USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1212 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 5 LYS NZ :NH3+ -98:sc= 0.0464 (180deg=0) USER MOD Set 1.2: A 121 HIS : no HD1:sc= -2.24! C(o=-2.2!,f=-2.5!) USER MOD Set 2.1: A 91 TYR OH : rot -66:sc= -1.95 USER MOD Set 2.2: A 93 TYR OH : rot 28:sc= 1.11 USER MOD Set 2.3: A 98 MET CE :methyl 161:sc= -0.77 (180deg=-1.06) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0.0281 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0272 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 HIS : no HE2:sc= -0.161 X(o=-0.16,f=-0.48) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -169:sc= -0.0244 (180deg=-0.18) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.099 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -129:sc= -1.83 (180deg=-5.32!) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 168:sc= -0.0177 (180deg=-0.173) USER MOD Single : A 30 GLN : amide:sc= -0.0138 K(o=-0.014,f=-0.82) USER MOD Single : A 32 MET CE :methyl -114:sc=-0.00592 (180deg=-1.96) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -84:sc= -0.225 USER MOD Single : A 44 THR OG1 : rot 75:sc= 0.0613 USER MOD Single : A 45 LYS NZ :NH3+ 149:sc= -0.851 (180deg=-2.36!) USER MOD Single : A 46 HIS : no HD1:sc=-0.00326 X(o=-0.0033,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0176) USER MOD Single : A 53 LYS NZ :NH3+ -129:sc= 0 (180deg=-0.373) USER MOD Single : A 54 TYR OH : rot -170:sc= 1.22 USER MOD Single : A 59 SER OG : rot 127:sc= 0.899 USER MOD Single : A 62 THR OG1 : rot -40:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -166:sc= -0.0116 (180deg=-0.171) USER MOD Single : A 65 MET CE :methyl 180:sc= -4.41! (180deg=-4.41!) USER MOD Single : A 68 ASN : amide:sc= -1.7 K(o=-1.7,f=-0.51) USER MOD Single : A 70 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0297) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ -164:sc= 0.48 (180deg=0.345) USER MOD Single : A 80 GLN : amide:sc= -1.84! K(o=-1.8!,f=-0.11) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ -167:sc= -0.026 (180deg=-0.196) USER MOD Single : A 100 ASN : amide:sc= 0.238 K(o=0.24,f=-6.7!) USER MOD Single : A 106 GLN : amide:sc= -0.243 K(o=-0.24,f=-0.75) USER MOD Single : A 110 LYS NZ :NH3+ -173:sc= 1.32 (180deg=1.21) USER MOD Single : A 113 TYR OH : rot 150:sc= -2.63! USER MOD Single : A 115 TYR OH : rot 90:sc= -2.11! USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -12.4! C(o=-12!,f=-21!) USER MOD Single : A 119 ASN : amide:sc= -0.0238 X(o=-0.024,f=0) USER MOD Single : A 120 THR OG1 : rot 94:sc= 0.738 USER MOD Single : A 123 GLN : amide:sc= -2.31! K(o=-2.3!,f=-0.18) USER MOD Single : A 127 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.038) USER MOD Single : A 131 GLN : amide:sc= -1.17 K(o=-1.2,f=-0.47) USER MOD Single : A 133 LYS NZ :NH3+ 150:sc= 1.72 (180deg=1.24) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 158:sc= -1.18! (180deg=-2.41!) USER MOD Single : A 138 ASN : amide:sc= 0.59 K(o=0.59,f=-1.2!) USER MOD Single : A 141 SER OG : rot 180:sc= -0.211 USER MOD Single : A 144 ASN : amide:sc= -0.443 K(o=-0.44,f=-11!) USER MOD Single : A 147 SER OG : rot -28:sc= 0.501 USER MOD Single : A 149 GLN : amide:sc= -1.06 X(o=-1.1,f=-0.77) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -15.664 19.415 -2.947 1.00 0.00 N ATOM 2 CA ALA A 1 -15.181 18.574 -1.860 1.00 0.00 C ATOM 3 C ALA A 1 -15.644 19.132 -0.530 1.00 0.00 C ATOM 4 O ALA A 1 -15.383 20.304 -0.212 1.00 0.00 O ATOM 5 CB ALA A 1 -13.664 18.478 -1.896 1.00 0.00 C ATOM 0 H1 ALA A 1 -15.342 19.026 -3.856 1.00 0.00 H new ATOM 0 H2 ALA A 1 -16.704 19.441 -2.930 1.00 0.00 H new ATOM 0 H3 ALA A 1 -15.291 20.379 -2.832 1.00 0.00 H new ATOM 0 HA ALA A 1 -15.591 17.571 -1.983 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -13.320 17.846 -1.077 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -13.349 18.045 -2.846 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -13.234 19.474 -1.791 1.00 0.00 H new ATOM 13 N THR A 2 -16.351 18.322 0.241 1.00 0.00 N ATOM 14 CA THR A 2 -16.815 18.714 1.559 1.00 0.00 C ATOM 15 C THR A 2 -15.610 18.894 2.461 1.00 0.00 C ATOM 16 O THR A 2 -15.500 19.845 3.227 1.00 0.00 O ATOM 17 CB THR A 2 -17.764 17.641 2.125 1.00 0.00 C ATOM 18 OG1 THR A 2 -17.192 16.332 1.893 1.00 0.00 O ATOM 19 CG2 THR A 2 -19.130 17.725 1.457 1.00 0.00 C ATOM 0 H THR A 2 -16.618 17.376 -0.030 1.00 0.00 H new ATOM 0 HA THR A 2 -17.367 19.652 1.499 1.00 0.00 H new ATOM 0 HB THR A 2 -17.891 17.810 3.194 1.00 0.00 H new ATOM 0 HG1 THR A 2 -17.791 15.645 2.253 1.00 0.00 H new ATOM 0 HG21 THR A 2 -19.785 16.959 1.871 1.00 0.00 H new ATOM 0 HG22 THR A 2 -19.563 18.709 1.637 1.00 0.00 H new ATOM 0 HG23 THR A 2 -19.021 17.568 0.384 1.00 0.00 H new ATOM 27 N SER A 3 -14.707 17.989 2.316 1.00 0.00 N ATOM 28 CA SER A 3 -13.444 18.021 2.941 1.00 0.00 C ATOM 29 C SER A 3 -12.454 17.748 1.827 1.00 0.00 C ATOM 30 O SER A 3 -12.779 16.987 0.910 1.00 0.00 O ATOM 31 CB SER A 3 -13.390 16.948 4.032 1.00 0.00 C ATOM 32 OG SER A 3 -14.482 17.110 4.941 1.00 0.00 O ATOM 0 H SER A 3 -14.842 17.167 1.727 1.00 0.00 H new ATOM 0 HA SER A 3 -13.226 18.970 3.431 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.428 15.957 3.579 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.445 17.015 4.572 1.00 0.00 H new ATOM 0 HG SER A 3 -14.437 16.417 5.633 1.00 0.00 H new ATOM 38 N THR A 4 -11.298 18.386 1.859 1.00 0.00 N ATOM 39 CA THR A 4 -10.307 18.258 0.796 1.00 0.00 C ATOM 40 C THR A 4 -9.813 16.833 0.707 1.00 0.00 C ATOM 41 O THR A 4 -9.535 16.281 -0.371 1.00 0.00 O ATOM 42 CB THR A 4 -9.144 19.200 1.066 1.00 0.00 C ATOM 43 OG1 THR A 4 -9.669 20.457 1.550 1.00 0.00 O ATOM 44 CG2 THR A 4 -8.337 19.449 -0.202 1.00 0.00 C ATOM 0 H THR A 4 -11.016 19.006 2.618 1.00 0.00 H new ATOM 0 HA THR A 4 -10.770 18.523 -0.155 1.00 0.00 H new ATOM 0 HB THR A 4 -8.487 18.746 1.808 1.00 0.00 H new ATOM 0 HG1 THR A 4 -8.929 21.073 1.730 1.00 0.00 H new ATOM 0 HG21 THR A 4 -7.512 20.126 0.019 1.00 0.00 H new ATOM 0 HG22 THR A 4 -7.942 18.503 -0.573 1.00 0.00 H new ATOM 0 HG23 THR A 4 -8.980 19.896 -0.960 1.00 0.00 H new ATOM 52 N LYS A 5 -9.801 16.255 1.824 1.00 0.00 N ATOM 53 CA LYS A 5 -9.365 14.929 2.016 1.00 0.00 C ATOM 54 C LYS A 5 -10.544 14.112 2.517 1.00 0.00 C ATOM 55 O LYS A 5 -10.775 13.980 3.720 1.00 0.00 O ATOM 56 CB LYS A 5 -8.192 14.944 2.987 1.00 0.00 C ATOM 57 CG LYS A 5 -7.449 13.636 3.153 1.00 0.00 C ATOM 58 CD LYS A 5 -6.126 13.859 3.882 1.00 0.00 C ATOM 59 CE LYS A 5 -5.174 14.750 3.069 1.00 0.00 C ATOM 60 NZ LYS A 5 -3.873 14.932 3.725 1.00 0.00 N ATOM 0 H LYS A 5 -10.109 16.708 2.684 1.00 0.00 H new ATOM 0 HA LYS A 5 -9.015 14.469 1.092 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -7.482 15.702 2.656 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -8.560 15.256 3.964 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -8.064 12.930 3.712 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -7.262 13.191 2.176 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -6.317 14.320 4.851 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.650 12.898 4.075 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.022 14.309 2.084 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -5.638 15.724 2.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -3.866 15.838 4.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -3.711 14.154 4.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -3.120 14.933 3.008 1.00 0.00 H new ATOM 74 N LYS A 6 -11.355 13.692 1.583 1.00 0.00 N ATOM 75 CA LYS A 6 -12.537 12.924 1.869 1.00 0.00 C ATOM 76 C LYS A 6 -12.582 11.710 0.964 1.00 0.00 C ATOM 77 O LYS A 6 -12.880 11.821 -0.231 1.00 0.00 O ATOM 78 CB LYS A 6 -13.800 13.787 1.663 1.00 0.00 C ATOM 79 CG LYS A 6 -15.108 13.117 2.074 1.00 0.00 C ATOM 80 CD LYS A 6 -15.074 12.711 3.535 1.00 0.00 C ATOM 81 CE LYS A 6 -16.365 12.062 3.972 1.00 0.00 C ATOM 82 NZ LYS A 6 -16.267 11.550 5.349 1.00 0.00 N ATOM 0 H LYS A 6 -11.212 13.876 0.590 1.00 0.00 H new ATOM 0 HA LYS A 6 -12.508 12.598 2.909 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -13.688 14.711 2.230 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -13.865 14.065 0.611 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -15.940 13.799 1.902 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -15.282 12.239 1.453 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -14.247 12.020 3.700 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -14.883 13.590 4.151 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -17.178 12.785 3.908 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -16.611 11.244 3.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -17.169 11.110 5.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -15.507 10.843 5.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -16.056 12.335 5.997 1.00 0.00 H new ATOM 96 N LEU A 7 -12.234 10.585 1.509 1.00 0.00 N ATOM 97 CA LEU A 7 -12.239 9.334 0.777 1.00 0.00 C ATOM 98 C LEU A 7 -12.996 8.324 1.553 1.00 0.00 C ATOM 99 O LEU A 7 -13.169 8.452 2.774 1.00 0.00 O ATOM 100 CB LEU A 7 -10.811 8.856 0.521 1.00 0.00 C ATOM 101 CG LEU A 7 -9.908 9.807 -0.271 1.00 0.00 C ATOM 102 CD1 LEU A 7 -8.501 9.266 -0.324 1.00 0.00 C ATOM 103 CD2 LEU A 7 -10.440 10.024 -1.681 1.00 0.00 C ATOM 0 H LEU A 7 -11.935 10.497 2.480 1.00 0.00 H new ATOM 0 HA LEU A 7 -12.719 9.482 -0.190 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -10.339 8.658 1.483 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -10.859 7.906 -0.012 1.00 0.00 H new ATOM 0 HG LEU A 7 -9.901 10.770 0.240 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -7.869 9.951 -0.890 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -8.111 9.165 0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -8.504 8.290 -0.810 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -9.779 10.703 -2.219 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -10.483 9.069 -2.205 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -11.440 10.455 -1.630 1.00 0.00 H new ATOM 115 N HIS A 8 -13.473 7.359 0.866 1.00 0.00 N ATOM 116 CA HIS A 8 -14.231 6.315 1.462 1.00 0.00 C ATOM 117 C HIS A 8 -13.364 5.127 1.781 1.00 0.00 C ATOM 118 O HIS A 8 -12.530 4.711 0.968 1.00 0.00 O ATOM 119 CB HIS A 8 -15.439 5.927 0.594 1.00 0.00 C ATOM 120 CG HIS A 8 -15.176 5.662 -0.865 1.00 0.00 C ATOM 121 ND1 HIS A 8 -15.809 6.323 -1.892 1.00 0.00 N ATOM 122 CD2 HIS A 8 -14.370 4.778 -1.443 1.00 0.00 C ATOM 123 CE1 HIS A 8 -15.372 5.821 -3.041 1.00 0.00 C ATOM 124 NE2 HIS A 8 -14.483 4.870 -2.828 1.00 0.00 N ATOM 0 H HIS A 8 -13.350 7.265 -0.142 1.00 0.00 H new ATOM 0 HA HIS A 8 -14.627 6.691 2.406 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -15.892 5.034 1.024 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -16.178 6.725 0.665 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -16.496 7.070 -1.789 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -13.724 4.091 -0.917 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -15.700 6.147 -4.017 1.00 0.00 H new ATOM 132 N LYS A 9 -13.523 4.604 2.961 1.00 0.00 N ATOM 133 CA LYS A 9 -12.780 3.478 3.346 1.00 0.00 C ATOM 134 C LYS A 9 -13.718 2.276 3.373 1.00 0.00 C ATOM 135 O LYS A 9 -14.871 2.397 3.788 1.00 0.00 O ATOM 136 CB LYS A 9 -12.129 3.721 4.676 1.00 0.00 C ATOM 137 CG LYS A 9 -10.947 2.826 4.873 1.00 0.00 C ATOM 138 CD LYS A 9 -10.242 3.063 6.166 1.00 0.00 C ATOM 139 CE LYS A 9 -9.794 4.506 6.329 1.00 0.00 C ATOM 140 NZ LYS A 9 -9.188 4.765 7.645 1.00 0.00 N ATOM 0 H LYS A 9 -14.170 4.955 3.667 1.00 0.00 H new ATOM 0 HA LYS A 9 -11.978 3.279 2.635 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -11.815 4.762 4.745 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.852 3.553 5.474 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -11.274 1.787 4.830 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -10.246 2.974 4.052 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -10.903 2.796 6.991 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -9.374 2.407 6.228 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -9.074 4.750 5.547 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -10.650 5.166 6.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -8.900 5.763 7.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -9.881 4.560 8.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -8.354 4.156 7.769 1.00 0.00 H new ATOM 154 N GLU A 10 -13.212 1.143 2.985 1.00 0.00 N ATOM 155 CA GLU A 10 -13.972 -0.049 2.687 1.00 0.00 C ATOM 156 C GLU A 10 -13.303 -1.233 3.368 1.00 0.00 C ATOM 157 O GLU A 10 -12.110 -1.167 3.644 1.00 0.00 O ATOM 158 CB GLU A 10 -13.904 -0.261 1.180 1.00 0.00 C ATOM 159 CG GLU A 10 -14.581 0.823 0.337 1.00 0.00 C ATOM 160 CD GLU A 10 -16.091 0.816 0.418 1.00 0.00 C ATOM 161 OE1 GLU A 10 -16.671 1.161 1.469 1.00 0.00 O ATOM 162 OE2 GLU A 10 -16.733 0.511 -0.602 1.00 0.00 O ATOM 0 H GLU A 10 -12.208 1.012 2.860 1.00 0.00 H new ATOM 0 HA GLU A 10 -15.003 0.045 3.029 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.857 -0.326 0.885 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.362 -1.221 0.943 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -14.215 1.799 0.658 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -14.283 0.697 -0.704 1.00 0.00 H new ATOM 169 N PRO A 11 -14.029 -2.316 3.644 1.00 0.00 N ATOM 170 CA PRO A 11 -13.489 -3.477 4.335 1.00 0.00 C ATOM 171 C PRO A 11 -12.880 -4.539 3.404 1.00 0.00 C ATOM 172 O PRO A 11 -13.445 -4.888 2.345 1.00 0.00 O ATOM 173 CB PRO A 11 -14.725 -4.047 5.055 1.00 0.00 C ATOM 174 CG PRO A 11 -15.840 -3.112 4.693 1.00 0.00 C ATOM 175 CD PRO A 11 -15.445 -2.511 3.394 1.00 0.00 C ATOM 0 HA PRO A 11 -12.661 -3.197 4.987 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -14.940 -5.065 4.728 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -14.573 -4.084 6.134 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -16.787 -3.645 4.608 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -15.973 -2.345 5.456 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -15.634 -3.174 2.550 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -15.967 -1.577 3.188 1.00 0.00 H new ATOM 183 N ALA A 12 -11.747 -5.051 3.814 1.00 0.00 N ATOM 184 CA ALA A 12 -11.041 -6.079 3.107 1.00 0.00 C ATOM 185 C ALA A 12 -10.454 -7.083 4.092 1.00 0.00 C ATOM 186 O ALA A 12 -10.366 -6.828 5.289 1.00 0.00 O ATOM 187 CB ALA A 12 -9.956 -5.457 2.251 1.00 0.00 C ATOM 0 H ALA A 12 -11.282 -4.754 4.672 1.00 0.00 H new ATOM 0 HA ALA A 12 -11.732 -6.612 2.454 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -9.421 -6.241 1.715 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -10.407 -4.770 1.535 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -9.259 -4.912 2.887 1.00 0.00 H new ATOM 193 N THR A 13 -10.155 -8.243 3.618 1.00 0.00 N ATOM 194 CA THR A 13 -9.534 -9.260 4.441 1.00 0.00 C ATOM 195 C THR A 13 -8.355 -9.887 3.689 1.00 0.00 C ATOM 196 O THR A 13 -8.371 -9.948 2.478 1.00 0.00 O ATOM 197 CB THR A 13 -10.586 -10.310 4.865 1.00 0.00 C ATOM 198 OG1 THR A 13 -11.635 -9.643 5.596 1.00 0.00 O ATOM 199 CG2 THR A 13 -9.970 -11.405 5.723 1.00 0.00 C ATOM 0 H THR A 13 -10.328 -8.527 2.654 1.00 0.00 H new ATOM 0 HA THR A 13 -9.139 -8.811 5.352 1.00 0.00 H new ATOM 0 HB THR A 13 -10.988 -10.784 3.970 1.00 0.00 H new ATOM 0 HG1 THR A 13 -12.310 -10.298 5.870 1.00 0.00 H new ATOM 0 HG21 THR A 13 -10.740 -12.125 6.002 1.00 0.00 H new ATOM 0 HG22 THR A 13 -9.187 -11.911 5.159 1.00 0.00 H new ATOM 0 HG23 THR A 13 -9.542 -10.964 6.623 1.00 0.00 H new ATOM 207 N LEU A 14 -7.331 -10.299 4.400 1.00 0.00 N ATOM 208 CA LEU A 14 -6.143 -10.836 3.784 1.00 0.00 C ATOM 209 C LEU A 14 -6.379 -12.183 3.133 1.00 0.00 C ATOM 210 O LEU A 14 -6.857 -13.127 3.767 1.00 0.00 O ATOM 211 CB LEU A 14 -4.972 -10.869 4.798 1.00 0.00 C ATOM 212 CG LEU A 14 -3.587 -11.424 4.339 1.00 0.00 C ATOM 213 CD1 LEU A 14 -3.491 -12.927 4.476 1.00 0.00 C ATOM 214 CD2 LEU A 14 -3.270 -11.006 2.911 1.00 0.00 C ATOM 0 H LEU A 14 -7.299 -10.271 5.419 1.00 0.00 H new ATOM 0 HA LEU A 14 -5.864 -10.165 2.972 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -4.816 -9.851 5.154 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -5.296 -11.460 5.655 1.00 0.00 H new ATOM 0 HG LEU A 14 -2.845 -10.986 5.007 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.508 -13.261 4.143 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.635 -13.207 5.519 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -4.260 -13.398 3.864 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -2.299 -11.408 2.621 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -4.038 -11.392 2.240 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -3.246 -9.918 2.847 1.00 0.00 H new ATOM 226 N ILE A 15 -6.080 -12.233 1.853 1.00 0.00 N ATOM 227 CA ILE A 15 -6.065 -13.451 1.120 1.00 0.00 C ATOM 228 C ILE A 15 -4.621 -13.835 0.813 1.00 0.00 C ATOM 229 O ILE A 15 -4.178 -14.943 1.140 1.00 0.00 O ATOM 230 CB ILE A 15 -6.905 -13.375 -0.179 1.00 0.00 C ATOM 231 CG1 ILE A 15 -8.375 -13.174 0.186 1.00 0.00 C ATOM 232 CG2 ILE A 15 -6.713 -14.627 -1.044 1.00 0.00 C ATOM 233 CD1 ILE A 15 -9.300 -13.135 -0.993 1.00 0.00 C ATOM 0 H ILE A 15 -5.840 -11.412 1.298 1.00 0.00 H new ATOM 0 HA ILE A 15 -6.528 -14.221 1.737 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.564 -12.527 -0.773 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -8.686 -13.979 0.851 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -8.475 -12.243 0.744 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.316 -14.541 -1.948 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -5.662 -14.723 -1.317 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.024 -15.508 -0.483 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -10.324 -12.989 -0.648 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -9.018 -12.312 -1.650 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -9.232 -14.075 -1.540 1.00 0.00 H new ATOM 245 N LYS A 16 -3.859 -12.904 0.242 1.00 0.00 N ATOM 246 CA LYS A 16 -2.465 -13.213 -0.112 1.00 0.00 C ATOM 247 C LYS A 16 -1.681 -11.967 -0.464 1.00 0.00 C ATOM 248 O LYS A 16 -2.013 -11.291 -1.395 1.00 0.00 O ATOM 249 CB LYS A 16 -2.421 -14.183 -1.309 1.00 0.00 C ATOM 250 CG LYS A 16 -1.022 -14.564 -1.780 1.00 0.00 C ATOM 251 CD LYS A 16 -0.252 -15.316 -0.709 1.00 0.00 C ATOM 252 CE LYS A 16 1.159 -15.633 -1.162 1.00 0.00 C ATOM 253 NZ LYS A 16 1.189 -16.460 -2.386 1.00 0.00 N ATOM 0 H LYS A 16 -4.165 -11.957 0.018 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.008 -13.673 0.764 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -2.957 -15.093 -1.040 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.958 -13.731 -2.143 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -1.095 -15.181 -2.676 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -0.474 -13.664 -2.057 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -0.218 -14.720 0.203 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -0.774 -16.241 -0.465 1.00 0.00 H new ATOM 0 HE2 LYS A 16 1.696 -14.702 -1.343 1.00 0.00 H new ATOM 0 HE3 LYS A 16 1.685 -16.154 -0.