USER MOD reduce.3.24.130724 H: found=0, std=0, add=1287, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1275 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 NoAdj-H: A 90 HIS HE2 : A 90 HIS NE2 : A 173 CU1CU :(H bumps) USER MOD Set 1.1: A 81 THR OG1 : rot -53:sc= 0.497 USER MOD Set 1.2: A 135 HIS : no HD1:sc= 0.541 K(o=1,f=-0.24) USER MOD Set 2.1: A 83 THR OG1 : rot 180:sc= -0.0512 USER MOD Set 2.2: A 133 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 94 GLN : amide:sc= -0.146 K(o=0.42,f=-0.88) USER MOD Set 3.2: A 96 HIS : no HD1:sc= 0.562 K(o=0.42,f=-4!) USER MOD Set 4.1: A 75 MET CE :methyl -177:sc= 0 (180deg=0) USER MOD Set 4.2: A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 1 HIS : no HD1:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 1 HIS N :NH3+ -166:sc= 0.0946 (180deg=0.0645) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0.223 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc=-0.00122 X(o=-0.0012,f=0) USER MOD Single : A 24 ASN : amide:sc= -0.0556 X(o=-0.056,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0.107 USER MOD Single : A 29 MET CE :methyl -122:sc= 0 (180deg=-0.00552) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.687 K(o=-0.69,f=-4.4!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= 0.444 K(o=0.44,f=-1.7!) USER MOD Single : A 44 SER OG : rot -119:sc= 0.0105 USER MOD Single : A 50 GLN : amide:sc= 0.102 X(o=0.1,f=-0.027) USER MOD Single : A 53 SER OG : rot 1:sc= 0.124 USER MOD Single : A 64 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 65 GLN : amide:sc= -0.0047 K(o=-0.0047,f=-0.75) USER MOD Single : A 66 SER OG : rot 170:sc= 0.405 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ -168:sc= 0.574 (180deg=0.471) USER MOD Single : A 73 HIS : no HD1:sc= 0 X(o=0,f=-0.075) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot -115:sc= 0.798 USER MOD Single : A 86 TYR OH : rot 21:sc= 1.34 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= 0.832 K(o=0.83,f=-0.55) USER MOD Single : A 92 THR OG1 : rot 1:sc= 0.319 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 169:sc= 0.558 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HE2:sc= 0.0907 K(o=0.091,f=-2.6!) USER MOD Single : A 126 SER OG : rot 87:sc= 1.1 USER MOD Single : A 129 SER OG : rot 180:sc=0.000472 USER MOD Single : A 131 ASN : amide:sc=-0.000883 K(o=-0.00088,f=-1.7!) USER MOD Single : A 134 HIS : no HD1:sc= -0.0639 X(o=-0.064,f=-0.065) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 HIS : no HE2:sc= 0.0245 K(o=0.024,f=-2.2) USER MOD Single : A 157 THR OG1 : rot -27:sc= 0.264 USER MOD Single : A 159 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 GLN : amide:sc= 0.0212 X(o=0.021,f=0.45) USER MOD Single : A 171 ASN : amide:sc= -0.0102 K(o=-0.01,f=-1.7!) USER MOD Single : A 172 LYS NZ :NH3+ -167:sc= -0.0267 (180deg=-0.358) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 0.621 3.274 -2.109 1.00 25.00 N ATOM 2 CA HIS A 1 1.751 3.638 -2.998 1.00 25.00 C ATOM 3 C HIS A 1 1.489 3.312 -4.511 1.00 25.00 C ATOM 4 O HIS A 1 0.923 2.237 -4.854 1.00 25.00 O ATOM 5 CB HIS A 1 3.079 3.012 -2.526 1.00 0.00 C ATOM 6 CG HIS A 1 3.269 1.560 -2.864 1.00 0.00 C ATOM 7 ND1 HIS A 1 2.562 0.581 -2.177 1.00 0.00 N ATOM 8 CD2 HIS A 1 3.977 0.972 -3.848 1.00 0.00 C ATOM 9 CE1 HIS A 1 2.876 -0.579 -2.870 1.00 0.00 C ATOM 10 NE2 HIS A 1 3.761 -0.364 -3.855 1.00 0.00 N ATOM 0 H1 HIS A 1 0.752 3.722 -1.180 1.00 25.00 H new ATOM 0 H2 HIS A 1 -0.271 3.603 -2.529 1.00 25.00 H new ATOM 0 H3 HIS A 1 0.589 2.241 -1.994 1.00 25.00 H new ATOM 0 HA HIS A 1 1.836 4.722 -2.924 1.00 25.00 H new ATOM 0 HB2 HIS A 1 3.902 3.579 -2.962 1.00 0.00 H new ATOM 0 HB3 HIS A 1 3.150 3.127 -1.444 1.00 0.00 H new ATOM 0 HD2 HIS A 1 4.626 1.494 -4.535 1.00 0.00 H new ATOM 0 HE1 HIS A 1 2.455 -1.547 -2.642 1.00 0.00 H new ATOM 0 HE2 HIS A 1 4.180 -1.057 -4.475 1.00 0.00 H new ATOM 17 N GLY A 2 1.763 4.289 -5.389 1.00 25.00 N ATOM 18 CA GLY A 2 1.376 4.094 -6.782 1.00 25.00 C ATOM 19 C GLY A 2 2.214 4.874 -7.762 1.00 25.00 C ATOM 20 O GLY A 2 3.217 5.498 -7.263 1.00 25.00 O ATOM 0 H GLY A 2 2.225 5.172 -5.172 1.00 25.00 H new ATOM 0 HA2 GLY A 2 1.445 3.033 -7.023 1.00 25.00 H new ATOM 0 HA3 GLY A 2 0.331 4.381 -6.903 1.00 25.00 H new ATOM 24 N PHE A 3 1.958 4.764 -9.061 1.00 25.00 N ATOM 25 CA PHE A 3 2.914 5.346 -10.023 1.00 25.00 C ATOM 26 C PHE A 3 2.268 6.303 -10.990 1.00 25.00 C ATOM 27 O PHE A 3 1.081 6.252 -11.229 1.00 25.00 O ATOM 28 CB PHE A 3 3.712 4.192 -10.745 1.00 25.00 C ATOM 29 CG PHE A 3 4.475 3.332 -9.794 1.00 25.00 C ATOM 30 CD1 PHE A 3 5.784 3.693 -9.472 1.00 50.00 C ATOM 31 CD2 PHE A 3 3.905 2.201 -9.135 1.00 50.00 C ATOM 32 CE1 PHE A 3 6.568 2.902 -8.615 1.00 25.00 C ATOM 33 CE2 PHE A 3 4.725 1.305 -8.333 1.00 25.00 C ATOM 34 CZ PHE A 3 6.062 1.654 -8.118 1.00 25.00 C ATOM 0 H PHE A 3 1.143 4.304 -9.467 1.00 25.00 H new ATOM 0 HA PHE A 3 3.625 5.956 -9.466 1.00 25.00 H new ATOM 0 HB2 PHE A 3 3.015 3.572 -11.308 1.00 25.00 H new ATOM 0 HB3 PHE A 3 4.403 4.630 -11.465 1.00 25.00 H new ATOM 0 HD1 PHE A 3 6.202 4.597 -9.889 1.00 50.00 H new ATOM 0 HD2 PHE A 3 2.847 2.007 -9.233 1.00 50.00 H new ATOM 0 HE1 PHE A 3 7.555 3.234 -8.329 1.00 25.00 H new ATOM 0 HE2 PHE A 3 4.313 0.398 -7.916 1.00 25.00 H new ATOM 0 HZ PHE A 3 6.714 0.984 -7.578 1.00 25.00 H new ATOM 44 N ILE A 4 2.998 7.280 -11.531 1.00 25.00 N ATOM 45 CA ILE A 4 2.447 8.391 -12.359 1.00 25.00 C ATOM 46 C ILE A 4 2.007 7.877 -13.683 1.00 25.00 C ATOM 47 O ILE A 4 2.807 7.295 -14.363 1.00 25.00 O ATOM 48 CB ILE A 4 3.389 9.651 -12.447 1.00 25.00 C ATOM 49 CG1 ILE A 4 3.938 10.027 -11.066 1.00 25.00 C ATOM 50 CG2 ILE A 4 2.654 10.731 -13.163 1.00 25.00 C ATOM 51 CD1 ILE A 4 4.964 11.203 -11.083 1.00 25.00 C ATOM 0 H ILE A 4 4.010 7.336 -11.412 1.00 25.00 H new ATOM 0 HA ILE A 4 1.565 8.773 -11.845 1.00 25.00 H new ATOM 0 HB ILE A 4 4.286 9.442 -13.030 1.00 25.00 H new ATOM 0 HG12 ILE A 4 3.105 10.296 -10.417 1.00 25.00 H new ATOM 0 HG13 ILE A 4 4.414 9.151 -10.626 1.00 25.00 H new ATOM 0 HG21 ILE A 4 3.287 11.615 -13.236 1.00 25.00 H new ATOM 0 HG22 ILE A 4 2.390 10.390 -14.164 1.00 25.00 H new ATOM 0 HG23 ILE A 4 1.746 10.979 -12.613 1.00 25.00 H new ATOM 0 HD11 ILE A 4 5.303 11.405 -10.067 1.00 25.00 H new ATOM 0 HD12 ILE A 4 5.818 10.932 -11.703 1.00 25.00 H new ATOM 0 HD13 ILE A 4 4.488 12.095 -11.491 1.00 25.00 H new ATOM 63 N GLU A 5 0.773 8.086 -14.060 1.00 25.00 N ATOM 64 CA GLU A 5 0.260 7.515 -15.288 1.00 25.00 C ATOM 65 C GLU A 5 0.254 8.601 -16.383 1.00 25.00 C ATOM 66 O GLU A 5 -0.224 8.433 -17.503 1.00 25.00 O ATOM 67 CB GLU A 5 -1.176 6.964 -15.096 1.00 25.00 C ATOM 68 CG GLU A 5 -1.726 6.018 -16.120 1.00 25.00 C ATOM 69 CD GLU A 5 -0.994 4.658 -16.057 1.00 25.00 C ATOM 70 OE1 GLU A 5 -0.514 4.198 -17.115 1.00 25.00 O ATOM 71 OE2 GLU A 5 -0.887 4.012 -15.002 1.00 25.00 O1- ATOM 0 H GLU A 5 0.100 8.647 -13.537 1.00 25.00 H new ATOM 0 HA GLU A 5 0.903 6.685 -15.580 1.00 25.00 H new ATOM 0 HB2 GLU A 5 -1.211 6.462 -14.129 1.00 25.00 H new ATOM 0 HB3 GLU A 5 -1.852 7.817 -15.037 1.00 25.00 H new ATOM 0 HG2 GLU A 5 -2.793 5.871 -15.950 1.00 25.00 H new ATOM 0 HG3 GLU A 5 -1.618 6.449 -17.115 1.00 25.00 H new ATOM 78 N LYS A 6 0.911 9.733 -16.080 1.00 25.00 N ATOM 79 CA LYS A 6 1.269 10.915 -16.847 1.00 25.00 C ATOM 80 C LYS A 6 0.152 11.979 -16.849 1.00 25.00 C ATOM 81 O LYS A 6 -0.964 11.603 -16.545 1.00 25.00 O ATOM 82 CB LYS A 6 1.845 10.516 -18.299 1.00 25.00 C ATOM 83 CG LYS A 6 3.028 9.623 -18.205 1.00 25.00 C ATOM 84 CD LYS A 6 3.673 9.299 -19.597 1.00 25.00 C ATOM 85 CE LYS A 6 2.850 8.248 -20.389 1.00 25.00 C ATOM 86 NZ LYS A 6 3.437 7.985 -21.774 1.00 25.00 N1+ ATOM 0 H LYS A 6 1.255 9.844 -15.126 1.00 25.00 H new ATOM 0 HA LYS A 6 2.096 11.415 -16.342 1.00 25.00 H new ATOM 0 HB2 LYS A 6 1.063 10.022 -18.875 1.00 25.00 H new ATOM 0 HB3 LYS A 6 2.117 11.421 -18.842 1.00 25.00 H new ATOM 0 HG2 LYS A 6 3.777 10.090 -17.565 1.00 25.00 H new ATOM 0 HG3 LYS A 6 2.733 8.691 -17.723 1.00 25.00 H new ATOM 0 HD2 LYS A 6 3.750 10.215 -20.183 1.00 25.00 H new ATOM 0 HD3 LYS A 6 4.687 8.929 -19.449 1.00 25.00 H new ATOM 0 HE2 LYS A 6 2.817 7.315 -19.826 1.00 25.00 H new ATOM 0 HE3 LYS A 6 1.822 8.595 -20.491 1.00 25.00 H new ATOM 0 HZ1 LYS A 6 2.857 7.277 -22.268 1.00 25.00 H new ATOM 0 HZ2 LYS A 6 3.445 8.869 -22.321 1.00 25.00 H new ATOM 0 HZ3 LYS A 6 4.409 7.629 -21.677 1.00 25.00 H new ATOM 100 N PRO A 7 0.449 13.266 -17.134 1.00 25.00 N ATOM 101 CA PRO A 7 1.697 13.938 -17.518 1.00 25.00 C ATOM 102 C PRO A 7 2.718 13.956 -16.466 1.00 25.00 C ATOM 103 O PRO A 7 2.514 14.150 -15.261 1.00 25.00 O ATOM 104 CB PRO A 7 1.143 15.394 -17.819 1.00 25.00 C ATOM 105 CG PRO A 7 0.072 15.621 -17.091 1.00 25.00 C ATOM 106 CD PRO A 7 -0.659 14.259 -17.072 1.00 25.00 C ATOM 0 HA PRO A 7 2.220 13.447 -18.339 1.00 25.00 H new ATOM 0 HB2 PRO A 7 1.909 16.138 -17.598 1.00 25.00 H new ATOM 0 HB3 PRO A 7 0.902 15.490 -18.878 1.00 25.00 H new ATOM 0 HG2 PRO A 7 0.335 15.948 -16.085 1.00 25.00 H new ATOM 0 HG3 PRO A 7 -0.550 16.402 -17.528 1.00 25.00 H new ATOM 0 HD2 PRO A 7 -1.256 14.137 -16.168 1.00 25.00 H new ATOM 0 HD3 PRO A 7 -1.337 14.156 -17.919 1.00 25.00 H new ATOM 114 N GLY A 8 3.893 13.750 -16.933 1.00 25.00 N ATOM 115 CA GLY A 8 5.117 14.020 -16.152 1.00 25.00 C ATOM 116 C GLY A 8 5.598 12.804 -15.323 1.00 25.00 C ATOM 117 O GLY A 8 5.548 12.868 -14.110 1.00 25.00 O ATOM 0 H GLY A 8 4.071 13.388 -17.870 1.00 25.00 H new ATOM 0 HA2 GLY A 8 5.913 14.325 -16.832 1.00 25.00 H new ATOM 0 HA3 GLY A 8 4.933 14.858 -15.480 1.00 25.00 H new ATOM 121 N SER A 9 6.082 11.757 -15.958 1.00 25.00 N ATOM 122 CA SER A 9 6.685 10.604 -15.265 1.00 25.00 C ATOM 123 C SER A 9 7.986 11.030 -14.671 1.00 25.00 C ATOM 124 O SER A 9 8.830 11.753 -15.218 1.00 25.00 O ATOM 125 CB SER A 9 6.859 9.454 -16.250 1.00 25.00 C ATOM 126 OG SER A 9 7.759 8.477 -15.730 1.00 25.00 O ATOM 0 H SER A 9 6.075 11.667 -16.974 1.00 25.00 H new ATOM 0 HA SER A 9 6.039 10.253 -14.460 1.00 25.00 H new ATOM 0 HB2 SER A 9 5.892 8.993 -16.454 1.00 25.00 H new ATOM 0 HB3 SER A 9 7.237 9.835 -17.199 1.00 25.00 H new ATOM 0 HG SER A 9 7.857 7.746 -16.375 1.00 25.00 H new ATOM 132 N ARG A 10 8.207 10.570 -13.431 1.00 25.00 N ATOM 133 CA ARG A 10 9.452 10.889 -12.676 1.00 25.00 C ATOM 134 C ARG A 10 10.385 9.697 -12.986 1.00 25.00 C ATOM 135 O ARG A 10 11.649 9.870 -12.866 1.00 25.00 O ATOM 136 CB ARG A 10 9.177 10.986 -11.169 1.00 25.00 C ATOM 137 CG ARG A 10 8.591 9.764 -10.481 1.00 25.00 C ATOM 138 CD ARG A 10 8.617 10.041 -8.929 1.00 25.00 C ATOM 139 NE ARG A 10 9.935 10.102 -8.290 1.00 25.00 N ATOM 140 CZ ARG A 10 10.120 10.556 -7.046 1.00 25.00 C ATOM 141 NH1 ARG A 10 11.355 10.721 -6.634 1.00 25.00 N1+ ATOM 142 NH2 ARG A 10 9.129 10.878 -6.249 1.00 25.00 N ATOM 0 H ARG A 10 7.550 9.978 -12.922 1.00 25.00 H new ATOM 0 HA ARG A 10 9.880 11.850 -12.962 1.00 25.00 H new ATOM 0 HB2 ARG A 10 10.115 11.234 -10.672 1.00 25.00 H new ATOM 0 HB3 ARG A 10 8.498 11.822 -11.005 1.00 25.00 H new ATOM 0 HG2 ARG A 10 7.572 9.583 -10.822 1.00 25.00 H new ATOM 0 HG3 ARG A 10 9.170 8.873 -10.722 1.00 25.00 H new ATOM 0 HD2 ARG A 10 8.106 10.986 -8.744 1.00 25.00 H new ATOM 0 HD3 ARG A 10 8.036 9.262 -8.435 1.00 25.00 H new ATOM 0 HE ARG A 10 10.748 9.784 -8.818 1.00 25.00 H new ATOM 0 HH11 ARG A 10 12.134 10.505 -7.257 1.00 25.00 H new ATOM 0 HH12 ARG A 10 11.536 11.066 -5.691 1.00 25.00 H new ATOM 0 HH21 ARG A 10 8.165 10.786 -6.571 1.00 25.00 H new ATOM 0 HH22 ARG A 10 9.322 11.220 -5.308 1.00 25.00 H new ATOM 156 N ALA A 11 9.852 8.565 -13.446 1.00 25.00 N ATOM 157 CA ALA A 11 10.657 7.408 -13.900 1.00 25.00 C ATOM 158 C ALA A 11 11.433 7.715 -15.190 1.00 25.00 C ATOM 159 O ALA A 11 12.503 7.177 -15.445 1.00 25.00 O ATOM 160 CB ALA A 11 9.793 6.145 -13.995 1.00 25.00 C ATOM 0 H ALA A 11 8.846 8.414 -13.518 1.00 25.00 H new ATOM 0 HA ALA A 11 11.419 7.209 -13.147 1.00 25.00 H new ATOM 0 HB1 ALA A 11 10.407 5.309 -14.330 1.00 25.00 H new ATOM 0 HB2 ALA A 11 9.373 5.917 -13.015 1.00 25.00 H new ATOM 0 HB3 ALA A 11 8.984 6.310 -14.707 1.00 25.00 H new ATOM 166 N ALA A 12 10.797 8.529 -16.018 1.00 25.00 N ATOM 167 CA ALA A 12 11.391 9.009 -17.228 1.00 25.00 C ATOM 168 C ALA A 12 12.672 9.759 -16.925 1.00 25.00 C ATOM 169 O ALA A 12 13.717 9.529 -17.527 1.00 25.00 O ATOM 170 CB ALA A 12 10.440 9.890 -17.979 1.00 25.00 C ATOM 0 H ALA A 12 9.849 8.870 -15.857 1.00 25.00 H new ATOM 0 HA ALA A 12 11.626 8.149 -17.854 1.00 25.00 H new ATOM 0 HB1 ALA A 12 10.916 10.242 -18.895 1.00 25.00 H new ATOM 0 HB2 ALA A 12 9.542 9.325 -18.230 1.00 25.00 H new ATOM 0 HB3 ALA A 12 10.169 10.745 -17.359 1.00 25.00 H new ATOM 176 N LEU A 13 12.594 10.496 -15.825 1.00 25.00 N ATOM 177 CA LEU A 13 13.650 11.402 -15.453 1.00 25.00 C ATOM 178 C LEU A 13 14.740 10.624 -14.634 1.00 25.00 C ATOM 179 O LEU A 13 15.855 11.124 -14.451 1.00 25.00 O ATOM 180 CB LEU A 13 13.127 12.570 -14.593 1.00 25.00 C ATOM 181 CG LEU A 13 12.294 13.537 -15.563 1.00 25.00 C ATOM 182 CD1 LEU A 13 11.500 14.472 -14.713 1.00 75.00 C ATOM 183 CD2 LEU A 13 13.180 14.336 -16.448 1.00 75.00 C ATOM 0 H LEU A 13 11.805 10.477 -15.179 1.00 25.00 H new ATOM 0 HA LEU A 13 14.072 11.812 -16.370 1.00 25.00 H new ATOM 0 HB2 LEU A 13 12.496 12.200 -13.784 1.00 25.00 H new ATOM 0 HB3 LEU A 13 13.955 13.108 -14.131 1.00 25.00 H new ATOM 0 HG LEU A 13 11.655 12.923 -16.197 1.00 25.00 H new ATOM 0 HD11 LEU A 13 10.923 15.142 -15.350 1.00 75.00 H new ATOM 0 HD12 LEU A 13 10.822 13.901 -14.079 1.00 75.00 H new ATOM 0 HD13 LEU A 13 12.174 15.057 -14.088 1.00 75.00 H new ATOM 0 HD21 LEU A 13 12.573 14.977 -17.088 1.00 75.00 H new ATOM 0 HD22 LEU A 13 13.842 14.953 -15.840 1.00 75.00 H new ATOM 0 HD23 LEU A 13 13.776 13.666 -17.067 1.00 75.00 H new ATOM 195 N CYS A 14 14.362 9.430 -14.156 1.00 25.00 N ATOM 196 CA CYS A 14 15.163 8.549 -13.389 1.00 25.00 C ATOM 197 C CYS A 14 16.163 7.710 -14.222 1.00 25.00 C ATOM 198 O CYS A 14 17.006 7.080 -13.616 1.00 25.00 O ATOM 199 CB CYS A 14 14.321 7.514 -12.638 1.00 25.00 C ATOM 200 SG CYS A 14 15.193 6.933 -11.172 1.00 25.00 S ATOM 0 H CYS A 14 13.426 9.059 -14.321 1.00 25.00 H new ATOM 0 HA CYS A 14 15.696 9.225 -12.721 1.00 25.00 H new ATOM 0 HB2 CYS A 14 13.366 7.954 -12.350 1.00 25.00 H new ATOM 0 HB3 CYS A 14 14.099 6.672 -13.294 1.00 25.00 H new ATOM 205 N SER A 15 16.068 7.678 -15.526 1.00 25.00 N ATOM 206 CA SER A 15 16.912 6.910 -16.422 1.00 25.00 C ATOM 207 C SER A 15 18.424 7.146 -16.060 1.00 25.00 C ATOM 208 O SER A 15 18.946 8.285 -15.991 1.00 25.00 O ATOM 209 CB SER A 15 16.709 7.351 -17.878 1.00 25.00 C ATOM 210 OG SER A 15 17.560 6.666 -18.684 1.00 25.00 O ATOM 0 H SER A 15 15.360 8.216 -16.026 1.00 25.00 H new ATOM 0 HA SER A 15 16.643 5.859 -16.312 1.00 25.00 H new ATOM 0 HB2 SER A 15 15.678 7.170 -18.183 1.00 25.00 H new ATOM 0 HB3 SER A 15 16.886 8.422 -17.972 1.00 25.00 H new ATOM 0 HG SER A 15 17.428 6.947 -19.613 1.00 25.00 H new ATOM 216 N GLU A 16 19.178 6.085 -16.015 1.00 25.00 N ATOM 217 CA GLU A 16 20.614 6.023 -15.708 1.00 25.00 C ATOM 218 C GLU A 16 21.447 6.740 -16.854 1.00 25.00 C ATOM 219 O GLU A 16 22.555 7.257 -16.620 1.00 25.00 O ATOM 220 CB GLU A 16 20.998 4.553 -15.790 1.00 25.00 C ATOM 221 CG GLU A 16 22.430 4.257 -15.372 1.00 25.00 C ATOM 222 CD GLU A 16 22.812 2.784 -15.425 1.00 25.00 C ATOM 223 OE1 GLU A 16 22.650 2.180 -16.545 1.00 25.00 O ATOM 224 OE2 GLU A 16 23.294 2.186 -14.381 1.00 25.00 O1- ATOM 0 H GLU A 16 18.793 5.159 -16.204 1.00 25.00 H new ATOM 0 HA GLU A 16 20.810 6.487 -14.741 1.00 25.00 H new ATOM 0 HB2 GLU A 16 20.321 3.977 -15.159 1.00 25.00 H new ATOM 0 HB3 GLU A 16 20.852 4.208 -16.813 1.00 25.00 H new ATOM 0 HG2 GLU A 16 23.107 4.818 -16.017 1.00 25.00 H new ATOM 0 HG3 GLU A 16 22.581 4.622 -14.356 1.00 25.00 H new ATOM 231 N ALA A 17 20.863 6.884 -18.037 1.00 25.00 N ATOM 232 CA ALA A 17 21.552 7.653 -19.116 1.00 25.00 C ATOM 233 C ALA A 17 21.828 9.142 -18.790 1.00 25.00 C ATOM 234 O ALA A 17 22.611 9.787 -19.501 1.00 25.00 O ATOM 235 CB ALA A 17 20.765 7.535 -20.441 1.00 25.00 C ATOM 0 H ALA A 17 19.951 6.503 -18.288 1.00 25.00 H new ATOM 0 HA ALA A 17 22.536 7.194 -19.210 1.00 25.00 H new ATOM 0 HB1 ALA A 17 21.277 8.100 -21.220 1.00 25.00 H new ATOM 0 HB2 ALA A 17 20.702 6.487 -20.735 1.00 25.00 H new ATOM 0 HB3 ALA A 17 19.760 7.935 -20.304 1.00 25.00 H new ATOM 241 N PHE A 18 21.224 9.667 -17.763 1.00 25.00 N ATOM 242 CA PHE A 18 21.600 10.924 -17.204 1.00 25.00 C ATOM 243 C PHE A 18 23.078 11.005 -16.828 1.00 25.00 C ATOM 244 O PHE A 18 23.700 12.067 -16.918 1.00 25.00 O ATOM 245 CB PHE A 18 20.781 11.282 -15.969 1.00 25.00 C ATOM 246 CG PHE A 18 20.742 12.719 -15.582 1.00 25.00 C ATOM 247 CD1 PHE A 18 19.859 13.587 -16.301 1.00 50.00 C ATOM 248 CD2 PHE A 18 21.564 13.297 -14.580 1.00 50.00 C ATOM 249 CE1 PHE A 18 19.869 15.006 -16.133 1.00 25.00 C ATOM 250 CE2 PHE A 18 21.659 14.750 -14.408 1.00 25.00 C ATOM 251 CZ PHE A 18 20.694 15.560 -15.157 1.00 25.00 C ATOM 0 H PHE A 18 20.441 9.221 -17.285 1.00 25.00 H new ATOM 0 HA PHE A 18 21.399 11.638 -18.003 1.00 25.00 H new ATOM 0 HB2 PHE A 18 19.757 10.946 -16.132 1.00 25.00 H new ATOM 0 HB3 PHE A 18 21.173 10.714 -15.125 1.00 25.00 H new ATOM 0 HD1 PHE A 18 19.158 13.152 -16.998 1.00 50.00 H new ATOM 0 HD2 PHE A 18 22.133 12.651 -13.928 1.00 50.00 H new ATOM 0 HE1 PHE A 18 19.248 15.637 -16.751 1.00 25.00 H new ATOM 0 HE2 PHE A 18 22.400 15.199 -13.764 1.00 25.00 H new ATOM 0 HZ PHE A 18 20.621 16.617 -14.946 1.00 25.00 H new ATOM 261 N GLY A 19 23.772 9.882 -16.614 1.00 25.00 N ATOM 262 CA GLY A 19 25.200 9.952 -16.322 1.00 25.00 C ATOM 263 C GLY A 19 25.875 8.787 -15.598 1.00 25.00 C ATOM 264 O GLY A 19 26.909 9.014 -15.004 1.00 25.00 O ATOM 0 H GLY A 19 23.379 8.941 -16.637 1.00 25.00 H new ATOM 0 HA2 GLY A 19 25.721 10.095 -17.269 1.00 25.00 H new ATOM 0 HA3 GLY A 19 25.369 10.849 -15.727 1.00 25.00 H new ATOM 268 N PHE A 20 25.221 7.649 -15.588 1.00 25.00 N ATOM 269 CA PHE A 20 25.799 6.429 -14.932 1.00 25.00 C ATOM 270 C PHE A 20 26.231 6.601 -13.445 1.00 25.00 C ATOM 271 O PHE A 20 27.092 5.891 -12.919 1.00 25.00 O ATOM 272 CB PHE A 20 26.913 5.911 -15.861 1.00 25.00 C ATOM 273 CG PHE A 20 27.217 4.529 -15.576 1.00 25.00 C ATOM 274 CD1 PHE A 20 26.267 3.499 -15.890 1.00 50.00 C ATOM 275 CD2 PHE A 20 28.489 4.114 -15.098 1.00 50.00 C ATOM 276 CE1 PHE A 20 26.512 2.136 -15.641 1.00 25.00 C ATOM 277 CE2 PHE A 20 28.790 2.743 -14.916 1.00 25.00 C ATOM 278 CZ PHE A 20 27.783 1.747 -15.102 1.00 25.00 C ATOM 0 H PHE A 20 24.303 7.511 -16.010 1.00 25.00 H new ATOM 0 HA PHE A 20 25.014 5.681 -14.823 1.00 25.00 H new ATOM 0 HB2 PHE A 20 26.602 6.013 -16.901 1.00 25.00 H new ATOM 0 HB3 PHE A 20 27.809 6.519 -15.735 1.00 25.00 H new ATOM 0 HD1 PHE A 20 25.325 3.782 -16.336 1.00 50.00 H new ATOM 0 HD2 PHE A 20 29.239 4.857 -14.870 1.00 50.00 H new ATOM 0 HE1 PHE A 20 25.755 1.395 -15.852 1.00 25.00 H new ATOM 0 HE2 PHE A 20 29.790 2.447 -14.634 1.00 25.00 H new ATOM 0 HZ PHE A 20 27.976 0.717 -14.841 1.00 25.00 H new ATOM 288 N LEU A 21 25.690 7.609 -12.750 1.00 25.00 N ATOM 289 CA LEU A 21 26.112 