A 41 18.144 5.406 -6.563 1.00 0.00 H new ATOM 619 N SER A 42 16.750 3.392 -3.394 1.00 0.00 N ATOM 620 CA SER A 42 16.910 4.115 -2.134 1.00 0.00 C ATOM 621 C SER A 42 17.258 3.227 -0.934 1.00 0.00 C ATOM 622 O SER A 42 16.990 2.021 -0.903 1.00 0.00 O ATOM 623 CB SER A 42 15.629 4.906 -1.893 1.00 0.00 C ATOM 624 OG SER A 42 15.451 5.886 -2.892 1.00 0.00 O ATOM 0 H SER A 42 16.146 2.571 -3.340 1.00 0.00 H new ATOM 0 HA SER A 42 17.771 4.777 -2.228 1.00 0.00 H new ATOM 0 HB2 SER A 42 14.774 4.229 -1.884 1.00 0.00 H new ATOM 0 HB3 SER A 42 15.669 5.382 -0.913 1.00 0.00 H new ATOM 0 HG SER A 42 14.985 5.491 -3.658 1.00 0.00 H new ATOM 630 N HIS A 43 17.901 3.838 0.061 1.00 0.00 N ATOM 631 CA HIS A 43 18.390 3.230 1.290 1.00 0.00 C ATOM 632 C HIS A 43 17.216 2.845 2.201 1.00 0.00 C ATOM 633 O HIS A 43 16.131 3.416 2.093 1.00 0.00 O ATOM 634 CB HIS A 43 19.334 4.257 1.941 1.00 0.00 C ATOM 635 CG HIS A 43 19.959 3.859 3.250 1.00 0.00 C ATOM 636 ND1 HIS A 43 19.946 4.617 4.401 1.00 0.00 N ATOM 637 CD2 HIS A 43 20.742 2.762 3.479 1.00 0.00 C ATOM 638 CE1 HIS A 43 20.677 3.971 5.323 1.00 0.00 C ATOM 639 NE2 HIS A 43 21.166 2.829 4.810 1.00 0.00 N ATOM 0 H HIS A 43 18.106 4.837 0.023 1.00 0.00 H new ATOM 0 HA HIS A 43 18.931 2.304 1.099 1.00 0.00 H new ATOM 0 HB2 HIS A 43 20.134 4.481 1.235 1.00 0.00 H new ATOM 0 HB3 HIS A 43 18.778 5.182 2.096 1.00 0.00 H new ATOM 0 HD2 HIS A 43 20.987 1.989 2.766 1.00 0.00 H new ATOM 0 HE1 HIS A 43 20.848 4.319 6.331 1.00 0.00 H new ATOM 0 HE2 HIS A 43 21.738 2.141 5.299 1.00 0.00 H new ATOM 647 N VAL A 44 17.431 1.931 3.148 1.00 0.00 N ATOM 648 CA VAL A 44 16.394 1.427 4.051 1.00 0.00 C ATOM 649 C VAL A 44 15.740 2.540 4.889 1.00 0.00 C ATOM 650 O VAL A 44 14.539 2.483 5.127 1.00 0.00 O ATOM 651 CB VAL A 44 16.969 0.274 4.897 1.00 0.00 C ATOM 652 CG1 VAL A 44 18.083 0.736 5.841 1.00 0.00 C ATOM 653 CG2 VAL A 44 15.892 -0.462 5.707 1.00 0.00 C ATOM 0 H VAL A 44 18.347 1.512 3.312 1.00 0.00 H new ATOM 0 HA VAL A 44 15.573 1.028 3.455 1.00 0.00 H new ATOM 0 HB VAL A 44 17.392 -0.421 4.172 1.00 0.00 H new ATOM 0 HG11 VAL A 44 18.452 -0.116 6.413 1.00 0.00 H new ATOM 0 HG12 VAL A 44 18.899 1.163 5.259 1.00 0.00 H new ATOM 0 HG13 VAL A 44 17.692 1.490 6.524 1.00 0.00 H new ATOM 0 HG21 VAL A 44 16.354 -1.263 6.283 1.00 0.00 H new ATOM 0 HG22 VAL A 44 15.405 0.238 6.385 1.00 0.00 H new ATOM 0 HG23 VAL A 44 15.151 -0.884 5.028 1.00 0.00 H new ATOM 663 N SER A 45 16.474 3.590 5.266 1.00 0.00 N ATOM 664 CA SER A 45 15.891 4.751 5.939 1.00 0.00 C ATOM 665 C SER A 45 14.790 5.375 5.062 1.00 0.00 C ATOM 666 O SER A 45 13.748 5.794 5.559 1.00 0.00 O ATOM 667 CB SER A 45 17.044 5.709 6.271 1.00 0.00 C ATOM 668 OG SER A 45 16.654 6.957 6.804 1.00 0.00 O ATOM 0 H SER A 45 17.480 3.659 5.115 1.00 0.00 H new ATOM 0 HA SER A 45 15.394 4.481 6.871 1.00 0.00 H new ATOM 0 HB2 SER A 45 17.708 5.219 6.983 1.00 0.00 H new ATOM 0 HB3 SER A 45 17.622 5.884 5.364 1.00 0.00 H new ATOM 0 HG SER A 45 17.450 7.498 6.986 1.00 0.00 H new ATOM 674 N ILE A 46 14.991 5.413 3.745 1.00 0.00 N ATOM 675 CA ILE A 46 14.033 5.955 2.793 1.00 0.00 C ATOM 676 C ILE A 46 12.888 4.962 2.561 1.00 0.00 C ATOM 677 O ILE A 46 11.774 5.367 2.232 1.00 0.00 O ATOM 678 CB ILE A 46 14.732 6.259 1.450 1.00 0.00 C ATOM 679 CG1 ILE A 46 16.174 6.803 1.523 1.00 0.00 C ATOM 680 CG2 ILE A 46 13.865 7.205 0.614 1.00 0.00 C ATOM 681 CD1 ILE A 46 16.360 8.075 2.338 1.00 0.00 C ATOM 0 H ILE A 46 15.841 5.060 3.306 1.00 0.00 H new ATOM 0 HA ILE A 46 13.625 6.878 3.204 1.00 0.00 H new ATOM 0 HB ILE A 46 14.838 5.281 0.981 1.00 0.00 H new ATOM 0 HG12 ILE A 46 16.814 6.027 1.943 1.00 0.00 H new ATOM 0 HG13 ILE A 46 16.524 6.990 0.508 1.00 0.00 H new ATOM 0 HG21 ILE A 46 14.364 7.415 -0.332 1.00 0.00 H new ATOM 0 HG22 ILE A 46 12.900 6.737 0.419 1.00 0.00 H new ATOM 0 HG23 ILE A 46 13.713 8.137 1.159 1.00 0.00 H new ATOM 0 HD11 ILE A 46 17.410 8.367 2.322 1.00 0.00 H new ATOM 0 HD12 ILE A 46 15.754 8.873 1.910 1.00 0.00 H new ATOM 0 HD13 ILE A 46 16.049 7.896 3.367 1.00 0.00 H new ATOM 693 N VAL A 47 13.141 3.651 2.654 1.00 0.00 N ATOM 694 CA VAL A 47 12.075 2.652 2.598 1.00 0.00 C ATOM 695 C VAL A 47 11.121 2.935 3.759 1.00 0.00 C ATOM 696 O VAL A 47 9.914 2.847 3.565 1.00 0.00 O ATOM 697 CB VAL A 47 12.660 1.231 2.725 1.00 0.00 C ATOM 698 CG1 VAL A 47 11.581 0.163 2.882 1.00 0.00 C ATOM 699 CG2 VAL A 47 13.512 0.880 1.499 1.00 0.00 C ATOM 0 H VAL A 47 14.076 3.260 2.768 1.00 0.00 H new ATOM 0 HA VAL A 47 11.550 2.710 1.645 1.00 0.00 H new ATOM 0 HB VAL A 47 13.274 1.239 3.626 1.00 0.00 H new ATOM 0 HG11 VAL A 47 12.049 -0.818 2.967 1.00 0.00 H new ATOM 0 HG12 VAL A 47 10.997 0.365 3.780 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.925 0.178 2.011 1.00 0.00 H new ATOM 0 HG21 VAL A 47 13.914 -0.127 1.611 1.00 0.00 H new ATOM 0 HG22 VAL A 47 12.895 0.926 0.602 1.00 0.00 H new ATOM 0 HG23 VAL A 47 14.334 1.591 1.411 1.00 0.00 H new ATOM 709 N LYS A 48 11.647 3.254 4.947 1.00 0.00 N ATOM 710 CA LYS A 48 10.841 3.483 6.141 1.00 0.00 C ATOM 711 C LYS A 48 9.983 4.739 6.043 1.00 0.00 C ATOM 712 O LYS A 48 8.858 4.717 6.524 1.00 0.00 O ATOM 713 CB LYS A 48 11.722 3.535 7.390 1.00 0.00 C ATOM 714 CG LYS A 48 12.258 2.157 7.763 1.00 0.00 C ATOM 715 CD LYS A 48 13.102 2.319 9.031 1.00 0.00 C ATOM 716 CE LYS A 48 13.023 1.109 9.948 1.00 0.00 C ATOM 717 NZ LYS A 48 11.690 0.871 10.554 1.00 0.00 N ATOM 0 H LYS A 48 12.649 3.360 5.103 1.00 0.00 H new ATOM 0 HA LYS A 48 10.158 2.637 6.221 1.00 0.00 H new ATOM 0 HB2 LYS A 48 12.556 4.215 7.218 1.00 0.00 H new ATOM 0 HB3 LYS A 48 11.147 3.939 8.223 1.00 0.00 H new ATOM 0 HG2 LYS A 48 11.438 1.460 7.935 1.00 0.00 H new ATOM 0 HG3 LYS A 48 12.860 1.747 6.952 1.00 0.00 H new ATOM 0 HD2 LYS A 48 14.141 2.490 8.751 1.00 0.00 H new ATOM 0 HD3 LYS A 48 12.768 3.203 9.574 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.312 0.223 9.383 1.00 0.00 H new ATOM 0 HE3 LYS A 48 13.754 1.229 10.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 11.790 0.241 11.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 11.281 1.777 10.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 11.063 0.428 9.852 1.00 0.00 H new ATOM 731 N GLU A 49 10.457 5.802 5.387 1.00 0.00 N ATOM 732 CA GLU A 49 9.591 6.922 5.017 1.00 0.00 C ATOM 733 C GLU A 49 8.396 6.382 4.242 1.00 0.00 C ATOM 734 O GLU A 49 7.242 6.568 4.627 1.00 0.00 O ATOM 735 CB GLU A 49 10.361 7.942 4.158 1.00 0.00 C ATOM 736 CG GLU A 49 11.214 8.917 4.965 1.00 0.00 C ATOM 737 CD GLU A 49 10.357 9.937 5.708 1.00 0.00 C ATOM 738 OE1 GLU A 49 9.857 9.607 6.810 1.00 0.00 O ATOM 739 OE2 GLU A 49 10.224 11.078 5.199 1.00 0.00 O ATOM 0 H GLU A 49 11.431 5.909 5.103 1.00 0.00 H new ATOM 0 HA GLU A 49 9.250 7.429 5.919 1.00 0.00 H new ATOM 0 HB2 GLU A 49 11.004 7.403 3.462 1.00 0.00 H new ATOM 0 HB3 GLU A 49 9.648 8.509 3.559 1.00 0.00 H new ATOM 0 HG2 GLU A 49 11.822 8.363 5.680 1.00 0.00 H new ATOM 0 HG3 GLU A 49 11.902 9.437 4.298 1.00 0.00 H new ATOM 746 N PHE A 50 8.690 5.715 3.130 1.00 0.00 N ATOM 747 CA PHE A 50 7.667 5.263 2.217 1.00 0.00 C ATOM 748 C PHE A 50 6.697 4.282 2.855 1.00 0.00 C ATOM 749 O PHE A 50 5.500 4.385 2.591 1.00 0.00 O ATOM 750 CB PHE A 50 8.312 4.643 0.992 1.00 0.00 C ATOM 751 CG PHE A 50 8.548 5.597 -0.149 1.00 0.00 C ATOM 752 CD1 PHE A 50 7.473 6.305 -0.715 1.00 0.00 C ATOM 753 CD2 PHE A 50 9.827 5.704 -0.707 1.00 0.00 C ATOM 754 CE1 PHE A 50 7.660 7.042 -1.893 1.00 0.00 C ATOM 755 CE2 PHE A 50 10.015 6.434 -1.884 1.00 0.00 C ATOM 756 CZ PHE A 50 8.921 7.060 -2.505 1.00 0.00 C ATOM 0 H PHE A 50 9.640 5.478 2.845 1.00 0.00 H new ATOM 0 HA PHE A 50 7.083 6.137 1.929 1.00 0.00 H new ATOM 0 HB2 PHE A 50 9.266 4.205 1.284 1.00 0.00 H new ATOM 0 HB3 PHE A 50 7.681 3.827 0.640 1.00 0.00 H new ATOM 0 HD1 PHE A 50 6.502 6.281 -0.242 1.00 0.00 H new ATOM 0 HD2 PHE A 50 10.668 5.223 -0.229 1.00 0.00 H new ATOM 0 HE1 PHE A 50 6.838 7.592 -2.326 1.00 0.00 H new ATOM 0 HE2 PHE A 50 11.001 6.517 -2.316 1.00 0.00 H new ATOM 0 HZ PHE A 50 9.052 7.556 -3.455 1.00 0.00 H new ATOM 766 N SER A 51 7.192 3.313 3.630 1.00 0.00 N ATOM 767 CA SER A 51 6.355 2.295 4.228 1.00 0.00 C ATOM 768 C SER A 51 5.317 2.992 5.081 1.00 0.00 C ATOM 769 O SER A 51 4.137 2.787 4.830 1.00 0.00 O ATOM 770 CB SER A 51 7.169 1.251 5.010 1.00 0.00 C ATOM 771 OG SER A 51 7.873 1.798 6.100 1.00 0.00 O ATOM 0 H SER A 51 8.183 3.221 3.854 1.00 0.00 H new ATOM 0 HA SER A 51 5.855 1.721 3.448 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.497 0.474 5.373 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.876 0.770 4.334 1.00 0.00 H new ATOM 0 HG SER A 51 8.083 2.737 5.916 1.00 0.00 H new ATOM 777 N GLU A 52 5.725 3.852 6.013 1.00 0.00 N ATOM 778 CA GLU A 52 4.787 4.584 6.850 1.00 0.00 C ATOM 779 C GLU A 52 3.759 5.312 5.982 1.00 0.00 C ATOM 780 O GLU A 52 2.564 5.128 6.186 1.00 0.00 O ATOM 781 CB GLU A 52 5.516 5.514 7.828 1.00 0.00 C ATOM 782 CG GLU A 52 6.367 4.713 8.833 1.00 0.00 C ATOM 783 CD GLU A 52 6.220 5.221 10.273 1.00 0.00 C ATOM 784 OE1 GLU A 52 5.121 5.068 10.851 1.00 0.00 O ATOM 785 OE2 GLU A 52 7.224 5.711 10.844 1.00 0.00 O ATOM 0 H GLU A 52 6.706 4.057 6.205 1.00 0.00 H new ATOM 0 HA GLU A 52 4.238 3.874 7.469 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.155 6.200 7.273 1.00 0.00 H new ATOM 0 HB3 GLU A 52 4.789 6.121 8.367 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.078 3.663 8.792 1.00 0.00 H new ATOM 0 HG3 GLU A 52 7.415 4.767 8.539 1.00 0.00 H new ATOM 792 N PHE A 53 4.170 6.080 4.970 1.00 0.00 N ATOM 793 CA PHE A 53 3.215 6.856 4.183 1.00 0.00 C ATOM 794 C PHE A 53 2.198 5.973 3.446 1.00 0.00 C ATOM 795 O PHE A 53 1.088 6.431 3.155 1.00 0.00 O ATOM 796 CB PHE A 53 3.989 7.794 3.249 1.00 0.00 C ATOM 797 CG PHE A 53 4.998 8.695 3.949 1.00 0.00 C ATOM 798 CD1 PHE A 53 4.770 9.148 5.269 1.00 0.00 C ATOM 799 CD2 PHE A 53 6.196 9.051 3.289 1.00 0.00 C ATOM 800 CE1 PHE A 53 5.732 9.921 5.936 1.00 0.00 C ATOM 801 CE2 PHE A 53 7.132 9.864 3.955 1.00 0.00 C ATOM 802 CZ PHE A 53 6.899 10.301 5.265 1.00 0.00 C ATOM 0 H PHE A 53 5.143 6.179 4.681 1.00 0.00 H new ATOM 0 HA PHE A 53 2.608 7.461 4.856 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.513 7.194 2.505 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.276 8.419 2.710 1.00 0.00 H new ATOM 0 HD1 PHE A 53 3.846 8.896 5.769 1.00 0.00 H new ATOM 0 HD2 PHE A 53 6.391 8.703 2.285 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.573 10.221 6.961 1.00 0.00 H new ATOM 0 HE2 PHE A 53 8.041 10.154 3.450 1.00 0.00 H new ATOM 0 HZ PHE A 53 7.622 10.933 5.758 1.00 0.00 H new ATOM 812 N ILE A 54 2.539 4.713 3.172 1.00 0.00 N ATOM 813 CA ILE A 54 1.636 3.704 2.643 1.00 0.00 C ATOM 814 C ILE A 54 0.751 3.141 3.759 1.00 0.00 C ATOM 815 O ILE A 54 -0.468 3.089 3.593 1.00 0.00 O ATOM 816 CB ILE A 54 2.438 2.608 1.916 1.00 0.00 C ATOM 817 CG1 ILE A 54 3.198 3.194 0.698 1.00 0.00 C ATOM 818 CG2 ILE A 54 1.502 1.496 1.421 1.00 0.00 C ATOM 819 CD1 ILE A 54 4.367 2.322 0.226 1.00 0.00 C ATOM 0 H ILE A 54 3.485 4.360 3.319 1.00 0.00 H new ATOM 0 HA ILE A 54 0.970 4.159 1.910 1.00 0.00 H new ATOM 0 HB ILE A 54 3.155 2.199 2.628 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.498 3.326 -0.127 1.00 0.00 H new ATOM 0 HG13 ILE A 54 3.575 4.183 0.957 1.00 0.00 H new ATOM 0 HG21 ILE A 54 2.085 0.730 0.910 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.984 1.051 2.271 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.771 1.916 0.730 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.851 2.794 -0.629 1.00 0.00 H new ATOM 0 HD12 ILE A 54 5.088 2.210 1.036 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.994 1.340 -0.065 1.00 