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 2.157 -16.804 -2.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 0.548 -17.271 -2.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 0.883 -15.888 -3.199 1.00 0.00 H new ATOM 267 N ALA A 17 -0.646 -11.676 0.271 1.00 0.00 N ATOM 268 CA ALA A 17 0.209 -10.559 -0.083 1.00 0.00 C ATOM 269 C ALA A 17 1.189 -11.027 -1.118 1.00 0.00 C ATOM 270 O ALA A 17 1.904 -12.016 -0.911 1.00 0.00 O ATOM 271 CB ALA A 17 0.893 -9.966 1.116 1.00 0.00 C ATOM 0 H ALA A 17 -0.369 -12.184 1.111 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.399 -9.754 -0.496 1.00 0.00 H new ATOM 0 HB1 ALA A 17 1.522 -9.133 0.801 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.144 -9.608 1.822 1.00 0.00 H new ATOM 0 HB3 ALA A 17 1.510 -10.726 1.596 1.00 0.00 H new ATOM 277 N ILE A 18 1.214 -10.345 -2.225 1.00 0.00 N ATOM 278 CA ILE A 18 1.935 -10.833 -3.381 1.00 0.00 C ATOM 279 C ILE A 18 3.309 -10.186 -3.524 1.00 0.00 C ATOM 280 O ILE A 18 4.333 -10.869 -3.478 1.00 0.00 O ATOM 281 CB ILE A 18 1.094 -10.617 -4.672 1.00 0.00 C ATOM 282 CG1 ILE A 18 -0.376 -10.957 -4.351 1.00 0.00 C ATOM 283 CG2 ILE A 18 1.631 -11.497 -5.803 1.00 0.00 C ATOM 284 CD1 ILE A 18 -1.338 -10.995 -5.502 1.00 0.00 C ATOM 0 H ILE A 18 0.746 -9.449 -2.360 1.00 0.00 H new ATOM 0 HA ILE A 18 2.099 -11.900 -3.233 1.00 0.00 H new ATOM 0 HB ILE A 18 1.162 -9.581 -5.003 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -0.398 -11.930 -3.860 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -0.742 -10.227 -3.629 1.00 0.00 H new ATOM 0 HG21 ILE A 18 1.035 -11.338 -6.702 1.00 0.00 H new ATOM 0 HG22 ILE A 18 2.670 -11.236 -6.005 1.00 0.00 H new ATOM 0 HG23 ILE A 18 1.571 -12.545 -5.509 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -2.334 -11.245 -5.136 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -1.364 -10.019 -5.986 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -1.016 -11.748 -6.221 1.00 0.00 H new ATOM 296 N ASP A 19 3.340 -8.882 -3.647 1.00 0.00 N ATOM 297 CA ASP A 19 4.625 -8.184 -3.902 1.00 0.00 C ATOM 298 C ASP A 19 4.921 -7.140 -2.898 1.00 0.00 C ATOM 299 O ASP A 19 5.879 -6.385 -3.031 1.00 0.00 O ATOM 300 CB ASP A 19 4.613 -7.495 -5.243 1.00 0.00 C ATOM 301 CG ASP A 19 4.940 -8.391 -6.401 1.00 0.00 C ATOM 302 OD1 ASP A 19 4.066 -9.124 -6.884 1.00 0.00 O ATOM 303 OD2 ASP A 19 6.082 -8.359 -6.860 1.00 0.00 O ATOM 0 H ASP A 19 2.524 -8.274 -3.581 1.00 0.00 H new ATOM 0 HA ASP A 19 5.384 -8.965 -3.859 1.00 0.00 H new ATOM 0 HB2 ASP A 19 3.628 -7.057 -5.404 1.00 0.00 H new ATOM 0 HB3 ASP A 19 5.328 -6.672 -5.222 1.00 0.00 H new ATOM 308 N GLY A 20 4.114 -7.066 -1.919 1.00 0.00 N ATOM 309 CA GLY A 20 4.232 -5.985 -1.000 1.00 0.00 C ATOM 310 C GLY A 20 3.310 -4.934 -1.453 1.00 0.00 C ATOM 311 O GLY A 20 2.266 -4.717 -0.866 1.00 0.00 O ATOM 0 H GLY A 20 3.365 -7.730 -1.723 1.00 0.00 H new ATOM 0 HA2 GLY A 20 3.982 -6.309 0.010 1.00 0.00 H new ATOM 0 HA3 GLY A 20 5.256 -5.613 -0.971 1.00 0.00 H new ATOM 315 N ASP A 21 3.659 -4.371 -2.580 1.00 0.00 N ATOM 316 CA ASP A 21 2.860 -3.387 -3.276 1.00 0.00 C ATOM 317 C ASP A 21 1.617 -4.026 -3.910 1.00 0.00 C ATOM 318 O ASP A 21 0.696 -3.368 -4.352 1.00 0.00 O ATOM 319 CB ASP A 21 3.717 -2.669 -4.317 1.00 0.00 C ATOM 320 CG ASP A 21 2.923 -1.912 -5.341 1.00 0.00 C ATOM 321 OD1 ASP A 21 2.401 -0.846 -5.025 1.00 0.00 O ATOM 322 OD2 ASP A 21 2.823 -2.396 -6.491 1.00 0.00 O ATOM 0 H ASP A 21 4.534 -4.589 -3.057 1.00 0.00 H new ATOM 0 HA ASP A 21 2.503 -2.651 -2.556 1.00 0.00 H new ATOM 0 HB2 ASP A 21 4.387 -1.977 -3.807 1.00 0.00 H new ATOM 0 HB3 ASP A 21 4.343 -3.402 -4.826 1.00 0.00 H new ATOM 327 N THR A 22 1.560 -5.312 -3.894 1.00 0.00 N ATOM 328 CA THR A 22 0.456 -5.978 -4.518 1.00 0.00 C ATOM 329 C THR A 22 -0.002 -7.057 -3.591 1.00 0.00 C ATOM 330 O THR A 22 0.842 -7.809 -3.047 1.00 0.00 O ATOM 331 CB THR A 22 0.857 -6.585 -5.864 1.00 0.00 C ATOM 332 OG1 THR A 22 1.845 -5.735 -6.488 1.00 0.00 O ATOM 333 CG2 THR A 22 -0.350 -6.615 -6.775 1.00 0.00 C ATOM 0 H THR A 22 2.253 -5.924 -3.463 1.00 0.00 H new ATOM 0 HA THR A 22 -0.341 -5.260 -4.711 1.00 0.00 H new ATOM 0 HB THR A 22 1.249 -7.589 -5.703 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.108 -6.118 -7.351 1.00 0.00 H new ATOM 0 HG21 THR A 22 -0.070 -7.047 -7.736 1.00 0.00 H new ATOM 0 HG22 THR A 22 -1.134 -7.220 -6.320 1.00 0.00 H new ATOM 0 HG23 THR A 22 -0.717 -5.600 -6.926 1.00 0.00 H new ATOM 341 N VAL A 23 -1.294 -7.118 -3.359 1.00 0.00 N ATOM 342 CA VAL A 23 -1.870 -8.048 -2.403 1.00 0.00 C ATOM 343 C VAL A 23 -3.196 -8.553 -2.970 1.00 0.00 C ATOM 344 O VAL A 23 -3.736 -7.940 -3.813 1.00 0.00 O ATOM 345 CB VAL A 23 -2.218 -7.303 -1.065 1.00 0.00 C ATOM 346 CG1 VAL A 23 -2.571 -8.235 0.085 1.00 0.00 C ATOM 347 CG2 VAL A 23 -1.167 -6.297 -0.652 1.00 0.00 C ATOM 0 H VAL A 23 -1.979 -6.525 -3.827 1.00 0.00 H new ATOM 0 HA VAL A 23 -1.158 -8.853 -2.221 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.124 -6.745 -1.299 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.799 -7.646 0.974 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -3.440 -8.834 -0.186 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -1.727 -8.893 0.292 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.468 -5.818 0.280 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -0.214 -6.805 -0.507 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -1.060 -5.542 -1.431 1.00 0.00 H new ATOM 357 N LYS A 24 -3.666 -9.671 -2.533 1.00 0.00 N ATOM 358 CA LYS A 24 -5.016 -10.083 -2.795 1.00 0.00 C ATOM 359 C LYS A 24 -5.761 -9.997 -1.533 1.00 0.00 C ATOM 360 O LYS A 24 -5.397 -10.678 -0.521 1.00 0.00 O ATOM 361 CB LYS A 24 -5.191 -11.492 -3.359 1.00 0.00 C ATOM 362 CG LYS A 24 -5.045 -11.626 -4.866 1.00 0.00 C ATOM 363 CD LYS A 24 -5.248 -13.068 -5.298 1.00 0.00 C ATOM 364 CE LYS A 24 -6.726 -13.445 -5.506 1.00 0.00 C ATOM 365 NZ LYS A 24 -7.275 -12.880 -6.758 1.00 0.00 N ATOM 0 H LYS A 24 -3.126 -10.335 -1.979 1.00 0.00 H new ATOM 0 HA LYS A 24 -5.384 -9.416 -3.574 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.461 -12.146 -2.883 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.178 -11.856 -3.075 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.772 -10.986 -5.365 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.056 -11.285 -5.173 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.703 -13.241 -6.226 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.815 -13.728 -4.547 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.823 -14.530 -5.526 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.313 -13.088 -4.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.272 -13.159 -6.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.207 -11.843 -6.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.732 -13.241 -7.569 1.00 0.00 H new ATOM 379 N LEU A 25 -6.737 -9.154 -1.535 1.00 0.00 N ATOM 380 CA LEU A 25 -7.585 -9.004 -0.411 1.00 0.00 C ATOM 381 C LEU A 25 -9.003 -9.381 -0.770 1.00 0.00 C ATOM 382 O LEU A 25 -9.389 -9.376 -1.940 1.00 0.00 O ATOM 383 CB LEU A 25 -7.546 -7.574 0.110 1.00 0.00 C ATOM 384 CG LEU A 25 -6.197 -7.055 0.590 1.00 0.00 C ATOM 385 CD1 LEU A 25 -6.303 -5.595 0.928 1.00 0.00 C ATOM 386 CD2 LEU A 25 -5.716 -7.832 1.799 1.00 0.00 C ATOM 0 H LEU A 25 -6.967 -8.548 -2.323 1.00 0.00 H new ATOM 0 HA LEU A 25 -7.227 -9.669 0.375 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -7.902 -6.914 -0.681 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -8.254 -7.493 0.935 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.472 -7.189 -0.213 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.335 -5.230 1.271 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.608 -5.038 0.042 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -7.043 -5.457 1.717 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.751 -7.442 2.122 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.438 -7.729 2.609 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.612 -8.885 1.537 1.00 0.00 H new ATOM 398 N MET A 26 -9.723 -9.763 0.229 1.00 0.00 N ATOM 399 CA MET A 26 -11.130 -10.060 0.174 1.00 0.00 C ATOM 400 C MET A 26 -11.817 -8.763 0.440 1.00 0.00 C ATOM 401 O MET A 26 -11.908 -8.342 1.565 1.00 0.00 O ATOM 402 CB MET A 26 -11.475 -11.014 1.316 1.00 0.00 C ATOM 403 CG MET A 26 -12.939 -11.471 1.456 1.00 0.00 C ATOM 404 SD MET A 26 -13.286 -13.127 0.800 1.00 0.00 S ATOM 405 CE MET A 26 -13.120 -12.887 -0.953 1.00 0.00 C ATOM 0 H MET A 26 -9.332 -9.886 1.163 1.00 0.00 H new ATOM 0 HA MET A 26 -11.418 -10.506 -0.778 1.00 0.00 H new ATOM 0 HB2 MET A 26 -10.856 -11.904 1.207 1.00 0.00 H new ATOM 0 HB3 MET A 26 -11.183 -10.536 2.251 1.00 0.00 H new ATOM 0 HG2 MET A 26 -13.212 -11.449 2.511 1.00 0.00 H new ATOM 0 HG3 MET A 26 -13.580 -10.752 0.946 1.00 0.00 H new ATOM 0 HE1 MET A 26 -14.002 -13.279 -1.459 1.00 0.00 H new ATOM 0 HE2 MET A 26 -13.022 -11.823 -1.167 1.00 0.00 H new ATOM 0 HE3 MET A 26 -12.234 -13.411 -1.310 1.00 0.00 H new ATOM 415 N TYR A 27 -12.228 -8.133 -0.564 1.00 0.00 N ATOM 416 CA TYR A 27 -12.838 -6.876 -0.468 1.00 0.00 C ATOM 417 C TYR A 27 -14.299 -7.080 -0.549 1.00 0.00 C ATOM 418 O TYR A 27 -14.828 -7.513 -1.578 1.00 0.00 O ATOM 419 CB TYR A 27 -12.280 -5.970 -1.553 1.00 0.00 C ATOM 420 CG TYR A 27 -13.136 -4.782 -1.973 1.00 0.00 C ATOM 421 CD1 TYR A 27 -13.101 -3.568 -1.286 1.00 0.00 C ATOM 422 CD2 TYR A 27 -13.973 -4.878 -3.078 1.00 0.00 C ATOM 423 CE1 TYR A 27 -13.879 -2.501 -1.691 1.00 0.00 C ATOM 424 CE2 TYR A 27 -14.747 -3.822 -3.483 1.00 0.00 C ATOM 425 CZ TYR A 27 -14.702 -2.640 -2.793 1.00 0.00 C ATOM 426 OH TYR A 27 -15.487 -1.588 -3.206 1.00 0.00 O ATOM 0 H TYR A 27 -12.151 -8.484 -1.519 1.00 0.00 H new ATOM 0 HA TYR A 27 -12.627 -6.379 0.479 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -11.317 -5.590 -1.214 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -12.089 -6.579 -2.437 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -12.457 -3.461 -0.426 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -14.015 -5.805 -3.630 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -13.845 -1.566 -1.151 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -15.391 -3.922 -4.344 1.00 0.00 H new ATOM 0 HH TYR A 27 -16.003 -1.855 -3.995 1.00 0.00 H new ATOM 436 N LYS A 28 -14.908 -6.932 0.592 1.00 0.00 N ATOM 437 CA LYS A 28 -16.336 -7.050 0.795 1.00 0.00 C ATOM 438 C LYS A 28 -16.862 -8.447 0.354 1.00 0.00 C ATOM 439 O LYS A 28 -18.047 -8.645 0.078 1.00 0.00 O ATOM 440 CB LYS A 28 -17.068 -5.881 0.102 1.00 0.00 C ATOM 441 CG LYS A 28 -18.524 -5.704 0.517 1.00 0.00 C ATOM 442 CD LYS A 28 -19.165 -4.494 -0.145 1.00 0.00 C ATOM 443 CE LYS A 28 -19.285 -4.640 -1.658 1.00 0.00 C ATOM 444 NZ LYS A 28 -20.143 -5.780 -2.043 1.00 0.00 N ATOM 0 H LYS A 28 -14.404 -6.715 1.452 1.00 0.00 H new ATOM 0 HA LYS A 28 -16.549 -6.978 1.861 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -16.530 -4.957 0.313 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -17.028 -6.034 -0.976 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -19.087 -6.600 0.255 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -18.581 -5.597 1.600 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -20.156 -4.336 0.280 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -18.576 -3.606 0.084 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -19.694 -3.721 -2.079 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -18.292 -4.773 -2.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -20.362 -5.723 -3.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -19.645 -6.671 -1.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -21.027 -5.749 -1.496 1.00 0.00 H new ATOM 458 N GLY A 29 -15.975 -9.413 0.350 1.00 0.00 N ATOM 459 CA GLY A 29 -16.343 -10.745 -0.047 1.00 0.00 C ATOM 460 C GLY A 29 -15.875 -11.097 -1.449 1.00 0.00 C ATOM 461 O GLY A 29 -16.236 -12.146 -1.978 1.00 0.00 O ATOM 0 H GLY A 29 -14.997 -9.300 0.617 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -15.921 -11.459 0.661 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -17.427 -10.847 0.005 1.00 0.00 H new ATOM 465 N GLN A 30 -15.090 -10.228 -2.072 1.00 0.00 N ATOM 466 CA GLN A 30 -14.548 -10.505 -3.390 1.00 0.00 C ATOM 467 C GLN A 30 -13.026 -10.423 -3.373 1.00 0.00 C ATOM 468 O GLN A 30 -12.473 -9.451 -2.876 1.00 0.00 O ATOM 469 CB GLN A 30 -15.104 -9.500 -4.348 1.00 0.00 C ATOM 470 CG GLN A 30 -16.601 -9.604 -4.493 1.00 0.00 C ATOM 471 CD GLN A 30 -17.206 -8.461 -5.271 1.00 0.00 C ATOM 472 OE1 GLN A 30 -16.709 -7.337 -5.245 1.00 0.00 O ATOM 473 NE2 GLN A 30 -18.271 -8.729 -5.977 1.00 0.00 N ATOM 0 H GLN A 30 -14.816 -9.326 -1.683 1.00 0.00 H new ATOM 0 HA GLN A 30 -14.827 -11.513 -3.696 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -14.844 -8.497 -4.008 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -14.638 -9.637 -5.324 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -16.847 -10.543 -4.990 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -17.054 -9.640 -3.502 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -18.659 -9.672 -5.977 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -18.715 -7.995 -6.529 1.00 0.00 H new ATOM 482 N PRO A 31 -12.318 -11.452 -3.883 1.00 0.00 N ATOM 483 CA PRO A 31 -10.873 -11.453 -3.913 1.00 0.00 C ATOM 484 C PRO A 31 -10.383 -10.568 -4.996 1.00 0.00 C ATOM 485 O PRO A 31 -10.749 -10.733 -6.168 1.00 0.00 O ATOM 486 CB PRO A 31 -10.479 -12.882 -4.240 1.00 0.00 C ATOM 487 CG PRO A 31 -11.734 -13.651 -4.300 1.00 0.00 C ATOM 488 CD PRO A 31 -12.856 -12.661 -4.493 1.00 0.00 C ATOM 0 HA PRO A 31 -10.455 -11.103 -2.969 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -9.947 -12.931 -5.190 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -9.811 -13.286 -3.479 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -11.707 -14.367 -5.121 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -11.879 -14.223 -3.383 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -13.090 -12.514 -5.547 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -13.774 -12.988 -4.005 1.00 0.00 H new ATOM 496 N MET A 32 -9.554 -9.673 -4.647 1.00 0.00 N ATOM 497 CA MET A 32 -9.091 -8.734 -5.594 1.00 0.00 C ATOM 498 C MET A 32 -7.672 -8.397 -5.289 1.00 0.00 C ATOM 499 O MET A 32 -7.267 -8.343 -4.111 1.00 0.00 O ATOM 500 CB MET A 32 -9.977 -7.491 -5.592 1.00 0.00 C ATOM 501 CG MET A 32 -9.923 -6.710 -6.907 1.00 0.00 C ATOM 502 SD MET A 32 -11.014 -5.270 -6.942 1.00 0.00 S ATOM 503 CE MET A 32 -10.216 -4.200 -5.762 1.00 0.00 C ATOM 0 H MET A 32 -9.175 -9.565 -3.706 1.00 0.00 H new ATOM 0 HA MET A 32 -9.141 -9.162 -6.595 1.00 0.00 H new ATOM 0 HB2 MET A 32 -11.007 -7.787 -5.395 1.00 0.00 H new ATOM 0 HB3 MET A 32 -9.672 -6.837 -4.775 1.00 0.00 H new ATOM 0 HG2 MET A 32 -8.898 -6.383 -7.083 1.00 0.00 H new ATOM 0 HG3 MET A 32 -10.190 -7.377 -7.727 1.00 0.00 H new ATOM 0 HE1 MET A 32 -10.864 -4.066 -4.896 1.00 0.00 H new ATOM 0 HE2 MET A 32 -9.274 -4.647 -5.445 1.00 0.00 H new ATOM 0 HE3 MET A 32 -10.022 -3.231 -6.222 1.00 0.00 H new ATOM 513 N THR A 33 -6.918 -8.227 -6.313 1.00 0.00 N ATOM 514 CA THR A 33 -5.544 -7.939 -6.191 1.00 0.00 C ATOM 515 C THR A 33 -5.359 -6.440 -6.007 1.00 0.00 C ATOM 516 O THR A 33 -5.464 -5.700 -6.944 1.00 0.00 O ATOM 517 CB THR A 33 -4.809 -8.388 -7.451 1.00 0.00 C ATOM 518 OG1 THR A 33 -5.395 -9.614 -7.925 1.00 0.00 O ATOM 519 CG2 THR A 33 -3.365 -8.650 -7.129 1.00 0.00 C ATOM 0 H THR A 33 -7.249 -8.286 -7.276 1.00 0.00 H new ATOM 0 HA THR A 33 -5.139 -8.469 -5.329 1.00 0.00 H new ATOM 0 HB THR A 33 -4.886 -7.608 -8.208 1.00 0.00 H new ATOM 0 HG1 THR A 33 -4.929 -9.907 -8.735 1.00 0.00 H new ATOM 0 HG21 THR A 33 -2.843 -8.970 -8.031 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.906 -7.738 -6.749 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.297 -9.432 -6.373 1.00 0.00 H new ATOM 527 N PHE A 34 -5.131 -6.024 -4.797 1.00 0.00 N ATOM 528 CA PHE A 34 -4.934 -4.645 -4.465 1.00 0.00 C ATOM 529 C PHE A 34 -3.505 -4.207 -4.717 1.00 0.00 C ATOM 530 O PHE A 34 -2.564 -5.036 -4.721 1.00 0.00 O ATOM 531 CB PHE A 34 -5.330 -4.346 -3.037 1.00 0.00 C ATOM 532 CG PHE A 34 -6.800 -4.276 -2.794 1.00 0.00 C ATOM 533 CD1 PHE A 34 -7.562 -5.412 -2.665 1.00 0.00 C ATOM 534 CD2 PHE A 34 -7.416 -3.042 -2.688 1.00 0.00 C ATOM 535 CE1 PHE A 34 -8.915 -5.324 -2.434 1.00 0.00 C ATOM 536 CE2 PHE A 34 -8.760 -2.944 -2.458 1.00 0.00 C ATOM 537 CZ PHE A 34 -9.514 -4.082 -2.330 1.00 0.00 C ATOM 0 H PHE A 34 -5.076 -6.650 -3.994 1.00 0.00 H new ATOM 0 HA PHE A 34 -5.588 -4.072 -5.123 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -4.906 -5.113 -2.389 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -4.882 -3.397 -2.742 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -7.095 -6.382 -2.746 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -6.826 -2.143 -2.788 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -9.507 -6.222 -2.334 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -9.226 -1.973 -2.377 1.00 0.00 H new ATOM 0 HZ PHE A 34 -10.576 -4.008 -2.148 1.00 0.00 H new ATOM 547 N ARG A 35 -3.364 -2.912 -4.897 1.00 0.00 N ATOM 548 CA ARG A 35 -2.150 -2.264 -5.264 1.00 0.00 C ATOM 549 C ARG A 35 -1.867 -1.192 -4.248 1.00 0.00 C ATOM 550 O ARG A 35 -2.779 -0.446 -3.857 1.00 0.00 O ATOM 551 CB ARG A 35 -2.394 -1.596 -6.594 1.00 0.00 C ATOM 552 CG ARG A 35 -1.201 -1.460 -7.532 1.00 0.00 C ATOM 553 CD ARG A 35 -0.154 -0.467 -7.063 1.00 0.00 C ATOM 554 NE ARG A 35 0.594 0.063 -8.203 1.00 0.00 N ATOM 555 CZ ARG A 35 1.710 0.778 -8.134 1.00 0.00 C ATOM 556 NH1 ARG A 35 2.422 0.815 -7.024 1.00 0.00 N ATOM 557 NH2 ARG A 35 2.132 1.398 -9.229 1.00 0.00 N ATOM 0 H ARG A 35 -4.140 -2.260 -4.782 1.00 0.00 H new ATOM 0 HA ARG A 35 -1.320 -2.968 -5.316 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -3.172 -2.154 -7.115 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -2.790 -0.599 -6.404 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -0.732 -2.437 -7.650 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -1.559 -1.157 -8.516 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -0.634 0.350 -6.524 1.00 0.00 H new ATOM 0 HD3 ARG A 35 0.529 -0.952 -6.365 1.00 0.00 H new ATOM 0 HE ARG A 35 0.225 -0.134 -9.133 1.00 0.00 H new ATOM 0 HH11 ARG A 35 2.117 0.290 -6.205 1.00 0.00 H new ATOM 0 HH12 ARG A 35 3.278 1.369 -6.985 1.00 0.00 H new ATOM 0 HH21 ARG A 35 1.602 1.319 -10.097 1.00 0.00 H new ATOM 0 HH22 ARG A 35 2.987 1.954 -9.203 1.00 0.00 H new ATOM 571 N LEU A 36 -0.653 -1.101 -3.839 1.00 0.00 N ATOM 572 CA LEU A 36 -0.248 -0.116 -2.919 1.00 0.00 C ATOM 573 C LEU A 36 -0.135 1.259 -3.541 1.00 0.00 C ATOM 574 O LEU A 36 0.765 1.566 -4.326 1.00 0.00 O ATOM 575 CB LEU A 36 1.016 -0.522 -2.190 1.00 0.00 C ATOM 576 CG LEU A 36 0.900 -1.669 -1.199 1.00 0.00 C ATOM 577 CD1 LEU A 36 2.074 -1.662 -0.271 1.00 0.00 C ATOM 578 CD2 LEU A 36 -0.367 -1.603 -0.419 1.00 0.00 C ATOM 0 H LEU A 36 0.096 -1.723 -4.143 1.00 0.00 H new ATOM 0 HA LEU A 36 -1.041 -0.040 -2.175 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.765 -0.791 -2.934 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.395 0.350 -1.657 1.00 0.00 H new ATOM 0 HG LEU A 36 0.888 -2.599 -1.768 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.984 -2.487 0.436 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.993 -1.776 -0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 36 2.102 -0.718 0.274 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.410 -2.441 0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.403 -0.666 0.138 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -1.217 -1.653 -1.100 1.00 0.00 H new ATOM 590 N LEU A 37 -1.123 2.048 -3.234 1.00 0.00 N ATOM 591 CA LEU A 37 -1.152 3.457 -3.582 1.00 0.00 C ATOM 592 C LEU A 37 0.076 4.187 -3.162 1.00 0.00 C ATOM 593 O LEU A 37 0.547 4.054 -2.042 1.00 0.00 O ATOM 594 CB LEU A 37 -2.286 4.185 -2.932 1.00 0.00 C ATOM 595 CG LEU A 37 -3.482 4.548 -3.788 1.00 0.00 C ATOM 596 CD1 LEU A 37 -4.101 5.771 -3.298 1.00 0.00 C ATOM 597 CD2 LEU A 37 -3.097 4.839 -5.127 1.00 0.00 C ATOM 0 H LEU A 37 -1.950 1.734 -2.726 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.250 3.450 -4.668 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.642 3.575 -2.102 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.890 5.106 -2.504 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.156 3.693 -3.746 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.959 6.020 -3.922 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.431 5.625 -2.269 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.377 6.585 -3.335 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.980 5.095 -5.712 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -2.403 5.679 -5.132 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -2.613 3.966 -5.564 1.00 0.00 H new ATOM 609 N LEU A 38 0.532 4.985 -4.066 1.00 0.00 N ATOM 610 CA LEU A 38 1.650 5.875 -3.901 1.00 0.00 C ATOM 611 C LEU A 38 2.956 5.155 -3.553 1.00 0.00 C ATOM 612 O LEU A 38 3.905 5.767 -3.074 1.00 0.00 O ATOM 613 CB LEU A 38 1.396 7.036 -2.906 1.00 0.00 C ATOM 614 CG LEU A 38 0.374 8.103 -3.320 1.00 0.00 C ATOM 615 CD1 LEU A 38 0.646 8.601 -4.735 1.00 0.00 C ATOM 616 CD2 LEU A 38 -1.049 7.603 -3.156 1.00 0.00 C ATOM 0 H LEU A 38 0.117 5.044 -4.996 1.00 0.00 H new ATOM 0 HA LEU A 38 1.766 6.320 -4.889 1.00 0.00 H new ATOM 0 HB2 LEU A 38 1.070 6.605 -1.960 1.00 0.00 H new ATOM 0 HB3 LEU A 38 2.347 7.534 -2.718 1.00 0.00 H new ATOM 0 HG LEU A 38 0.488 8.954 -2.649 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.093 9.356 -5.003 1.00 0.00 H new ATOM 0 HD12 LEU A 38 1.644 9.037 -4.782 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.581 7.766 -5.433 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.746 8.384 -3.458 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.199 6.722 -3.779 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.225 7.343 -2.112 1.00 0.00 H new ATOM 628 N VAL A 39 3.044 3.914 -3.905 1.00 0.00 N ATOM 629 CA VAL A 39 4.112 3.069 -3.427 1.00 0.00 C ATOM 630 C VAL A 39 4.946 2.532 -4.556 1.00 0.00 C ATOM 631 O VAL A 39 4.420 2.051 -5.566 1.00 0.00 O ATOM 632 CB VAL A 39 3.530 1.912 -2.550 1.00 0.00 C ATOM 633 CG1 VAL A 39 4.539 0.848 -2.247 1.00 0.00 C ATOM 634 CG2 VAL A 39 3.029 2.457 -1.244 1.00 0.00 C ATOM 0 H VAL A 39 2.385 3.450 -4.530 1.00 0.00 H new ATOM 0 HA VAL A 39 4.773 3.676 -2.808 1.00 0.00 H new ATOM 0 HB VAL A 39 2.722 1.467 -3.131 1.00 0.00 H new ATOM 0 HG11 VAL A 39 4.078 0.072 -1.636 1.00 0.00 H new ATOM 0 HG12 VAL A 39 4.897 0.410 -3.179 1.00 0.00 H new ATOM 0 HG13 VAL A 39 5.378 1.286 -1.705 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.626 1.643 -0.641 1.00 0.00 H new ATOM 0 HG22 VAL A 39 3.851 2.933 -0.709 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.246 3.191 -1.433 1.00 0.00 H new ATOM 644 N ASP A 40 6.236 2.692 -4.427 1.00 0.00 N ATOM 645 CA ASP A 40 7.151 2.125 -5.378 1.00 0.00 C ATOM 646 C ASP A 40 7.940 1.075 -4.696 1.00 0.00 C ATOM 647 O ASP A 40 8.924 1.376 -4.012 1.00 0.00 O ATOM 648 CB ASP A 40 8.117 3.143 -5.907 1.00 0.00 C ATOM 649 CG ASP A 40 8.867 2.674 -7.144 1.00 0.00 C ATOM 650 OD1 ASP A 40 9.898 1.996 -7.032 1.00 0.00 O ATOM 651 OD2 ASP A 40 8.455 3.027 -8.258 1.00 0.00 O ATOM 0 H ASP A 40 6.677 3.213 -3.669 1.00 0.00 H new ATOM 0 HA ASP A 40 6.567 1.732 -6.210 1.00 0.00 H new ATOM 0 HB2 ASP A 40 7.576 4.059 -6.144 1.00 0.00 H new ATOM 0 HB3 ASP A 40 8.836 3.391 -5.127 1.00 0.00 H new ATOM 656 N THR A 41 7.469 -0.099 -4.763 1.00 0.00 N ATOM 657 CA THR A 41 8.196 -1.213 -4.257 1.00 0.00 C ATOM 658 C THR A 41 8.895 -1.851 -5.411 1.00 0.00 C ATOM 659 O THR A 41 8.278 -2.043 -6.468 1.00 0.00 O ATOM 660 CB THR A 41 7.262 -2.261 -3.626 1.00 0.00 C ATOM 661 OG1 THR A 41 6.481 -1.643 -2.625 1.00 0.00 O ATOM 662 CG2 THR A 41 8.057 -3.396 -2.997 1.00 0.00 C ATOM 0 H THR A 41 6.563 -0.331 -5.170 1.00 0.00 H new ATOM 0 HA THR A 41 8.889 -0.866 -3.490 1.00 0.00 H new ATOM 0 HB THR A 41 6.627 -2.672 -4.411 1.00 0.00 H new ATOM 0 HG1 THR A 41 6.987 -1.615 -1.786 1.00 0.00 H new ATOM 0 HG21 THR A 41 7.371 -4.121 -2.559 1.00 0.00 H new ATOM 0 HG22 THR A 41 8.662 -3.884 -3.761 1.00 0.00 H new ATOM 0 HG23 THR A 41 8.708 -2.997 -2.219 1.00 0.00 H new ATOM 670 N PRO A 42 10.189 -2.116 -5.299 1.00 0.00 N ATOM 671 CA PRO A 42 10.859 -2.900 -6.287 1.00 0.00 C ATOM 672 C PRO A 42 10.279 -4.314 -6.221 1.00 0.00 C ATOM 673 O PRO A 42 10.530 -5.063 -5.260 1.00 0.00 O ATOM 674 CB PRO A 42 12.338 -2.852 -5.884 1.00 0.00 C ATOM 675 CG PRO A 42 12.440 -1.750 -4.882 1.00 0.00 C ATOM 676 CD PRO A 42 11.093 -1.652 -4.235 1.00 0.00 C ATOM 0 HA PRO A 42 10.740 -2.547 -7.311 1.00 0.00 H new ATOM 0 HB2 PRO A 42 12.660 -3.802 -5.457 1.00 0.00 H new ATOM 0 HB3 PRO A 42 12.974 -2.658 -6.747 1.00 0.00 H new ATOM 0 HG2 PRO A 42 13.212 -1.965 -4.144 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.711 -0.810 -5.363 1.00 0.00 H new ATOM 0 HD2 PRO A 42 11.025 -2.277 -3.345 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.865 -0.632 -3.926 1.00 0.00 H new ATOM 684 N GLU A 43 9.455 -4.615 -7.211 1.00 0.00 N ATOM 685 CA GLU A 43 8.636 -5.810 -7.277 1.00 0.00 C ATOM 686 C GLU A 43 9.410 -7.103 -7.188 1.00 0.00 C ATOM 687 O GLU A 43 10.600 -7.155 -7.481 1.00 0.00 O ATOM 688 CB GLU A 43 7.665 -5.809 -8.485 1.00 0.00 C ATOM 689 CG GLU A 43 8.276 -5.552 -9.868 1.00 0.00 C ATOM 690 CD GLU A 43 8.767 -4.133 -10.064 1.00 0.00 C ATOM 691 OE1 GLU A 43 7.957 -3.242 -10.385 1.00 0.00 O ATOM 692 OE2 GLU A 43 9.971 -3.883 -9.900 1.00 0.00 O ATOM 0 H GLU A 43 9.335 -4.008 -8.022 1.00 0.00 H new ATOM 0 HA GLU A 43 8.031 -5.767 -6.371 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.157 -6.773 -8.513 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.902 -5.052 -8.306 1.00 0.00 H new ATOM 0 HG2 GLU A 43 9.108 -6.239 -10.021 1.00 0.00 H new ATOM 0 HG3 GLU A 43 7.532 -5.778 -10.632 1.00 0.00 H new ATOM 699 N THR A 44 8.704 -8.141 -6.838 1.00 0.00 N ATOM 700 CA THR A 44 9.257 -9.420 -6.564 1.00 0.00 C ATOM 701 C THR A 44 9.595 -10.139 -7.846 1.00 0.00 C ATOM 702 O THR A 44 8.752 -10.792 -8.492 1.00 0.00 O ATOM 703 CB THR A 44 8.302 -10.255 -5.692 1.00 0.00 C ATOM 704 OG1 THR A 44 7.801 -9.415 -4.637 1.00 0.00 O ATOM 705 CG2 THR A 44 9.025 -11.442 -5.075 1.00 0.00 C ATOM 0 H THR A 44 7.690 -8.109 -6.734 1.00 0.00 H new ATOM 0 HA THR A 44 10.181 -9.281 -6.003 1.00 0.00 H new ATOM 0 HB THR A 44 7.490 -10.631 -6.314 1.00 0.00 H new ATOM 0 HG1 THR A 44 7.132 -8.798 -5.000 1.00 0.00 H new ATOM 0 HG21 THR A 44 8.328 -12.015 -4.464 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.421 -12.078 -5.866 1.00 0.00 H new ATOM 0 HG23 THR A 44 9.845 -11.085 -4.452 1.00 0.00 H new ATOM 713 N LYS A 45 10.760 -9.846 -8.273 1.00 0.00 N ATOM 714 CA LYS A 45 11.412 -10.514 -9.356 1.00 0.00 C ATOM 715 C LYS A 45 12.207 -11.696 -8.753 1.00 0.00 C ATOM 716 O LYS A 45 11.889 -12.155 -7.638 1.00 0.00 O ATOM 717 CB LYS A 45 12.374 -9.532 -10.017 1.00 0.00 C ATOM 718 CG LYS A 45 11.757 -8.206 -10.479 1.00 0.00 C ATOM 719 CD LYS A 45 10.780 -8.346 -11.654 1.00 0.00 C ATOM 720 CE LYS A 45 11.475 -8.511 -13.025 1.00 0.00 C ATOM 721 NZ LYS A 45 12.215 -9.793 -13.205 1.00 0.00 N ATOM 0 H LYS A 45 11.323 -9.099 -7.865 1.00 0.00 H new ATOM 0 HA LYS A 45 10.698 -10.874 -10.097 1.00 0.00 H new ATOM 0 HB2 LYS A 45 13.179 -9.312 -9.316 1.00 0.00 H new ATOM 0 HB3 LYS A 45 12.827 -10.021 -10.879 1.00 0.00 H new ATOM 0 HG2 LYS A 45 11.235 -7.748 -9.639 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.558 -7.525 -10.766 1.00 0.00 H new ATOM 0 HD2 LYS A 45 10.135 -9.207 -11.478 1.00 0.00 H new ATOM 0 HD3 LYS A 45 10.136 -7.467 -11.686 1.00 0.00 H new ATOM 0 HE2 LYS A 45 10.722 -8.430 -13.809 1.00 0.00 H new ATOM 0 HE3 LYS A 45 12.171 -7.684 -13.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 12.192 -10.069 -14.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.202 -9.670 -12.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.767 -10.536 -12.631 1.00 0.00 H new ATOM 735 N HIS A 46 13.227 -12.179 -9.461 1.00 0.00 N ATOM 736 CA HIS A 46 14.061 -13.271 -8.958 1.00 0.00 C ATOM 737 C HIS A 46 14.784 -12.863 -7.674 1.00 0.00 C ATOM 738 O HIS A 46 15.278 -11.733 -7.564 1.00 0.00 O ATOM 739 CB HIS A 46 15.053 -13.783 -10.013 1.00 0.00 C ATOM 740 CG HIS A 46 14.410 -14.534 -11.144 1.00 0.00 C ATOM 741 ND1 HIS A 46 14.635 -14.273 -12.478 1.00 0.00 N ATOM 742 CD2 HIS A 46 13.565 -15.592 -11.112 1.00 0.00 C ATOM 743 CE1 HIS A 46 13.941 -15.157 -13.199 1.00 0.00 C ATOM 744 NE2 HIS A 46 13.270 -15.984 -12.416 1.00 0.00 N ATOM 0 H HIS A 46 13.496 -11.833 -10.382 1.00 0.00 H new ATOM 0 HA HIS A 46 13.392 -14.100 -8.725 1.00 0.00 H new ATOM 0 HB2 HIS A 46 15.604 -12.935 -10.420 1.00 0.00 H new ATOM 0 HB3 HIS A 46 15.781 -14.432 -9.527 1.00 0.00 H new ATOM 0 HD2 HIS A 46 13.181 -16.058 -10.217 1.00 0.00 H new ATOM 0 HE1 HIS A 46 13.929 -15.192 -14.278 1.00 0.00 H new ATOM 0 HE2 HIS A 46 12.662 -16.750 -12.706 1.00 0.00 H new ATOM 752 N PRO A 47 14.845 -13.785 -6.691 1.00 0.00 N ATOM 753 CA PRO A 47 15.356 -13.515 -5.342 1.00 0.00 C ATOM 754 C PRO A 47 16.828 -13.070 -5.230 1.00 0.00 C ATOM 755 O PRO A 47 17.759 -13.887 -5.097 1.00 0.00 O ATOM 756 CB PRO A 47 15.104 -14.810 -4.576 1.00 0.00 C ATOM 757 CG PRO A 47 15.012 -15.854 -5.628 1.00 0.00 C ATOM 758 CD PRO A 47 14.390 -15.187 -6.815 1.00 0.00 C ATOM 0 HA PRO A 47 14.839 -12.644 -4.939 1.00 0.00 H new ATOM 0 HB2 PRO A 47 15.913 -15.021 -3.877 1.00 0.00 H new ATOM 0 HB3 PRO A 47 14.185 -14.753 -3.992 1.00 0.00 H new ATOM 0 HG2 PRO A 47 15.998 -16.249 -5.874 1.00 0.00 H new ATOM 0 HG3 PRO A 47 14.407 -16.696 -5.291 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.723 -15.637 -7.750 1.00 0.00 H new ATOM 0 HD3 PRO A 47 13.303 -15.261 -6.795 1.00 0.00 H new ATOM 766 N LYS A 48 16.991 -11.782 -5.346 1.00 0.00 N ATOM 767 CA LYS A 48 18.199 -11.024 -5.091 1.00 0.00 C ATOM 768 C LYS A 48 17.716 -9.781 -4.374 1.00 0.00 C ATOM 769 O LYS A 48 16.527 -9.710 -4.057 1.00 0.00 O ATOM 770 CB LYS A 48 18.952 -10.603 -6.389 1.00 0.00 C ATOM 771 CG LYS A 48 19.921 -11.623 -7.004 1.00 0.00 C ATOM 772 CD LYS A 48 19.248 -12.808 -7.669 1.00 0.00 C ATOM 773 CE LYS A 48 20.298 -13.747 -8.235 1.00 0.00 C ATOM 774 NZ LYS A 48 19.712 -14.921 -8.909 1.00 0.00 N ATOM 0 H LYS A 48 16.224 -11.180 -5.645 1.00 0.00 H new ATOM 0 HA LYS A 48 18.909 -11.626 -4.524 1.00 0.00 H new ATOM 0 HB2 LYS A 48 18.207 -10.348 -7.143 1.00 0.00 H new ATOM 0 HB3 LYS A 48 19.512 -9.693 -6.174 1.00 0.00 H new ATOM 0 HG2 LYS A 48 20.544 -11.115 -7.740 1.00 0.00 H new ATOM 0 HG3 LYS A 48 20.586 -11.990 -6.222 1.00 0.00 H new ATOM 0 HD2 LYS A 48 18.626 -13.337 -6.947 1.00 0.00 H new ATOM 0 HD3 LYS A 48 18.589 -12.463 -8.465 1.00 0.00 H new ATOM 0 HE2 LYS A 48 20.923 -13.202 -8.943 1.00 0.00 H new ATOM 0 HE3 LYS A 48 20.949 -14.084 -7.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 20.474 -15.527 -9.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.137 -15.460 -8.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.111 -14.605 -9.697 1.00 0.00 H new ATOM 788 N LYS A 49 18.579 -8.829 -4.107 1.00 0.00 N ATOM 789 CA LYS A 49 18.143 -7.583 -3.502 1.00 0.00 C ATOM 790 C LYS A 49 19.115 -6.475 -3.836 1.00 0.00 C ATOM 791 O LYS A 49 20.231 -6.736 -4.299 1.00 0.00 O ATOM 792 CB LYS A 49 17.939 -7.704 -1.971 1.00 0.00 C ATOM 793 CG LYS A 49 19.190 -8.019 -1.160 1.00 0.00 C ATOM 794 CD LYS A 49 18.859 -8.070 0.327 1.00 0.00 C ATOM 795 CE LYS A 49 20.096 -8.281 1.188 1.00 0.00 C ATOM 796 NZ LYS A 49 20.788 -9.557 0.912 1.00 0.00 N ATOM 0 H LYS A 49 19.580 -8.888 -4.295 1.00 0.00 H new ATOM 0 HA LYS A 49 17.168 -7.339 -3.923 1.00 0.00 H new ATOM 0 HB2 LYS A 49 17.517 -6.768 -1.604 1.00 0.00 H new ATOM 0 HB3 LYS A 49 17.200 -8.483 -1.782 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.607 -8.974 -1.479 1.00 0.00 H new ATOM 0 HG3 LYS A 49 19.951 -7.261 -1.344 1.00 0.00 H new ATOM 0 HD2 LYS A 49 18.370 -7.141 0.620 1.00 0.00 H new ATOM 0 HD3 LYS A 49 18.149 -8.876 0.511 1.00 0.00 H new ATOM 0 HE2 LYS A 49 20.790 -7.456 1.024 1.00 0.00 H new ATOM 0 HE3 LYS A 49 19.808 -8.251 2.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 21.591 -9.665 1.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 20.125 -10.347 1.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 21.136 -9.558 -0.068 1.00 0.00 H new ATOM 810 N GLY A 50 18.704 -5.264 -3.619 1.00 0.00 N ATOM 811 CA GLY A 50 19.527 -4.125 -3.894 1.00 0.00 C ATOM 812 C GLY A 50 18.657 -2.954 -4.176 1.00 0.00 C ATOM 813 O GLY A 50 17.766 -2.646 -3.399 1.00 0.00 O ATOM 0 H GLY A 50 17.783 -5.036 -3.244 1.00 0.00 H new ATOM 0 HA2 GLY A 50 20.176 -3.915 -3.043 1.00 0.00 H new ATOM 0 HA3 GLY A 50 20.175 -4.326 -4.747 1.00 0.00 H new ATOM 817 N VAL A 51 18.841 -2.338 -5.301 1.00 0.00 N ATOM 818 CA VAL A 51 17.977 -1.238 -5.685 1.00 0.00 C ATOM 819 C VAL A 51 16.836 -1.802 -6.523 1.00 0.00 C ATOM 820 O VAL A 51 15.980 -1.085 -7.027 1.00 0.00 O ATOM 821 CB VAL A 51 18.736 -0.120 -6.456 1.00 0.00 C ATOM 822 CG1 VAL A 51 19.850 0.461 -5.597 1.00 0.00 C ATOM 823 CG2 VAL A 51 19.292 -0.623 -7.781 1.00 0.00 C ATOM 0 H VAL A 51 19.573 -2.567 -5.974 1.00 0.00 H new ATOM 0 HA VAL A 51 17.590 -0.764 -4.783 1.00 0.00 H new ATOM 0 HB VAL A 51 18.017 0.668 -6.680 1.00 0.00 H new ATOM 0 HG11 VAL A 51 20.369 1.241 -6.153 1.00 0.00 H new ATOM 0 HG12 VAL A 51 19.425 0.886 -4.688 1.00 0.00 H new ATOM 0 HG13 VAL A 51 20.555 -0.327 -5.334 1.00 0.00 H new ATOM 0 HG21 VAL A 51 19.814 0.188 -8.288 1.00 0.00 H new ATOM 0 HG22 VAL A 51 19.987 -1.443 -7.596 1.00 0.00 H new ATOM 0 HG23 VAL A 51 18.474 -0.975 -8.409 1.00 0.00 H new ATOM 833 N GLU A 52 16.833 -3.110 -6.604 1.00 0.00 N ATOM 834 CA GLU A 52 15.902 -3.887 -7.359 1.00 0.00 C ATOM 835 C GLU A 52 15.421 -4.986 -6.455 1.00 0.00 C ATOM 836 O GLU A 52 16.198 -5.472 -5.630 1.00 0.00 O ATOM 837 CB GLU A 52 16.605 -4.515 -8.546 1.00 0.00 C ATOM 838 CG GLU A 52 17.268 -3.546 -9.492 1.00 0.00 C ATOM 839 CD GLU A 52 18.153 -4.262 -10.458 1.00 0.00 C ATOM 840 OE1 GLU A 52 19.312 -4.552 -10.093 1.00 0.00 O ATOM 841 OE2 GLU A 52 17.706 -4.585 -11.571 1.00 0.00 O ATOM 0 H GLU A 52 17.520 -3.684 -6.116 1.00 0.00 H new ATOM 0 HA GLU A 52 15.081 -3.266 -7.717 1.00 0.00 H new ATOM 0 HB2 GLU A 52 17.360 -5.208 -8.175 1.00 0.00 H new ATOM 0 HB3 GLU A 52 15.879 -5.105 -9.106 1.00 0.00 H new ATOM 0 HG2 GLU A 52 16.508 -2.986 -10.036 1.00 0.00 H new ATOM 0 HG3 GLU A 52 17.853 -2.822 -8.925 1.00 0.00 H new ATOM 848 N LYS A 53 14.170 -5.374 -6.635 1.00 0.00 N ATOM 849 CA LYS A 53 13.474 -6.392 -5.846 1.00 0.00 C ATOM 850 C LYS A 53 13.796 -6.436 -4.353 1.00 0.00 C ATOM 851 O LYS A 53 14.584 -7.243 -3.887 1.00 0.00 O ATOM 852 CB LYS A 53 13.365 -7.816 -6.473 1.00 0.00 C ATOM 853 CG LYS A 53 14.654 -8.451 -6.817 1.00 0.00 C ATOM 854 CD LYS A 53 15.202 -7.894 -8.114 1.00 0.00 C ATOM 855 CE LYS A 53 16.644 -8.179 -8.239 1.00 0.00 C ATOM 856 NZ LYS A 53 17.182 -7.745 -9.551 1.00 0.00 N ATOM 0 H LYS A 53 13.581 -4.974 -7.365 1.00 0.00 H new ATOM 0 HA LYS A 53 12.463 -5.988 -5.905 1.00 0.00 H new ATOM 0 HB2 LYS A 53 12.834 -8.463 -5.775 1.00 0.00 H new ATOM 0 HB3 LYS A 53 12.757 -7.753 -7.375 1.00 0.00 H new ATOM 0 HG2 LYS A 53 15.372 -8.285 -6.013 1.00 0.00 H new ATOM 0 HG3 LYS A 53 14.520 -9.529 -6.907 1.00 0.00 H new ATOM 0 HD2 LYS A 53 14.666 -8.330 -8.957 1.00 0.00 H new ATOM 0 HD3 LYS A 53 15.035 -6.818 -8.152 1.00 0.00 H new ATOM 0 HE2 LYS A 53 17.185 -7.673 -7.439 1.00 0.00 H new ATOM 0 HE3 LYS A 53 16.815 -9.248 -8.