USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1038 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 63 SER OG : rot -47:sc= 1.28 USER MOD Set 1.2: A 66 ASN : amide:sc= 1.35 K(o=2.6,f=-3.4!) USER MOD Set 2.1: A -2 HIS : no HD1:sc= -0.0304 X(o=-0.062,f=0.1) USER MOD Set 2.2: A -4 HIS : no HE2:sc= -0.0317 X(o=-0.062,f=-0.46) USER MOD Set 3.1: A -1 HIS : no HD1:sc= -0.477 K(o=-1.2,f=-0.37) USER MOD Set 3.2: A -3 HIS : no HD1:sc= -0.757 K(o=-1.2,f=-0.37) USER MOD Single : A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -5 HIS : no HD1:sc= -0.0139 X(o=-0.014,f=-0.039) USER MOD Single : A -5 HIS N :NH3+ -175:sc= 0 (180deg=-0.0122) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0139) USER MOD Single : A 14 THR OG1 : rot 180:sc=-0.00511 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 23 HIS : no HD1:sc= -0.0122 X(o=-0.012,f=-0.094) USER MOD Single : A 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.0456 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.223 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 48 SER OG : rot 180:sc=0.000555 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -3.23 K(o=-3.2,f=-2.7!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= -1.13 K(o=-1.1,f=-2.7!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -74:sc= 0.381 USER MOD Single : A 77 HIS : no HD1:sc= -2.04 K(o=-2,f=-4.4!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 166:sc= 0.0235 USER MOD Single : A 101 ASN : amide:sc= -2.45 K(o=-2.4,f=-5.5!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 HIS : no HD1:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot -64:sc= 1.05 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot -20:sc= -0.758 USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 140 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.0445) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -5 111.170 8.626 39.001 1.00 0.00 N ATOM 2 CA HIS A -5 110.461 8.690 37.692 1.00 0.00 C ATOM 3 C HIS A -5 110.307 10.148 37.271 1.00 0.00 C ATOM 4 O HIS A -5 109.502 10.887 37.839 1.00 0.00 O ATOM 5 CB HIS A -5 109.083 8.039 37.827 1.00 0.00 C ATOM 6 CG HIS A -5 109.145 6.570 38.147 1.00 0.00 C ATOM 7 ND1 HIS A -5 109.134 6.096 39.450 1.00 0.00 N ATOM 8 CD2 HIS A -5 109.218 5.458 37.345 1.00 0.00 C ATOM 9 CE1 HIS A -5 109.198 4.755 39.394 1.00 0.00 C ATOM 10 NE2 HIS A -5 109.252 4.313 38.136 1.00 0.00 N ATOM 0 H1 HIS A -5 111.351 7.633 39.249 1.00 0.00 H new ATOM 0 H2 HIS A -5 112.074 9.136 38.932 1.00 0.00 H new ATOM 0 H3 HIS A -5 110.580 9.065 39.737 1.00 0.00 H new ATOM 0 HA HIS A -5 111.037 8.156 36.936 1.00 0.00 H new ATOM 0 HB2 HIS A -5 108.523 8.550 38.610 1.00 0.00 H new ATOM 0 HB3 HIS A -5 108.531 8.178 36.897 1.00 0.00 H new ATOM 0 HD2 HIS A -5 109.245 5.470 36.265 1.00 0.00 H new ATOM 0 HE1 HIS A -5 109.205 4.113 40.262 1.00 0.00 H new ATOM 0 HE2 HIS A -5 109.306 3.344 37.822 1.00 0.00 H new ATOM 20 N HIS A -4 111.084 10.557 36.271 1.00 0.00 N ATOM 21 CA HIS A -4 111.030 11.929 35.772 1.00 0.00 C ATOM 22 C HIS A -4 110.704 11.941 34.282 1.00 0.00 C ATOM 23 O HIS A -4 111.343 11.245 33.492 1.00 0.00 O ATOM 24 CB HIS A -4 112.374 12.620 36.006 1.00 0.00 C ATOM 25 CG HIS A -4 112.384 14.066 35.590 1.00 0.00 C ATOM 26 ND1 HIS A -4 111.624 15.027 36.237 1.00 0.00 N ATOM 27 CD2 HIS A -4 113.059 14.731 34.594 1.00 0.00 C ATOM 28 CE1 HIS A -4 111.855 16.204 35.631 1.00 0.00 C ATOM 29 NE2 HIS A -4 112.722 16.081 34.623 1.00 0.00 N ATOM 0 H HIS A -4 111.757 9.960 35.791 1.00 0.00 H new ATOM 0 HA HIS A -4 110.247 12.464 36.310 1.00 0.00 H new ATOM 0 HB2 HIS A -4 112.629 12.552 37.063 1.00 0.00 H new ATOM 0 HB3 HIS A -4 113.149 12.086 35.456 1.00 0.00 H new ATOM 0 HD1 HIS A -4 111.002 14.870 37.030 1.00 0.00 H new ATOM 0 HD2 HIS A -4 113.746 14.276 33.896 1.00 0.00 H new ATOM 0 HE1 HIS A -4 111.395 17.136 35.924 1.00 0.00 H new ATOM 37 N HIS A -3 109.706 12.735 33.905 1.00 0.00 N ATOM 38 CA HIS A -3 109.298 12.831 32.508 1.00 0.00 C ATOM 39 C HIS A -3 109.084 14.288 32.112 1.00 0.00 C ATOM 40 O HIS A -3 108.852 15.146 32.964 1.00 0.00 O ATOM 41 CB HIS A -3 108.003 12.046 32.288 1.00 0.00 C ATOM 42 CG HIS A -3 107.564 12.008 30.849 1.00 0.00 C ATOM 43 ND1 HIS A -3 108.294 11.350 29.871 1.00 0.00 N ATOM 44 CD2 HIS A -3 106.473 12.540 30.207 1.00 0.00 C ATOM 45 CE1 HIS A -3 107.641 11.502 28.707 1.00 0.00 C ATOM 46 NE2 HIS A -3 106.525 12.219 28.853 1.00 0.00 N ATOM 0 H HIS A -3 109.167 13.319 34.545 1.00 0.00 H new ATOM 0 HA HIS A -3 110.089 12.410 31.888 1.00 0.00 H new ATOM 0 HB2 HIS A -3 108.140 11.025 32.645 1.00 0.00 H new ATOM 0 HB3 HIS A -3 107.211 12.491 32.890 1.00 0.00 H new ATOM 0 HD2 HIS A -3 105.694 13.119 30.680 1.00 0.00 H new ATOM 0 HE1 HIS A -3 107.979 11.093 27.766 1.00 0.00 H new ATOM 0 HE2 HIS A -3 105.854 12.476 28.129 1.00 0.00 H new ATOM 54 N HIS A -2 109.164 14.561 30.812 1.00 0.00 N ATOM 55 CA HIS A -2 108.971 15.916 30.303 1.00 0.00 C ATOM 56 C HIS A -2 107.682 16.001 29.492 1.00 0.00 C ATOM 57 O HIS A -2 107.363 15.097 28.720 1.00 0.00 O ATOM 58 CB HIS A -2 110.155 16.314 29.421 1.00 0.00 C ATOM 59 CG HIS A -2 111.470 16.323 30.153 1.00 0.00 C ATOM 60 ND1 HIS A -2 111.773 17.273 31.116 1.00 0.00 N ATOM 61 CD2 HIS A -2 112.571 15.505 30.073 1.00 0.00 C ATOM 62 CE1 HIS A -2 113.009 17.006 31.573 1.00 0.00 C ATOM 63 NE2 HIS A -2 113.542 15.940 30.972 1.00 0.00 N ATOM 0 H HIS A -2 109.361 13.864 30.094 1.00 0.00 H new ATOM 0 HA HIS A -2 108.903 16.598 31.150 1.00 0.00 H new ATOM 0 HB2 HIS A -2 110.220 15.623 28.580 1.00 0.00 H new ATOM 0 HB3 HIS A -2 109.972 17.305 29.006 1.00 0.00 H new ATOM 0 HD2 HIS A -2 112.669 14.655 29.414 1.00 0.00 H new ATOM 0 HE1 HIS A -2 113.510 17.585 32.335 1.00 0.00 H new ATOM 0 HE2 HIS A -2 114.462 15.532 31.136 1.00 0.00 H new ATOM 71 N HIS A -1 106.944 17.093 29.673 1.00 0.00 N ATOM 72 CA HIS A -1 105.678 17.286 28.969 1.00 0.00 C ATOM 73 C HIS A -1 105.764 18.485 28.030 1.00 0.00 C ATOM 74 O HIS A -1 106.332 19.520 28.378 1.00 0.00 O ATOM 75 CB HIS A -1 104.552 17.512 29.978 1.00 0.00 C ATOM 76 CG HIS A -1 104.342 16.350 30.912 1.00 0.00 C ATOM 77 ND1 HIS A -1 103.779 15.156 30.491 1.00 0.00 N ATOM 78 CD2 HIS A -1 104.614 16.186 32.249 1.00 0.00 C ATOM 79 CE1 HIS A -1 103.730 14.334 31.553 1.00 0.00 C ATOM 80 NE2 HIS A -1 104.226 14.911 32.651 1.00 0.00 N ATOM 0 H HIS A -1 107.199 17.856 30.299 1.00 0.00 H new ATOM 0 HA HIS A -1 105.470 16.391 28.382 1.00 0.00 H new ATOM 0 HB2 HIS A -1 104.773 18.404 30.564 1.00 0.00 H new ATOM 0 HB3 HIS A -1 103.625 17.707 29.439 1.00 0.00 H new ATOM 0 HD2 HIS A -1 105.060 16.932 32.890 1.00 0.00 H new ATOM 0 HE1 HIS A -1 103.337 13.328 31.522 1.00 0.00 H new ATOM 0 HE2 HIS A -1 104.304 14.505 33.583 1.00 0.00 H new ATOM 88 N HIS A 0 105.194 18.336 26.837 1.00 0.00 N ATOM 89 CA HIS A 0 105.191 19.413 25.850 1.00 0.00 C ATOM 90 C HIS A 0 103.768 19.702 25.386 1.00 0.00 C ATOM 91 O HIS A 0 103.000 18.782 25.098 1.00 0.00 O ATOM 92 CB HIS A 0 106.051 19.020 24.648 1.00 0.00 C ATOM 93 CG HIS A 0 106.170 20.108 23.616 1.00 0.00 C ATOM 94 ND1 HIS A 0 106.825 21.302 23.873 1.00 0.00 N ATOM 95 CD2 HIS A 0 105.723 20.197 22.320 1.00 0.00 C ATOM 96 CE1 HIS A 0 106.755 22.051 22.758 1.00 0.00 C ATOM 97 NE2 HIS A 0 106.094 21.426 21.781 1.00 0.00 N ATOM 0 H HIS A 0 104.729 17.482 26.530 1.00 0.00 H new ATOM 0 HA HIS A 0 105.603 20.310 26.312 1.00 0.00 H new ATOM 0 HB2 HIS A 0 107.048 18.750 24.997 1.00 0.00 H new ATOM 0 HB3 HIS A 0 105.625 18.132 24.181 1.00 0.00 H new ATOM 0 HD2 HIS A 0 105.168 19.431 21.799 1.00 0.00 H new ATOM 0 HE1 HIS A 0 107.182 23.039 22.664 1.00 0.00 H new ATOM 0 HE2 HIS A 0 105.902 21.774 20.842 1.00 0.00 H new ATOM 105 N SER A 1 103.419 20.984 25.313 1.00 0.00 N ATOM 106 CA SER A 1 102.079 21.390 24.896 1.00 0.00 C ATOM 107 C SER A 1 102.144 22.230 23.624 1.00 0.00 C ATOM 108 O SER A 1 103.049 23.045 23.452 1.00 0.00 O ATOM 109 CB SER A 1 101.414 22.201 26.008 1.00 0.00 C ATOM 110 OG SER A 1 100.073 22.490 25.637 1.00 0.00 O ATOM 0 H SER A 1 104.044 21.758 25.537 1.00 0.00 H new ATOM 0 HA SER A 1 101.493 20.493 24.696 1.00 0.00 H new ATOM 0 HB2 SER A 1 101.433 21.642 26.943 1.00 0.00 H new ATOM 0 HB3 SER A 1 101.964 23.126 26.179 1.00 0.00 H new ATOM 0 HG SER A 1 99.641 23.009 26.348 1.00 0.00 H new ATOM 116 N SER A 2 101.174 22.022 22.736 1.00 0.00 N ATOM 117 CA SER A 2 101.112 22.769 21.483 1.00 0.00 C ATOM 118 C SER A 2 99.746 23.428 21.325 1.00 0.00 C ATOM 119 O SER A 2 98.725 22.862 21.720 1.00 0.00 O ATOM 120 CB SER A 2 101.366 21.829 20.304 1.00 0.00 C ATOM 121 OG SER A 2 101.421 22.589 19.104 1.00 0.00 O ATOM 0 H SER A 2 100.422 21.344 22.861 1.00 0.00 H new ATOM 0 HA SER A 2 101.879 23.543 21.501 1.00 0.00 H new ATOM 0 HB2 SER A 2 102.301 21.288 20.449 1.00 0.00 H new ATOM 0 HB3 SER A 2 100.573 21.083 20.240 1.00 0.00 H new ATOM 0 HG SER A 2 101.585 21.991 18.345 1.00 0.00 H new ATOM 127 N GLY A 3 99.731 24.623 20.745 1.00 0.00 N ATOM 128 CA GLY A 3 98.482 25.348 20.546 1.00 0.00 C ATOM 129 C GLY A 3 97.774 24.876 19.280 1.00 0.00 C ATOM 130 O GLY A 3 98.267 23.998 18.572 1.00 0.00 O ATOM 0 H GLY A 3 100.563 25.107 20.407 1.00 0.00 H new ATOM 0 HA2 GLY A 3 97.831 25.202 21.408 1.00 0.00 H new ATOM 0 HA3 GLY A 3 98.684 26.417 20.477 1.00 0.00 H new ATOM 134 N LEU A 4 96.616 25.467 18.999 1.00 0.00 N ATOM 135 CA LEU A 4 95.848 25.097 17.816 1.00 0.00 C ATOM 136 C LEU A 4 96.099 26.086 16.682 1.00 0.00 C ATOM 137 O LEU A 4 96.175 27.294 16.905 1.00 0.00 O ATOM 138 CB LEU A 4 94.352 25.068 18.146 1.00 0.00 C ATOM 139 CG LEU A 4 94.087 24.104 19.308 1.00 0.00 C ATOM 140 CD1 LEU A 4 92.605 24.157 19.684 1.00 0.00 C ATOM 141 CD2 LEU A 4 94.449 22.677 18.889 1.00 0.00 C ATOM 0 H LEU A 4 96.192 26.198 19.570 1.00 0.00 H new ATOM 0 HA LEU A 4 96.168 24.105 17.498 1.00 0.00 H new ATOM 0 HB2 LEU A 4 94.010 26.069 18.409 1.00 0.00 H new ATOM 0 HB3 LEU A 4 93.784 24.757 17.269 1.00 0.00 H new ATOM 0 HG LEU A 4 94.696 24.397 20.164 1.00 0.00 H new ATOM 0 HD11 LEU A 4 92.415 23.472 20.510 1.00 0.00 H new ATOM 0 HD12 LEU A 4 92.342 25.171 19.985 1.00 0.00 H new ATOM 0 HD13 LEU A 4 92.001 23.866 18.825 1.00 0.00 H new ATOM 0 HD21 LEU A 4 94.259 21.995 19.718 1.00 0.00 H new ATOM 0 HD22 LEU A 4 93.842 22.384 18.032 1.00 0.00 H new ATOM 0 HD23 LEU A 4 95.504 22.634 18.618 1.00 0.00 H new ATOM 153 N VAL A 5 96.225 25.564 15.466 1.00 0.00 N ATOM 154 CA VAL A 5 96.457 26.412 14.302 1.00 0.00 C ATOM 155 C VAL A 5 95.171 27.174 13.958 1.00 0.00 C ATOM 156 O VAL A 5 94.084 26.610 14.094 1.00 0.00 O ATOM 157 CB VAL A 5 96.886 25.541 13.112 1.00 0.00 C ATOM 158 CG1 VAL A 5 97.174 26.418 11.892 1.00 0.00 C ATOM 159 CG2 VAL A 5 98.152 24.762 13.475 1.00 0.00 C ATOM 0 H VAL A 5 96.171 24.566 15.262 1.00 0.00 H new ATOM 0 HA VAL A 5 97.247 27.129 14.523 1.00 0.00 H new ATOM 0 HB VAL A 5 96.078 24.848 12.877 1.00 0.00 H new ATOM 0 HG11 VAL A 5 97.477 25.789 11.055 1.00 0.00 H new ATOM 0 HG12 VAL A 5 96.275 26.973 11.622 1.00 0.00 H new ATOM 0 HG13 VAL A 5 97.975 27.118 12.128 1.00 0.00 H new ATOM 0 HG21 VAL A 5 98.454 24.145 12.629 1.00 0.00 H new ATOM 0 HG22 VAL A 5 98.952 25.461 13.719 1.00 0.00 H new ATOM 0 HG23 VAL A 5 97.953 24.125 14.336 1.00 0.00 H new ATOM 169 N PRO A 6 95.247 28.416 13.525 1.00 0.00 N ATOM 170 CA PRO A 6 94.028 29.192 13.164 1.00 0.00 C ATOM 171 C PRO A 6 93.640 29.006 11.699 1.00 0.00 C ATOM 172 O PRO A 6 94.482 29.108 10.807 1.00 0.00 O ATOM 173 CB PRO A 6 94.441 30.637 13.442 1.00 0.00 C ATOM 174 CG PRO A 6 95.916 30.682 13.213 1.00 0.00 C ATOM 175 CD PRO A 6 96.449 29.250 13.331 1.00 0.00 C ATOM 0 HA PRO A 6 93.150 28.874 13.727 1.00 0.00 H new ATOM 0 HB2 PRO A 6 93.920 31.328 12.780 1.00 0.00 H new ATOM 0 HB3 PRO A 6 94.193 30.926 14.463 1.00 0.00 H new ATOM 0 HG2 PRO A 6 96.138 31.093 12.228 1.00 0.00 H new ATOM 0 HG3 PRO A 6 96.397 31.331 13.945 1.00 0.00 H new ATOM 0 HD2 PRO A 6 96.994 28.956 12.434 1.00 0.00 H new ATOM 0 HD3 PRO A 6 97.138 29.152 14.170 1.00 0.00 H new ATOM 183 N ARG A 7 92.362 28.734 11.460 1.00 0.00 N ATOM 184 CA ARG A 7 91.875 28.534 10.100 1.00 0.00 C ATOM 185 C ARG A 7 90.416 28.964 9.979 1.00 0.00 C ATOM 186 O ARG A 7 89.716 29.104 10.980 1.00 0.00 O ATOM 187 CB ARG A 7 92.018 27.061 9.706 1.00 0.00 C ATOM 188 CG ARG A 7 91.223 26.184 10.676 1.00 0.00 C ATOM 189 CD ARG A 7 91.395 24.713 10.296 1.00 0.00 C ATOM 190 NE ARG A 7 92.758 24.267 10.598 1.00 0.00 N ATOM 191 CZ ARG A 7 93.282 23.122 10.132 1.00 0.00 C ATOM 192 NH1 ARG A 7 92.606 22.306 9.359 1.00 0.00 N ATOM 193 NH2 ARG A 7 94.507 22.812 10.459 1.00 0.00 N ATOM 0 H ARG A 7 91.649 28.647 12.184 1.00 0.00 H new ATOM 0 HA ARG A 7 92.473 29.148 9.426 1.00 0.00 H new ATOM 0 HB2 ARG A 7 91.658 26.911 8.688 1.00 0.00 H new ATOM 0 HB3 ARG A 7 93.069 26.772 9.719 1.00 0.00 H new ATOM 0 HG2 ARG A 7 91.567 26.349 11.697 1.00 0.00 H new ATOM 0 HG3 ARG A 7 90.168 26.457 10.647 1.00 0.00 H new ATOM 0 HD2 ARG A 7 90.676 24.103 10.842 1.00 0.00 H new ATOM 0 HD3 ARG A 7 91.187 24.578 9.235 1.00 0.00 H new ATOM 0 HE ARG A 7 93.339 24.857 11.193 1.00 0.00 H new ATOM 0 HH11 ARG A 7 91.648 22.533 9.092 1.00 0.00 H new ATOM 0 HH12 ARG A 7 93.038 21.445 9.025 1.00 0.00 H new ATOM 0 HH21 ARG A 7 95.048 23.435 11.058 1.00 0.00 H new ATOM 0 HH22 ARG A 7 94.923 21.947 10.115 1.00 0.00 H new ATOM 207 N GLY A 8 89.967 29.173 8.745 1.00 0.00 N ATOM 208 CA GLY A 8 88.590 29.587 8.505 1.00 0.00 C ATOM 209 C GLY A 8 88.443 31.099 8.636 1.00 0.00 C ATOM 210 O GLY A 8 89.435 31.828 8.662 1.00 0.00 O ATOM 0 H GLY A 8 90.532 29.063 7.903 1.00 0.00 H new ATOM 0 HA2 GLY A 8 88.281 29.273 7.508 1.00 0.00 H new ATOM 0 HA3 GLY A 8 87.928 29.091 9.215 1.00 0.00 H new ATOM 214 N SER A 9 87.200 31.563 8.716 1.00 0.00 N ATOM 215 CA SER A 9 86.928 32.991 8.848 1.00 0.00 C ATOM 216 C SER A 9 85.924 33.242 9.968 1.00 0.00 C ATOM 217 O SER A 9 85.150 32.357 10.332 1.00 0.00 O ATOM 218 CB SER A 9 86.371 33.539 7.533 1.00 0.00 C ATOM 219 OG SER A 9 85.096 32.961 7.289 1.00 0.00 O ATOM 0 H SER A 9 86.368 30.974 8.692 1.00 0.00 H new ATOM 0 HA SER A 9 87.862 33.500 9.089 1.00 0.00 H new ATOM 0 HB2 SER A 9 86.288 34.625 7.584 1.00 0.00 H new ATOM 0 HB3 SER A 9 87.051 33.309 6.712 1.00 0.00 H new ATOM 0 HG SER A 9 84.734 33.310 6.448 1.00 0.00 H new ATOM 225 N GLY A 10 85.943 34.455 10.512 1.00 0.00 N ATOM 226 CA GLY A 10 85.033 34.811 11.594 1.00 0.00 C ATOM 227 C GLY A 10 83.692 35.287 11.045 1.00 0.00 C ATOM 228 O GLY A 10 83.453 35.244 9.838 1.00 0.00 O ATOM 0 H GLY A 10 86.574 35.203 10.224 1.00 0.00 H new ATOM 0 HA2 GLY A 10 84.879 33.949 12.243 1.00 0.00 H new ATOM 0 HA3 GLY A 10 85.479 35.595 12.206 1.00 0.00 H new ATOM 232 N MET A 11 82.820 35.738 11.941 1.00 0.00 N ATOM 233 CA MET A 11 81.503 36.230 11.545 1.00 0.00 C ATOM 234 C MET A 11 81.440 37.747 11.681 1.00 0.00 C ATOM 235 O MET A 11 82.241 38.348 12.397 1.00 0.00 O ATOM 236 CB MET A 11 80.423 35.593 12.422 1.00 0.00 C ATOM 237 CG MET A 11 80.360 34.090 12.146 1.00 0.00 C ATOM 238 SD MET A 11 79.006 33.358 13.101 1.00 0.00 S ATOM 239 CE MET A 11 79.317 31.634 12.649 1.00 0.00 C ATOM 0 H MET A 11 83.000 35.773 12.944 1.00 0.00 H new ATOM 0 HA MET A 11 81.331 35.960 10.503 1.00 0.00 H new ATOM 0 HB2 MET A 11 80.643 35.771 13.475 1.00 0.00 H new ATOM 0 HB3 MET A 11 79.456 36.052 12.217 1.00 0.00 H new ATOM 0 HG2 MET A 11 80.207 33.911 11.082 1.00 0.00 H new ATOM 0 HG3 MET A 11 81.306 33.620 12.416 1.00 0.00 H new ATOM 0 HE1 MET A 11 78.583 30.992 13.136 1.00 0.00 H new ATOM 0 HE2 MET A 11 79.237 31.521 11.568 1.00 0.00 H new ATOM 0 HE3 MET A 11 80.319 31.349 12.970 1.00 0.00 H new ATOM 249 N LYS A 12 80.485 38.362 10.990 1.00 0.00 N ATOM 250 CA LYS A 12 80.341 39.811 11.038 1.00 0.00 C ATOM 251 C LYS A 12 79.875 40.254 12.421 1.00 0.00 C ATOM 252 O LYS A 12 78.855 39.783 12.924 1.00 0.00 O ATOM 253 CB LYS A 12 79.329 40.267 9.983 1.00 0.00 C ATOM 254 CG LYS A 12 79.288 41.798 9.920 1.00 0.00 C ATOM 255 CD LYS A 12 80.531 42.321 9.197 1.00 0.00 C ATOM 256 CE LYS A 12 80.434 43.841 9.055 1.00 0.00 C ATOM 257 NZ LYS A 12 80.750 44.484 10.362 1.00 0.00 N ATOM 0 H LYS A 12 79.806 37.885 10.396 1.00 0.00 H new ATOM 0 HA LYS A 12 81.310 40.265 10.831 1.00 0.00 H new ATOM 0 HB2 LYS A 12 79.601 39.862 9.008 1.00 0.00 H new ATOM 0 HB3 LYS A 12 78.340 39.879 10.225 1.00 0.00 H new ATOM 0 HG2 LYS A 12 78.388 42.126 9.399 1.00 0.00 H new ATOM 0 HG3 LYS A 12 79.241 42.211 10.927 1.00 0.00 H new ATOM 0 HD2 LYS A 12 81.429 42.053 9.754 1.00 0.00 H new ATOM 0 HD3 LYS A 12 80.616 41.857 8.214 1.00 0.00 H new ATOM 0 HE2 LYS A 12 81.127 44.190 8.289 1.00 0.00 H new ATOM 0 HE3 LYS A 12 79.432 44.123 8.