0.00 H new ATOM 831 N LEU A 55 1.346 2.644 4.845 1.00 0.00 N ATOM 832 CA LEU A 55 0.664 1.846 5.857 1.00 0.00 C ATOM 833 C LEU A 55 -0.381 2.713 6.560 1.00 0.00 C ATOM 834 O LEU A 55 -1.525 2.289 6.745 1.00 0.00 O ATOM 835 CB LEU A 55 1.667 1.290 6.884 1.00 0.00 C ATOM 836 CG LEU A 55 2.811 0.407 6.359 1.00 0.00 C ATOM 837 CD1 LEU A 55 3.996 0.530 7.324 1.00 0.00 C ATOM 838 CD2 LEU A 55 2.423 -1.058 6.151 1.00 0.00 C ATOM 0 H LEU A 55 2.335 2.790 5.047 1.00 0.00 H new ATOM 0 HA LEU A 55 0.175 1.001 5.372 1.00 0.00 H new ATOM 0 HB2 LEU A 55 2.110 2.135 7.411 1.00 0.00 H new ATOM 0 HB3 LEU A 55 1.108 0.712 7.620 1.00 0.00 H new ATOM 0 HG LEU A 55 3.078 0.768 5.366 1.00 0.00 H new ATOM 0 HD11 LEU A 55 4.820 -0.090 6.970 1.00 0.00 H new ATOM 0 HD12 LEU A 55 4.319 1.570 7.373 1.00 0.00 H new ATOM 0 HD13 LEU A 55 3.693 0.197 8.317 1.00 0.00 H new ATOM 0 HD21 LEU A 55 3.284 -1.613 5.780 1.00 0.00 H new ATOM 0 HD22 LEU A 55 2.096 -1.486 7.099 1.00 0.00 H new ATOM 0 HD23 LEU A 55 1.611 -1.120 5.426 1.00 0.00 H new ATOM 850 N LYS A 56 -0.020 3.965 6.857 1.00 0.00 N ATOM 851 CA LYS A 56 -0.884 4.959 7.492 1.00 0.00 C ATOM 852 C LYS A 56 -2.144 5.222 6.663 1.00 0.00 C ATOM 853 O LYS A 56 -3.091 5.828 7.169 1.00 0.00 O ATOM 854 CB LYS A 56 -0.112 6.277 7.668 1.00 0.00 C ATOM 855 CG LYS A 56 1.155 6.192 8.532 1.00 0.00 C ATOM 856 CD LYS A 56 0.961 6.269 10.040 1.00 0.00 C ATOM 857 CE LYS A 56 2.392 6.229 10.589 1.00 0.00 C ATOM 858 NZ LYS A 56 2.483 6.314 12.060 1.00 0.00 N ATOM 0 H LYS A 56 0.913 4.324 6.654 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.188 4.566 8.462 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.166 6.649 6.682 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -0.783 7.014 8.109 1.00 0.00 H new ATOM 0 HG2 LYS A 56 1.662 5.255 8.302 1.00 0.00 H new ATOM 0 HG3 LYS A 56 1.825 6.998 8.234 1.00 0.00 H new ATOM 0 HD2 LYS A 56 0.445 7.184 10.332 1.00 0.00 H new ATOM 0 HD3 LYS A 56 0.366 5.435 10.411 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.869 5.305 10.260 1.00 0.00 H new ATOM 0 HE3 LYS A 56 2.958 7.052 10.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 3.482 6.280 12.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 2.059 7.207 12.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.972 5.514 12.486 1.00 0.00 H new ATOM 872 N ARG A 57 -2.190 4.836 5.380 1.00 0.00 N ATOM 873 CA ARG A 57 -3.382 5.024 4.560 1.00 0.00 C ATOM 874 C ARG A 57 -4.500 4.071 4.948 1.00 0.00 C ATOM 875 O ARG A 57 -5.668 4.407 4.779 1.00 0.00 O ATOM 876 CB ARG A 57 -3.043 4.812 3.079 1.00 0.00 C ATOM 877 CG ARG A 57 -3.862 5.740 2.173 1.00 0.00 C ATOM 878 CD ARG A 57 -3.539 7.219 2.396 1.00 0.00 C ATOM 879 NE ARG A 57 -2.083 7.480 2.449 1.00 0.00 N ATOM 880 CZ ARG A 57 -1.491 8.678 2.414 1.00 0.00 C ATOM 881 NH1 ARG A 57 -2.198 9.787 2.480 1.00 0.00 N ATOM 882 NH2 ARG A 57 -0.176 8.785 2.321 1.00 0.00 N ATOM 0 H ARG A 57 -1.412 4.392 4.893 1.00 0.00 H new ATOM 0 HA ARG A 57 -3.727 6.044 4.729 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -1.980 4.992 2.919 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.235 3.774 2.806 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -3.672 5.484 1.131 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -4.924 5.573 2.354 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -3.982 7.809 1.593 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -3.998 7.551 3.327 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.472 6.666 2.519 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -3.214 9.740 2.559 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -1.730 10.693 2.452 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.402 7.946 2.275 1.00 0.00 H new ATOM 0 HH22 ARG A 57 0.260 9.707 2.295 1.00 0.00 H new ATOM 896 N LEU A 58 -4.169 2.875 5.427 1.00 0.00 N ATOM 897 CA LEU A 58 -5.175 1.909 5.843 1.00 0.00 C ATOM 898 C LEU A 58 -5.748 2.319 7.197 1.00 0.00 C ATOM 899 O LEU A 58 -6.914 2.053 7.484 1.00 0.00 O ATOM 900 CB LEU A 58 -4.588 0.494 5.870 1.00 0.00 C ATOM 901 CG LEU A 58 -4.132 -0.085 4.515 1.00 0.00 C ATOM 902 CD1 LEU A 58 -5.122 0.133 3.362 1.00 0.00 C ATOM 903 CD2 LEU A 58 -2.780 0.469 4.059 1.00 0.00 C ATOM 0 H LEU A 58 -3.207 2.553 5.536 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.991 1.899 5.120 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.734 0.491 6.548 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -5.334 -0.177 6.295 1.00 0.00 H new ATOM 0 HG LEU A 58 -4.063 -1.153 4.722 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.720 -0.306 2.449 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -6.073 -0.341 3.604 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -5.277 1.202 3.213 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.510 0.026 3.100 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.848 1.552 3.953 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.018 0.224 4.799 1.00 0.00 H new ATOM 915 N ASP A 59 -4.968 3.077 7.968 1.00 0.00 N ATOM 916 CA ASP A 59 -5.321 3.745 9.220 1.00 0.00 C ATOM 917 C ASP A 59 -6.270 4.944 9.014 1.00 0.00 C ATOM 918 O ASP A 59 -6.516 5.721 9.936 1.00 0.00 O ATOM 919 CB ASP A 59 -4.002 4.190 9.882 1.00 0.00 C ATOM 920 CG ASP A 59 -3.961 3.886 11.371 1.00 0.00 C ATOM 921 OD1 ASP A 59 -4.131 2.702 11.753 1.00 0.00 O ATOM 922 OD2 ASP A 59 -3.639 4.793 12.168 1.00 0.00 O ATOM 0 H ASP A 59 -3.996 3.253 7.713 1.00 0.00 H new ATOM 0 HA ASP A 59 -5.870 3.052 9.858 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -3.167 3.691 9.390 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -3.867 5.261 9.730 1.00 0.00 H new ATOM 927 N ASN A 60 -6.755 5.168 7.787 1.00 0.00 N ATOM 928 CA ASN A 60 -7.611 6.298 7.417 1.00 0.00 C ATOM 929 C ASN A 60 -9.106 5.938 7.575 1.00 0.00 C ATOM 930 O ASN A 60 -9.455 4.893 8.131 1.00 0.00 O ATOM 931 CB ASN A 60 -7.248 6.757 5.996 1.00 0.00 C ATOM 932 CG ASN A 60 -7.545 8.230 5.731 1.00 0.00 C ATOM 933 OD1 ASN A 60 -8.694 8.624 5.577 1.00 0.00 O ATOM 934 ND2 ASN A 60 -6.532 9.069 5.657 1.00 0.00 N ATOM 0 H ASN A 60 -6.556 4.548 7.002 1.00 0.00 H new ATOM 0 HA ASN A 60 -7.437 7.135 8.093 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -6.187 6.573 5.824 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -7.797 6.150 5.276 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -6.701 10.057 5.470 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -5.579 8.730 5.787 1.00 0.00 H new ATOM 941 N LYS A 61 -10.013 6.811 7.125 1.00 0.00 N ATOM 942 CA LYS A 61 -11.441 6.833 7.439 1.00 0.00 C ATOM 943 C LYS A 61 -12.342 6.774 6.202 1.00 0.00 C ATOM 944 O LYS A 61 -13.562 6.811 6.369 1.00 0.00 O ATOM 945 CB LYS A 61 -11.725 8.123 8.222 1.00 0.00 C ATOM 946 CG LYS A 61 -11.162 8.118 9.646 1.00 0.00 C ATOM 947 CD LYS A 61 -11.963 7.196 10.574 1.00 0.00 C ATOM 948 CE LYS A 61 -11.590 7.478 12.028 1.00 0.00 C ATOM 949 NZ LYS A 61 -12.159 8.747 12.524 1.00 0.00 N ATOM 0 H LYS A 61 -9.751 7.567 6.493 1.00 0.00 H new ATOM 0 HA LYS A 61 -11.672 5.940 8.021 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -11.303 8.968 7.677 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -12.803 8.279 8.268 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -10.121 7.795 9.624 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -11.173 9.133 10.044 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -13.031 7.354 10.425 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -11.758 6.153 10.332 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -11.940 6.658 12.655 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -10.504 7.510 12.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -12.098 8.773 13.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -11.625 9.546 12.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -13.155 8.818 12.234 1.00 0.00 H new ATOM 963 N SER A 62 -11.790 6.641 4.995 1.00 0.00 N ATOM 964 CA SER A 62 -12.549 6.606 3.743 1.00 0.00 C ATOM 965 C SER A 62 -12.213 5.314 2.988 1.00 0.00 C ATOM 966 O SER A 62 -11.097 4.801 3.083 1.00 0.00 O ATOM 967 CB SER A 62 -12.230 7.868 2.941 1.00 0.00 C ATOM 968 OG SER A 62 -12.469 9.016 3.738 1.00 0.00 O ATOM 0 H SER A 62 -10.783 6.553 4.857 1.00 0.00 H new ATOM 0 HA SER A 62 -13.623 6.598 3.927 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.190 7.850 2.615 1.00 0.00 H new ATOM 0 HB3 SER A 62 -12.845 7.904 2.042 1.00 0.00 H new ATOM 0 HG SER A 62 -12.262 9.822 3.221 1.00 0.00 H new ATOM 974 N PRO A 63 -13.163 4.734 2.245 1.00 0.00 N ATOM 975 CA PRO A 63 -12.977 3.462 1.562 1.00 0.00 C ATOM 976 C PRO A 63 -11.954 3.608 0.425 1.00 0.00 C ATOM 977 O PRO A 63 -11.059 2.774 0.293 1.00 0.00 O ATOM 978 CB PRO A 63 -14.385 3.049 1.096 1.00 0.00 C ATOM 979 CG PRO A 63 -15.079 4.389 0.937 1.00 0.00 C ATOM 980 CD PRO A 63 -14.509 5.226 2.055 1.00 0.00 C ATOM 0 HA PRO A 63 -12.558 2.683 2.200 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -14.356 2.492 0.159 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -14.886 2.416 1.828 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -14.875 4.832 -0.038 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -16.161 4.291 1.022 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -14.509 6.284 1.794 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -15.099 5.122 2.966 1.00 0.00 H new ATOM 988 N ILE A 64 -12.040 4.671 -0.380 1.00 0.00 N ATOM 989 CA ILE A 64 -11.244 4.798 -1.605 1.00 0.00 C ATOM 990 C ILE A 64 -9.783 4.995 -1.229 1.00 0.00 C ATOM 991 O ILE A 64 -8.931 4.258 -1.723 1.00 0.00 O ATOM 992 CB ILE A 64 -11.752 5.957 -2.485 1.00 0.00 C ATOM 993 CG1 ILE A 64 -13.289 5.870 -2.660 1.00 0.00 C ATOM 994 CG2 ILE A 64 -10.999 6.015 -3.829 1.00 0.00 C ATOM 995 CD1 ILE A 64 -13.983 7.055 -1.980 1.00 0.00 C ATOM 0 H ILE A 64 -12.658 5.463 -0.203 1.00 0.00 H new ATOM 0 HA ILE A 64 -11.345 3.885 -2.192 1.00 0.00 H new ATOM 0 HB ILE A 64 -11.539 6.899 -1.979 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.538 5.857 -3.721 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -13.655 4.936 -2.235 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -11.382 6.843 -4.425 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -9.935 6.162 -3.644 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -11.147 5.080 -4.370 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.061 6.972 -2.116 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -13.750 7.051 -0.915 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -13.632 7.986 -2.424 1.00 0.00 H new ATOM 1007 N VAL A 65 -9.507 5.908 -0.290 1.00 0.00 N ATOM 1008 CA VAL A 65 -8.161 6.133 0.224 1.00 0.00 C ATOM 1009 C VAL A 65 -7.537 4.798 0.667 1.00 0.00 C ATOM 1010 O VAL A 65 -6.326 4.613 0.534 1.00 0.00 O ATOM 1011 CB VAL A 65 -8.214 7.214 1.339 1.00 0.00 C ATOM 1012 CG1 VAL A 65 -8.274 6.644 2.751 1.00 0.00 C ATOM 1013 CG2 VAL A 65 -7.054 8.212 1.301 1.00 0.00 C ATOM 0 H VAL A 65 -10.215 6.509 0.132 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.504 6.522 -0.554 1.00 0.00 H new ATOM 0 HB VAL A 65 -9.146 7.731 1.111 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.309 7.461 3.472 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.167 6.028 2.857 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.389 6.035 2.935 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.167 8.932 2.112 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.111 7.678 1.418 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.057 8.738 0.346 1.00 0.00 H new ATOM 1023 N LYS A 66 -8.348 3.867 1.210 1.00 0.00 N ATOM 1024 CA LYS A 66 -7.809 2.591 1.680 1.00 0.00 C ATOM 1025 C LYS A 66 -7.504 1.741 0.445 1.00 0.00 C ATOM 1026 O LYS A 66 -6.381 1.260 0.297 1.00 0.00 O ATOM 1027 CB LYS A 66 -8.773 1.849 2.648 1.00 0.00 C ATOM 1028 CG LYS A 66 -8.508 2.079 4.158 1.00 0.00 C ATOM 1029 CD LYS A 66 -9.703 2.500 5.026 1.00 0.00 C ATOM 1030 CE LYS A 66 -10.895 1.552 4.856 1.00 0.00 C ATOM 1031 NZ LYS A 66 -11.975 1.817 5.828 1.00 0.00 N ATOM 0 H LYS A 66 -9.355 3.977 1.329 1.00 0.00 H new ATOM 0 HA LYS A 66 -6.904 2.775 2.260 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -9.794 2.159 2.425 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -8.712 0.780 2.445 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -8.098 1.158 4.573 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -7.736 2.843 4.253 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -9.402 2.520 6.073 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -10.005 3.514 4.762 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -11.290 1.649 3.845 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -10.555 0.523 4.