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 17.707 -8.529 -9.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 16.397 -7.466 -10.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 17.820 -6.935 -9.414 1.00 0.00 H new ATOM 870 N TYR A 54 13.172 -5.564 -3.613 1.00 0.00 N ATOM 871 CA TYR A 54 13.241 -5.609 -2.164 1.00 0.00 C ATOM 872 C TYR A 54 11.914 -6.183 -1.716 1.00 0.00 C ATOM 873 O TYR A 54 11.453 -6.045 -0.573 1.00 0.00 O ATOM 874 CB TYR A 54 13.528 -4.232 -1.574 1.00 0.00 C ATOM 875 CG TYR A 54 14.771 -4.236 -0.696 1.00 0.00 C ATOM 876 CD1 TYR A 54 14.703 -4.528 0.660 1.00 0.00 C ATOM 877 CD2 TYR A 54 16.018 -3.959 -1.235 1.00 0.00 C ATOM 878 CE1 TYR A 54 15.849 -4.538 1.445 1.00 0.00 C ATOM 879 CE2 TYR A 54 17.161 -3.971 -0.453 1.00 0.00 C ATOM 880 CZ TYR A 54 17.072 -4.259 0.880 1.00 0.00 C ATOM 881 OH TYR A 54 18.215 -4.263 1.669 1.00 0.00 O ATOM 0 H TYR A 54 12.603 -4.804 -3.985 1.00 0.00 H new ATOM 0 HA TYR A 54 14.065 -6.230 -1.811 1.00 0.00 H new ATOM 0 HB2 TYR A 54 13.657 -3.511 -2.381 1.00 0.00 H new ATOM 0 HB3 TYR A 54 12.670 -3.903 -0.987 1.00 0.00 H new ATOM 0 HD1 TYR A 54 13.747 -4.750 1.110 1.00 0.00 H new ATOM 0 HD2 TYR A 54 16.100 -3.729 -2.287 1.00 0.00 H new ATOM 0 HE1 TYR A 54 15.780 -4.765 2.499 1.00 0.00 H new ATOM 0 HE2 TYR A 54 18.122 -3.753 -0.896 1.00 0.00 H new ATOM 0 HH TYR A 54 18.966 -3.895 1.159 1.00 0.00 H new ATOM 891 N GLY A 55 11.412 -6.974 -2.647 1.00 0.00 N ATOM 892 CA GLY A 55 10.175 -7.639 -2.615 1.00 0.00 C ATOM 893 C GLY A 55 10.089 -8.684 -1.522 1.00 0.00 C ATOM 894 O GLY A 55 9.064 -8.767 -0.867 1.00 0.00 O ATOM 0 H GLY A 55 11.924 -7.167 -3.508 1.00 0.00 H new ATOM 0 HA2 GLY A 55 9.380 -6.907 -2.473 1.00 0.00 H new ATOM 0 HA3 GLY A 55 10.001 -8.116 -3.580 1.00 0.00 H new ATOM 898 N PRO A 56 11.169 -9.499 -1.262 1.00 0.00 N ATOM 899 CA PRO A 56 11.156 -10.533 -0.221 1.00 0.00 C ATOM 900 C PRO A 56 10.770 -9.988 1.166 1.00 0.00 C ATOM 901 O PRO A 56 10.061 -10.661 1.940 1.00 0.00 O ATOM 902 CB PRO A 56 12.615 -11.024 -0.244 1.00 0.00 C ATOM 903 CG PRO A 56 13.359 -9.895 -0.823 1.00 0.00 C ATOM 904 CD PRO A 56 12.493 -9.512 -1.945 1.00 0.00 C ATOM 0 HA PRO A 56 10.415 -11.310 -0.407 1.00 0.00 H new ATOM 0 HB2 PRO A 56 12.971 -11.266 0.757 1.00 0.00 H new ATOM 0 HB3 PRO A 56 12.724 -11.925 -0.847 1.00 0.00 H new ATOM 0 HG2 PRO A 56 13.489 -9.081 -0.110 1.00 0.00 H new ATOM 0 HG3 PRO A 56 14.355 -10.188 -1.156 1.00 0.00 H new ATOM 0 HD2 PRO A 56 12.756 -8.539 -2.361 1.00 0.00 H new ATOM 0 HD3 PRO A 56 12.532 -10.230 -2.764 1.00 0.00 H new ATOM 912 N GLU A 57 11.202 -8.773 1.457 1.00 0.00 N ATOM 913 CA GLU A 57 10.905 -8.142 2.721 1.00 0.00 C ATOM 914 C GLU A 57 9.590 -7.386 2.640 1.00 0.00 C ATOM 915 O GLU A 57 8.742 -7.493 3.529 1.00 0.00 O ATOM 916 CB GLU A 57 12.041 -7.205 3.136 1.00 0.00 C ATOM 917 CG GLU A 57 13.366 -7.915 3.382 1.00 0.00 C ATOM 918 CD GLU A 57 13.261 -8.951 4.476 1.00 0.00 C ATOM 919 OE1 GLU A 57 13.329 -8.590 5.666 1.00 0.00 O ATOM 920 OE2 GLU A 57 13.070 -10.146 4.176 1.00 0.00 O ATOM 0 H GLU A 57 11.765 -8.203 0.825 1.00 0.00 H new ATOM 0 HA GLU A 57 10.810 -8.919 3.480 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.181 -6.453 2.359 1.00 0.00 H new ATOM 0 HB3 GLU A 57 11.749 -6.676 4.043 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.697 -8.394 2.460 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.126 -7.181 3.650 1.00 0.00 H new ATOM 927 N ALA A 58 9.407 -6.660 1.546 1.00 0.00 N ATOM 928 CA ALA A 58 8.210 -5.853 1.331 1.00 0.00 C ATOM 929 C ALA A 58 6.947 -6.703 1.348 1.00 0.00 C ATOM 930 O ALA A 58 5.980 -6.392 2.086 1.00 0.00 O ATOM 931 CB ALA A 58 8.319 -5.089 0.029 1.00 0.00 C ATOM 0 H ALA A 58 10.082 -6.613 0.783 1.00 0.00 H new ATOM 0 HA ALA A 58 8.137 -5.142 2.154 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.419 -4.491 -0.119 1.00 0.00 H new ATOM 0 HB2 ALA A 58 9.189 -4.433 0.064 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.427 -5.792 -0.797 1.00 0.00 H new ATOM 937 N SER A 59 6.978 -7.807 0.590 1.00 0.00 N ATOM 938 CA SER A 59 5.854 -8.704 0.485 1.00 0.00 C ATOM 939 C SER A 59 5.505 -9.217 1.860 1.00 0.00 C ATOM 940 O SER A 59 4.354 -9.229 2.237 1.00 0.00 O ATOM 941 CB SER A 59 6.173 -9.890 -0.449 1.00 0.00 C ATOM 942 OG SER A 59 5.005 -10.630 -0.777 1.00 0.00 O ATOM 0 H SER A 59 7.788 -8.090 0.039 1.00 0.00 H new ATOM 0 HA SER A 59 5.010 -8.160 0.061 1.00 0.00 H new ATOM 0 HB2 SER A 59 6.637 -9.519 -1.363 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.897 -10.547 0.032 1.00 0.00 H new ATOM 0 HG SER A 59 4.935 -10.717 -1.751 1.00 0.00 H new ATOM 948 N ALA A 60 6.526 -9.535 2.640 1.00 0.00 N ATOM 949 CA ALA A 60 6.318 -10.097 3.941 1.00 0.00 C ATOM 950 C ALA A 60 5.942 -9.053 4.969 1.00 0.00 C ATOM 951 O ALA A 60 5.296 -9.371 5.942 1.00 0.00 O ATOM 952 CB ALA A 60 7.489 -10.939 4.386 1.00 0.00 C ATOM 0 H ALA A 60 7.505 -9.408 2.383 1.00 0.00 H new ATOM 0 HA ALA A 60 5.461 -10.766 3.857 1.00 0.00 H new ATOM 0 HB1 ALA A 60 7.289 -11.345 5.377 1.00 0.00 H new ATOM 0 HB2 ALA A 60 7.637 -11.757 3.681 1.00 0.00 H new ATOM 0 HB3 ALA A 60 8.388 -10.323 4.421 1.00 0.00 H new ATOM 958 N PHE A 61 6.348 -7.813 4.769 1.00 0.00 N ATOM 959 CA PHE A 61 5.925 -6.759 5.670 1.00 0.00 C ATOM 960 C PHE A 61 4.456 -6.498 5.449 1.00 0.00 C ATOM 961 O PHE A 61 3.637 -6.483 6.431 1.00 0.00 O ATOM 962 CB PHE A 61 6.704 -5.477 5.447 1.00 0.00 C ATOM 963 CG PHE A 61 6.486 -4.466 6.541 1.00 0.00 C ATOM 964 CD1 PHE A 61 5.394 -3.620 6.519 1.00 0.00 C ATOM 965 CD2 PHE A 61 7.371 -4.374 7.593 1.00 0.00 C ATOM 966 CE1 PHE A 61 5.194 -2.701 7.519 1.00 0.00 C ATOM 967 CE2 PHE A 61 7.177 -3.455 8.603 1.00 0.00 C ATOM 968 CZ PHE A 61 6.087 -2.612 8.564 1.00 0.00 C ATOM 0 H PHE A 61 6.957 -7.515 4.007 1.00 0.00 H new ATOM 0 HA PHE A 61 6.113 -7.085 6.693 1.00 0.00 H new ATOM 0 HB2 PHE A 61 7.767 -5.710 5.380 1.00 0.00 H new ATOM 0 HB3 PHE A 61 6.412 -5.041 4.492 1.00 0.00 H new ATOM 0 HD1 PHE A 61 4.688 -3.682 5.704 1.00 0.00 H new ATOM 0 HD2 PHE A 61 8.228 -5.030 7.627 1.00 0.00 H new ATOM 0 HE1 PHE A 61 4.335 -2.047 7.486 1.00 0.00 H new ATOM 0 HE2 PHE A 61 7.878 -3.396 9.423 1.00 0.00 H new ATOM 0 HZ PHE A 61 5.934 -1.886 9.349 1.00 0.00 H new ATOM 978 N THR A 62 4.098 -6.299 4.173 1.00 0.00 N ATOM 979 CA THR A 62 2.724 -6.108 3.824 1.00 0.00 C ATOM 980 C THR A 62 1.925 -7.297 4.314 1.00 0.00 C ATOM 981 O THR A 62 0.909 -7.125 5.025 1.00 0.00 O ATOM 982 CB THR A 62 2.521 -5.891 2.293 1.00 0.00 C ATOM 983 OG1 THR A 62 3.190 -4.698 1.884 1.00 0.00 O ATOM 984 CG2 THR A 62 1.044 -5.780 1.974 1.00 0.00 C ATOM 0 H THR A 62 4.749 -6.270 3.388 1.00 0.00 H new ATOM 0 HA THR A 62 2.371 -5.197 4.308 1.00 0.00 H new ATOM 0 HB THR A 62 2.937 -6.743 1.756 1.00 0.00 H new ATOM 0 HG1 THR A 62 3.066 -4.004 2.564 1.00 0.00 H new ATOM 0 HG21 THR A 62 0.914 -5.629 0.902 1.00 0.00 H new ATOM 0 HG22 THR A 62 0.537 -6.697 2.275 1.00 0.00 H new ATOM 0 HG23 THR A 62 0.618 -4.935 2.514 1.00 0.00 H new ATOM 992 N LYS A 63 2.466 -8.492 4.048 1.00 0.00 N ATOM 993 CA LYS A 63 1.828 -9.715 4.421 1.00 0.00 C ATOM 994 C LYS A 63 1.653 -9.803 5.902 1.00 0.00 C ATOM 995 O LYS A 63 0.585 -10.124 6.332 1.00 0.00 O ATOM 996 CB LYS A 63 2.550 -10.948 3.850 1.00 0.00 C ATOM 997 CG LYS A 63 3.188 -11.854 4.847 1.00 0.00 C ATOM 998 CD LYS A 63 3.946 -12.929 4.167 1.00 0.00 C ATOM 999 CE LYS A 63 4.442 -13.912 5.173 1.00 0.00 C ATOM 1000 NZ LYS A 63 5.143 -15.038 4.535 1.00 0.00 N ATOM 0 H LYS A 63 3.358 -8.615 3.568 1.00 0.00 H new ATOM 0 HA LYS A 63 0.834 -9.710 3.974 1.00 0.00 H new ATOM 0 HB2 LYS A 63 1.832 -11.528 3.269 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.318 -10.605 3.157 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.856 -11.282 5.490 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.424 -12.291 5.490 1.00 0.00 H new ATOM 0 HD2 LYS A 63 3.309 -13.431 3.438 1.00 0.00 H new ATOM 0 HD3 LYS A 63 4.785 -12.503 3.617 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.115 -13.412 5.869 1.00 0.00 H new ATOM 0 HE3 LYS A 63 3.603 -14.290 5.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 5.473 -15.700 5.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 4.493 -15.531 3.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 5.959 -14.680 3.998 1.00 0.00 H new ATOM 1014 N LYS A 64 2.694 -9.452 6.692 1.00 0.00 N ATOM 1015 CA LYS A 64 2.577 -9.533 8.096 1.00 0.00 C ATOM 1016 C LYS A 64 1.504 -8.638 8.541 1.00 0.00 C ATOM 1017 O LYS A 64 0.584 -9.116 9.188 1.00 0.00 O ATOM 1018 CB LYS A 64 3.944 -9.392 8.862 1.00 0.00 C ATOM 1019 CG LYS A 64 4.599 -8.013 8.959 1.00 0.00 C ATOM 1020 CD LYS A 64 3.933 -7.169 10.014 1.00 0.00 C ATOM 1021 CE LYS A 64 4.676 -5.866 10.280 1.00 0.00 C ATOM 1022 NZ LYS A 64 5.986 -6.100 10.912 1.00 0.00 N ATOM 0 H LYS A 64 3.596 -9.119 6.351 1.00 0.00 H new ATOM 0 HA LYS A 64 2.283 -10.546 8.370 1.00 0.00 H new ATOM 0 HB2 LYS A 64 3.791 -9.756 9.878 1.00 0.00 H new ATOM 0 HB3 LYS A 64 4.659 -10.064 8.386 1.00 0.00 H new ATOM 0 HG2 LYS A 64 5.657 -8.126 9.194 1.00 0.00 H new ATOM 0 HG3 LYS A 64 4.538 -7.509 7.994 1.00 0.00 H new ATOM 0 HD2 LYS A 64 2.913 -6.944 9.703 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.865 -7.739 10.940 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.816 -5.330 9.341 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.071 -5.228 10.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 6.354 -5.204 11.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.880 -6.785 11.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 6.650 -6.476 10.206 1.00 0.00 H new ATOM 1036 N MET A 65 1.506 -7.368 8.085 1.00 0.00 N ATOM 1037 CA MET A 65 0.457 -6.478 8.538 1.00 0.00 C ATOM 1038 C MET A 65 -0.910 -6.951 8.181 1.00 0.00 C ATOM 1039 O MET A 65 -1.752 -7.092 9.059 1.00 0.00 O ATOM 1040 CB MET A 65 0.666 -5.042 8.176 1.00 0.00 C ATOM 1041 CG MET A 65 1.861 -4.464 8.887 1.00 0.00 C ATOM 1042 SD MET A 65 1.854 -2.676 9.074 1.00 0.00 S ATOM 1043 CE MET A 65 1.589 -2.139 7.408 1.00 0.00 C ATOM 0 H MET A 65 2.187 -6.967 7.440 1.00 0.00 H new ATOM 0 HA MET A 65 0.530 -6.517 9.625 1.00 0.00 H new ATOM 0 HB2 MET A 65 0.804 -4.953 7.098 1.00 0.00 H new ATOM 0 HB3 MET A 65 -0.224 -4.468 8.432 1.00 0.00 H new ATOM 0 HG2 MET A 65 1.928 -4.916 9.877 1.00 0.00 H new ATOM 0 HG3 MET A 65 2.761 -4.752 8.344 1.00 0.00 H new ATOM 0 HE1 MET A 65 1.563 -1.050 7.377 1.00 0.00 H new ATOM 0 HE2 MET A 65 2.400 -2.501 6.776 1.00 0.00 H new ATOM 0 HE3 MET A 65 0.641 -2.536 7.044 1.00 0.00 H new ATOM 1053 N VAL A 66 -1.125 -7.297 6.938 1.00 0.00 N ATOM 1054 CA VAL A 66 -2.441 -7.759 6.555 1.00 0.00 C ATOM 1055 C VAL A 66 -2.811 -9.115 7.196 1.00 0.00 C ATOM 1056 O VAL A 66 -3.990 -9.395 7.410 1.00 0.00 O ATOM 1057 CB VAL A 66 -2.696 -7.736 5.028 1.00 0.00 C ATOM 1058 CG1 VAL A 66 -2.775 -6.302 4.531 1.00 0.00 C ATOM 1059 CG2 VAL A 66 -1.613 -8.469 4.281 1.00 0.00 C ATOM 0 H VAL A 66 -0.431 -7.271 6.191 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.127 -7.021 6.971 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.644 -8.240 4.842 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.955 -6.299 3.456 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.591 -5.786 5.037 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.836 -5.791 4.743 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.821 -8.435 3.212 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.651 -7.996 4.479 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.582 -9.507 4.611 1.00 0.00 H new ATOM 1069 N GLU A 67 -1.811 -9.933 7.539 1.00 0.00 N ATOM 1070 CA GLU A 67 -2.059 -11.187 8.236 1.00 0.00 C ATOM 1071 C GLU A 67 -2.411 -10.949 9.699 1.00 0.00 C ATOM 1072 O GLU A 67 -3.297 -11.625 10.245 1.00 0.00 O ATOM 1073 CB GLU A 67 -0.884 -12.181 8.179 1.00 0.00 C ATOM 1074 CG GLU A 67 -0.575 -12.832 6.827 1.00 0.00 C ATOM 1075 CD GLU A 67 0.246 -14.096 6.982 1.00 0.00 C ATOM 1076 OE1 GLU A 67 -0.348 -15.185 7.121 1.00 0.00 O ATOM 1077 OE2 GLU A 67 1.497 -14.039 6.969 1.00 0.00 O ATOM 0 H GLU A 67 -0.828 -9.745 7.344 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.900 -11.632 7.704 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.013 -11.661 8.515 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.080 -12.976 8.898 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.508 -13.066 6.315 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.036 -12.124 6.198 1.00 0.00 H new ATOM 1084 N ASN A 68 -1.740 -9.997 10.341 1.00 0.00 N ATOM 1085 CA ASN A 68 -1.989 -9.762 11.766 1.00 0.00 C ATOM 1086 C ASN A 68 -3.068 -8.789 11.992 1.00 0.00 C ATOM 1087 O ASN A 68 -3.572 -8.667 13.112 1.00 0.00 O ATOM 1088 CB ASN A 68 -0.757 -9.320 12.577 1.00 0.00 C ATOM 1089 CG ASN A 68 -0.146 -7.996 12.206 1.00 0.00 C ATOM 1090 OD1 ASN A 68 -0.608 -6.925 12.612 1.00 0.00 O ATOM 1091 ND2 ASN A 68 0.968 -8.087 11.537 1.00 0.00 N ATOM 0 H ASN A 68 -1.039 -9.390 9.916 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.284 -10.746 12.130 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -1.037 -9.283 13.630 1.00 0.00 H new ATOM 0 HB3 ASN A 68 0.010 -10.089 12.478 1.00 0.00 H new ATOM 0 HD21 ASN A 68 1.505 -7.246 11.324 1.00 0.00 H new ATOM 0 HD22 ASN A 68 1.303 -8.999 11.226 1.00 0.00 H new ATOM 1098 N ALA A 69 -3.422 -8.064 10.978 1.00 0.00 N ATOM 1099 CA ALA A 69 -4.396 -7.111 11.136 1.00 0.00 C ATOM 1100 C ALA A 69 -5.743 -7.747 11.221 1.00 0.00 C ATOM 1101 O ALA A 69 -6.038 -8.732 10.543 1.00 0.00 O ATOM 1102 CB ALA A 69 -4.362 -6.104 10.037 1.00 0.00 C ATOM 0 H ALA A 69 -3.030 -8.138 10.039 1.00 0.00 H new ATOM 0 HA ALA A 69 -4.196 -6.587 12.071 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -5.148 -5.365 10.196 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.392 -5.606 10.029 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.521 -6.603 9.081 1.00 0.00 H new ATOM 1108 N LYS A 70 -6.524 -7.221 12.060 1.00 0.00 N ATOM 1109 CA LYS A 70 -7.871 -7.659 12.227 1.00 0.00 C ATOM 1110 C LYS A 70 -8.780 -6.706 11.494 1.00 0.00 C ATOM 1111 O LYS A 70 -9.952 -6.983 11.277 1.00 0.00 O ATOM 1112 CB LYS A 70 -8.266 -7.705 13.704 1.00 0.00 C ATOM 1113 CG LYS A 70 -7.605 -8.731 14.571 1.00 0.00 C ATOM 1114 CD LYS A 70 -6.186 -8.320 14.870 1.00 0.00 C ATOM 1115 CE LYS A 70 -5.550 -9.223 15.851 1.00 0.00 C ATOM 1116 NZ LYS A 70 -5.376 -10.601 15.340 1.00 0.00 N ATOM 0 H LYS A 70 -6.257 -6.453 12.675 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.963 -8.668 11.825 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -8.067 -6.724 14.135 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.343 -7.864 13.758 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -8.162 -8.846 15.501 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -7.614 -9.700 14.072 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.606 -8.319 13.947 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.176 -7.300 15.255 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.577 -8.819 16.131 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -6.156 -9.251 16.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -4.850 -11.166 16.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.309 -11.032 15.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -4.847 -10.575 14.445 1.00 0.00 H new ATOM 1130 N LYS A 71 -8.222 -5.582 11.117 1.00 0.00 N ATOM 1131 CA LYS A 71 -8.970 -4.553 10.413 1.00 0.00 C ATOM 1132 C LYS A 71 -8.292 -4.238 9.135 1.00 0.00 C ATOM 1133 O LYS A 71 -7.414 -3.385 9.108 1.00 0.00 O ATOM 1134 CB LYS A 71 -8.983 -3.253 11.189 1.00 0.00 C ATOM 1135 CG LYS A 71 -10.083 -2.299 10.806 1.00 0.00 C ATOM 1136 CD LYS A 71 -9.946 -1.005 11.572 1.00 0.00 C ATOM 1137 CE LYS A 71 -11.096 -0.063 11.277 1.00 0.00 C ATOM 1138 NZ LYS A 71 -10.918 1.273 11.892 1.00 0.00 N ATOM 0 H LYS A 71 -7.243 -5.349 11.285 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.981 -4.935 10.273 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -9.073 -3.481 12.251 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -8.024 -2.754 11.050 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.045 -2.101 9.735 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -11.053 -2.751 11.012 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -9.911 -1.215 12.641 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -9.003 -0.524 11.311 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -11.199 0.050 10.198 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -12.024 -0.505 11.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -11.733 1.875 11.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.847 1.173 12.