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 80.784 45.516 10.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 80.014 44.240 11.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 81.672 44.145 10.702 1.00 0.00 H new ATOM 271 N GLU A 13 80.630 41.163 13.031 1.00 0.00 N ATOM 272 CA GLU A 13 80.297 41.669 14.360 1.00 0.00 C ATOM 273 C GLU A 13 80.241 43.193 14.353 1.00 0.00 C ATOM 274 O GLU A 13 81.025 43.849 13.664 1.00 0.00 O ATOM 275 CB GLU A 13 81.346 41.203 15.372 1.00 0.00 C ATOM 276 CG GLU A 13 80.894 41.578 16.788 1.00 0.00 C ATOM 277 CD GLU A 13 81.948 41.216 17.841 1.00 0.00 C ATOM 278 OE1 GLU A 13 83.007 40.718 17.484 1.00 0.00 O ATOM 279 OE2 GLU A 13 81.676 41.447 19.007 1.00 0.00 O ATOM 0 H GLU A 13 81.476 41.564 12.627 1.00 0.00 H new ATOM 0 HA GLU A 13 79.319 41.280 14.643 1.00 0.00 H new ATOM 0 HB2 GLU A 13 81.485 40.124 15.297 1.00 0.00 H new ATOM 0 HB3 GLU A 13 82.309 41.664 15.152 1.00 0.00 H new ATOM 0 HG2 GLU A 13 80.690 42.648 16.832 1.00 0.00 H new ATOM 0 HG3 GLU A 13 79.960 41.065 17.018 1.00 0.00 H new ATOM 286 N THR A 14 79.312 43.751 15.121 1.00 0.00 N ATOM 287 CA THR A 14 79.183 45.201 15.213 1.00 0.00 C ATOM 288 C THR A 14 80.300 45.778 16.077 1.00 0.00 C ATOM 289 O THR A 14 80.828 45.100 16.958 1.00 0.00 O ATOM 290 CB THR A 14 77.824 45.570 15.812 1.00 0.00 C ATOM 291 OG1 THR A 14 77.731 46.983 15.935 1.00 0.00 O ATOM 292 CG2 THR A 14 77.671 44.926 17.190 1.00 0.00 C ATOM 0 H THR A 14 78.642 43.227 15.684 1.00 0.00 H new ATOM 0 HA THR A 14 79.259 45.621 14.210 1.00 0.00 H new ATOM 0 HB THR A 14 77.032 45.206 15.158 1.00 0.00 H new ATOM 0 HG1 THR A 14 76.861 47.222 16.317 1.00 0.00 H new ATOM 0 HG21 THR A 14 76.701 45.193 17.611 1.00 0.00 H new ATOM 0 HG22 THR A 14 77.739 43.842 17.095 1.00 0.00 H new ATOM 0 HG23 THR A 14 78.463 45.283 17.848 1.00 0.00 H new ATOM 300 N ALA A 15 80.658 47.032 15.820 1.00 0.00 N ATOM 301 CA ALA A 15 81.726 47.677 16.574 1.00 0.00 C ATOM 302 C ALA A 15 81.347 47.796 18.046 1.00 0.00 C ATOM 303 O ALA A 15 80.227 48.181 18.380 1.00 0.00 O ATOM 304 CB ALA A 15 82.003 49.069 16.002 1.00 0.00 C ATOM 0 H ALA A 15 80.229 47.617 15.103 1.00 0.00 H new ATOM 0 HA ALA A 15 82.624 47.065 16.490 1.00 0.00 H new ATOM 0 HB1 ALA A 15 82.802 49.544 16.571 1.00 0.00 H new ATOM 0 HB2 ALA A 15 82.304 48.980 14.958 1.00 0.00 H new ATOM 0 HB3 ALA A 15 81.100 49.676 16.069 1.00 0.00 H new ATOM 310 N ALA A 16 82.290 47.464 18.922 1.00 0.00 N ATOM 311 CA ALA A 16 82.048 47.541 20.357 1.00 0.00 C ATOM 312 C ALA A 16 83.343 47.841 21.103 1.00 0.00 C ATOM 313 O ALA A 16 84.434 47.548 20.613 1.00 0.00 O ATOM 314 CB ALA A 16 81.460 46.221 20.861 1.00 0.00 C ATOM 0 H ALA A 16 83.223 47.141 18.665 1.00 0.00 H new ATOM 0 HA ALA A 16 81.339 48.348 20.543 1.00 0.00 H new ATOM 0 HB1 ALA A 16 81.283 46.288 21.934 1.00 0.00 H new ATOM 0 HB2 ALA A 16 80.518 46.023 20.349 1.00 0.00 H new ATOM 0 HB3 ALA A 16 82.160 45.410 20.659 1.00 0.00 H new ATOM 320 N ALA A 17 83.217 48.427 22.289 1.00 0.00 N ATOM 321 CA ALA A 17 84.388 48.737 23.102 1.00 0.00 C ATOM 322 C ALA A 17 85.097 47.455 23.525 1.00 0.00 C ATOM 323 O ALA A 17 84.455 46.436 23.778 1.00 0.00 O ATOM 324 CB ALA A 17 83.967 49.524 24.345 1.00 0.00 C ATOM 0 H ALA A 17 82.325 48.695 22.706 1.00 0.00 H new ATOM 0 HA ALA A 17 85.074 49.340 22.506 1.00 0.00 H new ATOM 0 HB1 ALA A 17 84.847 49.752 24.947 1.00 0.00 H new ATOM 0 HB2 ALA A 17 83.485 50.453 24.041 1.00 0.00 H new ATOM 0 HB3 ALA A 17 83.269 48.929 24.934 1.00 0.00 H new ATOM 330 N LYS A 18 86.422 47.511 23.599 1.00 0.00 N ATOM 331 CA LYS A 18 87.203 46.341 23.986 1.00 0.00 C ATOM 332 C LYS A 18 87.193 46.165 25.503 1.00 0.00 C ATOM 333 O LYS A 18 87.310 47.135 26.251 1.00 0.00 O ATOM 334 CB LYS A 18 88.642 46.476 23.482 1.00 0.00 C ATOM 335 CG LYS A 18 89.303 47.717 24.090 1.00 0.00 C ATOM 336 CD LYS A 18 90.758 47.802 23.622 1.00 0.00 C ATOM 337 CE LYS A 18 90.797 48.155 22.134 1.00 0.00 C ATOM 338 NZ LYS A 18 92.205 48.418 21.723 1.00 0.00 N ATOM 0 H LYS A 18 86.974 48.345 23.398 1.00 0.00 H new ATOM 0 HA LYS A 18 86.750 45.460 23.532 1.00 0.00 H new ATOM 0 HB2 LYS A 18 89.212 45.585 23.746 1.00 0.00 H new ATOM 0 HB3 LYS A 18 88.649 46.548 22.394 1.00 0.00 H new ATOM 0 HG2 LYS A 18 88.761 48.614 23.791 1.00 0.00 H new ATOM 0 HG3 LYS A 18 89.262 47.668 25.178 1.00 0.00 H new ATOM 0 HD2 LYS A 18 91.293 48.556 24.199 1.00 0.00 H new ATOM 0 HD3 LYS A 18 91.262 46.851 23.794 1.00 0.00 H new ATOM 0 HE2 LYS A 18 90.381 47.338 21.544 1.00 0.00 H new ATOM 0 HE3 LYS A 18 90.180 49.033 21.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 92.232 48.658 20.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 92.586 49.211 22.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 92.781 47.569 21.893 1.00 0.00 H new ATOM 352 N PHE A 19 87.047 44.919 25.948 1.00 0.00 N ATOM 353 CA PHE A 19 87.018 44.615 27.376 1.00 0.00 C ATOM 354 C PHE A 19 88.124 43.628 27.735 1.00 0.00 C ATOM 355 O PHE A 19 88.582 42.858 26.889 1.00 0.00 O ATOM 356 CB PHE A 19 85.661 44.019 27.753 1.00 0.00 C ATOM 357 CG PHE A 19 84.506 44.961 27.515 1.00 0.00 C ATOM 358 CD1 PHE A 19 84.163 45.909 28.487 1.00 0.00 C ATOM 359 CD2 PHE A 19 83.775 44.887 26.323 1.00 0.00 C ATOM 360 CE1 PHE A 19 83.092 46.783 28.267 1.00 0.00 C ATOM 361 CE2 PHE A 19 82.704 45.760 26.102 1.00 0.00 C ATOM 362 CZ PHE A 19 82.361 46.708 27.074 1.00 0.00 C ATOM 0 H PHE A 19 86.947 44.105 25.341 1.00 0.00 H new ATOM 0 HA PHE A 19 87.177 45.540 27.930 1.00 0.00 H new ATOM 0 HB2 PHE A 19 85.501 43.107 27.178 1.00 0.00 H new ATOM 0 HB3 PHE A 19 85.677 43.734 28.805 1.00 0.00 H new ATOM 0 HD1 PHE A 19 84.725 45.966 29.407 1.00 0.00 H new ATOM 0 HD2 PHE A 19 84.038 44.155 25.573 1.00 0.00 H new ATOM 0 HE1 PHE A 19 82.829 47.515 29.016 1.00 0.00 H new ATOM 0 HE2 PHE A 19 82.142 45.703 25.182 1.00 0.00 H new ATOM 0 HZ PHE A 19 81.534 47.381 26.904 1.00 0.00 H new ATOM 372 N GLU A 20 88.549 43.655 28.993 1.00 0.00 N ATOM 373 CA GLU A 20 89.594 42.751 29.459 1.00 0.00 C ATOM 374 C GLU A 20 89.181 41.298 29.240 1.00 0.00 C ATOM 375 O GLU A 20 88.002 40.958 29.340 1.00 0.00 O ATOM 376 CB GLU A 20 89.868 42.987 30.945 1.00 0.00 C ATOM 377 CG GLU A 20 90.369 44.421 31.152 1.00 0.00 C ATOM 378 CD GLU A 20 91.688 44.666 30.414 1.00 0.00 C ATOM 379 OE1 GLU A 20 92.354 43.706 30.054 1.00 0.00 O ATOM 380 OE2 GLU A 20 92.016 45.824 30.217 1.00 0.00 O ATOM 0 H GLU A 20 88.188 44.290 29.705 1.00 0.00 H new ATOM 0 HA GLU A 20 90.501 42.950 28.888 1.00 0.00 H new ATOM 0 HB2 GLU A 20 88.959 42.821 31.524 1.00 0.00 H new ATOM 0 HB3 GLU A 20 90.611 42.275 31.306 1.00 0.00 H new ATOM 0 HG2 GLU A 20 89.616 45.125 30.798 1.00 0.00 H new ATOM 0 HG3 GLU A 20 90.506 44.610 32.217 1.00 0.00 H new ATOM 387 N ARG A 21 90.157 40.447 28.941 1.00 0.00 N ATOM 388 CA ARG A 21 89.880 39.036 28.705 1.00 0.00 C ATOM 389 C ARG A 21 91.006 38.158 29.250 1.00 0.00 C ATOM 390 O ARG A 21 92.123 38.628 29.465 1.00 0.00 O ATOM 391 CB ARG A 21 89.675 38.789 27.205 1.00 0.00 C ATOM 392 CG ARG A 21 90.965 39.083 26.430 1.00 0.00 C ATOM 393 CD ARG A 21 90.684 39.027 24.928 1.00 0.00 C ATOM 394 NE ARG A 21 91.931 39.182 24.173 1.00 0.00 N ATOM 395 CZ ARG A 21 92.045 38.898 22.866 1.00 0.00 C ATOM 396 NH1 ARG A 21 91.037 38.454 22.156 1.00 0.00 N ATOM 397 NH2 ARG A 21 93.200 39.069 22.284 1.00 0.00 N ATOM 0 H ARG A 21 91.140 40.708 28.857 1.00 0.00 H new ATOM 0 HA ARG A 21 88.966 38.768 29.234 1.00 0.00 H new ATOM 0 HB2 ARG A 21 89.372 37.755 27.039 1.00 0.00 H new ATOM 0 HB3 ARG A 21 88.869 39.421 26.833 1.00 0.00 H new ATOM 0 HG2 ARG A 21 91.349 40.066 26.702 1.00 0.00 H new ATOM 0 HG3 ARG A 21 91.734 38.357 26.694 1.00 0.00 H new ATOM 0 HD2 ARG A 21 90.212 38.078 24.674 1.00 0.00 H new ATOM 0 HD3 ARG A 21 89.983 39.815 24.652 1.00 0.00 H new ATOM 0 HE ARG A 21 92.755 39.524 24.667 1.00 0.00 H new ATOM 0 HH11 ARG A 21 90.127 38.313 22.595 1.00 0.00 H new ATOM 0 HH12 ARG A 21 91.162 38.249 21.165 1.00 0.00 H new ATOM 0 HH21 ARG A 21 93.996 39.413 22.821 1.00 0.00 H new ATOM 0 HH22 ARG A 21 93.307 38.859 21.292 1.00 0.00 H new ATOM 411 N GLN A 22 90.700 36.881 29.467 1.00 0.00 N ATOM 412 CA GLN A 22 91.681 35.939 30.000 1.00 0.00 C ATOM 413 C GLN A 22 91.969 34.835 28.987 1.00 0.00 C ATOM 414 O GLN A 22 91.156 34.563 28.103 1.00 0.00 O ATOM 415 CB GLN A 22 91.154 35.316 31.294 1.00 0.00 C ATOM 416 CG GLN A 22 90.992 36.406 32.357 1.00 0.00 C ATOM 417 CD GLN A 22 90.385 35.825 33.633 1.00 0.00 C ATOM 418 OE1 GLN A 22 89.793 34.745 33.614 1.00 0.00 O ATOM 419 NE2 GLN A 22 90.499 36.485 34.753 1.00 0.00 N ATOM 0 H GLN A 22 89.783 36.475 29.282 1.00 0.00 H new ATOM 0 HA GLN A 22 92.604 36.481 30.204 1.00 0.00 H new ATOM 0 HB2 GLN A 22 90.197 34.827 31.111 1.00 0.00 H new ATOM 0 HB3 GLN A 22 91.842 34.548 31.647 1.00 0.00 H new ATOM 0 HG2 GLN A 22 91.961 36.852 32.579 1.00 0.00 H new ATOM 0 HG3 GLN A 22 90.354 37.203 31.974 1.00 0.00 H new ATOM 0 HE21 GLN A 22 90.989 37.379 34.770 1.00 0.00 H new ATOM 0 HE22 GLN A 22 90.098 36.106 35.611 1.00 0.00 H new ATOM 428 N HIS A 23 93.132 34.205 29.121 1.00 0.00 N ATOM 429 CA HIS A 23 93.524 33.130 28.215 1.00 0.00 C ATOM 430 C HIS A 23 93.416 31.779 28.914 1.00 0.00 C ATOM 431 O HIS A 23 93.858 31.621 30.051 1.00 0.00 O ATOM 432 CB HIS A 23 94.963 33.346 27.741 1.00 0.00 C ATOM 433 CG HIS A 23 95.439 32.298 26.773 1.00 0.00 C ATOM 434 ND1 HIS A 23 96.145 31.180 27.183 1.00 0.00 N ATOM 435 CD2 HIS A 23 95.319 32.187 25.409 1.00 0.00 C ATOM 436 CE1 HIS A 23 96.422 30.449 26.088 1.00 0.00 C ATOM 437 NE2 HIS A 23 95.941 31.017 24.979 1.00 0.00 N ATOM 0 H HIS A 23 93.817 34.419 29.845 1.00 0.00 H new ATOM 0 HA HIS A 23 92.853 33.139 27.356 1.00 0.00 H new ATOM 0 HB2 HIS A 23 95.039 34.326 27.270 1.00 0.00 H new ATOM 0 HB3 HIS A 23 95.625 33.357 28.607 1.00 0.00 H new ATOM 0 HD2 HIS A 23 94.819 32.898 24.768 1.00 0.00 H new ATOM 0 HE1 HIS A 23 96.967 29.517 26.104 1.00 0.00 H new ATOM 0 HE2 HIS A 23 96.013 30.669 24.023 1.00 0.00 H new ATOM 445 N MET A 24 92.825 30.807 28.226 1.00 0.00 N ATOM 446 CA MET A 24 92.645 29.477 28.797 1.00 0.00 C ATOM 447 C MET A 24 93.726 28.525 28.297 1.00 0.00 C ATOM 448 O MET A 24 94.190 28.637 27.162 1.00 0.00 O ATOM 449 CB MET A 24 91.267 28.930 28.422 1.00 0.00 C ATOM 450 CG MET A 24 90.181 29.788 29.073 1.00 0.00 C ATOM 451 SD MET A 24 88.555 29.073 28.722 1.00 0.00 S ATOM 452 CE MET A 24 87.564 30.375 29.494 1.00 0.00 C ATOM 0 H MET A 24 92.465 30.914 27.278 1.00 0.00 H new ATOM 0 HA MET A 24 92.722 29.556 29.881 1.00 0.00 H new ATOM 0 HB2 MET A 24 91.146 28.932 27.339 1.00 0.00 H new ATOM 0 HB3 MET A 24 91.173 27.895 28.751 1.00 0.00 H new ATOM 0 HG2 MET A 24 90.342 29.842 30.150 1.00 0.00 H new ATOM 0 HG3 MET A 24 90.231 30.808 28.692 1.00 0.00 H new ATOM 0 HE1 MET A 24 86.506 30.135 29.393 1.00 0.00 H new ATOM 0 HE2 MET A 24 87.820 30.449 30.551 1.00 0.00 H new ATOM 0 HE3 MET A 24 87.768 31.327 29.004 1.00 0.00 H new ATOM 462 N ASP A 25 94.122 27.587 29.153 1.00 0.00 N ATOM 463 CA ASP A 25 95.147 26.617 28.790 1.00 0.00 C ATOM 464 C ASP A 25 94.583 25.566 27.837 1.00 0.00 C ATOM 465 O ASP A 25 93.405 25.604 27.484 1.00 0.00 O ATOM 466 CB ASP A 25 95.699 25.938 30.049 1.00 0.00 C ATOM 467 CG ASP A 25 94.609 25.142 30.765 1.00 0.00 C ATOM 468 OD1 ASP A 25 93.451 25.514 30.654 1.00 0.00 O ATOM 469 OD2 ASP A 25 94.951 24.172 31.421 1.00 0.00 O ATOM 0 H ASP A 25 93.751 27.479 30.097 1.00 0.00 H new ATOM 0 HA ASP A 25 95.955 27.145 28.284 1.00 0.00 H new ATOM 0 HB2 ASP A 25 96.520 25.274 29.778 1.00 0.00 H new ATOM 0 HB3 ASP A 25 96.107 26.691 30.723 1.00 0.00 H new ATOM 474 N SER A 26 95.432 24.629 27.428 1.00 0.00 N ATOM 475 CA SER A 26 95.009 23.577 26.511 1.00 0.00 C ATOM 476 C SER A 26 93.889 22.740 27.136 1.00 0.00 C ATOM 477 O SER A 26 93.759 22.716 28.361 1.00 0.00 O ATOM 478 CB SER A 26 96.193 22.673 26.171 1.00 0.00 C ATOM 479 OG SER A 26 96.499 21.859 27.297 1.00 0.00 O ATOM 0 H SER A 26 96.410 24.576 27.714 1.00 0.00 H new ATOM 0 HA SER A 26 94.636 24.043 25.599 1.00 0.00 H new ATOM 0 HB2 SER A 26 95.954 22.049 25.310 1.00 0.00 H new ATOM 0 HB3 SER A 26 97.059 23.276 25.897 1.00 0.00 H new ATOM 0 HG SER A 26 97.257 21.276 27.083 1.00 0.00 H new ATOM 485 N PRO A 27 93.083 22.061 26.345 1.00 0.00 N ATOM 486 CA PRO A 27 91.968 21.231 26.899 1.00 0.00 C ATOM 487 C PRO A 27 92.478 20.136 27.832 1.00 0.00 C ATOM 488 O PRO A 27 93.650 19.762 27.783 1.00 0.00 O ATOM 489 CB PRO A 27 91.281 20.625 25.667 1.00 0.00 C ATOM 490 CG PRO A 27 91.721 21.454 24.510 1.00 0.00 C ATOM 491 CD PRO A 27 93.102 21.993 24.869 1.00 0.00 C ATOM 0 HA PRO A 27 91.288 21.831 27.503 1.00 0.00 H new ATOM 0 HB2 PRO A 27 91.568 19.582 25.533 1.00 0.00 H new ATOM 0 HB3 PRO A 27 90.196 20.646 25.774 1.00 0.00 H new ATOM 0 HG2 PRO A 27 91.761 20.858 23.598 1.00 0.00 H new ATOM 0 HG3 PRO A 27 91.021 22.269 24.327 1.00 0.00 H new ATOM 0 HD2 PRO A 27 93.894 21.336 24.509 1.00 0.00 H new ATOM 0 HD3 PRO A 27 93.276 22.974 24.426 1.00 0.00 H new ATOM 499 N ASP A 28 91.590 19.628 28.679 1.00 0.00 N ATOM 500 CA ASP A 28 91.956 18.573 29.617 1.00 0.00 C ATOM 501 C ASP A 28 92.065 17.227 28.907 1.00 0.00 C ATOM 502 O ASP A 28 91.952 17.149 27.683 1.00 0.00 O ATOM 503 CB ASP A 28 90.918 18.489 30.742 1.00 0.00 C ATOM 504 CG ASP A 28 89.513 18.215 30.195 1.00 0.00 C ATOM 505 OD1 ASP A 28 89.392 17.779 29.061 1.00 0.00 O ATOM 506 OD2 ASP A 28 88.568 18.451 30.931 1.00 0.00 O ATOM 0 H ASP A 28 90.617 19.927 28.736 1.00 0.00 H new ATOM 0 HA ASP A 28 92.930 18.816 30.043 1.00 0.00 H new ATOM 0 HB2 ASP A 28 91.198 17.698 31.438 1.00 0.00 H new ATOM 0 HB3 ASP A 28 90.914 19.423 31.305 1.00 0.00 H new ATOM 511 N LEU A 29 92.284 16.171 29.682 1.00 0.00 N ATOM 512 CA LEU A 29 92.406 14.832 29.117 1.00 0.00 C ATOM 513 C LEU A 29 91.040 14.150 29.096 1.00 0.00 C ATOM 514 O LEU A 29 90.335 14.124 30.104 1.00 0.00 O ATOM 515 CB LEU A 29 93.388 14.007 29.952 1.00 0.00 C ATOM 516 CG LEU A 29 93.877 12.799 29.144 