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -12.853 1.365 5.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -11.709 1.430 6.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -12.124 2.843 5.911 1.00 0.00 H new ATOM 1045 N GLN A 67 -8.495 1.508 -0.427 1.00 0.00 N ATOM 1046 CA GLN A 67 -8.357 0.605 -1.572 1.00 0.00 C ATOM 1047 C GLN A 67 -7.225 1.061 -2.503 1.00 0.00 C ATOM 1048 O GLN A 67 -6.466 0.215 -2.979 1.00 0.00 O ATOM 1049 CB GLN A 67 -9.710 0.428 -2.300 1.00 0.00 C ATOM 1050 CG GLN A 67 -9.782 -0.856 -3.157 1.00 0.00 C ATOM 1051 CD GLN A 67 -9.028 -0.842 -4.492 1.00 0.00 C ATOM 1052 OE1 GLN A 67 -8.799 0.196 -5.111 1.00 0.00 O ATOM 1053 NE2 GLN A 67 -8.660 -2.008 -4.993 1.00 0.00 N ATOM 0 H GLN A 67 -9.415 1.942 -0.356 1.00 0.00 H new ATOM 0 HA GLN A 67 -8.071 -0.382 -1.207 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -10.512 0.409 -1.562 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -9.886 1.293 -2.939 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -9.400 -1.684 -2.560 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -10.831 -1.069 -3.362 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -8.851 -2.867 -4.478 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -8.185 -2.049 -5.895 1.00 0.00 H new ATOM 1062 N LYS A 68 -7.049 2.372 -2.708 1.00 0.00 N ATOM 1063 CA LYS A 68 -5.945 2.931 -3.486 1.00 0.00 C ATOM 1064 C LYS A 68 -4.585 2.488 -2.929 1.00 0.00 C ATOM 1065 O LYS A 68 -3.738 2.068 -3.716 1.00 0.00 O ATOM 1066 CB LYS A 68 -6.061 4.464 -3.576 1.00 0.00 C ATOM 1067 CG LYS A 68 -7.065 4.953 -4.644 1.00 0.00 C ATOM 1068 CD LYS A 68 -7.272 6.482 -4.634 1.00 0.00 C ATOM 1069 CE LYS A 68 -7.711 7.043 -5.999 1.00 0.00 C ATOM 1070 NZ LYS A 68 -7.484 8.503 -6.107 1.00 0.00 N ATOM 0 H LYS A 68 -7.679 3.080 -2.332 1.00 0.00 H new ATOM 0 HA LYS A 68 -6.012 2.538 -4.500 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -6.361 4.854 -2.603 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -5.078 4.881 -3.797 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -6.714 4.648 -5.630 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -8.025 4.463 -4.482 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -8.023 6.736 -3.886 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -6.344 6.966 -4.331 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -7.164 6.533 -6.792 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -8.769 6.830 -6.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -7.916 8.858 -6.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -7.914 8.983 -5.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -6.462 8.695 -6.122 1.00 0.00 H new ATOM 1084 N ALA A 69 -4.353 2.534 -1.610 1.00 0.00 N ATOM 1085 CA ALA A 69 -3.120 2.013 -1.034 1.00 0.00 C ATOM 1086 C ALA A 69 -3.014 0.505 -1.244 1.00 0.00 C ATOM 1087 O ALA A 69 -1.952 0.032 -1.630 1.00 0.00 O ATOM 1088 CB ALA A 69 -3.028 2.355 0.451 1.00 0.00 C ATOM 0 H ALA A 69 -5.004 2.926 -0.930 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.284 2.488 -1.547 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.100 1.956 0.859 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.044 3.438 0.577 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.875 1.916 0.979 1.00 0.00 H new ATOM 1094 N LEU A 70 -4.090 -0.258 -1.038 1.00 0.00 N ATOM 1095 CA LEU A 70 -4.055 -1.713 -1.199 1.00 0.00 C ATOM 1096 C LEU A 70 -3.509 -2.112 -2.578 1.00 0.00 C ATOM 1097 O LEU A 70 -2.560 -2.890 -2.662 1.00 0.00 O ATOM 1098 CB LEU A 70 -5.434 -2.335 -0.911 1.00 0.00 C ATOM 1099 CG LEU A 70 -5.941 -2.181 0.534 1.00 0.00 C ATOM 1100 CD1 LEU A 70 -7.375 -2.683 0.677 1.00 0.00 C ATOM 1101 CD2 LEU A 70 -5.039 -2.917 1.523 1.00 0.00 C ATOM 0 H LEU A 70 -4.999 0.110 -0.758 1.00 0.00 H new ATOM 0 HA LEU A 70 -3.363 -2.118 -0.461 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.164 -1.885 -1.584 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.392 -3.397 -1.152 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.918 -1.116 0.765 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.702 -2.560 1.709 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -8.028 -2.111 0.019 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.420 -3.738 0.405 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.426 -2.788 2.534 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.018 -3.978 1.276 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -4.029 -2.511 1.466 1.00 0.00 H new ATOM 1113 N ARG A 71 -4.038 -1.540 -3.669 1.00 0.00 N ATOM 1114 CA ARG A 71 -3.512 -1.824 -5.014 1.00 0.00 C ATOM 1115 C ARG A 71 -2.066 -1.361 -5.217 1.00 0.00 C ATOM 1116 O ARG A 71 -1.364 -1.950 -6.042 1.00 0.00 O ATOM 1117 CB ARG A 71 -4.433 -1.271 -6.115 1.00 0.00 C ATOM 1118 CG ARG A 71 -4.698 0.241 -6.027 1.00 0.00 C ATOM 1119 CD ARG A 71 -5.594 0.781 -7.145 1.00 0.00 C ATOM 1120 NE ARG A 71 -6.895 0.091 -7.223 1.00 0.00 N ATOM 1121 CZ ARG A 71 -7.295 -0.759 -8.180 1.00 0.00 C ATOM 1122 NH1 ARG A 71 -6.529 -1.013 -9.235 1.00 0.00 N ATOM 1123 NH2 ARG A 71 -8.477 -1.352 -8.073 1.00 0.00 N ATOM 0 H ARG A 71 -4.820 -0.886 -3.649 1.00 0.00 H new ATOM 0 HA ARG A 71 -3.497 -2.911 -5.097 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.991 -1.493 -7.086 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.387 -1.797 -6.071 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -5.160 0.463 -5.065 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.745 0.769 -6.052 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -5.763 1.846 -6.986 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -5.077 0.679 -8.099 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.559 0.280 -6.472 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.620 -0.559 -9.327 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -6.849 -1.662 -9.953 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -9.073 -1.160 -7.268 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -8.790 -2.000 -8.796 1.00 0.00 H new ATOM 1137 N LEU A 72 -1.608 -0.314 -4.527 1.00 0.00 N ATOM 1138 CA LEU A 72 -0.207 0.106 -4.591 1.00 0.00 C ATOM 1139 C LEU A 72 0.693 -0.967 -3.991 1.00 0.00 C ATOM 1140 O LEU A 72 1.794 -1.165 -4.503 1.00 0.00 O ATOM 1141 CB LEU A 72 -0.003 1.446 -3.848 1.00 0.00 C ATOM 1142 CG LEU A 72 1.462 1.920 -3.727 1.00 0.00 C ATOM 1143 CD1 LEU A 72 2.139 2.152 -5.081 1.00 0.00 C ATOM 1144 CD2 LEU A 72 1.499 3.226 -2.928 1.00 0.00 C ATOM 0 H LEU A 72 -2.189 0.260 -3.916 1.00 0.00 H new ATOM 0 HA LEU A 72 0.060 0.248 -5.638 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -0.576 2.218 -4.362 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.421 1.354 -2.846 1.00 0.00 H new ATOM 0 HG LEU A 72 2.012 1.125 -3.224 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.165 2.483 -4.923 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.142 1.223 -5.650 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.593 2.915 -5.635 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.530 3.568 -2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.909 3.984 -3.443 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.085 3.056 -1.934 1.00 0.00 H new ATOM 1156 N ILE A 73 0.277 -1.572 -2.872 1.00 0.00 N ATOM 1157 CA ILE A 73 1.198 -2.261 -1.980 1.00 0.00 C ATOM 1158 C ILE A 73 1.709 -3.467 -2.743 1.00 0.00 C ATOM 1159 O ILE A 73 2.873 -3.513 -3.130 1.00 0.00 O ATOM 1160 CB ILE A 73 0.523 -2.605 -0.630 1.00 0.00 C ATOM 1161 CG1 ILE A 73 0.351 -1.344 0.230 1.00 0.00 C ATOM 1162 CG2 ILE A 73 1.395 -3.568 0.187 1.00 0.00 C ATOM 1163 CD1 ILE A 73 -0.736 -1.468 1.297 1.00 0.00 C ATOM 0 H ILE A 73 -0.696 -1.594 -2.568 1.00 0.00 H new ATOM 0 HA ILE A 73 2.043 -1.632 -1.698 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.441 -3.054 -0.868 1.00 0.00 H new ATOM 0 HG12 ILE A 73 1.299 -1.115 0.716 1.00 0.00 H new ATOM 0 HG13 ILE A 73 0.114 -0.502 -0.420 1.00 0.00 H new ATOM 0 HG21 ILE A 73 0.900 -3.795 1.131 1.00 0.00 H new ATOM 0 HG22 ILE A 73 1.544 -4.490 -0.375 1.00 0.00 H new ATOM 0 HG23 ILE A 73 2.361 -3.104 0.386 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.798 -0.539 1.863 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -1.695 -1.666 0.818 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.492 -2.288 1.972 1.00 0.00 H new ATOM 1175 N LYS A 74 0.814 -4.411 -3.019 1.00 0.00 N ATOM 1176 CA LYS A 74 1.134 -5.682 -3.640 1.00 0.00 C ATOM 1177 C LYS A 74 1.998 -5.562 -4.886 1.00 0.00 C ATOM 1178 O LYS A 74 2.844 -6.424 -5.125 1.00 0.00 O ATOM 1179 CB LYS A 74 -0.160 -6.447 -3.925 1.00 0.00 C ATOM 1180 CG LYS A 74 -1.196 -5.718 -4.807 1.00 0.00 C ATOM 1181 CD LYS A 74 -1.980 -6.802 -5.573 1.00 0.00 C ATOM 1182 CE LYS A 74 -2.884 -6.316 -6.711 1.00 0.00 C ATOM 1183 NZ LYS A 74 -3.320 -7.448 -7.573 1.00 0.00 N ATOM 0 H LYS A 74 -0.179 -4.305 -2.809 1.00 0.00 H new ATOM 0 HA LYS A 74 1.746 -6.241 -2.932 1.00 0.00 H new ATOM 0 HB2 LYS A 74 0.097 -7.391 -4.406 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.631 -6.692 -2.973 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -1.868 -5.116 -4.195 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -0.701 -5.038 -5.500 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -1.264 -7.513 -5.986 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -2.595 -7.348 -4.858 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -3.758 -5.814 -6.296 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -2.351 -5.581 -7.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -3.931 -7.089 -8.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -2.486 -7.910 -7.