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -10.048 1.711 11.526 1.00 0.00 H new ATOM 1152 N ILE A 72 -8.576 -4.920 8.101 1.00 0.00 N ATOM 1153 CA ILE A 72 -8.007 -4.483 6.902 1.00 0.00 C ATOM 1154 C ILE A 72 -8.970 -3.667 6.157 1.00 0.00 C ATOM 1155 O ILE A 72 -9.978 -4.149 5.663 1.00 0.00 O ATOM 1156 CB ILE A 72 -7.390 -5.557 6.016 1.00 0.00 C ATOM 1157 CG1 ILE A 72 -6.341 -6.315 6.803 1.00 0.00 C ATOM 1158 CG2 ILE A 72 -6.757 -4.907 4.780 1.00 0.00 C ATOM 1159 CD1 ILE A 72 -6.849 -7.580 7.453 1.00 0.00 C ATOM 0 H ILE A 72 -9.172 -5.747 8.058 1.00 0.00 H new ATOM 0 HA ILE A 72 -7.149 -3.882 7.204 1.00 0.00 H new ATOM 0 HB ILE A 72 -8.164 -6.252 5.690 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.516 -6.568 6.137 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.938 -5.660 7.575 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -6.317 -5.679 4.148 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -7.522 -4.372 4.218 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.981 -4.208 5.093 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -6.036 -8.062 7.996 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -7.654 -7.335 8.146 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -7.225 -8.258 6.686 1.00 0.00 H new ATOM 1171 N GLU A 73 -8.725 -2.440 6.169 1.00 0.00 N ATOM 1172 CA GLU A 73 -9.505 -1.565 5.362 1.00 0.00 C ATOM 1173 C GLU A 73 -8.738 -1.033 4.230 1.00 0.00 C ATOM 1174 O GLU A 73 -7.507 -1.012 4.228 1.00 0.00 O ATOM 1175 CB GLU A 73 -10.107 -0.438 6.094 1.00 0.00 C ATOM 1176 CG GLU A 73 -11.329 -0.774 6.896 1.00 0.00 C ATOM 1177 CD GLU A 73 -11.870 0.416 7.617 1.00 0.00 C ATOM 1178 OE1 GLU A 73 -11.175 0.955 8.477 1.00 0.00 O ATOM 1179 OE2 GLU A 73 -13.022 0.831 7.345 1.00 0.00 O ATOM 0 H GLU A 73 -7.994 -1.993 6.722 1.00 0.00 H new ATOM 0 HA GLU A 73 -10.318 -2.195 5.002 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -9.356 -0.019 6.764 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -10.366 0.342 5.378 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -12.096 -1.177 6.235 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -11.086 -1.555 7.617 1.00 0.00 H new ATOM 1186 N VAL A 74 -9.458 -0.586 3.284 1.00 0.00 N ATOM 1187 CA VAL A 74 -8.918 -0.036 2.096 1.00 0.00 C ATOM 1188 C VAL A 74 -9.627 1.262 1.808 1.00 0.00 C ATOM 1189 O VAL A 74 -10.767 1.411 2.135 1.00 0.00 O ATOM 1190 CB VAL A 74 -9.089 -1.015 0.916 1.00 0.00 C ATOM 1191 CG1 VAL A 74 -8.254 -2.254 1.104 1.00 0.00 C ATOM 1192 CG2 VAL A 74 -10.542 -1.422 0.828 1.00 0.00 C ATOM 0 H VAL A 74 -10.478 -0.589 3.308 1.00 0.00 H new ATOM 0 HA VAL A 74 -7.851 0.143 2.226 1.00 0.00 H new ATOM 0 HB VAL A 74 -8.764 -0.513 0.004 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -8.398 -2.922 0.255 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -7.202 -1.977 1.173 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -8.557 -2.761 2.020 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -10.676 -2.115 -0.003 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -10.841 -1.908 1.757 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -11.158 -0.538 0.666 1.00 0.00 H new ATOM 1202 N GLU A 75 -8.958 2.172 1.223 1.00 0.00 N ATOM 1203 CA GLU A 75 -9.506 3.460 0.969 1.00 0.00 C ATOM 1204 C GLU A 75 -9.207 3.835 -0.446 1.00 0.00 C ATOM 1205 O GLU A 75 -8.081 4.186 -0.769 1.00 0.00 O ATOM 1206 CB GLU A 75 -8.874 4.440 1.939 1.00 0.00 C ATOM 1207 CG GLU A 75 -9.492 5.817 1.998 1.00 0.00 C ATOM 1208 CD GLU A 75 -8.949 6.624 3.155 1.00 0.00 C ATOM 1209 OE1 GLU A 75 -7.830 7.156 3.071 1.00 0.00 O ATOM 1210 OE2 GLU A 75 -9.628 6.719 4.190 1.00 0.00 O ATOM 0 H GLU A 75 -7.999 2.052 0.898 1.00 0.00 H new ATOM 0 HA GLU A 75 -10.587 3.469 1.108 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.912 4.005 2.938 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -7.821 4.549 1.678 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -9.297 6.344 1.064 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -10.574 5.727 2.093 1.00 0.00 H new ATOM 1217 N PHE A 76 -10.168 3.665 -1.310 1.00 0.00 N ATOM 1218 CA PHE A 76 -9.973 4.041 -2.675 1.00 0.00 C ATOM 1219 C PHE A 76 -9.809 5.530 -2.779 1.00 0.00 C ATOM 1220 O PHE A 76 -10.502 6.294 -2.094 1.00 0.00 O ATOM 1221 CB PHE A 76 -11.076 3.520 -3.565 1.00 0.00 C ATOM 1222 CG PHE A 76 -11.036 2.033 -3.742 1.00 0.00 C ATOM 1223 CD1 PHE A 76 -10.222 1.487 -4.707 1.00 0.00 C ATOM 1224 CD2 PHE A 76 -11.793 1.182 -2.950 1.00 0.00 C ATOM 1225 CE1 PHE A 76 -10.151 0.138 -4.895 1.00 0.00 C ATOM 1226 CE2 PHE A 76 -11.727 -0.180 -3.132 1.00 0.00 C ATOM 1227 CZ PHE A 76 -10.904 -0.705 -4.107 1.00 0.00 C ATOM 0 H PHE A 76 -11.084 3.272 -1.093 1.00 0.00 H new ATOM 0 HA PHE A 76 -9.055 3.576 -3.034 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -12.040 3.804 -3.143 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.003 3.998 -4.542 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -9.627 2.140 -5.328 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -12.438 1.591 -2.186 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -9.506 -0.269 -5.660 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.319 -0.838 -2.512 1.00 0.00 H new ATOM 0 HZ PHE A 76 -10.850 -1.774 -4.252 1.00 0.00 H new ATOM 1237 N ASP A 77 -8.901 5.937 -3.610 1.00 0.00 N ATOM 1238 CA ASP A 77 -8.530 7.341 -3.678 1.00 0.00 C ATOM 1239 C ASP A 77 -9.406 8.066 -4.679 1.00 0.00 C ATOM 1240 O ASP A 77 -10.472 7.574 -5.045 1.00 0.00 O ATOM 1241 CB ASP A 77 -7.097 7.476 -4.062 1.00 0.00 C ATOM 1242 CG ASP A 77 -6.416 8.760 -3.487 1.00 0.00 C ATOM 1243 OD1 ASP A 77 -6.636 9.854 -4.042 1.00 0.00 O ATOM 1244 OD2 ASP A 77 -5.644 8.685 -2.520 1.00 0.00 O ATOM 0 H ASP A 77 -8.396 5.329 -4.255 1.00 0.00 H new ATOM 0 HA ASP A 77 -8.675 7.788 -2.695 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.552 6.598 -3.715 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -7.020 7.489 -5.149 1.00 0.00 H new ATOM 1249 N LYS A 78 -8.979 9.211 -5.137 1.00 0.00 N ATOM 1250 CA LYS A 78 -9.796 9.993 -6.031 1.00 0.00 C ATOM 1251 C LYS A 78 -9.286 9.967 -7.458 1.00 0.00 C ATOM 1252 O LYS A 78 -9.750 10.732 -8.316 1.00 0.00 O ATOM 1253 CB LYS A 78 -9.966 11.422 -5.513 1.00 0.00 C ATOM 1254 CG LYS A 78 -8.650 12.197 -5.440 1.00 0.00 C ATOM 1255 CD LYS A 78 -8.815 13.590 -4.853 1.00 0.00 C ATOM 1256 CE LYS A 78 -9.196 13.543 -3.384 1.00 0.00 C ATOM 1257 NZ LYS A 78 -9.365 14.903 -2.818 1.00 0.00 N ATOM 0 H LYS A 78 -8.075 9.624 -4.909 1.00 0.00 H new ATOM 0 HA LYS A 78 -10.781 9.527 -6.053 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -10.659 11.957 -6.162 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -10.417 11.391 -4.521 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -7.937 11.636 -4.836 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -8.226 12.278 -6.441 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -7.884 14.146 -4.969 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -9.581 14.130 -5.410 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -10.123 12.982 -3.266 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -8.427 13.009 -2.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -9.355 14.851 -1.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -8.587 15.513 -3.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -10.272 15.301 -3.136 1.00 0.00 H new ATOM 1271 N GLY A 79 -8.396 9.073 -7.727 1.00 0.00 N ATOM 1272 CA GLY A 79 -7.826 8.983 -9.022 1.00 0.00 C ATOM 1273 C GLY A 79 -8.320 7.839 -9.855 1.00 0.00 C ATOM 1274 O GLY A 79 -8.758 8.021 -10.981 1.00 0.00 O ATOM 0 H GLY A 79 -8.046 8.388 -7.057 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.024 9.913 -9.555 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.744 8.898 -8.921 1.00 0.00 H new ATOM 1278 N GLN A 80 -8.238 6.658 -9.288 1.00 0.00 N ATOM 1279 CA GLN A 80 -8.467 5.428 -9.994 1.00 0.00 C ATOM 1280 C GLN A 80 -8.829 4.407 -8.952 1.00 0.00 C ATOM 1281 O GLN A 80 -8.851 4.744 -7.771 1.00 0.00 O ATOM 1282 CB GLN A 80 -7.143 5.010 -10.622 1.00 0.00 C ATOM 1283 CG GLN A 80 -7.260 4.205 -11.893 1.00 0.00 C ATOM 1284 CD GLN A 80 -7.726 5.053 -13.050 1.00 0.00 C ATOM 1285 OE1 GLN A 80 -8.411 4.583 -13.952 1.00 0.00 O ATOM 1286 NE2 GLN A 80 -7.301 6.297 -13.054 1.00 0.00 N ATOM 0 H GLN A 80 -8.005 6.527 -8.304 1.00 0.00 H new ATOM 0 HA GLN A 80 -9.242 5.524 -10.754 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -6.559 5.907 -10.831 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.581 4.427 -9.892 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -6.294 3.761 -12.133 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -7.959 3.383 -11.740 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -6.733 6.644 -12.281 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -7.539 6.915 -13.830 1.00 0.00 H new ATOM 1295 N ARG A 81 -9.150 3.204 -9.362 1.00 0.00 N ATOM 1296 CA ARG A 81 -9.412 2.116 -8.416 1.00 0.00 C ATOM 1297 C ARG A 81 -8.539 0.909 -8.732 1.00 0.00 C ATOM 1298 O ARG A 81 -8.392 0.024 -7.934 1.00 0.00 O ATOM 1299 CB ARG A 81 -10.878 1.688 -8.461 1.00 0.00 C ATOM 1300 CG ARG A 81 -11.865 2.815 -8.280 1.00 0.00 C ATOM 1301 CD ARG A 81 -11.628 3.553 -6.985 1.00 0.00 C ATOM 1302 NE ARG A 81 -12.665 4.547 -6.760 1.00 0.00 N ATOM 1303 CZ ARG A 81 -12.536 5.840 -7.022 1.00 0.00 C ATOM 1304 NH1 ARG A 81 -11.373 6.319 -7.453 1.00 0.00 N ATOM 1305 NH2 ARG A 81 -13.562 6.652 -6.844 1.00 0.00 N ATOM 0 H ARG A 81 -9.239 2.941 -10.343 1.00 0.00 H new ATOM 0 HA ARG A 81 -9.178 2.489 -7.419 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -11.072 1.202 -9.417 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -11.050 0.943 -7.684 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -11.784 3.509 -9.116 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -12.880 2.417 -8.293 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -11.610 2.845 -6.156 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -10.652 4.038 -7.011 1.00 0.00 H new ATOM 0 HE ARG A 81 -13.553 4.227 -6.374 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -10.579 5.691 -7.582 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -11.274 7.314 -7.654 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -14.451 6.284 -6.506 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -13.465 7.647 -7.045 1.00 0.00 H new ATOM 1319 N THR A 82 -7.987 0.899 -9.907 1.00 0.00 N ATOM 1320 CA THR A 82 -7.149 -0.180 -10.420 1.00 0.00 C ATOM 1321 C THR A 82 -5.881 0.349 -11.195 1.00 0.00 C ATOM 1322 O THR A 82 -5.979 1.290 -11.984 1.00 0.00 O ATOM 1323 CB THR A 82 -7.980 -1.099 -11.333 1.00 0.00 C ATOM 1324 OG1 THR A 82 -8.673 -0.311 -12.315 1.00 0.00 O ATOM 1325 CG2 THR A 82 -8.986 -1.928 -10.536 1.00 0.00 C ATOM 0 H THR A 82 -8.103 1.664 -10.572 1.00 0.00 H new ATOM 0 HA THR A 82 -6.785 -0.741 -9.559 1.00 0.00 H new ATOM 0 HB THR A 82 -7.294 -1.788 -11.826 1.00 0.00 H new ATOM 0 HG1 THR A 82 -9.199 -0.900 -12.895 1.00 0.00 H new ATOM 0 HG21 THR A 82 -9.553 -2.564 -11.216 1.00 0.00 H new ATOM 0 HG22 THR A 82 -8.455 -2.550 -9.815 1.00 0.00 H new ATOM 0 HG23 THR A 82 -9.668 -1.262 -10.007 1.00 0.00 H new ATOM 1333 N ASP A 83 -4.694 -0.250 -10.930 1.00 0.00 N ATOM 1334 CA ASP A 83 -3.433 0.182 -11.571 1.00 0.00 C ATOM 1335 C ASP A 83 -2.760 -0.871 -12.522 1.00 0.00 C ATOM 1336 O ASP A 83 -3.329 -1.205 -13.541 1.00 0.00 O ATOM 1337 CB ASP A 83 -2.465 0.740 -10.505 1.00 0.00 C ATOM 1338 CG ASP A 83 -1.116 1.251 -10.993 1.00 0.00 C ATOM 1339 OD1 ASP A 83 -1.030 2.369 -11.503 1.00 0.00 O ATOM 1340 OD2 ASP A 83 -0.122 0.530 -10.811 1.00 0.00 O ATOM 0 H ASP A 83 -4.586 -1.029 -10.280 1.00 0.00 H new ATOM 0 HA ASP A 83 -3.703 0.982 -12.260 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -2.968 1.556 -9.985 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -2.284 -0.043 -9.769 1.00 0.00 H new ATOM 1345 N LYS A 84 -1.596 -1.434 -12.097 1.00 0.00 N ATOM 1346 CA LYS A 84 -0.667 -2.309 -12.905 1.00 0.00 C ATOM 1347 C LYS A 84 -1.354 -3.199 -13.935 1.00 0.00 C ATOM 1348 O LYS A 84 -1.213 -2.999 -15.135 1.00 0.00 O ATOM 1349 CB LYS A 84 0.204 -3.170 -11.974 1.00 0.00 C ATOM 1350 CG LYS A 84 1.079 -2.414 -10.955 1.00 0.00 C ATOM 1351 CD LYS A 84 2.395 -1.840 -11.527 1.00 0.00 C ATOM 1352 CE LYS A 84 2.207 -0.740 -12.567 1.00 0.00 C ATOM 1353 NZ LYS A 84 3.489 -0.183 -13.023 1.00 0.00 N ATOM 0 H LYS A 84 -1.255 -1.292 -11.146 1.00 0.00 H new ATOM 0 HA LYS A 84 -0.052 -1.614 -13.477 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.450 -3.848 -11.425 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.856 -3.787 -12.592 1.00 0.00 H new ATOM 0 HG2 LYS A 84 0.495 -1.595 -10.534 1.00 0.00 H new ATOM 0 HG3 LYS A 84 1.321 -3.089 -10.134 1.00 0.00 H new ATOM 0 HD2 LYS A 84 2.993 -1.447 -10.705 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.966 -2.653 -11.976 1.00 0.00 H new ATOM 0 HE2 LYS A 84 1.662 -1.140 -13.422 1.00 0.00 H new ATOM 0 HE3 LYS A 84 1.596 0.057 -12.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 3.313 0.561 -13.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 3.999 0.222 -12.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.063 -0.938 -13.451 1.00 0.00 H new ATOM 1367 N TYR A 85 -2.049 -4.182 -13.459 1.00 0.00 N ATOM 1368 CA TYR A 85 -2.833 -5.070 -14.300 1.00 0.00 C ATOM 1369 C TYR A 85 -4.249 -4.875 -13.873 1.00 0.00 C ATOM 1370 O TYR A 85 -5.091 -5.764 -13.949 1.00 0.00 O ATOM 1371 CB TYR A 85 -2.419 -6.530 -14.090 1.00 0.00 C ATOM 1372 CG TYR A 85 -1.006 -6.860 -14.516 1.00 0.00 C ATOM 1373 CD1 TYR A 85 -0.720 -7.190 -15.830 1.00 0.00 C ATOM 1374 CD2 TYR A 85 0.033 -6.863 -13.600 1.00 0.00 C ATOM 1375 CE1 TYR A 85 0.561 -7.516 -16.220 1.00 0.00 C ATOM 1376 CE2 TYR A 85 1.320 -7.182 -13.980 1.00 0.00 C ATOM 1377 CZ TYR A 85 1.579 -7.509 -15.292 1.00 0.00 C ATOM 1378 OH TYR A 85 2.856 -7.849 -15.676 1.00 0.00 O ATOM 0 H TYR A 85 -2.098 -4.405 -12.465 1.00 0.00 H new ATOM 0 HA TYR A 85 -2.686 -4.847 -15.357 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -2.531 -6.776 -13.034 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -3.108 -7.170 -14.641 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -1.514 -7.192 -16.562 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -0.168 -6.611 -12.569 1.00 0.00 H new ATOM 0 HE1 TYR A 85 0.766 -7.776 -17.248 1.00 0.00 H new ATOM 0 HE2 TYR A 85 2.119 -7.175 -13.253 1.00 0.00 H new ATOM 0 HH TYR A 85 3.456 -7.793 -14.903 1.00 0.00 H new ATOM 1388 N GLY A 86 -4.497 -3.669 -13.436 1.00 0.00 N ATOM 1389 CA GLY A 86 -5.731 -3.331 -12.866 1.00 0.00 C ATOM 1390 C GLY A 86 -5.813 -3.852 -11.458 1.00 0.00 C ATOM 1391 O GLY A 86 -6.800 -4.445 -11.050 1.00 0.00 O ATOM 0 H GLY A 86 -3.827 -2.901 -13.476 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -5.857 -2.248 -12.869 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -6.542 -3.747 -13.463 1.00 0.00 H new ATOM 1395 N ARG A 87 -4.725 -3.684 -10.732 1.00 0.00 N ATOM 1396 CA ARG A 87 -4.693 -4.040 -9.325 1.00 0.00 C ATOM 1397 C ARG A 87 -5.407 -2.933 -8.589 1.00 0.00 C ATOM 1398 O ARG A 87 -5.334 -1.838 -9.014 1.00 0.00 O ATOM 1399 CB ARG A 87 -3.263 -4.148 -8.822 1.00 0.00 C ATOM 1400 CG ARG A 87 -2.364 -5.063 -9.627 1.00 0.00 C ATOM 1401 CD ARG A 87 -2.951 -6.438 -9.779 1.00 0.00 C ATOM 1402 NE ARG A 87 -2.038 -7.354 -10.444 1.00 0.00 N ATOM 1403 CZ ARG A 87 -2.410 -8.490 -11.054 1.00 0.00 C ATOM 1404 NH1 ARG A 87 -3.705 -8.784 -11.188 1.00 0.00 N ATOM 1405 NH2 ARG A 87 -1.487 -9.312 -11.539 1.00 0.00 N ATOM 0 H ARG A 87 -3.850 -3.303 -11.093 1.00 0.00 H new ATOM 0 HA ARG A 87 -5.168 -5.008 -9.165 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.823 -3.151 -8.810 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -3.283 -4.500 -7.791 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.195 -4.630 -10.613 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -1.391 -5.136 -9.140 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -3.207 -6.833 -8.796 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.878 -6.375 -10.348 1.00 0.00 H new ATOM 0 HE ARG A 87 -1.046 -7.117 -10.447 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -4.413 -8.145 -10.827 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -3.987 -9.648 -11.652 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -0.498 -9.079 -11.447 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -1.767 -10.176 -12.003 1.00 0.00 H new ATOM 1419 N GLY A 88 -5.960 -3.192 -7.463 1.00 0.00 N ATOM 1420 CA GLY A 88 -6.832 -2.265 -6.855 1.00 0.00 C ATOM 1421 C GLY A 88 -6.099 -1.279 -6.096 1.00 0.00 C ATOM 1422 O GLY A 88 -5.622 -1.496 -4.994 1.00 0.00 O ATOM 0 H GLY A 88 -5.819 -4.055 -6.938 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -7.430 -1.769 -7.619 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -7.526 -2.791 -6.199 1.00 0.00 H new ATOM 1426 N LEU A 89 -6.017 -0.241 -6.721 1.00 0.00 N ATOM 1427 CA LEU A 89 -5.285 0.845 -6.445 1.00 0.00 C ATOM 1428 C LEU A 89 -6.066 1.668 -5.445 1.00 0.00 C ATOM 1429 O LEU A 89 -7.091 2.275 -5.771 1.00 0.00 O ATOM 1430 CB LEU A 89 -5.148 1.435 -7.843 1.00 0.00 C ATOM 1431 CG LEU A 89 -4.354 2.668 -8.099 1.00 0.00 C ATOM 1432 CD1 LEU A 89 -5.030 3.897 -7.556 1.00 0.00 C ATOM 1433 CD2 LEU A 89 -2.983 2.437 -7.528 1.00 0.00 C ATOM 0 H LEU A 89 -6.551 -0.114 -7.581 1.00 0.00 H new ATOM 0 HA LEU A 89 -4.307 0.724 -5.980 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.729 0.653 -8.476 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.158 1.630 -8.204 1.00 0.00 H new ATOM 0 HG LEU A 89 -4.271 2.861 -9.169 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -4.416 4.773 -7.765 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -6.004 4.016 -8.030 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -5.161 3.794 -6.479 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.366 3.320 -7.695 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -3.062 2.246 -6.458 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -2.525 1.577 -8.017 1.00 0.00 H new ATOM 1445 N ALA A 90 -5.611 1.607 -4.225 1.00 0.00 N ATOM 1446 CA ALA A 90 -6.267 2.212 -3.126 1.00 0.00 C ATOM 1447 C ALA A 90 -5.294 2.312 -2.007 1.00 0.00 C ATOM 1448 O ALA A 90 -4.182 1.751 -2.071 1.00 0.00 O ATOM 1449 CB ALA A 90 -7.456 1.365 -2.682 1.00 0.00 C ATOM 0 H ALA A 90 -4.751 1.120 -3.973 1.00 0.00 H new ATOM 0 HA ALA A 90 -6.632 3.198 -3.414 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -7.949 1.845 -1.836 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.162 