1.00 0.00 C ATOM 517 CD1 LEU A 29 95.256 12.369 29.654 1.00 0.00 C ATOM 518 CD2 LEU A 29 92.887 11.638 29.295 1.00 0.00 C ATOM 0 H LEU A 29 92.380 16.215 30.697 1.00 0.00 H new ATOM 0 HA LEU A 29 92.780 14.907 28.096 1.00 0.00 H new ATOM 0 HB2 LEU A 29 94.236 14.625 30.247 1.00 0.00 H new ATOM 0 HB3 LEU A 29 92.905 13.670 30.869 1.00 0.00 H new ATOM 0 HG LEU A 29 93.948 13.074 28.092 1.00 0.00 H new ATOM 0 HD11 LEU A 29 95.605 11.510 29.080 1.00 0.00 H new ATOM 0 HD12 LEU A 29 95.960 13.193 29.538 1.00 0.00 H new ATOM 0 HD13 LEU A 29 95.186 12.097 30.707 1.00 0.00 H new ATOM 0 HD21 LEU A 29 93.239 10.782 28.719 1.00 0.00 H new ATOM 0 HD22 LEU A 29 92.809 11.361 30.346 1.00 0.00 H new ATOM 0 HD23 LEU A 29 91.908 11.945 28.927 1.00 0.00 H new ATOM 530 N GLY A 30 90.674 13.600 27.943 1.00 0.00 N ATOM 531 CA GLY A 30 89.363 12.976 27.780 1.00 0.00 C ATOM 532 C GLY A 30 89.102 11.927 28.857 1.00 0.00 C ATOM 533 O GLY A 30 89.985 11.145 29.208 1.00 0.00 O ATOM 0 H GLY A 30 91.263 13.573 27.110 1.00 0.00 H new ATOM 0 HA2 GLY A 30 88.588 13.741 27.821 1.00 0.00 H new ATOM 0 HA3 GLY A 30 89.300 12.511 26.796 1.00 0.00 H new ATOM 537 N THR A 31 87.877 11.916 29.374 1.00 0.00 N ATOM 538 CA THR A 31 87.495 10.961 30.409 1.00 0.00 C ATOM 539 C THR A 31 86.113 10.377 30.120 1.00 0.00 C ATOM 540 O THR A 31 85.340 10.947 29.350 1.00 0.00 O ATOM 541 CB THR A 31 87.511 11.646 31.781 1.00 0.00 C ATOM 542 OG1 THR A 31 87.211 10.691 32.789 1.00 0.00 O ATOM 543 CG2 THR A 31 86.488 12.784 31.822 1.00 0.00 C ATOM 0 H THR A 31 87.134 12.556 29.094 1.00 0.00 H new ATOM 0 HA THR A 31 88.215 10.143 30.413 1.00 0.00 H new ATOM 0 HB THR A 31 88.502 12.064 31.957 1.00 0.00 H new ATOM 0 HG1 THR A 31 87.223 11.127 33.667 1.00 0.00 H new ATOM 0 HG21 THR A 31 86.512 13.260 32.802 1.00 0.00 H new ATOM 0 HG22 THR A 31 86.731 13.520 31.056 1.00 0.00 H new ATOM 0 HG23 THR A 31 85.491 12.384 31.637 1.00 0.00 H new ATOM 551 N ASP A 32 85.809 9.241 30.740 1.00 0.00 N ATOM 552 CA ASP A 32 84.520 8.593 30.528 1.00 0.00 C ATOM 553 C ASP A 32 83.444 9.239 31.395 1.00 0.00 C ATOM 554 O ASP A 32 83.425 9.059 32.613 1.00 0.00 O ATOM 555 CB ASP A 32 84.624 7.104 30.865 1.00 0.00 C ATOM 556 CG ASP A 32 83.317 6.388 30.531 1.00 0.00 C ATOM 557 OD1 ASP A 32 82.654 6.801 29.593 1.00 0.00 O ATOM 558 OD2 ASP A 32 82.998 5.433 31.221 1.00 0.00 O ATOM 0 H ASP A 32 86.430 8.755 31.386 1.00 0.00 H new ATOM 0 HA ASP A 32 84.243 8.711 29.480 1.00 0.00 H new ATOM 0 HB2 ASP A 32 85.445 6.655 30.306 1.00 0.00 H new ATOM 0 HB3 ASP A 32 84.854 6.980 31.923 1.00 0.00 H new ATOM 563 N ASP A 33 82.543 9.978 30.754 1.00 0.00 N ATOM 564 CA ASP A 33 81.460 10.649 31.465 1.00 0.00 C ATOM 565 C ASP A 33 80.195 10.667 30.614 1.00 0.00 C ATOM 566 O ASP A 33 80.199 10.219 29.467 1.00 0.00 O ATOM 567 CB ASP A 33 81.861 12.086 31.805 1.00 0.00 C ATOM 568 CG ASP A 33 82.923 12.099 32.900 1.00 0.00 C ATOM 569 OD1 ASP A 33 82.880 11.229 33.754 1.00 0.00 O ATOM 570 OD2 ASP A 33 83.762 12.984 32.872 1.00 0.00 O ATOM 0 H ASP A 33 82.542 10.127 29.745 1.00 0.00 H new ATOM 0 HA ASP A 33 81.265 10.100 32.386 1.00 0.00 H new ATOM 0 HB2 ASP A 33 82.243 12.584 30.914 1.00 0.00 H new ATOM 0 HB3 ASP A 33 80.985 12.646 32.133 1.00 0.00 H new ATOM 575 N ASP A 34 79.112 11.186 31.184 1.00 0.00 N ATOM 576 CA ASP A 34 77.851 11.286 30.458 1.00 0.00 C ATOM 577 C ASP A 34 78.010 12.192 29.242 1.00 0.00 C ATOM 578 O ASP A 34 78.783 13.149 29.268 1.00 0.00 O ATOM 579 CB ASP A 34 76.761 11.843 31.375 1.00 0.00 C ATOM 580 CG ASP A 34 75.411 11.797 30.668 1.00 0.00 C ATOM 581 OD1 ASP A 34 74.782 10.753 30.702 1.00 0.00 O ATOM 582 OD2 ASP A 34 75.026 12.808 30.103 1.00 0.00 O ATOM 0 H ASP A 34 79.082 11.541 32.140 1.00 0.00 H new ATOM 0 HA ASP A 34 77.564 10.289 30.122 1.00 0.00 H new ATOM 0 HB2 ASP A 34 76.718 11.263 32.297 1.00 0.00 H new ATOM 0 HB3 ASP A 34 76.999 12.869 31.655 1.00 0.00 H new ATOM 587 N ASP A 35 77.275 11.885 28.177 1.00 0.00 N ATOM 588 CA ASP A 35 77.378 12.661 26.947 1.00 0.00 C ATOM 589 C ASP A 35 77.067 14.131 27.211 1.00 0.00 C ATOM 590 O ASP A 35 76.118 14.459 27.924 1.00 0.00 O ATOM 591 CB ASP A 35 76.403 12.111 25.901 1.00 0.00 C ATOM 592 CG ASP A 35 76.772 10.678 25.528 1.00 0.00 C ATOM 593 OD1 ASP A 35 77.948 10.352 25.566 1.00 0.00 O ATOM 594 OD2 ASP A 35 75.868 9.923 25.208 1.00 0.00 O ATOM 0 H ASP A 35 76.609 11.113 28.141 1.00 0.00 H new ATOM 0 HA ASP A 35 78.399 12.580 26.573 1.00 0.00 H new ATOM 0 HB2 ASP A 35 75.386 12.141 26.292 1.00 0.00 H new ATOM 0 HB3 ASP A 35 76.421 12.741 25.012 1.00 0.00 H new ATOM 599 N LYS A 36 77.877 15.010 26.629 1.00 0.00 N ATOM 600 CA LYS A 36 77.699 16.445 26.817 1.00 0.00 C ATOM 601 C LYS A 36 77.956 17.193 25.512 1.00 0.00 C ATOM 602 O LYS A 36 78.146 16.579 24.461 1.00 0.00 O ATOM 603 CB LYS A 36 78.647 16.948 27.910 1.00 0.00 C ATOM 604 CG LYS A 36 80.099 16.667 27.510 1.00 0.00 C ATOM 605 CD LYS A 36 81.040 17.218 28.582 1.00 0.00 C ATOM 606 CE LYS A 36 80.919 16.372 29.850 1.00 0.00 C ATOM 607 NZ LYS A 36 82.033 16.711 30.781 1.00 0.00 N ATOM 0 H LYS A 36 78.659 14.755 26.026 1.00 0.00 H new ATOM 0 HA LYS A 36 76.670 16.632 27.123 1.00 0.00 H new ATOM 0 HB2 LYS A 36 78.503 18.017 28.064 1.00 0.00 H new ATOM 0 HB3 LYS A 36 78.419 16.456 28.856 1.00 0.00 H new ATOM 0 HG2 LYS A 36 80.254 15.595 27.392 1.00 0.00 H new ATOM 0 HG3 LYS A 36 80.318 17.129 26.547 1.00 0.00 H new ATOM 0 HD2 LYS A 36 82.068 17.205 28.220 1.00 0.00 H new ATOM 0 HD3 LYS A 36 80.792 18.257 28.800 1.00 0.00 H new ATOM 0 HE2 LYS A 36 79.959 16.556 30.332 1.00 0.00 H new ATOM 0 HE3 LYS A 36 80.951 15.312 29.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 81.952 16.136 31.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 82.944 16.515 30.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 81.982 17.719 31.031 1.00 0.00 H new ATOM 621 N THR A 37 77.961 18.521 25.584 1.00 0.00 N ATOM 622 CA THR A 37 78.205 19.344 24.404 1.00 0.00 C ATOM 623 C THR A 37 79.543 18.978 23.764 1.00 0.00 C ATOM 624 O THR A 37 80.275 18.133 24.277 1.00 0.00 O ATOM 625 CB THR A 37 78.201 20.825 24.795 1.00 0.00 C ATOM 626 OG1 THR A 37 78.464 21.620 23.648 1.00 0.00 O ATOM 627 CG2 THR A 37 79.274 21.083 25.855 1.00 0.00 C ATOM 0 H THR A 37 77.800 19.048 26.442 1.00 0.00 H new ATOM 0 HA THR A 37 77.412 19.161 23.679 1.00 0.00 H new ATOM 0 HB THR A 37 77.224 21.087 25.202 1.00 0.00 H new ATOM 0 HG1 THR A 37 78.460 22.567 23.899 1.00 0.00 H new ATOM 0 HG21 THR A 37 79.268 22.138 26.130 1.00 0.00 H new ATOM 0 HG22 THR A 37 79.067 20.477 26.737 1.00 0.00 H new ATOM 0 HG23 THR A 37 80.253 20.819 25.454 1.00 0.00 H new ATOM 635 N GLY A 38 79.856 19.620 22.642 1.00 0.00 N ATOM 636 CA GLY A 38 81.091 19.323 21.926 1.00 0.00 C ATOM 637 C GLY A 38 82.305 19.843 22.687 1.00 0.00 C ATOM 638 O GLY A 38 82.172 20.430 23.761 1.00 0.00 O ATOM 0 H GLY A 38 79.277 20.342 22.213 1.00 0.00 H new ATOM 0 HA2 GLY A 38 81.182 18.246 21.782 1.00 0.00 H new ATOM 0 HA3 GLY A 38 81.058 19.775 20.935 1.00 0.00 H new ATOM 642 N GLY A 39 83.488 19.625 22.122 1.00 0.00 N ATOM 643 CA GLY A 39 84.723 20.050 22.769 1.00 0.00 C ATOM 644 C GLY A 39 85.834 20.257 21.745 1.00 0.00 C ATOM 645 O GLY A 39 85.569 20.505 20.569 1.00 0.00 O ATOM 0 H GLY A 39 83.617 19.160 21.224 1.00 0.00 H new ATOM 0 HA2 GLY A 39 84.551 20.977 23.316 1.00 0.00 H new ATOM 0 HA3 GLY A 39 85.031 19.302 23.499 1.00 0.00 H new ATOM 649 N GLY A 40 87.079 20.153 22.200 1.00 0.00 N ATOM 650 CA GLY A 40 88.224 20.348 21.318 1.00 0.00 C ATOM 651 C GLY A 40 88.471 19.112 20.459 1.00 0.00 C ATOM 652 O GLY A 40 87.695 18.156 20.492 1.00 0.00 O ATOM 0 H GLY A 40 87.320 19.936 23.167 1.00 0.00 H new ATOM 0 HA2 GLY A 40 88.050 21.212 20.676 1.00 0.00 H new ATOM 0 HA3 GLY A 40 89.112 20.566 21.912 1.00 0.00 H new ATOM 656 N ARG A 41 89.555 19.140 19.691 1.00 0.00 N ATOM 657 CA ARG A 41 89.882 18.029 18.806 1.00 0.00 C ATOM 658 C ARG A 41 90.266 16.792 19.610 1.00 0.00 C ATOM 659 O ARG A 41 90.918 16.890 20.649 1.00 0.00 O ATOM 660 CB ARG A 41 91.040 18.422 17.885 1.00 0.00 C ATOM 661 CG ARG A 41 91.278 17.315 16.856 1.00 0.00 C ATOM 662 CD ARG A 41 92.505 17.659 16.010 1.00 0.00 C ATOM 663 NE ARG A 41 92.289 18.921 15.296 1.00 0.00 N ATOM 664 CZ ARG A 41 93.239 19.534 14.572 1.00 0.00 C ATOM 665 NH1 ARG A 41 94.448 19.044 14.447 1.00 0.00 N ATOM 666 NH2 ARG A 41 92.949 20.657 13.974 1.00 0.00 N ATOM 0 H ARG A 41 90.218 19.915 19.663 1.00 0.00 H new ATOM 0 HA ARG A 41 89.001 17.796 18.207 1.00 0.00 H new ATOM 0 HB2 ARG A 41 90.812 19.360 17.379 1.00 0.00 H new ATOM 0 HB3 ARG A 41 91.944 18.587 18.471 1.00 0.00 H new ATOM 0 HG2 ARG A 41 91.427 16.361 17.361 1.00 0.00 H new ATOM 0 HG3 ARG A 41 90.402 17.204 16.217 1.00 0.00 H new ATOM 0 HD2 ARG A 41 93.385 17.740 16.648 1.00 0.00 H new ATOM 0 HD3 ARG A 41 92.701 16.858 15.297 1.00 0.00 H new ATOM 0 HE ARG A 41 91.368 19.356 15.352 1.00 0.00 H new ATOM 0 HH11 ARG A 41 94.694 18.168 14.908 1.00 0.00 H new ATOM 0 HH12 ARG A 41 95.143 19.539 13.888 1.00 0.00 H new ATOM 0 HH21 ARG A 41 92.014 21.054 14.061 1.00 0.00 H new ATOM 0 HH22 ARG A 41 93.658 21.137 13.420 1.00 0.00 H new ATOM 680 N ALA A 42 89.853 15.627 19.120 1.00 0.00 N ATOM 681 CA ALA A 42 90.160 14.370 19.793 1.00 0.00 C ATOM 682 C ALA A 42 91.666 14.123 19.811 1.00 0.00 C ATOM 683 O ALA A 42 92.388 14.573 18.922 1.00 0.00 O ATOM 684 CB ALA A 42 89.461 13.211 19.082 1.00 0.00 C ATOM 0 H ALA A 42 89.308 15.527 18.264 1.00 0.00 H new ATOM 0 HA ALA A 42 89.802 14.435 20.820 1.00 0.00 H new ATOM 0 HB1 ALA A 42 89.696 12.277 19.592 1.00 0.00 H new ATOM 0 HB2 ALA A 42 88.383 13.372 19.098 1.00 0.00 H new ATOM 0 HB3 ALA A 42 89.805 13.157 18.049 1.00 0.00 H new ATOM 690 N ASP A 43 92.131 13.407 20.829 1.00 0.00 N ATOM 691 CA ASP A 43 93.552 13.105 20.953 1.00 0.00 C ATOM 692 C ASP A 43 94.061 12.383 19.702 1.00 0.00 C ATOM 693 O ASP A 43 93.257 11.849 18.937 1.00 0.00 O ATOM 694 CB ASP A 43 93.794 12.228 22.184 1.00 0.00 C ATOM 695 CG ASP A 43 93.416 12.992 23.449 1.00 0.00 C ATOM 696 OD1 ASP A 43 92.235 13.221 23.648 1.00 0.00 O ATOM 697 OD2 ASP A 43 94.314 13.335 24.201 1.00 0.00 O ATOM 0 H ASP A 43 91.549 13.027 21.576 1.00 0.00 H new ATOM 0 HA ASP A 43 94.095 14.044 21.063 1.00 0.00 H new ATOM 0 HB2 ASP A 43 93.205 11.314 22.111 1.00 0.00 H new ATOM 0 HB3 ASP A 43 94.841 11.930 22.228 1.00 0.00 H new ATOM 702 N PRO A 44 95.358 12.350 19.470 1.00 0.00 N ATOM 703 CA PRO A 44 95.913 11.685 18.251 1.00 0.00 C ATOM 704 C PRO A 44 95.551 10.203 18.193 1.00 0.00 C ATOM 705 O PRO A 44 95.471 9.532 19.221 1.00 0.00 O ATOM 706 CB PRO A 44 97.432 11.875 18.359 1.00 0.00 C ATOM 707 CG PRO A 44 97.632 12.981 19.338 1.00 0.00 C ATOM 708 CD PRO A 44 96.443 12.924 20.293 1.00 0.00 C ATOM 0 HA PRO A 44 95.502 12.118 17.339 1.00 0.00 H new ATOM 0 HB2 PRO A 44 97.918 10.960 18.698 1.00 0.00 H new ATOM 0 HB3 PRO A 44 97.865 12.126 17.391 1.00 0.00 H new ATOM 0 HG2 PRO A 44 98.571 12.858 19.878 1.00 0.00 H new ATOM 0 HG3 PRO A 44 97.679 13.945 18.832 1.00 0.00 H new ATOM 0 HD2 PRO A 44 96.657 12.302 21.162 1.00 0.00 H new ATOM 0 HD3 PRO A 44 96.181 13.914 20.666 1.00 0.00 H new ATOM 716 N ALA A 45 95.336 9.702 16.981 1.00 0.00 N ATOM 717 CA ALA A 45 94.975 8.302 16.793 1.00 0.00 C ATOM 718 C ALA A 45 95.595 7.758 15.510 1.00 0.00 C ATOM 719 O ALA A 45 95.989 8.522 14.628 1.00 0.00 O ATOM 720 CB ALA A 45 93.453 8.159 16.728 1.00 0.00 C ATOM 0 H ALA A 45 95.405 10.242 16.118 1.00 0.00 H new ATOM 0 HA ALA A 45 95.357 7.730 17.639 1.00 0.00 H new ATOM 0 HB1 ALA A 45 93.192 7.110 16.587 1.00 0.00 H new ATOM 0 HB2 ALA A 45 93.014 8.521 17.657 1.00 0.00 H new ATOM 0 HB3 ALA A 45 93.068 8.744 15.893 1.00 0.00 H new ATOM 726 N HIS A 46 95.680 6.436 15.411 1.00 0.00 N ATOM 727 CA HIS A 46 96.257 5.805 14.229 1.00 0.00 C ATOM 728 C HIS A 46 95.241 5.774 13.092 1.00 0.00 C ATOM 729 O HIS A 46 94.083 5.406 13.291 1.00 0.00 O ATOM 730 CB HIS A 46 96.698 4.378 14.564 1.00 0.00 C ATOM 731 CG HIS A 46 97.304 3.646 13.397 1.00 0.00 C ATOM 732 ND1 HIS A 46 96.555 2.822 12.572 1.00 0.00 N ATOM 733 CD2 HIS A 46 98.586 3.605 12.904 1.00 0.00 C ATOM 734 CE1 HIS A 46 97.382 2.325 11.637 1.00 0.00 C ATOM 735 NE2 HIS A 46 98.632 2.769 11.791 1.00 0.00 N ATOM 0 H HIS A 46 95.360 5.785 16.128 1.00 0.00 H new ATOM 0 HA HIS A 46 97.122 6.387 13.912 1.00 0.00 H new ATOM 0 HB2 HIS A 46 97.423 4.412 15.377 1.00 0.00 H new ATOM 0 HB3 HIS A 46 95.837 3.816 14.927 1.00 0.00 H new ATOM 0 HD2 HIS A 46 99.429 4.139 13.317 1.00 0.00 H new ATOM 0 HE1 HIS A 46 97.073 1.648 10.855 1.00 0.00 H new ATOM 0 HE2 HIS A 46 99.445 2.544 11.217 1.00 0.00 H new ATOM 743 N ARG A 47 95.683 6.166 11.901 1.00 0.00 N ATOM 744 CA ARG A 47 94.807 6.201 10.733 1.00 0.00 C ATOM 745 C ARG A 47 95.415 5.404 9.583 1.00 0.00 C ATOM 746 O ARG A 47 96.634 5.271 9.483 1.00 0.00 O ATOM 747 CB ARG A 47 94.590 7.649 10.290 1.00 0.00 C ATOM 748 CG ARG A 47 93.884 8.423 11.407 1.00 0.00 C ATOM 749 CD ARG A 47 93.580 9.844 10.932 1.00 0.00 C ATOM 750 NE ARG A 47 93.092 10.658 12.049 1.00 0.00 N ATOM 751 CZ ARG A 47 93.156 11.999 12.072 1.00 0.00 C ATOM 752 NH1 ARG A 47 93.667 12.691 11.083 1.00 0.00 N ATOM 753 NH2 ARG A 47 92.695 12.633 13.115 1.00 0.00 N ATOM 0 H ARG A 47 96.641 6.464 11.719 1.00 0.00 H new ATOM 0 HA ARG A 47 93.851 5.754 11.005 1.00 0.00 H new ATOM 0 HB2 ARG A 47 95.547 8.117 10.057 1.00 0.00 H new ATOM 0 HB3 ARG A 47 93.992 7.676 9.379 1.00 0.00 H new ATOM 0 HG2 ARG A 47 92.960 7.917 11.687 1.00 0.00 H new ATOM 0 HG3 ARG A 47 94.513 8.453 12.297 1.00 0.00 H new ATOM 0 HD2 ARG A 47 94.479 10.294 10.510 1.00 0.00 H new ATOM 0 HD3 ARG A 47 92.833 9.818 10.138 1.00 0.00 H new ATOM 0 HE ARG A 47 92.682 10.180 12.852 1.00 0.00 H new ATOM 0 HH11 ARG A 47 94.033 12.211 10.261 1.00 0.00 H new ATOM 0 HH12 ARG A 47 93.699 13.709 11.136 1.00 0.00 H new ATOM 0 HH21 ARG A 47 92.295 12.110 13.894 1.00 0.00 H new ATOM 0 HH22 ARG A 47 92.735 13.652 13.151 1.00 0.00 H new ATOM 767 N SER A 48 94.555 4.877 8.716 1.00 0.00 N ATOM 768 CA SER A 48 95.018 4.099 7.573 1.00 0.00 C ATOM 769 C SER A 48 95.892 4.960 6.658 1.00 0.00 C ATOM 770 O SER A 48 95.786 6.187 6.691 1.00 0.00 O ATOM 771 CB SER A 48 93.820 3.566 6.786 1.00 0.00 C ATOM 772 OG SER A 48 92.884 2.993 7.689 1.00 0.00 O ATOM 0 H SER A 48 93.542 4.974 8.783 1.00 0.00 H new ATOM 0 HA SER A 48 95.611 3.262 7.941 1.00 0.00 H new ATOM 0 HB2 SER A 48 93.352 4.373 6.222 1.00 0.00 H new ATOM 0 HB3 SER A 48 94.148 2.820 6.062 1.00 0.00 H new ATOM 0 HG SER A 48 92.114 2.652 7.189 1.00 0.00 H new ATOM 778 N PRO A 49 96.745 4.364 5.848 1.00 0.00 N ATOM 779 CA PRO A 49 97.634 5.152 4.939 1.00 0.00 C ATOM 780 C PRO A 49 96.867 6.218 4.163 1.00 0.00 C ATOM 781 O PRO A 49 95.773 5.967 3.660 1.00 0.00 O ATOM 782 CB PRO A 49 98.223 4.108 3.989 1.00 0.00 C ATOM 783 CG PRO A 49 98.176 2.821 4.738 1.00 0.00 C ATOM 784 CD PRO A 49 96.981 2.913 5.686 1.00 0.00 C ATOM 0 HA PRO A 49 98.395 5.698 5.497 1.00 0.00 H new ATOM 0 HB2 PRO A 49 97.646 4.047 3.066 1.00 0.00 H new ATOM 0 HB3 PRO A 49 99.245 4.363 3.710 1.00 0.00 H new ATOM 0 HG2 PRO A 49 98.065 1.979 4.055 1.00 0.00 H new ATOM 0 HG3 PRO A 49 99.100 2.662 5.293 1.00 0.00 H new ATOM 0 HD2 PRO A 49 96.106 2.413 5.271 1.00 0.00 H new ATOM 0 HD3 PRO A 49 97.196 2.437 6.643 1.00 0.00 H new ATOM 792 N VAL