7.906 -11.404 1.00 25.00 C ATOM 290 C LEU A 21 25.336 7.030 -10.447 1.00 25.00 C ATOM 291 O LEU A 21 25.898 6.643 -9.433 1.00 25.00 O ATOM 292 CB LEU A 21 25.777 9.359 -10.988 1.00 25.00 C ATOM 293 CG LEU A 21 26.655 10.503 -11.476 1.00 25.00 C ATOM 294 CD1 LEU A 21 25.999 11.862 -11.444 1.00 50.00 C ATOM 295 CD2 LEU A 21 27.977 10.574 -10.779 1.00 50.00 C ATOM 0 H LEU A 21 24.960 8.224 -13.110 1.00 25.00 H new ATOM 0 HA LEU A 21 27.189 7.745 -11.370 1.00 25.00 H new ATOM 0 HB2 LEU A 21 24.759 9.566 -11.318 1.00 25.00 H new ATOM 0 HB3 LEU A 21 25.772 9.393 -9.899 1.00 25.00 H new ATOM 0 HG LEU A 21 26.821 10.248 -12.523 1.00 25.00 H new ATOM 0 HD11 LEU A 21 26.700 12.613 -11.809 1.00 50.00 H new ATOM 0 HD12 LEU A 21 25.113 11.853 -12.079 1.00 50.00 H new ATOM 0 HD13 LEU A 21 25.710 12.102 -10.421 1.00 50.00 H new ATOM 0 HD21 LEU A 21 28.552 11.411 -11.175 1.00 50.00 H new ATOM 0 HD22 LEU A 21 27.818 10.716 -9.710 1.00 50.00 H new ATOM 0 HD23 LEU A 21 28.526 9.647 -10.944 1.00 50.00 H new ATOM 307 N ASN A 22 24.086 6.717 -10.722 1.00 25.00 N ATOM 308 CA ASN A 22 23.258 5.888 -9.877 1.00 25.00 C ATOM 309 C ASN A 22 22.950 4.624 -10.613 1.00 25.00 C ATOM 310 O ASN A 22 23.280 4.476 -11.810 1.00 25.00 O ATOM 311 CB ASN A 22 21.970 6.580 -9.599 1.00 25.00 C ATOM 312 CG ASN A 22 22.108 7.978 -9.000 1.00 25.00 C ATOM 313 OD1 ASN A 22 22.582 8.117 -7.897 1.00 25.00 O ATOM 314 ND2 ASN A 22 21.642 8.979 -9.724 1.00 25.00 N ATOM 0 H ASN A 22 23.608 7.042 -11.562 1.00 25.00 H new ATOM 0 HA ASN A 22 23.781 5.685 -8.942 1.00 25.00 H new ATOM 0 HB2 ASN A 22 21.405 6.653 -10.528 1.00 25.00 H new ATOM 0 HB3 ASN A 22 21.383 5.965 -8.917 1.00 25.00 H new ATOM 0 HD21 ASN A 22 21.671 9.930 -9.357 1.00 25.00 H new ATOM 0 HD22 ASN A 22 21.253 8.801 -10.650 1.00 25.00 H new ATOM 321 N LEU A 23 22.261 3.712 -9.971 1.00 25.00 N ATOM 322 CA LEU A 23 21.677 2.511 -10.704 1.00 25.00 C ATOM 323 C LEU A 23 20.530 2.861 -11.611 1.00 25.00 C ATOM 324 O LEU A 23 20.022 3.957 -11.465 1.00 25.00 O ATOM 325 CB LEU A 23 21.156 1.488 -9.682 1.00 25.00 C ATOM 326 CG LEU A 23 22.150 0.609 -8.834 1.00 25.00 C ATOM 327 CD1 LEU A 23 23.208 1.286 -7.917 1.00 50.00 C ATOM 328 CD2 LEU A 23 21.206 -0.277 -7.980 1.00 50.00 C ATOM 0 H LEU A 23 22.070 3.735 -8.969 1.00 25.00 H new ATOM 0 HA LEU A 23 22.486 2.111 -11.315 1.00 25.00 H new ATOM 0 HB2 LEU A 23 20.530 2.033 -8.976 1.00 25.00 H new ATOM 0 HB3 LEU A 23 20.504 0.801 -10.222 1.00 25.00 H new ATOM 0 HG LEU A 23 22.810 0.111 -9.544 1.00 25.00 H new ATOM 0 HD11 LEU A 23 23.799 0.519 -7.415 1.00 50.00 H new ATOM 0 HD12 LEU A 23 23.865 1.913 -8.520 1.00 50.00 H new ATOM 0 HD13 LEU A 23 22.703 1.901 -7.172 1.00 50.00 H new ATOM 0 HD21 LEU A 23 21.800 -0.935 -7.345 1.00 50.00 H new ATOM 0 HD22 LEU A 23 20.577 0.358 -7.356 1.00 50.00 H new ATOM 0 HD23 LEU A 23 20.577 -0.878 -8.637 1.00 50.00 H new ATOM 340 N ASN A 24 20.092 1.879 -12.392 1.00 25.00 N ATOM 341 CA ASN A 24 18.977 1.949 -13.387 1.00 25.00 C ATOM 342 C ASN A 24 17.756 2.813 -13.073 1.00 25.00 C ATOM 343 O ASN A 24 17.294 3.469 -13.939 1.00 25.00 O ATOM 344 CB ASN A 24 18.516 0.515 -13.749 1.00 25.00 C ATOM 345 CG ASN A 24 17.607 0.406 -14.887 1.00 25.00 C ATOM 346 OD1 ASN A 24 17.729 1.026 -15.911 1.00 25.00 O ATOM 347 ND2 ASN A 24 16.622 -0.397 -14.687 1.00 25.00 N ATOM 0 H ASN A 24 20.516 0.952 -12.362 1.00 25.00 H new ATOM 0 HA ASN A 24 19.436 2.481 -14.220 1.00 25.00 H new ATOM 0 HB2 ASN A 24 19.400 -0.089 -13.955 1.00 25.00 H new ATOM 0 HB3 ASN A 24 18.029 0.079 -12.877 1.00 25.00 H new ATOM 0 HD21 ASN A 24 15.913 -0.524 -15.409 1.00 25.00 H new ATOM 0 HD22 ASN A 24 16.550 -0.907 -13.806 1.00 25.00 H new ATOM 354 N CYS A 25 17.380 2.790 -11.787 1.00 25.00 N ATOM 355 CA CYS A 25 16.707 3.921 -11.160 1.00 25.00 C ATOM 356 C CYS A 25 17.098 4.060 -9.677 1.00 25.00 C ATOM 357 O CYS A 25 17.014 5.157 -9.157 1.00 25.00 O ATOM 358 CB CYS A 25 15.179 3.874 -11.376 1.00 25.00 C ATOM 359 SG CYS A 25 14.213 5.212 -10.583 1.00 25.00 S ATOM 0 H CYS A 25 17.534 1.996 -11.165 1.00 25.00 H new ATOM 0 HA CYS A 25 17.054 4.827 -11.657 1.00 25.00 H new ATOM 0 HB2 CYS A 25 14.983 3.898 -12.448 1.00 25.00 H new ATOM 0 HB3 CYS A 25 14.809 2.918 -11.006 1.00 25.00 H new ATOM 364 N GLY A 26 17.579 2.973 -9.062 1.00 25.00 N ATOM 365 CA GLY A 26 17.915 2.953 -7.659 1.00 25.00 C ATOM 366 C GLY A 26 16.676 2.466 -6.932 1.00 25.00 C ATOM 367 O GLY A 26 15.635 3.079 -6.931 1.00 25.00 O ATOM 0 H GLY A 26 17.742 2.086 -9.538 1.00 25.00 H new ATOM 0 HA2 GLY A 26 18.761 2.292 -7.471 1.00 25.00 H new ATOM 0 HA3 GLY A 26 18.203 3.946 -7.314 1.00 25.00 H new ATOM 371 N SER A 27 16.810 1.361 -6.194 1.00 25.00 N ATOM 372 CA SER A 27 15.717 0.579 -5.626 1.00 25.00 C ATOM 373 C SER A 27 14.627 1.208 -4.681 1.00 25.00 C ATOM 374 O SER A 27 13.621 0.535 -4.424 1.00 25.00 O ATOM 375 CB SER A 27 16.311 -0.582 -4.856 1.00 25.00 C ATOM 376 OG SER A 27 17.595 -0.900 -5.312 1.00 25.00 O ATOM 0 H SER A 27 17.726 0.973 -5.968 1.00 25.00 H new ATOM 0 HA SER A 27 15.151 0.366 -6.533 1.00 25.00 H new ATOM 0 HB2 SER A 27 16.352 -0.333 -3.796 1.00 25.00 H new ATOM 0 HB3 SER A 27 15.663 -1.453 -4.954 1.00 25.00 H new ATOM 0 HG SER A 27 17.950 -1.652 -4.793 1.00 25.00 H new ATOM 382 N VAL A 28 14.762 2.481 -4.233 1.00 25.00 N ATOM 383 CA VAL A 28 13.678 3.221 -3.564 1.00 25.00 C ATOM 384 C VAL A 28 12.463 3.404 -4.460 1.00 25.00 C ATOM 385 O VAL A 28 11.362 3.552 -3.986 1.00 25.00 O ATOM 386 CB VAL A 28 14.151 4.689 -2.991 1.00 25.00 C ATOM 387 CG1 VAL A 28 14.575 5.612 -4.075 1.00 50.00 C ATOM 388 CG2 VAL A 28 13.139 5.362 -2.011 1.00 50.00 C ATOM 0 H VAL A 28 15.625 3.017 -4.328 1.00 25.00 H new ATOM 0 HA VAL A 28 13.404 2.597 -2.714 1.00 25.00 H new ATOM 0 HB VAL A 28 15.029 4.473 -2.383 1.00 25.00 H new ATOM 0 HG11 VAL A 28 14.877 6.566 -3.643 1.00 50.00 H new ATOM 0 HG12 VAL A 28 15.415 5.176 -4.616 1.00 50.00 H new ATOM 0 HG13 VAL A 28 13.744 5.772 -4.762 1.00 50.00 H new ATOM 0 HG21 VAL A 28 13.534 6.324 -1.685 1.00 50.00 H new ATOM 0 HG22 VAL A 28 12.187 5.514 -2.519 1.00 50.00 H new ATOM 0 HG23 VAL A 28 12.989 4.718 -1.144 1.00 50.00 H new ATOM 398 N MET A 29 12.639 3.141 -5.734 1.00 25.00 N ATOM 399 CA MET A 29 11.632 3.070 -6.830 1.00 25.00 C ATOM 400 C MET A 29 10.369 2.148 -6.673 1.00 25.00 C ATOM 401 O MET A 29 9.405 2.318 -7.320 1.00 25.00 O ATOM 402 CB MET A 29 12.332 2.651 -8.107 1.00 25.00 C ATOM 403 CG MET A 29 12.696 1.178 -8.099 1.00 25.00 C ATOM 404 SD MET A 29 13.676 0.760 -9.483 1.00 25.00 S ATOM 405 CE MET A 29 12.366 0.647 -10.808 1.00 25.00 C ATOM 0 H MET A 29 13.575 2.949 -6.090 1.00 25.00 H new ATOM 0 HA MET A 29 11.219 4.079 -6.821 1.00 25.00 H new ATOM 0 HB2 MET A 29 11.686 2.860 -8.960 1.00 25.00 H new ATOM 0 HB3 MET A 29 13.235 3.247 -8.238 1.00 25.00 H new ATOM 0 HG2 MET A 29 13.236 0.939 -7.183 1.00 25.00 H new ATOM 0 HG3 MET A 29 11.787 0.576 -8.099 1.00 25.00 H new ATOM 0 HE1 MET A 29 12.385 -0.347 -11.254 1.00 25.00 H new ATOM 0 HE2 MET A 29 11.386 0.829 -10.367 1.00 25.00 H new ATOM 0 HE3 MET A 29 12.562 1.394 -11.578 1.00 25.00 H new ATOM 415 N TYR A 30 10.429 1.277 -5.677 1.00 25.00 N ATOM 416 CA TYR A 30 9.253 0.513 -5.273 1.00 25.00 C ATOM 417 C TYR A 30 8.161 1.453 -4.712 1.00 25.00 C ATOM 418 O TYR A 30 6.953 1.347 -5.083 1.00 25.00 O ATOM 419 CB TYR A 30 9.651 -0.507 -4.211 1.00 25.00 C ATOM 420 CG TYR A 30 8.533 -1.368 -3.742 1.00 25.00 C ATOM 421 CD1 TYR A 30 8.323 -2.731 -4.191 1.00 50.00 C ATOM 422 CD2 TYR A 30 7.593 -0.838 -2.849 1.00 50.00 C ATOM 423 CE1 TYR A 30 7.223 -3.511 -3.626 1.00 25.00 C ATOM 424 CE2 TYR A 30 6.548 -1.575 -2.310 1.00 25.00 C ATOM 425 CZ TYR A 30 6.354 -2.957 -2.688 1.00 25.00 C ATOM 426 OH TYR A 30 5.327 -3.686 -2.230 1.00 25.00 O ATOM 0 H TYR A 30 11.271 1.081 -5.136 1.00 25.00 H new ATOM 0 HA TYR A 30 8.851 -0.003 -6.145 1.00 25.00 H new ATOM 0 HB2 TYR A 30 10.440 -1.143 -4.612 1.00 25.00 H new ATOM 0 HB3 TYR A 30 10.071 0.022 -3.355 1.00 25.00 H new ATOM 0 HD1 TYR A 30 8.973 -3.166 -4.936 1.00 50.00 H new ATOM 0 HD2 TYR A 30 7.687 0.200 -2.565 1.00 50.00 H new ATOM 0 HE1 TYR A 30 7.081 -4.534 -3.941 1.00 25.00 H new ATOM 0 HE2 TYR A 30 5.875 -1.113 -1.603 1.00 25.00 H new ATOM 0 HH TYR A 30 4.815 -3.159 -1.582 1.00 25.00 H new ATOM 436 N GLU A 31 8.611 2.460 -3.980 1.00 25.00 N ATOM 437 CA GLU A 31 7.726 3.445 -3.311 1.00 25.00 C ATOM 438 C GLU A 31 8.338 4.821 -3.227 1.00 25.00 C ATOM 439 O GLU A 31 8.489 5.417 -2.110 1.00 25.00 O ATOM 440 CB GLU A 31 7.221 2.873 -1.986 1.00 25.00 C ATOM 441 CG GLU A 31 8.376 2.482 -0.993 1.00 25.00 C ATOM 442 CD GLU A 31 7.920 1.712 0.233 1.00 25.00 C ATOM 443 OE1 GLU A 31 8.284 0.497 0.283 1.00 25.00 O ATOM 444 OE2 GLU A 31 7.301 2.183 1.201 1.00 25.00 O1- ATOM 0 H GLU A 31 9.604 2.632 -3.823 1.00 25.00 H new ATOM 0 HA GLU A 31 6.844 3.610 -3.930 1.00 25.00 H new ATOM 0 HB2 GLU A 31 6.572 3.606 -1.506 1.00 25.00 H new ATOM 0 HB3 GLU A 31 6.612 1.992 -2.188 1.00 25.00 H new ATOM 0 HG2 GLU A 31 9.112 1.883 -1.530 1.00 25.00 H new ATOM 0 HG3 GLU A 31 8.881 3.391 -0.668 1.00 25.00 H new ATOM 451 N PRO A 32 8.639 5.428 -4.375 1.00 25.00 N ATOM 452 CA PRO A 32 9.565 6.552 -4.127 1.00 25.00 C ATOM 453 C PRO A 32 8.923 7.825 -3.577 1.00 25.00 C ATOM 454 O PRO A 32 9.547 8.600 -2.861 1.00 25.00 O ATOM 455 CB PRO A 32 10.105 6.782 -5.527 1.00 25.00 C ATOM 456 CG PRO A 32 8.996 6.380 -6.448 1.00 25.00 C ATOM 457 CD PRO A 32 8.405 5.155 -5.795 1.00 25.00 C ATOM 0 HA PRO A 32 10.296 6.315 -3.354 1.00 25.00 H new ATOM 0 HB2 PRO A 32 10.381 7.826 -5.676 1.00 25.00 H new ATOM 0 HB3 PRO A 32 11.000 6.187 -5.706 1.00 25.00 H new ATOM 0 HG2 PRO A 32 8.256 7.173 -6.552 1.00 25.00 H new ATOM 0 HG3 PRO A 32 9.368 6.159 -7.448 1.00 25.00 H new ATOM 0 HD2 PRO A 32 7.344 5.043 -6.020 1.00 25.00 H new ATOM 0 HD3 PRO A 32 8.898 4.240 -6.122 1.00 25.00 H new ATOM 465 N GLN A 33 7.624 7.989 -3.791 1.00 25.00 N ATOM 466 CA GLN A 33 6.880 9.114 -3.279 1.00 25.00 C ATOM 467 C GLN A 33 6.567 8.942 -1.791 1.00 25.00 C ATOM 468 O GLN A 33 6.215 9.883 -1.107 1.00 25.00 O ATOM 469 CB GLN A 33 5.639 9.432 -4.080 1.00 25.00 C ATOM 470 CG GLN A 33 4.398 8.462 -3.913 1.00 25.00 C ATOM 471 CD GLN A 33 4.776 7.019 -4.387 1.00 25.00 C ATOM 472 OE1 GLN A 33 5.500 6.858 -5.282 1.00 25.00 O ATOM 473 NE2 GLN A 33 4.306 6.008 -3.708 1.00 25.00 N ATOM 0 H GLN A 33 7.059 7.334 -4.331 1.00 25.00 H new ATOM 0 HA GLN A 33 7.530 9.982 -3.390 1.00 25.00 H new ATOM 0 HB2 GLN A 33 5.317 10.440 -3.817 1.00 25.00 H new ATOM 0 HB3 GLN A 33 5.914 9.450 -5.135 1.00 25.00 H new ATOM 0 HG2 GLN A 33 4.082 8.440 -2.870 1.00 25.00 H new ATOM 0 HG3 GLN A 33 3.554 8.835 -4.494 1.00 25.00 H new ATOM 0 HE21 GLN A 33 3.672 6.170 -2.926 1.00 25.00 H new ATOM 0 HE22 GLN A 33 4.573 5.056 -3.960 1.00 25.00 H new ATOM 482 N SER A 34 6.722 7.708 -1.293 1.00 25.00 N ATOM 483 CA SER A 34 6.074 7.388 -0.029 1.00 25.00 C ATOM 484 C SER A 34 6.798 8.056 1.160 1.00 25.00 C ATOM 485 O SER A 34 7.989 7.777 1.395 1.00 25.00 O ATOM 486 CB SER A 34 6.171 5.901 0.271 1.00 25.00 C ATOM 487 OG SER A 34 5.662 5.618 1.623 1.00 25.00 O ATOM 0 H SER A 34 7.261 6.956 -1.723 1.00 25.00 H new ATOM 0 HA SER A 34 5.045 7.731 -0.134 1.00 25.00 H new ATOM 0 HB2 SER A 34 5.599 5.336 -0.466 1.00 25.00 H new ATOM 0 HB3 SER A 34 7.207 5.574 0.189 1.00 25.00 H new ATOM 0 HG SER A 34 5.729 4.657 1.803 1.00 25.00 H new ATOM 493 N LEU A 35 6.172 8.945 1.890 1.00 25.00 N ATOM 494 CA LEU A 35 6.598 9.343 3.197 1.00 25.00 C ATOM 495 C LEU A 35 5.426 8.941 4.126 1.00 25.00 C ATOM 496 O LEU A 35 4.356 8.789 3.693 1.00 25.00 O ATOM 497 CB LEU A 35 6.936 10.849 3.267 1.00 25.00 C ATOM 498 CG LEU A 35 8.119 11.431 2.429 1.00 25.00 C ATOM 499 CD1 LEU A 35 7.958 12.964 2.460 1.00 50.00 C ATOM 500 CD2 LEU A 35 9.471 10.987 3.032 1.00 50.00 C ATOM 0 H LEU A 35 5.327 9.423 1.576 1.00 25.00 H new ATOM 0 HA LEU A 35 7.527 8.857 3.495 1.00 25.00 H new ATOM 0 HB2 LEU A 35 6.038 11.395 2.979 1.00 25.00 H new ATOM 0 HB3 LEU A 35 7.133 11.087 4.312 1.00 25.00 H new ATOM 0 HG LEU A 35 8.105 11.068 1.401 1.00 25.00 H new ATOM 0 HD11 LEU A 35 8.762 13.426 1.887 1.00 50.00 H new ATOM 0 HD12 LEU A 35 6.998 13.238 2.023 1.00 50.00 H new ATOM 0 HD13 LEU A 35 8.000 13.314 3.492 1.00 50.00 H new ATOM 0 HD21 LEU A 35 10.287 11.399 2.439 1.00 50.00 H new ATOM 0 HD22 LEU A 35 9.549 11.349 4.057 1.00 50.00 H new ATOM 0 HD23 LEU A 35 9.532 9.899 3.026 1.00 50.00 H new ATOM 512 N GLU A 36 5.730 8.528 5.350 1.00 25.00 N ATOM 513 CA GLU A 36 4.692 8.041 6.255 1.00 25.00 C ATOM 514 C GLU A 36 4.980 8.595 7.641 1.00 25.00 C ATOM 515 O GLU A 36 6.082 8.858 8.063 1.00 25.00 O ATOM 516 CB GLU A 36 4.771 6.481 6.347 1.00 25.00 C ATOM 517 CG GLU A 36 4.490 5.687 5.092 1.00 25.00 C ATOM 518 CD GLU A 36 4.380 4.159 5.348 1.00 25.00 C ATOM 519 OE1 GLU A 36 4.368 3.669 6.481 1.00 25.00 O ATOM 520 OE2 GLU A 36 4.431 3.425 4.315 1.00 25.00 O1- ATOM 0 H GLU A 36 6.674 8.519 5.737 1.00 25.00 H new ATOM 0 HA GLU A 36 3.711 8.350 5.893 1.00 25.00 H new ATOM 0 HB2 GLU A 36 5.769 6.216 6.695 1.00 25.00 H new ATOM 0 HB3 GLU A 36 4.069 6.155 7.114 1.00 25.00 H new ATOM 0 HG2 GLU A 36 3.561 6.042 4.645 1.00 25.00 H new ATOM 0 HG3 GLU A 36 5.283 5.872 4.368 1.00 25.00 H new ATOM 527 N ALA A 37 3.919 8.630 8.432 1.00 25.00 N ATOM 528 CA ALA A 37 3.886 9.100 9.813 1.00 25.00 C ATOM 529 C ALA A 37 3.018 8.091 10.557 1.00 25.00 C ATOM 530 O ALA A 37 2.214 7.496 9.885 1.00 25.00 O ATOM 531 CB ALA A 37 3.400 10.541 9.992 1.00 25.00 C ATOM 0 H ALA A 37 3.004 8.313 8.111 1.00 25.00 H new ATOM 0 HA ALA A 37 4.899 9.150 10.213 1.00 25.00 H new ATOM 0 HB1 ALA A 37 3.410 10.800 11.051 1.00 25.00 H new ATOM 0 HB2 ALA A 37 4.058 11.217 9.447 1.00 25.00 H new ATOM 0 HB3 ALA A 37 2.385 10.633 9.606 1.00 25.00 H new ATOM 537 N LYS A 38 3.146 7.914 11.852 1.00 25.00 N ATOM 538 CA LYS A 38 2.142 7.183 12.631 1.00 25.00 C ATOM 539 C LYS A 38 1.795 7.930 13.907 1.00 25.00 C ATOM 540 O LYS A 38 2.632 8.680 14.384 1.00 25.00 O ATOM 541 CB LYS A 38 2.737 5.769 12.949 1.00 25.00 C ATOM 542 CG LYS A 38 1.812 4.705 13.401 1.00 25.00 C ATOM 543 CD LYS A 38 2.538 3.368 13.559 1.00 25.00 C ATOM 544 CE LYS A 38 1.714 2.130 14.043 1.00 25.00 C ATOM 545 NZ LYS A 38 2.654 0.941 14.238 1.00 25.00 N1+ ATOM 0 H LYS A 38 3.933 8.262 12.400 1.00 25.00 H new ATOM 0 HA LYS A 38 1.216 7.086 12.064 1.00 25.00 H new ATOM 0 HB2 LYS A 38 3.243 5.411 12.052 1.00 25.00 H new ATOM 0 HB3 LYS A 38 3.501 5.894 13.717 1.00 25.00 H new ATOM 0 HG2 LYS A 38 1.362 4.991 14.351 1.00 25.00 H new ATOM 0 HG3 LYS A 38 0.999 4.597 12.683 1.00 25.00 H new ATOM 0 HD2 LYS A 38 2.983 3.116 12.597 1.00 25.00 H new ATOM 0 HD3 LYS A 38 3.359 3.516 14.261 1.00 25.00 H new ATOM 0 HE2 LYS A 38 1.204 2.362 14.978 1.00 25.00 H new ATOM 0 HE3 LYS A 38 0.944 1.883 13.312 1.00 25.00 H new ATOM 0 HZ1 LYS A 38 2.108 0.116 14.560 1.00 25.00 H new ATOM 0 HZ2 LYS A 38 3.121 0.716 13.336 1.00 25.00 H new ATOM 0 HZ3 LYS A 38 3.373 1.180 14.951 1.00 25.00 H new ATOM 559 N LYS A 39 0.623 7.674 14.452 1.00 25.00 N ATOM 560 CA LYS A 39 0.186 8.248 15.773 1.00 25.00 C ATOM 561 C LYS A 39 0.831 7.580 17.013 1.00 25.00 C ATOM 562 O LYS A 39 1.451 6.522 16.930 1.00 25.00 O ATOM 563 CB LYS A 39 -1.258 8.071 15.956 1.00 25.00 C ATOM 564 CG LYS A 39 -2.137 8.838 14.970 1.00 25.00 C ATOM 565 CD LYS A 39 -3.556 8.442 15.077 1.00 25.00 C ATOM 566 CE LYS A 39 -4.371 9.253 14.104 1.00 25.00 C ATOM 567 NZ LYS A 39 -5.810 8.979 14.246 1.00 25.00 N1+ ATOM 0 H LYS A 39 -0.073 7.068 14.018 1.00 25.00 H new ATOM 0 HA LYS A 39 0.497 9.291 15.720 1.00 25.00 H new ATOM 0 HB2 LYS A 39 -1.491 7.009 15.876 1.00 25.00 H new ATOM 0 HB3 LYS A 39 -1.520 8.379 16.968 1.00 25.00 H new ATOM 0 HG2 LYS A 39 -2.043 9.908 15.156 1.00 25.00 H new ATOM 0 HG3 LYS A 39 -1.785 8.659 13.954 1.00 25.00 H new ATOM 0 HD2 LYS A 39 -3.666 7.379 14.864 1.00 25.00 H new ATOM 0 HD3 LYS A 39 -3.915 8.603 16.093 1.00 25.00 H new ATOM 0 HE2 LYS A 39 -4.184 10.314 14.267 1.00 25.00 H new ATOM 0 HE3 LYS A 39 -4.055 9.026 13.086 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 -6.342 9.554 13.562 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 -5.991 7.971 14.066 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 -6.116 9.219 15.211 1.00 25.00 H new ATOM 581 N GLY A 40 0.873 8.272 18.132 1.00 25.00 N ATOM 582 CA GLY A 40 1.520 7.736 19.307 1.00 25.00 C ATOM 583 C GLY A 40 1.836 8.974 20.194 1.00 25.00 C ATOM 584 O GLY A 40 1.874 10.090 19.783 1.00 25.00 O ATOM 0 H GLY A 40 0.469 9.201 18.251 1.00 25.00 H new ATOM 0 HA2 GLY A 40 0.871 7.032 19.828 1.00 25.00 H new ATOM 0 HA3 GLY A 40 2.430 7.196 19.045 1.00 25.00 H new ATOM 588 N PHE A 41 2.113 8.683 21.456 1.00 25.00 N ATOM 589 CA PHE A 41 2.500 9.583 22.509 1.00 25.00 C ATOM 590 C PHE A 41 3.608 9.029 23.412 1.00 25.00 C ATOM 591 O PHE A 41 3.722 7.810 23.541 1.00 25.00 O ATOM 592 CB PHE A 41 1.282 9.884 23.385 1.00 25.00 C ATOM 593 CG PHE A 41 0.260 10.604 22.620 1.00 25.00 C ATOM 594 CD1 PHE A 41 -0.930 9.986 22.218 1.00 25.00 C ATOM 595 CD2 PHE A 41 0.483 11.950 22.320 1.00 25.00 C ATOM 596 CE1 PHE A 41 -1.989 10.770 21.572 1.00 25.00 C ATOM 597 CE2 PHE A 41 -0.580 12.689 21.750 1.00 25.00 C ATOM 598 CZ PHE A 41 -1.801 12.117 21.380 1.00 25.00 C ATOM 0 H PHE A 41 2.065 7.720 21.790 1.00 25.00 H new ATOM 0 HA PHE A 41 2.888 10.478 22.023 1.00 25.00 H new ATOM 0 HB2 PHE A 41 0.866 8.953 23.771 1.00 25.00 H new ATOM 0 HB3 PHE A 41 1.585 10.479 24.246 1.00 25.00 H new ATOM 0 HD1 PHE A 41 -1.069 8.928 22.384 1.00 25.00 H new ATOM 0 HD2 PHE A 41 1.439 12.413 22.517 1.00 25.00 H new ATOM 0 HE1 PHE A 41 -2.904 10.294 21.252 1.00 25.00 H new ATOM 0 HE2 PHE A 41 -0.441 13.748 21.593 1.00 25.00 H new ATOM 0 HZ PHE A 41 -2.584 12.724 20.950 1.00 25.00 H new ATOM 608 N PRO A 42 4.395 9.906 24.113 1.00 25.00 N ATOM 609 CA PRO A 42 4.381 11.381 24.153 1.00 25.00 C ATOM 610 C PRO A 42 4.823 12.054 22.830 1.00 25.00 C ATOM 611 O PRO A 42 4.364 13.161 22.592 1.00 25.00 O ATOM 612 CB PRO A 42 5.294 11.733 25.321 1.00 25.00 C ATOM 613 CG PRO A 42 6.252 10.698 25.253 1.00 25.00 C ATOM 614 CD PRO A 42 5.456 9.409 25.028 1.00 25.00 C ATOM 0 HA PRO A 42 3.367 11.760 24.283 1.00 25.00 H new ATOM 0 HB2 PRO A 42 5.746 12.718 25.206 1.00 25.00 H new ATOM 0 HB3 PRO A 42 4.761 11.736 26.272 1.00 25.00 H new ATOM 0 HG2 PRO A 42 6.957 10.870 24.439 1.00 25.00 H new ATOM 0 HG3 PRO A 42 6.834 10.643 26.173 1.00 25.00 H new ATOM 0 HD2 PRO A 42 6.059 8.622 24.575 1.00 25.00 H new ATOM 0 HD3 PRO A 42 5.049 9.005 25.955 1.00 25.00 H new ATOM 622 N HIS A 43 5.701 11.438 21.988 1.00 25.00 N ATOM 623 CA HIS A 43 6.194 12.092 20.769 1.00 25.00 C ATOM 624 C HIS A 43 6.087 11.205 19.522 1.00 25.00 C ATOM 625 O HIS A 43 6.612 11.572 18.471 1.00 25.00 O ATOM 626 CB HIS A 43 7.664 12.604 20.926 1.00 25.00 C ATOM 627 CG HIS A 43 8.644 11.544 21.295 1.00 25.00 C ATOM 628 ND1 HIS A 43 9.187 10.708 20.379 1.00 25.00 N ATOM 629 CD2 HIS A 43 9.100 11.093 22.521 1.00 25.00 C ATOM 630 CE1 HIS A 43 9.962 9.825 21.015 1.00 25.00 C ATOM 631 NE2 HIS A 43 9.882 10.002 22.298 1.00 25.00 N ATOM 0 H HIS A 43 6.071 10.500 22.140 1.00 25.00 H new ATOM 0 HA HIS A 43 5.536 