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -3.849 -8.137 -7.001 1.00 0.00 H new ATOM 1197 N TYR A 75 1.772 -4.517 -5.678 1.00 0.00 N ATOM 1198 CA TYR A 75 2.499 -4.276 -6.900 1.00 0.00 C ATOM 1199 C TYR A 75 3.959 -3.963 -6.565 1.00 0.00 C ATOM 1200 O TYR A 75 4.848 -4.628 -7.097 1.00 0.00 O ATOM 1201 CB TYR A 75 1.755 -3.177 -7.667 1.00 0.00 C ATOM 1202 CG TYR A 75 2.392 -2.685 -8.957 1.00 0.00 C ATOM 1203 CD1 TYR A 75 3.010 -3.607 -9.822 1.00 0.00 C ATOM 1204 CD2 TYR A 75 2.311 -1.326 -9.338 1.00 0.00 C ATOM 1205 CE1 TYR A 75 3.516 -3.197 -11.063 1.00 0.00 C ATOM 1206 CE2 TYR A 75 2.811 -0.911 -10.586 1.00 0.00 C ATOM 1207 CZ TYR A 75 3.403 -1.850 -11.465 1.00 0.00 C ATOM 1208 OH TYR A 75 3.860 -1.503 -12.705 1.00 0.00 O ATOM 0 H TYR A 75 1.066 -3.809 -5.477 1.00 0.00 H new ATOM 0 HA TYR A 75 2.540 -5.147 -7.554 1.00 0.00 H new ATOM 0 HB2 TYR A 75 0.756 -3.544 -7.901 1.00 0.00 H new ATOM 0 HB3 TYR A 75 1.633 -2.322 -7.002 1.00 0.00 H new ATOM 0 HD1 TYR A 75 3.095 -4.642 -9.526 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.864 -0.605 -8.670 1.00 0.00 H new ATOM 0 HE1 TYR A 75 3.994 -3.915 -11.713 1.00 0.00 H new ATOM 0 HE2 TYR A 75 2.743 0.128 -10.875 1.00 0.00 H new ATOM 0 HH TYR A 75 3.105 -1.443 -13.327 1.00 0.00 H new ATOM 1218 N ALA A 76 4.210 -3.005 -5.666 1.00 0.00 N ATOM 1219 CA ALA A 76 5.557 -2.635 -5.245 1.00 0.00 C ATOM 1220 C ALA A 76 6.244 -3.732 -4.411 1.00 0.00 C ATOM 1221 O ALA A 76 7.449 -3.926 -4.547 1.00 0.00 O ATOM 1222 CB ALA A 76 5.496 -1.325 -4.451 1.00 0.00 C ATOM 0 H ALA A 76 3.476 -2.463 -5.210 1.00 0.00 H new ATOM 0 HA ALA A 76 6.160 -2.505 -6.144 1.00 0.00 H new ATOM 0 HB1 ALA A 76 6.501 -1.044 -4.134 1.00 0.00 H new ATOM 0 HB2 ALA A 76 5.081 -0.537 -5.080 1.00 0.00 H new ATOM 0 HB3 ALA A 76 4.863 -1.460 -3.574 1.00 0.00 H new ATOM 1228 N VAL A 77 5.510 -4.474 -3.571 1.00 0.00 N ATOM 1229 CA VAL A 77 6.063 -5.512 -2.688 1.00 0.00 C ATOM 1230 C VAL A 77 6.936 -6.491 -3.476 1.00 0.00 C ATOM 1231 O VAL A 77 8.060 -6.777 -3.069 1.00 0.00 O ATOM 1232 CB VAL A 77 4.942 -6.224 -1.901 1.00 0.00 C ATOM 1233 CG1 VAL A 77 5.503 -7.416 -1.125 1.00 0.00 C ATOM 1234 CG2 VAL A 77 4.317 -5.313 -0.837 1.00 0.00 C ATOM 0 H VAL A 77 4.499 -4.369 -3.484 1.00 0.00 H new ATOM 0 HA VAL A 77 6.709 -5.032 -1.953 1.00 0.00 H new ATOM 0 HB VAL A 77 4.203 -6.521 -2.646 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.698 -7.905 -0.577 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.951 -8.125 -1.821 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.261 -7.069 -0.423 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.533 -5.856 -0.308 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.084 -5.002 -0.128 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.889 -4.433 -1.317 1.00 0.00 H new ATOM 1244 N GLY A 78 6.461 -6.948 -4.632 1.00 0.00 N ATOM 1245 CA GLY A 78 7.121 -7.974 -5.430 1.00 0.00 C ATOM 1246 C GLY A 78 8.297 -7.458 -6.265 1.00 0.00 C ATOM 1247 O GLY A 78 8.717 -8.136 -7.209 1.00 0.00 O ATOM 0 H GLY A 78 5.592 -6.609 -5.046 1.00 0.00 H new ATOM 0 HA2 GLY A 78 7.479 -8.761 -4.766 1.00 0.00 H new ATOM 0 HA3 GLY A 78 6.388 -8.428 -6.097 1.00 0.00 H new ATOM 1251 N LYS A 79 8.785 -6.242 -5.994 1.00 0.00 N ATOM 1252 CA LYS A 79 9.755 -5.510 -6.810 1.00 0.00 C ATOM 1253 C LYS A 79 10.760 -4.730 -5.959 1.00 0.00 C ATOM 1254 O LYS A 79 11.953 -4.733 -6.249 1.00 0.00 O ATOM 1255 CB LYS A 79 8.990 -4.524 -7.699 1.00 0.00 C ATOM 1256 CG LYS A 79 8.128 -5.178 -8.772 1.00 0.00 C ATOM 1257 CD LYS A 79 7.397 -4.099 -9.582 1.00 0.00 C ATOM 1258 CE LYS A 79 6.685 -4.708 -10.794 1.00 0.00 C ATOM 1259 NZ LYS A 79 7.604 -5.415 -11.715 1.00 0.00 N ATOM 0 H LYS A 79 8.501 -5.721 -5.164 1.00 0.00 H new ATOM 0 HA LYS A 79 10.315 -6.234 -7.401 1.00 0.00 H new ATOM 0 HB2 LYS A 79 8.354 -3.904 -7.068 1.00 0.00 H new ATOM 0 HB3 LYS A 79 9.706 -3.859 -8.182 1.00 0.00 H new ATOM 0 HG2 LYS A 79 8.750 -5.782 -9.432 1.00 0.00 H new ATOM 0 HG3 LYS A 79 7.405 -5.851 -8.310 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.671 -3.592 -8.946 1.00 0.00 H new ATOM 0 HD3 LYS A 79 8.110 -3.345 -9.916 1.00 0.00 H new ATOM 0 HE2 LYS A 79 5.922 -5.404 -10.447 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.170 -3.917 -11.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.143 -5.536 -12.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 8.474 -4.858 -11.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 7.840 -6.348 -11.321 1.00 0.00 H new ATOM 1273 N SER A 80 10.276 -4.036 -4.934 1.00 0.00 N ATOM 1274 CA SER A 80 10.987 -3.014 -4.186 1.00 0.00 C ATOM 1275 C SER A 80 12.282 -3.523 -3.529 1.00 0.00 C ATOM 1276 O SER A 80 13.287 -2.812 -3.537 1.00 0.00 O ATOM 1277 CB SER A 80 9.961 -2.476 -3.189 1.00 0.00 C ATOM 1278 OG SER A 80 10.471 -1.452 -2.383 1.00 0.00 O ATOM 0 H SER A 80 9.328 -4.182 -4.588 1.00 0.00 H new ATOM 0 HA SER A 80 11.357 -2.224 -4.839 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.093 -2.105 -3.733 1.00 0.00 H new ATOM 0 HB3 SER A 80 9.615 -3.292 -2.555 1.00 0.00 H new ATOM 0 HG SER A 80 11.215 -1.797 -1.847 1.00 0.00 H new ATOM 1284 N GLY A 81 12.306 -4.752 -3.003 1.00 0.00 N ATOM 1285 CA GLY A 81 13.458 -5.345 -2.327 1.00 0.00 C ATOM 1286 C GLY A 81 13.076 -5.909 -0.962 1.00 0.00 C ATOM 1287 O GLY A 81 11.962 -5.681 -0.473 1.00 0.00 O ATOM 0 H GLY A 81 11.501 -5.377 -3.038 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.875 -6.139 -2.946 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.237 -4.592 -2.206 1.00 0.00 H new ATOM 1291 N SER A 82 13.987 -6.667 -0.346 1.00 0.00 N ATOM 1292 CA SER A 82 13.742 -7.278 0.952 1.00 0.00 C ATOM 1293 C SER A 82 13.494 -6.209 2.017 1.00 0.00 C ATOM 1294 O SER A 82 12.571 -6.352 2.813 1.00 0.00 O ATOM 1295 CB SER A 82 14.875 -8.247 1.324 1.00 0.00 C ATOM 1296 OG SER A 82 16.166 -7.695 1.147 1.00 0.00 O ATOM 0 H SER A 82 14.908 -6.870 -0.735 1.00 0.00 H new ATOM 0 HA SER A 82 12.832 -7.875 0.895 1.00 0.00 H new ATOM 0 HB2 SER A 82 14.757 -8.550 2.364 1.00 0.00 H new ATOM 0 HB3 SER A 82 14.787 -9.148 0.717 1.00 0.00 H new ATOM 0 HG SER A 82 16.095 -6.723 1.044 1.00 0.00 H new ATOM 1302 N GLU A 83 14.225 -5.098 1.981 1.00 0.00 N ATOM 1303 CA GLU A 83 14.140 -3.997 2.933 1.00 0.00 C ATOM 1304 C GLU A 83 12.688 -3.529 3.084 1.00 0.00 C ATOM 1305 O GLU A 83 12.196 -3.354 4.200 1.00 0.00 O ATOM 1306 CB GLU A 83 15.035 -2.834 2.463 1.00 0.00 C ATOM 1307 CG GLU A 83 16.546 -3.099 2.613 1.00 0.00 C ATOM 1308 CD GLU A 83 17.179 -4.048 1.582 1.00 0.00 C ATOM 1309 OE1 GLU A 83 16.538 -4.499 0.611 1.00 0.00 O ATOM 1310 OE2 GLU A 83 18.372 -4.399 1.781 1.00 0.00 O ATOM 0 H GLU A 83 14.923 -4.935 1.255 1.00 0.00 H new ATOM 0 HA GLU A 83 14.489 -4.342 3.906 1.00 0.00 H new ATOM 0 HB2 GLU A 83 14.817 -2.623 1.416 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.776 -1.939 3.030 1.00 0.00 H new ATOM 0 HG2 GLU A 83 17.067 -2.143 2.563 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.724 -3.507 3.608 1.00 0.00 H new ATOM 1317 N PHE A 84 11.995 -3.339 1.958 1.00 0.00 N ATOM 1318 CA PHE A 84 10.589 -2.953 1.938 1.00 0.00 C ATOM 1319 C PHE A 84 9.665 -4.118 2.268 1.00 0.00 C ATOM 1320 O PHE A 84 8.615 -3.897 2.882 1.00 0.00 O ATOM 1321 CB PHE A 84 10.252 -2.385 0.559 1.00 0.00 C ATOM 1322 CG PHE A 84 8.795 -2.004 0.360 1.00 0.00 C ATOM 1323 CD1 PHE A 84 8.274 -0.813 0.904 1.00 0.00 C ATOM 1324 CD2 PHE A 84 7.948 -2.856 -0.374 1.00 0.00 C ATOM 1325 CE1 PHE A 84 6.938 -0.452 0.667 1.00 0.00 C ATOM 1326 CE2 PHE A 84 6.607 -2.501 -0.595 1.00 0.00 C ATOM 1327 CZ PHE A 84 6.102 -1.291 -0.088 1.00 0.00 C ATOM 0 H PHE A 84 12.401 -3.451 1.029 1.00 0.00 H new ATOM 0 HA PHE A 84 10.432 -2.198 2.708 1.00 0.00 H new ATOM 0 HB2 PHE A 84 10.869 -1.504 0.385 1.00 0.00 H new ATOM 0 HB3 PHE A 84 10.526 -3.121 -0.197 1.00 0.00 H new ATOM 0 HD1 PHE A 84 8.905 -0.175 1.506 1.00 0.00 H new ATOM 0 HD2 PHE A 84 8.331 -3.786 -0.769 1.00 0.00 H new ATOM 0 HE1 PHE A 84 6.552 0.474 1.067 1.00 0.00 H new ATOM 0 HE2 PHE A 84 5.962 -3.160 -1.157 1.00 0.00 H new ATOM 0 HZ PHE A 84 5.077 -1.008 -0.278 1.00 0.00 H new ATOM 1337 N ARG A 85 9.999 -5.345 1.836 1.00 0.00 N ATOM 1338 CA ARG A 85 9.081 -6.461 2.038 1.00 0.00 C ATOM 1339 C ARG A 85 8.880 -6.616 3.537 1.00 0.00 C ATOM 1340 O ARG A 85 7.740 -6.734 3.971 1.00 0.00 O ATOM 1341 CB ARG A 85 9.493 -7.751 1.274 1.00 0.00 C ATOM 1342 CG ARG A 85 10.332 -8.788 2.048 1.00 0.00 C ATOM 1343 CD ARG A 85 10.947 -9.895 1.174 1.00 0.00 C ATOM 1344 NE ARG A 85 10.031 -11.021 0.912 1.00 0.00 N ATOM 1345 CZ ARG A 85 10.397 -12.287 0.650 1.00 0.00 C ATOM 1346 NH1 ARG A 85 11.684 -12.597 0.556 1.00 0.00 N ATOM 1347 NH2 ARG A 85 9.489 -13.246 0.472 1.00 0.00 N ATOM 0 H ARG A 85 10.871 -5.579 1.360 1.00 0.00 H new ATOM 0 HA ARG A 85 8.112 -6.249 1.585 1.00 0.00 H new ATOM 0 HB2 ARG A 85 8.585 -8.243 0.926 1.00 0.00 H new ATOM 0 HB3 ARG A 85 10.055 -7.455 0.388 1.00 0.00 H new ATOM 0 HG2 ARG A 85 11.135 -8.269 2.572 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.703 -9.251 2.808 1.00 0.00 H new ATOM 0 HD2 ARG A 85 11.259 -9.463 0.223 1.00 0.00 H new ATOM 0 HD3 ARG A 85 11.845 -10.274 1.662 1.00 0.00 H new ATOM 0 HE ARG A 85 9.031 -10.821 0.931 1.00 0.00 H new ATOM 0 HH11 ARG A 85 12.393 -11.875 0.683 1.00 0.00 H new ATOM 0 HH12 ARG A 85 11.964 -13.557 0.357 1.00 0.00 H new ATOM 0 HH21 ARG A 85 8.495 -13.025 0.534 1.00 0.00 H new ATOM 0 HH22 ARG A 85 9.788 -14.201 0.274 1.00 0.00 H new ATOM 1361 N ARG A 86 9.947 -6.556 4.337 1.00 0.00 N ATOM 1362 CA ARG A 86 9.844 -6.754 5.777 1.00 0.00 C ATOM 1363 C ARG A 86 9.038 -5.651 6.455 1.00 0.00 C ATOM 1364 O ARG A 86 8.231 -5.977 7.317 1.00 0.00 O ATOM 1365 CB ARG A 86 11.233 -6.858 6.416 1.00 0.00 C ATOM 1366 CG ARG A 86 12.166 -7.905 5.794 1.00 0.00 C ATOM 1367 CD ARG A 86 11.553 -9.306 5.704 1.00 0.00 C ATOM 1368 NE ARG A 86 12.472 -10.236 5.036 1.00 0.00 N ATOM 1369 CZ ARG A 86 13.667 -10.667 5.451 1.00 0.00 C ATOM 1370 NH1 ARG A 86 14.072 -10.485 6.705 1.00 0.00 N ATOM 1371 NH2 ARG A 86 14.446 -11.304 4.585 1.00 0.00 N ATOM 0 H ARG A 86 10.894 -6.371 4.006 1.00 0.00 H new ATOM 0 HA ARG A 86 9.312 -7.693 5.927 1.00 0.00 H new ATOM 0 HB2 ARG A 86 11.716 -5.883 6.355 1.00 0.00 H new ATOM 0 HB3 ARG A 86 11.111 -7.088 7.475 1.00 0.00 H new ATOM 0 HG2 ARG A 86 12.448 -7.577 4.793 1.00 0.00 H new ATOM 0 HG3 ARG A 86 13.082 -7.957 6.383 1.00 0.00 H new ATOM 0 HD2 ARG A 86 11.322 -9.672 6.705 1.00 0.00 H new ATOM 0 HD3 ARG A 86 10.612 -9.261 5.156 1.00 0.00 H new ATOM 0 HE ARG A 86 12.157 -10.601 4.137 1.00 0.00 H new ATOM 0 HH11 ARG A 86 13.466 -10.008 7.372 1.00 0.00 H new ATOM 0 HH12 ARG A 86 14.988 -10.823 6.999 1.00 0.00 H new ATOM 0 HH21 ARG A 86 14.128 -11.455 3.628 1.00 0.00 H new ATOM 0 HH22 ARG A 86 15.363 -11.643 4.877 1.00 0.00 H new ATOM 1385 N GLU A 87 9.194 -4.373 6.092 1.00 0.00 N ATOM 1386 CA GLU A 87 8.407 -3.319 6.745 1.00 0.00 C ATOM 1387 C GLU A 87 6.907 -3.535 6.487 1.00 0.00 C ATOM 1388 O GLU A 87 6.090 -3.382 7.397 1.00 0.00 O ATOM 1389 CB GLU A 87 8.858 -1.915 6.304 1.00 0.00 C ATOM 1390 CG GLU A 87 10.268 -1.534 6.790 1.00 0.00 C ATOM 1391 CD GLU A 87 10.438 -1.598 8.318 1.00 0.00 C ATOM 1392 OE1 GLU A 87 9.940 -0.708 9.040 1.00 0.00 O ATOM 1393 OE2 GLU A 87 11.122 -2.529 8.803 1.00 0.00 O ATOM 0 H GLU A 87 9.838 -4.048 5.371 1.00 0.00 H new ATOM 0 HA GLU A 87 8.582 -3.383 7.819 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.832 -1.860 5.216 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.144 -1.180 6.677 1.00 0.00 H new ATOM 0 HG2 GLU A 87 10.995 -2.200 6.325 1.00 0.00 H new ATOM 0 HG3 GLU A 87 10.498 -0.524 6.450 1.00 0.00 H new ATOM 1400 N MET A 88 6.544 -3.953 5.270 1.00 0.00 N ATOM 1401 CA MET A 88 5.171 -4.317 4.932 1.00 0.00 C ATOM 1402 C MET A 88 4.699 -5.535 5.745 1.00 0.00 C ATOM 1403 O MET A 88 3.565 -5.521 6.217 1.00 0.00 O ATOM 1404 CB MET A 88 5.060 -4.562 3.424 1.00 0.00 C ATOM 1405 CG MET A 88 5.122 -3.272 2.615 1.00 0.00 C ATOM 1406 SD MET A 88 3.564 -2.352 2.680 1.00 0.00 S ATOM 1407 CE MET A 88 4.203 -0.771 3.243 1.00 0.00 C ATOM 0 H MET A 88 7.198 -4.047 4.493 1.00 0.00 H new ATOM 0 HA MET A 88 4.511 -3.491 5.196 1.00 0.00 H new ATOM 0 HB2 MET A 88 5.865 -5.224 3.107 1.00 0.00 H new ATOM 0 HB3 MET A 88 4.122 -5.075 3.211 1.00 0.00 H new ATOM 0 HG2 MET A 88 5.929 -2.645 2.994 1.00 0.00 H new ATOM 0 HG3 MET A 88 5.361 -3.506 1.578 1.00 0.00 H new ATOM 0 HE1 MET A 88 3.379 -0.067 3.362 1.00 0.00 H new ATOM 0 HE2 MET A 88 4.709 -0.903 4.200 1.00 0.00 H new ATOM 0 HE3 MET A 88 4.910 -0.382 2.510 1.00 0.00 H new ATOM 1417 N GLN A 89 5.535 -6.568 5.954 1.00 0.00 N ATOM 1418 CA GLN A 89 5.227 -7.705 6.831 1.00 0.00 C ATOM 1419 C GLN A 89 4.950 -7.228 8.258 1.00 0.00 C ATOM 1420 O GLN