A 50 97.450 7.410 4.071 1.00 0.00 N ATOM 793 CA VAL A 50 96.786 8.523 3.399 1.00 0.00 C ATOM 794 C VAL A 50 97.165 8.528 1.912 1.00 0.00 C ATOM 795 O VAL A 50 98.322 8.247 1.595 1.00 0.00 O ATOM 796 CB VAL A 50 97.218 9.843 4.053 1.00 0.00 C ATOM 797 CG1 VAL A 50 96.508 11.025 3.387 1.00 0.00 C ATOM 798 CG2 VAL A 50 96.856 9.821 5.541 1.00 0.00 C ATOM 0 H VAL A 50 98.372 7.629 4.449 1.00 0.00 H new ATOM 0 HA VAL A 50 95.705 8.412 3.490 1.00 0.00 H new ATOM 0 HB VAL A 50 98.295 9.955 3.932 1.00 0.00 H new ATOM 0 HG11 VAL A 50 96.825 11.954 3.862 1.00 0.00 H new ATOM 0 HG12 VAL A 50 96.764 11.053 2.328 1.00 0.00 H new ATOM 0 HG13 VAL A 50 95.430 10.911 3.497 1.00 0.00 H new ATOM 0 HG21 VAL A 50 97.163 10.759 6.004 1.00 0.00 H new ATOM 0 HG22 VAL A 50 95.779 9.698 5.652 1.00 0.00 H new ATOM 0 HG23 VAL A 50 97.368 8.991 6.028 1.00 0.00 H new ATOM 808 N PRO A 51 96.266 8.856 1.007 1.00 0.00 N ATOM 809 CA PRO A 51 96.620 8.936 -0.444 1.00 0.00 C ATOM 810 C PRO A 51 97.839 9.826 -0.671 1.00 0.00 C ATOM 811 O PRO A 51 98.189 10.638 0.187 1.00 0.00 O ATOM 812 CB PRO A 51 95.380 9.532 -1.112 1.00 0.00 C ATOM 813 CG PRO A 51 94.250 9.213 -0.196 1.00 0.00 C ATOM 814 CD PRO A 51 94.838 9.173 1.213 1.00 0.00 C ATOM 0 HA PRO A 51 96.884 7.960 -0.852 1.00 0.00 H new ATOM 0 HB2 PRO A 51 95.485 10.608 -1.247 1.00 0.00 H new ATOM 0 HB3 PRO A 51 95.220 9.101 -2.100 1.00 0.00 H new ATOM 0 HG2 PRO A 51 93.466 9.967 -0.269 1.00 0.00 H new ATOM 0 HG3 PRO A 51 93.797 8.256 -0.456 1.00 0.00 H new ATOM 0 HD2 PRO A 51 94.713 10.128 1.723 1.00 0.00 H new ATOM 0 HD3 PRO A 51 94.348 8.417 1.827 1.00 0.00 H new ATOM 822 N LEU A 52 98.481 9.672 -1.825 1.00 0.00 N ATOM 823 CA LEU A 52 99.677 10.452 -2.125 1.00 0.00 C ATOM 824 C LEU A 52 99.332 11.941 -2.203 1.00 0.00 C ATOM 825 O LEU A 52 98.189 12.285 -2.513 1.00 0.00 O ATOM 826 CB LEU A 52 100.278 10.008 -3.462 1.00 0.00 C ATOM 827 CG LEU A 52 101.215 8.815 -3.256 1.00 0.00 C ATOM 828 CD1 LEU A 52 101.589 8.235 -4.620 1.00 0.00 C ATOM 829 CD2 LEU A 52 102.489 9.274 -2.544 1.00 0.00 C ATOM 0 H LEU A 52 98.198 9.023 -2.559 1.00 0.00 H new ATOM 0 HA LEU A 52 100.402 10.287 -1.328 1.00 0.00 H new ATOM 0 HB2 LEU A 52 99.481 9.737 -4.154 1.00 0.00 H new ATOM 0 HB3 LEU A 52 100.826 10.835 -3.914 1.00 0.00 H new ATOM 0 HG LEU A 52 100.713 8.060 -2.650 1.00 0.00 H new ATOM 0 HD11 LEU A 52 102.257 7.384 -4.483 1.00 0.00 H new ATOM 0 HD12 LEU A 52 100.686 7.908 -5.136 1.00 0.00 H new ATOM 0 HD13 LEU A 52 102.091 8.998 -5.215 1.00 0.00 H new ATOM 0 HD21 LEU A 52 103.153 8.421 -2.400 1.00 0.00 H new ATOM 0 HD22 LEU A 52 102.993 10.027 -3.149 1.00 0.00 H new ATOM 0 HD23 LEU A 52 102.231 9.701 -1.575 1.00 0.00 H new ATOM 841 N PRO A 53 100.269 12.827 -1.935 1.00 0.00 N ATOM 842 CA PRO A 53 100.020 14.289 -2.080 1.00 0.00 C ATOM 843 C PRO A 53 100.198 14.737 -3.526 1.00 0.00 C ATOM 844 O PRO A 53 101.012 14.173 -4.263 1.00 0.00 O ATOM 845 CB PRO A 53 101.069 14.927 -1.170 1.00 0.00 C ATOM 846 CG PRO A 53 102.216 13.973 -1.165 1.00 0.00 C ATOM 847 CD PRO A 53 101.651 12.583 -1.470 1.00 0.00 C ATOM 0 HA PRO A 53 99.002 14.572 -1.812 1.00 0.00 H new ATOM 0 HB2 PRO A 53 101.372 15.905 -1.544 1.00 0.00 H new ATOM 0 HB3 PRO A 53 100.678 15.078 -0.164 1.00 0.00 H new ATOM 0 HG2 PRO A 53 102.957 14.259 -1.911 1.00 0.00 H new ATOM 0 HG3 PRO A 53 102.718 13.980 -0.198 1.00 0.00 H new ATOM 0 HD2 PRO A 53 102.241 12.076 -2.233 1.00 0.00 H new ATOM 0 HD3 PRO A 53 101.663 11.948 -0.584 1.00 0.00 H new ATOM 855 N SER A 54 99.466 15.779 -3.920 1.00 0.00 N ATOM 856 CA SER A 54 99.502 16.244 -5.303 1.00 0.00 C ATOM 857 C SER A 54 100.943 16.566 -5.712 1.00 0.00 C ATOM 858 O SER A 54 101.656 17.216 -4.945 1.00 0.00 O ATOM 859 CB SER A 54 98.637 17.495 -5.455 1.00 0.00 C ATOM 860 OG SER A 54 98.993 18.435 -4.450 1.00 0.00 O ATOM 0 H SER A 54 98.848 16.311 -3.307 1.00 0.00 H new ATOM 0 HA SER A 54 99.114 15.456 -5.948 1.00 0.00 H new ATOM 0 HB2 SER A 54 98.778 17.931 -6.444 1.00 0.00 H new ATOM 0 HB3 SER A 54 97.582 17.235 -5.369 1.00 0.00 H new ATOM 0 HG SER A 54 98.442 19.240 -4.545 1.00 0.00 H new ATOM 866 N PRO A 55 101.390 16.148 -6.875 1.00 0.00 N ATOM 867 CA PRO A 55 102.834 16.239 -7.225 1.00 0.00 C ATOM 868 C PRO A 55 103.251 17.632 -7.681 1.00 0.00 C ATOM 869 O PRO A 55 102.735 18.153 -8.669 1.00 0.00 O ATOM 870 CB PRO A 55 102.989 15.228 -8.358 1.00 0.00 C ATOM 871 CG PRO A 55 101.668 15.212 -9.050 1.00 0.00 C ATOM 872 CD PRO A 55 100.616 15.617 -8.016 1.00 0.00 C ATOM 0 HA PRO A 55 103.470 16.035 -6.363 1.00 0.00 H new ATOM 0 HB2 PRO A 55 103.787 15.520 -9.040 1.00 0.00 H new ATOM 0 HB3 PRO A 55 103.244 14.241 -7.973 1.00 0.00 H new ATOM 0 HG2 PRO A 55 101.666 15.903 -9.893 1.00 0.00 H new ATOM 0 HG3 PRO A 55 101.454 14.221 -9.450 1.00 0.00 H new ATOM 0 HD2 PRO A 55 99.937 16.369 -8.417 1.00 0.00 H new ATOM 0 HD3 PRO A 55 100.007 14.764 -7.717 1.00 0.00 H new ATOM 880 N THR A 56 104.188 18.229 -6.953 1.00 0.00 N ATOM 881 CA THR A 56 104.836 19.442 -7.431 1.00 0.00 C ATOM 882 C THR A 56 105.833 19.038 -8.508 1.00 0.00 C ATOM 883 O THR A 56 106.295 17.895 -8.519 1.00 0.00 O ATOM 884 CB THR A 56 105.562 20.157 -6.287 1.00 0.00 C ATOM 885 OG1 THR A 56 106.614 19.332 -5.808 1.00 0.00 O ATOM 886 CG2 THR A 56 104.580 20.451 -5.151 1.00 0.00 C ATOM 0 H THR A 56 104.511 17.899 -6.044 1.00 0.00 H new ATOM 0 HA THR A 56 104.091 20.130 -7.831 1.00 0.00 H new ATOM 0 HB THR A 56 105.974 21.097 -6.653 1.00 0.00 H new ATOM 0 HG1 THR A 56 107.081 19.788 -5.077 1.00 0.00 H new ATOM 0 HG21 THR A 56 105.103 20.959 -4.341 1.00 0.00 H new ATOM 0 HG22 THR A 56 103.776 21.088 -5.520 1.00 0.00 H new ATOM 0 HG23 THR A 56 104.161 19.515 -4.781 1.00 0.00 H new ATOM 894 N SER A 57 106.203 19.965 -9.391 1.00 0.00 N ATOM 895 CA SER A 57 107.029 19.598 -10.540 1.00 0.00 C ATOM 896 C SER A 57 108.308 18.887 -10.098 1.00 0.00 C ATOM 897 O SER A 57 109.027 19.372 -9.226 1.00 0.00 O ATOM 898 CB SER A 57 107.394 20.852 -11.337 1.00 0.00 C ATOM 899 OG SER A 57 106.204 21.458 -11.825 1.00 0.00 O ATOM 0 H SER A 57 105.951 20.952 -9.337 1.00 0.00 H new ATOM 0 HA SER A 57 106.454 18.915 -11.165 1.00 0.00 H new ATOM 0 HB2 SER A 57 107.941 21.552 -10.706 1.00 0.00 H new ATOM 0 HB3 SER A 57 108.051 20.592 -12.167 1.00 0.00 H new ATOM 0 HG SER A 57 106.432 22.263 -12.335 1.00 0.00 H new ATOM 905 N ASN A 58 108.517 17.699 -10.660 1.00 0.00 N ATOM 906 CA ASN A 58 109.762 16.947 -10.512 1.00 0.00 C ATOM 907 C ASN A 58 110.051 16.531 -9.064 1.00 0.00 C ATOM 908 O ASN A 58 111.183 16.154 -8.763 1.00 0.00 O ATOM 909 CB ASN A 58 110.947 17.711 -11.137 1.00 0.00 C ATOM 910 CG ASN A 58 111.494 18.813 -10.228 1.00 0.00 C ATOM 911 OD1 ASN A 58 111.907 18.542 -9.101 1.00 0.00 O ATOM 912 ND2 ASN A 58 111.520 20.044 -10.657 1.00 0.00 N ATOM 0 H ASN A 58 107.821 17.226 -11.236 1.00 0.00 H new ATOM 0 HA ASN A 58 109.629 16.016 -11.063 1.00 0.00 H new ATOM 0 HB2 ASN A 58 111.746 17.006 -11.366 1.00 0.00 H new ATOM 0 HB3 ASN A 58 110.630 18.151 -12.082 1.00 0.00 H new ATOM 0 HD21 ASN A 58 111.883 20.785 -10.058 1.00 0.00 H new ATOM 0 HD22 ASN A 58 111.177 20.266 -11.592 1.00 0.00 H new ATOM 919 N LYS A 59 109.052 16.577 -8.177 1.00 0.00 N ATOM 920 CA LYS A 59 109.301 16.271 -6.767 1.00 0.00 C ATOM 921 C LYS A 59 108.053 15.752 -6.046 1.00 0.00 C ATOM 922 O LYS A 59 106.942 16.232 -6.273 1.00 0.00 O ATOM 923 CB LYS A 59 109.810 17.534 -6.063 1.00 0.00 C ATOM 924 CG LYS A 59 110.211 17.214 -4.619 1.00 0.00 C ATOM 925 CD LYS A 59 110.645 18.499 -3.911 1.00 0.00 C ATOM 926 CE LYS A 59 111.192 18.159 -2.524 1.00 0.00 C ATOM 927 NZ LYS A 59 111.245 19.394 -1.694 1.00 0.00 N ATOM 0 H LYS A 59 108.087 16.817 -8.403 1.00 0.00 H new ATOM 0 HA LYS A 59 110.047 15.477 -6.729 1.00 0.00 H new ATOM 0 HB2 LYS A 59 110.665 17.940 -6.603 1.00 0.00 H new ATOM 0 HB3 LYS A 59 109.035 18.300 -6.071 1.00 0.00 H new ATOM 0 HG2 LYS A 59 109.373 16.760 -4.090 1.00 0.00 H new ATOM 0 HG3 LYS A 59 111.024 16.489 -4.609 1.00 0.00 H new ATOM 0 HD2 LYS A 59 111.407 19.011 -4.499 1.00 0.00 H new ATOM 0 HD3 LYS A 59 109.799 19.181 -3.823 1.00 0.00 H new ATOM 0 HE2 LYS A 59 110.558 17.413 -2.045 1.00 0.00 H new ATOM 0 HE3 LYS A 59 112.187 17.724 -2.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 111.617 19.163 -0.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 111.867 20.092 -2.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 110.288 19.791 -1.601 1.00 0.00 H new ATOM 941 N GLN A 60 108.259 14.763 -5.175 1.00 0.00 N ATOM 942 CA GLN A 60 107.218 14.314 -4.248 1.00 0.00 C ATOM 943 C GLN A 60 107.826 13.918 -2.907 1.00 0.00 C ATOM 944 O GLN A 60 108.963 13.452 -2.844 1.00 0.00 O ATOM 945 CB GLN A 60 106.449 13.107 -4.790 1.00 0.00 C ATOM 946 CG GLN A 60 105.444 13.544 -5.854 1.00 0.00 C ATOM 947 CD GLN A 60 104.577 12.355 -6.262 1.00 0.00 C ATOM 948 OE1 GLN A 60 105.091 11.375 -6.799 1.00 0.00 O ATOM 949 NE2 GLN A 60 103.294 12.356 -6.005 1.00 0.00 N ATOM 0 H GLN A 60 109.140 14.256 -5.092 1.00 0.00 H new ATOM 0 HA GLN A 60 106.532 15.152 -4.126 1.00 0.00 H new ATOM 0 HB2 GLN A 60 107.147 12.386 -5.215 1.00 0.00 H new ATOM 0 HB3 GLN A 60 105.928 12.605 -3.975 1.00 0.00 H new ATOM 0 HG2 GLN A 60 104.817 14.348 -5.468 1.00 0.00 H new ATOM 0 HG3 GLN A 60 105.969 13.939 -6.724 1.00 0.00 H new ATOM 0 HE21 GLN A 60 102.864 13.167 -5.560 1.00 0.00 H new ATOM 0 HE22 GLN A 60 102.724 11.546 -6.250 1.00 0.00 H new ATOM 958 N ASP A 61 107.056 14.086 -1.838 1.00 0.00 N ATOM 959 CA ASP A 61 107.470 13.600 -0.526 1.00 0.00 C ATOM 960 C ASP A 61 106.829 12.242 -0.261 1.00 0.00 C ATOM 961 O ASP A 61 105.609 12.104 -0.342 1.00 0.00 O ATOM 962 CB ASP A 61 107.047 14.593 0.560 1.00 0.00 C ATOM 963 CG ASP A 61 107.742 15.938 0.357 1.00 0.00 C ATOM 964 OD1 ASP A 61 108.855 15.945 -0.144 1.00 0.00 O ATOM 965 OD2 ASP A 61 107.148 16.944 0.707 1.00 0.00 O ATOM 0 H ASP A 61 106.148 14.551 -1.852 1.00 0.00 H new ATOM 0 HA ASP A 61 108.555 13.499 -0.508 1.00 0.00 H new ATOM 0 HB2 ASP A 61 105.966 14.729 0.535 1.00 0.00 H new ATOM 0 HB3 ASP A 61 107.296 14.193 1.543 1.00 0.00 H new ATOM 970 N ILE A 62 107.645 11.238 0.058 1.00 0.00 N ATOM 971 CA ILE A 62 107.134 9.880 0.249 1.00 0.00 C ATOM 972 C ILE A 62 107.575 9.321 1.605 1.00 0.00 C ATOM 973 O ILE A 62 108.672 9.625 2.073 1.00 0.00 O ATOM 974 CB ILE A 62 107.610 8.997 -0.916 1.00 0.00 C ATOM 975 CG1 ILE A 62 106.856 7.667 -0.883 1.00 0.00 C ATOM 976 CG2 ILE A 62 109.121 8.740 -0.850 1.00 0.00 C ATOM 977 CD1 ILE A 62 105.400 7.889 -1.310 1.00 0.00 C ATOM 0 H ILE A 62 108.652 11.336 0.189 1.00 0.00 H new ATOM 0 HA ILE A 62 106.044 9.893 0.252 1.00 0.00 H new ATOM 0 HB ILE A 62 107.403 9.522 -1.849 1.00 0.00 H new ATOM 0 HG12 ILE A 62 107.335 6.949 -1.549 1.00 0.00 H new ATOM 0 HG13 ILE A 62 106.890 7.243 0.121 1.00 0.00 H new ATOM 0 HG21 ILE A 62 109.420 8.112 -1.689 1.00 0.00 H new ATOM 0 HG22 ILE A 62 109.654 9.690 -0.899 1.00 0.00 H new ATOM 0 HG23 ILE A 62 109.364 8.235 0.085 1.00 0.00 H new ATOM 0 HD11 ILE A 62 104.865 6.940 -1.286 1.00 0.00 H new ATOM 0 HD12 ILE A 62 104.924 8.592 -0.627 1.00 0.00 H new ATOM 0 HD13 ILE A 62 105.375 8.294 -2.322 1.00 0.00 H new ATOM 989 N SER A 63 106.733 8.493 2.226 1.00 0.00 N ATOM 990 CA SER A 63 107.023 8.020 3.577 1.00 0.00 C ATOM 991 C SER A 63 106.436 6.636 3.845 1.00 0.00 C ATOM 992 O SER A 63 105.508 6.184 3.170 1.00 0.00 O ATOM 993 CB SER A 63 106.470 9.010 4.603 1.00 0.00 C ATOM 994 OG SER A 63 105.051 8.927 4.617 1.00 0.00 O ATOM 0 H SER A 63 105.863 8.143 1.824 1.00 0.00 H new ATOM 0 HA SER A 63 108.107 7.946 3.667 1.00 0.00 H new ATOM 0 HB2 SER A 63 106.869 8.787 5.593 1.00 0.00 H new ATOM 0 HB3 SER A 63 106.784 10.024 4.354 1.00 0.00 H new ATOM 0 HG SER A 63 104.714 8.933 3.697 1.00 0.00 H new ATOM 1000 N GLU A 64 106.978 5.977 4.865 1.00 0.00 N ATOM 1001 CA GLU A 64 106.516 4.651 5.252 1.00 0.00 C ATOM 1002 C GLU A 64 105.014 4.642 5.534 1.00 0.00 C ATOM 1003 O GLU A 64 104.330 3.666 5.231 1.00 0.00 O ATOM 1004 CB GLU A 64 107.279 4.179 6.495 1.00 0.00 C ATOM 1005 CG GLU A 64 107.032 5.141 7.664 1.00 0.00 C ATOM 1006 CD GLU A 64 107.858 4.764 8.898 1.00 0.00 C ATOM 1007 OE1 GLU A 64 108.520 3.736 8.885 1.00 0.00 O ATOM 1008 OE2 GLU A 64 107.813 5.519 9.855 1.00 0.00 O ATOM 0 H GLU A 64 107.739 6.342 5.438 1.00 0.00 H new ATOM 0 HA GLU A 64 106.707 3.972 4.421 1.00 0.00 H new ATOM 0 HB2 GLU A 64 106.958 3.174 6.768 1.00 0.00 H new ATOM 0 HB3 GLU A 64 108.346 4.125 6.278 1.00 0.00 H new ATOM 0 HG2 GLU A 64 107.281 6.157 7.357 1.00 0.00 H new ATOM 0 HG3 GLU A 64 105.973 5.136 7.921 1.00 0.00 H new ATOM 1015 N ALA A 65 104.496 5.735 6.088 1.00 0.00 N ATOM 1016 CA ALA A 65 103.088 5.789 6.468 1.00 0.00 C ATOM 1017 C ALA A 65 102.182 5.545 5.264 1.00 0.00 C ATOM 1018 O ALA A 65 101.207 4.799 5.354 1.00 0.00 O ATOM 1019 CB ALA A 65 102.766 7.155 7.078 1.00 0.00 C ATOM 0 H ALA A 65 105.023 6.586 6.282 1.00 0.00 H new ATOM 0 HA ALA A 65 102.907 5.004 7.202 1.00 0.00 H new ATOM 0 HB1 ALA A 65 101.714 7.189 7.359 1.00 0.00 H new ATOM 0 HB2 ALA A 65 103.383 7.313 7.962 1.00 0.00 H new ATOM 0 HB3 ALA A 65 102.971 7.937 6.347 1.00 0.00 H new ATOM 1025 N ASN A 66 102.506 6.177 4.140 1.00 0.00 N ATOM 1026 CA ASN A 66 101.663 6.072 2.953 1.00 0.00 C ATOM 1027 C ASN A 66 101.735 4.674 2.344 1.00 0.00 C ATOM 1028 O ASN A 66 100.711 4.086 1.995 1.00 0.00 O ATOM 1029 CB ASN A 66 102.094 7.098 1.901 1.00 0.00 C ATOM 1030 CG ASN A 66 102.148 8.500 2.502 1.00 0.00 C ATOM 1031 OD1 ASN A 66 103.211 8.955 2.923 1.00 0.00 O ATOM 1032 ND2 ASN A 66 101.061 9.218 2.556 1.00 0.00 N ATOM 0 H ASN A 66 103.335 6.760 4.026 1.00 0.00 H new ATOM 0 HA ASN A 66 100.636 6.269 3.262 1.00 0.00 H new ATOM 0 HB2 ASN A 66 103.073 6.829 1.504 1.00 0.00 H new ATOM 0 HB3 ASN A 66 101.396 7.083 1.064 1.00 0.00 H new ATOM 0 HD21 ASN A 66 101.090 10.159 2.948 1.00 0.00 H new ATOM 0 HD22 ASN A 66 100.181 8.838 2.206 1.00 0.00 H new ATOM 1039 N LEU A 67 102.949 4.153 2.201 1.00 0.00 N ATOM 1040 CA LEU A 67 103.138 2.847 1.569 1.00 0.00 C ATOM 1041 C LEU A 67 102.673 1.687 2.450 1.00 0.00 C ATOM 1042 O LEU A 67 102.334 0.621 1.936 1.00 0.00 O ATOM 1043 CB LEU A 67 104.607 2.651 1.186 1.00 0.00 C ATOM 1044 CG LEU A 67 104.900 3.417 -0.107 1.00 0.00 C ATOM 1045 CD1 LEU A 67 105.003 4.913 0.199 1.00 0.00 C ATOM 1046 CD2 LEU A 67 106.212 2.921 -0.730 1.00 0.00 C ATOM 0 H LEU A 67 103.809 4.606 2.509 1.00 0.00 H new ATOM 0 HA LEU A 67 102.516 2.840 0.674 1.00 0.00 H new ATOM 0 HB2 LEU A 67 105.254 3.007 1.988 1.00 0.00 H new ATOM 0 HB3 LEU A 67 104.821 1.591 1.051 1.00 0.00 H new ATOM 0 HG LEU A 67 104.089 3.246 -0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 67 105.212 5.459 -0.721 1.00 0.00 H new ATOM 0 HD12 LEU A 67 104.062 5.263 0.623 1.00 0.00 H new ATOM 0 HD13 LEU A 67 105.809 5.084 0.913 1.00 0.00 H new ATOM 0 HD21 LEU A 67 106.410 3.473 -1.649 1.00 0.00 H new ATOM 0 HD22 LEU A 67 107.031 3.079 -0.028 1.00 0.00 H new ATOM 0 HD23 LEU A 67 106.128 1.858 -0.956 1.00 0.00 H new ATOM 1058 N ALA A 68 102.668 1.879 3.771 1.00 0.00 N ATOM 1059 CA ALA A 68 102.308 0.813 4.708 1.00 0.00 C ATOM 1060 C ALA A 68 103.422 -0.246 4.712 1.00 0.00 C ATOM 1061 O ALA A 68 104.579 0.104 4.482 1.00 0.00 O ATOM 1062 CB ALA A 68 100.928 0.230 4.353 1.00 0.00 C ATOM 0 H ALA A 68 102.910 2.764 4.216 1.00 0.00 H new