12.949 20.624 1.00 25.00 H new ATOM 0 HB2 HIS A 43 7.979 13.064 19.989 1.00 25.00 H new ATOM 0 HB3 HIS A 43 7.686 13.384 21.687 1.00 25.00 H new ATOM 0 HD1 HIS A 43 9.031 10.746 19.372 1.00 25.00 H new ATOM 0 HD2 HIS A 43 8.875 11.529 23.483 1.00 25.00 H new ATOM 0 HE1 HIS A 43 10.567 9.073 20.531 1.00 25.00 H new ATOM 639 N SER A 44 5.365 10.093 19.703 1.00 25.00 N ATOM 640 CA SER A 44 5.322 9.010 18.768 1.00 25.00 C ATOM 641 C SER A 44 6.670 8.429 18.595 1.00 25.00 C ATOM 642 O SER A 44 7.450 8.384 19.554 1.00 25.00 O ATOM 643 CB SER A 44 4.572 9.419 17.461 1.00 25.00 C ATOM 644 OG SER A 44 3.956 8.353 16.828 1.00 25.00 O ATOM 0 H SER A 44 4.788 9.937 20.529 1.00 25.00 H new ATOM 0 HA SER A 44 4.718 8.192 19.161 1.00 25.00 H new ATOM 0 HB2 SER A 44 3.822 10.173 17.701 1.00 25.00 H new ATOM 0 HB3 SER A 44 5.280 9.881 16.773 1.00 25.00 H new ATOM 0 HG SER A 44 4.333 8.244 15.930 1.00 25.00 H new ATOM 650 N GLY A 45 7.036 7.935 17.397 1.00 25.00 N ATOM 651 CA GLY A 45 8.450 7.582 17.171 1.00 25.00 C ATOM 652 C GLY A 45 9.420 8.773 17.220 1.00 25.00 C ATOM 653 O GLY A 45 9.063 9.934 17.510 1.00 25.00 O ATOM 0 H GLY A 45 6.409 7.777 16.608 1.00 25.00 H new ATOM 0 HA2 GLY A 45 8.753 6.852 17.921 1.00 25.00 H new ATOM 0 HA3 GLY A 45 8.539 7.097 16.199 1.00 25.00 H new ATOM 657 N PRO A 46 10.632 8.537 16.681 1.00 25.00 N ATOM 658 CA PRO A 46 11.606 9.590 16.461 1.00 25.00 C ATOM 659 C PRO A 46 11.176 10.609 15.377 1.00 25.00 C ATOM 660 O PRO A 46 10.134 10.462 14.724 1.00 25.00 O ATOM 661 CB PRO A 46 12.828 8.847 16.017 1.00 25.00 C ATOM 662 CG PRO A 46 12.329 7.702 15.410 1.00 25.00 C ATOM 663 CD PRO A 46 11.195 7.256 16.255 1.00 25.00 C ATOM 0 HA PRO A 46 11.747 10.190 17.360 1.00 25.00 H new ATOM 0 HB2 PRO A 46 13.423 9.439 15.322 1.00 25.00 H new ATOM 0 HB3 PRO A 46 13.473 8.602 16.861 1.00 25.00 H new ATOM 0 HG2 PRO A 46 11.999 7.911 14.392 1.00 25.00 H new ATOM 0 HG3 PRO A 46 13.095 6.929 15.344 1.00 25.00 H new ATOM 0 HD2 PRO A 46 10.476 6.657 15.695 1.00 25.00 H new ATOM 0 HD3 PRO A 46 11.525 6.651 17.100 1.00 25.00 H new ATOM 671 N ALA A 47 11.904 11.721 15.262 1.00 25.00 N ATOM 672 CA ALA A 47 11.544 12.863 14.446 1.00 25.00 C ATOM 673 C ALA A 47 11.559 12.600 12.903 1.00 25.00 C ATOM 674 O ALA A 47 12.487 12.910 12.183 1.00 25.00 O ATOM 675 CB ALA A 47 12.430 14.021 14.756 1.00 25.00 C ATOM 0 H ALA A 47 12.788 11.847 15.754 1.00 25.00 H new ATOM 0 HA ALA A 47 10.508 13.081 14.707 1.00 25.00 H new ATOM 0 HB1 ALA A 47 12.148 14.871 14.135 1.00 25.00 H new ATOM 0 HB2 ALA A 47 12.325 14.288 15.807 1.00 25.00 H new ATOM 0 HB3 ALA A 47 13.466 13.751 14.552 1.00 25.00 H new ATOM 681 N ASP A 48 10.518 11.975 12.392 1.00 25.00 N ATOM 682 CA ASP A 48 10.364 11.846 10.945 1.00 25.00 C ATOM 683 C ASP A 48 8.851 11.908 10.940 1.00 25.00 C ATOM 684 O ASP A 48 8.231 11.654 11.977 1.00 25.00 O ATOM 685 CB ASP A 48 10.909 10.500 10.510 1.00 25.00 C ATOM 686 CG ASP A 48 10.600 10.164 9.064 1.00 25.00 C ATOM 687 OD1 ASP A 48 10.527 11.085 8.211 1.00 25.00 O ATOM 688 OD2 ASP A 48 10.229 9.004 8.828 1.00 25.00 O1- ATOM 0 H ASP A 48 9.771 11.551 12.943 1.00 25.00 H new ATOM 0 HA ASP A 48 10.865 12.557 10.288 1.00 25.00 H new ATOM 0 HB2 ASP A 48 11.989 10.490 10.655 1.00 25.00 H new ATOM 0 HB3 ASP A 48 10.494 9.723 11.152 1.00 25.00 H new ATOM 693 N GLY A 49 8.260 12.259 9.826 1.00 25.00 N ATOM 694 CA GLY A 49 6.820 12.450 9.781 1.00 25.00 C ATOM 695 C GLY A 49 6.440 13.719 10.554 1.00 25.00 C ATOM 696 O GLY A 49 5.317 13.825 11.145 1.00 25.00 O ATOM 0 H GLY A 49 8.742 12.419 8.942 1.00 25.00 H new ATOM 0 HA2 GLY A 49 6.487 12.530 8.746 1.00 25.00 H new ATOM 0 HA3 GLY A 49 6.316 11.585 10.213 1.00 25.00 H new ATOM 700 N GLN A 50 7.291 14.751 10.447 1.00 25.00 N ATOM 701 CA GLN A 50 7.120 16.043 11.098 1.00 25.00 C ATOM 702 C GLN A 50 6.479 17.034 10.085 1.00 25.00 C ATOM 703 O GLN A 50 6.712 18.221 10.166 1.00 25.00 O ATOM 704 CB GLN A 50 8.501 16.578 11.576 1.00 25.00 C ATOM 705 CG GLN A 50 9.304 15.564 12.525 1.00 25.00 C ATOM 706 CD GLN A 50 8.444 15.284 13.793 1.00 25.00 C ATOM 707 OE1 GLN A 50 8.094 16.187 14.503 1.00 25.00 O ATOM 708 NE2 GLN A 50 8.079 14.079 14.018 1.00 25.00 N ATOM 0 H GLN A 50 8.141 14.700 9.886 1.00 25.00 H new ATOM 0 HA GLN A 50 6.469 15.940 11.966 1.00 25.00 H new ATOM 0 HB2 GLN A 50 9.113 16.803 10.703 1.00 25.00 H new ATOM 0 HB3 GLN A 50 8.350 17.516 12.110 1.00 25.00 H new ATOM 0 HG2 GLN A 50 9.511 14.634 11.996 1.00 25.00 H new ATOM 0 HG3 GLN A 50 10.266 15.991 12.807 1.00 25.00 H new ATOM 0 HE21 GLN A 50 8.389 13.328 13.401 1.00 25.00 H new ATOM 0 HE22 GLN A 50 7.478 13.869 14.815 1.00 25.00 H new ATOM 717 N ILE A 51 5.840 16.496 9.091 1.00 25.00 N ATOM 718 CA ILE A 51 5.450 17.297 7.917 1.00 25.00 C ATOM 719 C ILE A 51 4.245 18.177 8.311 1.00 25.00 C ATOM 720 O ILE A 51 4.165 19.369 7.912 1.00 25.00 O ATOM 721 CB ILE A 51 5.076 16.384 6.736 1.00 25.00 C ATOM 722 CG1 ILE A 51 6.321 15.501 6.407 1.00 25.00 C ATOM 723 CG2 ILE A 51 4.468 17.231 5.557 1.00 25.00 C ATOM 724 CD1 ILE A 51 6.005 14.266 5.655 1.00 25.00 C ATOM 0 H ILE A 51 5.568 15.514 9.047 1.00 25.00 H new ATOM 0 HA ILE A 51 6.287 17.921 7.604 1.00 25.00 H new ATOM 0 HB ILE A 51 4.271 15.688 6.973 1.00 25.00 H new ATOM 0 HG12 ILE A 51 7.031 16.093 5.830 1.00 25.00 H new ATOM 0 HG13 ILE A 51 6.817 15.229 7.339 1.00 25.00 H new ATOM 0 HG21 ILE A 51 4.209 16.570 4.730 1.00 25.00 H new ATOM 0 HG22 ILE A 51 3.572 17.747 5.904 1.00 25.00 H new ATOM 0 HG23 ILE A 51 5.201 17.964 5.220 1.00 25.00 H new ATOM 0 HD11 ILE A 51 6.923 13.710 5.467 1.00 25.00 H new ATOM 0 HD12 ILE A 51 5.321 13.650 6.238 1.00 25.00 H new ATOM 0 HD13 ILE A 51 5.538 14.528 4.705 1.00 25.00 H new ATOM 736 N ALA A 52 3.233 17.644 9.007 1.00 25.00 N ATOM 737 CA ALA A 52 2.085 18.406 9.450 1.00 25.00 C ATOM 738 C ALA A 52 2.509 19.503 10.478 1.00 25.00 C ATOM 739 O ALA A 52 1.915 20.603 10.471 1.00 25.00 O ATOM 740 CB ALA A 52 0.999 17.455 9.886 1.00 25.00 C ATOM 0 H ALA A 52 3.199 16.661 9.275 1.00 25.00 H new ATOM 0 HA ALA A 52 1.648 18.984 8.636 1.00 25.00 H new ATOM 0 HB1 ALA A 52 0.131 18.023 10.221 1.00 25.00 H new ATOM 0 HB2 ALA A 52 0.715 16.818 9.048 1.00 25.00 H new ATOM 0 HB3 ALA A 52 1.365 16.835 10.705 1.00 25.00 H new ATOM 746 N SER A 53 3.574 19.190 11.251 1.00 25.00 N ATOM 747 CA SER A 53 4.138 20.189 12.103 1.00 25.00 C ATOM 748 C SER A 53 5.122 21.172 11.433 1.00 25.00 C ATOM 749 O SER A 53 5.878 21.851 12.139 1.00 25.00 O ATOM 750 CB SER A 53 4.770 19.614 13.412 1.00 25.00 C ATOM 751 OG SER A 53 5.861 18.747 13.178 1.00 25.00 O ATOM 0 H SER A 53 4.028 18.277 11.284 1.00 25.00 H new ATOM 0 HA SER A 53 3.257 20.775 12.366 1.00 25.00 H new ATOM 0 HB2 SER A 53 5.102 20.441 14.040 1.00 25.00 H new ATOM 0 HB3 SER A 53 4.003 19.077 13.971 1.00 25.00 H new ATOM 0 HG SER A 53 6.027 18.683 12.214 1.00 25.00 H new ATOM 757 N ALA A 54 5.217 21.089 10.086 1.00 25.00 N ATOM 758 CA ALA A 54 6.216 21.706 9.274 1.00 25.00 C ATOM 759 C ALA A 54 7.653 21.511 9.705 1.00 25.00 C ATOM 760 O ALA A 54 8.550 22.116 9.059 1.00 25.00 O ATOM 761 CB ALA A 54 5.936 23.236 9.047 1.00 25.00 C ATOM 0 H ALA A 54 4.547 20.553 9.534 1.00 25.00 H new ATOM 0 HA ALA A 54 6.121 21.160 8.335 1.00 25.00 H new ATOM 0 HB1 ALA A 54 6.723 23.661 8.424 1.00 25.00 H new ATOM 0 HB2 ALA A 54 4.973 23.360 8.551 1.00 25.00 H new ATOM 0 HB3 ALA A 54 5.918 23.749 10.009 1.00 25.00 H new ATOM 767 N GLY A 55 7.993 20.664 10.646 1.00 25.00 N ATOM 768 CA GLY A 55 9.411 20.491 11.021 1.00 25.00 C ATOM 769 C GLY A 55 10.191 19.997 9.801 1.00 25.00 C ATOM 770 O GLY A 55 11.229 20.547 9.387 1.00 25.00 O ATOM 0 H GLY A 55 7.336 20.085 11.169 1.00 25.00 H new ATOM 0 HA2 GLY A 55 9.825 21.435 11.376 1.00 25.00 H new ATOM 0 HA3 GLY A 55 9.500 19.777 11.839 1.00 25.00 H new ATOM 774 N GLY A 56 9.555 19.083 9.065 1.00 25.00 N ATOM 775 CA GLY A 56 10.218 18.510 7.919 1.00 25.00 C ATOM 776 C GLY A 56 10.241 19.437 6.655 1.00 25.00 C ATOM 777 O GLY A 56 10.861 19.084 5.664 1.00 25.00 O ATOM 0 H GLY A 56 8.611 18.740 9.243 1.00 25.00 H new ATOM 0 HA2 GLY A 56 11.244 18.264 8.193 1.00 25.00 H new ATOM 0 HA3 GLY A 56 9.724 17.574 7.659 1.00 25.00 H new ATOM 781 N LEU A 57 9.620 20.598 6.783 1.00 25.00 N ATOM 782 CA LEU A 57 9.545 21.558 5.685 1.00 25.00 C ATOM 783 C LEU A 57 10.360 22.872 5.931 1.00 25.00 C ATOM 784 O LEU A 57 10.880 23.411 4.958 1.00 25.00 O ATOM 785 CB LEU A 57 8.045 21.888 5.514 1.00 25.00 C ATOM 786 CG LEU A 57 6.902 20.878 5.459 1.00 25.00 C ATOM 787 CD1 LEU A 57 5.563 21.587 5.372 1.00 50.00 C ATOM 788 CD2 LEU A 57 7.195 19.989 4.215 1.00 50.00 C ATOM 0 H LEU A 57 9.157 20.903 7.639 1.00 25.00 H new ATOM 0 HA LEU A 57 9.990 21.116 4.793 1.00 25.00 H new ATOM 0 HB2 LEU A 57 7.799 22.566 6.331 1.00 25.00 H new ATOM 0 HB3 LEU A 57 7.974 22.462 4.590 1.00 25.00 H new ATOM 0 HG LEU A 57 6.842 20.266 6.359 1.00 25.00 H new ATOM 0 HD11 LEU A 57 4.762 20.849 5.334 1.00 50.00 H new ATOM 0 HD12 LEU A 57 5.430 22.222 6.248 1.00 50.00 H new ATOM 0 HD13 LEU A 57 5.534 22.201 4.472 1.00 50.00 H new ATOM 0 HD21 LEU A 57 6.412 19.238 4.112 1.00 50.00 H new ATOM 0 HD22 LEU A 57 7.220 20.612 3.321 1.00 50.00 H new ATOM 0 HD23 LEU A 57 8.158 19.494 4.340 1.00 50.00 H new ATOM 800 N PHE A 58 10.602 23.193 7.187 1.00 25.00 N ATOM 801 CA PHE A 58 11.691 24.148 7.524 1.00 25.00 C ATOM 802 C PHE A 58 13.005 23.426 7.274 1.00 25.00 C ATOM 803 O PHE A 58 13.976 23.995 6.704 1.00 25.00 O ATOM 804 CB PHE A 58 11.566 24.702 8.957 1.00 25.00 C ATOM 805 CG PHE A 58 10.278 25.327 9.295 1.00 25.00 C ATOM 806 CD1 PHE A 58 9.442 24.776 10.277 1.00 50.00 C ATOM 807 CD2 PHE A 58 9.872 26.533 8.679 1.00 50.00 C ATOM 808 CE1 PHE A 58 8.222 25.432 10.625 1.00 25.00 C ATOM 809 CE2 PHE A 58 8.639 27.076 8.913 1.00 25.00 C ATOM 810 CZ PHE A 58 7.796 26.517 9.972 1.00 25.00 C ATOM 0 H PHE A 58 10.085 22.828 7.987 1.00 25.00 H new ATOM 0 HA PHE A 58 11.631 25.035 6.894 1.00 25.00 H new ATOM 0 HB2 PHE A 58 11.747 23.887 9.658 1.00 25.00 H new ATOM 0 HB3 PHE A 58 12.356 25.437 9.112 1.00 25.00 H new ATOM 0 HD1 PHE A 58 9.721 23.856 10.770 1.00 50.00 H new ATOM 0 HD2 PHE A 58 10.552 27.037 8.008 1.00 50.00 H new ATOM 0 HE1 PHE A 58 7.628 25.041 11.438 1.00 25.00 H new ATOM 0 HE2 PHE A 58 8.290 27.910 8.322 1.00 25.00 H new ATOM 0 HZ PHE A 58 6.849 26.973 10.220 1.00 25.00 H new ATOM 820 N GLY A 59 13.035 22.118 7.573 1.00 25.00 N ATOM 821 CA GLY A 59 14.158 21.300 7.210 1.00 25.00 C ATOM 822 C GLY A 59 14.264 20.975 5.741 1.00 25.00 C ATOM 823 O GLY A 59 15.244 20.626 5.236 1.00 25.00 O ATOM 0 H GLY A 59 12.289 21.624 8.063 1.00 25.00 H new ATOM 0 HA2 GLY A 59 15.072 21.806 7.521 1.00 25.00 H new ATOM 0 HA3 GLY A 59 14.104 20.366 7.770 1.00 25.00 H new ATOM 827 N GLY A 60 13.203 21.160 5.001 1.00 25.00 N ATOM 828 CA GLY A 60 13.199 20.954 3.564 1.00 25.00 C ATOM 829 C GLY A 60 14.002 22.017 2.834 1.00 25.00 C ATOM 830 O GLY A 60 14.419 21.846 1.672 1.00 25.00 O ATOM 0 H GLY A 60 12.304 21.461 5.376 1.00 25.00 H new ATOM 0 HA2 GLY A 60 13.610 19.970 3.338 1.00 25.00 H new ATOM 0 HA3 GLY A 60 12.172 20.962 3.200 1.00 25.00 H new ATOM 834 N ILE A 61 14.257 23.136 3.579 1.00 25.00 N ATOM 835 CA ILE A 61 15.092 24.267 3.029 1.00 25.00 C ATOM 836 C ILE A 61 16.534 23.815 3.127 1.00 25.00 C ATOM 837 O ILE A 61 17.354 24.122 2.254 1.00 25.00 O ATOM 838 CB ILE A 61 14.855 25.581 3.782 1.00 25.00 C ATOM 839 CG1 ILE A 61 13.338 25.953 3.665 1.00 25.00 C ATOM 840 CG2 ILE A 61 15.575 26.674 3.122 1.00 25.00 C ATOM 841 CD1 ILE A 61 12.872 27.297 4.248 1.00 25.00 C ATOM 0 H ILE A 61 13.914 23.283 4.528 1.00 25.00 H new ATOM 0 HA ILE A 61 14.818 24.481 1.996 1.00 25.00 H new ATOM 0 HB ILE A 61 15.183 25.453 4.814 1.00 25.00 H new ATOM 0 HG12 ILE A 61 13.072 25.939 2.608 1.00 25.00 H new ATOM 0 HG13 ILE A 61 12.763 25.163 4.149 1.00 25.00 H new ATOM 0 HG21 ILE A 61 15.401 27.604 3.664 1.00 25.00 H new ATOM 0 HG22 ILE A 61 16.642 26.454 3.113 1.00 25.00 H new ATOM 0 HG23 ILE A 61 15.218 26.779 2.098 1.00 25.00 H new ATOM 0 HD11 ILE A 61 11.799 27.410 4.090 1.00 25.00 H new ATOM 0 HD12 ILE A 61 13.086 27.324 5.316 1.00 25.00 H new ATOM 0 HD13 ILE A 61 13.400 28.111 3.752 1.00 25.00 H new ATOM 853 N LEU A 62 16.919 23.050 4.136 1.00 25.00 N ATOM 854 CA LEU A 62 18.322 22.625 4.252 1.00 25.00 C ATOM 855 C LEU A 62 18.569 21.505 3.193 1.00 25.00 C ATOM 856 O LEU A 62 19.729 21.268 2.734 1.00 25.00 O ATOM 857 CB LEU A 62 18.516 22.022 5.656 1.00 25.00 C ATOM 858 CG LEU A 62 18.716 22.872 6.906 1.00 25.00 C ATOM 859 CD1 LEU A 62 17.537 23.756 7.403 1.00 75.00 C ATOM 860 CD2 LEU A 62 18.995 21.872 8.039 1.00 75.00 C ATOM 0 H LEU A 62 16.303 22.712 4.875 1.00 25.00 H new ATOM 0 HA LEU A 62 19.004 23.460 4.095 1.00 25.00 H new ATOM 0 HB2 LEU A 62 17.646 21.394 5.845 1.00 25.00 H new ATOM 0 HB3 LEU A 62 19.379 21.360 5.591 1.00 25.00 H new ATOM 0 HG LEU A 62 19.501 23.581 6.643 1.00 25.00 H new ATOM 0 HD11 LEU A 62 17.840 24.296 8.300 1.00 75.00 H new ATOM 0 HD12 LEU A 62 17.263 24.469 6.625 1.00 75.00 H new ATOM 0 HD13 LEU A 62 16.680 23.123 7.633 1.00 75.00 H new ATOM 0 HD21 LEU A 62 19.150 22.413 8.972 1.00 75.00 H new ATOM 0 HD22 LEU A 62 18.145 21.198 8.147 1.00 75.00 H new ATOM 0 HD23 LEU A 62 19.889 21.294 7.803 1.00 75.00 H new ATOM 872 N ASP A 63 17.450 20.871 2.812 1.00 25.00 N ATOM 873 CA ASP A 63 17.509 19.783 1.801 1.00 25.00 C ATOM 874 C ASP A 63 17.758 20.305 0.385 1.00 25.00 C ATOM 875 O ASP A 63 18.064 19.562 -0.506 1.00 25.00 O ATOM 876 CB ASP A 63 16.181 18.991 1.906 1.00 25.00 C ATOM 877 CG ASP A 63 16.350 17.502 1.521 1.00 25.00 C ATOM 878 OD1 ASP A 63 15.328 16.942 1.164 1.00 50.00 O ATOM 879 OD2 ASP A 63 17.417 16.876 1.595 1.00 50.00 O1- ATOM 0 H ASP A 63 16.517 21.077 3.170 1.00 25.00 H new ATOM 0 HA ASP A 63 18.359 19.132 2.007 1.00 25.00 H new ATOM 0 HB2 ASP A 63 15.800 19.059 2.925 1.00 25.00 H new ATOM 0 HB3 ASP A 63 15.436 19.449 1.256 1.00 25.00 H new ATOM 884 N GLN A 64 17.725 21.628 0.180 1.00 25.00 N ATOM 885 CA GLN A 64 17.957 22.262 -1.076 1.00 25.00 C ATOM 886 C GLN A 64 19.412 22.335 -1.451 1.00 25.00 C ATOM 887 O GLN A 64 19.840 22.906 -2.438 1.00 25.00 O ATOM 888 CB GLN A 64 17.445 23.698 -1.051 1.00 25.00 C ATOM 889 CG GLN A 64 16.046 23.693 -0.802 1.00 25.00 C ATOM 890 CD GLN A 64 15.459 25.121 -0.873 1.00 25.00 C ATOM 891 OE1 GLN A 64 16.190 26.043 -1.042 1.00 25.00 O ATOM 892 NE2 GLN A 64 14.176 25.249 -0.787 1.00 25.00 N ATOM 0 H GLN A 64 17.526 22.291 0.929 1.00 25.00 H new ATOM 0 HA GLN A 64 17.429 21.648 -1.805 1.00 25.00 H new ATOM 0 HB2 GLN A 64 17.962 24.267 -0.278 1.00 25.00 H new ATOM 0 HB3 GLN A 64 17.655 24.188 -2.002 1.00 25.00 H new ATOM 0 HG2 GLN A 64 15.547 23.055 -1.532 1.00 25.00 H new ATOM 0 HG3 GLN A 64 15.851 23.266 0.181 1.00 25.00 H new ATOM 0 HE21 GLN A 64 13.590 24.427 -0.642 1.00 25.00 H new ATOM 0 HE22 GLN A 64 13.749 26.172 -0.865 1.00 25.00 H new ATOM 901 N GLN A 65 20.242 21.645 -0.620 1.00 25.00 N ATOM 902 CA GLN A 65 21.701 21.658 -0.695 1.00 25.00 C ATOM 903 C GLN A 65 22.169 20.211 -0.652 1.00 25.00 C ATOM 904 O GLN A 65 23.128 19.867 0.018 1.00 25.00 O ATOM 905 CB GLN A 65 22.222 22.506 0.476 1.00 25.00 C ATOM 906 CG GLN A 65 21.888 23.956 0.365 1.00 25.00 C ATOM 907 CD GLN A 65 22.668 24.845 1.289 1.00 25.00 C ATOM 908 OE1 GLN A 65 23.825 24.614 1.622 1.00 25.00 O ATOM 909 NE2 GLN A 65 22.117 25.987 1.577 1.00 25.00 N ATOM 0 H GLN A 65 19.890 21.055 0.134 1.00 25.00 H new ATOM 0 HA GLN A 65 22.085 22.103 -1.613 1.00 25.00 H new ATOM 0 HB2 GLN A 65 21.808 22.117 1.406 1.00 25.00 H new ATOM 0 HB3 GLN A 65 23.305 22.396 0.539 1.00 25.00 H new ATOM 0 HG2 GLN A 65 22.061 24.279 -0.662 1.00 25.00 H new ATOM 0 HG3 GLN A 65 20.825 24.088 0.566 1.00 25.00 H new ATOM 0 HE21 GLN A 65 21.154 26.174 1.297 1.00 25.00 H new ATOM 0 HE22 GLN A 65 22.648 26.696 2.083 1.00 25.00 H new ATOM 918 N SER A 66 21.398 19.287 -1.240 1.00 25.00 N ATOM 919 CA SER A 66 21.512 17.865 -1.039 1.00 25.00 C ATOM 920 C SER A 66 21.255 17.078 -2.353 1.00 25.00 C ATOM 921 O SER A 66 20.633 17.608 -3.302 1.00 25.00 O ATOM 922 CB SER A 66 20.464 17.393 -0.029 1.00 25.00 C ATOM 923 OG SER A 66 20.423 15.970 0.071 1.00 25.00 O ATOM 0 H SER A 66 20.653 19.535 -1.891 1.00 25.00 H new ATOM 0 HA SER A 66 22.525 17.678 -0.684 1.00 25.00 H new ATOM 0 HB2 SER A 66 20.685 17.819 0.949 1.00 25.00 H new ATOM 0 HB3 SER A 66 19.483 17.764 -0.324 1.00 25.00 H new ATOM 0 HG SER A 66 19.864 15.712 0.833 1.00 25.00 H new ATOM 929 N GLU A 67 21.764 15.838 -2.427 1.00 25.00 N ATOM 930 CA GLU A 67 21.470 14.906 -3.557 1.00 25.00 C ATOM 931 C GLU A 67 19.968 14.616 -3.609 1.00 25.00 C ATOM 932 O GLU A 67 19.388 14.418 -4.635 1.00 25.00 O ATOM 933 CB GLU A 67 22.361 13.659 -3.460 1.00 25.00 C ATOM 934 CG GLU A 67 22.229 12.658 -4.626 1.00 25.00 C ATOM 935 CD GLU A 67 23.201 11.507 -4.385 1.00 25.00 C ATOM 936 OE1 GLU A 67 24.145 11.310 -5.214 1.00 25.00 O ATOM 937 OE2 GLU A 67 23.048 10.759 -3.379 1.00 25.00 O1- ATOM 0 H GLU A 67 22.385 15.445 -1.720 1.00 25.00 H new ATOM 0 HA GLU A 67 21.719 15.366 -4.513 1.00 25.00 H new ATOM 0 HB2 GLU A 67 23.401 13.980 -3.396 1.00 25.00 H new ATOM 0 HB3 GLU A 67 22.130 13.140 -2.530 1.00 25.00 H new ATOM 0 HG2 GLU A 67 21.207 12.284 -4.691 1.00 25.00 H new ATOM 0 HG3 GLU A 67 22.450 13.149 -5.574 1.00 25.00 H new ATOM 944 N ASN A 68 19.309 14.757 -2.449 1.00 25.00 N ATOM 945 CA ASN A 68 17.900 14.453 -2.165 1.00 25.00 C ATOM 946 C ASN A 68 17.069 15.732 -2.423 1.00 25.00 C ATOM 947 O ASN A 68 15.899 15.820 -2.080 1.00 25.00 O ATOM 948 CB ASN A 68 17.780 13.919 -0.678 1.00 25.00 C ATOM 949 CG ASN A 68 18.540 12.672 -0.405 1.00 25.00 C ATOM 950 OD1 ASN A 68 18.314 11.679 -1.087 1.00 25.00 O ATOM 951 ND2 ASN A 68 19.369 12.677 0.544 1.00 25.00 N ATOM 0 H ASN A 68 19.786 15.115 -1.621 1.00 25.00 H new ATOM 0 HA ASN A 68 17.511 13.670 -2.815 1.00 25.00 H new ATOM 0 HB2 ASN A 68 18.127 14.697 0.002 1.00 25.00 H new ATOM 0 HB3 ASN A 68 16.728 13.744 -0.452 1.00 25.00 H new ATOM 0 HD21 ASN A 68 19.887 11.829 0.773 1.00 25.00 H new ATOM 0 HD22 ASN A 68 19.522 13.529 1.083 1.00 25.00 H new ATOM 958 N ARG A 69 17.675 16.707 -3.086 1.00 25.00 N ATOM 959 CA ARG A 69 16.953 17.879 -3.641 1.00 25.00 C ATOM 960 C ARG A 69 16.283 17.323 -4.872 1.00 25.00 C ATOM 961 O ARG A 69 16.776 17.268 -5.986 1.00 25.00 O ATOM 962 CB ARG A 69 17.816 19.093 -3.956 1.00 25.00 C ATOM 963 CG ARG A 69 16.932 20.281 -4.530 1.00 25.00 C ATOM 964 CD ARG A 69 17.794 21.467 -4.755 1.00 25.00 C ATOM 965 NE ARG A 69 17.067 22.652 -5.137 1.00 25.00 N ATOM 966 CZ ARG A 69 17.462 23.883 -5.377 1.00 25.00 C ATOM 967 NH1 ARG A 69 16.573 24.743 -5.513 1.00 25.00 N1+ ATOM 968 NH2 ARG A 69 18.714 24.272 -5.359 1.00 25.00 N ATOM 0 H ARG A 69 18.680 16.722 -3.262 1.00 25.00 H new ATOM 0 HA ARG A 69 16.262 18.289 -2.904 1.00 25.00 H new ATOM 0 HB2 ARG A 69 18.333 19.421 -3.054 1.00 25.00 H new ATOM 0 HB3 ARG A 69 18.583 18.821 -4.681 1.00 25.00 H new ATOM 0 HG2 ARG A 69 16.458 19.979 -5.464 1.00 25.00 H new ATOM 0 HG3 ARG A 69 16.132 20.525 -3.831 1.00 25.00 H new ATOM 0 HD2 ARG A 69 18.355 21.675 -3.844 1.00 25.00 H new ATOM 0 HD3 ARG A 69 18.522 21.233 -5.532 1.00 25.00 H new ATOM 0 HE ARG A 69 16.062 22.509 -5.240 1.00 25.00 H new ATOM 0 HH11 ARG A 69 15.591 24.478 -5.437 1.00 25.00 H new ATOM 0 HH12 ARG A 69 16.826 25.713 -5.701 1.00 25.00 H new ATOM 0 HH21 ARG A 69 19.453 23.602 -5.149 1.00 25.00 H new ATOM 0 HH22 ARG A 69 18.949 25.245 -5.555 1.00 25.00 H new ATOM 982 N TRP A 70 15.037 17.076 -4.554 1.00 25.00 N ATOM 983 CA TRP A 70 13.937 16.788 -5.483 1.00 25.00 C ATOM 984 C TRP A 70 13.870 17.755 -6.676 1.00 25.00 C ATOM 985 O TRP A 70 14.216 18.945 -6.517 1.00 25.00 O ATOM 986 CB TRP A 70 12.643 16.975 -4.704 1.00 25.00 C ATOM 987 CG TRP A 70 12.671 18.154 -3.657 1.00 25.00 C ATOM 988 CD1 TRP A 70 13.124 19.463 -3.775 1.00 25.00 C ATOM 989 CD2 TRP A 70 12.378 18.009 -2.244 1.00 25.00 C ATOM 990 NE1 TRP A 70 13.128 20.118 -2.545 1.00 25.00 N ATOM 991 CE2 TRP A 70 12.687 19.242 -1.619 1.00 25.00 C ATOM 992 CE3 TRP A 70 11.858 16.941 -1.457 1.00 25.00 C ATOM 993 CZ2 TRP A 70 12.696 19.392 -0.239 1.00 25.00 C ATOM 994 CZ3 TRP A 70 11.798 17.103 -0.053 1.00 25.00 C ATOM 995 CH2 TRP A 70 12.169 18.403 0.548 1.00 25.00 C ATOM 0 H TRP A 70 14.729 17.067 -3.582 1.00 25.00 H new ATOM 0 HA TRP A 70 14.090 15.782 -5.874 1.00 25.00 H new ATOM 0 HB2 TRP A 70 11.832 17.153 -5.410 1.00 25.00 H new ATOM 0 HB3 TRP A 70 12.412 16.047 -4.181 1.00 25.00 H new ATOM 0 HD1 TRP A 70 13.434 19.916 -4.705 1.00 25.00 H new ATOM 0 HE1 TRP A 70 13.412 21.083 -2.376 1.00 25.00 H new ATOM 0 HE3 TRP A 70 11.517 16.028 -1.922 1.00 25.00 H new ATOM 0 HZ2 TRP A 70 13.115 20.281 0.210 1.00 25.00 H new ATOM 0 HZ3 TRP A 70 11.484 16.283 0.576 1.00 25.00 H new ATOM 0 HH2 TRP A 70 12.025 18.572 1.605 1.00 25.00 H new ATOM 1006 N PHE A 71 13.481 17.322 -7.881 1.00 25.00 N ATOM 1007 CA PHE A 71 13.566 18.247 -9.009 1.00 25.00 C ATOM 1008 C PHE A 71 12.356 19.217 -9.005 1.00 25.00 C ATOM 1009 O PHE A 71 11.313 18.751 -8.606 1.00 25.00 O ATOM 1010 CB PHE A 71 13.679 17.458 -10.325 1.00 25.00 C ATOM 1011 CG PHE A 71 12.622 16.393 -10.557 1.00 25.00 C ATOM 1012 CD1 PHE A 71 13.012 15.038 -10.568 1.00 50.00 C ATOM 1013 CD2 PHE A 71 11.283 16.731 -10.875 1.00 50.00 C ATOM 1014 CE1 PHE A 71 12.022 14.072 -10.780 1.00 25.00 C ATOM 1015 CE2 PHE A 71 10.253 15.721 -11.068 1.00 25.00 C ATOM 1016 CZ PHE A 71 10.653 14.368 -11.020 1.00 25.00 C ATOM 0 H PHE A 71 13.124 16.390 -8.092 1.00 25.00 H new ATOM 0 HA PHE A 71 14.464 18.858 -8.914 1.00 25.00 H new ATOM 0 HB2 PHE A 71 13.641 18.165 -11.154 1.00 25.00 H new ATOM 0 HB3 PHE A 71 14.659 16.982 -10.357 1.00 25.00 H new ATOM 0 HD1 PHE A 71 14.043 14.754 -10.417 1.00 50.00 H new ATOM 0 HD2 PHE A 71 11.018 17.773 -10.978 1.00 50.00 H new ATOM 0 HE1 PHE A 71 12.318 13.033 -10.760 1.00 25.00 H new ATOM 0 HE2 PHE A 71 9.223 15.996 -11.241 1.00 25.00 H new ATOM 0 HZ PHE A 71 9.934 13.575 -11.163 1.00 25.00 H new ATOM 1026 N LYS A 72 12.540 20.449 -9.468 1.00 25.00 N ATOM 1027 CA LYS A 72 11.428 21.399 -9.687 1.00 25.00 C ATOM 1028 C LYS A 72 10.864 21.129 -11.092 1.00 25.00 C ATOM 1029 O LYS A 72 11.474 21.539 -12.071 1.00 25.00 O ATOM 1030 CB LYS A 72 11.867 22.817 -9.630 1.00 25.00 C ATOM 1031 CG LYS A 72 12.515 23.295 -8.278 1.00 25.00 C ATOM 1032 CD LYS A 72 13.097 24.676 -8.287 1.00 25.00 C ATOM 1033 CE LYS A 72 12.133 25.870 -8.374 1.00 25.00 C ATOM 1034 NZ LYS A 72 12.952 27.170 -8.258 1.00 25.00 N1+ ATOM 0 H LYS A 72 13.457 20.827 -9.705 1.00 25.00 H new ATOM 0 HA LYS A 72 10.690 21.251 -8.899 1.00 25.00 H new ATOM 0 HB2 LYS A 72 12.586 22.984 -10.432 1.00 25.00 H new ATOM 0 HB3 LYS A 72 11.005 23.450 -9.838 1.00 25.00 H new ATOM 0 HG2 LYS A 72 11.757 23.245 -7.496 1.00 25.00 H new ATOM 0 HG3 LYS A 72 13.301 22.591 -8.005 1.00 25.00 H new ATOM 0 HD2 LYS A 72 13.691 24.793 -7.380 1.00 25.00 H new ATOM 0 HD3 LYS A 72 13.785 24.742 -9.130 1.00 25.00 H new ATOM 0 HE2 LYS A 72 11.588 25.849 -9.318 1.00 25.00 H new ATOM 0 HE3 LYS A 72 11.392 25.817 -7.577 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 12.309 27.974 -8.111 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 13.606 27.098 -7.452 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 13.495 27.317 -9.133 1.00 25.00 H new ATOM 1048 N HIS A 73 9.752 20.439 -11.181 1.00 25.00 N ATOM 1049 CA HIS A 73 9.200 20.063 -12.507 1.00 25.00 C ATOM 1050 C HIS A 73 8.622 21.327 -13.124 1.00 25.00 C ATOM 1051 O HIS A 73 7.700 22.004 -12.540 1.00 25.00 O ATOM 1052 CB HIS A 73 8.146 18.979 -12.421 1.00 25.00 C ATOM 1053 CG HIS A 73 7.749 18.555 -13.777 1.00 25.00 C ATOM 1054 ND1 HIS A 73 8.599 17.789 -14.564 1.00 25.00 N ATOM 1055 CD2 HIS A 73 6.601 18.710 -14.485 1.00 25.00 C ATOM 1056 CE1 HIS A 73 7.962 17.504 -15.694 1.00 25.00 C ATOM 1057 NE2 HIS A 73 6.767 18.058 -15.702 1.00 25.00 N ATOM 0 H HIS A 73 9.204 20.121 -10.382 1.00 25.00 H new ATOM 0 HA HIS A 73 9.997 19.646 -13.123 1.00 25.00 H new ATOM 0 HB2 HIS A 73 8.533 18.127 -11.863 1.00 25.00 H new ATOM 0 HB3 HIS A 73 7.276 19.348 -11.877 1.00 25.00 H new ATOM 0 HD2 HIS A 73 5.719 19.243 -14.162 1.00 25.00 H new ATOM 0 HE1 HIS A 73 8.367 16.902 -16.494 1.00 25.00 H new ATOM 0 HE2 HIS A 73 6.088 18.016 -16.462 1.00 25.00 H new ATOM 1065 N ILE A 74 9.158 21.719 -14.280 1.00 25.00 N ATOM 1066 CA ILE A 74 8.838 22.931 -14.949 1.00 25.00 C ATOM 1067 C ILE A 74 7.586 22.630 -15.671 1.00 25.00 C ATOM 1068 O ILE A 74 7.531 21.596 -16.341 1.00 25.00 O ATOM 1069 CB ILE A 74 9.941 23.377 -15.934 1.00 25.00 C ATOM 1070 CG1 ILE A 74 11.319 23.462 -15.224 1.00 25.00 C ATOM 1071 CG2 ILE A 74 9.559 24.738 -16.537 1.00 25.00 C ATOM 1072 CD1 ILE A 74 12.501 23.426 -16.135 1.00 25.00 C ATOM 0 H ILE A 74 9.853 21.162 -14.777 1.00 25.00 H new ATOM 0 HA ILE A 74 8.740 23.757 -14.244 1.00 25.00 H new ATOM 0 HB ILE A 74 10.026 22.638 -16.731 1.00 25.00 H new ATOM 0 HG12 ILE A 74 11.355 24.383 -14.643 1.00 25.00 H new ATOM 0 HG13 ILE A 74 11.398 22.636 -14.517 1.00 25.00 H new ATOM 0 HG21 ILE A 74 10.334 25.058 -17.233 1.00 25.00 H new ATOM 0 HG22 ILE A 74 8.610 24.648 -17.066 1.00 25.00 H new ATOM 0 HG23 ILE A 74 9.461 25.475 -15.740 1.00 25.00 H new ATOM 0 HD11 ILE A 74 13.416 23.491 -15.546 1.00 25.00 H new ATOM 0 HD12 ILE A 74 12.498 22.493 -16.699 1.00 25.00 H new ATOM 0 HD13 ILE A 74 12.454 24.268 -16.826 1.00 25.00 H new ATOM 1084 N MET A 75 6.577 23.478 -15.554 1.00 25.00 N ATOM 1085 CA MET A 75 5.332 23.270 -16.267 1.00 25.00 C ATOM 1086 C MET A 75 4.727 24.689 -16.612 1.00 25.00 C ATOM 1087 O MET A 75 4.696 25.551 -15.810 1.00 25.00 O ATOM 1088 CB MET A 75 4.346 22.447 -15.409 1.00 25.00 C ATOM 1089 CG MET A 75 3.303 21.573 -16.215 1.00 25.00 C ATOM 1090 SD MET A 75 2.057 20.588 -15.333 1.00 25.00 S ATOM 1091 CE MET A 75 1.530 19.568 -16.801 1.00 25.00 C ATOM 0 H MET A 75 6.598 24.315 -14.972 1.00 25.00 H new ATOM 0 HA MET A 75 5.511 22.708 -17.184 1.00 25.00 H new ATOM 0 HB2 MET A 75 4.921 21.787 -14.760 1.00 25.00 H new ATOM 0 HB3 MET A 75 3.797 23.131 -14.762 1.00 25.00 H new ATOM 0 HG2 MET A 75 2.767 22.246 -16.885 1.00 25.00 H new ATOM 0 HG3 MET A 75 3.873 20.887 -16.841 1.00 25.00 H new ATOM 0 HE1 MET A 75 0.713 18.907 -16.511 1.00 25.00 H new ATOM 0 HE2 MET A 75 1.196 20.228 -17.601 1.00 25.00 H new ATOM 0 HE3 MET A 75 2.373 18.971 -17.151 1.00 25.00 H new ATOM 1101 N THR A 76 4.267 24.880 -17.835 1.00 25.00 N ATOM 1102 CA THR A 76 3.706 26.179 -18.281 1.00 25.00 C ATOM 1103 C THR A 76 2.267 26.193 -17.719 1.00 25.00 C ATOM 1104 O THR A 76 1.609 25.178 -17.533 1.00 25.00 O ATOM 1105 CB THR A 76 3.687 26.377 -19.849 1.00 25.00 C ATOM 1106 OG1 THR A 76 2.776 25.419 -20.371 1.00 25.00 O ATOM 1107 CG2 THR A 76 5.011 26.160 -20.515 1.00 25.00 C ATOM 0 H THR A 76 4.263 24.157 -18.555 1.00 25.00 H new ATOM 0 HA THR A 76 4.330 26.997 -17.920 1.00 25.00 H new ATOM 0 HB THR A 76 3.408 27.412 -20.046 1.00 25.00 H new ATOM 0 HG1 THR A 76 2.731 25.507 -21.346 1.00 25.00 H new ATOM 0 HG21 THR A 76 4.908 26.316 -21.589 1.00 25.00 H new ATOM 0 HG22 THR A 76 5.740 26.865 -20.114 1.00 25.00 H new ATOM 0 HG23 THR A 76 5.350 25.141 -20.327 1.00 25.00 H new ATOM 1115 N GLY A 77 1.807 27.376 -17.447 1.00 25.00 N ATOM 1116 CA GLY A 77 0.424 27.509 -16.915 1.00 25.00 C ATOM 1117 C GLY A 77 -0.762 27.114 -17.784 1.00 25.00 C ATOM 1118 O GLY A 77 -0.641 26.906 -19.010 1.00 25.00 O ATOM 0 H GLY A 77 2.320 28.250 -17.567 1.00 25.00 H new ATOM 0 HA2 GLY A 77 0.369 26.917 -16.001 1.00 25.00 H new ATOM 0 HA3 GLY A 77 0.285 28.551 -16.629 1.00 25.00 H new ATOM 1122 N GLY A 78 -1.908 26.938 -17.093 1.00 25.00 N ATOM 1123 CA GLY A 78 -3.155 26.554 -17.730 1.00 25.00 C ATOM 1124 C GLY A 78 -3.718 25.435 -16.898 1.00 25.00 C ATOM 1125 O GLY A 78 -3.197 25.106 -15.787 1.00 25.00 O ATOM 0 H GLY A 78 -1.980 27.061 -16.083 1.00 25.00 H new ATOM 0 HA2 GLY A 78 -3.847 27.395 -17.772 1.00 25.00 H new ATOM 0 HA3 GLY A 78 -2.985 26.230 -18.757 1.00 25.00 H new ATOM 1129 N GLU A 79 -4.852 24.912 -17.349 1.00 25.00 N ATOM 1130 CA GLU A 79 -5.453 23.781 -16.567 1.00 25.00 C ATOM 1131 C GLU A 79 -4.728 22.522 -17.012 1.00 25.00 C ATOM 1132 O GLU A 79 -4.200 22.363 -18.078 1.00 25.00 O ATOM 1133 CB GLU A 79 -6.909 23.529 -16.850 1.00 25.00 C ATOM 1134 CG GLU A 79 -7.356 23.289 -18.285 1.00 25.00 C ATOM 1135 CD GLU A 79 -8.827 22.870 -18.414 1.00 25.00 C ATOM 1136 OE1 GLU A 79 -9.788 23.627 -18.058 1.00 25.00 O ATOM 1137 OE2 GLU A 79 -9.041 21.698 -18.776 1.00 25.00 O1- ATOM 0 H GLU A 79 -5.360 25.207 -18.183 1.00 25.00 H new ATOM 0 HA GLU A 79 -5.358 24.036 -15.512 1.00 25.00 H new ATOM 0 HB2 GLU A 79 -7.212 22.662 -16.263 1.00 25.00 H new ATOM 0 HB3 GLU A 79 -7.470 24.383 -16.470 1.00 25.00 H new ATOM 0 HG2 GLU A 79 -7.195 24.199 -18.863 1.00 25.00 H new ATOM 0 HG3 GLU A 79 -6.728 22.516 -18.727 1.00 25.00 H new ATOM 1144 N HIS A 80 -4.657 21.525 -16.108 1.00 25.00 N ATOM 1145 CA HIS A 80 -3.968 20.228 -16.286 1.00 25.00 C ATOM 1146 C HIS A 80 -4.911 19.194 -15.751 1.00 25.00 C ATOM 1147 O HIS A 80 -5.633 19.442 -14.810 1.00 25.00 O ATOM 1148 CB HIS A 80 -2.672 20.214 -15.493 1.00 25.00 C ATOM 1149 CG HIS A 80 -1.777 21.363 -15.816 1.00 25.00 C ATOM 1150 ND1 HIS A 80 -1.108 21.544 -17.025 1.00 25.00 N ATOM 1151 CD2 HIS A 80 -1.485 22.448 -15.082 1.00 25.00 C ATOM 1152 CE1 HIS A 80 -0.381 22.636 -16.948 1.00 25.00 C ATOM 1153 NE2 HIS A 80 -0.596 23.241 -15.808 1.00 25.00 N ATOM 0 H HIS A 80 -5.098 21.604 -15.192 1.00 25.00 H new ATOM 0 HA HIS A 80 -3.715 20.043 -17.330 1.00 25.00 H new ATOM 0 HB2 HIS A 80 -2.904 20.230 -14.428 1.00 25.00 H new ATOM 0 HB3 HIS A 80 -2.142 19.282 -15.690 1.00 25.00 H new ATOM 0 HD2 HIS A 80 -1.872 22.669 -14.098 1.00 25.00 H new ATOM 0 HE1 HIS A 80 0.296 22.984 -17.715 1.00 25.00 H new ATOM 0 HE2 HIS A 80 -0.190 24.127 -15.507 1.00 25.00 H new ATOM 1161 N THR A 81 -4.802 17.977 -16.234 1.00 25.00 N ATOM 1162 CA THR A 81 -5.378 16.798 -15.617 1.00 25.00 C ATOM 1163 C THR A 81 -4.167 15.954 -15.291 1.00 25.00 C ATOM 1164 O THR A 81 -3.305 15.686 -16.140 1.00 25.00 O ATOM 1165 CB THR A 81 -6.272 16.051 -16.578 1.00 25.00 C ATOM 1166 OG1 THR A 81 -7.239 16.896 -17.218 1.00 25.00 O ATOM 1167 CG2 THR A 81 -7.135 14.966 -15.838 1.00 25.00 C ATOM 0 H THR A 81 -4.294 17.771 -17.094 1.00 25.00 H new ATOM 0 HA THR A 81 -5.997 17.043 -14.754 1.00 25.00 H new ATOM 0 HB THR A 81 -5.581 15.620 -17.302 1.00 25.00 H new ATOM 0 HG1 THR A 81 -7.737 17.396 -16.538 1.00 25.00 H new ATOM 0 HG21 THR A 81 -7.766 14.448 -16.560 1.00 25.00 H new ATOM 0 HG22 THR A 81 -6.476 14.247 -15.351 1.00 25.00 H new ATOM 0 HG23 THR A 81 -7.762 15.449 -15.089 1.00 25.00 H new ATOM 1175 N PHE A 82 -4.139 15.474 -14.067 1.00 25.00 N ATOM 1176 CA PHE A 82 -3.051 14.641 -13.591 1.00 25.00 C ATOM 1177 C PHE A 82 -3.620 13.294 -13.291 1.00 25.00 C ATOM 1178 O PHE A 82 -4.792 13.156 -12.879 1.00 25.00 O ATOM 1179 CB PHE A 82 -2.457 15.225 -12.304 1.00 25.00 C ATOM 1180 CG PHE A 82 -1.722 16.485 -12.518 1.00 25.00 C ATOM 1181 CD1 PHE A 82 -0.363 16.467 -12.888 1.00 50.00 C ATOM 1182 CD2 PHE A 82 -2.351 17.731 -12.365 1.00 50.00 C ATOM 1183 CE1 PHE A 82 0.357 17.690 -13.137 1.00 25.00 C ATOM 1184 CE2 PHE A 82 -1.618 18.957 -12.528 1.00 25.00 C ATOM 1185 CZ PHE A 82 -0.230 18.921 -12.900 1.00 25.00 C ATOM 0 H PHE A 82 -4.867 15.648 -13.374 1.00 25.00 H new ATOM 0 HA PHE A 82 -2.265 14.585 -14.344 1.00 25.00 H new ATOM 0 HB2 PHE A 82 -3.260 15.399 -11.588 1.00 25.00 H new ATOM 0 HB3 PHE A 82 -1.785 14.492 -11.858 1.00 25.00 H new ATOM 0 HD1 PHE A 82 0.148 15.521 -12.987 1.00 50.00 H new ATOM 0 HD2 PHE A 82 -3.402 17.769 -12.121 1.00 50.00 H new ATOM 0 HE1 PHE A 82 1.368 17.646 -13.514 1.00 25.00 H new ATOM 0 HE2 PHE A 82 -2.110 19.905 -12.371 1.00 25.00 H new ATOM 0 HZ PHE A 82 0.341 19.833 -12.992 1.00 25.00 H new ATOM 1195 N THR A 83 -2.808 12.299 -13.631 1.00 25.00 N ATOM 1196 CA THR A 83 -3.248 10.913 -13.613 1.00 25.00 C ATOM 1197 C THR A 83 -2.156 9.967 -13.053 1.00 25.00 C ATOM 1198 O THR A 83 -0.941 10.153 -13.266 1.00 25.00 O ATOM 1199 CB THR A 83 -3.644 10.495 -15.024 1.00 25.00 C ATOM 1200 OG1 THR A 83 -4.358 11.560 -15.633 1.00 25.00 O ATOM 1201 CG2 THR A 83 -4.486 9.150 -15.088 1.00 25.00 C ATOM 0 H THR A 83 -1.839 12.429 -13.923 1.00 25.00 H new ATOM 0 HA THR A 83 -4.109 10.834 -12.949 1.00 25.00 H new ATOM 0 HB THR A 83 -2.723 10.283 -15.568 1.00 25.00 H new ATOM 0 HG1 THR A 83 -4.617 11.303 -16.543 1.00 25.00 H new ATOM 0 HG21 THR A 83 -4.728 8.921 -16.126 1.00 25.00 H new ATOM 0 HG22 THR A 83 -3.901 8.334 -14.664 1.00 25.00 H new ATOM 0 HG23 THR A 83 -5.407 9.270 -14.518 1.00 25.00 H new ATOM 1209 N TRP A 84 -2.579 9.169 -12.104 1.00 25.00 N ATOM 1210 CA TRP A 84 -1.749 8.244 -11.306 1.00 25.00 C ATOM 1211 C TRP A 84 -2.534 6.984 -11.394 1.00 25.00 C ATOM 1212 O TRP A 84 -3.749 7.009 -11.562 1.00 25.00 O ATOM 1213 CB TRP A 84 -1.538 8.571 -9.815 1.00 25.00 C ATOM 1214 CG TRP A 84 -0.588 9.759 -9.621 1.00 25.00 C ATOM 1215 CD1 TRP A 84 -0.767 10.979 -10.097 1.00 25.00 C ATOM 1216 CD2 TRP A 84 0.597 9.819 -8.794 1.00 25.00 C ATOM 1217 NE1 TRP A 84 0.136 11.838 -9.662 1.00 25.00 N ATOM 1218 CE2 TRP A 84 0.972 11.206 -8.754 1.00 25.00 C ATOM 1219 CE3 TRP A 84 1.348 8.905 -8.067 1.00 25.00 C ATOM 1220 CZ2 TRP A 84 2.004 11.691 -7.906 1.00 25.00 C ATOM 1221 CZ3 TRP A 84 2.440 9.358 -7.264 1.00 25.00 C ATOM 1222 CH2 TRP A 84 2.725 10.721 -7.206 1.00 25.00 C ATOM 0 H TRP A 84 -3.563 9.131 -11.838 1.00 25.00 H new ATOM 0 HA TRP A 84 -0.732 8.253 -11.699 1.00 25.00 H new ATOM 0 HB2 TRP A 84 -2.499 8.795 -9.353 1.00 25.00 H new ATOM 0 HB3 TRP A 84 -1.135 7.696 -9.305 1.00 25.00 H new ATOM 0 HD1 TRP A 84 -1.568 11.245 -10.771 1.00 25.00 H new ATOM 0 HE1 TRP A 84 0.208 12.814 -9.949 1.00 25.00 H new ATOM 0 HE3 TRP A 84 1.107 7.853 -8.108 1.00 25.00 H new ATOM 0 HZ2 TRP A 84 2.218 12.745 -7.809 1.00 25.00 H new ATOM 0 HZ3 TRP A 84 3.038 8.651 -6.708 1.00 25.00 H new ATOM 0 HH2 TRP A 84 3.548 11.045 -6.586 1.00 25.00 H new ATOM 1233 N THR A 85 -1.896 5.858 -11.083 1.00 25.00 N ATOM 1234 CA THR A 85 -2.582 4.652 -10.640 1.00 25.00 C ATOM 1235 C THR A 85 -1.944 4.068 -9.429 1.00 25.00 C ATOM 1236 O THR A 85 -0.707 4.020 -9.355 1.00 25.00 O ATOM 1237 CB THR A 85 -2.631 3.588 -11.737 1.00 25.00 C ATOM 1238 OG1 THR A 85 -1.318 3.322 -12.244 1.00 25.00 O ATOM 1239 CG2 THR A 85 -3.541 4.071 -12.897 1.00 25.00 C ATOM 0 H THR A 85 -0.882 5.759 -11.132 1.00 25.00 H new ATOM 0 HA THR A 85 -3.600 4.957 -10.396 1.00 25.00 H new ATOM 0 HB THR A 85 -3.035 2.671 -11.308 1.00 25.00 H new ATOM 0 HG1 THR A 85 -1.266 3.603 -13.182 1.00 25.00 H new ATOM 0 HG21 THR A 85 -3.573 3.309 -13.676 1.00 25.00 H new ATOM 0 HG22 THR A 85 -4.549 4.247 -12.520 1.00 25.00 H new ATOM 0 HG23 THR A 85 -3.142 4.997 -13.311 1.00 25.00 H new ATOM 1247 N TYR A 86 -2.711 3.577 -8.474 1.00 25.00 N ATOM 1248 CA TYR A 86 -2.214 2.680 -7.388 1.00 25.00 C ATOM 1249 C TYR A 86 -2.110 1.291 -7.974 1.00 25.00 C ATOM 1250 O TYR A 86 -2.813 1.013 -8.967 1.00 25.00 O ATOM 1251 CB TYR A 86 -3.111 2.677 -6.159 1.00 25.00 C ATOM 1252 CG TYR A 86 -3.045 3.965 -5.351 1.00 25.00 C ATOM 1253 CD1 TYR A 86 -3.991 4.994 -5.438 1.00 50.00 C ATOM 1254 CD2 TYR A 86 -1.992 4.155 -4.423 1.00 50.00 C ATOM 1255 CE1 TYR A 86 -3.832 6.243 -4.763 1.00 25.00 C ATOM 1256 CE2 TYR A 86 -1.881 5.377 -3.689 1.00 25.00 C ATOM 1257 CZ TYR A 86 -2.770 6.393 -3.899 1.00 25.00 C ATOM 1258 OH TYR A 86 -2.511 7.486 -3.196 1.00 25.00 O ATOM 0 H TYR A 86 -3.709 3.777 -8.409 1.00 25.00 H new ATOM 0 HA TYR A 86 -1.247 3.043 -7.040 1.00 25.00 H new ATOM 0 HB2 TYR A 86 -4.141 2.507 -6.472 1.00 25.00 H new ATOM 0 HB3 TYR A 86 -2.831 1.841 -5.518 1.00 25.00 H new ATOM 0 HD1 TYR A 86 -4.875 4.837 -6.039 1.00 50.00 H new ATOM 0 HD2 TYR A 86 -1.267 3.370 -4.268 1.00 50.00 H new ATOM 0 HE1 TYR A 86 -4.529 7.052 -4.927 1.00 25.00 H new ATOM 0 HE2 TYR A 86 -1.090 5.498 -2.964 1.00 25.00 H new ATOM 0 HH TYR A 86 -3.326 8.024 -3.115 1.00 25.00 H new ATOM 1268 N THR A 87 -1.232 0.453 -7.398 1.00 25.00 N ATOM 1269 CA THR A 87 -0.849 -0.766 -8.084 1.00 25.00 C ATOM 1270 C THR A 87 -1.806 -1.860 -7.607 1.00 25.00 C ATOM 1271 O THR A 87 -1.971 -2.934 -8.238 1.00 25.00 O ATOM 1272 CB THR A 87 0.640 -1.010 -7.978 1.00 25.00 C ATOM 1273 OG1 THR A 87 0.875 -2.233 -8.616 1.00 25.00 O ATOM 1274 CG2 THR A 87 1.135 -1.123 -6.536 1.00 25.00 C ATOM 0 H THR A 87 -0.793 0.600 -6.489 1.00 25.00 H new ATOM 0 HA THR A 87 -0.969 -0.721 -9.166 1.00 25.00 H new ATOM 0 HB THR A 87 1.168 -0.167 -8.425 1.00 25.00 H new ATOM 0 HG1 THR A 87 1.832 -2.443 -8.579 1.00 25.00 H new ATOM 0 HG21 THR A 87 2.211 -1.298 -6.533 1.00 25.00 H new ATOM 0 HG22 THR A 87 0.916 -0.198 -6.003 1.00 25.00 H new ATOM 0 HG23 THR A 87 0.631 -1.954 -6.042 1.00 25.00 H new ATOM 1282 N ALA A 88 -2.413 -1.595 -6.480 1.00 25.00 N ATOM 1283 CA ALA A 88 -3.431 -2.558 -5.973 1.00 25.00 C ATOM 1284 C ALA A 88 -4.491 -1.791 -5.163 1.00 25.00 C ATOM 1285 O ALA A 88 -4.103 -0.870 -4.465 1.00 25.00 O ATOM 1286 CB ALA A 88 -2.779 -3.655 -5.118 1.00 25.00 C ATOM 0 H ALA A 88 -2.252 -0.771 -5.900 1.00 25.00 H new ATOM 0 HA ALA A 88 -3.909 -3.049 -6.821 1.00 25.00 H new ATOM 0 HB1 ALA A 88 -3.546 -4.343 -4.762 1.00 25.00 H new ATOM 0 HB2 ALA A 88 -2.052 -4.201 -5.719 1.00 25.00 H new ATOM 0 HB3 ALA A 88 -2.275 -3.200 -4.265 1.00 25.00 H new ATOM 1292 N PRO A 89 -5.814 -2.136 -5.300 1.00 25.00 N ATOM 1293 CA PRO A 89 -6.749 -1.386 -4.463 1.00 25.00 C ATOM 1294 C PRO A 89 -6.465 -1.637 -2.910 1.00 25.00 C ATOM 1295 O PRO A 89 -6.296 -2.805 -2.456 1.00 25.00 O ATOM 1296 CB PRO A 89 -8.180 -1.860 -4.879 1.00 25.00 C ATOM 1297 CG PRO A 89 -7.917 -2.412 -6.254 1.00 25.00 C ATOM 1298 CD PRO A 89 -6.549 -3.069 -6.171 1.00 25.00 C ATOM 0 HA PRO A 89 -6.641 -0.311 -4.610 1.00 25.00 H new ATOM 0 HB2 PRO A 89 -8.576 -2.616 -4.201 1.00 25.00 H new ATOM 0 HB3 PRO A 89 -8.897 -1.039 -4.895 1.00 25.00 H new ATOM 0 HG2 PRO A 89 -8.682 -3.133 -6.541 1.00 25.00 H new ATOM 0 HG3 PRO A 89 -7.928 -1.621 -7.004 1.00 25.00 H new ATOM 0 HD2 PRO A 89 -6.602 -4.070 -5.743 1.00 25.00 H new ATOM 0 HD3 PRO A 89 -6.082 -3.166 -7.151 1.00 25.00 H new ATOM 1306 N HIS A 90 -6.413 -0.546 -2.209 1.00 25.00 N ATOM 1307 CA HIS A 90 -6.253 -0.503 -0.769 1.00 25.00 C ATOM 1308 C HIS A 90 -6.933 0.857 -0.336 1.00 