A 89 3.875 -7.496 8.796 1.00 0.00 O ATOM 1421 CB GLN A 89 6.359 -8.749 6.824 1.00 0.00 C ATOM 1422 CG GLN A 89 6.563 -9.429 5.479 1.00 0.00 C ATOM 1423 CD GLN A 89 7.659 -10.493 5.514 1.00 0.00 C ATOM 1424 OE1 GLN A 89 8.217 -10.864 6.543 1.00 0.00 O ATOM 1425 NE2 GLN A 89 8.021 -10.988 4.355 1.00 0.00 N ATOM 0 H GLN A 89 6.452 -6.635 5.513 1.00 0.00 H new ATOM 0 HA GLN A 89 4.329 -8.185 6.442 1.00 0.00 H new ATOM 0 HB2 GLN A 89 7.289 -8.264 7.119 1.00 0.00 H new ATOM 0 HB3 GLN A 89 6.144 -9.509 7.575 1.00 0.00 H new ATOM 0 HG2 GLN A 89 5.626 -9.889 5.164 1.00 0.00 H new ATOM 0 HG3 GLN A 89 6.816 -8.677 4.732 1.00 0.00 H new ATOM 0 HE21 GLN A 89 7.557 -10.679 3.501 1.00 0.00 H new ATOM 0 HE22 GLN A 89 8.767 -11.682 4.307 1.00 0.00 H new ATOM 1434 N ARG A 90 5.890 -6.495 8.867 1.00 0.00 N ATOM 1435 CA ARG A 90 5.788 -6.025 10.251 1.00 0.00 C ATOM 1436 C ARG A 90 4.466 -5.308 10.497 1.00 0.00 C ATOM 1437 O ARG A 90 3.837 -5.548 11.530 1.00 0.00 O ATOM 1438 CB ARG A 90 6.967 -5.100 10.608 1.00 0.00 C ATOM 1439 CG ARG A 90 8.305 -5.847 10.716 1.00 0.00 C ATOM 1440 CD ARG A 90 9.426 -4.894 11.128 1.00 0.00 C ATOM 1441 NE ARG A 90 10.703 -5.600 11.329 1.00 0.00 N ATOM 1442 CZ ARG A 90 11.834 -5.030 11.764 1.00 0.00 C ATOM 1443 NH1 ARG A 90 11.856 -3.759 12.150 1.00 0.00 N ATOM 1444 NH2 ARG A 90 12.965 -5.729 11.820 1.00 0.00 N ATOM 0 H ARG A 90 6.753 -6.209 8.405 1.00 0.00 H new ATOM 0 HA ARG A 90 5.826 -6.903 10.896 1.00 0.00 H new ATOM 0 HB2 ARG A 90 7.052 -4.321 9.851 1.00 0.00 H new ATOM 0 HB3 ARG A 90 6.757 -4.603 11.555 1.00 0.00 H new ATOM 0 HG2 ARG A 90 8.219 -6.652 11.446 1.00 0.00 H new ATOM 0 HG3 ARG A 90 8.547 -6.309 9.759 1.00 0.00 H new ATOM 0 HD2 ARG A 90 9.551 -4.129 10.362 1.00 0.00 H new ATOM 0 HD3 ARG A 90 9.146 -4.381 12.048 1.00 0.00 H new ATOM 0 HE ARG A 90 10.728 -6.598 11.121 1.00 0.00 H new ATOM 0 HH11 ARG A 90 11.003 -3.201 12.118 1.00 0.00 H new ATOM 0 HH12 ARG A 90 12.726 -3.341 12.479 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.975 -6.707 11.530 1.00 0.00 H new ATOM 0 HH22 ARG A 90 13.822 -5.287 12.153 1.00 0.00 H new ATOM 1458 N ASN A 91 4.022 -4.473 9.556 1.00 0.00 N ATOM 1459 CA ASN A 91 2.868 -3.593 9.741 1.00 0.00 C ATOM 1460 C ASN A 91 1.655 -4.070 8.933 1.00 0.00 C ATOM 1461 O ASN A 91 0.707 -3.314 8.722 1.00 0.00 O ATOM 1462 CB ASN A 91 3.276 -2.132 9.473 1.00 0.00 C ATOM 1463 CG ASN A 91 4.489 -1.733 10.310 1.00 0.00 C ATOM 1464 OD1 ASN A 91 5.486 -1.072 9.744 1.00 0.00 O flip ATOM 1465 ND2 ASN A 91 4.574 -2.095 11.479 1.00 0.00 N flip ATOM 0 H ASN A 91 4.457 -4.388 8.637 1.00 0.00 H new ATOM 0 HA ASN A 91 2.538 -3.638 10.779 1.00 0.00 H new ATOM 0 HB2 ASN A 91 3.504 -2.004 8.415 1.00 0.00 H new ATOM 0 HB3 ASN A 91 2.440 -1.471 9.702 1.00 0.00 H new ATOM 0 HD21 ASN A 91 3.804 -2.604 11.912 1.00 0.00 H new ATOM 0 HD22 ASN A 91 5.415 -1.887 12.018 1.00 0.00 H new ATOM 1472 N SER A 92 1.650 -5.337 8.501 1.00 0.00 N ATOM 1473 CA SER A 92 0.608 -5.947 7.678 1.00 0.00 C ATOM 1474 C SER A 92 -0.794 -5.880 8.297 1.00 0.00 C ATOM 1475 O SER A 92 -1.794 -5.967 7.578 1.00 0.00 O ATOM 1476 CB SER A 92 0.997 -7.404 7.405 1.00 0.00 C ATOM 1477 OG SER A 92 0.957 -8.203 8.578 1.00 0.00 O ATOM 0 H SER A 92 2.403 -5.988 8.726 1.00 0.00 H new ATOM 0 HA SER A 92 0.546 -5.373 6.753 1.00 0.00 H new ATOM 0 HB2 SER A 92 0.322 -7.824 6.659 1.00 0.00 H new ATOM 0 HB3 SER A 92 2.001 -7.436 6.981 1.00 0.00 H new ATOM 0 HG SER A 92 1.845 -8.222 8.991 1.00 0.00 H new ATOM 1483 N VAL A 93 -0.886 -5.724 9.619 1.00 0.00 N ATOM 1484 CA VAL A 93 -2.140 -5.671 10.353 1.00 0.00 C ATOM 1485 C VAL A 93 -3.096 -4.625 9.798 1.00 0.00 C ATOM 1486 O VAL A 93 -4.298 -4.875 9.781 1.00 0.00 O ATOM 1487 CB VAL A 93 -1.866 -5.450 11.848 1.00 0.00 C ATOM 1488 CG1 VAL A 93 -1.043 -4.186 12.144 1.00 0.00 C ATOM 1489 CG2 VAL A 93 -3.149 -5.472 12.688 1.00 0.00 C ATOM 0 H VAL A 93 -0.066 -5.629 10.219 1.00 0.00 H new ATOM 0 HA VAL A 93 -2.639 -6.632 10.227 1.00 0.00 H new ATOM 0 HB VAL A 93 -1.252 -6.300 12.146 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -0.889 -4.096 13.219 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -0.077 -4.255 11.644 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -1.578 -3.309 11.779 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.900 -5.311 13.737 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -3.819 -4.682 12.349 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -3.641 -6.438 12.576 1.00 0.00 H new ATOM 1499 N ALA A 94 -2.581 -3.489 9.323 1.00 0.00 N ATOM 1500 CA ALA A 94 -3.424 -2.389 8.891 1.00 0.00 C ATOM 1501 C ALA A 94 -4.344 -2.834 7.745 1.00 0.00 C ATOM 1502 O ALA A 94 -5.500 -2.431 7.646 1.00 0.00 O ATOM 1503 CB ALA A 94 -2.516 -1.237 8.448 1.00 0.00 C ATOM 0 H ALA A 94 -1.581 -3.313 9.230 1.00 0.00 H new ATOM 0 HA ALA A 94 -4.062 -2.060 9.711 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -3.128 -0.397 8.118 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -1.891 -0.924 9.284 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -1.882 -1.569 7.626 1.00 0.00 H new ATOM 1509 N VAL A 95 -3.813 -3.691 6.874 1.00 0.00 N ATOM 1510 CA VAL A 95 -4.512 -4.334 5.777 1.00 0.00 C ATOM 1511 C VAL A 95 -5.417 -5.428 6.342 1.00 0.00 C ATOM 1512 O VAL A 95 -6.605 -5.467 6.037 1.00 0.00 O ATOM 1513 CB VAL A 95 -3.446 -4.896 4.817 1.00 0.00 C ATOM 1514 CG1 VAL A 95 -4.030 -5.740 3.686 1.00 0.00 C ATOM 1515 CG2 VAL A 95 -2.594 -3.764 4.235 1.00 0.00 C ATOM 0 H VAL A 95 -2.832 -3.966 6.923 1.00 0.00 H new ATOM 0 HA VAL A 95 -5.147 -3.638 5.228 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.822 -5.560 5.416 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.223 -6.103 3.049 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.570 -6.588 4.107 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.714 -5.132 3.094 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -1.847 -4.181 3.560 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.233 -3.072 3.686 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.094 -3.232 5.044 1.00 0.00 H new ATOM 1525 N ARG A 96 -4.856 -6.334 7.145 1.00 0.00 N ATOM 1526 CA ARG A 96 -5.545 -7.515 7.673 1.00 0.00 C ATOM 1527 C ARG A 96 -6.822 -7.138 8.420 1.00 0.00 C ATOM 1528 O ARG A 96 -7.846 -7.798 8.275 1.00 0.00 O ATOM 1529 CB ARG A 96 -4.571 -8.275 8.580 1.00 0.00 C ATOM 1530 CG ARG A 96 -3.498 -8.998 7.773 1.00 0.00 C ATOM 1531 CD ARG A 96 -2.215 -9.349 8.520 1.00 0.00 C ATOM 1532 NE ARG A 96 -2.382 -10.401 9.526 1.00 0.00 N ATOM 1533 CZ ARG A 96 -1.370 -10.870 10.267 1.00 0.00 C ATOM 1534 NH1 ARG A 96 -0.160 -10.328 10.174 1.00 0.00 N ATOM 1535 NH2 ARG A 96 -1.566 -11.882 11.100 1.00 0.00 N ATOM 0 H ARG A 96 -3.886 -6.266 7.454 1.00 0.00 H new ATOM 0 HA ARG A 96 -5.854 -8.154 6.846 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -4.098 -7.578 9.272 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -5.122 -8.997 9.182 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -3.928 -9.919 7.379 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -3.237 -8.377 6.917 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -1.462 -9.666 7.799 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -1.833 -8.452 9.007 1.00 0.00 H new ATOM 0 HE ARG A 96 -3.312 -10.794 9.669 1.00 0.00 H new ATOM 0 HH11 ARG A 96 0.002 -9.550 9.535 1.00 0.00 H new ATOM 0 HH12 ARG A 96 0.606 -10.690 10.742 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -2.490 -12.306 11.178 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -0.793 -12.236 11.663 1.00 0.00 H new ATOM 1549 N ASN A 97 -6.788 -6.050 9.185 1.00 0.00 N ATOM 1550 CA ASN A 97 -7.929 -5.522 9.919 1.00 0.00 C ATOM 1551 C ASN A 97 -9.114 -5.182 9.002 1.00 0.00 C ATOM 1552 O ASN A 97 -10.268 -5.242 9.437 1.00 0.00 O ATOM 1553 CB ASN A 97 -7.469 -4.278 10.690 1.00 0.00 C ATOM 1554 CG ASN A 97 -8.634 -3.634 11.427 1.00 0.00 C ATOM 1555 OD1 ASN A 97 -9.141 -2.593 11.021 1.00 0.00 O ATOM 1556 ND2 ASN A 97 -9.122 -4.246 12.491 1.00 0.00 N ATOM 0 H ASN A 97 -5.940 -5.497 9.313 1.00 0.00 H new ATOM 0 HA ASN A 97 -8.287 -6.290 10.605 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -6.691 -4.554 11.402 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -7.029 -3.559 9.999 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -9.926 -3.854 12.981 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -8.695 -5.111 12.822 1.00 0.00 H new ATOM 1563 N LEU A 98 -8.849 -4.820 7.743 1.00 0.00 N ATOM 1564 CA LEU A 98 -9.853 -4.436 6.758 1.00 0.00 C ATOM 1565 C LEU A 98 -10.457 -5.619 6.008 1.00 0.00 C ATOM 1566 O LEU A 98 -11.403 -5.376 5.263 1.00 0.00 O ATOM 1567 CB LEU A 98 -9.255 -3.460 5.728 1.00 0.00 C ATOM 1568 CG LEU A 98 -8.781 -2.089 6.242 1.00 0.00 C ATOM 1569 CD1 LEU A 98 -7.995 -1.409 5.131 1.00 0.00 C ATOM 1570 CD2 LEU A 98 -9.953 -1.227 6.717 1.00 0.00 C ATOM 0 H LEU A 98 -7.899 -4.787 7.374 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.652 -3.961 7.327 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -8.407 -3.952 5.251 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.002 -3.289 4.953 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.138 -2.227 7.112 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.649 -0.434 5.474 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -7.137 -2.025 4.863 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.636 -1.280 4.259 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.578 -0.267 7.072 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -10.643 -1.063 5.889 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.474 -1.736 7.528 1.00 0.00 H new ATOM 1582 N PHE A 99 -10.018 -6.866 6.229 1.00 0.00 N ATOM 1583 CA PHE A 99 -10.625 -8.065 5.623 1.00 0.00 C ATOM 1584 C PHE A 99 -12.144 -8.080 5.802 1.00 0.00 C ATOM 1585 O PHE A 99 -12.884 -8.624 4.981 1.00 0.00 O ATOM 1586 CB PHE A 99 -10.054 -9.333 6.283 1.00 0.00 C ATOM 1587 CG PHE A 99 -8.767 -9.883 5.698 1.00 0.00 C ATOM 1588 CD1 PHE A 99 -7.742 -9.032 5.242 1.00 0.00 C ATOM 1589 CD2 PHE A 99 -8.607 -11.277 5.590 1.00 0.00 C ATOM 1590 CE1 PHE A 99 -6.572 -9.572 4.687 1.00 0.00 C ATOM 1591 CE2 PHE A 99 -7.435 -11.815 5.031 1.00 0.00 C ATOM 1592 CZ PHE A 99 -6.411 -10.963 4.588 1.00 0.00 C ATOM 0 H PHE A 99 -9.226 -7.075 6.837 1.00 0.00 H new ATOM 0 HA PHE A 99 -10.391 -8.042 4.559 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -9.885 -9.121 7.339 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -10.812 -10.114 6.232 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.857 -7.961 5.320 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -9.388 -11.936 5.938 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.791 -8.914 4.334 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -7.322 -12.885 4.942 1.00 0.00 H new ATOM 0 HZ PHE A 99 -5.503 -11.376 4.173 1.00 0.00 H new ATOM 1602 N HIS A 100 -12.614 -7.471 6.893 1.00 0.00 N ATOM 1603 CA HIS A 100 -14.005 -7.456 7.294 1.00 0.00 C ATOM 1604 C HIS A 100 -14.539 -6.030 7.444 1.00 0.00 C ATOM 1605 O HIS A 100 -15.527 -5.807 8.151 1.00 0.00 O ATOM 1606 CB HIS A 100 -14.153 -8.320 8.550 1.00 0.00 C ATOM 1607 CG HIS A 100 -13.504 -9.686 8.440 1.00 0.00 C ATOM 1608 ND1 HIS A 100 -13.810 -10.658 7.514 1.00 0.00 N ATOM 1609 CD2 HIS A 100 -12.434 -10.139 9.164 1.00 0.00 C ATOM 1610 CE1 HIS A 100 -12.959 -11.679 7.684 1.00 0.00 C ATOM 1611 NE2 HIS A 100 -12.116 -11.424 8.704 1.00 0.00 N ATOM 0 H HIS A 100 -12.009 -6.961 7.537 1.00 0.00 H new ATOM 0 HA HIS A 100 -14.631 -7.891 6.515 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -13.717 -7.789 9.397 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -15.213 -8.449 8.766 