ATOM 0 HA ALA A 68 102.221 1.209 5.720 1.00 0.00 H new ATOM 0 HB1 ALA A 68 100.675 -0.561 5.059 1.00 0.00 H new ATOM 0 HB2 ALA A 68 100.176 1.017 4.405 1.00 0.00 H new ATOM 0 HB3 ALA A 68 100.955 -0.179 3.343 1.00 0.00 H new ATOM 1068 N TYR A 69 103.108 -1.524 4.939 1.00 0.00 N ATOM 1069 CA TYR A 69 104.144 -2.559 5.011 1.00 0.00 C ATOM 1070 C TYR A 69 105.011 -2.609 3.745 1.00 0.00 C ATOM 1071 O TYR A 69 106.122 -3.139 3.774 1.00 0.00 O ATOM 1072 CB TYR A 69 103.493 -3.924 5.236 1.00 0.00 C ATOM 1073 CG TYR A 69 102.760 -4.029 6.552 1.00 0.00 C ATOM 1074 CD1 TYR A 69 103.472 -4.288 7.729 1.00 0.00 C ATOM 1075 CD2 TYR A 69 101.370 -3.867 6.595 1.00 0.00 C ATOM 1076 CE1 TYR A 69 102.793 -4.385 8.951 1.00 0.00 C ATOM 1077 CE2 TYR A 69 100.692 -3.963 7.816 1.00 0.00 C ATOM 1078 CZ TYR A 69 101.403 -4.222 8.994 1.00 0.00 C ATOM 1079 OH TYR A 69 100.734 -4.317 10.198 1.00 0.00 O ATOM 0 H TYR A 69 102.156 -1.865 5.075 1.00 0.00 H new ATOM 0 HA TYR A 69 104.797 -2.307 5.847 1.00 0.00 H new ATOM 0 HB2 TYR A 69 102.795 -4.124 4.423 1.00 0.00 H new ATOM 0 HB3 TYR A 69 104.261 -4.696 5.194 1.00 0.00 H new ATOM 0 HD1 TYR A 69 104.544 -4.413 7.695 1.00 0.00 H new ATOM 0 HD2 TYR A 69 100.821 -3.668 5.686 1.00 0.00 H new ATOM 0 HE1 TYR A 69 103.342 -4.585 9.859 1.00 0.00 H new ATOM 0 HE2 TYR A 69 99.620 -3.837 7.849 1.00 0.00 H new ATOM 0 HH TYR A 69 99.775 -4.178 10.051 1.00 0.00 H new ATOM 1089 N LEU A 70 104.509 -2.063 2.639 1.00 0.00 N ATOM 1090 CA LEU A 70 105.251 -2.058 1.377 1.00 0.00 C ATOM 1091 C LEU A 70 106.595 -1.329 1.496 1.00 0.00 C ATOM 1092 O LEU A 70 107.514 -1.595 0.720 1.00 0.00 O ATOM 1093 CB LEU A 70 104.409 -1.392 0.284 1.00 0.00 C ATOM 1094 CG LEU A 70 103.069 -2.118 0.134 1.00 0.00 C ATOM 1095 CD1 LEU A 70 102.204 -1.380 -0.890 1.00 0.00 C ATOM 1096 CD2 LEU A 70 103.307 -3.550 -0.350 1.00 0.00 C ATOM 0 H LEU A 70 103.592 -1.618 2.590 1.00 0.00 H new ATOM 0 HA LEU A 70 105.457 -3.096 1.118 1.00 0.00 H new ATOM 0 HB2 LEU A 70 104.238 -0.345 0.534 1.00 0.00 H new ATOM 0 HB3 LEU A 70 104.949 -1.410 -0.663 1.00 0.00 H new ATOM 0 HG LEU A 70 102.563 -2.140 1.099 1.00 0.00 H new ATOM 0 HD11 LEU A 70 101.249 -1.895 -0.999 1.00 0.00 H new ATOM 0 HD12 LEU A 70 102.029 -0.359 -0.550 1.00 0.00 H new ATOM 0 HD13 LEU A 70 102.717 -1.359 -1.852 1.00 0.00 H new ATOM 0 HD21 LEU A 70 102.351 -4.062 -0.455 1.00 0.00 H new ATOM 0 HD22 LEU A 70 103.815 -3.528 -1.314 1.00 0.00 H new ATOM 0 HD23 LEU A 70 103.925 -4.081 0.374 1.00 0.00 H new ATOM 1108 N TRP A 71 106.714 -0.416 2.458 1.00 0.00 N ATOM 1109 CA TRP A 71 107.926 0.382 2.611 1.00 0.00 C ATOM 1110 C TRP A 71 109.152 -0.533 2.763 1.00 0.00 C ATOM 1111 O TRP A 71 109.262 -1.222 3.779 1.00 0.00 O ATOM 1112 CB TRP A 71 107.793 1.243 3.868 1.00 0.00 C ATOM 1113 CG TRP A 71 108.782 2.362 3.940 1.00 0.00 C ATOM 1114 CD1 TRP A 71 109.756 2.472 4.871 1.00 0.00 C ATOM 1115 CD2 TRP A 71 108.910 3.529 3.073 1.00 0.00 C ATOM 1116 NE1 TRP A 71 110.460 3.638 4.643 1.00 0.00 N ATOM 1117 CE2 TRP A 71 109.985 4.321 3.542 1.00 0.00 C ATOM 1118 CE3 TRP A 71 108.205 3.972 1.943 1.00 0.00 C ATOM 1119 CZ2 TRP A 71 110.348 5.514 2.907 1.00 0.00 C ATOM 1120 CZ3 TRP A 71 108.567 5.166 1.302 1.00 0.00 C ATOM 1121 CH2 TRP A 71 109.635 5.936 1.782 1.00 0.00 C ATOM 0 H TRP A 71 105.986 -0.211 3.142 1.00 0.00 H new ATOM 0 HA TRP A 71 108.056 1.008 1.728 1.00 0.00 H new ATOM 0 HB2 TRP A 71 106.786 1.658 3.908 1.00 0.00 H new ATOM 0 HB3 TRP A 71 107.912 0.608 4.746 1.00 0.00 H new ATOM 0 HD1 TRP A 71 109.951 1.764 5.663 1.00 0.00 H new ATOM 0 HE1 TRP A 71 111.239 3.957 5.220 1.00 0.00 H new ATOM 0 HE3 TRP A 71 107.378 3.389 1.564 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 111.172 6.103 3.283 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 108.018 5.494 0.432 1.00 0.00 H new ATOM 0 HH2 TRP A 71 109.907 6.854 1.283 1.00 0.00 H new ATOM 1132 N PRO A 72 110.069 -0.572 1.815 1.00 0.00 N ATOM 1133 CA PRO A 72 111.227 -1.515 1.879 1.00 0.00 C ATOM 1134 C PRO A 72 112.454 -0.952 2.598 1.00 0.00 C ATOM 1135 O PRO A 72 113.390 -1.695 2.896 1.00 0.00 O ATOM 1136 CB PRO A 72 111.538 -1.758 0.404 1.00 0.00 C ATOM 1137 CG PRO A 72 111.231 -0.461 -0.264 1.00 0.00 C ATOM 1138 CD PRO A 72 110.152 0.229 0.576 1.00 0.00 C ATOM 0 HA PRO A 72 110.981 -2.409 2.452 1.00 0.00 H new ATOM 0 HB2 PRO A 72 112.581 -2.041 0.260 1.00 0.00 H new ATOM 0 HB3 PRO A 72 110.930 -2.566 -0.001 1.00 0.00 H new ATOM 0 HG2 PRO A 72 112.124 0.160 -0.330 1.00 0.00 H new ATOM 0 HG3 PRO A 72 110.881 -0.625 -1.283 1.00 0.00 H new ATOM 0 HD2 PRO A 72 110.419 1.264 0.791 1.00 0.00 H new ATOM 0 HD3 PRO A 72 109.196 0.249 0.053 1.00 0.00 H new ATOM 1146 N LEU A 73 112.476 0.356 2.840 1.00 0.00 N ATOM 1147 CA LEU A 73 113.656 0.997 3.418 1.00 0.00 C ATOM 1148 C LEU A 73 113.594 1.034 4.940 1.00 0.00 C ATOM 1149 O LEU A 73 112.524 1.184 5.532 1.00 0.00 O ATOM 1150 CB LEU A 73 113.786 2.430 2.899 1.00 0.00 C ATOM 1151 CG LEU A 73 113.820 2.446 1.370 1.00 0.00 C ATOM 1152 CD1 LEU A 73 113.867 3.899 0.899 1.00 0.00 C ATOM 1153 CD2 LEU A 73 115.064 1.706 0.869 1.00 0.00 C ATOM 0 H LEU A 73 111.699 0.988 2.648 1.00 0.00 H new ATOM 0 HA LEU A 73 114.521 0.405 3.119 1.00 0.00 H new ATOM 0 HB2 LEU A 73 112.949 3.030 3.256 1.00 0.00 H new ATOM 0 HB3 LEU A 73 114.695 2.885 3.293 1.00 0.00 H new ATOM 0 HG LEU A 73 112.932 1.951 0.976 1.00 0.00 H new ATOM 0 HD11 LEU A 73 113.892 3.928 -0.190 1.00 0.00 H new ATOM 0 HD12 LEU A 73 112.982 4.426 1.256 1.00 0.00 H new ATOM 0 HD13 LEU A 73 114.761 4.381 1.295 1.00 0.00 H new ATOM 0 HD21 LEU A 73 115.082 1.721 -0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 73 115.958 2.196 1.254 1.00 0.00 H new ATOM 0 HD23 LEU A 73 115.038 0.673 1.217 1.00 0.00 H new ATOM 1165 N THR A 74 114.761 0.897 5.561 1.00 0.00 N ATOM 1166 CA THR A 74 114.880 1.020 7.009 1.00 0.00 C ATOM 1167 C THR A 74 114.644 2.463 7.446 1.00 0.00 C ATOM 1168 O THR A 74 114.039 2.702 8.492 1.00 0.00 O ATOM 1169 CB THR A 74 116.273 0.570 7.461 1.00 0.00 C ATOM 1170 OG1 THR A 74 117.253 1.420 6.883 1.00 0.00 O ATOM 1171 CG2 THR A 74 116.519 -0.873 7.019 1.00 0.00 C ATOM 0 H THR A 74 115.640 0.700 5.082 1.00 0.00 H new ATOM 0 HA THR A 74 114.125 0.384 7.471 1.00 0.00 H new ATOM 0 HB THR A 74 116.337 0.626 8.548 1.00 0.00 H new ATOM 0 HG1 THR A 74 117.350 1.207 5.931 1.00 0.00 H new ATOM 0 HG21 THR A 74 117.511 -1.189 7.343 1.00 0.00 H new ATOM 0 HG22 THR A 74 115.767 -1.524 7.466 1.00 0.00 H new ATOM 0 HG23 THR A 74 116.454 -0.937 5.933 1.00 0.00 H new ATOM 1179 N VAL A 75 115.121 3.424 6.650 1.00 0.00 N ATOM 1180 CA VAL A 75 114.850 4.827 6.946 1.00 0.00 C ATOM 1181 C VAL A 75 113.353 5.060 6.816 1.00 0.00 C ATOM 1182 O VAL A 75 112.746 4.669 5.825 1.00 0.00 O ATOM 1183 CB VAL A 75 115.621 5.761 6.008 1.00 0.00 C ATOM 1184 CG1 VAL A 75 117.121 5.623 6.274 1.00 0.00 C ATOM 1185 CG2 VAL A 75 115.339 5.412 4.543 1.00 0.00 C ATOM 0 H VAL A 75 115.684 3.259 5.815 1.00 0.00 H new ATOM 0 HA VAL A 75 115.183 5.050 7.960 1.00 0.00 H new ATOM 0 HB VAL A 75 115.297 6.785 6.196 1.00 0.00 H new ATOM 0 HG11 VAL A 75 117.671 6.287 5.607 1.00 0.00 H new ATOM 0 HG12 VAL A 75 117.333 5.891 7.309 1.00 0.00 H new ATOM 0 HG13 VAL A 75 117.429 4.593 6.095 1.00 0.00 H new ATOM 0 HG21 VAL A 75 115.897 6.088 3.894 1.00 0.00 H new ATOM 0 HG22 VAL A 75 115.647 4.385 4.348 1.00 0.00 H new ATOM 0 HG23 VAL A 75 114.272 5.515 4.343 1.00 0.00 H new ATOM 1195 N ASP A 76 112.755 5.677 7.827 1.00 0.00 N ATOM 1196 CA ASP A 76 111.301 5.739 7.908 1.00 0.00 C ATOM 1197 C ASP A 76 110.691 6.494 6.735 1.00 0.00 C ATOM 1198 O ASP A 76 109.582 6.170 6.307 1.00 0.00 O ATOM 1199 CB ASP A 76 110.874 6.391 9.226 1.00 0.00 C ATOM 1200 CG ASP A 76 111.294 5.528 10.412 1.00 0.00 C ATOM 1201 OD1 ASP A 76 111.347 4.318 10.261 1.00 0.00 O ATOM 1202 OD2 ASP A 76 111.561 6.092 11.461 1.00 0.00 O ATOM 0 H ASP A 76 113.247 6.136 8.594 1.00 0.00 H new ATOM 0 HA ASP A 76 110.930 4.715 7.868 1.00 0.00 H new ATOM 0 HB2 ASP A 76 111.324 7.380 9.311 1.00 0.00 H new ATOM 0 HB3 ASP A 76 109.793 6.531 9.236 1.00 0.00 H new ATOM 1207 N HIS A 77 111.388 7.509 6.233 1.00 0.00 N ATOM 1208 CA HIS A 77 110.860 8.284 5.117 1.00 0.00 C ATOM 1209 C HIS A 77 111.987 8.791 4.232 1.00 0.00 C ATOM 1210 O HIS A 77 113.161 8.572 4.522 1.00 0.00 O ATOM 1211 CB HIS A 77 110.023 9.456 5.632 1.00 0.00 C ATOM 1212 CG HIS A 77 110.743 10.332 6.620 1.00 0.00 C ATOM 1213 ND1 HIS A 77 111.231 9.845 7.822 1.00 0.00 N ATOM 1214 CD2 HIS A 77 111.047 11.671 6.607 1.00 0.00 C ATOM 1215 CE1 HIS A 77 111.798 10.874 8.477 1.00 0.00 C ATOM 1216 NE2 HIS A 77 111.714 12.011 7.782 1.00 0.00 N ATOM 0 H HIS A 77 112.301 7.809 6.573 1.00 0.00 H new ATOM 0 HA HIS A 77 110.222 7.632 4.520 1.00 0.00 H new ATOM 0 HB2 HIS A 77 109.708 10.064 4.784 1.00 0.00 H new ATOM 0 HB3 HIS A 77 109.118 9.066 6.099 1.00 0.00 H new ATOM 0 HD2 HIS A 77 110.806 12.356 5.808 1.00 0.00 H new ATOM 0 HE1 HIS A 77 112.265 10.791 9.447 1.00 0.00 H new ATOM 0 HE2 HIS A 77 112.063 12.930 8.053 1.00 0.00 H new ATOM 1224 N GLY A 78 111.610 9.413 3.123 1.00 0.00 N ATOM 1225 CA GLY A 78 112.575 10.026 2.226 1.00 0.00 C ATOM 1226 C GLY A 78 111.852 10.833 1.155 1.00 0.00 C ATOM 1227 O GLY A 78 110.652 10.672 0.934 1.00 0.00 O ATOM 0 H GLY A 78 110.639 9.505 2.824 1.00 0.00 H new ATOM 0 HA2 GLY A 78 113.247 10.674 2.789 1.00 0.00 H new ATOM 0 HA3 GLY A 78 113.190 9.257 1.760 1.00 0.00 H new ATOM 1231 N THR A 79 112.584 11.728 0.507 1.00 0.00 N ATOM 1232 CA THR A 79 112.015 12.541 -0.561 1.00 0.00 C ATOM 1233 C THR A 79 112.561 12.080 -1.907 1.00 0.00 C ATOM 1234 O THR A 79 113.740 11.760 -2.023 1.00 0.00 O ATOM 1235 CB THR A 79 112.367 14.012 -0.338 1.00 0.00 C ATOM 1236 OG1 THR A 79 112.211 14.327 1.039 1.00 0.00 O ATOM 1237 CG2 THR A 79 111.414 14.876 -1.165 1.00 0.00 C ATOM 0 H THR A 79 113.569 11.910 0.700 1.00 0.00 H new ATOM 0 HA THR A 79 110.931 12.428 -0.556 1.00 0.00 H new ATOM 0 HB THR A 79 113.397 14.200 -0.640 1.00 0.00 H new ATOM 0 HG1 THR A 79 112.437 15.269 1.187 1.00 0.00 H new ATOM 0 HG21 THR A 79 111.654 15.929 -1.015 1.00 0.00 H new ATOM 0 HG22 THR A 79 111.520 14.626 -2.221 1.00 0.00 H new ATOM 0 HG23 THR A 79 110.387 14.690 -0.850 1.00 0.00 H new ATOM 1245 N ILE A 80 111.706 12.044 -2.925 1.00 0.00 N ATOM 1246 CA ILE A 80 112.128 11.602 -4.253 1.00 0.00 C ATOM 1247 C ILE A 80 112.194 12.792 -5.202 1.00 0.00 C ATOM 1248 O ILE A 80 111.309 13.649 -5.199 1.00 0.00 O ATOM 1249 CB ILE A 80 111.158 10.546 -4.789 1.00 0.00 C ATOM 1250 CG1 ILE A 80 109.732 11.110 -4.827 1.00 0.00 C ATOM 1251 CG2 ILE A 80 111.204 9.320 -3.875 1.00 0.00 C ATOM 1252 CD1 ILE A 80 108.783 10.088 -5.461 1.00 0.00 C ATOM 0 H ILE A 80 110.724 12.313 -2.859 1.00 0.00 H new ATOM 0 HA ILE A 80 113.121 11.158 -4.180 1.00 0.00 H new ATOM 0 HB ILE A 80 111.450 10.265 -5.801 1.00 0.00 H new ATOM 0 HG12 ILE A 80 109.400 11.350 -3.817 1.00 0.00 H new ATOM 0 HG13 ILE A 80 109.714 12.039 -5.398 1.00 0.00 H new ATOM 0 HG21 ILE A 80 110.516 8.562 -4.249 1.00 0.00 H new ATOM 0 HG22 ILE A 80 112.216 8.916 -3.859 1.00 0.00 H new ATOM 0 HG23 ILE A 80 110.913 9.608 -2.865 1.00 0.00 H new ATOM 0 HD11 ILE A 80 107.772 10.496 -5.484 1.00 0.00 H new ATOM 0 HD12 ILE A 80 109.110 9.870 -6.478 1.00 0.00 H new ATOM 0 HD13 ILE A 80 108.791 9.171 -4.873 1.00 0.00 H new ATOM 1264 N GLU A 81 113.256 12.850 -6.001 1.00 0.00 N ATOM 1265 CA GLU A 81 113.461 13.989 -6.889 1.00 0.00 C ATOM 1266 C GLU A 81 113.959 13.559 -8.262 1.00 0.00 C ATOM 1267 O GLU A 81 114.735 12.611 -8.394 1.00 0.00 O ATOM 1268 CB GLU A 81 114.478 14.950 -6.270 1.00 0.00 C ATOM 1269 CG GLU A 81 113.944 15.480 -4.935 1.00 0.00 C ATOM 1270 CD GLU A 81 114.890 16.511 -4.311 1.00 0.00 C ATOM 1271 OE1 GLU A 81 116.006 16.664 -4.788 1.00 0.00 O ATOM 1272 OE2 GLU A 81 114.479 17.144 -3.353 1.00 0.00 O ATOM 0 H GLU A 81 113.979 12.132 -6.052 1.00 0.00 H new ATOM 0 HA GLU A 81 112.497 14.482 -7.015 1.00 0.00 H new ATOM 0 HB2 GLU A 81 115.428 14.439 -6.115 1.00 0.00 H new ATOM 0 HB3 GLU A 81 114.670 15.779 -6.951 1.00 0.00 H new ATOM 0 HG2 GLU A 81 112.965 15.933 -5.090 1.00 0.00 H new ATOM 0 HG3 GLU A 81 113.806 14.649 -4.244 1.00 0.00 H new ATOM 1279 N CYS A 82 113.495 14.278 -9.277 1.00 0.00 N ATOM 1280 CA CYS A 82 113.985 14.099 -10.639 1.00 0.00 C ATOM 1281 C CYS A 82 114.783 15.330 -11.065 1.00 0.00 C ATOM 1282 O CYS A 82 114.248 16.437 -11.117 1.00 0.00 O ATOM 1283 CB CYS A 82 112.806 13.888 -11.594 1.00 0.00 C ATOM 1284 SG CYS A 82 112.432 12.120 -11.702 1.00 0.00 S ATOM 0 H CYS A 82 112.776 14.995 -9.182 1.00 0.00 H new ATOM 0 HA CYS A 82 114.632 13.222 -10.674 1.00 0.00 H new ATOM 0 HB2 CYS A 82 111.933 14.435 -11.238 1.00 0.00 H new ATOM 0 HB3 CYS A 82 113.048 14.281 -12.581 1.00 0.00 H new ATOM 1289 N LEU A 83 116.062 15.131 -11.365 1.00 0.00 N ATOM 1290 CA LEU A 83 116.931 16.244 -11.733 1.00 0.00 C ATOM 1291 C LEU A 83 116.780 16.593 -13.217 1.00 0.00 C ATOM 1292 O LEU A 83 116.379 15.739 -14.007 1.00 0.00 O ATOM 1293 CB LEU A 83 118.389 15.882 -11.441 1.00 0.00 C ATOM 1294 CG LEU A 83 118.597 15.780 -9.929 1.00 0.00 C ATOM 1295 CD1 LEU A 83 119.806 14.888 -9.638 1.00 0.00 C ATOM 1296 CD2 LEU A 83 118.846 17.176 -9.354 1.00 0.00 C ATOM 0 H LEU A 83 116.517 14.218 -11.361 1.00 0.00 H new ATOM 0 HA LEU A 83 116.640 17.112 -11.141 1.00 0.00 H new ATOM 0 HB2 LEU A 83 118.642 14.935 -11.918 1.00 0.00 H new ATOM 0 HB3 LEU A 83 119.053 16.638 -11.860 1.00 0.00 H new ATOM 0 HG LEU A 83 117.708 15.349 -9.469 1.00 0.00 H new ATOM 0 HD11 LEU A 83 119.954 14.816 -8.560 1.00 0.00 H new ATOM 0 HD12 LEU A 83 119.631 13.893 -10.048 1.00 0.00 H new ATOM 0 HD13 LEU A 83 120.695 15.319 -10.098 1.00 0.00 H new ATOM 0 HD21 LEU A 83 118.994 17.105 -8.277 1.00 0.00 H new ATOM 0 HD22 LEU A 83 119.735 17.606 -9.815 1.00 0.00 H new ATOM 0 HD23 LEU A 83 117.986 17.813 -9.560 1.00 0.00 H new ATOM 1308 N PRO A 84 117.101 17.804 -13.624 1.00 0.00 N ATOM 1309 CA PRO A 84 117.008 18.193 -15.070 1.00 0.00 C ATOM 1310 C PRO A 84 117.801 17.261 -15.995 1.00 0.00 C ATOM 1311 O PRO A 84 117.566 17.234 -17.202 1.00 0.00 O ATOM 1312 CB PRO A 84 117.557 19.627 -15.122 1.00 0.00 C ATOM 1313 CG PRO A 84 118.270 19.842 -13.831 1.00 0.00 C ATOM 1314 CD PRO A 84 117.587 18.935 -12.810 1.00 0.00 C ATOM 0 HA PRO A 84 115.981 18.120 -15.429 1.00 0.00 H new ATOM 0 HB2 PRO A 84 118.233 19.755 -15.967 1.00 0.00 H new ATOM 0 HB3 PRO A 84 116.750 20.349 -15.247 1.00 0.00 H new ATOM 0 HG2 PRO A 84 119.328 19.595 -13.925 1.00 0.00 H new ATOM 0 HG3 PRO A 84 118.212 20.886 -13.524 1.00 0.00 H new ATOM 0 HD2 PRO A 84 118.282 18.604 -12.038 1.00 0.00 H new ATOM 0 HD3 PRO A 84 116.768 19.446 -12.304 1.00 0.00 H new ATOM 1322 N SER A 85 118.737 16.502 -15.430 1.00 0.00 N ATOM 1323 CA SER A 85 119.553 15.571 -16.213 1.00 0.00 C ATOM 1324 C SER A 85 118.833 14.250 -16.527 1.00 0.00 C ATOM 1325 O SER A 85 119.443 13.347 -17.097 1.00 0.00 O ATOM 1326 CB SER A 85 120.846 15.267 -15.455 1.00 0.00 C ATOM 1327 OG SER A 85 121.617 16.457 -15.350 1.00 0.00 O ATOM 0 H SER A 85 118.951 16.512 -14.433 1.00 0.00 H new ATOM 0 HA SER A 85 119.761 16.059 -17.166 1.00 0.00 H new ATOM 0 HB2 SER A 85 120.617 14.879 -14.462 1.00 0.00 H new ATOM 0 HB3 SER A 85 121.414 14.496 -15.975 1.00 0.00 H new ATOM 0 HG SER A 85 122.446 16.268 -14.863 1.00 0.00 