1.269 -3.507 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -7.107 0.376 -2.385 1.00 0.00 H new ATOM 1455 N TYR A 91 -5.676 3.014 -1.019 1.00 0.00 N ATOM 1456 CA TYR A 91 -4.906 3.174 0.137 1.00 0.00 C ATOM 1457 C TYR A 91 -5.286 2.031 1.053 1.00 0.00 C ATOM 1458 O TYR A 91 -6.413 1.573 1.011 1.00 0.00 O ATOM 1459 CB TYR A 91 -5.262 4.514 0.721 1.00 0.00 C ATOM 1460 CG TYR A 91 -4.103 5.311 1.157 1.00 0.00 C ATOM 1461 CD1 TYR A 91 -2.917 5.311 0.441 1.00 0.00 C ATOM 1462 CD2 TYR A 91 -4.182 6.062 2.276 1.00 0.00 C ATOM 1463 CE1 TYR A 91 -1.850 6.042 0.859 1.00 0.00 C ATOM 1464 CE2 TYR A 91 -3.131 6.793 2.694 1.00 0.00 C ATOM 1465 CZ TYR A 91 -1.965 6.780 1.994 1.00 0.00 C ATOM 1466 OH TYR A 91 -0.900 7.489 2.458 1.00 0.00 O ATOM 0 H TYR A 91 -6.567 3.510 -0.994 1.00 0.00 H new ATOM 0 HA TYR A 91 -3.830 3.152 -0.036 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -5.822 5.084 -0.021 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -5.925 4.362 1.573 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -2.839 4.722 -0.461 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -5.101 6.077 2.844 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -0.927 6.036 0.299 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -3.214 7.392 3.589 1.00 0.00 H new ATOM 0 HH TYR A 91 -0.193 6.871 2.740 1.00 0.00 H new ATOM 1476 N ILE A 92 -4.381 1.537 1.824 1.00 0.00 N ATOM 1477 CA ILE A 92 -4.672 0.374 2.602 1.00 0.00 C ATOM 1478 C ILE A 92 -4.237 0.505 4.071 1.00 0.00 C ATOM 1479 O ILE A 92 -3.089 0.922 4.402 1.00 0.00 O ATOM 1480 CB ILE A 92 -4.058 -0.856 1.932 1.00 0.00 C ATOM 1481 CG1 ILE A 92 -4.270 -2.108 2.753 1.00 0.00 C ATOM 1482 CG2 ILE A 92 -2.620 -0.608 1.666 1.00 0.00 C ATOM 1483 CD1 ILE A 92 -3.785 -3.380 2.084 1.00 0.00 C ATOM 0 H ILE A 92 -3.439 1.913 1.936 1.00 0.00 H new ATOM 0 HA ILE A 92 -5.755 0.259 2.635 1.00 0.00 H new ATOM 0 HB ILE A 92 -4.565 -1.026 0.982 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -3.756 -1.994 3.708 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -5.333 -2.209 2.973 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -2.182 -1.484 1.188 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -2.515 0.254 1.008 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.105 -0.411 2.606 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -3.974 -4.230 2.739 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.316 -3.521 1.143 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -2.715 -3.303 1.889 1.00 0.00 H new ATOM 1495 N TYR A 93 -5.145 0.114 4.925 1.00 0.00 N ATOM 1496 CA TYR A 93 -5.014 0.214 6.340 1.00 0.00 C ATOM 1497 C TYR A 93 -5.090 -1.180 6.943 1.00 0.00 C ATOM 1498 O TYR A 93 -6.110 -1.876 6.823 1.00 0.00 O ATOM 1499 CB TYR A 93 -6.128 1.114 6.890 1.00 0.00 C ATOM 1500 CG TYR A 93 -6.080 2.541 6.363 1.00 0.00 C ATOM 1501 CD1 TYR A 93 -6.700 2.892 5.163 1.00 0.00 C ATOM 1502 CD2 TYR A 93 -5.421 3.534 7.065 1.00 0.00 C ATOM 1503 CE1 TYR A 93 -6.658 4.184 4.689 1.00 0.00 C ATOM 1504 CE2 TYR A 93 -5.378 4.829 6.600 1.00 0.00 C ATOM 1505 CZ TYR A 93 -6.002 5.155 5.410 1.00 0.00 C ATOM 1506 OH TYR A 93 -5.944 6.451 4.935 1.00 0.00 O ATOM 0 H TYR A 93 -6.031 -0.299 4.633 1.00 0.00 H new ATOM 0 HA TYR A 93 -4.054 0.657 6.604 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -7.094 0.676 6.639 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -6.061 1.136 7.978 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -7.222 2.136 4.596 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -4.931 3.289 7.996 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -7.138 4.434 3.755 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -4.858 5.589 7.164 1.00 0.00 H new ATOM 0 HH TYR A 93 -6.728 6.629 4.375 1.00 0.00 H new ATOM 1516 N ALA A 94 -4.045 -1.545 7.635 1.00 0.00 N ATOM 1517 CA ALA A 94 -3.865 -2.875 8.171 1.00 0.00 C ATOM 1518 C ALA A 94 -3.885 -2.743 9.632 1.00 0.00 C ATOM 1519 O ALA A 94 -2.912 -2.362 10.236 1.00 0.00 O ATOM 1520 CB ALA A 94 -2.549 -3.502 7.709 1.00 0.00 C ATOM 0 H ALA A 94 -3.274 -0.913 7.849 1.00 0.00 H new ATOM 0 HA ALA A 94 -4.658 -3.534 7.817 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -2.453 -4.501 8.134 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.540 -3.568 6.621 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -1.715 -2.884 8.042 1.00 0.00 H new ATOM 1526 N ASP A 95 -5.056 -2.899 10.163 1.00 0.00 N ATOM 1527 CA ASP A 95 -5.380 -2.708 11.582 1.00 0.00 C ATOM 1528 C ASP A 95 -5.287 -1.237 11.872 1.00 0.00 C ATOM 1529 O ASP A 95 -5.270 -0.785 13.012 1.00 0.00 O ATOM 1530 CB ASP A 95 -4.480 -3.504 12.527 1.00 0.00 C ATOM 1531 CG ASP A 95 -5.257 -4.043 13.694 1.00 0.00 C ATOM 1532 OD1 ASP A 95 -6.003 -5.031 13.516 1.00 0.00 O ATOM 1533 OD2 ASP A 95 -5.168 -3.485 14.796 1.00 0.00 O ATOM 0 H ASP A 95 -5.867 -3.177 9.610 1.00 0.00 H new ATOM 0 HA ASP A 95 -6.386 -3.087 11.761 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -4.017 -4.328 11.984 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -3.673 -2.866 12.888 1.00 0.00 H new ATOM 1538 N GLY A 96 -5.243 -0.503 10.792 1.00 0.00 N ATOM 1539 CA GLY A 96 -5.122 0.878 10.822 1.00 0.00 C ATOM 1540 C GLY A 96 -3.748 1.341 10.456 1.00 0.00 C ATOM 1541 O GLY A 96 -3.520 2.540 10.277 1.00 0.00 O ATOM 0 H GLY A 96 -5.294 -0.891 9.850 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -5.845 1.318 10.135 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.370 1.240 11.820 1.00 0.00 H new ATOM 1545 N LYS A 97 -2.821 0.414 10.351 1.00 0.00 N ATOM 1546 CA LYS A 97 -1.478 0.763 9.956 1.00 0.00 C ATOM 1547 C LYS A 97 -1.522 1.014 8.480 1.00 0.00 C ATOM 1548 O LYS A 97 -2.018 0.175 7.741 1.00 0.00 O ATOM 1549 CB LYS A 97 -0.526 -0.395 10.202 1.00 0.00 C ATOM 1550 CG LYS A 97 -0.589 -1.031 11.593 1.00 0.00 C ATOM 1551 CD LYS A 97 -0.253 -0.070 12.704 1.00 0.00 C ATOM 1552 CE LYS A 97 1.225 0.332 12.696 1.00 0.00 C ATOM 1553 NZ LYS A 97 2.122 -0.812 13.000 1.00 0.00 N ATOM 0 H LYS A 97 -2.972 -0.578 10.532 1.00 0.00 H new ATOM 0 HA LYS A 97 -1.133 1.627 10.524 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -0.727 -1.169 9.461 1.00 0.00 H new ATOM 0 HB3 LYS A 97 0.492 -0.046 10.030 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -1.590 -1.430 11.757 1.00 0.00 H new ATOM 0 HG3 LYS A 97 0.100 -1.874 11.631 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.871 0.823 12.609 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -0.498 -0.526 13.663 1.00 0.00 H new ATOM 0 HE2 LYS A 97 1.482 0.743 11.720 1.00 0.00 H new ATOM 0 HE3 LYS A 97 1.388 1.123 13.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 3.079 -0.459 13.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 1.761 -1.325 13.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 2.154 -1.455 12.183 1.00 0.00 H new ATOM 1567 N MET A 98 -1.063 2.142 8.052 1.00 0.00 N ATOM 1568 CA MET A 98 -1.048 2.454 6.657 1.00 0.00 C ATOM 1569 C MET A 98 -0.026 1.567 6.014 1.00 0.00 C ATOM 1570 O MET A 98 1.175 1.771 6.232 1.00 0.00 O ATOM 1571 CB MET A 98 -0.577 3.860 6.451 1.00 0.00 C ATOM 1572 CG MET A 98 -0.842 4.333 5.064 1.00 0.00 C ATOM 1573 SD MET A 98 -2.474 4.964 4.981 1.00 0.00 S ATOM 1574 CE MET A 98 -2.250 6.560 5.823 1.00 0.00 C ATOM 0 H MET A 98 -0.688 2.874 8.655 1.00 0.00 H new ATOM 0 HA MET A 98 -2.048 2.323 6.242 1.00 0.00 H new ATOM 0 HB2 MET A 98 -1.076 4.519 7.162 1.00 0.00 H new ATOM 0 HB3 MET A 98 0.492 3.920 6.658 1.00 0.00 H new ATOM 0 HG2 MET A 98 -0.125 5.105 4.786 1.00 0.00 H new ATOM 0 HG3 MET A 98 -0.718 3.513 4.356 1.00 0.00 H new ATOM 0 HE1 MET A 98 -3.076 7.224 5.569 1.00 0.00 H new ATOM 0 HE2 MET A 98 -2.229 6.403 6.901 1.00 0.00 H new ATOM 0 HE3 MET A 98 -1.311 7.011 5.504 1.00 0.00 H new ATOM 1584 N VAL A 99 -0.455 0.596 5.234 1.00 0.00 N ATOM 1585 CA VAL A 99 0.509 -0.332 4.641 1.00 0.00 C ATOM 1586 C VAL A 99 1.420 0.412 3.685 1.00 0.00 C ATOM 1587 O VAL A 99 2.635 0.168 3.631 1.00 0.00 O ATOM 1588 CB VAL A 99 -0.161 -1.520 3.902 1.00 0.00 C ATOM 1589 CG1 VAL A 99 0.882 -2.450 3.324 1.00 0.00 C ATOM 1590 CG2 VAL A 99 -1.095 -2.292 4.817 1.00 0.00 C ATOM 0 H VAL A 99 -1.432 0.424 4.996 1.00 0.00 H new ATOM 0 HA VAL A 99 1.084 -0.754 5.465 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.753 -1.102 3.088 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.389 -3.275 2.811 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.505 -1.903 2.617 1.00 0.00 H new ATOM 0 HG13 VAL A 99 1.505 -2.843 4.128 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.546 -3.116 4.265 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.532 -2.687 5.663 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.879 -1.628 5.181 1.00 0.00 H new ATOM 1600 N ASN A 100 0.840 1.403 3.024 1.00 0.00 N ATOM 1601 CA ASN A 100 1.551 2.158 2.016 1.00 0.00 C ATOM 1602 C ASN A 100 2.718 2.900 2.704 1.00 0.00 C ATOM 1603 O ASN A 100 3.938 2.716 2.359 1.00 0.00 O ATOM 1604 CB ASN A 100 0.599 3.161 1.308 1.00 0.00 C ATOM 1605 CG ASN A 100 -0.715 2.571 0.849 1.00 0.00 C ATOM 1606 OD1 ASN A 100 -1.654 2.450 1.634 1.00 0.00 O ATOM 1607 ND2 ASN A 100 -0.832 2.309 -0.406 1.00 0.00 N ATOM 0 H ASN A 100 -0.125 1.700 3.172 1.00 0.00 H new ATOM 0 HA ASN A 100 1.940 1.485 1.251 1.00 0.00 H new ATOM 0 HB2 ASN A 100 0.392 3.987 1.989 1.00 0.00 H new ATOM 0 HB3 ASN A 100 1.114 3.581 0.444 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -1.726 1.989 -0.779 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -0.031 2.421 -1.027 1.00 0.00 H new ATOM 1614 N GLU A 101 2.335 3.638 3.760 1.00 0.00 N ATOM 1615 CA GLU A 101 3.251 4.408 4.590 1.00 0.00 C ATOM 1616 C GLU A 101 4.270 3.495 5.142 1.00 0.00 C ATOM 1617 O GLU A 101 5.405 3.671 4.911 1.00 0.00 O ATOM 1618 CB GLU A 101 2.538 4.975 5.792 1.00 0.00 C ATOM 1619 CG GLU A 101 3.321 5.983 6.617 1.00 0.00 C ATOM 1620 CD GLU A 101 2.693 6.198 7.961 1.00 0.00 C ATOM 1621 OE1 GLU A 101 3.004 5.438 8.897 1.00 0.00 O ATOM 1622 OE2 GLU A 101 1.871 7.108 8.114 1.00 0.00 O ATOM 0 H GLU A 101 1.362 3.711 4.058 1.00 0.00 H new ATOM 0 HA GLU A 101 3.673 5.201 3.972 1.00 0.00 H new ATOM 0 HB2 GLU A 101 1.617 5.450 5.453 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.250 4.149 6.442 1.00 0.00 H new ATOM 0 HG2 GLU A 101 4.345 5.633 6.745 1.00 0.00 H new ATOM 0 HG3 GLU A 101 3.372 6.931 6.082 1.00 0.00 H new ATOM 1629 N ALA A 102 3.820 2.487 5.851 1.00 0.00 N ATOM 1630 CA ALA A 102 4.694 1.590 6.540 1.00 0.00 C ATOM 1631 C ALA A 102 5.692 0.930 5.605 1.00 0.00 C ATOM 1632 O ALA A 102 6.889 0.833 5.936 1.00 0.00 O ATOM 1633 CB ALA A 102 3.894 0.588 7.313 1.00 0.00 C ATOM 0 H ALA A 102 2.829 2.271 5.962 1.00 0.00 H new ATOM 0 HA ALA A 102 5.288 2.169 7.247 1.00 0.00 H new ATOM 0 HB1 ALA A 102 4.568 -0.091 7.835 1.00 0.00 H new ATOM 0 HB2 ALA A 102 3.267 1.105 8.039 1.00 0.00 H new ATOM 0 HB3 ALA A 102 3.264 0.020 6.629 1.00 0.00 H new ATOM 1639 N LEU A 103 5.254 0.586 4.393 1.00 0.00 N ATOM 1640 CA LEU A 103 6.149 -0.067 3.486 1.00 0.00 C ATOM 1641 C LEU A 103 7.192 0.950 3.034 1.00 0.00 C ATOM 1642 O LEU A 103 8.401 0.673 3.044 1.00 0.00 O ATOM 1643 CB LEU A 103 5.417 -0.642 2.283 1.00 0.00 C ATOM 1644 CG LEU A 103 6.121 -1.807 1.599 1.00 0.00 C ATOM 1645 CD1 LEU A 103 6.184 -3.000 2.532 1.00 0.00 C ATOM 1646 CD2 LEU A 103 5.425 -2.183 0.321 1.00 0.00 C ATOM 0 H LEU A 103 4.311 0.750 4.040 1.00 0.00 H new ATOM 0 HA LEU A 103 6.624 -0.905 3.996 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.428 -0.971 2.601 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.269 0.153 1.552 1.00 0.00 H new ATOM 0 HG LEU A 103 7.136 -1.494 1.353 1.00 0.00 H new ATOM 0 HD11 LEU A 103 6.689 -3.826 2.032 1.00 0.00 H new ATOM 0 HD12 LEU A 103 6.735 -2.729 3.432 1.00 0.00 H new ATOM 0 HD13 LEU A 103 5.173 -3.304 2.803 1.00 0.00 H new ATOM 0 HD21 LEU A 103 5.948 -3.017 -0.147 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.398 -2.475 0.539 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.423 -1.330 -0.357 1.00 0.00 H new ATOM 1658 N VAL A 104 6.737 2.167 2.710 1.00 0.00 N ATOM 1659 CA VAL A 104 7.689 3.216 2.313 1.00 0.00 C ATOM 1660 C VAL A 104 8.490 3.749 3.543 1.00 0.00 C ATOM 1661 O VAL A 104 9.584 4.285 3.414 1.00 0.00 O ATOM 1662 CB VAL A 104 6.984 4.384 1.539 1.00 0.00 C ATOM 1663 CG1 VAL A 104 6.058 5.171 2.384 1.00 0.00 C ATOM 1664 CG2 VAL A 104 7.955 5.281 0.820 1.00 0.00 C ATOM 0 H VAL A 104 5.756 2.445 2.713 1.00 0.00 H new ATOM 0 HA VAL A 104 8.401 2.761 1.625 1.00 0.00 H new ATOM 0 HB VAL A 104 6.378 3.889 0.781 1.00 0.00 H new ATOM 0 HG11 VAL A 104 5.604 5.962 1.787 1.00 0.00 H new ATOM 0 HG12 VAL A 104 5.277 4.518 2.774 1.00 0.00 H new ATOM 0 HG13 VAL A 104 6.609 5.613 3.214 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.408 6.070 0.303 1.00 0.00 H new ATOM 0 HG22 VAL A 104 8.640 5.727 1.541 1.00 0.00 H new ATOM 0 HG23 VAL A 104 8.521 4.697 0.094 1.00 0.00 H new ATOM 1674 N ARG A 105 7.963 3.489 4.724 1.00 0.00 N ATOM 1675 CA ARG A 105 8.507 3.969 5.990 1.00 0.00 C ATOM 1676 C ARG A 105 9.555 3.024 6.434 1.00 0.00 C ATOM 1677 O ARG A 105 10.354 3.336 7.282 1.00 0.00 O ATOM 1678 CB ARG A 105 7.402 3.983 7.051 1.00 0.00 C ATOM 1679 CG ARG A 105 7.693 4.754 8.321 1.00 0.00 C ATOM 1680 CD ARG A 105 7.895 6.218 8.018 1.00 0.00 C ATOM 1681 NE ARG A 105 7.871 7.041 9.221 1.00 0.00 N ATOM 1682 CZ ARG A 105 7.201 8.199 9.357 1.00 0.00 C ATOM 1683 NH1 ARG A 105 6.370 8.620 8.398 1.00 0.00 N ATOM 1684 NH2 ARG A 105 7.336 8.909 10.461 1.00 0.00 N ATOM 0 H ARG A 105 7.122 2.923 4.838 1.00 0.00 H new ATOM 0 HA ARG A 105 8.911 4.973 5.859 1.00 0.00 H new ATOM 0 HB2 ARG A 105 6.501 4.398 6.599 1.00 0.00 H new ATOM 0 HB3 ARG A 105 7.177 2.952 7.322 1.00 0.00 H new ATOM 0 HG2 ARG A 105 6.869 4.633 9.024 1.00 0.00 H new ATOM 0 HG3 ARG A 105 8.584 4.350 8.802 1.00 0.00 H new ATOM 0 HD2 ARG A 105 8.849 6.353 7.507 1.00 0.00 H new ATOM 0 HD3 ARG A 105 7.117 6.556 7.334 1.00 0.00 H new ATOM 0 HE ARG A 105 8.406 6.712 10.025 1.00 0.00 H new ATOM 0 HH11 ARG A 105 6.240 8.061 7.554 1.00 0.00 H new ATOM 0 HH12 ARG A 105 5.866 9.500 8.510 1.00 0.00 H new ATOM 0 HH21 ARG A 105 7.947 8.579 11.208 1.00 0.00 H new ATOM 0 HH22 ARG A 105 6.829 9.788 10.567 1.00 0.00 H new ATOM 1698 N GLN A 106 9.448 1.824 5.940 1.00 0.00 N ATOM 1699 CA GLN A 106 10.381 0.811 6.152 1.00 0.00 C ATOM 1700 C GLN A 106 11.560 0.852 5.198 1.00 0.00 C ATOM 1701 O GLN A 106 12.559 0.199 5.444 1.00 0.00 O ATOM 1702 CB GLN A 106 9.694 -0.505 5.992 1.00 0.00 C ATOM 1703 CG GLN A 106 9.213 -1.116 7.277 1.00 0.00 C ATOM 1704 CD GLN A 106 10.353 -1.404 8.231 1.00 0.00 C ATOM 1705 OE1 GLN A 106 10.720 -0.568 9.055 1.00 0.00 O ATOM 1706 NE2 GLN A 106 10.936 -2.567 8.115 1.00 0.00 N ATOM 0 H GLN A 106 8.664 1.535 5.355 1.00 0.00 H new ATOM 0 HA GLN A 106 10.780 0.955 7.156 1.00 0.00 H new ATOM 0 HB2 GLN A 106 8.842 -0.377 5.324 1.00 0.00 H new ATOM 0 HB3 GLN A 106 10.378 -1.201 5.507 1.00 0.00 H new ATOM 0 HG2 GLN A 106 8.502 -0.442 7.755 1.00 0.00 H new ATOM 0 HG3 GLN A 106 8.679 -2.041 7.061 1.00 0.00 H new ATOM 0 HE21 GLN A 106 10.605 -3.236 7.420 1.00 0.00 H new ATOM 0 HE22 GLN A 106 11.722 -2.806 8.719 1.00 0.00 H new ATOM 1715 N GLY A 107 11.468 1.594 4.121 1.00 0.00 N ATOM 1716 CA GLY A 107 12.535 1.512 3.145 1.00 0.00 C ATOM 1717 C GLY A 107 12.295 0.337 2.225 1.00 0.00 C ATOM 1718 O GLY A 107 13.214 -0.219 1.652 1.00 0.00 O ATOM 0 H GLY A 107 10.705 2.234 3.900 1.00 0.00 H new ATOM 0 HA2 GLY A 107 12.584 2.435 2.567 1.00 0.00 H new ATOM 0 HA3 GLY A 107 13.495 1.401 3.650 1.00 0.00 H new ATOM 1722 N LEU A 108 11.055 -0.071 2.147 1.00 0.00 N ATOM 1723 CA LEU A 108 10.627 -1.198 1.328 1.00 0.00 C ATOM 1724 C LEU A 108 9.873 -0.684 0.119 1.00 0.00 C ATOM 1725 O LEU A 108 9.372 -1.451 -0.705 1.00 0.00 O ATOM 1726 CB LEU A 108 9.737 -2.126 2.181 1.00 0.00 C ATOM 1727 CG LEU A 108 10.404 -3.319 2.922 1.00 0.00 C ATOM 1728 CD1 LEU A 108 11.823 -3.065 3.306 1.00 0.00 C ATOM 1729 CD2 LEU A 108 9.597 -3.712 4.143 1.00 0.00 C ATOM 0 H LEU A 108 10.292 0.373 2.658 1.00 0.00 H new ATOM 0 HA LEU A 108 11.491 -1.763 0.978 1.00 0.00 H new ATOM 0 HB2 LEU A 108 9.236 -1.510 2.928 1.00 0.00 H new ATOM 0 HB3 LEU A 108 8.962 -2.531 1.531 1.00 0.00 H new ATOM 0 HG LEU A 108 10.417 -4.143 2.209 1.00 0.00 H new ATOM 0 HD11 LEU A 108 12.223 -3.940 3.819 1.00 0.00 H new ATOM 0 HD12 LEU A 108 12.412 -2.868 2.411 1.00 0.00 H new ATOM 0 HD13 LEU A 108 11.871 -2.202 3.970 1.00 0.00 H new ATOM 0 HD21 LEU A 108 10.082 -4.549 4.646 1.00 0.00 H new ATOM 0 HD22 LEU A 108 9.534 -2.865 4.826 1.00 0.00 H new ATOM 0 HD23 LEU A 108 8.593 -4.006 3.837 1.00 0.00 H new ATOM 1741 N ALA A 109 9.823 0.619 0.019 1.00 0.00 N ATOM 1742 CA ALA A 109 9.142 1.303 -1.027 1.00 0.00 C ATOM 1743 C ALA A 109 9.609 2.716 -1.069 1.00 0.00 C ATOM 1744 O ALA A 109 10.267 3.192 -0.135 1.00 0.00 O ATOM 1745 CB ALA A 109 7.646 1.271 -0.795 1.00 0.00 C ATOM 0 H ALA A 109 10.272 1.244 0.688 1.00 0.00 H new ATOM 0 HA ALA A 109 9.358 0.810 -1.975 1.00 0.00 H new ATOM 0 HB1 ALA A 109 7.141 1.799 -1.604 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.304 0.236 -0.767 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.415 1.755 0.154 1.00 0.00 H new ATOM 1751 N LYS A 110 9.306 3.350 -2.151 1.00 0.00 N ATOM 1752 CA LYS A 110 9.579 4.745 -2.374 1.00 0.00 C ATOM 1753 C LYS A 110 8.229 5.377 -2.581 1.00 0.00 C ATOM 1754 O LYS A 110 7.223 4.640 -2.745 1.00 0.00 O ATOM 1755 CB LYS A 110 10.337 4.934 -3.677 1.00 0.00 C ATOM 1756 CG LYS A 110 11.485 3.979 -3.924 1.00 0.00 C ATOM 1757 CD LYS A 110 11.804 3.980 -5.397 1.00 0.00 C ATOM 1758 CE LYS A 110 12.697 2.834 -5.806 1.00 0.00 C ATOM 1759 NZ LYS A 110 12.534 2.561 -7.248 1.00 0.00 N ATOM 0 H LYS A 110 8.843 2.900 -2.941 1.00 0.00 H new ATOM 0 HA LYS A 110 10.156 5.162 -1.549 1.00 0.00 H new ATOM 0 HB2 LYS A 110 9.630 4.841 -4.502 1.00 0.00 H new ATOM 0 HB3 LYS A 110 10.726 5.952 -3.703 1.00 0.00 H new ATOM 0 HG2 LYS A 110 12.359 4.282 -3.348 1.00 0.00 H new ATOM 0 HG3 LYS A 110 11.219 2.974 -3.595 1.00 0.00 H new ATOM 0 HD2 LYS A 110 10.875 3.930 -5.965 1.00 0.00 H new ATOM 0 HD3 LYS A 110 12.287 4.921 -5.658 1.00 0.00 H new ATOM 0 HE2 LYS A 110 13.737 3.076 -5.588 1.00 0.00 H new ATOM 0 HE3 LYS A 110 12.449 1.944 -5.