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -11.925 -9.601 9.950 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -12.950 -12.579 7.088 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -11.391 -12.043 9.068 1.00 0.00 H new ATOM 1619 N TYR A 101 -13.884 -5.058 6.796 1.00 0.00 N ATOM 1620 CA TYR A 101 -14.363 -3.688 6.747 1.00 0.00 C ATOM 1621 C TYR A 101 -15.663 -3.653 5.952 1.00 0.00 C ATOM 1622 O TYR A 101 -15.796 -4.327 4.925 1.00 0.00 O ATOM 1623 CB TYR A 101 -13.312 -2.763 6.117 1.00 0.00 C ATOM 1624 CG TYR A 101 -13.836 -1.361 5.871 1.00 0.00 C ATOM 1625 CD1 TYR A 101 -14.245 -0.562 6.955 1.00 0.00 C ATOM 1626 CD2 TYR A 101 -14.041 -0.909 4.556 1.00 0.00 C ATOM 1627 CE1 TYR A 101 -14.927 0.646 6.726 1.00 0.00 C ATOM 1628 CE2 TYR A 101 -14.680 0.320 4.323 1.00 0.00 C ATOM 1629 CZ TYR A 101 -15.183 1.072 5.404 1.00 0.00 C ATOM 1630 OH TYR A 101 -15.890 2.201 5.155 1.00 0.00 O ATOM 0 H TYR A 101 -13.009 -5.208 6.294 1.00 0.00 H new ATOM 0 HA TYR A 101 -14.545 -3.329 7.760 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -12.441 -2.711 6.771 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -12.976 -3.192 5.173 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -14.034 -0.878 7.966 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -13.706 -1.508 3.722 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -15.255 1.248 7.561 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -14.786 0.689 3.314 1.00 0.00 H new ATOM 0 HH TYR A 101 -15.964 2.334 4.187 1.00 0.00 H new ATOM 1640 N LYS A 102 -16.623 -2.855 6.412 1.00 0.00 N ATOM 1641 CA LYS A 102 -17.948 -2.729 5.809 1.00 0.00 C ATOM 1642 C LYS A 102 -18.418 -1.290 5.838 1.00 0.00 C ATOM 1643 O LYS A 102 -18.891 -0.777 4.827 1.00 0.00 O ATOM 1644 CB LYS A 102 -18.944 -3.642 6.525 1.00 0.00 C ATOM 1645 CG LYS A 102 -18.921 -3.536 8.061 1.00 0.00 C ATOM 1646 CD LYS A 102 -19.953 -4.513 8.581 1.00 0.00 C ATOM 1647 CE LYS A 102 -19.929 -4.672 10.098 1.00 0.00 C ATOM 1648 NZ LYS A 102 -20.137 -6.084 10.466 1.00 0.00 N ATOM 0 H LYS A 102 -16.499 -2.264 7.234 1.00 0.00 H new ATOM 0 HA LYS A 102 -17.884 -3.039 4.766 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -19.949 -3.409 6.173 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -18.739 -4.674 6.242 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -17.931 -3.775 8.450 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -19.153 -2.521 8.382 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -20.944 -4.180 8.274 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -19.786 -5.486 8.119 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -18.975 -4.323 10.492 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -20.705 -4.053 10.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -20.119 -6.179 11.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -21.058 -6.405 10.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -19.381 -6.666 10.051 1.00 0.00 H new ATOM 1662 N GLY A 103 -18.228 -0.608 6.961 1.00 0.00 N ATOM 1663 CA GLY A 103 -18.631 0.776 7.082 1.00 0.00 C ATOM 1664 C GLY A 103 -20.155 0.832 7.024 1.00 0.00 C ATOM 1665 O GLY A 103 -20.825 0.228 7.869 1.00 0.00 O ATOM 0 H GLY A 103 -17.796 -0.997 7.799 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -18.270 1.197 8.020 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -18.197 1.371 6.278 1.00 0.00 H new ATOM 1669 N HIS A 104 -20.693 1.566 6.053 1.00 0.00 N ATOM 1670 CA HIS A 104 -22.110 1.896 5.911 1.00 0.00 C ATOM 1671 C HIS A 104 -22.507 1.780 4.431 1.00 0.00 C ATOM 1672 O HIS A 104 -21.617 1.832 3.572 1.00 0.00 O ATOM 1673 CB HIS A 104 -22.315 3.333 6.435 1.00 0.00 C ATOM 1674 CG HIS A 104 -22.002 3.459 7.904 1.00 0.00 C ATOM 1675 ND1 HIS A 104 -20.753 3.634 8.429 1.00 0.00 N flip ATOM 1676 CD2 HIS A 104 -22.882 3.336 8.956 1.00 0.00 C flip ATOM 1677 CE1 HIS A 104 -20.865 3.596 9.823 1.00 0.00 C flip ATOM 1678 NE2 HIS A 104 -22.170 3.419 10.093 1.00 0.00 N flip ATOM 0 H HIS A 104 -20.125 1.967 5.307 1.00 0.00 H new ATOM 0 HA HIS A 104 -22.738 1.212 6.482 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -21.680 4.016 5.871 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -23.347 3.637 6.259 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -23.951 3.198 8.881 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -20.063 3.690 10.540 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -22.565 3.356 11.031 1.00 0.00 H new ATOM 1686 N PRO A 105 -23.809 1.697 4.108 1.00 0.00 N ATOM 1687 CA PRO A 105 -24.291 1.758 2.733 1.00 0.00 C ATOM 1688 C PRO A 105 -24.019 3.134 2.109 1.00 0.00 C ATOM 1689 O PRO A 105 -23.320 3.974 2.683 1.00 0.00 O ATOM 1690 CB PRO A 105 -25.780 1.420 2.822 1.00 0.00 C ATOM 1691 CG PRO A 105 -26.166 1.964 4.190 1.00 0.00 C ATOM 1692 CD PRO A 105 -24.937 1.618 5.028 1.00 0.00 C ATOM 0 HA PRO A 105 -23.776 1.058 2.076 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -26.351 1.893 2.023 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -25.957 0.347 2.748 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -26.353 3.038 4.164 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -27.069 1.492 4.577 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -24.818 2.315 5.857 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -25.023 0.621 5.460 1.00 0.00 H new ATOM 1700 N ASP A 106 -24.520 3.354 0.893 1.00 0.00 N ATOM 1701 CA ASP A 106 -24.214 4.540 0.096 1.00 0.00 C ATOM 1702 C ASP A 106 -25.477 5.030 -0.609 1.00 0.00 C ATOM 1703 O ASP A 106 -26.305 4.180 -0.952 1.00 0.00 O ATOM 1704 CB ASP A 106 -23.176 4.144 -0.960 1.00 0.00 C ATOM 1705 CG ASP A 106 -22.508 5.356 -1.577 1.00 0.00 C ATOM 1706 OD1 ASP A 106 -21.569 5.899 -0.958 1.00 0.00 O ATOM 1707 OD2 ASP A 106 -22.945 5.752 -2.675 1.00 0.00 O ATOM 0 H ASP A 106 -25.157 2.706 0.430 1.00 0.00 H new ATOM 0 HA ASP A 106 -23.833 5.334 0.738 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -22.420 3.505 -0.504 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -23.659 3.558 -1.742 1.00 0.00 H new ATOM 1712 N PRO A 107 -25.626 6.324 -0.948 1.00 0.00 N ATOM 1713 CA PRO A 107 -26.702 6.781 -1.824 1.00 0.00 C ATOM 1714 C PRO A 107 -26.806 6.052 -3.173 1.00 0.00 C ATOM 1715 O PRO A 107 -27.907 6.002 -3.727 1.00 0.00 O ATOM 1716 CB PRO A 107 -26.462 8.279 -2.027 1.00 0.00 C ATOM 1717 CG PRO A 107 -24.989 8.486 -1.688 1.00 0.00 C ATOM 1718 CD PRO A 107 -24.766 7.449 -0.597 1.00 0.00 C ATOM 0 HA PRO A 107 -27.658 6.559 -1.349 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -26.678 8.579 -3.052 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -27.105 8.874 -1.379 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -24.344 8.316 -2.550 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -24.790 9.498 -1.336 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -23.720 7.145 -0.552 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -25.024 7.849 0.384 1.00 0.00 H new ATOM 1726 N LEU A 108 -25.715 5.488 -3.705 1.00 0.00 N ATOM 1727 CA LEU A 108 -25.706 4.785 -4.986 1.00 0.00 C ATOM 1728 C LEU A 108 -24.837 3.530 -4.990 1.00 0.00 C ATOM 1729 O LEU A 108 -25.190 2.550 -5.646 1.00 0.00 O ATOM 1730 CB LEU A 108 -25.227 5.706 -6.123 1.00 0.00 C ATOM 1731 CG LEU A 108 -24.027 6.614 -5.807 1.00 0.00 C ATOM 1732 CD1 LEU A 108 -23.059 6.687 -6.988 1.00 0.00 C ATOM 1733 CD2 LEU A 108 -24.491 8.014 -5.424 1.00 0.00 C ATOM 0 H LEU A 108 -24.803 5.509 -3.249 1.00 0.00 H new ATOM 0 HA LEU A 108 -26.740 4.481 -5.146 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -24.969 5.084 -6.980 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -26.062 6.337 -6.427 1.00 0.00 H new ATOM 0 HG LEU A 108 -23.500 6.176 -4.959 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -22.222 7.337 -6.733 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.687 5.688 -7.216 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -23.577 7.088 -7.859 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -23.624 8.637 -5.205 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -25.052 8.450 -6.250 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -25.129 7.957 -4.542 1.00 0.00 H new ATOM 1745 N LYS A 109 -23.673 3.557 -4.342 1.00 0.00 N ATOM 1746 CA LYS A 109 -22.662 2.509 -4.486 1.00 0.00 C ATOM 1747 C LYS A 109 -23.053 1.205 -3.797 1.00 0.00 C ATOM 1748 O LYS A 109 -22.305 0.246 -3.940 1.00 0.00 O ATOM 1749 CB LYS A 109 -21.308 2.992 -3.942 1.00 0.00 C ATOM 1750 CG LYS A 109 -20.787 4.267 -4.615 1.00 0.00 C ATOM 1751 CD LYS A 109 -20.139 4.043 -5.982 1.00 0.00 C ATOM 1752 CE LYS A 109 -19.090 5.126 -6.257 1.00 0.00 C ATOM 1753 NZ LYS A 109 -19.632 6.502 -6.276 1.00 0.00 N ATOM 0 H LYS A 109 -23.404 4.305 -3.703 1.00 0.00 H new ATOM 0 HA LYS A 109 -22.584 2.301 -5.553 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -21.401 3.170 -2.871 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -20.572 2.198 -4.070 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -21.615 4.966 -4.730 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -20.059 4.740 -3.955 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -19.672 3.059 -6.014 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -20.902 4.060 -6.761 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -18.312 5.064 -5.496 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -18.615 4.921 -7.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -18.849 7.183 -6.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -20.266 6.614 -7.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -20.163 6.678 -5.399 1.00 0.00 H new ATOM 1767 N GLY A 110 -24.141 1.164 -3.025 1.00 0.00 N ATOM 1768 CA GLY A 110 -24.706 -0.040 -2.430 1.00 0.00 C ATOM 1769 C GLY A 110 -23.662 -0.981 -1.842 1.00 0.00 C ATOM 1770 O GLY A 110 -23.643 -2.171 -2.169 1.00 0.00 O ATOM 0 H GLY A 110 -24.670 2.004 -2.791 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -25.406 0.247 -1.646 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -25.278 -0.575 -3.188 1.00 0.00 H new ATOM 1774 N ASP A 111 -22.813 -0.461 -0.952 1.00 0.00 N ATOM 1775 CA ASP A 111 -21.859 -1.240 -0.154 1.00 0.00 C ATOM 1776 C ASP A 111 -20.718 -1.828 -1.014 1.00 0.00 C ATOM 1777 O ASP A 111 -19.963 -2.686 -0.553 1.00 0.00 O ATOM 1778 CB ASP A 111 -22.554 -2.312 0.722 1.00 0.00 C ATOM 1779 CG ASP A 111 -23.759 -1.797 1.516 1.00 0.00 C ATOM 1780 OD1 ASP A 111 -24.866 -1.711 0.928 1.00 0.00 O ATOM 1781 OD2 ASP A 111 -23.590 -1.478 2.712 1.00 0.00 O ATOM 0 H ASP A 111 -22.768 0.540 -0.760 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.393 -0.539 0.538 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -22.880 -3.132 0.081 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.824 -2.723 1.419 1.00 0.00 H new ATOM 1786 N ALA A 112 -20.546 -1.357 -2.256 1.00 0.00 N ATOM 1787 CA ALA A 112 -19.461 -1.753 -3.151 1.00 0.00 C ATOM 1788 C ALA A 112 -18.107 -1.226 -2.675 1.00 0.00 C ATOM 1789 O ALA A 112 -17.125 -1.960 -2.678 1.00 0.00 O ATOM 1790 CB ALA A 112 -19.713 -1.209 -4.560 1.00 0.00 C ATOM 0 H ALA A 112 -21.176 -0.672 -2.673 1.00 0.00 H new ATOM 0 HA ALA A 112 -19.437 -2.843 -3.155 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -18.898 -1.511 -5.218 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -20.653 -1.608 -4.941 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -19.768 -0.121 -4.526 1.00 0.00 H new ATOM 1796 N LEU A 113 -18.027 0.061 -2.316 1.00 0.00 N ATOM 1797 CA LEU A 113 -16.756 0.755 -2.075 1.00 0.00 C ATOM 1798 C LEU A 113 -15.966 0.078 -0.956 1.00 0.00 C ATOM 1799 O LEU A 113 -14.766 -0.159 -1.068 1.00 0.00 O ATOM 1800 CB LEU A 113 -17.018 2.242 -1.746 1.00 0.00 C