25.00 C ATOM 1309 O HIS A 90 -7.215 1.667 -1.160 1.00 25.00 O ATOM 1310 CB HIS A 90 -4.763 -0.674 -0.310 1.00 0.00 C ATOM 1311 CG HIS A 90 -3.750 0.340 -0.827 1.00 0.00 C ATOM 1312 ND1 HIS A 90 -3.875 1.039 -1.966 1.00 0.00 N ATOM 1313 CD2 HIS A 90 -2.576 0.745 -0.354 1.00 0.00 C ATOM 1314 CE1 HIS A 90 -2.808 1.843 -2.119 1.00 0.00 C ATOM 1315 NE2 HIS A 90 -1.901 1.583 -1.197 1.00 0.00 N ATOM 0 H HIS A 90 -6.483 0.380 -2.631 1.00 25.00 H new ATOM 0 HA HIS A 90 -6.731 -1.346 -0.270 1.00 25.00 H new ATOM 0 HB2 HIS A 90 -4.741 -0.647 0.779 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -4.429 -1.667 -0.611 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -4.659 0.971 -2.615 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -2.191 0.440 0.608 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -2.708 2.595 -2.888 1.00 0.00 H new ATOM 1323 N ASN A 91 -7.298 0.988 0.957 1.00 25.00 N ATOM 1324 CA ASN A 91 -8.309 1.926 1.432 1.00 25.00 C ATOM 1325 C ASN A 91 -7.850 3.347 1.635 1.00 25.00 C ATOM 1326 O ASN A 91 -6.656 3.645 1.686 1.00 25.00 O ATOM 1327 CB ASN A 91 -9.020 1.424 2.698 1.00 25.00 C ATOM 1328 CG ASN A 91 -9.720 0.095 2.521 1.00 25.00 C ATOM 1329 OD1 ASN A 91 -10.137 -0.254 1.495 1.00 25.00 O ATOM 1330 ND2 ASN A 91 -9.767 -0.619 3.608 1.00 25.00 N ATOM 0 H ASN A 91 -6.885 0.430 1.704 1.00 25.00 H new ATOM 0 HA ASN A 91 -9.012 1.961 0.600 1.00 25.00 H new ATOM 0 HB2 ASN A 91 -8.289 1.335 3.502 1.00 25.00 H new ATOM 0 HB3 ASN A 91 -9.750 2.169 3.012 1.00 25.00 H new ATOM 0 HD21 ASN A 91 -10.190 -1.547 3.591 1.00 25.00 H new ATOM 0 HD22 ASN A 91 -9.381 -0.251 4.477 1.00 25.00 H new ATOM 1337 N THR A 92 -8.796 4.246 1.689 1.00 25.00 N ATOM 1338 CA THR A 92 -8.520 5.688 1.914 1.00 25.00 C ATOM 1339 C THR A 92 -9.737 6.282 2.509 1.00 25.00 C ATOM 1340 O THR A 92 -10.868 5.925 2.121 1.00 25.00 O ATOM 1341 CB THR A 92 -8.290 6.428 0.631 1.00 25.00 C ATOM 1342 OG1 THR A 92 -7.099 5.917 0.033 1.00 25.00 O ATOM 1343 CG2 THR A 92 -8.159 7.888 0.792 1.00 25.00 C ATOM 0 H THR A 92 -9.786 4.026 1.582 1.00 25.00 H new ATOM 0 HA THR A 92 -7.633 5.766 2.542 1.00 25.00 H new ATOM 0 HB THR A 92 -9.170 6.270 0.007 1.00 25.00 H new ATOM 0 HG1 THR A 92 -6.735 5.199 0.592 1.00 25.00 H new ATOM 0 HG21 THR A 92 -7.995 8.348 -0.182 1.00 25.00 H new ATOM 0 HG22 THR A 92 -9.072 8.289 1.233 1.00 25.00 H new ATOM 0 HG23 THR A 92 -7.314 8.108 1.444 1.00 25.00 H new ATOM 1351 N SER A 93 -9.599 7.101 3.549 1.00 25.00 N ATOM 1352 CA SER A 93 -10.760 7.727 4.186 1.00 25.00 C ATOM 1353 C SER A 93 -10.965 9.061 3.492 1.00 25.00 C ATOM 1354 O SER A 93 -12.102 9.373 3.160 1.00 25.00 O ATOM 1355 CB SER A 93 -10.567 7.870 5.696 1.00 25.00 C ATOM 1356 OG SER A 93 -9.433 8.704 5.925 1.00 25.00 O ATOM 0 H SER A 93 -8.702 7.347 3.968 1.00 25.00 H new ATOM 0 HA SER A 93 -11.650 7.108 4.078 1.00 25.00 H new ATOM 0 HB2 SER A 93 -11.456 8.304 6.153 1.00 25.00 H new ATOM 0 HB3 SER A 93 -10.418 6.892 6.154 1.00 25.00 H new ATOM 0 HG SER A 93 -9.294 8.809 6.889 1.00 25.00 H new ATOM 1362 N GLN A 94 -9.895 9.779 3.205 1.00 25.00 N ATOM 1363 CA GLN A 94 -9.974 11.001 2.411 1.00 25.00 C ATOM 1364 C GLN A 94 -8.536 11.247 1.916 1.00 25.00 C ATOM 1365 O GLN A 94 -7.589 10.605 2.492 1.00 25.00 O ATOM 1366 CB GLN A 94 -10.471 12.223 3.201 1.00 25.00 C ATOM 1367 CG GLN A 94 -9.558 12.542 4.410 1.00 25.00 C ATOM 1368 CD GLN A 94 -9.958 13.751 5.203 1.00 25.00 C ATOM 1369 OE1 GLN A 94 -10.017 14.857 4.714 1.00 25.00 O ATOM 1370 NE2 GLN A 94 -10.072 13.536 6.500 1.00 25.00 N ATOM 0 H GLN A 94 -8.952 9.538 3.511 1.00 25.00 H new ATOM 0 HA GLN A 94 -10.699 10.873 1.607 1.00 25.00 H new ATOM 0 HB2 GLN A 94 -10.514 13.089 2.540 1.00 25.00 H new ATOM 0 HB3 GLN A 94 -11.486 12.039 3.552 1.00 25.00 H new ATOM 0 HG2 GLN A 94 -9.545 11.678 5.074 1.00 25.00 H new ATOM 0 HG3 GLN A 94 -8.539 12.683 4.050 1.00 25.00 H new ATOM 0 HE21 GLN A 94 -10.016 12.586 6.866 1.00 25.00 H new ATOM 0 HE22 GLN A 94 -10.216 14.320 7.136 1.00 25.00 H new ATOM 1379 N TRP A 95 -8.343 12.231 1.029 1.00 25.00 N ATOM 1380 CA TRP A 95 -6.983 12.695 0.721 1.00 25.00 C ATOM 1381 C TRP A 95 -6.870 14.218 0.447 1.00 25.00 C ATOM 1382 O TRP A 95 -7.887 14.875 0.105 1.00 25.00 O ATOM 1383 CB TRP A 95 -6.481 11.828 -0.442 1.00 25.00 C ATOM 1384 CG TRP A 95 -7.019 12.060 -1.841 1.00 25.00 C ATOM 1385 CD1 TRP A 95 -6.734 13.127 -2.624 1.00 25.00 C ATOM 1386 CD2 TRP A 95 -7.788 11.159 -2.639 1.00 25.00 C ATOM 1387 NE1 TRP A 95 -7.251 12.975 -3.869 1.00 25.00 N ATOM 1388 CE2 TRP A 95 -7.906 11.749 -3.899 1.00 25.00 C ATOM 1389 CE3 TRP A 95 -8.400 9.924 -2.386 1.00 25.00 C ATOM 1390 CZ2 TRP A 95 -8.536 11.067 -4.938 1.00 25.00 C ATOM 1391 CZ3 TRP A 95 -8.934 9.195 -3.452 1.00 25.00 C ATOM 1392 CH2 TRP A 95 -8.943 9.783 -4.728 1.00 25.00 C ATOM 0 H TRP A 95 -9.088 12.711 0.524 1.00 25.00 H new ATOM 0 HA TRP A 95 -6.347 12.573 1.598 1.00 25.00 H new ATOM 0 HB2 TRP A 95 -5.398 11.940 -0.487 1.00 25.00 H new ATOM 0 HB3 TRP A 95 -6.683 10.789 -0.184 1.00 25.00 H new ATOM 0 HD1 TRP A 95 -6.168 13.988 -2.299 1.00 25.00 H new ATOM 0 HE1 TRP A 95 -7.174 13.638 -4.641 1.00 25.00 H new ATOM 0 HE3 TRP A 95 -8.458 9.540 -1.378 1.00 25.00 H new ATOM 0 HZ2 TRP A 95 -8.699 11.547 -5.892 1.00 25.00 H new ATOM 0 HZ3 TRP A 95 -9.331 8.202 -3.298 1.00 25.00 H new ATOM 0 HH2 TRP A 95 -9.283 9.199 -5.570 1.00 25.00 H new ATOM 1403 N HIS A 96 -5.692 14.775 0.722 1.00 25.00 N ATOM 1404 CA HIS A 96 -5.503 16.218 0.781 1.00 25.00 C ATOM 1405 C HIS A 96 -4.337 16.633 -0.069 1.00 25.00 C ATOM 1406 O HIS A 96 -3.355 15.918 -0.058 1.00 25.00 O ATOM 1407 CB HIS A 96 -5.092 16.650 2.220 1.00 25.00 C ATOM 1408 CG HIS A 96 -5.727 15.953 3.357 1.00 25.00 C ATOM 1409 ND1 HIS A 96 -6.781 16.452 4.147 1.00 25.00 N ATOM 1410 CD2 HIS A 96 -5.428 14.762 3.937 1.00 25.00 C ATOM 1411 CE1 HIS A 96 -7.130 15.593 5.072 1.00 25.00 C ATOM 1412 NE2 HIS A 96 -6.269 14.584 5.050 1.00 25.00 N ATOM 0 H HIS A 96 -4.845 14.238 0.909 1.00 25.00 H new ATOM 0 HA HIS A 96 -6.441 16.668 0.454 1.00 25.00 H new ATOM 0 HB2 HIS A 96 -4.013 16.526 2.311 1.00 25.00 H new ATOM 0 HB3 HIS A 96 -5.300 17.715 2.322 1.00 25.00 H new ATOM 0 HD2 HIS A 96 -4.672 14.068 3.600 1.00 25.00 H new ATOM 0 HE1 HIS A 96 -7.974 15.690 5.739 1.00 25.00 H new ATOM 0 HE2 HIS A 96 -6.225 13.816 5.720 1.00 25.00 H new ATOM 1420 N TYR A 97 -4.385 17.762 -0.766 1.00 25.00 N ATOM 1421 CA TYR A 97 -3.193 18.314 -1.398 1.00 25.00 C ATOM 1422 C TYR A 97 -2.958 19.682 -0.809 1.00 25.00 C ATOM 1423 O TYR A 97 -3.947 20.405 -0.528 1.00 25.00 O ATOM 1424 CB TYR A 97 -3.290 18.478 -2.922 1.00 25.00 C ATOM 1425 CG TYR A 97 -3.281 17.149 -3.698 1.00 25.00 C ATOM 1426 CD1 TYR A 97 -4.463 16.418 -3.774 1.00 50.00 C ATOM 1427 CD2 TYR A 97 -2.151 16.659 -4.357 1.00 50.00 C ATOM 1428 CE1 TYR A 97 -4.568 15.205 -4.487 1.00 25.00 C ATOM 1429 CE2 TYR A 97 -2.232 15.399 -5.100 1.00 25.00 C ATOM 1430 CZ TYR A 97 -3.496 14.702 -5.232 1.00 25.00 C ATOM 1431 OH TYR A 97 -3.680 13.530 -5.971 1.00 25.00 O ATOM 0 H TYR A 97 -5.233 18.311 -0.908 1.00 25.00 H new ATOM 0 HA TYR A 97 -2.385 17.606 -1.211 1.00 25.00 H new ATOM 0 HB2 TYR A 97 -4.205 19.020 -3.161 1.00 25.00 H new ATOM 0 HB3 TYR A 97 -2.457 19.092 -3.264 1.00 25.00 H new ATOM 0 HD1 TYR A 97 -5.338 16.796 -3.265 1.00 50.00 H new ATOM 0 HD2 TYR A 97 -1.221 17.207 -4.319 1.00 50.00 H new ATOM 0 HE1 TYR A 97 -5.496 14.653 -4.457 1.00 25.00 H new ATOM 0 HE2 TYR A 97 -1.343 14.986 -5.553 1.00 25.00 H new ATOM 0 HH TYR A 97 -2.848 13.303 -6.437 1.00 25.00 H new ATOM 1441 N TYR A 98 -1.731 20.110 -0.609 1.00 25.00 N ATOM 1442 CA TYR A 98 -1.413 21.368 -0.006 1.00 25.00 C ATOM 1443 C TYR A 98 -0.300 21.995 -0.904 1.00 25.00 C ATOM 1444 O TYR A 98 0.302 21.282 -1.648 1.00 25.00 O ATOM 1445 CB TYR A 98 -0.788 21.188 1.425 1.00 25.00 C ATOM 1446 CG TYR A 98 -1.757 20.849 2.466 1.00 25.00 C ATOM 1447 CD1 TYR A 98 -2.059 19.562 2.766 1.00 50.00 C ATOM 1448 CD2 TYR A 98 -2.375 21.872 3.234 1.00 50.00 C ATOM 1449 CE1 TYR A 98 -2.922 19.202 3.838 1.00 25.00 C ATOM 1450 CE2 TYR A 98 -3.229 21.565 4.327 1.00 25.00 C ATOM 1451 CZ TYR A 98 -3.487 20.205 4.625 1.00 25.00 C ATOM 1452 OH TYR A 98 -4.383 19.873 5.601 1.00 25.00 O ATOM 0 H TYR A 98 -0.908 19.569 -0.873 1.00 25.00 H new ATOM 0 HA TYR A 98 -2.317 21.971 0.082 1.00 25.00 H new ATOM 0 HB2 TYR A 98 -0.030 20.406 1.382 1.00 25.00 H new ATOM 0 HB3 TYR A 98 -0.279 22.110 1.705 1.00 25.00 H new ATOM 0 HD1 TYR A 98 -1.626 18.776 2.165 1.00 50.00 H new ATOM 0 HD2 TYR A 98 -2.192 22.906 2.981 1.00 50.00 H new ATOM 0 HE1 TYR A 98 -3.137 18.163 4.040 1.00 25.00 H new ATOM 0 HE2 TYR A 98 -3.672 22.353 4.918 1.00 25.00 H new ATOM 0 HH TYR A 98 -4.683 20.685 6.060 1.00 25.00 H new ATOM 1462 N ILE A 99 -0.018 23.241 -0.709 1.00 25.00 N ATOM 1463 CA ILE A 99 1.109 23.972 -1.350 1.00 25.00 C ATOM 1464 C ILE A 99 1.853 24.671 -0.196 1.00 25.00 C ATOM 1465 O ILE A 99 1.189 25.124 0.773 1.00 25.00 O ATOM 1466 CB ILE A 99 0.634 24.993 -2.515 1.00 25.00 C ATOM 1467 CG1 ILE A 99 -0.282 26.057 -1.952 1.00 25.00 C ATOM 1468 CG2 ILE A 99 -0.084 24.199 -3.621 1.00 25.00 C ATOM 1469 CD1 ILE A 99 -0.590 27.175 -3.016 1.00 25.00 C ATOM 0 H ILE A 99 -0.565 23.830 -0.082 1.00 25.00 H new ATOM 0 HA ILE A 99 1.766 23.285 -1.884 1.00 25.00 H new ATOM 0 HB ILE A 99 1.509 25.490 -2.934 1.00 25.00 H new ATOM 0 HG12 ILE A 99 -1.215 25.599 -1.624 1.00 25.00 H new ATOM 0 HG13 ILE A 99 0.179 26.507 -1.073 1.00 25.00 H new ATOM 0 HG21 ILE A 99 -0.406 24.881 -4.408 1.00 25.00 H new ATOM 0 HG22 ILE A 99 0.598 23.459 -4.039 1.00 25.00 H new ATOM 0 HG23 ILE A 99 -0.954 23.694 -3.200 1.00 25.00 H new ATOM 0 HD11 ILE A 99 -1.251 27.923 -2.577 1.00 25.00 H new ATOM 0 HD12 ILE A 99 0.341 27.650 -3.325 1.00 25.00 H new ATOM 0 HD13 ILE A 99 -1.074 26.728 -3.884 1.00 25.00 H new ATOM 1481 N THR A 100 3.165 24.843 -0.284 1.00 25.00 N ATOM 1482 CA THR A 100 3.916 25.676 0.659 1.00 25.00 C ATOM 1483 C THR A 100 3.723 27.114 0.318 1.00 25.00 C ATOM 1484 O THR A 100 3.446 27.399 -0.868 1.00 25.00 O ATOM 1485 CB THR A 100 5.451 25.333 0.540 1.00 25.00 C ATOM 1486 OG1 THR A 100 5.844 25.399 -0.818 1.00 25.00 O ATOM 1487 CG2 THR A 100 5.750 23.915 0.981 1.00 25.00 C ATOM 0 H THR A 100 3.742 24.413 -1.007 1.00 25.00 H new ATOM 0 HA THR A 100 3.562 25.485 1.672 1.00 25.00 H new ATOM 0 HB THR A 100 5.980 26.047 1.170 1.00 25.00 H new ATOM 0 HG1 THR A 100 6.821 25.363 -0.878 1.00 25.00 H new ATOM 0 HG21 THR A 100 6.818 23.721 0.883 1.00 25.00 H new ATOM 0 HG22 THR A 100 5.452 23.787 2.022 1.00 25.00 H new ATOM 0 HG23 THR A 100 5.195 23.215 0.356 1.00 25.00 H new ATOM 1495 N LYS A 101 3.873 28.004 1.289 1.00 25.00 N ATOM 1496 CA LYS A 101 3.740 29.447 1.082 1.00 25.00 C ATOM 1497 C LYS A 101 4.654 30.361 1.895 1.00 25.00 C ATOM 1498 O LYS A 101 4.249 31.001 2.876 1.00 25.00 O ATOM 1499 CB LYS A 101 2.289 29.845 1.377 1.00 25.00 C ATOM 1500 CG LYS A 101 1.771 31.157 0.714 1.00 25.00 C ATOM 1501 CD LYS A 101 0.508 31.662 1.333 1.00 25.00 C ATOM 1502 CE LYS A 101 0.208 33.029 0.634 1.00 25.00 C ATOM 1503 NZ LYS A 101 -0.929 33.828 1.089 1.00 25.00 N1+ ATOM 0 H LYS A 101 4.092 27.747 2.252 1.00 25.00 H new ATOM 0 HA LYS A 101 4.047 29.599 0.047 1.00 25.00 H new ATOM 0 HB2 LYS A 101 1.642 29.027 1.062 1.00 25.00 H new ATOM 0 HB3 LYS A 101 2.176 29.943 2.457 1.00 25.00 H new ATOM 0 HG2 LYS A 101 2.540 31.925 0.791 1.00 25.00 H new ATOM 0 HG3 LYS A 101 1.603 30.980 -0.348 1.00 25.00 H new ATOM 0 HD2 LYS A 101 -0.310 30.958 1.182 1.00 25.00 H new ATOM 0 HD3 LYS A 101 0.624 31.790 2.409 1.00 25.00 H new ATOM 0 HE2 LYS A 101 1.101 33.647 0.725 1.00 25.00 H new ATOM 0 HE3 LYS A 101 0.065 32.830 -0.428 1.00 25.00 H new ATOM 0 HZ1 LYS A 101 -0.989 34.700 0.525 1.00 25.00 H new ATOM 0 HZ2 LYS A 101 -1.806 33.281 0.974 1.00 25.00 H new ATOM 0 HZ3 LYS A 101 -0.802 34.073 2.092 1.00 25.00 H new ATOM 1517 N LYS A 102 5.868 30.452 1.391 1.00 25.00 N ATOM 1518 CA LYS A 102 6.805 31.483 1.849 1.00 25.00 C ATOM 1519 C LYS A 102 6.236 32.871 1.931 1.00 25.00 C ATOM 1520 O LYS A 102 5.285 33.303 1.251 1.00 25.00 O ATOM 1521 CB LYS A 102 8.103 31.526 1.025 1.00 25.00 C ATOM 1522 CG LYS A 102 8.022 32.144 -0.390 1.00 25.00 C ATOM 1523 CD LYS A 102 9.413 32.065 -1.099 1.00 25.00 C ATOM 1524 CE LYS A 102 9.510 32.531 -2.557 1.00 25.00 C ATOM 1525 NZ LYS A 102 10.921 32.620 -3.142 1.00 25.00 N1+ ATOM 0 H LYS A 102 6.236 29.833 0.668 1.00 25.00 H new ATOM 0 HA LYS A 102 7.028 31.164 2.867 1.00 25.00 H new ATOM 0 HB2 LYS A 102 8.846 32.083 1.595 1.00 25.00 H new ATOM 0 HB3 LYS A 102 8.475 30.506 0.927 1.00 25.00 H new ATOM 0 HG2 LYS A 102 7.274 31.616 -0.982 1.00 25.00 H new ATOM 0 HG3 LYS A 102 7.700 33.183 -0.322 1.00 25.00 H new ATOM 0 HD2 LYS A 102 10.119 32.654 -0.513 1.00 25.00 H new ATOM 0 HD3 LYS A 102 9.750 31.029 -1.057 1.00 25.00 H new ATOM 0 HE2 LYS A 102 8.925 31.850 -3.175 1.00 25.00 H new ATOM 0 HE3 LYS A 102 9.043 33.513 -2.635 1.00 25.00 H new ATOM 0 HZ1 LYS A 102 10.868 32.944 -4.129 1.00 25.00 H new ATOM 0 HZ2 LYS A 102 11.485 33.294 -2.586 1.00 25.00 H new ATOM 0 HZ3 LYS A 102 11.370 31.683 -3.109 1.00 25.00 H new ATOM 1539 N GLY A 103 6.909 33.661 2.758 1.00 25.00 N ATOM 1540 CA GLY A 103 6.609 35.107 2.697 1.00 25.00 C ATOM 1541 C GLY A 103 5.408 35.472 3.528 1.00 25.00 C ATOM 1542 O GLY A 103 4.614 36.280 3.121 1.00 25.00 O ATOM 0 H GLY A 103 7.615 33.368 3.434 1.00 25.00 H new ATOM 0 HA2 GLY A 103 7.475 35.671 3.044 1.00 25.00 H new ATOM 0 HA3 GLY A 103 6.434 35.397 1.661 1.00 25.00 H new ATOM 1546 N TRP A 104 5.222 34.768 4.608 1.00 25.00 N ATOM 1547 CA TRP A 104 3.992 34.889 5.387 1.00 25.00 C ATOM 1548 C TRP A 104 3.701 36.256 5.955 1.00 25.00 C ATOM 1549 O TRP A 104 4.592 37.099 6.079 1.00 25.00 O ATOM 1550 CB TRP A 104 4.062 33.847 6.505 1.00 25.00 C ATOM 1551 CG TRP A 104 5.401 33.910 7.266 1.00 25.00 C ATOM 1552 CD1 TRP A 104 5.899 34.982 7.902 1.00 25.00 C ATOM 1553 CD2 TRP A 104 6.424 32.902 7.383 1.00 25.00 C ATOM 1554 NE1 TRP A 104 7.152 34.740 8.453 1.00 25.00 N ATOM 1555 CE2 TRP A 104 7.513 33.449 8.151 1.00 25.00 C ATOM 1556 CE3 TRP A 104 6.566 31.585 6.917 1.00 25.00 C ATOM 1557 CZ2 TRP A 104 8.730 32.765 8.344 1.00 25.00 C ATOM 1558 CZ3 TRP A 104 7.739 30.803 7.256 1.00 25.00 C ATOM 1559 CH2 TRP A 104 8.811 31.458 7.955 1.00 25.00 C ATOM 0 H TRP A 104 5.897 34.101 4.981 1.00 25.00 H new ATOM 0 HA TRP A 104 3.162 34.719 4.701 1.00 25.00 H new ATOM 0 HB2 TRP A 104 3.240 34.007 7.203 1.00 25.00 H new ATOM 0 HB3 TRP A 104 3.931 32.851 6.082 1.00 25.00 H new ATOM 0 HD1 TRP A 104 5.383 35.928 7.977 1.00 25.00 H new ATOM 0 HE1 TRP A 104 7.708 35.406 8.989 1.00 25.00 H new ATOM 0 HE3 TRP A 104 5.794 31.150 6.300 1.00 25.00 H new ATOM 0 HZ2 TRP A 104 9.579 33.263 8.789 1.00 25.00 H new ATOM 0 HZ3 TRP A 104 7.806 29.758 6.991 1.00 25.00 H new ATOM 0 HH2 TRP A 104 9.708 30.900 8.179 1.00 25.00 H new ATOM 1570 N ASP A 105 2.455 36.542 6.298 1.00 25.00 N ATOM 1571 CA ASP A 105 2.136 37.657 7.181 1.00 25.00 C ATOM 1572 C ASP A 105 2.518 37.237 8.586 1.00 25.00 C ATOM 1573 O ASP A 105 2.309 36.085 8.971 1.00 25.00 O ATOM 1574 CB ASP A 105 0.594 37.813 7.121 1.00 25.00 C ATOM 1575 CG ASP A 105 0.057 38.922 7.960 1.00 25.00 C ATOM 1576 OD1 ASP A 105 0.279 38.925 9.191 1.00 25.00 O ATOM 1577 OD2 ASP A 105 -0.655 39.748 7.405 1.00 25.00 O1- ATOM 0 H ASP A 105 1.643 36.015 5.977 1.00 25.00 H new ATOM 0 HA ASP A 105 2.648 38.579 6.904 1.00 25.00 H new ATOM 0 HB2 ASP A 105 0.297 37.980 6.086 1.00 25.00 H new ATOM 0 HB3 ASP A 105 0.133 36.877 7.438 1.00 25.00 H new ATOM 1582 N PRO A 106 3.211 38.115 9.363 1.00 25.00 N ATOM 1583 CA PRO A 106 3.680 37.570 10.643 1.00 25.00 C ATOM 1584 C PRO A 106 2.691 37.170 11.701 1.00 25.00 C ATOM 1585 O PRO A 106 3.068 36.417 12.608 1.00 25.00 O ATOM 1586 CB PRO A 106 4.483 38.750 11.176 1.00 25.00 C ATOM 1587 CG PRO A 106 3.876 39.943 10.672 1.00 25.00 C ATOM 1588 CD PRO A 106 3.599 39.525 9.208 1.00 25.00 C ATOM 0 HA PRO A 106 4.169 36.616 10.445 1.00 25.00 H new ATOM 0 HB2 PRO A 106 4.485 38.752 12.266 1.00 25.00 H new ATOM 0 HB3 PRO A 106 5.523 38.683 10.855 1.00 25.00 H new ATOM 0 HG2 PRO A 106 2.963 40.202 11.209 1.00 25.00 H new ATOM 0 HG3 PRO A 106 4.540 40.805 10.738 1.00 25.00 H new ATOM 0 HD2 PRO A 106 2.805 40.120 8.757 1.00 25.00 H new ATOM 0 HD3 PRO A 106 4.480 39.639 8.577 1.00 25.00 H new ATOM 1596 N ASP A 107 1.506 37.738 11.756 1.00 25.00 N ATOM 1597 CA ASP A 107 0.699 37.465 12.932 1.00 25.00 C ATOM 1598 C ASP A 107 -0.118 36.189 12.727 1.00 25.00 C ATOM 1599 O ASP A 107 -0.706 35.659 13.617 1.00 25.00 O ATOM 1600 CB ASP A 107 -0.294 38.626 13.220 1.00 25.00 C ATOM 1601 CG ASP A 107 -1.097 38.415 14.507 1.00 25.00 C ATOM 1602 OD1 ASP A 107 -2.352 38.558 14.488 1.00 75.00 O ATOM 1603 OD2 ASP A 107 -0.481 38.180 15.578 1.00 75.00 O1- ATOM 0 H ASP A 107 1.097 38.353 11.053 1.00 25.00 H new ATOM 0 HA ASP A 107 1.383 37.354 13.773 1.00 25.00 H new ATOM 0 HB2 ASP A 107 0.260 39.562 13.292 1.00 25.00 H new ATOM 0 HB3 ASP A 107 -0.982 38.726 12.380 1.00 25.00 H new ATOM 1608 N LYS A 108 -0.002 35.734 11.515 1.00 25.00 N ATOM 1609 CA LYS A 108 -0.608 34.470 11.056 1.00 25.00 C ATOM 1610 C LYS A 108 0.042 33.254 11.767 1.00 25.00 C ATOM 1611 O LYS A 108 1.190 33.385 12.260 1.00 25.00 O ATOM 1612 CB LYS A 108 -0.504 34.342 9.525 1.00 25.00 C ATOM 1613 CG LYS A 108 -1.595 35.165 8.810 1.00 25.00 C ATOM 1614 CD LYS A 108 -1.741 34.728 7.414 1.00 25.00 C ATOM 1615 CE LYS A 108 -2.807 35.507 6.670 1.00 25.00 C ATOM 1616 NZ LYS A 108 -3.139 34.916 5.319 1.00 25.00 N1+ ATOM 0 H LYS A 108 0.521 36.222 10.787 1.00 25.00 H new ATOM 0 HA LYS A 108 -1.665 34.482 11.321 1.00 25.00 H new ATOM 0 HB2 LYS A 108 0.480 34.679 9.197 1.00 25.00 H new ATOM 0 HB3 LYS A 108 -0.593 33.294 9.240 1.00 25.00 H new ATOM 0 HG2 LYS A 108 -2.545 35.052 9.333 1.00 25.00 H new ATOM 0 HG3 LYS A 108 -1.338 36.224 8.840 1.00 25.00 H new ATOM 0 HD2 LYS A 108 -0.787 34.842 6.899 1.00 25.00 H new ATOM 0 HD3 LYS A 108 -1.990 33.667 7.393 1.00 25.00 H new ATOM 0 HE2 LYS A 108 -3.712 35.543 7.276 1.00 25.00 H new ATOM 0 HE3 LYS A 108 -2.471 36.535 6.537 1.00 25.00 H new ATOM 0 HZ1 LYS A 108 -3.873 35.492 4.859 1.00 25.00 H new ATOM 0 HZ2 LYS A 108 -2.285 34.905 4.725 1.00 25.00 H new ATOM 0 HZ3 LYS A 108 -3.488 33.944 5.442 1.00 25.00 H new ATOM 1630 N PRO A 109 -0.674 32.088 11.829 1.00 25.00 N ATOM 1631 CA PRO A 109 -0.177 30.854 12.474 1.00 25.00 C ATOM 1632 C PRO A 109 0.949 29.996 11.875 1.00 25.00 C ATOM 1633 O PRO A 109 0.814 28.778 11.703 1.00 25.00 O ATOM 1634 CB PRO A 109 -1.529 30.065 12.627 1.00 25.00 C ATOM 1635 CG PRO A 109 -2.276 30.332 11.423 1.00 25.00 C ATOM 1636 CD PRO A 109 -1.994 31.816 11.183 1.00 25.00 C ATOM 0 HA PRO A 109 0.389 31.129 13.364 1.00 25.00 H new ATOM 0 HB2 PRO A 109 -1.347 28.997 12.746 1.00 25.00 H new ATOM 0 HB3 PRO A 109 -2.077 30.395 13.509 1.00 25.00 H new ATOM 0 HG2 PRO A 109 -1.939 29.715 10.590 1.00 25.00 H new ATOM 0 HG3 PRO A 109 -3.340 30.137 11.554 1.00 25.00 H new ATOM 0 HD2 PRO A 109 -1.962 32.041 10.117 1.00 25.00 H new ATOM 0 HD3 PRO A 109 -2.777 32.438 11.616 1.00 25.00 H new ATOM 1644 N LEU A 110 2.019 30.665 11.560 1.00 25.00 