H new ATOM 1333 N ASP A 86 117.566 14.122 -16.125 1.00 0.00 N ATOM 1334 CA ASP A 86 116.805 12.884 -16.289 1.00 0.00 C ATOM 1335 C ASP A 86 117.428 11.758 -15.465 1.00 0.00 C ATOM 1336 O ASP A 86 117.504 10.612 -15.907 1.00 0.00 O ATOM 1337 CB ASP A 86 116.718 12.482 -17.766 1.00 0.00 C ATOM 1338 CG ASP A 86 116.053 13.589 -18.580 1.00 0.00 C ATOM 1339 OD1 ASP A 86 115.197 14.272 -18.038 1.00 0.00 O ATOM 1340 OD2 ASP A 86 116.408 13.739 -19.738 1.00 0.00 O ATOM 0 H ASP A 86 117.041 14.873 -15.678 1.00 0.00 H new ATOM 0 HA ASP A 86 115.792 13.061 -15.926 1.00 0.00 H new ATOM 0 HB2 ASP A 86 117.717 12.285 -18.155 1.00 0.00 H new ATOM 0 HB3 ASP A 86 116.149 11.557 -17.865 1.00 0.00 H new ATOM 1345 N ASN A 87 117.856 12.097 -14.253 1.00 0.00 N ATOM 1346 CA ASN A 87 118.371 11.109 -13.312 1.00 0.00 C ATOM 1347 C ASN A 87 117.451 11.046 -12.098 1.00 0.00 C ATOM 1348 O ASN A 87 117.126 12.077 -11.509 1.00 0.00 O ATOM 1349 CB ASN A 87 119.784 11.492 -12.869 1.00 0.00 C ATOM 1350 CG ASN A 87 120.738 11.464 -14.059 1.00 0.00 C ATOM 1351 OD1 ASN A 87 120.479 10.783 -15.052 1.00 0.00 O ATOM 1352 ND2 ASN A 87 121.835 12.169 -14.021 1.00 0.00 N ATOM 0 H ASN A 87 117.856 13.053 -13.898 1.00 0.00 H new ATOM 0 HA ASN A 87 118.407 10.133 -13.797 1.00 0.00 H new ATOM 0 HB2 ASN A 87 119.776 12.487 -12.424 1.00 0.00 H new ATOM 0 HB3 ASN A 87 120.131 10.802 -12.100 1.00 0.00 H new ATOM 0 HD21 ASN A 87 122.477 12.156 -14.813 1.00 0.00 H new ATOM 0 HD22 ASN A 87 122.050 12.733 -13.199 1.00 0.00 H new ATOM 1359 N ALA A 88 117.015 9.842 -11.749 1.00 0.00 N ATOM 1360 CA ALA A 88 116.123 9.671 -10.609 1.00 0.00 C ATOM 1361 C ALA A 88 116.919 9.284 -9.370 1.00 0.00 C ATOM 1362 O ALA A 88 117.646 8.289 -9.375 1.00 0.00 O ATOM 1363 CB ALA A 88 115.089 8.585 -10.912 1.00 0.00 C ATOM 0 H ALA A 88 117.261 8.978 -12.233 1.00 0.00 H new ATOM 0 HA ALA A 88 115.611 10.615 -10.423 1.00 0.00 H new ATOM 0 HB1 ALA A 88 114.427 8.464 -10.055 1.00 0.00 H new ATOM 0 HB2 ALA A 88 114.504 8.873 -11.785 1.00 0.00 H new ATOM 0 HB3 ALA A 88 115.599 7.643 -11.112 1.00 0.00 H new ATOM 1369 N VAL A 89 116.771 10.065 -8.302 1.00 0.00 N ATOM 1370 CA VAL A 89 117.495 9.794 -7.061 1.00 0.00 C ATOM 1371 C VAL A 89 116.569 9.876 -5.849 1.00 0.00 C ATOM 1372 O VAL A 89 115.533 10.540 -5.878 1.00 0.00 O ATOM 1373 CB VAL A 89 118.639 10.796 -6.884 1.00 0.00 C ATOM 1374 CG1 VAL A 89 119.648 10.632 -8.021 1.00 0.00 C ATOM 1375 CG2 VAL A 89 118.082 12.222 -6.898 1.00 0.00 C ATOM 0 H VAL A 89 116.163 10.883 -8.270 1.00 0.00 H new ATOM 0 HA VAL A 89 117.896 8.783 -7.129 1.00 0.00 H new ATOM 0 HB VAL A 89 119.134 10.610 -5.931 1.00 0.00 H new ATOM 0 HG11 VAL A 89 120.461 11.347 -7.892 1.00 0.00 H new ATOM 0 HG12 VAL A 89 120.050 9.619 -8.007 1.00 0.00 H new ATOM 0 HG13 VAL A 89 119.153 10.813 -8.975 1.00 0.00 H new ATOM 0 HG21 VAL A 89 118.899 12.933 -6.772 1.00 0.00 H new ATOM 0 HG22 VAL A 89 117.583 12.408 -7.849 1.00 0.00 H new ATOM 0 HG23 VAL A 89 117.368 12.342 -6.083 1.00 0.00 H new ATOM 1385 N PHE A 90 116.981 9.200 -4.782 1.00 0.00 N ATOM 1386 CA PHE A 90 116.238 9.170 -3.527 1.00 0.00 C ATOM 1387 C PHE A 90 117.038 9.867 -2.428 1.00 0.00 C ATOM 1388 O PHE A 90 118.191 9.529 -2.188 1.00 0.00 O ATOM 1389 CB PHE A 90 115.996 7.708 -3.143 1.00 0.00 C ATOM 1390 CG PHE A 90 115.299 7.502 -1.817 1.00 0.00 C ATOM 1391 CD1 PHE A 90 113.918 7.701 -1.707 1.00 0.00 C ATOM 1392 CD2 PHE A 90 116.037 7.089 -0.702 1.00 0.00 C ATOM 1393 CE1 PHE A 90 113.276 7.487 -0.480 1.00 0.00 C ATOM 1394 CE2 PHE A 90 115.397 6.876 0.523 1.00 0.00 C ATOM 1395 CZ PHE A 90 114.016 7.073 0.633 1.00 0.00 C ATOM 0 H PHE A 90 117.843 8.655 -4.763 1.00 0.00 H new ATOM 0 HA PHE A 90 115.287 9.690 -3.646 1.00 0.00 H new ATOM 0 HB2 PHE A 90 115.402 7.236 -3.926 1.00 0.00 H new ATOM 0 HB3 PHE A 90 116.956 7.192 -3.116 1.00 0.00 H new ATOM 0 HD1 PHE A 90 113.348 8.019 -2.567 1.00 0.00 H new ATOM 0 HD2 PHE A 90 117.102 6.935 -0.788 1.00 0.00 H new ATOM 0 HE1 PHE A 90 112.211 7.642 -0.393 1.00 0.00 H new ATOM 0 HE2 PHE A 90 115.968 6.560 1.383 1.00 0.00 H new ATOM 0 HZ PHE A 90 113.521 6.905 1.578 1.00 0.00 H new ATOM 1405 N VAL A 91 116.424 10.837 -1.760 1.00 0.00 N ATOM 1406 CA VAL A 91 117.090 11.559 -0.678 1.00 0.00 C ATOM 1407 C VAL A 91 116.516 11.106 0.657 1.00 0.00 C ATOM 1408 O VAL A 91 115.300 11.090 0.835 1.00 0.00 O ATOM 1409 CB VAL A 91 116.872 13.070 -0.847 1.00 0.00 C ATOM 1410 CG1 VAL A 91 117.590 13.865 0.254 1.00 0.00 C ATOM 1411 CG2 VAL A 91 117.405 13.512 -2.213 1.00 0.00 C ATOM 0 H VAL A 91 115.469 11.142 -1.947 1.00 0.00 H new ATOM 0 HA VAL A 91 118.159 11.348 -0.707 1.00 0.00 H new ATOM 0 HB VAL A 91 115.803 13.268 -0.774 1.00 0.00 H new ATOM 0 HG11 VAL A 91 117.416 14.931 0.106 1.00 0.00 H new ATOM 0 HG12 VAL A 91 117.204 13.567 1.229 1.00 0.00 H new ATOM 0 HG13 VAL A 91 118.660 13.663 0.210 1.00 0.00 H new ATOM 0 HG21 VAL A 91 117.251 14.584 -2.334 1.00 0.00 H new ATOM 0 HG22 VAL A 91 118.470 13.289 -2.278 1.00 0.00 H new ATOM 0 HG23 VAL A 91 116.874 12.978 -3.001 1.00 0.00 H new ATOM 1421 N ALA A 92 117.388 10.762 1.599 1.00 0.00 N ATOM 1422 CA ALA A 92 116.930 10.333 2.919 1.00 0.00 C ATOM 1423 C ALA A 92 117.044 11.476 3.933 1.00 0.00 C ATOM 1424 O ALA A 92 117.850 12.383 3.736 1.00 0.00 O ATOM 1425 CB ALA A 92 117.764 9.143 3.398 1.00 0.00 C ATOM 0 H ALA A 92 118.401 10.771 1.478 1.00 0.00 H new ATOM 0 HA ALA A 92 115.883 10.039 2.839 1.00 0.00 H new ATOM 0 HB1 ALA A 92 117.417 8.828 4.382 1.00 0.00 H new ATOM 0 HB2 ALA A 92 117.657 8.317 2.695 1.00 0.00 H new ATOM 0 HB3 ALA A 92 118.813 9.434 3.459 1.00 0.00 H new ATOM 1431 N PRO A 93 116.272 11.465 5.001 1.00 0.00 N ATOM 1432 CA PRO A 93 116.351 12.542 6.036 1.00 0.00 C ATOM 1433 C PRO A 93 117.781 12.841 6.482 1.00 0.00 C ATOM 1434 O PRO A 93 118.080 13.954 6.917 1.00 0.00 O ATOM 1435 CB PRO A 93 115.530 12.005 7.212 1.00 0.00 C ATOM 1436 CG PRO A 93 114.585 11.012 6.628 1.00 0.00 C ATOM 1437 CD PRO A 93 115.224 10.480 5.347 1.00 0.00 C ATOM 0 HA PRO A 93 115.976 13.486 5.639 1.00 0.00 H new ATOM 0 HB2 PRO A 93 116.174 11.540 7.958 1.00 0.00 H new ATOM 0 HB3 PRO A 93 114.992 12.810 7.713 1.00 0.00 H new ATOM 0 HG2 PRO A 93 114.398 10.200 7.330 1.00 0.00 H new ATOM 0 HG3 PRO A 93 113.623 11.477 6.414 1.00 0.00 H new ATOM 0 HD2 PRO A 93 115.650 9.489 5.501 1.00 0.00 H new ATOM 0 HD3 PRO A 93 114.488 10.390 4.548 1.00 0.00 H new ATOM 1445 N ASP A 94 118.657 11.851 6.375 1.00 0.00 N ATOM 1446 CA ASP A 94 120.041 12.019 6.812 1.00 0.00 C ATOM 1447 C ASP A 94 120.805 13.066 5.985 1.00 0.00 C ATOM 1448 O ASP A 94 121.901 13.473 6.371 1.00 0.00 O ATOM 1449 CB ASP A 94 120.767 10.666 6.750 1.00 0.00 C ATOM 1450 CG ASP A 94 120.654 10.016 5.366 1.00 0.00 C ATOM 1451 OD1 ASP A 94 120.226 10.679 4.436 1.00 0.00 O ATOM 1452 OD2 ASP A 94 121.009 8.853 5.252 1.00 0.00 O ATOM 0 H ASP A 94 118.439 10.930 5.993 1.00 0.00 H new ATOM 0 HA ASP A 94 120.015 12.387 7.838 1.00 0.00 H new ATOM 0 HB2 ASP A 94 121.819 10.807 6.999 1.00 0.00 H new ATOM 0 HB3 ASP A 94 120.349 9.995 7.501 1.00 0.00 H new ATOM 1457 N GLY A 95 120.242 13.505 4.858 1.00 0.00 N ATOM 1458 CA GLY A 95 120.924 14.460 3.982 1.00 0.00 C ATOM 1459 C GLY A 95 121.802 13.777 2.920 1.00 0.00 C ATOM 1460 O GLY A 95 122.566 14.445 2.225 1.00 0.00 O ATOM 0 H GLY A 95 119.320 13.216 4.531 1.00 0.00 H new ATOM 0 HA2 GLY A 95 120.181 15.084 3.485 1.00 0.00 H new ATOM 0 HA3 GLY A 95 121.543 15.122 4.587 1.00 0.00 H new ATOM 1464 N THR A 96 121.695 12.455 2.796 1.00 0.00 N ATOM 1465 CA THR A 96 122.477 11.697 1.834 1.00 0.00 C ATOM 1466 C THR A 96 121.626 11.410 0.608 1.00 0.00 C ATOM 1467 O THR A 96 120.437 11.111 0.731 1.00 0.00 O ATOM 1468 CB THR A 96 122.919 10.374 2.465 1.00 0.00 C ATOM 1469 OG1 THR A 96 123.628 10.640 3.666 1.00 0.00 O ATOM 1470 CG2 THR A 96 123.817 9.601 1.497 1.00 0.00 C ATOM 0 H THR A 96 121.064 11.885 3.360 1.00 0.00 H new ATOM 0 HA THR A 96 123.355 12.274 1.544 1.00 0.00 H new ATOM 0 HB THR A 96 122.038 9.771 2.685 1.00 0.00 H new ATOM 0 HG1 THR A 96 123.911 9.795 4.073 1.00 0.00 H new ATOM 0 HG21 THR A 96 124.125 8.662 1.957 1.00 0.00 H new ATOM 0 HG22 THR A 96 123.268 9.392 0.579 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.699 10.197 1.264 1.00 0.00 H new ATOM 1478 N THR A 97 122.229 11.503 -0.571 1.00 0.00 N ATOM 1479 CA THR A 97 121.513 11.202 -1.804 1.00 0.00 C ATOM 1480 C THR A 97 121.931 9.835 -2.332 1.00 0.00 C ATOM 1481 O THR A 97 123.119 9.533 -2.449 1.00 0.00 O ATOM 1482 CB THR A 97 121.808 12.273 -2.856 1.00 0.00 C ATOM 1483 OG1 THR A 97 121.515 13.555 -2.318 1.00 0.00 O ATOM 1484 CG2 THR A 97 120.944 12.028 -4.093 1.00 0.00 C ATOM 0 H THR A 97 123.202 11.781 -0.699 1.00 0.00 H new ATOM 0 HA THR A 97 120.443 11.191 -1.594 1.00 0.00 H new ATOM 0 HB THR A 97 122.860 12.227 -3.136 1.00 0.00 H new ATOM 0 HG1 THR A 97 121.705 14.243 -2.990 1.00 0.00 H new ATOM 0 HG21 THR A 97 121.155 12.792 -4.841 1.00 0.00 H new ATOM 0 HG22 THR A 97 121.169 11.044 -4.505 1.00 0.00 H new ATOM 0 HG23 THR A 97 119.891 12.073 -3.816 1.00 0.00 H new ATOM 1492 N TYR A 98 120.935 9.019 -2.648 1.00 0.00 N ATOM 1493 CA TYR A 98 121.162 7.686 -3.185 1.00 0.00 C ATOM 1494 C TYR A 98 120.609 7.619 -4.606 1.00 0.00 C ATOM 1495 O TYR A 98 119.637 8.298 -4.922 1.00 0.00 O ATOM 1496 CB TYR A 98 120.445 6.649 -2.317 1.00 0.00 C ATOM 1497 CG TYR A 98 120.878 6.635 -0.866 1.00 0.00 C ATOM 1498 CD1 TYR A 98 121.941 5.818 -0.457 1.00 0.00 C ATOM 1499 CD2 TYR A 98 120.209 7.429 0.074 1.00 0.00 C ATOM 1500 CE1 TYR A 98 122.331 5.797 0.889 1.00 0.00 C ATOM 1501 CE2 TYR A 98 120.601 7.409 1.418 1.00 0.00 C ATOM 1502 CZ TYR A 98 121.662 6.593 1.828 1.00 0.00 C ATOM 1503 OH TYR A 98 122.049 6.573 3.154 1.00 0.00 O ATOM 0 H TYR A 98 119.950 9.262 -2.540 1.00 0.00 H new ATOM 0 HA TYR A 98 122.231 7.475 -3.191 1.00 0.00 H new ATOM 0 HB2 TYR A 98 119.372 6.837 -2.361 1.00 0.00 H new ATOM 0 HB3 TYR A 98 120.613 5.660 -2.742 1.00 0.00 H new ATOM 0 HD1 TYR A 98 122.460 5.205 -1.179 1.00 0.00 H new ATOM 0 HD2 TYR A 98 119.389 8.058 -0.239 1.00 0.00 H new ATOM 0 HE1 TYR A 98 123.149 5.166 1.203 1.00 0.00 H new ATOM 0 HE2 TYR A 98 120.084 8.024 2.140 1.00 0.00 H new ATOM 0 HH TYR A 98 121.642 7.330 3.625 1.00 0.00 H new ATOM 1513 N ALA A 99 121.221 6.805 -5.458 1.00 0.00 N ATOM 1514 CA ALA A 99 120.773 6.687 -6.843 1.00 0.00 C ATOM 1515 C ALA A 99 119.677 5.634 -6.970 1.00 0.00 C ATOM 1516 O ALA A 99 119.848 4.493 -6.538 1.00 0.00 O ATOM 1517 CB ALA A 99 121.954 6.308 -7.740 1.00 0.00 C ATOM 0 H ALA A 99 122.022 6.221 -5.219 1.00 0.00 H new ATOM 0 HA ALA A 99 120.369 7.650 -7.156 1.00 0.00 H new ATOM 0 HB1 ALA A 99 121.614 6.221 -8.772 1.00 0.00 H new ATOM 0 HB2 ALA A 99 122.722 7.078 -7.675 1.00 0.00 H new ATOM 0 HB3 ALA A 99 122.368 5.354 -7.413 1.00 0.00 H new ATOM 1523 N LEU A 100 118.552 6.019 -7.566 1.00 0.00 N ATOM 1524 CA LEU A 100 117.452 5.086 -7.774 1.00 0.00 C ATOM 1525 C LEU A 100 117.662 4.304 -9.062 1.00 0.00 C ATOM 1526 O LEU A 100 117.584 3.076 -9.077 1.00 0.00 O ATOM 1527 CB LEU A 100 116.119 5.832 -7.864 1.00 0.00 C ATOM 1528 CG LEU A 100 115.661 6.267 -6.473 1.00 0.00 C ATOM 1529 CD1 LEU A 100 114.642 7.400 -6.614 1.00 0.00 C ATOM 1530 CD2 LEU A 100 115.000 5.079 -5.769 1.00 0.00 C ATOM 0 H LEU A 100 118.380 6.963 -7.911 1.00 0.00 H new ATOM 0 HA LEU A 100 117.428 4.403 -6.925 1.00 0.00 H new ATOM 0 HB2 LEU A 100 116.225 6.704 -8.509 1.00 0.00 H new ATOM 0 HB3 LEU A 100 115.365 5.190 -8.319 1.00 0.00 H new ATOM 0 HG LEU A 100 116.516 6.610 -5.891 1.00 0.00 H new ATOM 0 HD11 LEU A 100 114.310 7.716 -5.625 1.00 0.00 H new ATOM 0 HD12 LEU A 100 115.104 8.243 -7.128 1.00 0.00 H new ATOM 0 HD13 LEU A 100 113.785 7.049 -7.189 1.00 0.00 H new ATOM 0 HD21 LEU A 100 114.671 5.382 -4.775 1.00 0.00 H new ATOM 0 HD22 LEU A 100 114.141 4.744 -6.350 1.00 0.00 H new ATOM 0 HD23 LEU A 100 115.718 4.263 -5.680 1.00 0.00 H new ATOM 1542 N ASN A 101 117.932 5.029 -10.146 1.00 0.00 N ATOM 1543 CA ASN A 101 118.085 4.397 -11.459 1.00 0.00 C ATOM 1544 C ASN A 101 119.553 4.313 -11.878 1.00 0.00 C ATOM 1545 O ASN A 101 120.429 4.941 -11.280 1.00 0.00 O ATOM 1546 CB ASN A 101 117.254 5.143 -12.512 1.00 0.00 C ATOM 1547 CG ASN A 101 117.828 6.525 -12.814 1.00 0.00 C ATOM 1548 OD1 ASN A 101 118.836 6.928 -12.238 1.00 0.00 O ATOM 1549 ND2 ASN A 101 117.236 7.281 -13.698 1.00 0.00 N ATOM 0 H ASN A 101 118.049 6.042 -10.145 1.00 0.00 H new ATOM 0 HA ASN A 101 117.713 3.375 -11.383 1.00 0.00 H new ATOM 0 HB2 ASN A 101 117.219 4.556 -13.430 1.00 0.00 H new ATOM 0 HB3 ASN A 101 116.228 5.245 -12.159 1.00 0.00 H new ATOM 0 HD21 ASN A 101 117.610 8.206 -13.911 1.00 0.00 H new ATOM 0 HD22 ASN A 101 116.399 6.947 -14.176 1.00 0.00 H new ATOM 1556 N ASP A 102 119.811 3.535 -12.922 1.00 0.00 N ATOM 1557 CA ASP A 102 121.181 3.232 -13.321 1.00 0.00 C ATOM 1558 C ASP A 102 121.990 4.496 -13.599 1.00 0.00 C ATOM 1559 O ASP A 102 123.170 4.562 -13.259 1.00 0.00 O ATOM 1560 CB ASP A 102 121.174 2.338 -14.566 1.00 0.00 C ATOM 1561 CG ASP A 102 120.557 3.068 -15.757 1.00 0.00 C ATOM 1562 OD1 ASP A 102 119.705 3.915 -15.541 1.00 0.00 O ATOM 1563 OD2 ASP A 102 120.948 2.768 -16.874 1.00 0.00 O ATOM 0 H ASP A 102 119.094 3.104 -13.506 1.00 0.00 H new ATOM 0 HA ASP A 102 121.657 2.711 -12.491 1.00 0.00 H new ATOM 0 HB2 ASP A 102 122.193 2.036 -14.808 1.00 0.00 H new ATOM 0 HB3 ASP A 102 120.612 1.427 -14.361 1.00 0.00 H new ATOM 1568 N ARG A 103 121.361 5.497 -14.208 1.00 0.00 N ATOM 1569 CA ARG A 103 122.079 6.711 -14.586 1.00 0.00 C ATOM 1570 C ARG A 103 122.587 7.467 -13.360 1.00 0.00 C ATOM 1571 O ARG A 103 123.724 7.939 -13.339 1.00 0.00 O ATOM 1572 CB ARG A 103 121.175 7.597 -15.447 1.00 0.00 C ATOM 1573 CG ARG A 103 120.942 6.893 -16.787 1.00 0.00 C ATOM 1574 CD ARG A 103 120.127 7.789 -17.719 1.00 0.00 C ATOM 1575 NE ARG A 103 118.835 8.112 -17.108 1.00 0.00 N ATOM 1576 CZ ARG A 103 117.847 7.221 -16.953 1.00 0.00 C ATOM 1577 NH1 ARG A 103 117.965 5.968 -17.322 1.00 0.00 N ATOM 1578 NH2 ARG A 103 116.731 7.622 -16.413 1.00 0.00 N ATOM 0 H ARG A 103 120.370 5.494 -14.448 1.00 0.00 H new ATOM 0 HA ARG A 103 122.955 6.428 -15.169 1.00 0.00 H new ATOM 0 HB2 ARG A 103 120.226 7.774 -14.942 1.00 0.00 H new ATOM 0 HB3 ARG A 103 121.638 8.571 -15.606 1.00 0.00 H new ATOM 0 HG2 ARG A 103 121.899 6.649 -17.249 1.00 0.00 H new ATOM 0 HG3 ARG A 103 120.417 5.951 -16.625 1.00 0.00 H new ATOM 0 HD2 ARG A 103 120.678 8.706 -17.928 1.00 0.00 H new ATOM 0 HD3 ARG A 103 119.971 7.287 -18.674 1.00 0.00 H new ATOM 0 HE ARG A 103 118.680 9.066 -16.783 1.00 0.00 H new ATOM 0 HH11 ARG A 103 118.834 5.640 -17.745 1.00 0.00 H new ATOM 0 HH12 ARG A 103 117.188 5.321 -17.186 1.00 0.00 H new ATOM 0 HH21 ARG A 103 116.626 8.593 -16.120 1.00 0.00 H new ATOM 0 HH22 ARG A 103 115.962 6.964 -16.283 1.00 0.00 H new ATOM 1592 N ALA A 104 121.761 7.556 -12.323 1.00 0.00 N ATOM 1593 CA ALA A 104 122.192 8.177 -11.073 1.00 0.00 C ATOM 1594 C ALA A 104 123.378 7.422 -10.472 1.00 0.00 C ATOM 1595 O ALA A 104 124.297 8.028 -9.916 1.00 0.00 O ATOM 1596 CB ALA A 104 121.033 8.195 -10.075 1.00 0.00 C ATOM 0 H ALA A 104 120.801 7.211 -12.320 1.00 0.00 H new ATOM 0 HA ALA A 104 122.504 9.199 -11.287 1.00 0.00 H new ATOM 0 HB1 ALA A 104 121.361 8.659 -9.145 1.00 0.00 H new ATOM 0 HB2 ALA A 104 120.203 8.765 -10.492 1.00 0.00 H new ATOM 0 HB3 ALA A 104 120.708 7.174 -9.876 1.00 0.00 H new ATOM 1602 N GLU A 105 123.361 6.096 -10.585 1.00 0.00 N ATOM 1603 CA GLU A 105 124.426 5.279 -10.013 1.00 0.00 C ATOM 1604 C GLU A 105 125.756 5.557 -10.706 1.00 0.00 C ATOM 1605 O GLU A 105 126.750 5.882 -10.056 1.00 0.00 O ATOM 1606 CB GLU A 105 124.076 3.796 -10.145 1.00 0.00 C ATOM 1607 CG GLU A 105 125.075 2.963 -9.333 1.00 0.00 C ATOM 1608 CD GLU A 105 124.837 1.458 -9.498 1.00 0.00 C ATOM 1609 OE1 GLU A 105 123.944 1.070 -10.237 1.00 0.00 O ATOM 1610 OE2 GLU A 105 125.565 0.705 -8.873 1.00 0.00 O ATOM 0 H GLU A 105 122.629 5.570 -11.062 1.00 0.00 H new ATOM 0 HA GLU A 105 124.524 5.536 -8.958 1.00 0.00 H new ATOM 0 HB2 GLU A 105 123.062 3.617 -9.788 1.00 0.00 H new ATOM 0 HB3 GLU A 105 124.103 3.497 -11.193 1.00 0.00 H new ATOM 0 HG2 GLU A 105 126.090 3.206 -9.648 1.00 0.00 H new ATOM 0 HG3 GLU A 105 124.996 3.229 -8.279 1.00 0.00 H new ATOM 1617 N LYS A 106 125.764 5.478 -12.033 1.00 0.00 N ATOM 1618 CA LYS A 106 126.989 5.744 -12.794 1.00 0.00 C ATOM 1619 C LYS A 106 127.462 7.200 -12.657 1.00 0.00 C ATOM 1620 O LYS A 106 128.630 7.497 -12.908 1.00 0.00 O ATOM 1621 CB LYS A 106 126.809 5.358 -14.269 1.00 0.00 C ATOM 1622 CG LYS A 106 125.823 6.300 -14.965 1.00 0.00 C ATOM 1623 CD LYS A 106 125.591 5.826 -16.401 1.00 0.00 C ATOM 1624 CE LYS A 106 124.870 6.918 -17.191 1.00 0.00 C ATOM 1625 NZ LYS A 106 125.868 7.895 -17.712 1.00 0.00 N ATOM 0 H LYS A 106 124.952 5.236 -12.600 1.00 0.00 H new ATOM 0 HA LYS A 106 127.772 5.119 -12.366 1.00 0.00 H new ATOM 0 HB2 LYS A 106 127.772 5.393 -14.778 1.00 0.00 H new ATOM 0 HB3 LYS A 106 126.448 4.332 -14.339 1.00 0.00 H new ATOM 0 HG2 LYS A 106 124.879 6.322 -14.421 1.00 0.00 H new ATOM 0 HG3 LYS A 106 126.214 7.317 -14.965 1.00 0.00 H new ATOM 0 HD2 LYS A 106 126.544 5.589 -16.875 1.00 0.00 H new ATOM 0 HD3 LYS A 106 124.998 4.911 -16.401 1.00 0.00 H new ATOM 0 HE2 LYS A 106 124.312 6.476 -18.017 1.00 0.00 H new ATOM 0 HE3 LYS A 106 124.147 7.426 -16.