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 13.059 1.699 -7.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 11.525 2.428 -7.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 12.903 3.363 -7.797 1.00 0.00 H new ATOM 1773 N VAL A 111 8.169 6.673 -2.620 1.00 0.00 N ATOM 1774 CA VAL A 111 6.925 7.315 -2.895 1.00 0.00 C ATOM 1775 C VAL A 111 6.729 7.415 -4.395 1.00 0.00 C ATOM 1776 O VAL A 111 7.522 8.029 -5.126 1.00 0.00 O ATOM 1777 CB VAL A 111 6.743 8.696 -2.191 1.00 0.00 C ATOM 1778 CG1 VAL A 111 7.845 9.672 -2.547 1.00 0.00 C ATOM 1779 CG2 VAL A 111 5.376 9.289 -2.514 1.00 0.00 C ATOM 0 H VAL A 111 8.959 7.300 -2.466 1.00 0.00 H new ATOM 0 HA VAL A 111 6.143 6.690 -2.464 1.00 0.00 H new ATOM 0 HB VAL A 111 6.806 8.518 -1.117 1.00 0.00 H new ATOM 0 HG11 VAL A 111 7.674 10.618 -2.033 1.00 0.00 H new ATOM 0 HG12 VAL A 111 8.807 9.262 -2.241 1.00 0.00 H new ATOM 0 HG13 VAL A 111 7.848 9.840 -3.624 1.00 0.00 H new ATOM 0 HG21 VAL A 111 5.269 10.251 -2.014 1.00 0.00 H new ATOM 0 HG22 VAL A 111 5.285 9.428 -3.591 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.595 8.612 -2.168 1.00 0.00 H new ATOM 1789 N ALA A 112 5.737 6.747 -4.853 1.00 0.00 N ATOM 1790 CA ALA A 112 5.404 6.743 -6.240 1.00 0.00 C ATOM 1791 C ALA A 112 4.277 7.725 -6.505 1.00 0.00 C ATOM 1792 O ALA A 112 3.944 8.564 -5.667 1.00 0.00 O ATOM 1793 CB ALA A 112 4.997 5.340 -6.676 1.00 0.00 C ATOM 0 H ALA A 112 5.121 6.178 -4.273 1.00 0.00 H new ATOM 0 HA ALA A 112 6.278 7.048 -6.816 1.00 0.00 H new ATOM 0 HB1 ALA A 112 4.745 5.347 -7.736 1.00 0.00 H new ATOM 0 HB2 ALA A 112 5.824 4.651 -6.505 1.00 0.00 H new ATOM 0 HB3 ALA A 112 4.131 5.017 -6.099 1.00 0.00 H new ATOM 1799 N TYR A 113 3.699 7.585 -7.646 1.00 0.00 N ATOM 1800 CA TYR A 113 2.609 8.369 -8.107 1.00 0.00 C ATOM 1801 C TYR A 113 1.956 7.530 -9.159 1.00 0.00 C ATOM 1802 O TYR A 113 2.631 6.936 -9.998 1.00 0.00 O ATOM 1803 CB TYR A 113 3.077 9.728 -8.648 1.00 0.00 C ATOM 1804 CG TYR A 113 1.965 10.652 -9.127 1.00 0.00 C ATOM 1805 CD1 TYR A 113 0.884 11.000 -8.306 1.00 0.00 C ATOM 1806 CD2 TYR A 113 2.005 11.187 -10.399 1.00 0.00 C ATOM 1807 CE1 TYR A 113 -0.104 11.847 -8.762 1.00 0.00 C ATOM 1808 CE2 TYR A 113 1.027 12.035 -10.849 1.00 0.00 C ATOM 1809 CZ TYR A 113 -0.020 12.362 -10.031 1.00 0.00 C ATOM 1810 OH TYR A 113 -0.988 13.207 -10.489 1.00 0.00 O ATOM 0 H TYR A 113 3.992 6.879 -8.321 1.00 0.00 H new ATOM 0 HA TYR A 113 1.913 8.619 -7.307 1.00 0.00 H new ATOM 0 HB2 TYR A 113 3.640 10.238 -7.866 1.00 0.00 H new ATOM 0 HB3 TYR A 113 3.765 9.554 -9.475 1.00 0.00 H new ATOM 0 HD1 TYR A 113 0.824 10.600 -7.305 1.00 0.00 H new ATOM 0 HD2 TYR A 113 2.825 10.932 -11.054 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -0.938 12.103 -8.125 1.00 0.00 H new ATOM 0 HE2 TYR A 113 1.083 12.444 -11.847 1.00 0.00 H new ATOM 0 HH TYR A 113 -0.598 13.831 -11.137 1.00 0.00 H new ATOM 1820 N VAL A 114 0.687 7.404 -9.070 1.00 0.00 N ATOM 1821 CA VAL A 114 -0.015 6.483 -9.893 1.00 0.00 C ATOM 1822 C VAL A 114 -0.818 7.127 -10.987 1.00 0.00 C ATOM 1823 O VAL A 114 -0.577 6.886 -12.171 1.00 0.00 O ATOM 1824 CB VAL A 114 -0.889 5.570 -9.033 1.00 0.00 C ATOM 1825 CG1 VAL A 114 -0.015 4.511 -8.367 1.00 0.00 C ATOM 1826 CG2 VAL A 114 -1.640 6.377 -7.950 1.00 0.00 C ATOM 0 H VAL A 114 0.100 7.934 -8.426 1.00 0.00 H new ATOM 0 HA VAL A 114 0.742 5.889 -10.405 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.627 5.093 -9.677 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -0.637 3.859 -7.753 1.00 0.00 H new ATOM 0 HG12 VAL A 114 0.486 3.919 -9.133 1.00 0.00 H new ATOM 0 HG13 VAL A 114 0.731 4.998 -7.739 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -2.254 5.702 -7.353 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -0.919 6.878 -7.304 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -2.278 7.121 -8.427 1.00 0.00 H new ATOM 1836 N TYR A 115 -1.743 7.941 -10.600 1.00 0.00 N ATOM 1837 CA TYR A 115 -2.636 8.573 -11.495 1.00 0.00 C ATOM 1838 C TYR A 115 -2.993 9.874 -10.872 1.00 0.00 C ATOM 1839 O TYR A 115 -3.036 9.951 -9.632 1.00 0.00 O ATOM 1840 CB TYR A 115 -3.952 7.780 -11.671 1.00 0.00 C ATOM 1841 CG TYR A 115 -3.844 6.375 -12.189 1.00 0.00 C ATOM 1842 CD1 TYR A 115 -3.839 6.126 -13.554 1.00 0.00 C ATOM 1843 CD2 TYR A 115 -3.807 5.288 -11.312 1.00 0.00 C ATOM 1844 CE1 TYR A 115 -3.803 4.843 -14.044 1.00 0.00 C ATOM 1845 CE2 TYR A 115 -3.757 4.000 -11.802 1.00 0.00 C ATOM 1846 CZ TYR A 115 -3.760 3.784 -13.171 1.00 0.00 C ATOM 1847 OH TYR A 115 -3.757 2.500 -13.664 1.00 0.00 O ATOM 0 H TYR A 115 -1.898 8.188 -9.622 1.00 0.00 H new ATOM 0 HA TYR A 115 -2.158 8.661 -12.471 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -4.457 7.746 -10.706 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -4.596 8.341 -12.348 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -3.864 6.956 -14.244 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -3.818 5.457 -10.245 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -3.808 4.668 -15.110 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -3.716 3.162 -11.121 1.00 0.00 H new ATOM 0 HH TYR A 115 -2.833 2.208 -13.811 1.00 0.00 H new ATOM 1857 N LYS A 116 -3.212 10.872 -11.683 1.00 0.00 N ATOM 1858 CA LYS A 116 -3.678 12.185 -11.242 1.00 0.00 C ATOM 1859 C LYS A 116 -4.935 11.994 -10.438 1.00 0.00 C ATOM 1860 O LYS A 116 -5.972 11.561 -10.959 1.00 0.00 O ATOM 1861 CB LYS A 116 -3.974 13.072 -12.460 1.00 0.00 C ATOM 1862 CG LYS A 116 -3.469 14.536 -12.421 1.00 0.00 C ATOM 1863 CD LYS A 116 -4.100 15.446 -11.344 1.00 0.00 C ATOM 1864 CE LYS A 116 -3.514 15.239 -9.949 1.00 0.00 C ATOM 1865 NZ LYS A 116 -3.985 16.265 -8.990 1.00 0.00 N ATOM 0 H LYS A 116 -3.073 10.808 -12.691 1.00 0.00 H new ATOM 0 HA LYS A 116 -2.912 12.669 -10.636 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -3.543 12.591 -13.338 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -5.054 13.093 -12.606 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.390 14.522 -12.269 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -3.647 14.986 -13.398 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -3.964 16.488 -11.635 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -5.174 15.262 -11.309 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -3.788 14.249 -9.584 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -2.426 15.268 -10.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -3.563 16.087 -8.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -3.702 17.208 -9.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -5.021 16.221 -8.916 1.00 0.00 H new ATOM 1879 N GLY A 117 -4.812 12.230 -9.179 1.00 0.00 N ATOM 1880 CA GLY A 117 -5.890 12.045 -8.311 1.00 0.00 C ATOM 1881 C GLY A 117 -5.439 11.341 -7.107 1.00 0.00 C ATOM 1882 O GLY A 117 -5.419 11.912 -6.026 1.00 0.00 O ATOM 0 H GLY A 117 -3.954 12.557 -8.734 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -6.321 13.009 -8.040 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -6.674 11.473 -8.806 1.00 0.00 H new ATOM 1886 N ASN A 118 -4.933 10.145 -7.312 1.00 0.00 N ATOM 1887 CA ASN A 118 -4.585 9.288 -6.208 1.00 0.00 C ATOM 1888 C ASN A 118 -3.246 9.666 -5.703 1.00 0.00 C ATOM 1889 O ASN A 118 -2.220 9.170 -6.190 1.00 0.00 O ATOM 1890 CB ASN A 118 -4.557 7.798 -6.554 1.00 0.00 C ATOM 1891 CG ASN A 118 -5.702 7.299 -7.385 1.00 0.00 C ATOM 1892 OD1 ASN A 118 -6.786 7.000 -6.910 1.00 0.00 O ATOM 1893 ND2 ASN A 118 -5.484 7.186 -8.655 1.00 0.00 N ATOM 0 H ASN A 118 -4.755 9.747 -8.234 1.00 0.00 H new ATOM 0 HA ASN A 118 -5.366 9.430 -5.461 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -3.628 7.585 -7.083 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -4.532 7.229 -5.625 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -6.222 6.844 -9.271 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -4.574 7.439 -9.041 1.00 0.00 H new ATOM 1900 N ASN A 119 -3.241 10.599 -4.807 1.00 0.00 N ATOM 1901 CA ASN A 119 -2.037 11.073 -4.192 1.00 0.00 C ATOM 1902 C ASN A 119 -2.405 11.916 -2.988 1.00 0.00 C ATOM 1903 O ASN A 119 -1.600 12.702 -2.476 1.00 0.00 O ATOM 1904 CB ASN A 119 -1.141 11.865 -5.199 1.00 0.00 C ATOM 1905 CG ASN A 119 -1.589 13.299 -5.514 1.00 0.00 C ATOM 1906 OD1 ASN A 119 -0.755 14.210 -5.574 1.00 0.00 O ATOM 1907 ND2 ASN A 119 -2.846 13.494 -5.830 1.00 0.00 N ATOM 0 H ASN A 119 -4.086 11.063 -4.474 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.442 10.219 -3.867 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -0.127 11.901 -4.801 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -1.097 11.306 -6.133 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -3.158 14.416 -6.135 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -3.512 12.724 -5.771 1.00 0.00 H new ATOM 1914 N THR A 120 -3.583 11.656 -2.456 1.00 0.00 N ATOM 1915 CA THR A 120 -4.149 12.448 -1.376 1.00 0.00 C ATOM 1916 C THR A 120 -3.303 12.361 -0.073 1.00 0.00 C ATOM 1917 O THR A 120 -3.365 13.231 0.793 1.00 0.00 O ATOM 1918 CB THR A 120 -5.628 12.053 -1.172 1.00 0.00 C ATOM 1919 OG1 THR A 120 -6.261 12.017 -2.469 1.00 0.00 O ATOM 1920 CG2 THR A 120 -6.345 13.094 -0.348 1.00 0.00 C ATOM 0 H THR A 120 -4.179 10.886 -2.760 1.00 0.00 H new ATOM 0 HA THR A 120 -4.119 13.501 -1.655 1.00 0.00 H new ATOM 0 HB THR A 120 -5.674 11.089 -0.665 1.00 0.00 H new ATOM 0 HG1 THR A 120 -6.228 11.104 -2.824 1.00 0.00 H new ATOM 0 HG21 THR A 120 -7.386 12.799 -0.215 1.00 0.00 H new ATOM 0 HG22 THR A 120 -5.865 13.181 0.627 1.00 0.00 H new ATOM 0 HG23 THR A 120 -6.303 14.055 -0.860 1.00 0.00 H new ATOM 1928 N HIS A 121 -2.496 11.341 0.037 1.00 0.00 N ATOM 1929 CA HIS A 121 -1.553 11.257 1.104 1.00 0.00 C ATOM 1930 C HIS A 121 -0.163 11.043 0.593 1.00 0.00 C ATOM 1931 O HIS A 121 0.706 10.633 1.331 1.00 0.00 O ATOM 1932 CB HIS A 121 -1.923 10.219 2.096 1.00 0.00 C ATOM 1933 CG HIS A 121 -2.840 10.700 3.166 1.00 0.00 C ATOM 1934 ND1 HIS A 121 -4.030 10.105 3.510 1.00 0.00 N ATOM 1935 CD2 HIS A 121 -2.675 11.727 4.020 1.00 0.00 C ATOM 1936 CE1 HIS A 121 -4.539 10.766 4.545 1.00 0.00 C ATOM 1937 NE2 HIS A 121 -3.746 11.776 4.899 1.00 0.00 N ATOM 0 H HIS A 121 -2.478 10.552 -0.609 1.00 0.00 H new ATOM 0 HA HIS A 121 -1.575 12.217 1.619 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -2.395 9.386 1.575 1.00 0.00 H new ATOM 0 HB3 HIS A 121 -1.014 9.833 2.558 1.00 0.00 H new ATOM 0 HD2 HIS A 121 -1.837 12.408 4.020 1.00 0.00 H new ATOM 0 HE1 HIS A 121 -5.470 10.518 5.033 1.00 0.00 H new ATOM 0 HE2 HIS A 121 -3.895 12.443 5.656 1.00 0.00 H new ATOM 1945 N GLU A 122 0.071 11.438 -0.651 1.00 0.00 N ATOM 1946 CA GLU A 122 1.392 11.308 -1.280 1.00 0.00 C ATOM 1947 C GLU A 122 2.445 12.057 -0.477 1.00 0.00 C ATOM 1948 O GLU A 122 3.588 11.604 -0.353 1.00 0.00 O ATOM 1949 CB GLU A 122 1.291 11.776 -2.741 1.00 0.00 C ATOM 1950 CG GLU A 122 2.572 11.836 -3.584 1.00 0.00 C ATOM 1951 CD GLU A 122 3.423 13.065 -3.316 1.00 0.00 C ATOM 1952 OE1 GLU A 122 2.859 14.180 -3.219 1.00 0.00 O ATOM 1953 OE2 GLU A 122 4.649 12.945 -3.210 1.00 0.00 O ATOM 0 H GLU A 122 -0.638 11.855 -1.254 1.00 0.00 H new ATOM 0 HA GLU A 122 1.713 10.266 -1.287 1.00 0.00 H new ATOM 0 HB2 GLU A 122 0.589 11.117 -3.252 1.00 0.00 H new ATOM 0 HB3 GLU A 122 0.849 12.772 -2.739 1.00 0.00 H new ATOM 0 HG2 GLU A 122 3.167 10.944 -3.389 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.303 11.815 -4.640 1.00 0.00 H new ATOM 1960 N GLN A 123 2.036 13.156 0.142 1.00 0.00 N ATOM 1961 CA GLN A 123 2.957 13.909 0.957 1.00 0.00 C ATOM 1962 C GLN A 123 3.416 13.109 2.185 1.00 0.00 C ATOM 1963 O GLN A 123 4.589 13.167 2.589 1.00 0.00 O ATOM 1964 CB GLN A 123 2.488 15.339 1.305 1.00 0.00 C ATOM 1965 CG GLN A 123 1.131 15.508 1.943 1.00 0.00 C ATOM 1966 CD GLN A 123 0.018 15.579 0.912 1.00 0.00 C ATOM 1967 OE1 GLN A 123 -0.265 16.639 0.377 1.00 0.00 O ATOM 1968 NE2 GLN A 123 -0.685 14.507 0.690 1.00 0.00 N ATOM 0 H GLN A 123 1.090 13.534 0.093 1.00 0.00 H new ATOM 0 HA GLN A 123 3.834 14.069 0.330 1.00 0.00 H new ATOM 0 HB2 GLN A 123 3.228 15.779 1.974 1.00 0.00 H new ATOM 0 HB3 GLN A 123 2.500 15.926 0.387 1.00 0.00 H new ATOM 0 HG2 GLN A 123 0.944 14.675 2.621 1.00 0.00 H new ATOM 0 HG3 GLN A 123 1.125 16.417 2.545 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -0.434 13.629 1.145 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -1.487 14.544 0.060 1.00 0.00 H new ATOM 1977 N LEU A 124 2.523 12.285 2.701 1.00 0.00 N ATOM 1978 CA LEU A 124 2.837 11.417 3.808 1.00 0.00 C ATOM 1979 C LEU A 124 3.838 10.357 3.363 1.00 0.00 C ATOM 1980 O LEU A 124 4.782 10.035 4.086 1.00 0.00 O ATOM 1981 CB LEU A 124 1.534 10.809 4.416 1.00 0.00 C ATOM 1982 CG LEU A 124 1.669 9.556 5.311 1.00 0.00 C ATOM 1983 CD1 LEU A 124 0.517 9.465 6.281 1.00 0.00 C ATOM 1984 CD2 LEU A 124 1.650 8.298 4.455 1.00 0.00 C ATOM 0 H LEU A 124 1.564 12.203 2.362 1.00 0.00 H new ATOM 0 HA LEU A 124 3.308 11.991 4.606 1.00 0.00 H new ATOM 0 HB2 LEU A 124 1.044 11.587 5.002 1.00 0.00 H new ATOM 0 HB3 LEU A 124 0.865 10.561 3.592 1.00 0.00 H new ATOM 0 HG LEU A 124 2.610 9.639 5.855 1.00 0.00 H new ATOM 0 HD11 LEU A 124 0.633 8.576 6.901 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.505 10.351 6.916 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -0.420 9.403 5.728 1.00 0.00 H new ATOM 0 HD21 LEU A 124 1.746 7.421 5.095 1.00 0.00 H new ATOM 0 HD22 LEU A 124 0.710 8.246 3.906 1.00 0.00 H new ATOM 0 HD23 LEU A 124 2.481 8.325 3.750 1.00 0.00 H new ATOM 1996 N LEU A 125 3.661 9.850 2.160 1.00 0.00 N ATOM 1997 CA LEU A 125 4.565 8.852 1.659 1.00 0.00 C ATOM 1998 C LEU A 125 5.896 9.421 1.309 1.00 0.00 C ATOM 1999 O LEU A 125 6.906 8.793 1.568 1.00 0.00 O ATOM 2000 CB LEU A 125 4.012 8.038 0.520 1.00 0.00 C ATOM 2001 CG LEU A 125 2.898 7.096 0.882 1.00 0.00 C ATOM 2002 CD1 LEU A 125 1.544 7.697 0.635 1.00 0.00 C ATOM 2003 CD2 LEU A 125 3.087 5.792 0.193 1.00 0.00 C ATOM 0 H LEU A 125 2.908 10.112 1.523 1.00 0.00 H new ATOM 0 HA LEU A 125 4.698 8.159 2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 125 3.652 8.720 -0.251 1.00 0.00 H new ATOM 0 HB3 LEU A 125 4.825 7.460 0.080 1.00 0.00 H new ATOM 0 HG LEU A 125 2.939 6.911 1.955 1.00 0.00 H new ATOM 0 HD11 LEU A 125 0.771 6.979 0.911 1.00 0.00 H new ATOM 0 HD12 LEU A 125 1.432 8.600 1.235 1.00 0.00 H new ATOM 0 HD13 LEU A 125 1.445 7.948 -0.421 1.00 0.00 H new ATOM 0 HD21 LEU A 125 2.275 5.117 0.462 1.00 0.00 H new ATOM 0 HD22 LEU A 125 3.087 5.947 -0.886 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.038 5.354 0.497 1.00 0.00 H new ATOM 2015 N ARG A 126 5.920 10.616 0.744 1.00 0.00 N ATOM 2016 CA ARG A 126 7.188 11.245 0.467 1.00 0.00 C ATOM 2017 C ARG A 126 7.890 11.578 1.772 1.00 0.00 C ATOM 2018 O ARG A 126 9.120 11.451 1.877 1.00 0.00 O ATOM 2019 CB ARG A 126 7.035 12.443 -0.435 1.00 0.00 C ATOM 2020 CG ARG A 126 6.382 13.606 0.166 1.00 0.00 C ATOM 2021 CD ARG A 126 6.046 14.556 -0.897 1.00 0.00 C ATOM 2022 NE ARG A 126 5.590 15.822 -0.339 1.00 0.00 N ATOM 2023 CZ ARG A 126 4.802 16.711 -0.950 1.00 0.00 C ATOM 2024 NH1 ARG A 126 4.095 16.371 -2.035 1.00 0.00 N ATOM 2025 NH2 ARG A 126 4.654 17.915 -0.417 1.00 0.00 N ATOM 0 H ARG A 126 5.096 11.154 0.476 1.00 0.00 H new ATOM 0 HA ARG A 126 7.817 10.544 -0.082 1.00 0.00 H new ATOM 0 HB2 ARG A 126 8.024 12.743 -0.782 1.00 0.00 H new ATOM 0 HB3 ARG A 126 6.466 12.143 -1.315 1.00 0.00 H new ATOM 0 HG2 ARG A 126 5.481 13.301 0.699 1.00 0.00 H new ATOM 0 HG3 ARG A 126 7.041 14.074 0.897 1.00 0.00 H new ATOM 0 HD2 ARG A 126 6.919 14.726 -1.528 1.00 0.00 H new ATOM 0 HD3 ARG A 126 5.269 14.134 -1.535 1.00 0.00 H new ATOM 0 HE ARG A 126 5.901 16.051 0.605 1.00 0.00 H new ATOM 0 HH11 ARG A 126 4.154 15.422 -2.405 1.00 0.00 H new ATOM 0 HH12 ARG A 126 3.497 17.060 -2.491 1.00 0.00 H new ATOM 0 HH21 ARG A 126 5.139 18.153 0.449 1.00 0.00 H new ATOM 0 HH22 ARG A 126 4.056 18.604 -0.872 1.00 0.00 H new ATOM 2039 N LYS A 127 7.093 11.949 2.790 1.00 0.00 N ATOM 2040 CA LYS A 127 7.614 12.163 4.131 1.00 0.00 C ATOM 2041 C LYS A 127 8.166 10.844 4.702 1.00 0.00 C ATOM 2042 O LYS A 127 9.242 10.822 5.311 1.00 0.00 O ATOM 2043 CB LYS A 127 6.513 12.724 5.057 1.00 0.00 C ATOM 2044 CG LYS A 127 6.959 13.065 6.480 1.00 0.00 C ATOM 2045 CD LYS A 127 7.956 14.212 6.489 1.00 0.00 C ATOM 2046 CE LYS A 127 8.390 14.594 7.901 1.00 0.00 C ATOM 2047 NZ LYS A 127 9.110 13.500 8.602 1.00 0.00 N ATOM 0 H LYS A 127 6.089 12.104 2.699 1.00 0.00 H new ATOM 0 HA LYS A 127 8.424 12.891 4.076 1.00 0.00 H new ATOM 0 HB2 LYS A 127 6.101 13.623 4.599 1.00 0.00 H new ATOM 0 HB3 LYS A 127 5.704 11.996 5.113 1.00 0.00 H new ATOM 0 HG2 LYS A 127 6.090 13.332 7.081 1.00 0.00 H new ATOM 0 HG3 LYS A 127 7.409 12.186 6.942 1.00 0.00 H new ATOM 0 HD2 LYS A 127 8.833 13.932 5.905 1.00 0.00 H new ATOM 0 HD3 LYS A 127 7.512 15.080 6.001 1.00 0.00 H new ATOM 0 HE2 LYS A 127 9.033 15.472 7.852 1.00 0.00 H new ATOM 0 HE3 LYS A 127 7.511 14.874 8.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 9.468 13.849 9.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 8.459 12.706 8.