N ATOM 1645 CA LEU A 110 3.290 30.256 10.984 1.00 25.00 C ATOM 1646 C LEU A 110 3.537 28.741 10.695 1.00 25.00 C ATOM 1647 O LEU A 110 3.695 28.415 9.508 1.00 25.00 O ATOM 1648 CB LEU A 110 4.467 30.816 11.794 1.00 25.00 C ATOM 1649 CG LEU A 110 5.745 31.345 11.175 1.00 25.00 C ATOM 1650 CD1 LEU A 110 6.574 31.973 12.329 1.00 50.00 C ATOM 1651 CD2 LEU A 110 6.562 30.272 10.536 1.00 50.00 C ATOM 0 H LEU A 110 2.030 31.672 11.724 1.00 25.00 H new ATOM 0 HA LEU A 110 3.221 30.693 9.988 1.00 25.00 H new ATOM 0 HB2 LEU A 110 4.062 31.628 12.398 1.00 25.00 H new ATOM 0 HB3 LEU A 110 4.766 30.026 12.482 1.00 25.00 H new ATOM 0 HG LEU A 110 5.488 32.061 10.395 1.00 25.00 H new ATOM 0 HD11 LEU A 110 7.508 32.370 11.932 1.00 50.00 H new ATOM 0 HD12 LEU A 110 6.004 32.780 12.789 1.00 50.00 H new ATOM 0 HD13 LEU A 110 6.792 31.211 13.077 1.00 50.00 H new ATOM 0 HD21 LEU A 110 7.465 30.708 10.109 1.00 50.00 H new ATOM 0 HD22 LEU A 110 6.837 29.529 11.285 1.00 50.00 H new ATOM 0 HD23 LEU A 110 5.982 29.794 9.747 1.00 50.00 H new ATOM 1663 N LYS A 111 3.629 27.832 11.677 1.00 25.00 N ATOM 1664 CA LYS A 111 3.920 26.484 11.294 1.00 25.00 C ATOM 1665 C LYS A 111 2.732 25.731 10.590 1.00 25.00 C ATOM 1666 O LYS A 111 2.916 24.627 10.077 1.00 25.00 O ATOM 1667 CB LYS A 111 4.402 25.656 12.500 1.00 25.00 C ATOM 1668 CG LYS A 111 5.572 26.295 13.206 1.00 25.00 C ATOM 1669 CD LYS A 111 6.223 25.512 14.310 1.00 25.00 C ATOM 1670 CE LYS A 111 5.481 25.880 15.601 1.00 25.00 C ATOM 1671 NZ LYS A 111 6.158 25.354 16.818 1.00 25.00 N1+ ATOM 0 H LYS A 111 3.511 28.007 12.675 1.00 25.00 H new ATOM 0 HA LYS A 111 4.714 26.576 10.553 1.00 25.00 H new ATOM 0 HB2 LYS A 111 3.579 25.533 13.204 1.00 25.00 H new ATOM 0 HB3 LYS A 111 4.685 24.659 12.163 1.00 25.00 H new ATOM 0 HG2 LYS A 111 6.333 26.522 12.459 1.00 25.00 H new ATOM 0 HG3 LYS A 111 5.237 27.246 13.619 1.00 25.00 H new ATOM 0 HD2 LYS A 111 6.158 24.441 14.117 1.00 25.00 H new ATOM 0 HD3 LYS A 111 7.282 25.758 14.388 1.00 25.00 H new ATOM 0 HE2 LYS A 111 5.401 26.965 15.674 1.00 25.00 H new ATOM 0 HE3 LYS A 111 4.465 25.488 15.556 1.00 25.00 H new ATOM 0 HZ1 LYS A 111 5.617 25.630 17.663 1.00 25.00 H new ATOM 0 HZ2 LYS A 111 6.212 24.317 16.765 1.00 25.00 H new ATOM 0 HZ3 LYS A 111 7.119 25.748 16.878 1.00 25.00 H new ATOM 1685 N ARG A 112 1.570 26.367 10.600 1.00 25.00 N ATOM 1686 CA ARG A 112 0.434 26.014 9.774 1.00 25.00 C ATOM 1687 C ARG A 112 0.362 26.968 8.576 1.00 25.00 C ATOM 1688 O ARG A 112 0.366 26.485 7.472 1.00 25.00 O ATOM 1689 CB ARG A 112 -0.857 26.200 10.589 1.00 25.00 C ATOM 1690 CG ARG A 112 -1.089 25.172 11.723 1.00 25.00 C ATOM 1691 CD ARG A 112 -2.390 25.425 12.600 1.00 25.00 C ATOM 1692 NE ARG A 112 -2.468 24.673 13.864 1.00 25.00 N ATOM 1693 CZ ARG A 112 -3.451 24.744 14.790 1.00 25.00 C ATOM 1694 NH1 ARG A 112 -4.498 25.560 14.709 1.00 25.00 N1+ ATOM 1695 NH2 ARG A 112 -3.425 23.843 15.733 1.00 25.00 N ATOM 0 H ARG A 112 1.390 27.169 11.204 1.00 25.00 H new ATOM 0 HA ARG A 112 0.541 24.982 9.441 1.00 25.00 H new ATOM 0 HB2 ARG A 112 -0.849 27.199 11.025 1.00 25.00 H new ATOM 0 HB3 ARG A 112 -1.705 26.158 9.906 1.00 25.00 H new ATOM 0 HG2 ARG A 112 -1.153 24.177 11.284 1.00 25.00 H new ATOM 0 HG3 ARG A 112 -0.219 25.175 12.380 1.00 25.00 H new ATOM 0 HD2 ARG A 112 -2.450 26.489 12.828 1.00 25.00 H new ATOM 0 HD3 ARG A 112 -3.265 25.178 11.998 1.00 25.00 H new ATOM 0 HE ARG A 112 -1.700 24.031 14.062 1.00 25.00 H new ATOM 0 HH11 ARG A 112 -4.596 26.186 13.910 1.00 25.00 H new ATOM 0 HH12 ARG A 112 -5.203 25.560 15.446 1.00 25.00 H new ATOM 0 HH21 ARG A 112 -2.689 23.136 15.743 1.00 25.00 H new ATOM 0 HH22 ARG A 112 -4.140 23.845 16.460 1.00 25.00 H new ATOM 1709 N ALA A 113 0.316 28.288 8.794 1.00 25.00 N ATOM 1710 CA ALA A 113 0.291 29.329 7.781 1.00 25.00 C ATOM 1711 C ALA A 113 1.347 29.227 6.610 1.00 25.00 C ATOM 1712 O ALA A 113 1.097 29.797 5.528 1.00 25.00 O ATOM 1713 CB ALA A 113 0.457 30.671 8.432 1.00 25.00 C ATOM 0 H ALA A 113 0.294 28.671 9.739 1.00 25.00 H new ATOM 0 HA ALA A 113 -0.680 29.191 7.305 1.00 25.00 H new ATOM 0 HB1 ALA A 113 0.438 31.450 7.670 1.00 25.00 H new ATOM 0 HB2 ALA A 113 -0.356 30.835 9.139 1.00 25.00 H new ATOM 0 HB3 ALA A 113 1.410 30.704 8.960 1.00 25.00 H new ATOM 1719 N ASP A 114 2.484 28.569 6.850 1.00 25.00 N ATOM 1720 CA ASP A 114 3.526 28.424 5.814 1.00 25.00 C ATOM 1721 C ASP A 114 3.178 27.243 4.891 1.00 25.00 C ATOM 1722 O ASP A 114 3.977 26.864 4.015 1.00 25.00 O ATOM 1723 CB ASP A 114 4.903 28.215 6.524 1.00 25.00 C ATOM 1724 CG ASP A 114 6.074 28.058 5.556 1.00 25.00 C ATOM 1725 OD1 ASP A 114 6.882 27.176 5.758 1.00 25.00 O ATOM 1726 OD2 ASP A 114 6.183 28.905 4.623 1.00 25.00 O1- ATOM 0 H ASP A 114 2.711 28.130 7.742 1.00 25.00 H new ATOM 0 HA ASP A 114 3.583 29.319 5.194 1.00 25.00 H new ATOM 0 HB2 ASP A 114 5.096 29.064 7.180 1.00 25.00 H new ATOM 0 HB3 ASP A 114 4.845 27.330 7.157 1.00 25.00 H new ATOM 1731 N PHE A 115 2.003 26.659 5.006 1.00 25.00 N ATOM 1732 CA PHE A 115 1.434 25.854 3.935 1.00 25.00 C ATOM 1733 C PHE A 115 -0.071 26.124 3.872 1.00 25.00 C ATOM 1734 O PHE A 115 -0.648 26.673 4.825 1.00 25.00 O ATOM 1735 CB PHE A 115 1.939 24.392 4.137 1.00 25.00 C ATOM 1736 CG PHE A 115 1.457 23.681 5.376 1.00 25.00 C ATOM 1737 CD1 PHE A 115 2.341 23.605 6.518 1.00 50.00 C ATOM 1738 CD2 PHE A 115 0.194 23.048 5.468 1.00 50.00 C ATOM 1739 CE1 PHE A 115 1.981 22.917 7.666 1.00 25.00 C ATOM 1740 CE2 PHE A 115 -0.208 22.429 6.654 1.00 25.00 C ATOM 1741 CZ PHE A 115 0.669 22.363 7.763 1.00 25.00 C ATOM 0 H PHE A 115 1.416 26.726 5.837 1.00 25.00 H new ATOM 0 HA PHE A 115 1.763 26.108 2.927 1.00 25.00 H new ATOM 0 HB2 PHE A 115 1.641 23.805 3.268 1.00 25.00 H new ATOM 0 HB3 PHE A 115 3.029 24.406 4.154 1.00 25.00 H new ATOM 0 HD1 PHE A 115 3.303 24.095 6.475 1.00 50.00 H new ATOM 0 HD2 PHE A 115 -0.465 23.044 4.613 1.00 50.00 H new ATOM 0 HE1 PHE A 115 2.684 22.801 8.477 1.00 25.00 H new ATOM 0 HE2 PHE A 115 -1.195 21.998 6.725 1.00 25.00 H new ATOM 0 HZ PHE A 115 0.346 21.894 8.681 1.00 25.00 H new ATOM 1751 N GLU A 116 -0.697 25.817 2.765 1.00 25.00 N ATOM 1752 CA GLU A 116 -2.087 26.229 2.479 1.00 25.00 C ATOM 1753 C GLU A 116 -2.701 25.094 1.717 1.00 25.00 C ATOM 1754 O GLU A 116 -2.099 24.477 0.909 1.00 25.00 O ATOM 1755 CB GLU A 116 -2.251 27.499 1.580 1.00 25.00 C ATOM 1756 CG GLU A 116 -2.721 28.737 2.319 1.00 25.00 C ATOM 1757 CD GLU A 116 -3.219 29.959 1.472 1.00 25.00 C ATOM 1758 OE1 GLU A 116 -3.888 29.784 0.420 1.00 25.00 O ATOM 1759 OE2 GLU A 116 -2.922 31.101 1.811 1.00 25.00 O1- ATOM 0 H GLU A 116 -0.271 25.270 2.017 1.00 25.00 H new ATOM 0 HA GLU A 116 -2.546 26.471 3.438 1.00 25.00 H new ATOM 0 HB2 GLU A 116 -1.295 27.717 1.103 1.00 25.00 H new ATOM 0 HB3 GLU A 116 -2.961 27.275 0.784 1.00 25.00 H new ATOM 0 HG2 GLU A 116 -3.532 28.440 2.984 1.00 25.00 H new ATOM 0 HG3 GLU A 116 -1.901 29.080 2.949 1.00 25.00 H new ATOM 1766 N LEU A 117 -3.911 24.717 2.101 1.00 25.00 N ATOM 1767 CA LEU A 117 -4.735 23.706 1.409 1.00 25.00 C ATOM 1768 C LEU A 117 -5.116 24.165 0.011 1.00 25.00 C ATOM 1769 O LEU A 117 -5.512 25.333 -0.149 1.00 25.00 O ATOM 1770 CB LEU A 117 -6.001 23.368 2.154 1.00 25.00 C ATOM 1771 CG LEU A 117 -6.806 22.151 1.670 1.00 25.00 C ATOM 1772 CD1 LEU A 117 -6.169 20.821 2.080 1.00 50.00 C ATOM 1773 CD2 LEU A 117 -8.176 22.291 2.358 1.00 50.00 C ATOM 0 H LEU A 117 -4.370 25.109 2.923 1.00 25.00 H new ATOM 0 HA LEU A 117 -4.112 22.813 1.358 1.00 25.00 H new ATOM 0 HB2 LEU A 117 -5.742 23.206 3.200 1.00 25.00 H new ATOM 0 HB3 LEU A 117 -6.655 24.239 2.119 1.00 25.00 H new ATOM 0 HG LEU A 117 -6.859 22.137 0.581 1.00 25.00 H new ATOM 0 HD11 LEU A 117 -6.779 19.996 1.712 1.00 50.00 H new ATOM 0 HD12 LEU A 117 -5.168 20.750 1.654 1.00 50.00 H new ATOM 0 HD13 LEU A 117 -6.105 20.768 3.167 1.00 50.00 H new ATOM 0 HD21 LEU A 117 -8.817 21.459 2.066 1.00 50.00 H new ATOM 0 HD22 LEU A 117 -8.042 22.284 3.440 1.00 50.00 H new ATOM 0 HD23 LEU A 117 -8.641 23.230 2.056 1.00 50.00 H new ATOM 1785 N ILE A 118 -4.961 23.319 -1.010 1.00 25.00 N ATOM 1786 CA ILE A 118 -5.354 23.697 -2.368 1.00 25.00 C ATOM 1787 C ILE A 118 -6.553 22.843 -2.714 1.00 25.00 C ATOM 1788 O ILE A 118 -7.221 23.087 -3.688 1.00 25.00 O ATOM 1789 CB ILE A 118 -4.140 23.651 -3.324 1.00 25.00 C ATOM 1790 CG1 ILE A 118 -4.472 24.352 -4.649 1.00 25.00 C ATOM 1791 CG2 ILE A 118 -3.696 22.166 -3.575 1.00 25.00 C ATOM 1792 CD1 ILE A 118 -3.266 24.774 -5.417 1.00 25.00 C ATOM 0 H ILE A 118 -4.572 22.380 -0.924 1.00 25.00 H new ATOM 0 HA ILE A 118 -5.672 24.735 -2.466 1.00 25.00 H new ATOM 0 HB ILE A 118 -3.310 24.181 -2.857 1.00 25.00 H new ATOM 0 HG12 ILE A 118 -5.070 23.681 -5.266 1.00 25.00 H new ATOM 0 HG13 ILE A 118 -5.087 25.228 -4.443 1.00 25.00 H new ATOM 0 HG21 ILE A 118 -2.840 22.151 -4.250 1.00 25.00 H new ATOM 0 HG22 ILE A 118 -3.419 21.704 -2.627 1.00 25.00 H new ATOM 0 HG23 ILE A 118 -4.520 21.610 -4.022 1.00 25.00 H new ATOM 0 HD11 ILE A 118 -3.576 25.262 -6.341 1.00 25.00 H new ATOM 0 HD12 ILE A 118 -2.678 25.470 -4.818 1.00 25.00 H new ATOM 0 HD13 ILE A 118 -2.661 23.899 -5.654 1.00 25.00 H new ATOM 1804 N GLY A 119 -6.777 21.767 -2.008 1.00 25.00 N ATOM 1805 CA GLY A 119 -7.913 20.902 -2.253 1.00 25.00 C ATOM 1806 C GLY A 119 -7.896 19.645 -1.407 1.00 25.00 C ATOM 1807 O GLY A 119 -6.857 19.189 -0.915 1.00 25.00 O ATOM 0 H GLY A 119 -6.177 21.460 -1.242 1.00 25.00 H new ATOM 0 HA2 GLY A 119 -8.832 21.454 -2.055 1.00 25.00 H new ATOM 0 HA3 GLY A 119 -7.930 20.623 -3.307 1.00 25.00 H new ATOM 1811 N ALA A 120 -9.061 19.088 -1.206 1.00 25.00 N ATOM 1812 CA ALA A 120 -9.223 17.897 -0.414 1.00 25.00 C ATOM 1813 C ALA A 120 -10.391 17.102 -1.027 1.00 25.00 C ATOM 1814 O ALA A 120 -11.381 17.639 -1.605 1.00 25.00 O ATOM 1815 CB ALA A 120 -9.551 18.242 1.058 1.00 25.00 C ATOM 0 H ALA A 120 -9.933 19.452 -1.591 1.00 25.00 H new ATOM 0 HA ALA A 120 -8.298 17.321 -0.418 1.00 25.00 H new ATOM 0 HB1 ALA A 120 -9.667 17.322 1.630 1.00 25.00 H new ATOM 0 HB2 ALA A 120 -8.740 18.833 1.483 1.00 25.00 H new ATOM 0 HB3 ALA A 120 -10.477 18.815 1.100 1.00 25.00 H new ATOM 1821 N VAL A 121 -10.203 15.800 -1.075 1.00 25.00 N ATOM 1822 CA VAL A 121 -11.075 14.880 -1.798 1.00 25.00 C ATOM 1823 C VAL A 121 -11.508 13.719 -0.870 1.00 25.00 C ATOM 1824 O VAL A 121 -10.633 12.923 -0.450 1.00 25.00 O ATOM 1825 CB VAL A 121 -10.340 14.325 -3.099 1.00 25.00 C ATOM 1826 CG1 VAL A 121 -11.293 13.320 -3.868 1.00 50.00 C ATOM 1827 CG2 VAL A 121 -9.856 15.456 -4.116 1.00 50.00 C ATOM 0 H VAL A 121 -9.426 15.336 -0.605 1.00 25.00 H new ATOM 0 HA VAL A 121 -11.968 15.416 -2.118 1.00 25.00 H new ATOM 0 HB VAL A 121 -9.442 13.825 -2.737 1.00 25.00 H new ATOM 0 HG11 VAL A 121 -10.785 12.944 -4.756 1.00 50.00 H new ATOM 0 HG12 VAL A 121 -11.545 12.485 -3.214 1.00 50.00 H new ATOM 0 HG13 VAL A 121 -12.205 13.838 -4.164 1.00 50.00 H new ATOM 0 HG21 VAL A 121 -9.367 14.991 -4.972 1.00 50.00 H new ATOM 0 HG22 VAL A 121 -10.717 16.030 -4.458 1.00 50.00 H new ATOM 0 HG23 VAL A 121 -9.153 16.121 -3.613 1.00 50.00 H new ATOM 1837 N PRO A 122 -12.789 13.696 -0.415 1.00 25.00 N ATOM 1838 CA PRO A 122 -13.063 12.582 0.477 1.00 25.00 C ATOM 1839 C PRO A 122 -13.225 11.248 -0.201 1.00 25.00 C ATOM 1840 O PRO A 122 -13.497 11.194 -1.422 1.00 25.00 O ATOM 1841 CB PRO A 122 -14.324 13.033 1.201 1.00 25.00 C ATOM 1842 CG PRO A 122 -15.020 13.837 0.182 1.00 25.00 C ATOM 1843 CD PRO A 122 -13.959 14.587 -0.514 1.00 25.00 C ATOM 0 HA PRO A 122 -12.221 12.383 1.140 1.00 25.00 H new ATOM 0 HB2 PRO A 122 -14.927 12.186 1.528 1.00 25.00 H new ATOM 0 HB3 PRO A 122 -14.091 13.620 2.089 1.00 25.00 H new ATOM 0 HG2 PRO A 122 -15.572 13.202 -0.511 1.00 25.00 H new ATOM 0 HG3 PRO A 122 -15.743 14.512 0.640 1.00 25.00 H new ATOM 0 HD2 PRO A 122 -14.224 14.788 -1.552 1.00 25.00 H new ATOM 0 HD3 PRO A 122 -13.771 15.551 -0.040 1.00 25.00 H new ATOM 1851 N HIS A 123 -13.154 10.212 0.595 1.00 25.00 N ATOM 1852 CA HIS A 123 -13.297 8.876 0.028 1.00 25.00 C ATOM 1853 C HIS A 123 -14.096 7.855 0.806 1.00 25.00 C ATOM 1854 O HIS A 123 -14.279 6.694 0.394 1.00 25.00 O ATOM 1855 CB HIS A 123 -11.853 8.326 -0.128 1.00 25.00 C ATOM 1856 CG HIS A 123 -11.702 7.178 -1.111 1.00 25.00 C ATOM 1857 ND1 HIS A 123 -11.576 5.877 -0.699 1.00 25.00 N ATOM 1858 CD2 HIS A 123 -11.692 7.142 -2.474 1.00 25.00 C ATOM 1859 CE1 HIS A 123 -11.412 5.105 -1.750 1.00 25.00 C ATOM 1860 NE2 HIS A 123 -11.535 5.848 -2.829 1.00 25.00 N ATOM 0 H HIS A 123 -13.004 10.251 1.603 1.00 25.00 H new ATOM 0 HA HIS A 123 -13.869 9.006 -0.891 1.00 25.00 H new ATOM 0 HB2 HIS A 123 -11.203 9.142 -0.444 1.00 25.00 H new ATOM 0 HB3 HIS A 123 -11.499 7.996 0.849 1.00 25.00 H new ATOM 0 HD1 HIS A 123 -11.605 5.558 0.270 1.00 25.00 H new ATOM 0 HD2 HIS A 123 -11.791 7.985 -3.141 1.00 25.00 H new ATOM 0 HE1 HIS A 123 -11.211 4.044 -1.731 1.00 25.00 H new ATOM 1868 N ASP A 124 -14.655 8.311 1.934 1.00 25.00 N ATOM 1869 CA ASP A 124 -15.420 7.410 2.811 1.00 25.00 C ATOM 1870 C ASP A 124 -16.898 7.453 2.353 1.00 25.00 C ATOM 1871 O ASP A 124 -17.636 6.500 2.581 1.00 25.00 O ATOM 1872 CB ASP A 124 -15.291 7.822 4.285 1.00 25.00 C ATOM 1873 CG ASP A 124 -15.962 9.150 4.515 1.00 25.00 C ATOM 1874 OD1 ASP A 124 -15.741 10.106 3.775 1.00 50.00 O ATOM 1875 OD2 ASP A 124 -16.662 9.274 5.555 1.00 50.00 O1- ATOM 0 H ASP A 124 -14.596 9.276 2.258 1.00 25.00 H new ATOM 0 HA ASP A 124 -15.028 6.396 2.735 1.00 25.00 H new ATOM 0 HB2 ASP A 124 -15.743 7.063 4.923 1.00 25.00 H new ATOM 0 HB3 ASP A 124 -14.239 7.885 4.562 1.00 25.00 H new ATOM 1880 N GLY A 125 -17.274 8.580 1.708 1.00 25.00 N ATOM 1881 CA GLY A 125 -18.385 8.654 0.765 1.00 25.00 C ATOM 1882 C GLY A 125 -17.700 9.628 -0.179 1.00 25.00 C ATOM 1883 O GLY A 125 -16.757 10.286 0.321 1.00 25.00 O ATOM 0 H GLY A 125 -16.798 9.473 1.838 1.00 25.00 H new ATOM 0 HA2 GLY A 125 -18.631 7.698 0.303 1.00 25.00 H new ATOM 0 HA3 GLY A 125 -19.305 9.043 1.202 1.00 25.00 H new ATOM 1887 N SER A 126 -18.124 9.766 -1.433 1.00 25.00 N ATOM 1888 CA SER A 126 -17.399 10.672 -2.304 1.00 25.00 C ATOM 1889 C SER A 126 -18.271 11.220 -3.451 1.00 25.00 C ATOM 1890 O SER A 126 -19.165 10.527 -3.910 1.00 25.00 O ATOM 1891 CB SER A 126 -16.125 9.907 -2.854 1.00 25.00 C ATOM 1892 OG SER A 126 -15.195 10.760 -3.498 1.00 25.00 O ATOM 0 H SER A 126 -18.924 9.288 -1.848 1.00 25.00 H new ATOM 0 HA SER A 126 -17.094 11.548 -1.732 1.00 25.00 H new ATOM 0 HB2 SER A 126 -15.629 9.399 -2.027 1.00 25.00 H new ATOM 0 HB3 SER A 126 -16.447 9.136 -3.555 1.00 25.00 H new ATOM 0 HG SER A 126 -14.578 11.132 -2.834 1.00 25.00 H new ATOM 1898 N PRO A 127 -18.004 12.438 -3.910 1.00 25.00 N ATOM 1899 CA PRO A 127 -18.713 12.802 -5.105 1.00 25.00 C ATOM 1900 C PRO A 127 -18.131 12.069 -6.342 1.00 25.00 C ATOM 1901 O PRO A 127 -17.243 11.204 -6.266 1.00 25.00 O ATOM 1902 CB PRO A 127 -18.494 14.287 -5.159 1.00 25.00 C ATOM 1903 CG PRO A 127 -17.196 14.541 -4.635 1.00 25.00 C ATOM 1904 CD PRO A 127 -17.035 13.456 -3.507 1.00 25.00 C ATOM 0 HA PRO A 127 -19.768 12.529 -5.103 1.00 25.00 H new ATOM 0 HB2 PRO A 127 -18.573 14.650 -6.184 1.00 25.00 H new ATOM 0 HB3 PRO A 127 -19.253 14.809 -4.576 1.00 25.00 H new ATOM 0 HG2 PRO A 127 -16.427 14.440 -5.401 1.00 25.00 H new ATOM 0 HG3 PRO A 127 -17.116 15.551 -4.234 1.00 25.00 H new ATOM 0 HD2 PRO A 127 -16.021 13.058 -3.467 1.00 25.00 H new ATOM 0 HD3 PRO A 127 -17.258 13.860 -2.520 1.00 25.00 H new ATOM 1912 N ALA A 128 -18.655 12.332 -7.527 1.00 25.00 N ATOM 1913 CA ALA A 128 -17.965 11.802 -8.727 1.00 25.00 C ATOM 1914 C ALA A 128 -16.477 12.225 -8.885 1.00 25.00 C ATOM 1915 O ALA A 128 -15.717 11.519 -9.534 1.00 25.00 O ATOM 1916 CB ALA A 128 -18.776 12.228 -9.915 1.00 25.00 C ATOM 0 H ALA A 128 -19.502 12.873 -7.698 1.00 25.00 H new ATOM 0 HA ALA A 128 -17.907 10.718 -8.627 1.00 25.00 H new ATOM 0 HB1 ALA A 128 -18.306 11.860 -10.827 1.00 25.00 H new ATOM 0 HB2 ALA A 128 -19.783 11.818 -9.834 1.00 25.00 H new ATOM 0 HB3 ALA A 128 -18.829 13.316 -9.948 1.00 25.00 H new ATOM 1922 N SER A 129 -16.043 13.249 -8.152 1.00 25.00 N ATOM 1923 CA SER A 129 -14.626 13.606 -7.989 1.00 25.00 C ATOM 1924 C SER A 129 -13.739 12.563 -7.261 1.00 25.00 C ATOM 1925 O SER A 129 -12.529 12.775 -7.121 1.00 25.00 O ATOM 1926 CB SER A 129 -14.410 14.903 -7.250 1.00 25.00 C ATOM 1927 OG SER A 129 -15.418 15.807 -7.694 1.00 25.00 O ATOM 0 H SER A 129 -16.674 13.868 -7.644 1.00 25.00 H new ATOM 0 HA SER A 129 -14.320 13.674 -9.033 1.00 25.00 H new ATOM 0 HB2 SER A 129 -14.477 14.749 -6.173 1.00 25.00 H new ATOM 0 HB3 SER A 129 -13.417 15.302 -7.454 1.00 25.00 H new ATOM 0 HG SER A 129 -15.313 16.666 -7.234 1.00 25.00 H new ATOM 1933 N ARG A 130 -14.302 11.403 -6.917 1.00 25.00 N ATOM 1934 CA ARG A 130 -13.631 10.219 -6.422 1.00 25.00 C ATOM 1935 C ARG A 130 -12.548 9.654 -7.345 1.00 25.00 C ATOM 1936 O ARG A 130 -11.595 9.026 -6.825 1.00 25.00 O ATOM 1937 CB ARG A 130 -14.636 9.075 -6.244 1.00 25.00 C ATOM 1938 CG ARG A 130 -14.155 7.748 -5.489 1.00 25.00 C ATOM 1939 CD ARG A 130 -15.178 6.619 -5.515 1.00 25.00 C ATOM 1940 NE ARG A 130 -16.376 6.828 -4.677 1.00 25.00 N ATOM 1941 CZ ARG A 130 -17.611 7.200 -5.011 1.00 25.00 C ATOM 1942 NH1 ARG A 130 -18.538 7.136 -4.096 1.00 25.00 N1+ ATOM 1943 NH2 ARG A 130 -17.985 7.552 -6.244 1.00 25.00 N ATOM 0 H ARG A 130 -15.310 11.266 -6.985 1.00 25.00 H new ATOM 0 HA ARG A 130 -13.169 10.553 -5.493 1.00 25.00 H new ATOM 0 HB2 ARG A 130 -15.496 9.470 -5.704 1.00 25.00 H new ATOM 0 HB3 ARG A 130 -14.987 8.785 -7.234 1.00 25.00 H new ATOM 0 HG2 ARG A 130 -13.229 7.397 -5.945 1.00 25.00 H new ATOM 0 HG3 ARG A 130 -13.926 7.994 -4.452 1.00 25.00 H new ATOM 0 HD2 ARG A 130 -15.499 6.466 -6.545 1.00 25.00 H new ATOM 0 HD3 ARG A 130 -14.687 5.700 -5.194 1.00 25.00 H new ATOM 0 HE ARG A 130 -16.235 6.660 -3.681 1.00 25.00 H new ATOM 0 HH11 ARG A 130 -18.307 6.809 -3.158 1.00 25.00 H new ATOM 0 HH12 ARG A 130 -19.494 7.413 -4.318 1.00 25.00 H new ATOM 0 HH21 ARG A 130 -17.305 7.547 -7.004 1.00 25.00 H new ATOM 0 HH22 ARG A 130 -18.951 7.826 -6.425 1.00 25.00 H new ATOM 1957 N ASN A 131 -12.697 9.749 -8.646 1.00 25.00 N ATOM 1958 CA ASN A 131 -11.663 9.357 -9.582 1.00 25.00 C ATOM 1959 C ASN A 131 -10.290 9.929 -9.236 1.00 25.00 C ATOM 1960 O ASN A 131 -10.167 11.072 -8.971 1.00 25.00 O ATOM 1961 CB ASN A 131 -12.127 9.778 -10.994 1.00 25.00 C ATOM 1962 CG ASN A 131 -13.244 9.005 -11.510 1.00 25.00 C ATOM 1963 OD1 ASN A 131 -14.355 9.002 -10.971 1.00 25.00 O ATOM 1964 ND2 ASN A 131 -13.085 8.498 -12.681 1.00 25.00 N ATOM 0 H ASN A 131 -13.544 10.103 -9.090 1.00 25.00 H new ATOM 0 HA ASN A 131 -11.528 8.277 -9.533 1.00 25.00 H new ATOM 0 HB2 ASN A 131 -12.408 10.831 -10.973 1.00 25.00 H new ATOM 0 HB3 ASN A 131 -11.287 9.686 -11.683 1.00 25.00 H new ATOM 0 HD21 ASN A 131 -13.880 8.089 -13.172 1.00 25.00 H new ATOM 0 HD22 ASN A 131 -12.164 8.505 -13.119 1.00 25.00 H new ATOM 1971 N LEU A 132 -9.286 9.081 -9.235 1.00 25.00 N ATOM 1972 CA LEU A 132 -7.930 9.470 -8.920 1.00 25.00 C ATOM 1973 C LEU A 132 -7.306 10.450 -9.969 1.00 25.00 C ATOM 1974 O LEU A 132 -6.424 11.304 -9.650 1.00 