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 125.378 8.638 -18.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 126.381 8.325 -16.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 126.542 7.405 -18.334 1.00 0.00 H new ATOM 1639 N ALA A 107 126.563 8.103 -12.264 1.00 0.00 N ATOM 1640 CA ALA A 107 126.931 9.492 -11.982 1.00 0.00 C ATOM 1641 C ALA A 107 127.604 9.665 -10.610 1.00 0.00 C ATOM 1642 O ALA A 107 127.803 10.792 -10.159 1.00 0.00 O ATOM 1643 CB ALA A 107 125.683 10.374 -12.042 1.00 0.00 C ATOM 0 H ALA A 107 125.573 7.897 -12.133 1.00 0.00 H new ATOM 0 HA ALA A 107 127.655 9.790 -12.741 1.00 0.00 H new ATOM 0 HB1 ALA A 107 125.958 11.408 -11.832 1.00 0.00 H new ATOM 0 HB2 ALA A 107 125.240 10.311 -13.036 1.00 0.00 H new ATOM 0 HB3 ALA A 107 124.960 10.033 -11.301 1.00 0.00 H new ATOM 1649 N GLY A 108 127.953 8.561 -9.948 1.00 0.00 N ATOM 1650 CA GLY A 108 128.681 8.620 -8.684 1.00 0.00 C ATOM 1651 C GLY A 108 127.792 8.943 -7.485 1.00 0.00 C ATOM 1652 O GLY A 108 128.277 9.444 -6.470 1.00 0.00 O ATOM 0 H GLY A 108 127.742 7.616 -10.268 1.00 0.00 H new ATOM 0 HA2 GLY A 108 129.175 7.664 -8.513 1.00 0.00 H new ATOM 0 HA3 GLY A 108 129.464 9.374 -8.760 1.00 0.00 H new ATOM 1656 N HIS A 109 126.494 8.662 -7.594 1.00 0.00 N ATOM 1657 CA HIS A 109 125.619 8.720 -6.430 1.00 0.00 C ATOM 1658 C HIS A 109 125.462 7.304 -5.858 1.00 0.00 C ATOM 1659 O HIS A 109 124.863 6.461 -6.528 1.00 0.00 O ATOM 1660 CB HIS A 109 124.245 9.249 -6.846 1.00 0.00 C ATOM 1661 CG HIS A 109 124.221 10.735 -7.084 1.00 0.00 C ATOM 1662 ND1 HIS A 109 124.616 11.645 -6.116 1.00 0.00 N ATOM 1663 CD2 HIS A 109 123.852 11.485 -8.174 1.00 0.00 C ATOM 1664 CE1 HIS A 109 124.476 12.877 -6.637 1.00 0.00 C ATOM 1665 NE2 HIS A 109 124.014 12.838 -7.888 1.00 0.00 N ATOM 0 H HIS A 109 126.033 8.396 -8.464 1.00 0.00 H new ATOM 0 HA HIS A 109 126.049 9.383 -5.679 1.00 0.00 H new ATOM 0 HB2 HIS A 109 123.928 8.738 -7.755 1.00 0.00 H new ATOM 0 HB3 HIS A 109 123.519 9.001 -6.071 1.00 0.00 H new ATOM 0 HD2 HIS A 109 123.491 11.086 -9.110 1.00 0.00 H new ATOM 0 HE1 HIS A 109 124.709 13.788 -6.106 1.00 0.00 H new ATOM 0 HE2 HIS A 109 123.821 13.629 -8.502 1.00 0.00 H new ATOM 1673 N PRO A 110 125.959 6.999 -4.671 1.00 0.00 N ATOM 1674 CA PRO A 110 125.907 5.595 -4.148 1.00 0.00 C ATOM 1675 C PRO A 110 124.482 5.039 -4.161 1.00 0.00 C ATOM 1676 O PRO A 110 123.531 5.814 -4.093 1.00 0.00 O ATOM 1677 CB PRO A 110 126.438 5.694 -2.715 1.00 0.00 C ATOM 1678 CG PRO A 110 127.248 6.943 -2.681 1.00 0.00 C ATOM 1679 CD PRO A 110 126.611 7.892 -3.692 1.00 0.00 C ATOM 0 HA PRO A 110 126.494 4.915 -4.765 1.00 0.00 H new ATOM 0 HB2 PRO A 110 125.621 5.736 -1.995 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.044 4.825 -2.459 1.00 0.00 H new ATOM 0 HG2 PRO A 110 127.247 7.380 -1.683 1.00 0.00 H new ATOM 0 HG3 PRO A 110 128.287 6.740 -2.939 1.00 0.00 H new ATOM 0 HD2 PRO A 110 125.889 8.554 -3.215 1.00 0.00 H new ATOM 0 HD3 PRO A 110 127.359 8.526 -4.168 1.00 0.00 H new ATOM 1687 N PRO A 111 124.300 3.739 -4.267 1.00 0.00 N ATOM 1688 CA PRO A 111 122.929 3.147 -4.350 1.00 0.00 C ATOM 1689 C PRO A 111 122.234 3.074 -2.992 1.00 0.00 C ATOM 1690 O PRO A 111 122.885 3.100 -1.948 1.00 0.00 O ATOM 1691 CB PRO A 111 123.164 1.751 -4.926 1.00 0.00 C ATOM 1692 CG PRO A 111 124.555 1.382 -4.537 1.00 0.00 C ATOM 1693 CD PRO A 111 125.332 2.683 -4.324 1.00 0.00 C ATOM 0 HA PRO A 111 122.265 3.757 -4.963 1.00 0.00 H new ATOM 0 HB2 PRO A 111 122.444 1.037 -4.527 1.00 0.00 H new ATOM 0 HB3 PRO A 111 123.047 1.750 -6.010 1.00 0.00 H new ATOM 0 HG2 PRO A 111 124.553 0.783 -3.626 1.00 0.00 H new ATOM 0 HG3 PRO A 111 125.023 0.778 -5.314 1.00 0.00 H new ATOM 0 HD2 PRO A 111 125.914 2.649 -3.403 1.00 0.00 H new ATOM 0 HD3 PRO A 111 126.035 2.861 -5.138 1.00 0.00 H new ATOM 1701 N ILE A 112 120.905 2.980 -3.017 1.00 0.00 N ATOM 1702 CA ILE A 112 120.121 2.876 -1.785 1.00 0.00 C ATOM 1703 C ILE A 112 120.473 1.616 -0.973 1.00 0.00 C ATOM 1704 O ILE A 112 120.082 1.532 0.190 1.00 0.00 O ATOM 1705 CB ILE A 112 118.613 2.908 -2.118 1.00 0.00 C ATOM 1706 CG1 ILE A 112 118.286 4.244 -2.794 1.00 0.00 C ATOM 1707 CG2 ILE A 112 117.764 2.784 -0.841 1.00 0.00 C ATOM 1708 CD1 ILE A 112 116.846 4.247 -3.320 1.00 0.00 C ATOM 0 H ILE A 112 120.350 2.974 -3.873 1.00 0.00 H new ATOM 0 HA ILE A 112 120.371 3.733 -1.160 1.00 0.00 H new ATOM 0 HB ILE A 112 118.383 2.070 -2.776 1.00 0.00 H new ATOM 0 HG12 ILE A 112 118.421 5.059 -2.083 1.00 0.00 H new ATOM 0 HG13 ILE A 112 118.979 4.420 -3.616 1.00 0.00 H new ATOM 0 HG21 ILE A 112 116.706 2.809 -1.103 1.00 0.00 H new ATOM 0 HG22 ILE A 112 117.992 1.842 -0.343 1.00 0.00 H new ATOM 0 HG23 ILE A 112 117.991 3.613 -0.171 1.00 0.00 H new ATOM 0 HD11 ILE A 112 116.635 5.204 -3.796 1.00 0.00 H new ATOM 0 HD12 ILE A 112 116.723 3.445 -4.048 1.00 0.00 H new ATOM 0 HD13 ILE A 112 116.155 4.094 -2.491 1.00 0.00 H new ATOM 1720 N THR A 113 121.243 0.678 -1.539 1.00 0.00 N ATOM 1721 CA THR A 113 121.487 -0.617 -0.898 1.00 0.00 C ATOM 1722 C THR A 113 121.755 -0.570 0.617 1.00 0.00 C ATOM 1723 O THR A 113 121.171 -1.394 1.324 1.00 0.00 O ATOM 1724 CB THR A 113 122.571 -1.415 -1.649 1.00 0.00 C ATOM 1725 OG1 THR A 113 122.419 -2.792 -1.340 1.00 0.00 O ATOM 1726 CG2 THR A 113 123.999 -0.987 -1.285 1.00 0.00 C ATOM 0 H THR A 113 121.707 0.793 -2.440 1.00 0.00 H new ATOM 0 HA THR A 113 120.538 -1.147 -0.978 1.00 0.00 H new ATOM 0 HB THR A 113 122.435 -1.219 -2.713 1.00 0.00 H new ATOM 0 HG1 THR A 113 123.102 -3.311 -1.813 1.00 0.00 H new ATOM 0 HG21 THR A 113 124.713 -1.587 -1.848 1.00 0.00 H new ATOM 0 HG22 THR A 113 124.137 0.066 -1.530 1.00 0.00 H new ATOM 0 HG23 THR A 113 124.162 -1.135 -0.218 1.00 0.00 H new ATOM 1734 N PRO A 114 122.526 0.357 1.165 1.00 0.00 N ATOM 1735 CA PRO A 114 122.889 0.289 2.618 1.00 0.00 C ATOM 1736 C PRO A 114 121.668 0.381 3.534 1.00 0.00 C ATOM 1737 O PRO A 114 121.665 -0.180 4.629 1.00 0.00 O ATOM 1738 CB PRO A 114 123.844 1.470 2.845 1.00 0.00 C ATOM 1739 CG PRO A 114 124.263 1.910 1.486 1.00 0.00 C ATOM 1740 CD PRO A 114 123.088 1.584 0.571 1.00 0.00 C ATOM 0 HA PRO A 114 123.348 -0.669 2.862 1.00 0.00 H new ATOM 0 HB2 PRO A 114 123.348 2.278 3.383 1.00 0.00 H new ATOM 0 HB3 PRO A 114 124.704 1.170 3.443 1.00 0.00 H new ATOM 0 HG2 PRO A 114 124.488 2.976 1.471 1.00 0.00 H new ATOM 0 HG3 PRO A 114 125.166 1.389 1.166 1.00 0.00 H new ATOM 0 HD2 PRO A 114 122.357 2.393 0.551 1.00 0.00 H new ATOM 0 HD3 PRO A 114 123.412 1.422 -0.457 1.00 0.00 H new ATOM 1748 N ILE A 115 120.633 1.088 3.086 1.00 0.00 N ATOM 1749 CA ILE A 115 119.419 1.257 3.892 1.00 0.00 C ATOM 1750 C ILE A 115 118.290 0.299 3.499 1.00 0.00 C ATOM 1751 O ILE A 115 117.192 0.416 4.038 1.00 0.00 O ATOM 1752 CB ILE A 115 118.893 2.703 3.825 1.00 0.00 C ATOM 1753 CG1 ILE A 115 118.827 3.202 2.373 1.00 0.00 C ATOM 1754 CG2 ILE A 115 119.798 3.622 4.648 1.00 0.00 C ATOM 1755 CD1 ILE A 115 118.064 4.532 2.293 1.00 0.00 C ATOM 0 H ILE A 115 120.607 1.551 2.177 1.00 0.00 H new ATOM 0 HA ILE A 115 119.720 1.019 4.912 1.00 0.00 H new ATOM 0 HB ILE A 115 117.884 2.718 4.237 1.00 0.00 H new ATOM 0 HG12 ILE A 115 119.836 3.331 1.981 1.00 0.00 H new ATOM 0 HG13 ILE A 115 118.335 2.456 1.748 1.00 0.00 H new ATOM 0 HG21 ILE A 115 119.422 4.644 4.597 1.00 0.00 H new ATOM 0 HG22 ILE A 115 119.807 3.290 5.686 1.00 0.00 H new ATOM 0 HG23 ILE A 115 120.811 3.588 4.248 1.00 0.00 H new ATOM 0 HD11 ILE A 115 118.028 4.869 1.257 1.00 0.00 H new ATOM 0 HD12 ILE A 115 117.049 4.392 2.665 1.00 0.00 H new ATOM 0 HD13 ILE A 115 118.573 5.280 2.901 1.00 0.00 H new ATOM 1767 N ARG A 116 118.532 -0.639 2.580 1.00 0.00 N ATOM 1768 CA ARG A 116 117.492 -1.589 2.188 1.00 0.00 C ATOM 1769 C ARG A 116 117.303 -2.651 3.266 1.00 0.00 C ATOM 1770 O ARG A 116 118.267 -3.087 3.896 1.00 0.00 O ATOM 1771 CB ARG A 116 117.851 -2.265 0.862 1.00 0.00 C ATOM 1772 CG ARG A 116 117.838 -1.228 -0.263 1.00 0.00 C ATOM 1773 CD ARG A 116 118.136 -1.915 -1.598 1.00 0.00 C ATOM 1774 NE ARG A 116 117.014 -2.766 -2.004 1.00 0.00 N ATOM 1775 CZ ARG A 116 117.049 -3.572 -3.077 1.00 0.00 C ATOM 1776 NH1 ARG A 116 118.108 -3.669 -3.845 1.00 0.00 N ATOM 1777 NH2 ARG A 116 115.995 -4.283 -3.367 1.00 0.00 N ATOM 0 H ARG A 116 119.424 -0.759 2.101 1.00 0.00 H new ATOM 0 HA ARG A 116 116.561 -1.036 2.065 1.00 0.00 H new ATOM 0 HB2 ARG A 116 118.836 -2.727 0.933 1.00 0.00 H new ATOM 0 HB3 ARG A 116 117.140 -3.062 0.644 1.00 0.00 H new ATOM 0 HG2 ARG A 116 116.867 -0.735 -0.305 1.00 0.00 H new ATOM 0 HG3 ARG A 116 118.580 -0.454 -0.067 1.00 0.00 H new ATOM 0 HD2 ARG A 116 118.325 -1.164 -2.365 1.00 0.00 H new ATOM 0 HD3 ARG A 116 119.041 -2.516 -1.510 1.00 0.00 H new ATOM 0 HE ARG A 116 116.163 -2.745 -1.442 1.00 0.00 H new ATOM 0 HH11 ARG A 116 118.942 -3.121 -3.635 1.00 0.00 H new ATOM 0 HH12 ARG A 116 118.097 -4.293 -4.652 1.00 0.00 H new ATOM 0 HH21 ARG A 116 115.162 -4.221 -2.782 1.00 0.00 H new ATOM 0 HH22 ARG A 116 116.004 -4.901 -4.179 1.00 0.00 H new ATOM 1791 N ALA A 117 116.056 -3.065 3.477 1.00 0.00 N ATOM 1792 CA ALA A 117 115.754 -4.067 4.491 1.00 0.00 C ATOM 1793 C ALA A 117 115.893 -5.477 3.928 1.00 0.00 C ATOM 1794 O ALA A 117 115.481 -5.751 2.801 1.00 0.00 O ATOM 1795 CB ALA A 117 114.325 -3.872 4.996 1.00 0.00 C ATOM 0 H ALA A 117 115.244 -2.724 2.962 1.00 0.00 H new ATOM 0 HA ALA A 117 116.463 -3.945 5.310 1.00 0.00 H new ATOM 0 HB1 ALA A 117 114.101 -4.623 5.754 1.00 0.00 H new ATOM 0 HB2 ALA A 117 114.225 -2.877 5.430 1.00 0.00 H new ATOM 0 HB3 ALA A 117 113.628 -3.977 4.165 1.00 0.00 H new ATOM 1801 N LYS A 118 116.476 -6.370 4.720 1.00 0.00 N ATOM 1802 CA LYS A 118 116.575 -7.770 4.327 1.00 0.00 C ATOM 1803 C LYS A 118 115.380 -8.545 4.871 1.00 0.00 C ATOM 1804 O LYS A 118 114.949 -8.322 6.002 1.00 0.00 O ATOM 1805 CB LYS A 118 117.873 -8.376 4.865 1.00 0.00 C ATOM 1806 CG LYS A 118 118.052 -9.788 4.302 1.00 0.00 C ATOM 1807 CD LYS A 118 119.307 -10.423 4.904 1.00 0.00 C ATOM 1808 CE LYS A 118 119.575 -11.768 4.226 1.00 0.00 C ATOM 1809 NZ LYS A 118 120.856 -12.334 4.732 1.00 0.00 N ATOM 0 H LYS A 118 116.884 -6.152 5.629 1.00 0.00 H new ATOM 0 HA LYS A 118 116.579 -7.833 3.239 1.00 0.00 H new ATOM 0 HB2 LYS A 118 118.721 -7.752 4.585 1.00 0.00 H new ATOM 0 HB3 LYS A 118 117.847 -8.408 5.954 1.00 0.00 H new ATOM 0 HG2 LYS A 118 117.177 -10.396 4.533 1.00 0.00 H new ATOM 0 HG3 LYS A 118 118.136 -9.750 3.216 1.00 0.00 H new ATOM 0 HD2 LYS A 118 120.162 -9.760 4.771 1.00 0.00 H new ATOM 0 HD3 LYS A 118 119.177 -10.564 5.977 1.00 0.00 H new ATOM 0 HE2 LYS A 118 118.756 -12.458 4.427 1.00 0.00 H new ATOM 0 HE3 LYS A 118 119.624 -11.639 3.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 121.038 -13.248 4.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 121.634 -11.678 4.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 120.792 -12.472 5.761 1.00 0.00 H new ATOM 1823 N GLY A 119 114.846 -9.457 4.064 1.00 0.00 N ATOM 1824 CA GLY A 119 113.684 -10.239 4.476 1.00 0.00 C ATOM 1825 C GLY A 119 114.080 -11.649 4.898 1.00 0.00 C ATOM 1826 O GLY A 119 115.218 -12.073 4.691 1.00 0.00 O ATOM 0 H GLY A 119 115.195 -9.672 3.130 1.00 0.00 H new ATOM 0 HA2 GLY A 119 113.182 -9.738 5.304 1.00 0.00 H new ATOM 0 HA3 GLY A 119 112.970 -10.291 3.654 1.00 0.00 H new ATOM 1830 N SER A 120 113.135 -12.372 5.493 1.00 0.00 N ATOM 1831 CA SER A 120 113.389 -13.750 5.901 1.00 0.00 C ATOM 1832 C SER A 120 113.799 -14.601 4.702 1.00 0.00 C ATOM 1833 O SER A 120 114.677 -15.458 4.809 1.00 0.00 O ATOM 1834 CB SER A 120 112.135 -14.342 6.544 1.00 0.00 C ATOM 1835 OG SER A 120 112.448 -15.615 7.092 1.00 0.00 O ATOM 0 H SER A 120 112.196 -12.031 5.702 1.00 0.00 H new ATOM 0 HA SER A 120 114.204 -13.749 6.625 1.00 0.00 H new ATOM 0 HB2 SER A 120 111.764 -13.678 7.325 1.00 0.00 H new ATOM 0 HB3 SER A 120 111.342 -14.437 5.803 1.00 0.00 H new ATOM 0 HG SER A 120 111.647 -15.998 7.507 1.00 0.00 H new ATOM 1841 N GLY A 121 113.159 -14.362 3.560 1.00 0.00 N ATOM 1842 CA GLY A 121 113.491 -15.085 2.339 1.00 0.00 C ATOM 1843 C GLY A 121 113.433 -14.158 1.131 1.00 0.00 C ATOM 1844 O GLY A 121 112.892 -13.054 1.209 1.00 0.00 O ATOM 0 H GLY A 121 112.411 -13.676 3.456 1.00 0.00 H new ATOM 0 HA2 GLY A 121 114.489 -15.516 2.425 1.00 0.00 H new ATOM 0 HA3 GLY A 121 112.797 -15.914 2.201 1.00 0.00 H new ATOM 1848 N GLY A 122 113.993 -14.610 0.015 1.00 0.00 N ATOM 1849 CA GLY A 122 113.995 -13.810 -1.207 1.00 0.00 C ATOM 1850 C GLY A 122 115.029 -12.684 -1.159 1.00 0.00 C ATOM 1851 O GLY A 122 114.845 -11.642 -1.789 1.00 0.00 O ATOM 0 H GLY A 122 114.448 -15.519 -0.071 1.00 0.00 H new ATOM 0 HA2 GLY A 122 114.202 -14.455 -2.061 1.00 0.00 H new ATOM 0 HA3 GLY A 122 113.004 -13.384 -1.362 1.00 0.00 H new ATOM 1855 N GLY A 123 116.114 -12.887 -0.414 1.00 0.00 N ATOM 1856 CA GLY A 123 117.178 -11.892 -0.341 1.00 0.00 C ATOM 1857 C GLY A 123 116.678 -10.582 0.261 1.00 0.00 C ATOM 1858 O GLY A 123 116.187 -10.546 1.389 1.00 0.00 O ATOM 0 H GLY A 123 116.278 -13.726 0.143 1.00 0.00 H new ATOM 0 HA2 GLY A 123 118.000 -12.280 0.261 1.00 0.00 H new ATOM 0 HA3 GLY A 123 117.574 -11.707 -1.340 1.00 0.00 H new ATOM 1862 N TYR A 124 116.808 -9.502 -0.503 1.00 0.00 N ATOM 1863 CA TYR A 124 116.417 -8.178 -0.025 1.00 0.00 C ATOM 1864 C TYR A 124 115.114 -7.726 -0.674 1.00 0.00 C ATOM 1865 O TYR A 124 114.761 -8.172 -1.767 1.00 0.00 O ATOM 1866 CB TYR A 124 117.526 -7.172 -0.331 1.00 0.00 C ATOM 1867 CG TYR A 124 118.668 -7.231 0.654 1.00 0.00 C ATOM 1868 CD1 TYR A 124 119.257 -8.461 0.969 1.00 0.00 C ATOM 1869 CD2 TYR A 124 119.143 -6.056 1.250 1.00 0.00 C ATOM 1870 CE1 TYR A 124 120.321 -8.517 1.878 1.00 0.00 C ATOM 1871 CE2 TYR A 124 120.205 -6.111 2.159 1.00 0.00 C ATOM 1872 CZ TYR A 124 120.794 -7.342 2.474 1.00 0.00 C ATOM 1873 OH TYR A 124 121.842 -7.397 3.370 1.00 0.00 O ATOM 0 H TYR A 124 117.180 -9.516 -1.453 1.00 0.00 H new ATOM 0 HA TYR A 124 116.261 -8.233 1.052 1.00 0.00 H new ATOM 0 HB2 TYR A 124 117.910 -7.357 -1.334 1.00 0.00 H new ATOM 0 HB3 TYR A 124 117.106 -6.166 -0.331 1.00 0.00 H new ATOM 0 HD1 TYR A 124 118.891 -9.368 0.511 1.00 0.00 H new ATOM 0 HD2 TYR A 124 118.689 -5.107 1.008 1.00 0.00 H new ATOM 0 HE1 TYR A 124 120.776 -9.466 2.119 1.00 0.00 H new ATOM 0 HE2 TYR A 124 120.571 -5.204 2.618 1.00 0.00 H new ATOM 0 HH TYR A 124 122.047 -6.494 3.690 1.00 0.00 H new ATOM 1883 N ILE A 125 114.404 -6.837 0.012 1.00 0.00 N ATOM 1884 CA ILE A 125 113.110 -6.363 -0.463 1.00 0.00 C ATOM 1885 C ILE A 125 113.304 -5.388 -1.625 1.00 0.00 C ATOM 1886 O ILE A 125 114.084 -4.440 -1.533 1.00 0.00 O ATOM 1887 CB ILE A 125 112.363 -5.706 0.708 1.00 0.00 C ATOM 1888 CG1 ILE A 125 112.110 -6.756 1.800 1.00 0.00 C ATOM 1889 CG2 ILE A 125 111.013 -5.142 0.248 1.00 0.00 C ATOM 1890 CD1 ILE A 125 111.929 -6.071 3.157 1.00 0.00 C ATOM 0 H ILE A 125 114.703 -6.430 0.898 1.00 0.00 H new ATOM 0 HA ILE A 125 112.514 -7.197 -0.833 1.00 0.00 H new ATOM 0 HB ILE A 125 112.976 -4.891 1.093 1.00 0.00 H new ATOM 0 HG12 ILE A 125 111.221 -7.338 1.556 1.00 0.00 H new ATOM 0 HG13 ILE A 125 112.946 -7.454 1.845 1.00 0.00 H new ATOM 0 HG21 ILE A 125 110.503 -4.682 1.095 1.00 0.00 H new ATOM 0 HG22 ILE A 125 111.177 -4.393 -0.527 1.00 0.00 H new ATOM 0 HG23 ILE A 125 110.398 -5.949 -0.151 1.00 0.00 H new ATOM 0 HD11 ILE A 125 111.750 -6.825 3.924 1.00 0.00 H new ATOM 0 HD12 ILE A 125 112.830 -5.509 3.404 1.00 0.00 H new ATOM 0 HD13 ILE A 125 111.078 -5.391 3.111 1.00 0.00 H new ATOM 1902 N SER A 126 112.576 -5.633 -2.711 1.00 0.00 N ATOM 1903 CA SER A 126 112.728 -4.848 -3.932 1.00 0.00 C ATOM 1904 C SER A 126 112.352 -3.387 -3.722 1.00 0.00 C ATOM 1905 O SER A 126 111.392 -3.068 -3.024 1.00 0.00 O ATOM 1906 CB SER A 126 111.846 -5.440 -5.032 1.00 0.00 C ATOM 1907 OG SER A 126 112.224 -6.792 -5.257 1.00 0.00 O ATOM 0 H SER A 126 111.874 -6.370 -2.770 1.00 0.00 H new ATOM 0 HA SER A 126 113.778 -4.887 -4.221 1.00 0.00 H new ATOM 0 HB2 SER A 126 110.797 -5.387 -4.742 1.00 0.00 H new ATOM 0 HB3 SER A 126 111.952 -4.862 -5.950 1.00 0.00 H new ATOM 0 HG SER A 126 111.660 -7.177 -5.960 1.00 0.00 H new ATOM 1913 N LEU A 127 113.132 -2.508 -4.344 1.00 0.00 N ATOM 1914 CA LEU A 127 112.797 -1.084 -4.390 1.00 0.00 C ATOM 1915 C LEU A 127 112.004 -0.716 -5.656 1.00 0.00 C ATOM 1916 O LEU A 127 111.805 0.465 -5.937 1.00 0.00 O ATOM 1917 CB LEU A 127 114.078 -0.242 -4.359 1.00 0.00 C ATOM 1918 CG LEU A 127 114.940 -0.607 -3.146 1.00 0.00 C ATOM 1919 CD1 LEU A 127 116.231 0.213 -3.179 1.00 0.00 C ATOM 1920 CD2 LEU A 127 114.182 -0.291 -1.855 1.00 0.00 C ATOM 0 H LEU A 127 113.999 -2.753 -4.823 1.00 0.00 H new ATOM 0 HA LEU A 127 112.177 -0.875 -3.518 1.00 0.00 H new ATOM 0 HB2 LEU A 127 114.646 -0.402 -5.276 1.00 0.00 H new ATOM 0 HB3 LEU A 127 113.822 0.817 -4.323 1.00 0.00 H new ATOM 0 HG LEU A 127 115.172 -1.671 -3.179 1.00 0.00 H new ATOM 0 HD11 LEU A 127 116.847 -0.044 -2.317 1.00 0.00 H new ATOM 0 HD12 LEU A 127 116.779 -0.007 -4.095 1.00 0.00 H new ATOM 0 HD13 LEU A 127 115.988 1.275 -3.148 1.00 0.00 H new ATOM 0 HD21 LEU A 127 114.800 -0.553 -0.997 1.00 0.00 H new ATOM 0 HD22 LEU A 127 113.947 0.773 -1.822 1.00 0.00 H new ATOM 0 HD23 LEU A 127 113.257 -0.868 -1.825 1.00 0.00 H new ATOM 1932 N GLY A 128 111.552 -1.709 -6.425 1.00 0.00 N ATOM 1933 CA GLY A 128 110.899 -1.450 -7.706 1.00 0.00 C ATOM 1934 C GLY A 128 109.810 -0.384 -7.609 1.00 0.00 C ATOM 1935 O GLY A 128 109.739 0.511 -8.452 1.00 0.00 O ATOM 0 H GLY A 128 111.627 -2.697 -6.182 1.00 0.00 H new ATOM 0 HA2 GLY A 128 111.647 -1.134 -8.433 1.00 0.00 H new ATOM 0 HA3 GLY A 128 110.463 -2.376 -8.080 1.00 0.00 H new ATOM 1939 N ALA A 129 108.977 -0.459 -6.574 1.00 0.00 N ATOM 1940 CA ALA A 129 107.870 0.484 -6.435 1.00 0.00 C ATOM 1941 C ALA A 129 108.389 1.916 -6.347 1.00 0.00 C ATOM 1942 O ALA A 129 107.921 2.806 -7.060 1.00 0.00 O ATOM 1943 CB ALA A 129 107.058 0.155 -5.182 1.00 0.00 C ATOM 0 H ALA A 129 109.045 -1.152 -5.829 1.00 0.00 H new ATOM 0 HA ALA A 129 107.232 0.396 -7.315 1.00 0.00 H new ATOM 0 HB1 ALA A 129 106.235 0.863 -5.086 1.00 0.00 H new ATOM 0 HB2 ALA A 129 106.660 -0.856 -5.262 1.00 0.00 H new ATOM 0 HB3 ALA A 129 107.700 0.224 -4.304 1.00 0.00 H new ATOM 1949 N LEU A 130 109.383 2.128 -5.494 1.00 0.00 N ATOM 1950 CA LEU A 130 109.940 3.462 -5.306 1.00 0.00 C ATOM 1951 C LEU A 130 110.486 4.003 -6.625 1.00 0.00 C ATOM 1952 O LEU A 130 110.277 5.167 -6.969 1.00 0.00 O ATOM 1953 CB LEU A 130 111.055 3.404 -4.262 1.00 0.00 C ATOM 1954 CG LEU A 130 111.563 4.816 -3.966 1.00 0.00 C ATOM 1955 CD1 LEU A 130 110.476 5.608 -3.238 1.00 0.00 C ATOM 1956 CD2 LEU A 130 112.808 4.727 -3.081 1.00 0.00 C ATOM 0 H LEU A 130 109.817 1.401 -4.926 1.00 0.00 H new ATOM 0 HA LEU A 130 109.152 4.131 -4.960 1.00 0.00 H new ATOM 0 HB2 LEU A 130 110.685 2.942 -3.347 1.00 0.00 H new ATOM 0 HB3 LEU A 130 111.873 2.782 -4.625 1.00 0.00 H new ATOM 0 HG LEU A 130 111.812 5.319 -4.900 1.00 0.00 H new ATOM 0 HD11 LEU A 130 110.838 6.614 -3.027 1.00 0.00 H new ATOM 0 HD12 LEU A 130 109.587 5.667 -3.865 1.00 0.00 H new ATOM 0 HD13 LEU A 130 110.227 5.108 -2.302 1.00 0.00 H new ATOM 0 HD21 LEU A 130 113.175 5.731 -2.867 1.00 0.00 H new ATOM 0 HD22 LEU A 130 112.555 4.226 -2.147 1.00 0.00 H new ATOM 0 HD23 LEU A 130 113.582 4.161 -3.598 1.00 0.00 H new ATOM 1968 N LEU A 131 111.163 3.141 -7.377 1.00 0.00 N ATOM 1969 CA LEU A 131 111.752 3.552 -8.645 1.00 0.00 C ATOM 1970 C LEU A 131 110.671 4.043 -9.601 1.00 0.00 C ATOM 1971 O LEU A 131 110.823 5.086 -10.234 1.00 0.00 O ATOM 1972 CB LEU A 131 112.504 2.372 -9.270 1.00 0.00 C ATOM 1973 CG LEU A 131 113.204 2.807 -10.561 1.00 0.00 C ATOM 1974 CD1 LEU A 131 114.384 3.720 -10.225 1.00 0.00 C ATOM 1975 CD2 LEU A 131 113.717 1.568 -11.300 1.00 0.00 C ATOM 0 H LEU A 131 111.316 2.163 -7.133 1.00 0.00 H new ATOM 0 HA LEU A 131 112.449 4.369 -8.460 1.00 0.00 H new ATOM 0 HB2 LEU A 131 113.238 1.985 -8.563 1.00 0.00 H new ATOM 0 HB3 LEU A 131 111.808 1.560 -9.482 1.00 0.00 H new ATOM 0 HG LEU A 131 112.498 3.347 -11.192 1.00 0.00 H new ATOM 0 HD11 LEU A 131 114.880 4.028 -11.146 1.00 0.00 H new ATOM 0 HD12 LEU A 131 114.023 4.602 -9.695 1.00 0.00 H new ATOM 0 HD13 LEU A 131 115.092 3.182 -9.594 1.00 0.00 H new ATOM 0 HD21 LEU A 131 114.216 1.873 -12.220 1.00 0.00 H new ATOM 0 HD22 LEU A 131 114.423 1.032 -10.665 1.00 0.00 H new ATOM 0 HD23 LEU A 131 112.878 0.915 -11.542 1.00 0.00 H new ATOM 1987 N SER A 132 109.568 3.308 -9.678 1.00 0.00 N ATOM 1988 CA SER A 132 108.501 3.657 -10.608 1.00 0.00 C ATOM 1989 C SER A 132 107.962 5.051 -10.309 1.00 0.00 C ATOM 1990 O SER A 132 107.721 5.841 -11.223 1.00 0.00 O ATOM 1991 CB SER A 132 107.367 2.636 -10.513 1.00 0.00 C ATOM 1992 OG SER A 132 106.719 2.773 -9.255 1.00 0.00 O ATOM 0 H SER A 132 109.390 2.476 -9.115 1.00 0.00 H new ATOM 0 HA SER A 132 108.911 3.649 -11.618 1.00 0.00 H new ATOM 0 HB2 SER A 132 106.653 2.791 -11.322 1.00 0.00 H new ATOM 0 HB3 SER A 132 107.761 1.626 -10.625 1.00 0.00 H new ATOM 0 HG SER A 132 107.349 2.553 -8.537 1.00 0.00 H new ATOM 1998 N THR A 133 107.812 5.366 -9.026 1.00 0.00 N ATOM 1999 CA THR A 133 107.270 6.663 -8.636 1.00 0.00 C ATOM 2000 C THR A 133 108.172 7.792 -9.128 1.00 0.00 C ATOM 2001 O THR A 133 107.706 8.747 -9.754 1.00 0.00 O ATOM 2002 CB THR A 133 107.135 6.739 -7.114 1.00 0.00 C ATOM 2003 OG1 THR A 133 106.378 5.628 -6.654 1.00 0.00 O ATOM 2004 CG2 THR A 133 106.428 8.037 -6.724 1.00 0.00 C ATOM 0 H THR A 133 108.054 4.751 -8.249 1.00 0.00 H new ATOM 0 HA THR A 133 106.286 6.775 -9.092 1.00 0.00 H new ATOM 0 HB THR A 133 108.126 6.720 -6.660 1.00 0.00 H new ATOM 0 HG1 THR A 133 106.291 5.673 -5.679 1.00 0.00 H new ATOM 0 HG21 THR A 133 106.333 8.088 -5.639 1.00 0.00 H new ATOM 0 HG22 THR A 133 107.009 8.888 -7.078 1.00 0.00 H new ATOM 0 HG23 THR A 133 105.437 8.061 -7.176 1.00 0.00 H new ATOM 2012 N THR A 134 109.471 7.662 -8.875 1.00 0.00 N ATOM 2013 CA THR A 134 110.409 8.713 -9.260 1.00 0.00 C ATOM 2014 C THR A 134 110.423 8.896 -10.775 1.00 0.00 C ATOM 2015 O THR A 134 110.465 10.021 -11.270 1.00 0.00 O ATOM 2016 CB THR A 134 111.816 8.391 -8.756 1.00 0.00 C ATOM 2017 OG1 THR A 134 111.753 8.062 -7.375 1.00 0.00 O ATOM 2018 CG2 THR A 134 112.716 9.615 -8.946 1.00 0.00 C ATOM 0 H THR A 134 109.893 6.856 -8.414 1.00 0.00 H new ATOM 0 HA THR A 134 110.079 9.645 -8.801 1.00 0.00 H new ATOM 0 HB THR A 134 112.223 7.549 -9.316 1.00 0.00 H new ATOM 0 HG1 THR A 134 110.923 8.416 -6.992 1.00 0.00 H new ATOM 0 HG21 THR A 134 113.720 9.388 -8.587 1.00 0.00 H new ATOM 0 HG22 THR A 134 112.759 9.874 -10.004 1.00 0.00 H new ATOM 0 HG23 THR A 134 112.311 10.455 -8.382 1.00 0.00 H new ATOM 2026 N LEU A 135 110.370 7.791 -11.512 1.00 0.00 N ATOM 2027 CA LEU A 135 110.377 7.858 -12.971 1.00 0.00 C ATOM 2028 C LEU A 135 109.176 8.646 -13.485 1.00 0.00 C ATOM 2029 O LEU A 135 109.293 9.412 -14.442 1.00 0.00 O ATOM 2030 CB LEU A 135 110.357 6.447 -13.563 1.00 0.00 C ATOM 2031 CG LEU A 135 111.662 5.725 -13.220 1.00 0.00 C ATOM 2032 CD1 LEU A 135 111.542 4.248 -13.601 1.00 0.00 C ATOM 2033 CD2 LEU A 135 112.815 6.356 -14.004 1.00 0.00 C ATOM 0 H LEU A 135 110.322 6.847 -11.129 1.00 0.00 H new ATOM 0 HA LEU A 135 111.288 8.369 -13.282 1.00 0.00 H new ATOM 0 HB2 LEU A 135 109.507 5.889 -13.169 1.00 0.00 H new ATOM 0 HB3 LEU A 135 110.232 6.498 -14.645 1.00 0.00 H new ATOM 0 HG LEU A 135 111.855 5.813 -12.151 1.00 0.00 H new ATOM 0 HD11 LEU A 135 112.471 3.733 -13.357 1.00 0.00 H new ATOM 0 HD12 LEU A 135 110.720 3.795 -13.047 1.00 0.00 H new ATOM 0 HD13 LEU A 135 111.350 4.163 -14.670 1.00 0.00 H new ATOM 0 HD21 LEU A 135 113.745 5.842 -13.760 1.00 0.00 H new ATOM 0 HD22 LEU A 135 112.620 6.266 -15.073 1.00 0.00 H new ATOM 0 HD23 LEU A 135 112.902 7.410 -13.738 1.00 0.00 H new ATOM 2045 N ASN A 136 108.022 8.451 -12.853 1.00 0.00 N ATOM 2046 CA ASN A 136 106.821 9.178 -13.249 1.00 0.00 C ATOM 2047 C ASN A 136 107.052 10.681 -13.140 1.00 0.00 C ATOM 2048 O ASN A 136 106.660 11.446 -14.021 1.00 0.00 O ATOM 2049 CB ASN A 136 105.646 8.771 -12.356 1.00 0.00 C ATOM 2050 CG ASN A 136 104.340 9.297 -12.940 1.00 0.00 C ATOM 2051 OD1 ASN A 136 103.957 8.918 -14.047 1.00 0.00 O ATOM 2052 ND2 ASN A 136 103.629 10.153 -12.259 1.00 0.00 N ATOM 0 H ASN A 136 107.894 7.804 -12.075 1.00 0.00 H new ATOM 0 HA ASN A 136 106.589 8.930 -14.285 1.00 0.00 H new ATOM 0 HB2 ASN A 136 105.604 7.685 -12.269 1.00 0.00 H new ATOM 0 HB3 ASN A 136 105.789 9.166 -11.350 1.00 0.00 H new ATOM 0 HD21 ASN A 136 102.754 10.509 -12.644 1.00 0.00 H new ATOM 0 HD22 ASN A 136 103.948 10.466 -11.342 1.00 0.00 H new ATOM 2059 N LEU A 137 107.693 11.093 -12.051 1.00 0.00 N ATOM 2060 CA LEU A 137 108.019 12.505 -11.857 1.00 0.00 C ATOM 2061 C LEU A 137 108.957 13.003 -12.953 1.00 0.00 C ATOM 2062 O LEU A 137 108.815 14.125 -13.442 1.00 0.00 O ATOM 2063 CB LEU A 137 108.680 12.706 -10.490 1.00 0.00 C ATOM 2064 CG LEU A 137 107.762 12.189 -9.378 1.00 0.00 C ATOM 2065 CD1 LEU A 137 108.475 12.330 -8.031 1.00 0.00 C ATOM 2066 CD2 LEU A 137 106.463 13.003 -9.349 1.00 0.00 C ATOM 0 H LEU A 137 107.995 10.478 -11.295 1.00 0.00 H new ATOM 0 HA LEU A 137 107.092 13.077 -11.904 1.00 0.00 H new ATOM 0 HB2 LEU A 137 109.634 12.180 -10.458 1.00 0.00 H new ATOM 0 HB3 LEU A 137 108.894 13.763 -10.333 1.00 0.00 H new ATOM 0 HG LEU A 137 107.525 11.142 -9.567 1.00 0.00 H new ATOM 0 HD11 LEU A 137 107.826 11.963 -7.236 1.00 0.00 H new ATOM 0 HD12 LEU A 137 109.397 11.748 -8.044 1.00 0.00 H new ATOM 0 HD13 LEU A 137 108.711 13.379 -7.852 1.00 0.00 H new ATOM 0 HD21 LEU A 137 105.817 12.628 -8.555 1.00 0.00 H new ATOM 0 HD22 LEU A 137 106.695 14.052 -9.163 1.00 0.00 H new ATOM 0 HD23 LEU A 137 105.953 12.908 -10.308 1.00 0.00 H new ATOM 2078 N CYS A 138 109.912 12.163 -13.336 1.00 0.00 N ATOM 2079 CA CYS A 138 110.843 12.505 -14.411 1.00 0.00 C ATOM 2080 C CYS A 138 110.113 12.767 -15.735 1.00 0.00 C ATOM 2081 O CYS A 138 110.626 13.487 -16.591 1.00 0.00 O ATOM 2082 CB CYS A 138 111.851 11.368 -14.605 1.00 0.00 C ATOM 2083 SG CYS A 138 113.247 11.551 -13.462 1.00 0.00 S ATOM 0 H CYS A 138 110.064 11.243 -12.922 1.00 0.00 H new ATOM 0 HA CYS A 138 111.359 13.420 -14.122 1.00 0.00 H new ATOM 0 HB2 CYS A 138 111.361 10.408 -14.439 1.00 0.00 H new ATOM 0 HB3 CYS A 138 112.213 11.367 -15.633 1.00 0.00 H new ATOM 2088 N GLY A 139 108.925 12.188 -15.908 1.00 0.00 N ATOM 2089 CA GLY A 139 108.169 12.366 -17.146 1.00 0.00 C ATOM 2090 C GLY A 139 108.426 11.247 -18.160 1.00 0.00 C ATOM 2091 O GLY A 139 108.227 11.441 -19.359 1.00 0.00 O ATOM 0 H GLY A 139 108.469 11.597 -15.213 1.00 0.00 H new ATOM 0 HA2 GLY A 139 107.104 12.404 -16.915 1.00 0.00 H new ATOM 0 HA3 GLY A 139 108.433 13.324 -17.594 1.00 0.00 H new ATOM 2095 N LYS A 140 108.866 10.081 -17.690 1.00 0.00 N ATOM 2096 CA LYS A 140 109.130 8.956 -18.580 1.00 0.00 C ATOM 2097 C LYS A 140 107.867 8.121 -18.767 1.00 0.00 C ATOM 2098 O LYS A 140 107.059 7.986 -17.849 1.00 0.00 O ATOM 2099 CB LYS A 140 110.242 8.073 -18.007 1.00 0.00 C ATOM 2100 CG LYS A 140 111.502 8.906 -17.751 1.00 0.00 C ATOM 2101 CD LYS A 140 112.045 9.454 -19.073 1.00 0.00 C ATOM 2102 CE LYS A 140 113.402 10.117 -18.831 1.00 0.00 C ATOM 2103 NZ LYS A 140 114.457 9.070 -18.732 1.00 0.00 N ATOM 0 H LYS A 140 109.046 9.893 -16.704 1.00 0.00 H new ATOM 0 HA LYS A 140 109.447 9.351 -19.545 1.00 0.00 H new ATOM 0 HB2 LYS A 140 109.907 7.612 -17.078 1.00 0.00 H new ATOM 0 HB3 LYS A 140 110.467 7.264 -18.701 1.00 0.00 H new ATOM 0 HG2 LYS A 140 111.273 9.729 -17.074 1.00 0.00 H new ATOM 0 HG3 LYS A 140 112.260 8.293 -17.263 1.00 0.00 H new ATOM 0 HD2 LYS A 140 112.147 8.647 -19.799 1.00 0.00 H new ATOM 0 HD3 LYS A 140 111.346 10.176 -19.494 1.00 0.00 H new ATOM 0 HE2 LYS A 140 113.633 10.805 -19.645 1.00 0.00 H new ATOM 0 HE3 LYS A 140 113.372 10.706 -17.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 115.118 9.314 -17.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 114.016 8.151 -18.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 114.975 9.013 -19.632 1.00 0.00 H new ATOM 2117 N GLY A 141 107.703 7.563 -19.963 1.00 0.00 N ATOM 2118 CA GLY A 141 106.534 6.744 -20.259 1.00 0.00 C ATOM 2119 C GLY A 141 106.856 5.261 -20.108 1.00 0.00 C ATOM 2120 O GLY A 141 106.051 4.453 -20.542 1.00 0.00 O ATOM 2121 OXT GLY A 141 107.902 4.954 -19.561 1.00 0.00 O ATOM 0 H GLY A 141 108.360 7.662 -20.737 1.00 0.00 H new ATOM 0 HA2 GLY A 141 105.717 7.013 -19.589 1.00 0.00 H new ATOM 0 HA3 GLY A 141 106.192 6.944 -21.274 1.00 0.00 H new TER 2125 GLY A 141