ATOM 1801 CG LEU A 113 -16.375 3.238 -2.724 1.00 0.00 C ATOM 1802 CD1 LEU A 113 -16.858 3.056 -4.167 1.00 0.00 C ATOM 1803 CD2 LEU A 113 -16.735 4.650 -2.257 1.00 0.00 C ATOM 0 H LEU A 113 -18.847 0.653 -2.184 1.00 0.00 H new ATOM 0 HA LEU A 113 -16.154 0.701 -2.982 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -18.094 2.413 -1.730 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -16.648 2.449 -0.742 1.00 0.00 H new ATOM 0 HG LEU A 113 -15.299 3.065 -2.724 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -16.368 3.788 -4.810 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -16.612 2.051 -4.509 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -17.938 3.200 -4.210 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -16.292 5.381 -2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -17.819 4.768 -2.256 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -16.352 4.809 -1.249 1.00 0.00 H new ATOM 1815 N ASN A 114 -16.642 -0.250 0.139 1.00 0.00 N ATOM 1816 CA ASN A 114 -16.065 -1.020 1.230 1.00 0.00 C ATOM 1817 C ASN A 114 -15.773 -2.459 0.841 1.00 0.00 C ATOM 1818 O ASN A 114 -14.769 -2.981 1.312 1.00 0.00 O ATOM 1819 CB ASN A 114 -17.017 -1.037 2.433 1.00 0.00 C ATOM 1820 CG ASN A 114 -18.432 -1.441 2.032 1.00 0.00 C ATOM 1821 OD1 ASN A 114 -19.144 -0.616 1.471 1.00 0.00 O ATOM 1822 ND2 ASN A 114 -18.845 -2.680 2.219 1.00 0.00 N ATOM 0 H ASN A 114 -17.615 0.014 0.294 1.00 0.00 H new ATOM 0 HA ASN A 114 -15.124 -0.531 1.483 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -16.640 -1.731 3.184 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -17.038 -0.049 2.893 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -19.770 -2.964 1.895 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -18.240 -3.354 2.688 1.00 0.00 H new ATOM 1829 N LYS A 115 -16.582 -3.103 -0.005 1.00 0.00 N ATOM 1830 CA LYS A 115 -16.248 -4.437 -0.490 1.00 0.00 C ATOM 1831 C LYS A 115 -14.925 -4.386 -1.244 1.00 0.00 C ATOM 1832 O LYS A 115 -14.068 -5.231 -1.007 1.00 0.00 O ATOM 1833 CB LYS A 115 -17.361 -4.993 -1.382 1.00 0.00 C ATOM 1834 CG LYS A 115 -17.197 -6.497 -1.657 1.00 0.00 C ATOM 1835 CD LYS A 115 -17.792 -6.908 -3.008 1.00 0.00 C ATOM 1836 CE LYS A 115 -16.842 -6.482 -4.137 1.00 0.00 C ATOM 1837 NZ LYS A 115 -17.411 -6.744 -5.468 1.00 0.00 N ATOM 0 H LYS A 115 -17.460 -2.726 -0.362 1.00 0.00 H new ATOM 0 HA LYS A 115 -16.147 -5.107 0.364 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -18.326 -4.817 -0.907 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -17.368 -4.452 -2.328 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -16.138 -6.755 -1.635 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -17.680 -7.065 -0.862 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -17.947 -7.987 -3.036 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -18.768 -6.442 -3.144 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -16.620 -5.419 -4.041 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -15.897 -7.016 -4.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -16.737 -6.441 -6.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -17.600 -7.762 -5.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -18.300 -6.215 -5.576 1.00 0.00 H new ATOM 1851 N ALA A 116 -14.738 -3.380 -2.099 1.00 0.00 N ATOM 1852 CA ALA A 116 -13.509 -3.191 -2.846 1.00 0.00 C ATOM 1853 C ALA A 116 -12.314 -3.141 -1.893 1.00 0.00 C ATOM 1854 O ALA A 116 -11.317 -3.818 -2.133 1.00 0.00 O ATOM 1855 CB ALA A 116 -13.601 -1.945 -3.734 1.00 0.00 C ATOM 0 H ALA A 116 -15.446 -2.671 -2.289 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.359 -4.042 -3.511 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -12.669 -1.822 -4.286 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.426 -2.059 -4.437 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.773 -1.067 -3.112 1.00 0.00 H new ATOM 1861 N VAL A 117 -12.410 -2.398 -0.785 1.00 0.00 N ATOM 1862 CA VAL A 117 -11.402 -2.441 0.276 1.00 0.00 C ATOM 1863 C VAL A 117 -11.232 -3.875 0.789 1.00 0.00 C ATOM 1864 O VAL A 117 -10.107 -4.374 0.803 1.00 0.00 O ATOM 1865 CB VAL A 117 -11.757 -1.474 1.424 1.00 0.00 C ATOM 1866 CG1 VAL A 117 -10.754 -1.551 2.579 1.00 0.00 C ATOM 1867 CG2 VAL A 117 -11.810 -0.021 0.969 1.00 0.00 C ATOM 0 H VAL A 117 -13.181 -1.756 -0.601 1.00 0.00 H new ATOM 0 HA VAL A 117 -10.450 -2.112 -0.141 1.00 0.00 H new ATOM 0 HB VAL A 117 -12.743 -1.795 1.759 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -11.047 -0.852 3.362 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -10.741 -2.563 2.982 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -9.760 -1.292 2.215 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.064 0.616 1.816 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -10.838 0.272 0.573 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.566 0.090 0.192 1.00 0.00 H new ATOM 1877 N ARG A 118 -12.317 -4.495 1.273 1.00 0.00 N ATOM 1878 CA ARG A 118 -12.271 -5.719 2.063 1.00 0.00 C ATOM 1879 C ARG A 118 -11.547 -6.819 1.296 1.00 0.00 C ATOM 1880 O ARG A 118 -10.644 -7.445 1.836 1.00 0.00 O ATOM 1881 CB ARG A 118 -13.691 -6.068 2.591 1.00 0.00 C ATOM 1882 CG ARG A 118 -14.488 -7.148 1.842 1.00 0.00 C ATOM 1883 CD ARG A 118 -16.002 -7.070 2.115 1.00 0.00 C ATOM 1884 NE ARG A 118 -16.571 -8.247 2.789 1.00 0.00 N ATOM 1885 CZ ARG A 118 -16.832 -9.424 2.207 1.00 0.00 C ATOM 1886 NH1 ARG A 118 -16.354 -9.689 0.994 1.00 0.00 N ATOM 1887 NH2 ARG A 118 -17.581 -10.333 2.824 1.00 0.00 N ATOM 0 H ARG A 118 -13.264 -4.149 1.120 1.00 0.00 H new ATOM 0 HA ARG A 118 -11.672 -5.583 2.963 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -13.594 -6.383 3.630 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -14.283 -5.153 2.589 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -14.311 -7.047 0.771 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -14.121 -8.132 2.134 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -16.202 -6.189 2.724 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -16.520 -6.926 1.167 1.00 0.00 H new ATOM 0 HE ARG A 118 -16.784 -8.159 3.783 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -15.788 -8.995 0.506 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -16.554 -10.586 0.552 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -17.963 -10.137 3.749 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -17.774 -11.227 2.372 1.00 0.00 H new ATOM 1901 N GLU A 119 -11.890 -6.999 0.023 1.00 0.00 N ATOM 1902 CA GLU A 119 -11.331 -8.071 -0.784 1.00 0.00 C ATOM 1903 C GLU A 119 -9.913 -7.713 -1.209 1.00 0.00 C ATOM 1904 O GLU A 119 -9.021 -8.551 -1.115 1.00 0.00 O ATOM 1905 CB GLU A 119 -12.230 -8.355 -1.990 1.00 0.00 C ATOM 1906 CG GLU A 119 -13.671 -8.634 -1.523 1.00 0.00 C ATOM 1907 CD GLU A 119 -14.582 -9.247 -2.577 1.00 0.00 C ATOM 1908 OE1 GLU A 119 -14.237 -9.206 -3.781 1.00 0.00 O ATOM 1909 OE2 GLU A 119 -15.671 -9.727 -2.184 1.00 0.00 O ATOM 0 H GLU A 119 -12.559 -6.409 -0.472 1.00 0.00 H new ATOM 0 HA GLU A 119 -11.284 -8.984 -0.190 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -12.219 -7.503 -2.670 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -11.847 -9.211 -2.545 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -13.635 -9.302 -0.663 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -14.114 -7.698 -1.182 1.00 0.00 H new ATOM 1916 N THR A 120 -9.655 -6.460 -1.609 1.00 0.00 N ATOM 1917 CA THR A 120 -8.299 -6.086 -2.001 1.00 0.00 C ATOM 1918 C THR A 120 -7.327 -6.272 -0.831 1.00 0.00 C ATOM 1919 O THR A 120 -6.145 -6.530 -1.055 1.00 0.00 O ATOM 1920 CB THR A 120 -8.243 -4.654 -2.550 1.00 0.00 C ATOM 1921 OG1 THR A 120 -9.243 -4.425 -3.517 1.00 0.00 O ATOM 1922 CG2 THR A 120 -6.927 -4.371 -3.275 1.00 0.00 C ATOM 0 H THR A 120 -10.347 -5.713 -1.667 1.00 0.00 H new ATOM 0 HA THR A 120 -7.990 -6.751 -2.808 1.00 0.00 H new ATOM 0 HB THR A 120 -8.368 -4.016 -1.675 1.00 0.00 H new ATOM 0 HG1 THR A 120 -9.986 -3.933 -3.109 1.00 0.00 H new ATOM 0 HG21 THR A 120 -6.930 -3.347 -3.648 1.00 0.00 H new ATOM 0 HG22 THR A 120 -6.095 -4.503 -2.584 1.00 0.00 H new ATOM 0 HG23 THR A 120 -6.817 -5.061 -4.112 1.00 0.00 H new ATOM 1930 N ALA A 121 -7.786 -6.182 0.419 1.00 0.00 N ATOM 1931 CA ALA A 121 -6.933 -6.469 1.551 1.00 0.00 C ATOM 1932 C ALA A 121 -6.468 -7.931 1.532 1.00 0.00 C ATOM 1933 O ALA A 121 -5.299 -8.176 1.825 1.00 0.00 O ATOM 1934 CB ALA A 121 -7.639 -6.082 2.852 1.00 0.00 C ATOM 0 H ALA A 121 -8.740 -5.913 0.662 1.00 0.00 H new ATOM 0 HA ALA A 121 -6.029 -5.863 1.484 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -6.988 -6.302 3.698 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -7.869 -5.017 2.838 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -8.564 -6.651 2.947 1.00 0.00 H new ATOM 1940 N HIS A 122 -7.331 -8.878 1.154 1.00 0.00 N ATOM 1941 CA HIS A 122 -6.960 -10.281 0.996 1.00 0.00 C ATOM 1942 C HIS A 122 -5.889 -10.414 -0.092 1.00 0.00 C ATOM 1943 O HIS A 122 -4.835 -11.007 0.161 1.00 0.00 O ATOM 1944 CB HIS A 122 -8.163 -11.159 0.623 1.00 0.00 C ATOM 1945 CG HIS A 122 -9.302 -11.291 1.610 1.00 0.00 C ATOM 1946 ND1 HIS A 122 -10.129 -12.386 1.679 1.00 0.00 N ATOM 1947 CD2 HIS A 122 -9.775 -10.370 2.509 1.00 0.00 C ATOM 1948 CE1 HIS A 122 -11.082 -12.133 2.589 1.00 0.00 C ATOM 1949 NE2 HIS A 122 -10.911 -10.912 3.122 1.00 0.00 N ATOM 0 H HIS A 122 -8.312 -8.688 0.949 1.00 0.00 H new ATOM 0 HA HIS A 122 -6.575 -10.625 1.956 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.577 -10.774 -0.309 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -7.788 -12.161 0.415 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -9.347 -9.399 2.709 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -11.875 -12.816 2.856 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -11.493 -10.468 3.832 1.00 0.00 H new ATOM 1957 N GLU A 123 -6.129 -9.815 -1.268 1.00 0.00 N ATOM 1958 CA GLU A 123 -5.174 -9.774 -2.382 1.00 0.00 C ATOM 1959 C GLU A 123 -3.815 -9.259 -1.898 1.00 0.00 C ATOM 1960 O GLU A 123 -2.766 -9.784 -2.267 1.00 0.00 O ATOM 1961 CB GLU A 123 -5.667 -8.839 -3.507 1.00 0.00 C ATOM 1962 CG GLU A 123 -6.621 -9.463 -4.527 1.00 0.00 C ATOM 1963 CD GLU A 123 -8.028 -9.713 -4.000 1.00 0.00 C ATOM 1964 OE1 GLU A 123 -8.852 -8.772 -4.077 1.00 0.00 O ATOM 1965 OE2 GLU A 123 -8.325 -10.869 -3.621 1.00 0.00 O ATOM 0 H GLU A 123 -7.007 -9.338 -1.473 1.00 0.00 H new ATOM 0 HA GLU A 123 -5.082 -10.790 -2.767 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -6.164 -7.984 -3.050 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -4.797 -8.455 -4.040 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -6.683 -8.809 -5.397 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -6.201 -10.409 -4.869 1.00 0.00 H new ATOM 1972 N THR A 124 -3.837 -8.214 -1.072 1.00 0.00 N ATOM 1973 CA THR A 124 -2.645 -7.561 -0.573 1.00 0.00 C ATOM 1974 C THR A 124 -1.843 -8.522 0.313 1.00 0.00 C ATOM 1975 O THR A 124 -0.634 -8.618 0.130 1.00 0.00 O ATOM 1976 CB THR A 124 -3.038 -6.250 0.122 1.00 0.00 C ATOM 1977 OG1 THR A 124 -3.750 -5.422 -0.774 1.00 0.00 O ATOM 1978 CG2 THR A 124 -1.832 -5.458 0.622 1.00 0.00 C ATOM 0 H THR A 124 -4.702 -7.796 -0.730 1.00 0.00 H new ATOM 0 HA THR A 124 -1.979 -7.293 -1.394 1.00 0.00 H new ATOM 0 HB THR A 124 -3.649 -6.533 0.979 1.00 0.00 H new ATOM 0 HG1 THR A 124 -4.648 -5.789 -0.915 1.00 0.00 H new ATOM 0 HG21 THR A 124 -2.173 -4.542 1.104 1.00 0.00 H new ATOM 0 HG22 THR A 124 -1.274 -6.059 1.339 1.00 0.00 H new ATOM 0 HG23 THR A 124 -1.187 -5.207 -0.220 1.00 0.00 H new ATOM 1986 N ILE A 125 -2.448 -9.248 1.256 1.00 0.00 N ATOM 1987 CA ILE A 125 -1.692 -10.168 2.117 1.00 