25.00 O ATOM 1975 CB LEU A 132 -7.081 8.200 -8.732 1.00 25.00 C ATOM 1976 CG LEU A 132 -5.634 8.415 -8.227 1.00 25.00 C ATOM 1977 CD1 LEU A 132 -5.585 9.140 -6.792 1.00 75.00 C ATOM 1978 CD2 LEU A 132 -4.994 7.142 -8.183 1.00 75.00 C ATOM 0 H LEU A 132 -9.389 8.091 -9.455 1.00 25.00 H new ATOM 0 HA LEU A 132 -7.945 10.038 -7.990 1.00 25.00 H new ATOM 0 HB2 LEU A 132 -7.596 7.545 -8.029 1.00 25.00 H new ATOM 0 HB3 LEU A 132 -7.037 7.673 -9.685 1.00 25.00 H new ATOM 0 HG LEU A 132 -5.111 9.082 -8.912 1.00 25.00 H new ATOM 0 HD11 LEU A 132 -4.547 9.267 -6.484 1.00 75.00 H new ATOM 0 HD12 LEU A 132 -6.065 10.116 -6.861 1.00 75.00 H new ATOM 0 HD13 LEU A 132 -6.110 8.529 -6.057 1.00 75.00 H new ATOM 0 HD21 LEU A 132 -3.970 7.262 -7.830 1.00 75.00 H new ATOM 0 HD22 LEU A 132 -5.537 6.485 -7.504 1.00 75.00 H new ATOM 0 HD23 LEU A 132 -4.985 6.705 -9.181 1.00 75.00 H new ATOM 1990 N SER A 133 -7.738 10.333 -11.198 1.00 25.00 N ATOM 1991 CA SER A 133 -7.452 11.373 -12.181 1.00 25.00 C ATOM 1992 C SER A 133 -8.219 12.696 -11.827 1.00 25.00 C ATOM 1993 O SER A 133 -9.408 12.643 -11.405 1.00 25.00 O ATOM 1994 CB SER A 133 -7.981 10.844 -13.515 1.00 25.00 C ATOM 1995 OG SER A 133 -7.582 11.747 -14.537 1.00 25.00 O ATOM 0 H SER A 133 -8.282 9.545 -11.549 1.00 25.00 H new ATOM 0 HA SER A 133 -6.385 11.596 -12.209 1.00 25.00 H new ATOM 0 HB2 SER A 133 -7.587 9.847 -13.713 1.00 25.00 H new ATOM 0 HB3 SER A 133 -9.067 10.757 -13.486 1.00 25.00 H new ATOM 0 HG SER A 133 -7.909 11.426 -15.403 1.00 25.00 H new ATOM 2001 N HIS A 134 -7.516 13.814 -11.858 1.00 25.00 N ATOM 2002 CA HIS A 134 -8.073 15.085 -11.285 1.00 25.00 C ATOM 2003 C HIS A 134 -7.456 16.282 -11.956 1.00 25.00 C ATOM 2004 O HIS A 134 -6.411 16.242 -12.573 1.00 25.00 O ATOM 2005 CB HIS A 134 -7.727 15.154 -9.818 1.00 25.00 C ATOM 2006 CG HIS A 134 -8.560 16.078 -8.970 1.00 25.00 C ATOM 2007 ND1 HIS A 134 -8.076 17.074 -8.146 1.00 25.00 N ATOM 2008 CD2 HIS A 134 -9.948 16.142 -8.880 1.00 25.00 C ATOM 2009 CE1 HIS A 134 -9.083 17.761 -7.682 1.00 25.00 C ATOM 2010 NE2 HIS A 134 -10.249 17.211 -8.084 1.00 25.00 N ATOM 0 H HIS A 134 -6.581 13.897 -12.256 1.00 25.00 H new ATOM 0 HA HIS A 134 -9.152 15.091 -11.439 1.00 25.00 H new ATOM 0 HB2 HIS A 134 -7.804 14.149 -9.403 1.00 25.00 H new ATOM 0 HB3 HIS A 134 -6.684 15.457 -9.728 1.00 25.00 H new ATOM 0 HD2 HIS A 134 -10.653 15.473 -9.350 1.00 25.00 H new ATOM 0 HE1 HIS A 134 -8.997 18.643 -7.065 1.00 25.00 H new ATOM 0 HE2 HIS A 134 -11.184 17.535 -7.838 1.00 25.00 H new ATOM 2018 N HIS A 135 -8.147 17.416 -11.814 1.00 25.00 N ATOM 2019 CA HIS A 135 -7.808 18.664 -12.508 1.00 25.00 C ATOM 2020 C HIS A 135 -7.326 19.738 -11.630 1.00 25.00 C ATOM 2021 O HIS A 135 -7.954 19.981 -10.591 1.00 25.00 O ATOM 2022 CB HIS A 135 -8.939 19.270 -13.304 1.00 25.00 C ATOM 2023 CG HIS A 135 -9.593 18.358 -14.304 1.00 25.00 C ATOM 2024 ND1 HIS A 135 -9.351 18.336 -15.654 1.00 25.00 N ATOM 2025 CD2 HIS A 135 -10.650 17.525 -14.152 1.00 25.00 C ATOM 2026 CE1 HIS A 135 -10.183 17.556 -16.302 1.00 25.00 C ATOM 2027 NE2 HIS A 135 -11.022 17.029 -15.404 1.00 25.00 N ATOM 0 H HIS A 135 -8.965 17.496 -11.209 1.00 25.00 H new ATOM 0 HA HIS A 135 -7.014 18.320 -13.170 1.00 25.00 H new ATOM 0 HB2 HIS A 135 -9.701 19.622 -12.608 1.00 25.00 H new ATOM 0 HB3 HIS A 135 -8.560 20.145 -13.831 1.00 25.00 H new ATOM 0 HD2 HIS A 135 -11.128 17.283 -13.214 1.00 25.00 H new ATOM 0 HE1 HIS A 135 -10.189 17.373 -17.366 1.00 25.00 H new ATOM 0 HE2 HIS A 135 -11.790 16.386 -15.597 1.00 25.00 H new ATOM 2035 N ILE A 136 -6.329 20.459 -11.980 1.00 25.00 N ATOM 2036 CA ILE A 136 -5.842 21.655 -11.238 1.00 25.00 C ATOM 2037 C ILE A 136 -5.674 22.688 -12.332 1.00 25.00 C ATOM 2038 O ILE A 136 -5.142 22.362 -13.388 1.00 25.00 O ATOM 2039 CB ILE A 136 -4.506 21.417 -10.441 1.00 25.00 C ATOM 2040 CG1 ILE A 136 -4.600 20.157 -9.488 1.00 25.00 C ATOM 2041 CG2 ILE A 136 -4.137 22.689 -9.595 1.00 25.00 C ATOM 2042 CD1 ILE A 136 -3.233 19.773 -8.860 1.00 25.00 C ATOM 0 H ILE A 136 -5.780 20.261 -12.817 1.00 25.00 H new ATOM 0 HA ILE A 136 -6.537 21.954 -10.453 1.00 25.00 H new ATOM 0 HB ILE A 136 -3.725 21.226 -11.177 1.00 25.00 H new ATOM 0 HG12 ILE A 136 -5.315 20.362 -8.692 1.00 25.00 H new ATOM 0 HG13 ILE A 136 -4.986 19.308 -10.053 1.00 25.00 H new ATOM 0 HG21 ILE A 136 -3.211 22.507 -9.050 1.00 25.00 H new ATOM 0 HG22 ILE A 136 -4.005 23.543 -10.260 1.00 25.00 H new ATOM 0 HG23 ILE A 136 -4.939 22.900 -8.887 1.00 25.00 H new ATOM 0 HD11 ILE A 136 -3.360 18.902 -8.217 1.00 25.00 H new ATOM 0 HD12 ILE A 136 -2.522 19.538 -9.652 1.00 25.00 H new ATOM 0 HD13 ILE A 136 -2.856 20.608 -8.270 1.00 25.00 H new ATOM 2054 N TYR A 137 -6.175 23.865 -12.066 1.00 25.00 N ATOM 2055 CA TYR A 137 -5.986 25.016 -12.938 1.00 25.00 C ATOM 2056 C TYR A 137 -4.859 25.867 -12.276 1.00 25.00 C ATOM 2057 O TYR A 137 -4.869 26.050 -11.067 1.00 25.00 O ATOM 2058 CB TYR A 137 -7.230 25.829 -13.161 1.00 25.00 C ATOM 2059 CG TYR A 137 -6.996 27.199 -13.928 1.00 25.00 C ATOM 2060 CD1 TYR A 137 -7.031 28.399 -13.164 1.00 50.00 C ATOM 2061 CD2 TYR A 137 -6.623 27.245 -15.246 1.00 50.00 C ATOM 2062 CE1 TYR A 137 -6.870 29.655 -13.849 1.00 25.00 C ATOM 2063 CE2 TYR A 137 -6.399 28.474 -15.902 1.00 25.00 C ATOM 2064 CZ TYR A 137 -6.590 29.688 -15.212 1.00 25.00 C ATOM 2065 OH TYR A 137 -6.446 30.921 -15.786 1.00 25.00 O ATOM 0 H TYR A 137 -6.731 24.063 -11.234 1.00 25.00 H new ATOM 0 HA TYR A 137 -5.717 24.677 -13.939 1.00 25.00 H new ATOM 0 HB2 TYR A 137 -7.944 25.229 -13.726 1.00 25.00 H new ATOM 0 HB3 TYR A 137 -7.687 26.042 -12.195 1.00 25.00 H new ATOM 0 HD1 TYR A 137 -7.175 28.368 -12.094 1.00 50.00 H new ATOM 0 HD2 TYR A 137 -6.498 26.322 -15.793 1.00 50.00 H new ATOM 0 HE1 TYR A 137 -6.967 30.580 -13.300 1.00 25.00 H new ATOM 0 HE2 TYR A 137 -6.081 28.484 -16.934 1.00 25.00 H new ATOM 0 HH TYR A 137 -6.251 30.817 -16.741 1.00 25.00 H new ATOM 2075 N ILE A 138 -3.926 26.294 -13.091 1.00 25.00 N ATOM 2076 CA ILE A 138 -2.812 27.121 -12.575 1.00 25.00 C ATOM 2077 C ILE A 138 -2.886 28.323 -13.446 1.00 25.00 C ATOM 2078 O ILE A 138 -2.721 28.155 -14.623 1.00 25.00 O ATOM 2079 CB ILE A 138 -1.419 26.371 -12.715 1.00 25.00 C ATOM 2080 CG1 ILE A 138 -1.434 25.010 -11.975 1.00 25.00 C ATOM 2081 CG2 ILE A 138 -0.268 27.300 -12.359 1.00 25.00 C ATOM 2082 CD1 ILE A 138 -1.438 25.061 -10.451 1.00 25.00 C ATOM 0 H ILE A 138 -3.895 26.101 -14.092 1.00 25.00 H new ATOM 0 HA ILE A 138 -2.890 27.352 -11.513 1.00 25.00 H new ATOM 0 HB ILE A 138 -1.249 26.104 -13.758 1.00 25.00 H new ATOM 0 HG12 ILE A 138 -2.315 24.456 -12.300 1.00 25.00 H new ATOM 0 HG13 ILE A 138 -0.562 24.439 -12.294 1.00 25.00 H new ATOM 0 HG21 ILE A 138 0.676 26.765 -12.462 1.00 25.00 H new ATOM 0 HG22 ILE A 138 -0.273 28.159 -13.029 1.00 25.00 H new ATOM 0 HG23 ILE A 138 -0.381 27.642 -11.330 1.00 25.00 H new ATOM 0 HD11 ILE A 138 -1.449 24.046 -10.053 1.00 25.00 H new ATOM 0 HD12 ILE A 138 -0.544 25.578 -10.102 1.00 25.00 H new ATOM 0 HD13 ILE A 138 -2.324 25.595 -10.107 1.00 25.00 H new ATOM 2094 N PRO A 139 -3.269 29.482 -12.975 1.00 25.00 N ATOM 2095 CA PRO A 139 -3.322 30.567 -13.960 1.00 25.00 C ATOM 2096 C PRO A 139 -1.927 30.935 -14.391 1.00 25.00 C ATOM 2097 O PRO A 139 -0.974 30.741 -13.617 1.00 25.00 O ATOM 2098 CB PRO A 139 -3.943 31.699 -13.212 1.00 25.00 C ATOM 2099 CG PRO A 139 -3.655 31.481 -11.831 1.00 25.00 C ATOM 2100 CD PRO A 139 -3.709 30.004 -11.657 1.00 25.00 C ATOM 0 HA PRO A 139 -3.876 30.300 -14.860 1.00 25.00 H new ATOM 0 HB2 PRO A 139 -3.537 32.654 -13.547 1.00 25.00 H new ATOM 0 HB3 PRO A 139 -5.019 31.733 -13.383 1.00 25.00 H new ATOM 0 HG2 PRO A 139 -2.674 31.874 -11.565 1.00 25.00 H new ATOM 0 HG3 PRO A 139 -4.383 31.981 -11.192 1.00 25.00 H new ATOM 0 HD2 PRO A 139 -3.052 29.670 -10.854 1.00 25.00 H new ATOM 0 HD3 PRO A 139 -4.715 29.666 -11.407 1.00 25.00 H new ATOM 2108 N GLU A 140 -1.746 31.393 -15.602 1.00 25.00 N ATOM 2109 CA GLU A 140 -0.421 31.772 -16.056 1.00 25.00 C ATOM 2110 C GLU A 140 -0.248 33.254 -15.780 1.00 25.00 C ATOM 2111 O GLU A 140 0.197 34.020 -16.664 1.00 25.00 O ATOM 2112 CB GLU A 140 -0.304 31.401 -17.511 1.00 25.00 C ATOM 2113 CG GLU A 140 1.119 31.221 -18.023 1.00 25.00 C ATOM 2114 CD GLU A 140 1.186 31.080 -19.546 1.00 25.00 C ATOM 2115 OE1 GLU A 140 1.981 31.766 -20.172 1.00 25.00 O ATOM 2116 OE2 GLU A 140 0.424 30.317 -20.132 1.00 25.00 O1- ATOM 0 H GLU A 140 -2.488 31.514 -16.291 1.00 25.00 H new ATOM 0 HA GLU A 140 0.380 31.251 -15.532 1.00 25.00 H new ATOM 0 HB2 GLU A 140 -0.853 30.474 -17.678 1.00 25.00 H new ATOM 0 HB3 GLU A 140 -0.792 32.173 -18.106 1.00 25.00 H new ATOM 0 HG2 GLU A 140 1.722 32.075 -17.714 1.00 25.00 H new ATOM 0 HG3 GLU A 140 1.558 30.337 -17.561 1.00 25.00 H new ATOM 2123 N ASP A 141 -0.579 33.764 -14.599 1.00 25.00 N ATOM 2124 CA ASP A 141 -0.504 35.175 -14.235 1.00 25.00 C ATOM 2125 C ASP A 141 0.920 35.692 -13.980 1.00 25.00 C ATOM 2126 O ASP A 141 1.131 36.926 -13.951 1.00 25.00 O ATOM 2127 CB ASP A 141 -1.422 35.590 -13.028 1.00 25.00 C ATOM 2128 CG ASP A 141 -0.879 35.030 -11.715 1.00 25.00 C ATOM 2129 OD1 ASP A 141 -0.801 33.799 -11.465 1.00 50.00 O ATOM 2130 OD2 ASP A 141 -0.428 35.910 -10.924 1.00 50.00 O1- ATOM 0 H ASP A 141 -0.922 33.180 -13.836 1.00 25.00 H new ATOM 0 HA ASP A 141 -0.887 35.657 -15.134 1.00 25.00 H new ATOM 0 HB2 ASP A 141 -1.482 36.677 -12.968 1.00 25.00 H new ATOM 0 HB3 ASP A 141 -2.435 35.224 -13.193 1.00 25.00 H new ATOM 2135 N ARG A 142 1.886 34.768 -13.815 1.00 25.00 N ATOM 2136 CA ARG A 142 3.239 35.086 -13.507 1.00 25.00 C ATOM 2137 C ARG A 142 3.993 33.778 -13.763 1.00 25.00 C ATOM 2138 O ARG A 142 3.349 32.716 -13.810 1.00 25.00 O ATOM 2139 CB ARG A 142 3.459 35.490 -12.006 1.00 25.00 C ATOM 2140 CG ARG A 142 2.949 34.502 -10.905 1.00 25.00 C ATOM 2141 CD ARG A 142 3.494 34.928 -9.571 1.00 25.00 C ATOM 2142 NE ARG A 142 3.005 33.970 -8.578 1.00 25.00 N ATOM 2143 CZ ARG A 142 1.794 33.862 -8.126 1.00 25.00 C ATOM 2144 NH1 ARG A 142 0.824 34.727 -8.269 1.00 25.00 N1+ ATOM 2145 NH2 ARG A 142 1.492 32.778 -7.462 1.00 25.00 N ATOM 0 H ARG A 142 1.714 33.766 -13.900 1.00 25.00 H new ATOM 0 HA ARG A 142 3.569 35.938 -14.102 1.00 25.00 H new ATOM 0 HB2 ARG A 142 4.528 35.641 -11.852 1.00 25.00 H new ATOM 0 HB3 ARG A 142 2.975 36.453 -11.843 1.00 25.00 H new ATOM 0 HG2 ARG A 142 1.859 34.496 -10.881 1.00 25.00 H new ATOM 0 HG3 ARG A 142 3.269 33.486 -11.135 1.00 25.00 H new ATOM 0 HD2 ARG A 142 4.584 34.943 -9.587 1.00 25.00 H new ATOM 0 HD3 ARG A 142 3.165 35.938 -9.326 1.00 25.00 H new ATOM 0 HE ARG A 142 3.691 33.316 -8.201 1.00 25.00 H new ATOM 0 HH11 ARG A 142 0.985 35.594 -8.782 1.00 25.00 H new ATOM 0 HH12 ARG A 142 -0.094 34.535 -7.868 1.00 25.00 H new ATOM 0 HH21 ARG A 142 2.198 32.056 -7.316 1.00 25.00 H new ATOM 0 HH22 ARG A 142 0.551 32.654 -7.090 1.00 25.00 H new ATOM 2159 N LEU A 143 5.363 33.817 -13.766 1.00 25.00 N ATOM 2160 CA LEU A 143 6.214 32.628 -13.645 1.00 25.00 C ATOM 2161 C LEU A 143 6.540 32.675 -12.188 1.00 25.00 C ATOM 2162 O LEU A 143 6.515 33.793 -11.563 1.00 25.00 O ATOM 2163 CB LEU A 143 7.480 32.834 -14.494 1.00 25.00 C ATOM 2164 CG LEU A 143 8.701 33.734 -14.175 1.00 25.00 C ATOM 2165 CD1 LEU A 143 9.928 33.547 -15.052 1.00 50.00 C ATOM 2166 CD2 LEU A 143 8.451 35.254 -14.223 1.00 50.00 C ATOM 0 H LEU A 143 5.891 34.685 -13.854 1.00 25.00 H new ATOM 0 HA LEU A 143 5.770 31.688 -13.973 1.00 25.00 H new ATOM 0 HB2 LEU A 143 7.892 31.835 -14.639 1.00 25.00 H new ATOM 0 HB3 LEU A 143 7.120 33.175 -15.465 1.00 25.00 H new ATOM 0 HG LEU A 143 8.879 33.381 -13.159 1.00 25.00 H new ATOM 0 HD11 LEU A 143 10.713 34.232 -14.730 1.00 50.00 H new ATOM 0 HD12 LEU A 143 10.284 32.520 -14.965 1.00 50.00 H new ATOM 0 HD13 LEU A 143 9.668 33.755 -16.090 1.00 50.00 H new ATOM 0 HD21 LEU A 143 9.374 35.782 -13.983 1.00 50.00 H new ATOM 0 HD22 LEU A 143 8.120 35.537 -15.222 1.00 50.00 H new ATOM 0 HD23 LEU A 143 7.682 35.519 -13.497 1.00 50.00 H new ATOM 2178 N GLY A 144 6.815 31.546 -11.553 1.00 25.00 N ATOM 2179 CA GLY A 144 6.955 31.542 -10.131 1.00 25.00 C ATOM 2180 C GLY A 144 6.857 30.121 -9.570 1.00 25.00 C ATOM 2181 O GLY A 144 6.470 29.150 -10.236 1.00 25.00 O ATOM 0 H GLY A 144 6.942 30.640 -12.004 1.00 25.00 H new ATOM 0 HA2 GLY A 144 7.915 31.979 -9.856 1.00 25.00 H new ATOM 0 HA3 GLY A 144 6.181 32.166 -9.685 1.00 25.00 H new ATOM 2185 N TYR A 145 7.268 29.881 -8.343 1.00 25.00 N ATOM 2186 CA TYR A 145 7.325 28.530 -7.730 1.00 25.00 C ATOM 2187 C TYR A 145 6.926 28.423 -6.284 1.00 25.00 C ATOM 2188 O TYR A 145 6.933 29.416 -5.542 1.00 25.00 O ATOM 2189 CB TYR A 145 8.750 28.039 -8.038 1.00 25.00 C ATOM 2190 CG TYR A 145 9.814 28.746 -7.258 1.00 25.00 C ATOM 2191 CD1 TYR A 145 10.627 29.668 -7.946 1.00 50.00 C ATOM 2192 CD2 TYR A 145 10.089 28.556 -5.863 1.00 50.00 C ATOM 2193 CE1 TYR A 145 11.726 30.320 -7.344 1.00 25.00 C ATOM 2194 CE2 TYR A 145 11.188 29.224 -5.278 1.00 25.00 C ATOM 2195 CZ TYR A 145 12.008 30.019 -6.050 1.00 25.00 C ATOM 2196 OH TYR A 145 13.178 30.451 -5.414 1.00 25.00 O ATOM 0 H TYR A 145 7.582 30.620 -7.714 1.00 25.00 H new ATOM 0 HA TYR A 145 6.556 27.888 -8.160 1.00 25.00 H new ATOM 0 HB2 TYR A 145 8.809 26.971 -7.830 1.00 25.00 H new ATOM 0 HB3 TYR A 145 8.947 28.168 -9.102 1.00 25.00 H new ATOM 0 HD1 TYR A 145 10.400 29.886 -8.979 1.00 50.00 H new ATOM 0 HD2 TYR A 145 9.463 27.909 -5.266 1.00 50.00 H new ATOM 0 HE1 TYR A 145 12.322 31.034 -7.894 1.00 25.00 H new ATOM 0 HE2 TYR A 145 11.386 29.111 -4.222 1.00 25.00 H new ATOM 0 HH TYR A 145 13.186 30.128 -4.489 1.00 25.00 H new ATOM 2206 N HIS A 146 6.536 27.215 -5.876 1.00 25.00 N ATOM 2207 CA HIS A 146 6.282 26.778 -4.526 1.00 25.00 C ATOM 2208 C HIS A 146 6.436 25.249 -4.687 1.00 25.00 C ATOM 2209 O HIS A 146 6.670 24.771 -5.773 1.00 25.00 O ATOM 2210 CB HIS A 146 4.878 27.277 -4.026 1.00 25.00 C ATOM 2211 CG HIS A 146 3.747 26.886 -4.929 1.00 25.00 C ATOM 2212 ND1 HIS A 146 3.114 25.622 -4.900 1.00 25.00 N ATOM 2213 CD2 HIS A 146 3.093 27.605 -5.865 1.00 25.00 C ATOM 2214 CE1 HIS A 146 2.117 25.666 -5.786 1.00 25.00 C ATOM 2215 NE2 HIS A 146 2.137 26.833 -6.412 1.00 25.00 N ATOM 0 H HIS A 146 6.380 26.463 -6.547 1.00 25.00 H new ATOM 0 HA HIS A 146 6.942 27.172 -3.753 1.00 25.00 H new ATOM 0 HB2 HIS A 146 4.692 26.875 -3.030 1.00 25.00 H new ATOM 0 HB3 HIS A 146 4.899 28.363 -3.933 1.00 25.00 H new ATOM 0 HD1 HIS A 146 3.371 24.828 -4.314 1.00 25.00 H new ATOM 0 HD2 HIS A 146 3.302 28.631 -6.131 1.00 25.00 H new ATOM 0 HE1 HIS A 146 1.405 24.874 -5.965 1.00 25.00 H new ATOM 2223 N VAL A 147 6.345 24.521 -3.595 1.00 25.00 N ATOM 2224 CA VAL A 147 6.204 23.069 -3.606 1.00 25.00 C ATOM 2225 C VAL A 147 4.728 22.637 -3.468 1.00 25.00 C ATOM 2226 O VAL A 147 3.891 23.367 -2.918 1.00 25.00 O ATOM 2227 CB VAL A 147 7.075 22.511 -2.373 1.00 25.00 C ATOM 2228 CG1 VAL A 147 7.074 20.972 -2.298 1.00 50.00 C ATOM 2229 CG2 VAL A 147 8.499 23.054 -2.308 1.00 50.00 C ATOM 0 H VAL A 147 6.367 24.921 -2.657 1.00 25.00 H new ATOM 0 HA VAL A 147 6.554 22.663 -4.555 1.00 25.00 H new ATOM 0 HB VAL A 147 6.563 22.898 -1.492 1.00 25.00 H new ATOM 0 HG11 VAL A 147 7.676 20.649 -1.449 1.00 50.00 H new ATOM 0 HG12 VAL A 147 6.052 20.614 -2.175 1.00 50.00 H new ATOM 0 HG13 VAL A 147 7.494 20.563 -3.217 1.00 50.00 H new ATOM 0 HG21 VAL A 147 9.013 22.626 -1.447 1.00 50.00 H new ATOM 0 HG22 VAL A 147 9.033 22.786 -3.220 1.00 50.00 H new ATOM 0 HG23 VAL A 147 8.470 24.139 -2.210 1.00 50.00 H new ATOM 2239 N ILE A 148 4.313 21.506 -4.100 1.00 25.00 N ATOM 2240 CA ILE A 148 3.007 20.981 -3.931 1.00 25.00 C ATOM 2241 C ILE A 148 3.165 19.694 -3.130 1.00 25.00 C ATOM 2242 O ILE A 148 4.121 18.890 -3.325 1.00 25.00 O ATOM 2243 CB ILE A 148 2.285 20.688 -5.314 1.00 25.00 C ATOM 2244 CG1 ILE A 148 2.224 21.997 -6.210 1.00 25.00 C ATOM 2245 CG2 ILE A 148 0.855 20.113 -5.065 1.00 25.00 C ATOM 2246 CD1 ILE A 148 1.757 21.806 -7.660 1.00 25.00 C ATOM 0 H ILE A 148 4.902 20.963 -4.731 1.00 25.00 H new ATOM 0 HA ILE A 148 2.378 21.708 -3.418 1.00 25.00 H new ATOM 0 HB ILE A 148 2.866 19.942 -5.857 1.00 25.00 H new ATOM 0 HG12 ILE A 148 1.558 22.712 -5.727 1.00 25.00 H new ATOM 0 HG13 ILE A 148 3.217 22.447 -6.226 1.00 25.00 H new ATOM 0 HG21 ILE A 148 0.370 19.916 -6.021 1.00 25.00 H new ATOM 0 HG22 ILE A 148 0.930 19.185 -4.498 1.00 25.00 H new ATOM 0 HG23 ILE A 148 0.265 20.836 -4.501 1.00 25.00 H new ATOM 0 HD11 ILE A 148 1.756 22.768 -8.172 1.00 25.00 H new ATOM 0 HD12 ILE A 148 2.434 21.123 -8.173 1.00 25.00 H new ATOM 0 HD13 ILE A 148 0.749 21.391 -7.666 1.00 25.00 H new ATOM 2258 N LEU A 149 2.397 19.597 -2.057 1.00 25.00 N ATOM 2259 CA LEU A 149 2.567 18.594 -1.011 1.00 25.00 C ATOM 2260 C LEU A 149 1.315 17.722 -1.038 1.00 25.00 C ATOM 2261 O LEU A 149 0.272 18.287 -1.416 1.00 25.00 O ATOM 2262 CB LEU A 149 2.548 19.333 0.315 1.00 25.00 C ATOM 2263 CG LEU A 149 3.724 20.333 0.678 1.00 25.00 C ATOM 2264 CD1 LEU A 149 3.431 21.058 1.964 1.00 50.00 C ATOM 2265 CD2 LEU A 149 4.991 19.571 0.885 1.00 50.00 C ATOM 0 H LEU A 149 1.616 20.230 -1.882 1.00 25.00 H new ATOM 0 HA LEU A 149 3.480 18.014 -1.145 1.00 25.00 H new ATOM 0 HB2 LEU A 149 1.616 19.897 0.359 1.00 25.00 H new ATOM 0 HB3 LEU A 149 2.504 18.583 1.105 1.00 25.00 H new ATOM 0 HG LEU A 149 3.818 21.042 -0.144 1.00 25.00 H new ATOM 0 HD11 LEU A 149 4.251 21.738 2.193 1.00 50.00 H new ATOM 0 HD12 LEU A 149 2.507 21.626 1.859 1.00 50.00 H new ATOM 0 HD13 LEU A 149 3.323 20.335 2.773 1.00 50.00 H new ATOM 0 HD21 LEU A 149 5.795 20.263 1.134 1.00 50.00 H new ATOM 0 HD22 LEU A 149 4.859 18.860 1.700 1.00 50.00 H new ATOM 0 HD23 LEU A 149 5.245 19.033 -0.028 1.00 50.00 H new ATOM 2277 N ALA A 150 1.337 16.471 -0.617 1.00 25.00 N ATOM 2278 CA ALA A 150 0.085 15.766 -0.497 1.00 25.00 C ATOM 2279 C ALA A 150 -0.005 14.839 0.705 1.00 25.00 C ATOM 2280 O ALA A 150 1.045 14.359 1.156 1.00 25.00 O ATOM 2281 CB ALA A 150 -0.262 14.983 -1.798 1.00 25.00 C ATOM 0 H ALA A 150 2.173 15.944 -0.363 1.00 25.00 H new ATOM 0 HA ALA A 150 -0.654 16.551 -0.336 1.00 25.00 H new ATOM 0 HB1 ALA A 150 -1.212 14.465 -1.668 1.00 25.00 H new ATOM 0 HB2 ALA A 150 -0.340 15.680 -2.632 1.00 25.00 H new ATOM 0 HB3 ALA A 150 0.523 14.255 -2.005 1.00 25.00 H new ATOM 2287 N VAL A 151 -1.211 14.581 1.201 1.00 25.00 N ATOM 2288 CA VAL A 151 -1.479 13.709 2.337 1.00 25.00 C ATOM 2289 C VAL A 151 -2.635 12.707 2.038 1.00 25.00 C ATOM 2290 O VAL A 151 -3.694 13.140 1.688 1.00 25.00 O ATOM 2291 CB VAL A 151 -1.866 14.523 3.643 1.00 25.00 C ATOM 2292 CG1 VAL A 151 -1.979 13.644 4.944 1.00 50.00 C ATOM 2293 CG2 VAL A 151 -0.784 15.671 4.020 1.00 50.00 C ATOM 0 H VAL A 151 -2.059 14.989 0.808 1.00 25.00 H new ATOM 0 HA VAL A 151 -0.550 13.166 2.509 1.00 25.00 H new ATOM 0 HB VAL A 151 -2.834 14.943 3.371 1.00 25.00 H new ATOM 0 HG11 VAL A 151 -2.247 14.278 5.789 1.00 50.00 H new ATOM 0 HG12 VAL A 151 -2.747 12.883 4.804 1.00 50.00 H new ATOM 0 HG13 VAL A 151 -1.022 13.161 5.141 1.00 50.00 H new ATOM 0 HG21 VAL A 151 -1.105 16.192 4.922 1.00 50.00 H new ATOM 0 HG22 VAL A 151 0.189 15.211 4.194 1.00 50.00 H new ATOM 0 HG23 VAL A 