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 9.907 13.179 8.017 1.00 0.00 H new ATOM 2061 N ALA A 128 7.453 9.735 4.463 1.00 0.00 N ATOM 2062 CA ALA A 128 7.864 8.447 4.992 1.00 0.00 C ATOM 2063 C ALA A 128 9.111 7.969 4.271 1.00 0.00 C ATOM 2064 O ALA A 128 10.055 7.428 4.900 1.00 0.00 O ATOM 2065 CB ALA A 128 6.733 7.456 4.862 1.00 0.00 C ATOM 0 H ALA A 128 6.596 9.713 3.910 1.00 0.00 H new ATOM 0 HA ALA A 128 8.105 8.543 6.051 1.00 0.00 H new ATOM 0 HB1 ALA A 128 7.047 6.491 5.260 1.00 0.00 H new ATOM 0 HB2 ALA A 128 5.868 7.815 5.420 1.00 0.00 H new ATOM 0 HB3 ALA A 128 6.466 7.345 3.811 1.00 0.00 H new ATOM 2071 N GLU A 129 9.119 8.185 2.968 1.00 0.00 N ATOM 2072 CA GLU A 129 10.254 7.919 2.149 1.00 0.00 C ATOM 2073 C GLU A 129 11.442 8.686 2.687 1.00 0.00 C ATOM 2074 O GLU A 129 12.455 8.093 3.021 1.00 0.00 O ATOM 2075 CB GLU A 129 9.997 8.339 0.710 1.00 0.00 C ATOM 2076 CG GLU A 129 11.161 8.052 -0.195 1.00 0.00 C ATOM 2077 CD GLU A 129 11.015 8.651 -1.550 1.00 0.00 C ATOM 2078 OE1 GLU A 129 11.363 9.843 -1.715 1.00 0.00 O ATOM 2079 OE2 GLU A 129 10.569 7.962 -2.469 1.00 0.00 O ATOM 0 H GLU A 129 8.318 8.556 2.456 1.00 0.00 H new ATOM 0 HA GLU A 129 10.453 6.848 2.166 1.00 0.00 H new ATOM 0 HB2 GLU A 129 9.115 7.819 0.336 1.00 0.00 H new ATOM 0 HB3 GLU A 129 9.774 9.406 0.682 1.00 0.00 H new ATOM 0 HG2 GLU A 129 12.073 8.431 0.266 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.279 6.973 -0.293 1.00 0.00 H new ATOM 2086 N ALA A 130 11.288 10.012 2.821 1.00 0.00 N ATOM 2087 CA ALA A 130 12.362 10.858 3.318 1.00 0.00 C ATOM 2088 C ALA A 130 12.805 10.439 4.706 1.00 0.00 C ATOM 2089 O ALA A 130 14.002 10.505 5.033 1.00 0.00 O ATOM 2090 CB ALA A 130 12.004 12.326 3.266 1.00 0.00 C ATOM 0 H ALA A 130 10.429 10.512 2.591 1.00 0.00 H new ATOM 0 HA ALA A 130 13.210 10.718 2.648 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.837 12.917 3.647 1.00 0.00 H new ATOM 0 HB2 ALA A 130 11.796 12.614 2.235 1.00 0.00 H new ATOM 0 HB3 ALA A 130 11.120 12.507 3.878 1.00 0.00 H new ATOM 2096 N GLN A 131 11.850 9.976 5.506 1.00 0.00 N ATOM 2097 CA GLN A 131 12.135 9.426 6.810 1.00 0.00 C ATOM 2098 C GLN A 131 13.053 8.203 6.637 1.00 0.00 C ATOM 2099 O GLN A 131 14.129 8.131 7.226 1.00 0.00 O ATOM 2100 CB GLN A 131 10.799 9.042 7.490 1.00 0.00 C ATOM 2101 CG GLN A 131 10.841 8.688 8.984 1.00 0.00 C ATOM 2102 CD GLN A 131 11.477 7.353 9.352 1.00 0.00 C ATOM 2103 OE1 GLN A 131 12.045 7.223 10.428 1.00 0.00 O ATOM 2104 NE2 GLN A 131 11.365 6.355 8.501 1.00 0.00 N ATOM 0 H GLN A 131 10.860 9.975 5.261 1.00 0.00 H new ATOM 0 HA GLN A 131 12.645 10.153 7.443 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.105 9.872 7.360 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.381 8.190 6.954 1.00 0.00 H new ATOM 0 HG2 GLN A 131 11.381 9.478 9.506 1.00 0.00 H new ATOM 0 HG3 GLN A 131 9.820 8.695 9.364 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.886 6.495 7.612 1.00 0.00 H new ATOM 0 HE22 GLN A 131 11.758 5.442 8.731 1.00 0.00 H new ATOM 2113 N ALA A 132 12.687 7.309 5.732 1.00 0.00 N ATOM 2114 CA ALA A 132 13.430 6.070 5.561 1.00 0.00 C ATOM 2115 C ALA A 132 14.774 6.374 4.927 1.00 0.00 C ATOM 2116 O ALA A 132 15.770 5.689 5.146 1.00 0.00 O ATOM 2117 CB ALA A 132 12.628 5.097 4.717 1.00 0.00 C ATOM 0 H ALA A 132 11.887 7.416 5.109 1.00 0.00 H new ATOM 0 HA ALA A 132 13.604 5.605 6.531 1.00 0.00 H new ATOM 0 HB1 ALA A 132 13.191 4.172 4.594 1.00 0.00 H new ATOM 0 HB2 ALA A 132 11.681 4.882 5.211 1.00 0.00 H new ATOM 0 HB3 ALA A 132 12.435 5.537 3.739 1.00 0.00 H new ATOM 2123 N LYS A 133 14.791 7.454 4.221 1.00 0.00 N ATOM 2124 CA LYS A 133 15.942 7.941 3.554 1.00 0.00 C ATOM 2125 C LYS A 133 16.932 8.445 4.542 1.00 0.00 C ATOM 2126 O LYS A 133 18.107 8.086 4.501 1.00 0.00 O ATOM 2127 CB LYS A 133 15.530 9.043 2.648 1.00 0.00 C ATOM 2128 CG LYS A 133 14.943 8.597 1.360 1.00 0.00 C ATOM 2129 CD LYS A 133 14.575 9.798 0.528 1.00 0.00 C ATOM 2130 CE LYS A 133 14.438 9.472 -0.931 1.00 0.00 C ATOM 2131 NZ LYS A 133 14.156 10.676 -1.726 1.00 0.00 N ATOM 0 H LYS A 133 13.968 8.042 4.090 1.00 0.00 H new ATOM 0 HA LYS A 133 16.404 7.137 2.981 1.00 0.00 H new ATOM 0 HB2 LYS A 133 14.803 9.669 3.166 1.00 0.00 H new ATOM 0 HB3 LYS A 133 16.398 9.668 2.439 1.00 0.00 H new ATOM 0 HG2 LYS A 133 15.656 7.973 0.821 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.060 7.985 1.544 1.00 0.00 H new ATOM 0 HD2 LYS A 133 13.636 10.214 0.893 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.335 10.569 0.654 1.00 0.00 H new ATOM 0 HE2 LYS A 133 15.356 9.005 -1.289 1.00 0.00 H new ATOM 0 HE3 LYS A 133 13.636 8.747 -1.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 14.551 10.562 -2.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 13.128 10.816 -1.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 14.590 11.503 -1.269 1.00 0.00 H new ATOM 2145 N LYS A 134 16.455 9.271 5.441 1.00 0.00 N ATOM 2146 CA LYS A 134 17.294 9.793 6.482 1.00 0.00 C ATOM 2147 C LYS A 134 17.677 8.689 7.465 1.00 0.00 C ATOM 2148 O LYS A 134 18.700 8.773 8.150 1.00 0.00 O ATOM 2149 CB LYS A 134 16.640 11.019 7.166 1.00 0.00 C ATOM 2150 CG LYS A 134 15.324 10.795 7.898 1.00 0.00 C ATOM 2151 CD LYS A 134 15.554 10.206 9.277 1.00 0.00 C ATOM 2152 CE LYS A 134 14.294 10.059 10.094 1.00 0.00 C ATOM 2153 NZ LYS A 134 13.827 11.334 10.672 1.00 0.00 N ATOM 0 H LYS A 134 15.488 9.594 5.469 1.00 0.00 H new ATOM 0 HA LYS A 134 18.222 10.155 6.040 1.00 0.00 H new ATOM 0 HB2 LYS A 134 17.356 11.429 7.879 1.00 0.00 H new ATOM 0 HB3 LYS A 134 16.476 11.782 6.405 1.00 0.00 H new ATOM 0 HG2 LYS A 134 14.790 11.741 7.989 1.00 0.00 H new ATOM 0 HG3 LYS A 134 14.691 10.126 7.315 1.00 0.00 H new ATOM 0 HD2 LYS A 134 16.023 9.228 9.171 1.00 0.00 H new ATOM 0 HD3 LYS A 134 16.256 10.839 9.820 1.00 0.00 H new ATOM 0 HE2 LYS A 134 13.507 9.642 9.465 1.00 0.00 H new ATOM 0 HE3 LYS A 134 14.471 9.345 10.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 12.959 11.169 11.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 14.563 11.723 11.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 13.629 12.010 9.907 1.00 0.00 H new ATOM 2167 N GLU A 135 16.844 7.660 7.549 1.00 0.00 N ATOM 2168 CA GLU A 135 17.153 6.519 8.398 1.00 0.00 C ATOM 2169 C GLU A 135 18.188 5.639 7.783 1.00 0.00 C ATOM 2170 O GLU A 135 19.020 5.058 8.496 1.00 0.00 O ATOM 2171 CB GLU A 135 15.934 5.687 8.616 1.00 0.00 C ATOM 2172 CG GLU A 135 14.916 6.359 9.433 1.00 0.00 C ATOM 2173 CD GLU A 135 15.333 6.537 10.879 1.00 0.00 C ATOM 2174 OE1 GLU A 135 16.034 7.529 11.203 1.00 0.00 O ATOM 2175 OE2 GLU A 135 14.979 5.687 11.718 1.00 0.00 O ATOM 0 H GLU A 135 15.959 7.592 7.046 1.00 0.00 H new ATOM 0 HA GLU A 135 17.525 6.922 9.340 1.00 0.00 H new ATOM 0 HB2 GLU A 135 15.502 5.426 7.650 1.00 0.00 H new ATOM 0 HB3 GLU A 135 16.221 4.753 9.099 1.00 0.00 H new ATOM 0 HG2 GLU A 135 14.700 7.336 9.001 1.00 0.00 H new ATOM 0 HG3 GLU A 135 13.992 5.783 9.397 1.00 0.00 H new ATOM 2182 N LYS A 136 18.129 5.551 6.457 1.00 0.00 N ATOM 2183 CA LYS A 136 18.900 4.624 5.664 1.00 0.00 C ATOM 2184 C LYS A 136 18.244 3.297 5.877 1.00 0.00 C ATOM 2185 O LYS A 136 18.671 2.477 6.690 1.00 0.00 O ATOM 2186 CB LYS A 136 20.403 4.575 6.011 1.00 0.00 C ATOM 2187 CG LYS A 136 21.136 5.900 5.875 1.00 0.00 C ATOM 2188 CD LYS A 136 22.545 5.845 6.485 1.00 0.00 C ATOM 2189 CE LYS A 136 22.560 5.904 8.038 1.00 0.00 C ATOM 2190 NZ LYS A 136 21.878 4.761 8.712 1.00 0.00 N ATOM 0 H LYS A 136 17.520 6.147 5.895 1.00 0.00 H new ATOM 0 HA LYS A 136 18.899 4.939 4.620 1.00 0.00 H new ATOM 0 HB2 LYS A 136 20.513 4.219 7.036 1.00 0.00 H new ATOM 0 HB3 LYS A 136 20.886 3.841 5.365 1.00 0.00 H new ATOM 0 HG2 LYS A 136 21.208 6.168 4.821 1.00 0.00 H new ATOM 0 HG3 LYS A 136 20.560 6.685 6.365 1.00 0.00 H new ATOM 0 HD2 LYS A 136 23.035 4.927 6.161 1.00 0.00 H new ATOM 0 HD3 LYS A 136 23.133 6.675 6.094 1.00 0.00 H new ATOM 0 HE2 LYS A 136 23.595 5.942 8.377 1.00 0.00 H new ATOM 0 HE3 LYS A 136 22.086 6.832 8.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 22.236 4.667 9.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 20.853 4.934 8.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 22.069 3.884 8.186 1.00 0.00 H new ATOM 2204 N LEU A 137 17.090 3.199 5.318 1.00 0.00 N ATOM 2205 CA LEU A 137 16.294 2.030 5.409 1.00 0.00 C ATOM 2206 C LEU A 137 16.259 1.201 4.148 1.00 0.00 C ATOM 2207 O LEU A 137 15.745 1.639 3.126 1.00 0.00 O ATOM 2208 CB LEU A 137 14.923 2.441 5.770 1.00 0.00 C ATOM 2209 CG LEU A 137 14.638 2.663 7.236 1.00 0.00 C ATOM 2210 CD1 LEU A 137 13.235 3.045 7.442 1.00 0.00 C ATOM 2211 CD2 LEU A 137 14.914 1.454 8.057 1.00 0.00 C ATOM 0 H LEU A 137 16.664 3.948 4.772 1.00 0.00 H new ATOM 0 HA LEU A 137 16.745 1.389 6.166 1.00 0.00 H new ATOM 0 HB2 LEU A 137 14.694 3.364 5.237 1.00 0.00 H new ATOM 0 HB3 LEU A 137 14.234 1.681 5.402 1.00 0.00 H new ATOM 0 HG LEU A 137 15.304 3.465 7.555 1.00 0.00 H new ATOM 0 HD11 LEU A 137 13.052 3.200 8.505 1.00 0.00 H new ATOM 0 HD12 LEU A 137 13.026 3.967 6.900 1.00 0.00 H new ATOM 0 HD13 LEU A 137 12.584 2.252 7.074 1.00 0.00 H new ATOM 0 HD21 LEU A 137 14.693 1.666 9.103 1.00 0.00 H new ATOM 0 HD22 LEU A 137 14.288 0.630 7.714 1.00 0.00 H new ATOM 0 HD23 LEU A 137 15.964 1.178 7.957 1.00 0.00 H new ATOM 2223 N ASN A 138 16.763 -0.011 4.268 1.00 0.00 N ATOM 2224 CA ASN A 138 16.788 -1.045 3.219 1.00 0.00 C ATOM 2225 C ASN A 138 17.264 -0.535 1.857 1.00 0.00 C ATOM 2226 O ASN A 138 18.459 -0.500 1.589 1.00 0.00 O ATOM 2227 CB ASN A 138 15.445 -1.767 3.089 1.00 0.00 C ATOM 2228 CG ASN A 138 15.017 -2.540 4.324 1.00 0.00 C ATOM 2229 OD1 ASN A 138 15.409 -3.692 4.527 1.00 0.00 O ATOM 2230 ND2 ASN A 138 14.154 -1.959 5.117 1.00 0.00 N ATOM 0 H ASN A 138 17.190 -0.330 5.137 1.00 0.00 H new ATOM 0 HA ASN A 138 17.534 -1.765 3.555 1.00 0.00 H new ATOM 0 HB2 ASN A 138 14.675 -1.033 2.852 1.00 0.00 H new ATOM 0 HB3 ASN A 138 15.499 -2.456 2.246 1.00 0.00 H new ATOM 0 HD21 ASN A 138 13.788 -2.460 5.927 1.00 0.00 H new ATOM 0 HD22 ASN A 138 13.847 -1.005 4.925 1.00 0.00 H new ATOM 2237 N ILE A 139 16.322 -0.084 1.014 1.00 0.00 N ATOM 2238 CA ILE A 139 16.648 0.472 -0.305 1.00 0.00 C ATOM 2239 C ILE A 139 17.478 1.722 -0.162 1.00 0.00 C ATOM 2240 O ILE A 139 18.317 2.027 -1.000 1.00 0.00 O ATOM 2241 CB ILE A 139 15.383 0.779 -1.155 1.00 0.00 C ATOM 2242 CG1 ILE A 139 14.368 1.624 -0.386 1.00 0.00 C ATOM 2243 CG2 ILE A 139 14.743 -0.495 -1.682 1.00 0.00 C ATOM 2244 CD1 ILE A 139 13.135 1.968 -1.191 1.00 0.00 C ATOM 0 H ILE A 139 15.324 -0.095 1.226 1.00 0.00 H new ATOM 0 HA ILE A 139 17.220 -0.292 -0.832 1.00 0.00 H new ATOM 0 HB ILE A 139 15.714 1.367 -2.011 1.00 0.00 H new ATOM 0 HG12 ILE A 139 14.067 1.086 0.513 1.00 0.00 H new ATOM 0 HG13 ILE A 139 14.848 2.547 -0.060 1.00 0.00 H new ATOM 0 HG21 ILE A 139 13.862 -0.242 -2.272 1.00 0.00 H new ATOM 0 HG22 ILE A 139 15.458 -1.029 -2.308 1.00 0.00 H new ATOM 0 HG23 ILE A 139 14.450 -1.128 -0.845 1.00 0.00 H new ATOM 0 HD11 ILE A 139 12.459 2.569 -0.582 1.00 0.00 H new ATOM 0 HD12 ILE A 139 13.425 2.533 -2.077 1.00 0.00 H new ATOM 0 HD13 ILE A 139 12.631 1.050 -1.495 1.00 0.00 H new ATOM 2256 N TRP A 140 17.298 2.372 0.955 1.00 0.00 N ATOM 2257 CA TRP A 140 17.941 3.611 1.290 1.00 0.00 C ATOM 2258 C TRP A 140 19.320 3.366 1.900 1.00 0.00 C ATOM 2259 O TRP A 140 20.023 4.300 2.303 1.00 0.00 O ATOM 2260 CB TRP A 140 16.978 4.403 2.208 1.00 0.00 C ATOM 2261 CG TRP A 140 15.673 4.692 1.554 1.00 0.00 C ATOM 2262 CD1 TRP A 140 14.472 4.421 2.072 1.00 0.00 C ATOM 2263 CD2 TRP A 140 15.430 5.242 0.241 1.00 0.00 C ATOM 2264 NE1 TRP A 140 13.483 4.721 1.173 1.00 0.00 N ATOM 2265 CE2 TRP A 140 14.043 5.237 0.049 1.00 0.00 C ATOM 2266 CE3 TRP A 140 16.237 5.729 -0.778 1.00 0.00 C ATOM 2267 CZ2 TRP A 140 13.450 5.691 -1.123 1.00 0.00 C ATOM 2268 CZ3 TRP A 140 15.649 6.184 -1.937 1.00 0.00 C ATOM 2269 CH2 TRP A 140 14.267 6.160 -2.103 1.00 0.00 C ATOM 0 H TRP A 140 16.672 2.037 1.687 1.00 0.00 H new ATOM 0 HA TRP A 140 18.137 4.211 0.401 1.00 0.00 H new ATOM 0 HB2 TRP A 140 16.804 3.835 3.122 1.00 0.00 H new ATOM 0 HB3 TRP A 140 17.450 5.341 2.500 1.00 0.00 H new ATOM 0 HD1 TRP A 140 14.304 4.021 3.061 1.00 0.00 H new ATOM 0 HE1 TRP A 140 12.484 4.579 1.324 1.00 0.00 H new ATOM 0 HE3 TRP A 140 17.311 5.751 -0.663 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 12.378 5.672 -1.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 16.272 6.567 -2.732 1.00 0.00 H new ATOM 0 HH2 TRP A 140 13.837 6.520 -3.026 1.00 0.00 H new ATOM 2280 N SER A 141 19.713 2.118 1.920 1.00 0.00 N ATOM 2281 CA SER A 141 20.999 1.726 2.430 1.00 0.00 C ATOM 2282 C SER A 141 21.831 1.060 1.344 1.00 0.00 C ATOM 2283 O SER A 141 23.043 0.916 1.474 1.00 0.00 O ATOM 2284 CB SER A 141 20.775 0.740 3.541 1.00 0.00 C ATOM 2285 OG SER A 141 19.992 1.298 4.556 1.00 0.00 O ATOM 0 H SER A 141 19.145 1.342 1.580 1.00 0.00 H new ATOM 0 HA SER A 141 21.533 2.608 2.783 1.00 0.00 H new ATOM 0 HB2 SER A 141 20.286 -0.151 3.148 1.00 0.00 H new ATOM 0 HB3 SER A 141 21.734 0.423 3.950 1.00 0.00 H new ATOM 0 HG SER A 141 19.859 0.637 5.267 1.00 0.00 H new ATOM 2291 N GLU A 142 21.180 0.708 0.257 1.00 0.00 N ATOM 2292 CA GLU A 142 21.762 -0.087 -0.778 1.00 0.00 C ATOM 2293 C GLU A 142 22.815 0.599 -1.603 1.00 0.00 C ATOM 2294 O GLU A 142 23.708 -0.060 -2.149 1.00 0.00 O ATOM 2295 CB GLU A 142 20.675 -0.635 -1.655 1.00 0.00 C ATOM 2296 CG GLU A 142 19.826 -1.708 -1.013 1.00 0.00 C ATOM 2297 CD GLU A 142 20.637 -2.898 -0.558 1.00 0.00 C ATOM 2298 OE1 GLU A 142 21.406 -3.461 -1.372 1.00 0.00 O ATOM 2299 OE2 GLU A 142 20.552 -3.267 0.627 1.00 0.00 O ATOM 0 H GLU A 142 20.213 0.976 0.074 1.00 0.00 H new ATOM 0 HA GLU A 142 22.297 -0.890 -0.271 1.00 0.00 H new ATOM 0 HB2 GLU A 142 20.027 0.186 -1.963 1.00 0.00 H new ATOM 0 HB3 GLU A 142 21.127 -1.041 -2.560 1.00 0.00 H new ATOM 0 HG2 GLU A 142 19.298 -1.285 -0.158 1.00 0.00 H new ATOM 0 HG3 GLU A 142 19.069 -2.040 -1.723 1.00 0.00 H new ATOM 2306 N ASP A 143 22.723 1.880 -1.670 1.00 0.00 N ATOM 2307 CA ASP A 143 23.612 2.691 -2.533 1.00 0.00 C ATOM 2308 C ASP A 143 23.331 4.152 -2.403 1.00 0.00 C ATOM 2309 O ASP A 143 24.052 4.901 -1.760 1.00 0.00 O ATOM 2310 CB ASP A 143 23.474 2.244 -4.019 1.00 0.00 C ATOM 2311 CG ASP A 143 24.273 3.068 -5.009 1.00 0.00 C ATOM 2312 OD1 ASP A 143 25.446 2.750 -5.265 1.00 0.00 O ATOM 2313 OD2 ASP A 143 23.705 3.992 -5.606 1.00 0.00 O ATOM 0 H ASP A 143 22.042 2.426 -1.143 1.00 0.00 H new ATOM 0 HA ASP A 143 24.637 2.523 -2.201 1.00 0.00 H new ATOM 0 HB2 ASP A 143 23.785 1.202 -4.100 1.00 0.00 H new ATOM 0 HB3 ASP A 143 22.422 2.285 -4.300 1.00 0.00 H new ATOM 2318 N ASN A 144 22.237 4.456 -2.943 1.00 0.00 N ATOM 2319 CA ASN A 144 21.658 5.790 -3.134 1.00 0.00 C ATOM 2320 C ASN A 144 21.830 6.775 -1.970 1.00 0.00 C ATOM 2321 O ASN A 144 22.705 7.641 -2.019 1.00 0.00 O ATOM 2322 CB ASN A 144 20.177 5.677 -3.550 1.00 0.00 C ATOM 2323 CG ASN A 144 19.396 4.689 -2.695 1.00 0.00 C ATOM 2324 OD1 ASN A 144 18.937 5.025 -1.628 1.00 0.00 O ATOM 2325 ND2 ASN A 144 19.219 3.477 -3.169 1.00 0.00 N ATOM 0 H ASN A 144 21.625 3.731 -3.317 1.00 0.00 H new ATOM 0 HA ASN A 144 22.246 6.233 -3.938 1.00 0.00 H new ATOM 0 HB2 ASN A 144 19.709 6.659 -3.481 1.00 0.00 H new ATOM 0 HB3 ASN A 144 20.120 5.370 -4.594 1.00 0.00 H new ATOM 0 HD21 ASN A 144 18.683 2.793 -2.634 1.00 0.00 H new ATOM 0 HD22 ASN A 144 19.617 3.219 -4.072 1.00 0.00 H new ATOM 2332 N ALA A 145 21.015 6.631 -0.948 1.00 0.00 N ATOM 2333 CA ALA A 145 20.979 7.564 0.166 1.00 0.00 C ATOM 2334 C ALA A 145 22.293 7.656 0.892 1.00 0.00 C ATOM 2335 O ALA A 145 22.940 8.703 0.853 1.00 0.00 O ATOM 2336 CB ALA A 145 19.826 7.264 1.113 1.00 0.00 C ATOM 0 H ALA A 145 20.353 5.860 -0.862 1.00 0.00 H new ATOM 0 HA ALA A 145 20.801 8.550 -0.263 1.00 0.00 H new ATOM 0 HB1 ALA A 145 19.832 7.982 1.933 1.00 0.00 H new ATOM 0 HB2 ALA A 145 18.882 7.338 0.572 1.00 0.00 H new ATOM 0 HB3 ALA A 145 19.937 6.256 1.513 1.00 0.00 H new ATOM 2342 N ASP A 146 22.651 6.599 1.627 1.00 0.00 N ATOM 2343 CA ASP A 146 23.967 6.509 2.357 1.00 0.00 C ATOM 2344 C ASP A 146 24.050 7.489 3.515 1.00 0.00 C ATOM 2345 O ASP A 146 24.949 7.446 4.348 1.00 0.00 O ATOM 2346 CB ASP A 146 25.156 6.671 1.369 1.00 0.00 C ATOM 2347 CG ASP A 146 26.540 6.667 2.015 1.00 0.00 C ATOM 2348 OD1 ASP A 146 27.123 5.581 2.230 1.00 0.00 O ATOM 2349 OD2 ASP A 146 27.083 7.744 2.303 1.00 0.00 O ATOM 0 H ASP A 146 22.059 5.777 1.747 1.00 0.00 H new ATOM 0 HA ASP A 146 24.033 5.514 2.797 1.00 0.00 H new ATOM 0 HB2 ASP A 146 25.112 5.865 0.636 1.00 0.00 H new ATOM 0 HB3 ASP A 146 25.030 7.606 0.823 1.00 0.00 H new ATOM 2354 N SER A 147 23.042 8.256 3.618 1.00 0.00 N ATOM 2355 CA SER A 147 22.989 9.367 4.508 1.00 0.00 C ATOM 2356 C SER A 147 21.576 9.955 4.551 1.00 0.00 C ATOM 2357 O SER A 147 20.967 10.061 5.619 1.00 0.00 O ATOM 2358 CB SER A 147 24.025 10.391 4.028 1.00 0.00 C ATOM 2359 OG SER A 147 23.868 10.696 2.628 1.00 0.00 O ATOM 0 H SER A 147 22.191 8.133 3.069 1.00 0.00 H new ATOM 0 HA SER A 147 23.225 9.062 5.528 1.00 0.00 H new ATOM 0 HB2 SER A 147 23.929 11.306 4.612 1.00 0.00 H new ATOM 0 HB3 SER A 147 25.028 10.003 4.205 1.00 0.00 H new ATOM 0 HG SER A 147 23.482 9.923 2.166 1.00 0.00 H new ATOM 2365 N GLY A 148 21.070 10.325 3.400 1.00 0.00 N ATOM 2366 CA GLY A 148 19.744 10.857 3.298 1.00 0.00 C ATOM 2367 C GLY A 148 19.600 11.657 2.038 1.00 0.00 C ATOM 2368 O GLY A 148 20.572 12.292 1.590 1.00 0.00 O ATOM 0 H GLY A 148 21.569 10.264 2.512 1.00 0.00 H new ATOM 0 HA2 GLY A 148 19.017 10.045 3.306 1.00 0.00 H new ATOM 0 HA3 GLY A 148 19.529 11.485 4.162 1.00 0.00 H new ATOM 2372 N GLN A 149 18.430 11.626 1.457 1.00 0.00 N ATOM 2373 CA GLN A 149 18.148 12.322 0.231 1.00 0.00 C ATOM 2374 C GLN A 149 16.640 12.500 0.137 1.00 0.00 C ATOM 2375 O GLN A 149 16.058 12.371 -0.959 1.00 0.00 O ATOM 2376 CB GLN A 149 18.708 11.519 -0.974 1.00 0.00 C ATOM 2377 CG GLN A 149 18.160 10.094 -1.107 1.00 0.00 C ATOM 2378 CD GLN A 149 18.799 9.317 -2.239 1.00 0.00 C ATOM 2379 OE1 GLN A 149 19.963 9.525 -2.574 1.00 0.00 O ATOM 2380 NE2 GLN A 149 18.043 8.445 -2.849 1.00 0.00 N ATOM 2381 OXT GLN A 149 16.010 12.664 1.202 1.00 0.00 O ATOM 0 H GLN A 149 17.634 11.108 1.829 1.00 0.00 H new ATOM 0 HA GLN A 149 18.629 13.300 0.215 1.00 0.00 H new ATOM 0 HB2 GLN A 149 18.487 12.065 -1.891 1.00 0.00 H new ATOM 0 HB3 GLN A 149 19.793 11.469 -0.887 1.00 0.00 H new ATOM 0 HG2 GLN A 149 18.321 9.560 -0.171 1.00 0.00 H new ATOM 0 HG3 GLN A 149 17.083 10.138 -1.267 1.00 0.00 H new ATOM 0 HE21 GLN A 149 17.081 8.300 -2.542 1.00 0.00 H new ATOM 0 HE22 GLN A 149 18.414 7.908 -3.633 1.00 0.00 H new TER 2390 GLN A 149