0.00 C ATOM 1988 C ILE A 125 -1.042 -11.288 1.295 1.00 0.00 C ATOM 1989 O ILE A 125 0.111 -11.624 1.568 1.00 0.00 O ATOM 1990 CB ILE A 125 -2.558 -10.672 3.291 1.00 0.00 C ATOM 1991 CG1 ILE A 125 -3.078 -9.503 4.151 1.00 0.00 C ATOM 1992 CG2 ILE A 125 -1.823 -11.665 4.206 1.00 0.00 C ATOM 1993 CD1 ILE A 125 -2.020 -8.520 4.657 1.00 0.00 C ATOM 0 H ILE A 125 -3.450 -9.219 1.444 1.00 0.00 H new ATOM 0 HA ILE A 125 -0.867 -9.623 2.574 1.00 0.00 H new ATOM 0 HB ILE A 125 -3.393 -11.194 2.824 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -3.812 -8.947 3.568 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -3.602 -9.917 5.012 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -2.488 -11.980 5.010 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.517 -12.536 3.626 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -0.942 -11.184 4.631 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -2.501 -7.741 5.249 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -1.296 -9.051 5.275 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.509 -8.066 3.808 1.00 0.00 H new ATOM 2005 N SER A 126 -1.699 -11.766 0.231 1.00 0.00 N ATOM 2006 CA SER A 126 -1.113 -12.731 -0.701 1.00 0.00 C ATOM 2007 C SER A 126 0.152 -12.201 -1.405 1.00 0.00 C ATOM 2008 O SER A 126 0.828 -12.969 -2.093 1.00 0.00 O ATOM 2009 CB SER A 126 -2.163 -13.123 -1.747 1.00 0.00 C ATOM 2010 OG SER A 126 -1.691 -14.187 -2.553 1.00 0.00 O ATOM 0 H SER A 126 -2.653 -11.493 -0.006 1.00 0.00 H new ATOM 0 HA SER A 126 -0.806 -13.599 -0.118 1.00 0.00 H new ATOM 0 HB2 SER A 126 -3.087 -13.419 -1.250 1.00 0.00 H new ATOM 0 HB3 SER A 126 -2.399 -12.263 -2.373 1.00 0.00 H new ATOM 0 HG SER A 126 -0.721 -14.107 -2.666 1.00 0.00 H new ATOM 2016 N ALA A 127 0.468 -10.914 -1.279 1.00 0.00 N ATOM 2017 CA ALA A 127 1.689 -10.281 -1.747 1.00 0.00 C ATOM 2018 C ALA A 127 2.604 -9.924 -0.575 1.00 0.00 C ATOM 2019 O ALA A 127 3.799 -10.175 -0.693 1.00 0.00 O ATOM 2020 CB ALA A 127 1.319 -9.083 -2.606 1.00 0.00 C ATOM 0 H ALA A 127 -0.159 -10.252 -0.822 1.00 0.00 H new ATOM 0 HA ALA A 127 2.262 -10.973 -2.365 1.00 0.00 H new ATOM 0 HB1 ALA A 127 2.227 -8.598 -2.964 1.00 0.00 H new ATOM 0 HB2 ALA A 127 0.725 -9.415 -3.457 1.00 0.00 H new ATOM 0 HB3 ALA A 127 0.739 -8.375 -2.013 1.00 0.00 H new ATOM 2026 N ILE A 128 2.095 -9.408 0.560 1.00 0.00 N ATOM 2027 CA ILE A 128 2.939 -9.061 1.712 1.00 0.00 C ATOM 2028 C ILE A 128 3.764 -10.280 2.142 1.00 0.00 C ATOM 2029 O ILE A 128 4.924 -10.117 2.516 1.00 0.00 O ATOM 2030 CB ILE A 128 2.136 -8.469 2.902 1.00 0.00 C ATOM 2031 CG1 ILE A 128 1.441 -7.153 2.494 1.00 0.00 C ATOM 2032 CG2 ILE A 128 3.057 -8.203 4.104 1.00 0.00 C ATOM 2033 CD1 ILE A 128 0.810 -6.338 3.629 1.00 0.00 C ATOM 0 H ILE A 128 1.102 -9.223 0.701 1.00 0.00 H new ATOM 0 HA ILE A 128 3.614 -8.268 1.391 1.00 0.00 H new ATOM 0 HB ILE A 128 1.380 -9.201 3.185 1.00 0.00 H new ATOM 0 HG12 ILE A 128 2.172 -6.523 1.986 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.663 -7.388 1.768 1.00 0.00 H new ATOM 0 HG21 ILE A 128 2.473 -7.789 4.925 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.519 -9.138 4.422 1.00 0.00 H new ATOM 0 HG23 ILE A 128 3.834 -7.494 3.817 1.00 0.00 H new ATOM 0 HD11 ILE A 128 0.353 -5.437 3.220 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.048 -6.937 4.127 1.00 0.00 H new ATOM 0 HD13 ILE A 128 1.580 -6.059 4.348 1.00 0.00 H new ATOM 2045 N PHE A 129 3.207 -11.484 2.042 1.00 0.00 N ATOM 2046 CA PHE A 129 3.883 -12.729 2.379 1.00 0.00 C ATOM 2047 C PHE A 129 3.963 -13.639 1.147 1.00 0.00 C ATOM 2048 O PHE A 129 3.916 -14.861 1.281 1.00 0.00 O ATOM 2049 CB PHE A 129 3.180 -13.374 3.581 1.00 0.00 C ATOM 2050 CG PHE A 129 3.114 -12.485 4.814 1.00 0.00 C ATOM 2051 CD1 PHE A 129 4.151 -12.498 5.766 1.00 0.00 C ATOM 2052 CD2 PHE A 129 2.009 -11.636 5.006 1.00 0.00 C ATOM 2053 CE1 PHE A 129 4.077 -11.669 6.901 1.00 0.00 C ATOM 2054 CE2 PHE A 129 1.942 -10.802 6.136 1.00 0.00 C ATOM 2055 CZ PHE A 129 2.976 -10.817 7.087 1.00 0.00 C ATOM 0 H PHE A 129 2.250 -11.622 1.716 1.00 0.00 H new ATOM 0 HA PHE A 129 4.914 -12.541 2.677 1.00 0.00 H new ATOM 0 HB2 PHE A 129 2.166 -13.649 3.290 1.00 0.00 H new ATOM 0 HB3 PHE A 129 3.699 -14.297 3.839 1.00 0.00 H new ATOM 0 HD1 PHE A 129 5.004 -13.145 5.625 1.00 0.00 H new ATOM 0 HD2 PHE A 129 1.208 -11.625 4.282 1.00 0.00 H new ATOM 0 HE1 PHE A 129 4.871 -11.688 7.633 1.00 0.00 H new ATOM 0 HE2 PHE A 129 1.093 -10.148 6.273 1.00 0.00 H new ATOM 0 HZ PHE A 129 2.925 -10.177 7.956 1.00 0.00 H new ATOM 2065 N SER A 130 4.053 -13.068 -0.060 1.00 0.00 N ATOM 2066 CA SER A 130 4.458 -13.830 -1.232 1.00 0.00 C ATOM 2067 C SER A 130 5.843 -14.407 -0.942 1.00 0.00 C ATOM 2068 O SER A 130 6.750 -13.681 -0.504 1.00 0.00 O ATOM 2069 CB SER A 130 4.446 -12.949 -2.488 1.00 0.00 C ATOM 2070 OG SER A 130 4.793 -13.656 -3.665 1.00 0.00 O ATOM 0 H SER A 130 3.851 -12.085 -0.243 1.00 0.00 H new ATOM 0 HA SER A 130 3.759 -14.642 -1.431 1.00 0.00 H new ATOM 0 HB2 SER A 130 3.454 -12.515 -2.611 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.141 -12.121 -2.350 1.00 0.00 H new ATOM 0 HG SER A 130 4.767 -13.047 -4.432 1.00 0.00 H new ATOM 2076 N GLU A 131 5.978 -15.711 -1.164 1.00 0.00 N ATOM 2077 CA GLU A 131 7.214 -16.448 -1.001 1.00 0.00 C ATOM 2078 C GLU A 131 8.229 -16.009 -2.066 1.00 0.00 C ATOM 2079 O GLU A 131 8.022 -15.045 -2.807 1.00 0.00 O ATOM 2080 CB GLU A 131 6.895 -17.962 -1.006 1.00 0.00 C ATOM 2081 CG GLU A 131 7.889 -18.825 -0.212 1.00 0.00 C ATOM 2082 CD GLU A 131 8.134 -18.266 1.191 1.00 0.00 C ATOM 2083 OE1 GLU A 131 7.189 -17.801 1.867 1.00 0.00 O ATOM 2084 OE2 GLU A 131 9.307 -18.145 1.598 1.00 0.00 O ATOM 0 H GLU A 131 5.202 -16.297 -1.472 1.00 0.00 H new ATOM 0 HA GLU A 131 7.686 -16.231 -0.043 1.00 0.00 H new ATOM 0 HB2 GLU A 131 5.896 -18.111 -0.597 1.00 0.00 H new ATOM 0 HB3 GLU A 131 6.872 -18.312 -2.038 1.00 0.00 H new ATOM 0 HG2 GLU A 131 7.506 -19.843 -0.136 1.00 0.00 H new ATOM 0 HG3 GLU A 131 8.835 -18.880 -0.752 1.00 0.00 H new ATOM 2091 N GLU A 132 9.387 -16.654 -2.107 1.00 0.00 N ATOM 2092 CA GLU A 132 10.489 -16.337 -3.003 1.00 0.00 C ATOM 2093 C GLU A 132 10.919 -17.605 -3.713 1.00 0.00 C ATOM 2094 O GLU A 132 10.566 -18.702 -3.283 1.00 0.00 O ATOM 2095 CB GLU A 132 11.626 -15.710 -2.189 1.00 0.00 C ATOM 2096 CG GLU A 132 12.290 -16.697 -1.201 1.00 0.00 C ATOM 2097 CD GLU A 132 12.855 -15.983 0.022 1.00 0.00 C ATOM 2098 OE1 GLU A 132 13.213 -14.790 -0.074 1.00 0.00 O ATOM 2099 OE2 GLU A 132 12.828 -16.544 1.138 1.00 0.00 O ATOM 0 H GLU A 132 9.592 -17.443 -1.493 1.00 0.00 H new ATOM 0 HA GLU A 132 10.189 -15.615 -3.762 1.00 0.00 H new ATOM 0 HB2 GLU A 132 12.384 -15.327 -2.872 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.237 -14.857 -1.633 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.558 -17.439 -0.882 1.00 0.00 H new ATOM 0 HG3 GLU A 132 13.090 -17.236 -1.709 1.00 0.00 H new ATOM 2106 N ASN A 133 11.671 -17.486 -4.806 1.00 0.00 N ATOM 2107 CA ASN A 133 12.163 -18.653 -5.532 1.00 0.00 C ATOM 2108 C ASN A 133 13.421 -19.138 -4.813 1.00 0.00 C ATOM 2109 O ASN A 133 14.544 -18.921 -5.280 1.00 0.00 O ATOM 2110 CB ASN A 133 12.361 -18.313 -7.018 1.00 0.00 C ATOM 2111 CG ASN A 133 11.064 -17.879 -7.692 1.00 0.00 C ATOM 2112 OD1 ASN A 133 9.997 -18.405 -7.382 1.00 0.00 O ATOM 2113 ND2 ASN A 133 11.101 -16.906 -8.589 1.00 0.00 N ATOM 0 H ASN A 133 11.952 -16.592 -5.208 1.00 0.00 H new ATOM 0 HA ASN A 133 11.445 -19.473 -5.533 1.00 0.00 H new ATOM 0 HB2 ASN A 133 13.100 -17.517 -7.111 1.00 0.00 H new ATOM 0 HB3 ASN A 133 12.764 -19.183 -7.537 1.00 0.00 H new ATOM 0 HD21 ASN A 133 10.239 -16.586 -9.030 1.00 0.00 H new ATOM 0 HD22 ASN A 133 11.992 -16.476 -8.839 1.00 0.00 H new ATOM 2120 N GLY A 134 13.230 -19.709 -3.626 1.00 0.00 N ATOM 2121 CA GLY A 134 14.246 -20.204 -2.717 1.00 0.00 C ATOM 2122 C GLY A 134 13.952 -21.669 -2.440 1.00 0.00 C ATOM 2123 O GLY A 134 12.887 -22.005 -1.913 1.00 0.00 O ATOM 0 H GLY A 134 12.291 -19.845 -3.253 1.00 0.00 H new ATOM 0 HA2 GLY A 134 15.238 -20.090 -3.155 1.00 0.00 H new ATOM 0 HA3 GLY A 134 14.239 -19.632 -1.789 1.00 0.00 H new ATOM 2127 N SER A 135 14.892 -22.529 -2.820 1.00 0.00 N ATOM 2128 CA SER A 135 14.819 -23.974 -2.740 1.00 0.00 C ATOM 2129 C SER A 135 14.863 -24.456 -1.287 1.00 0.00 C ATOM 2130 O SER A 135 15.931 -24.783 -0.759 1.00 0.00 O ATOM 2131 CB SER A 135 15.952 -24.549 -3.598 1.00 0.00 C ATOM 2132 OG SER A 135 17.178 -23.835 -3.481 1.00 0.00 O ATOM 0 H SER A 135 15.777 -22.210 -3.215 1.00 0.00 H new ATOM 0 HA SER A 135 13.866 -24.332 -3.129 1.00 0.00 H new ATOM 0 HB2 SER A 135 16.119 -25.588 -3.315 1.00 0.00 H new ATOM 0 HB3 SER A 135 15.640 -24.549 -4.643 1.00 0.00 H new ATOM 0 HG SER A 135 17.856 -24.254 -4.051 1.00 0.00 H new ATOM 2138 N GLY A 136 13.707 -24.497 -0.632 1.00 0.00 N ATOM 2139 CA GLY A 136 13.578 -24.828 0.776 1.00 0.00 C ATOM 2140 C GLY A 136 12.231 -24.328 1.277 1.00 0.00 C ATOM 2141 O GLY A 136 11.311 -25.134 1.411 1.00 0.00 O ATOM 0 H GLY A 136 12.813 -24.295 -1.081 1.00 0.00 H new ATOM 0 HA2 GLY A 136 13.657 -25.906 0.919 1.00 0.00 H new ATOM 0 HA3 GLY A 136 14.386 -24.371 1.347 1.00 0.00 H new ATOM 2145 N PRO A 137 12.072 -23.013 1.512 1.00 0.00 N ATOM 2146 CA PRO A 137 10.799 -22.462 1.946 1.00 0.00 C ATOM 2147 C PRO A 137 9.710 -22.574 0.869 1.00 0.00 C ATOM 2148 O PRO A 137 8.555 -22.814 1.230 1.00 0.00 O ATOM 2149 CB PRO A 137 11.094 -21.011 2.322 1.00 0.00 C ATOM 2150 CG PRO A 137 12.306 -20.645 1.465 1.00 0.00 C ATOM 2151 CD PRO A 137 13.077 -21.963 1.402 1.00 0.00 C ATOM 0 HA PRO A 137 10.396 -23.020 2.791 1.00 0.00 H new ATOM 0 HB2 PRO A 137 10.244 -20.363 2.109 1.00 0.00 H new ATOM 0 HB3 PRO A 137 11.312 -20.911 3.385 1.00 0.00 H new ATOM 0 HG2 PRO A 137 12.013 -20.299 0.474 1.00 0.00 H new ATOM 0 HG3 PRO A 137 12.898 -19.850 1.918 1.00 0.00 H new ATOM 0 HD2 PRO A 137 13.631 -22.048 0.467 1.00 0.00 H new ATOM 0 HD3 PRO A 137 13.804 -22.030 2.211 1.00 0.00 H new ATOM 2159 N SER A 138 10.032 -22.412 -0.420 1.00 0.00 N ATOM 2160 CA SER A 138 9.066 -22.612 -1.498 1.00 0.00 C ATOM 2161 C SER A 138 8.912 -24.106 -1.821 1.00 0.00 C ATOM 2162 O SER A 138 9.439 -24.973 -1.120 1.00 0.00 O ATOM 2163 CB SER A 138 9.460 -21.770 -2.719 1.00 0.00 C ATOM 2164 OG SER A 138 8.356 -21.671 -3.601 1.00 0.00 O ATOM 0 H SER A 138 10.962 -22.141 -0.740 1.00 0.00 H new ATOM 0 HA SER A 138 8.083 -22.267 -1.176 1.00 0.00 H new ATOM 0 HB2 SER A 138 9.776 -20.776 -2.402 1.00 0.00 H new ATOM 0 HB3 SER A 138 10.308 -22.226 -3.230 1.00 0.00 H new ATOM 0 HG SER A 138 8.607 -21.132 -4.380 1.00 0.00 H new ATOM 2170 N SER A 139 8.148 -24.429 -2.859 1.00 0.00 N ATOM 2171 CA SER A 139 7.908 -25.770 -3.370 1.00 0.00 C ATOM 2172 C SER A 139 7.684 -25.700 -4.889 1.00 0.00 C ATOM 2173 O SER A 139 7.728 -24.623 -5.495 1.00 0.00 O ATOM 2174 CB SER A 139 6.728 -26.379 -2.599 1.00 0.00 C ATOM 2175 OG SER A 139 7.112 -26.602 -1.250 1.00 0.00 O ATOM 0 H SER A 139 7.651 -23.718 -3.396 1.00 0.00 H new ATOM 0 HA SER A 139 8.766 -26.424 -3.215 1.00 0.00 H new ATOM 0 HB2 SER A 139 5.869 -25.709 -2.638 1.00 0.00 H new ATOM 0 HB3 SER A 139 6.422 -27.317 -3.062 1.00 0.00 H new ATOM 0 HG SER A 139 6.360 -26.989 -0.755 1.00 0.00 H new ATOM 2181 N GLY A 140 7.535 -26.857 -5.532 1.00 0.00 N ATOM 2182 CA GLY A 140 7.346 -27.014 -6.965 1.00 0.00 C ATOM 2183 C GLY A 140 6.621 -28.321 -7.219 1.00 0.00 C ATOM 2184 O GLY A 140 6.359 -29.044 -6.233 1.00 0.00 O ATOM 0 H GLY A 140 7.544 -27.751 -5.040 1.00 0.00 H new ATOM 0 HA2 GLY A 140 6.770 -26.179 -7.364 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.309 -27.010 -7.476 1.00 0.00 H new TER 2188 GLY A 140