151 -0.707 16.383 3.198 1.00 50.00 H new ATOM 2303 N TRP A 152 -2.508 11.430 2.380 1.00 25.00 N ATOM 2304 CA TRP A 152 -3.522 10.420 2.375 1.00 25.00 C ATOM 2305 C TRP A 152 -3.729 9.974 3.831 1.00 25.00 C ATOM 2306 O TRP A 152 -2.765 9.706 4.625 1.00 25.00 O ATOM 2307 CB TRP A 152 -3.172 9.171 1.502 1.00 25.00 C ATOM 2308 CG TRP A 152 -3.699 9.300 0.158 1.00 25.00 C ATOM 2309 CD1 TRP A 152 -4.784 8.596 -0.320 1.00 25.00 C ATOM 2310 CD2 TRP A 152 -3.188 10.053 -0.958 1.00 25.00 C ATOM 2311 NE1 TRP A 152 -4.976 8.885 -1.640 1.00 25.00 N ATOM 2312 CE2 TRP A 152 -4.054 9.790 -2.077 1.00 25.00 C ATOM 2313 CE3 TRP A 152 -2.066 10.932 -1.164 1.00 25.00 C ATOM 2314 CZ2 TRP A 152 -3.876 10.390 -3.352 1.00 25.00 C ATOM 2315 CZ3 TRP A 152 -1.878 11.533 -2.420 1.00 25.00 C ATOM 2316 CH2 TRP A 152 -2.806 11.256 -3.515 1.00 25.00 C ATOM 0 H TRP A 152 -1.611 11.059 2.692 1.00 25.00 H new ATOM 0 HA TRP A 152 -4.420 10.852 1.933 1.00 25.00 H new ATOM 0 HB2 TRP A 152 -2.090 9.047 1.460 1.00 25.00 H new ATOM 0 HB3 TRP A 152 -3.578 8.274 1.969 1.00 25.00 H new ATOM 0 HD1 TRP A 152 -5.390 7.918 0.262 1.00 25.00 H new ATOM 0 HE1 TRP A 152 -5.710 8.479 -2.221 1.00 25.00 H new ATOM 0 HE3 TRP A 152 -1.374 11.128 -0.358 1.00 25.00 H new ATOM 0 HZ2 TRP A 152 -4.552 10.179 -4.167 1.00 25.00 H new ATOM 0 HZ3 TRP A 152 -1.045 12.202 -2.577 1.00 25.00 H new ATOM 0 HH2 TRP A 152 -2.655 11.736 -4.471 1.00 25.00 H new ATOM 2327 N ASP A 153 -5.011 9.803 4.182 1.00 25.00 N ATOM 2328 CA ASP A 153 -5.491 9.319 5.486 1.00 25.00 C ATOM 2329 C ASP A 153 -6.222 8.023 5.132 1.00 25.00 C ATOM 2330 O ASP A 153 -6.880 7.896 4.109 1.00 25.00 O ATOM 2331 CB ASP A 153 -6.329 10.295 6.169 1.00 25.00 C ATOM 2332 CG ASP A 153 -5.469 11.300 6.902 1.00 25.00 C ATOM 2333 OD1 ASP A 153 -4.542 10.956 7.677 1.00 25.00 O ATOM 2334 OD2 ASP A 153 -5.745 12.493 6.765 1.00 25.00 O1- ATOM 0 H ASP A 153 -5.775 10.007 3.538 1.00 25.00 H new ATOM 0 HA ASP A 153 -4.687 9.151 6.203 1.00 25.00 H new ATOM 0 HB2 ASP A 153 -6.965 10.808 5.447 1.00 25.00 H new ATOM 0 HB3 ASP A 153 -6.990 9.789 6.873 1.00 25.00 H new ATOM 2339 N VAL A 154 -6.097 7.085 6.056 1.00 25.00 N ATOM 2340 CA VAL A 154 -6.664 5.738 5.824 1.00 25.00 C ATOM 2341 C VAL A 154 -7.160 5.271 7.170 1.00 25.00 C ATOM 2342 O VAL A 154 -6.402 5.066 8.074 1.00 25.00 O ATOM 2343 CB VAL A 154 -5.539 4.778 5.342 1.00 25.00 C ATOM 2344 CG1 VAL A 154 -6.014 3.343 5.230 1.00 50.00 C ATOM 2345 CG2 VAL A 154 -4.919 5.261 4.086 1.00 50.00 C ATOM 0 H VAL A 154 -5.626 7.209 6.952 1.00 25.00 H new ATOM 0 HA VAL A 154 -7.454 5.755 5.073 1.00 25.00 H new ATOM 0 HB VAL A 154 -4.764 4.782 6.109 1.00 25.00 H new ATOM 0 HG11 VAL A 154 -5.192 2.713 4.890 1.00 50.00 H new ATOM 0 HG12 VAL A 154 -6.358 2.996 6.205 1.00 50.00 H new ATOM 0 HG13 VAL A 154 -6.834 3.286 4.515 1.00 50.00 H new ATOM 0 HG21 VAL A 154 -4.137 4.568 3.776 1.00 50.00 H new ATOM 0 HG22 VAL A 154 -5.678 5.324 3.306 1.00 50.00 H new ATOM 0 HG23 VAL A 154 -4.485 6.247 4.250 1.00 50.00 H new ATOM 2355 N ALA A 155 -8.484 5.123 7.321 1.00 25.00 N ATOM 2356 CA ALA A 155 -9.090 4.948 8.617 1.00 25.00 C ATOM 2357 C ALA A 155 -8.827 3.600 9.282 1.00 25.00 C ATOM 2358 O ALA A 155 -9.066 3.451 10.512 1.00 25.00 O ATOM 2359 CB ALA A 155 -10.563 5.194 8.477 1.00 25.00 C ATOM 0 H ALA A 155 -9.147 5.123 6.545 1.00 25.00 H new ATOM 0 HA ALA A 155 -8.621 5.668 9.288 1.00 25.00 H new ATOM 0 HB1 ALA A 155 -11.047 5.068 9.446 1.00 25.00 H new ATOM 0 HB2 ALA A 155 -10.730 6.210 8.118 1.00 25.00 H new ATOM 0 HB3 ALA A 155 -10.985 4.484 7.766 1.00 25.00 H new ATOM 2365 N ASP A 156 -8.334 2.675 8.452 1.00 25.00 N ATOM 2366 CA ASP A 156 -7.967 1.306 8.890 1.00 25.00 C ATOM 2367 C ASP A 156 -6.729 1.322 9.736 1.00 25.00 C ATOM 2368 O ASP A 156 -6.383 0.364 10.401 1.00 25.00 O ATOM 2369 CB ASP A 156 -7.847 0.374 7.687 1.00 25.00 C ATOM 2370 CG ASP A 156 -9.180 0.102 7.056 1.00 25.00 C ATOM 2371 OD1 ASP A 156 -9.576 0.783 6.054 1.00 25.00 O ATOM 2372 OD2 ASP A 156 -9.938 -0.695 7.651 1.00 25.00 O1- ATOM 0 H ASP A 156 -8.175 2.844 7.459 1.00 25.00 H new ATOM 0 HA ASP A 156 -8.765 0.914 9.521 1.00 25.00 H new ATOM 0 HB2 ASP A 156 -7.180 0.818 6.949 1.00 25.00 H new ATOM 0 HB3 ASP A 156 -7.395 -0.567 8.000 1.00 25.00 H new ATOM 2377 N THR A 157 -5.959 2.377 9.483 1.00 25.00 N ATOM 2378 CA THR A 157 -4.552 2.421 10.014 1.00 25.00 C ATOM 2379 C THR A 157 -4.327 3.640 10.957 1.00 25.00 C ATOM 2380 O THR A 157 -5.144 4.562 11.027 1.00 25.00 O ATOM 2381 CB THR A 157 -3.533 2.484 8.791 1.00 25.00 C ATOM 2382 OG1 THR A 157 -3.741 3.715 8.096 1.00 25.00 O ATOM 2383 CG2 THR A 157 -3.737 1.406 7.769 1.00 25.00 C ATOM 0 H THR A 157 -6.246 3.192 8.940 1.00 25.00 H new ATOM 0 HA THR A 157 -4.380 1.518 10.600 1.00 25.00 H new ATOM 0 HB THR A 157 -2.539 2.373 9.223 1.00 25.00 H new ATOM 0 HG1 THR A 157 -4.669 4.006 8.217 1.00 25.00 H new ATOM 0 HG21 THR A 157 -3.004 1.519 6.970 1.00 25.00 H new ATOM 0 HG22 THR A 157 -3.614 0.431 8.239 1.00 25.00 H new ATOM 0 HG23 THR A 157 -4.742 1.484 7.354 1.00 25.00 H new ATOM 2391 N GLU A 158 -3.235 3.582 11.686 1.00 25.00 N ATOM 2392 CA GLU A 158 -2.810 4.573 12.652 1.00 25.00 C ATOM 2393 C GLU A 158 -1.707 5.450 11.968 1.00 25.00 C ATOM 2394 O GLU A 158 -1.331 6.512 12.399 1.00 25.00 O ATOM 2395 CB GLU A 158 -2.163 3.884 13.814 1.00 25.00 C ATOM 2396 CG GLU A 158 -3.046 3.132 14.823 1.00 25.00 C ATOM 2397 CD GLU A 158 -4.092 4.038 15.571 1.00 25.00 C ATOM 2398 OE1 GLU A 158 -3.735 5.151 16.004 1.00 25.00 O ATOM 2399 OE2 GLU A 158 -5.258 3.634 15.800 1.00 25.00 O1- ATOM 0 H GLU A 158 -2.584 2.800 11.618 1.00 25.00 H new ATOM 0 HA GLU A 158 -3.663 5.165 12.984 1.00 25.00 H new ATOM 0 HB2 GLU A 158 -1.442 3.172 13.414 1.00 25.00 H new ATOM 0 HB3 GLU A 158 -1.597 4.634 14.367 1.00 25.00 H new ATOM 0 HG2 GLU A 158 -3.579 2.338 14.300 1.00 25.00 H new ATOM 0 HG3 GLU A 158 -2.405 2.652 15.562 1.00 25.00 H new ATOM 2406 N ASN A 159 -1.299 4.960 10.805 1.00 25.00 N ATOM 2407 CA ASN A 159 -0.373 5.601 9.887 1.00 25.00 C ATOM 2408 C ASN A 159 -1.024 6.689 9.060 1.00 25.00 C ATOM 2409 O ASN A 159 -2.258 6.672 8.860 1.00 25.00 O ATOM 2410 CB ASN A 159 0.367 4.632 8.950 1.00 25.00 C ATOM 2411 CG ASN A 159 1.517 3.861 9.661 1.00 25.00 C ATOM 2412 OD1 ASN A 159 1.256 2.919 10.372 1.00 25.00 O ATOM 2413 ND2 ASN A 159 2.710 4.205 9.422 1.00 25.00 N ATOM 0 H ASN A 159 -1.624 4.057 10.460 1.00 25.00 H new ATOM 0 HA ASN A 159 0.369 6.047 10.550 1.00 25.00 H new ATOM 0 HB2 ASN A 159 -0.345 3.915 8.541 1.00 25.00 H new ATOM 0 HB3 ASN A 159 0.777 5.190 8.108 1.00 25.00 H new ATOM 0 HD21 ASN A 159 3.484 3.683 9.833 1.00 25.00 H new ATOM 0 HD22 ASN A 159 2.899 5.005 8.818 1.00 25.00 H new ATOM 2420 N ALA A 160 -0.289 7.633 8.486 1.00 25.00 N ATOM 2421 CA ALA A 160 -0.814 8.659 7.589 1.00 25.00 C ATOM 2422 C ALA A 160 0.336 8.670 6.539 1.00 25.00 C ATOM 2423 O ALA A 160 1.484 8.305 6.872 1.00 25.00 O ATOM 2424 CB ALA A 160 -0.908 9.987 8.300 1.00 25.00 C ATOM 0 H ALA A 160 0.717 7.710 8.635 1.00 25.00 H new ATOM 0 HA ALA A 160 -1.814 8.481 7.192 1.00 25.00 H new ATOM 0 HB1 ALA A 160 -1.301 10.739 7.616 1.00 25.00 H new ATOM 0 HB2 ALA A 160 -1.573 9.894 9.158 1.00 25.00 H new ATOM 0 HB3 ALA A 160 0.083 10.289 8.640 1.00 25.00 H new ATOM 2430 N PHE A 161 0.014 8.954 5.292 1.00 25.00 N ATOM 2431 CA PHE A 161 0.897 8.719 4.140 1.00 25.00 C ATOM 2432 C PHE A 161 1.012 10.051 3.372 1.00 25.00 C ATOM 2433 O PHE A 161 0.027 10.768 3.283 1.00 25.00 O ATOM 2434 CB PHE A 161 0.215 7.665 3.255 1.00 25.00 C ATOM 2435 CG PHE A 161 -0.112 6.393 3.984 1.00 25.00 C ATOM 2436 CD1 PHE A 161 -1.222 6.266 4.781 1.00 50.00 C ATOM 2437 CD2 PHE A 161 0.826 5.368 3.916 1.00 50.00 C ATOM 2438 CE1 PHE A 161 -1.398 5.048 5.559 1.00 25.00 C ATOM 2439 CE2 PHE A 161 0.643 4.152 4.649 1.00 25.00 C ATOM 2440 CZ PHE A 161 -0.446 4.022 5.481 1.00 25.00 C ATOM 0 H PHE A 161 -0.884 9.363 5.034 1.00 25.00 H new ATOM 0 HA PHE A 161 1.888 8.374 4.437 1.00 25.00 H new ATOM 0 HB2 PHE A 161 -0.703 8.086 2.844 1.00 25.00 H new ATOM 0 HB3 PHE A 161 0.865 7.434 2.411 1.00 25.00 H new ATOM 0 HD1 PHE A 161 -1.954 7.058 4.830 1.00 50.00 H new ATOM 0 HD2 PHE A 161 1.705 5.491 3.301 1.00 50.00 H new ATOM 0 HE1 PHE A 161 -2.262 4.935 6.197 1.00 25.00 H new ATOM 0 HE2 PHE A 161 1.353 3.344 4.550 1.00 25.00 H new ATOM 0 HZ PHE A 161 -0.567 3.128 6.075 1.00 25.00 H new ATOM 2450 N TYR A 162 2.249 10.330 2.915 1.00 25.00 N ATOM 2451 CA TYR A 162 2.556 11.689 2.434 1.00 25.00 C ATOM 2452 C TYR A 162 3.432 11.627 1.199 1.00 25.00 C ATOM 2453 O TYR A 162 4.060 10.637 0.929 1.00 25.00 O ATOM 2454 CB TYR A 162 3.396 12.424 3.418 1.00 25.00 C ATOM 2455 CG TYR A 162 2.819 12.668 4.751 1.00 25.00 C ATOM 2456 CD1 TYR A 162 2.848 11.643 5.687 1.00 50.00 C ATOM 2457 CD2 TYR A 162 2.317 13.926 5.137 1.00 50.00 C ATOM 2458 CE1 TYR A 162 2.220 11.712 6.897 1.00 25.00 C ATOM 2459 CE2 TYR A 162 1.631 14.044 6.399 1.00 25.00 C ATOM 2460 CZ TYR A 162 1.591 12.952 7.277 1.00 25.00 C ATOM 2461 OH TYR A 162 0.974 13.002 8.460 1.00 25.00 O ATOM 0 H TYR A 162 3.021 9.664 2.869 1.00 25.00 H new ATOM 0 HA TYR A 162 1.595 12.171 2.256 1.00 25.00 H new ATOM 0 HB2 TYR A 162 4.325 11.869 3.549 1.00 25.00 H new ATOM 0 HB3 TYR A 162 3.659 13.388 2.983 1.00 25.00 H new ATOM 0 HD1 TYR A 162 3.396 10.744 5.445 1.00 50.00 H new ATOM 0 HD2 TYR A 162 2.444 14.788 4.498 1.00 50.00 H new ATOM 0 HE1 TYR A 162 2.195 10.856 7.555 1.00 25.00 H new ATOM 0 HE2 TYR A 162 1.149 14.972 6.668 1.00 25.00 H new ATOM 0 HH TYR A 162 0.593 13.895 8.593 1.00 25.00 H new ATOM 2471 N GLN A 163 3.454 12.692 0.418 1.00 25.00 N ATOM 2472 CA GLN A 163 4.441 12.941 -0.661 1.00 25.00 C ATOM 2473 C GLN A 163 4.716 14.412 -0.840 1.00 25.00 C ATOM 2474 O GLN A 163 3.949 15.281 -0.442 1.00 25.00 O ATOM 2475 CB GLN A 163 4.032 12.275 -2.003 1.00 25.00 C ATOM 2476 CG GLN A 163 2.777 13.011 -2.531 1.00 25.00 C ATOM 2477 CD GLN A 163 2.324 12.528 -3.897 1.00 25.00 C ATOM 2478 OE1 GLN A 163 2.148 11.363 -4.124 1.00 25.00 O ATOM 2479 NE2 GLN A 163 2.066 13.457 -4.793 1.00 25.00 N ATOM 0 H GLN A 163 2.770 13.443 0.506 1.00 25.00 H new ATOM 0 HA GLN A 163 5.370 12.469 -0.343 1.00 25.00 H new ATOM 0 HB2 GLN A 163 4.846 12.340 -2.726 1.00 25.00 H new ATOM 0 HB3 GLN A 163 3.820 11.216 -1.855 1.00 25.00 H new ATOM 0 HG2 GLN A 163 1.962 12.880 -1.819 1.00 25.00 H new ATOM 0 HG3 GLN A 163 2.987 14.079 -2.583 1.00 25.00 H new ATOM 0 HE21 GLN A 163 2.226 14.439 -4.570 1.00 25.00 H new ATOM 0 HE22 GLN A 163 1.706 13.195 -5.711 1.00 25.00 H new ATOM 2488 N VAL A 164 5.820 14.682 -1.490 1.00 25.00 N ATOM 2489 CA VAL A 164 6.213 16.067 -1.786 1.00 25.00 C ATOM 2490 C VAL A 164 6.689 16.077 -3.279 1.00 25.00 C ATOM 2491 O VAL A 164 7.520 15.329 -3.619 1.00 25.00 O ATOM 2492 CB VAL A 164 7.361 16.493 -0.752 1.00 25.00 C ATOM 2493 CG1 VAL A 164 8.469 15.424 -0.661 1.00 75.00 C ATOM 2494 CG2 VAL A 164 7.989 17.865 -0.923 1.00 75.00 C ATOM 0 H VAL A 164 6.471 13.974 -1.830 1.00 25.00 H new ATOM 0 HA VAL A 164 5.403 16.788 -1.672 1.00 25.00 H new ATOM 0 HB VAL A 164 6.805 16.567 0.183 1.00 25.00 H new ATOM 0 HG11 VAL A 164 9.230 15.748 0.049 1.00 75.00 H new ATOM 0 HG12 VAL A 164 8.038 14.481 -0.326 1.00 75.00 H new ATOM 0 HG13 VAL A 164 8.924 15.287 -1.642 1.00 75.00 H new ATOM 0 HG21 VAL A 164 8.748 18.016 -0.155 1.00 75.00 H new ATOM 0 HG22 VAL A 164 8.451 17.934 -1.908 1.00 75.00 H new ATOM 0 HG23 VAL A 164 7.220 18.632 -0.829 1.00 75.00 H new ATOM 2504 N ILE A 165 6.166 17.038 -4.080 1.00 25.00 N ATOM 2505 CA ILE A 165 6.631 17.218 -5.465 1.00 25.00 C ATOM 2506 C ILE A 165 7.015 18.675 -5.611 1.00 25.00 C ATOM 2507 O ILE A 165 6.171 19.522 -5.358 1.00 25.00 O ATOM 2508 CB ILE A 165 5.575 16.824 -6.542 1.00 25.00 C ATOM 2509 CG1 ILE A 165 5.209 15.356 -6.337 1.00 25.00 C ATOM 2510 CG2 ILE A 165 6.210 17.041 -7.988 1.00 25.00 C ATOM 2511 CD1 ILE A 165 4.174 14.664 -7.187 1.00 25.00 C ATOM 0 H ILE A 165 5.434 17.687 -3.791 1.00 25.00 H new ATOM 0 HA ILE A 165 7.473 16.549 -5.640 1.00 25.00 H new ATOM 0 HB ILE A 165 4.679 17.438 -6.454 1.00 25.00 H new ATOM 0 HG12 ILE A 165 6.132 14.785 -6.439 1.00 25.00 H new ATOM 0 HG13 ILE A 165 4.884 15.255 -5.302 1.00 25.00 H new ATOM 0 HG21 ILE A 165 5.480 16.769 -8.750 1.00 25.00 H new ATOM 0 HG22 ILE A 165 6.488 18.088 -8.110 1.00 25.00 H new ATOM 0 HG23 ILE A 165 7.096 16.415 -8.094 1.00 25.00 H new ATOM 0 HD11 ILE A 165 4.075 13.627 -6.867 1.00 25.00 H new ATOM 0 HD12 ILE A 165 3.215 15.171 -7.077 1.00 25.00 H new ATOM 0 HD13 ILE A 165 4.483 14.693 -8.232 1.00 25.00 H new ATOM 2523 N ASP A 166 8.262 18.942 -5.955 1.00 25.00 N ATOM 2524 CA ASP A 166 8.703 20.319 -6.093 1.00 25.00 C ATOM 2525 C ASP A 166 8.479 20.736 -7.584 1.00 25.00 C ATOM 2526 O ASP A 166 8.472 19.867 -8.437 1.00 25.00 O ATOM 2527 CB ASP A 166 10.184 20.470 -5.709 1.00 25.00 C ATOM 2528 CG ASP A 166 10.669 21.909 -5.495 1.00 25.00 C ATOM 2529 OD1 ASP A 166 11.844 22.204 -5.188 1.00 25.00 O ATOM 2530 OD2 ASP A 166 9.793 22.750 -5.737 1.00 25.00 O1- ATOM 0 H ASP A 166 8.976 18.238 -6.141 1.00 25.00 H new ATOM 0 HA ASP A 166 8.133 20.962 -5.422 1.00 25.00 H new ATOM 0 HB2 ASP A 166 10.363 19.905 -4.794 1.00 25.00 H new ATOM 0 HB3 ASP A 166 10.792 20.013 -6.490 1.00 25.00 H new ATOM 2535 N VAL A 167 8.122 22.014 -7.852 1.00 25.00 N ATOM 2536 CA VAL A 167 7.668 22.556 -9.135 1.00 25.00 C ATOM 2537 C VAL A 167 8.183 23.952 -9.399 1.00 25.00 C ATOM 2538 O VAL A 167 8.711 24.620 -8.501 1.00 25.00 O ATOM 2539 CB VAL A 167 6.057 22.582 -9.255 1.00 25.00 C ATOM 2540 CG1 VAL A 167 5.482 21.189 -9.229 1.00 50.00 C ATOM 2541 CG2 VAL A 167 5.339 23.408 -8.219 1.00 50.00 C ATOM 0 H VAL A 167 8.148 22.731 -7.127 1.00 25.00 H new ATOM 0 HA VAL A 167 8.081 21.877 -9.882 1.00 25.00 H new ATOM 0 HB VAL A 167 5.885 23.066 -10.216 1.00 25.00 H new ATOM 0 HG11 VAL A 167 4.396 21.242 -9.312 1.00 50.00 H new ATOM 0 HG12 VAL A 167 5.882 20.615 -10.065 1.00 50.00 H new ATOM 0 HG13 VAL A 167 5.751 20.702 -8.292 1.00 50.00 H new ATOM 0 HG21 VAL A 167 4.264 23.355 -8.393 1.00 50.00 H new ATOM 0 HG22 VAL A 167 5.565 23.022 -7.225 1.00 50.00 H new ATOM 0 HG23 VAL A 167 5.667 24.445 -8.289 1.00 50.00 H new ATOM 2551 N ASP A 168 8.078 24.315 -10.668 1.00 25.00 N ATOM 2552 CA ASP A 168 8.369 25.647 -11.246 1.00 25.00 C ATOM 2553 C ASP A 168 7.315 25.995 -12.292 1.00 25.00 C ATOM 2554 O ASP A 168 7.256 25.313 -13.285 1.00 25.00 O ATOM 2555 CB ASP A 168 9.718 25.722 -11.950 1.00 25.00 C ATOM 2556 CG ASP A 168 10.124 27.173 -12.353 1.00 25.00 C ATOM 2557 OD1 ASP A 168 11.166 27.293 -13.061 1.00 25.00 O ATOM 2558 OD2 ASP A 168 9.569 28.161 -11.882 1.00 25.00 O1- ATOM 0 H ASP A 168 7.768 23.654 -11.380 1.00 25.00 H new ATOM 0 HA ASP A 168 8.371 26.339 -10.404 1.00 25.00 H new ATOM 0 HB2 ASP A 168 10.485 25.306 -11.296 1.00 25.00 H new ATOM 0 HB3 ASP A 168 9.689 25.099 -12.844 1.00 25.00 H new ATOM 2563 N LEU A 169 6.405 26.942 -12.036 1.00 25.00 N ATOM 2564 CA LEU A 169 5.140 27.060 -12.807 1.00 25.00 C ATOM 2565 C LEU A 169 5.323 28.366 -13.559 1.00 25.00 C ATOM 2566 O LEU A 169 5.484 29.448 -12.965 1.00 25.00 O ATOM 2567 CB LEU A 169 3.849 27.054 -11.940 1.00 25.00 C ATOM 2568 CG LEU A 169 3.743 25.785 -11.061 1.00 25.00 C ATOM 2569 CD1 LEU A 169 2.676 25.986 -9.990 1.00 50.00 C ATOM 2570 CD2 LEU A 169 3.491 24.465 -11.801 1.00 50.00 C ATOM 0 H LEU A 169 6.512 27.643 -11.303 1.00 25.00 H new ATOM 0 HA LEU A 169 4.983 26.196 -13.453 1.00 25.00 H new ATOM 0 HB2 LEU A 169 3.837 27.938 -11.302 1.00 25.00 H new ATOM 0 HB3 LEU A 169 2.976 27.118 -12.590 1.00 25.00 H new ATOM 0 HG LEU A 169 4.736 25.671 -10.626 1.00 25.00 H new ATOM 0 HD11 LEU A 169 2.605 25.090 -9.374 1.00 50.00 H new ATOM 0 HD12 LEU A 169 2.945 26.837 -9.364 1.00 50.00 H new ATOM 0 HD13 LEU A 169 1.714 26.176 -10.466 1.00 50.00 H new ATOM 0 HD21 LEU A 169 3.436 23.649 -11.081 1.00 50.00 H new ATOM 0 HD22 LEU A 169 2.551 24.529 -12.349 1.00 50.00 H new ATOM 0 HD23 LEU A 169 4.307 24.278 -12.500 1.00 50.00 H new ATOM 2582 N VAL A 170 5.357 28.260 -14.862 1.00 25.00 N ATOM 2583 CA VAL A 170 6.012 29.298 -15.639 1.00 25.00 C ATOM 2584 C VAL A 170 5.117 29.894 -16.703 1.00 25.00 C ATOM 2585 O VAL A 170 4.087 29.305 -17.025 1.00 25.00 O ATOM 2586 CB VAL A 170 7.357 28.774 -16.207 1.00 25.00 C ATOM 2587 CG1 VAL A 170 8.316 28.328 -15.124 1.00 50.00 C ATOM 2588 CG2 VAL A 170 7.218 27.611 -17.220 1.00 50.00 C ATOM 0 H VAL A 170 4.954 27.493 -15.401 1.00 25.00 H new ATOM 0 HA VAL A 170 6.233 30.127 -14.966 1.00 25.00 H new ATOM 0 HB VAL A 170 7.754 29.643 -16.732 1.00 25.00 H new ATOM 0 HG11 VAL A 170 9.240 27.971 -15.580 1.00 50.00 H new ATOM 0 HG12 VAL A 170 8.537 29.168 -14.465 1.00 50.00 H new ATOM 0 HG13 VAL A 170 7.863 27.523 -14.546 1.00 50.00 H new ATOM 0 HG21 VAL A 170 8.207 27.309 -17.565 1.00 50.00 H new ATOM 0 HG22 VAL A 170 6.727 26.765 -16.738 1.00 50.00 H new ATOM 0 HG23 VAL A 170 6.622 27.939 -18.071 1.00 50.00 H new ATOM 2598 N ASN A 171 5.556 30.994 -17.267 1.00 25.00 N ATOM 2599 CA ASN A 171 4.915 31.489 -18.483 1.00 25.00 C ATOM 2600 C ASN A 171 5.406 30.665 -19.645 1.00 25.00 C ATOM 2601 O ASN A 171 6.502 30.039 -19.614 1.00 25.00 O ATOM 2602 CB ASN A 171 5.338 32.944 -18.743 1.00 25.00 C ATOM 2603 CG ASN A 171 4.761 33.929 -17.747 1.00 25.00 C ATOM 2604 OD1 ASN A 171 3.608 33.955 -17.388 1.00 25.00 O ATOM 2605 ND2 ASN A 171 5.572 34.847 -17.345 1.00 25.00 N ATOM 0 H ASN A 171 6.333 31.558 -16.922 1.00 25.00 H new ATOM 0 HA ASN A 171 3.833 31.426 -18.371 1.00 25.00 H new ATOM 0 HB2 ASN A 171 6.426 33.008 -18.716 1.00 25.00 H new ATOM 0 HB3 ASN A 171 5.026 33.231 -19.747 1.00 25.00 H new ATOM 0 HD21 ASN A 171 5.238 35.588 -16.728 1.00 25.00 H new ATOM 0 HD22 ASN A 171 6.547 34.832 -17.643 1.00 25.00 H new ATOM 2612 N LYS A 172 4.555 30.636 -20.683 1.00 25.00 N ATOM 2613 CA LYS A 172 4.886 29.828 -21.843 1.00 25.00 C ATOM 2614 C LYS A 172 5.956 30.594 -22.626 1.00 25.00 C ATOM 2615 O LYS A 172 6.065 31.820 -22.413 1.00 25.00 O ATOM 2616 CB LYS A 172 3.652 29.445 -22.730 1.00 25.00 C ATOM 2617 CG LYS A 172 3.032 30.678 -23.403 1.00 25.00 C ATOM 2618 CD LYS A 172 1.776 30.226 -24.131 1.00 25.00 C ATOM 2619 CE LYS A 172 1.263 31.436 -24.935 1.00 25.00 C ATOM 2620 NZ LYS A 172 0.982 32.610 -24.105 1.00 25.00 N1+ ATOM 2621 OXT LYS A 172 6.771 29.961 -23.359 1.00 25.00 O1- ATOM 0 H LYS A 172 3.672 31.143 -20.735 1.00 25.00 H new ATOM 0 HA LYS A 172 5.263 28.861 -21.511 1.00 25.00 H new ATOM 0 HB2 LYS A 172 3.960 28.730 -23.493 1.00 25.00 H new ATOM 0 HB3 LYS A 172 2.901 28.950 -22.114 1.00 25.00 H new ATOM 0 HG2 LYS A 172 2.791 31.438 -22.660 1.00 25.00 H new ATOM 0 HG3 LYS A 172 3.738 31.128 -24.101 1.00 25.00 H new ATOM 0 HD2 LYS A 172 1.994 29.388 -24.793 1.00 25.00 H new ATOM 0 HD3 LYS A 172 1.021 29.885 -23.423 1.00 25.00 H new ATOM 0 HE2 LYS A 172 2.004 31.702 -25.689 1.00 25.00 H new ATOM 0 HE3 LYS A 172 0.355 31.151 -25.467 1.00 25.00 H new ATOM 0 HZ1 LYS A 172 0.441 33.305 -24.658 1.00 25.00 H new ATOM 0 HZ2 LYS A 172 0.428 32.322 -23.273 1.00 25.00 H new ATOM 0 HZ3 LYS A 172 1.878 33.038 -23.794 1.00 25.00 H new TER 2635 LYS A 172 HETATM 2636 CU CU1 A 173 0.114 1.163 -1.509 1.00 0.00 CU