USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 773 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 16 THR OG1 : rot 79:sc= -0.522! USER MOD Set 1.2: A 19 ASN :FLIP amide:sc= -1.2! C(o=-11!,f=-1.7!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.753 X(o=-0.75,f=-1) USER MOD Single : A 4 MET CE :methyl -127:sc= -0.0229 (180deg=-0.266) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0688 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN :FLIP amide:sc= -2.2 F(o=-4.2!,f=-2.2) USER MOD Single : A 26 ASN : amide:sc= -4.64! C(o=-4.6!,f=-11!) USER MOD Single : A 28 ASN :FLIP amide:sc= 0 F(o=-0.89,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 156:sc= -0.225 (180deg=-0.663) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -134:sc= -0.097 (180deg=-0.544) USER MOD Single : A 45 ASN :FLIP amide:sc= -1.03 F(o=-1.6!,f=-1) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 139:sc= 0.98 USER MOD Single : A 57 ASN : amide:sc= -0.42 X(o=-0.42,f=-0.076) USER MOD Single : A 59 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.568) USER MOD Single : A 62 TYR OH : rot 180:sc= -1.74 USER MOD Single : A 67 SER OG : rot -97:sc= -2.03! USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 THR OG1 : rot 92:sc= -4.49! USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -1.57! C(o=-1.6!,f=-3.1!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -21:sc= 0.844 USER MOD Single : A 101 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 58.452 34.989 -17.095 1.00 0.00 N ATOM 2 CA GLY A 1 58.349 36.445 -16.796 1.00 0.00 C ATOM 3 C GLY A 1 59.436 37.202 -17.561 1.00 0.00 C ATOM 4 O GLY A 1 59.491 37.171 -18.775 1.00 0.00 O ATOM 0 H1 GLY A 1 57.713 34.475 -16.575 1.00 0.00 H new ATOM 0 H2 GLY A 1 58.328 34.835 -18.116 1.00 0.00 H new ATOM 0 H3 GLY A 1 59.387 34.640 -16.803 1.00 0.00 H new ATOM 0 HA2 GLY A 1 57.364 36.816 -17.080 1.00 0.00 H new ATOM 0 HA3 GLY A 1 58.458 36.616 -15.725 1.00 0.00 H new ATOM 10 N SER A 2 60.303 37.883 -16.862 1.00 0.00 N ATOM 11 CA SER A 2 61.385 38.641 -17.551 1.00 0.00 C ATOM 12 C SER A 2 62.651 37.785 -17.650 1.00 0.00 C ATOM 13 O SER A 2 63.603 38.141 -18.315 1.00 0.00 O ATOM 14 CB SER A 2 61.634 39.865 -16.670 1.00 0.00 C ATOM 15 OG SER A 2 62.328 39.464 -15.496 1.00 0.00 O ATOM 0 H SER A 2 60.308 37.947 -15.844 1.00 0.00 H new ATOM 0 HA SER A 2 61.110 38.920 -18.568 1.00 0.00 H new ATOM 0 HB2 SER A 2 62.217 40.608 -17.215 1.00 0.00 H new ATOM 0 HB3 SER A 2 60.687 40.335 -16.404 1.00 0.00 H new ATOM 0 HG SER A 2 62.491 40.247 -14.929 1.00 0.00 H new ATOM 21 N HIS A 3 62.668 36.657 -16.993 1.00 0.00 N ATOM 22 CA HIS A 3 63.872 35.779 -17.049 1.00 0.00 C ATOM 23 C HIS A 3 63.670 34.672 -18.087 1.00 0.00 C ATOM 24 O HIS A 3 62.980 34.848 -19.071 1.00 0.00 O ATOM 25 CB HIS A 3 63.995 35.185 -15.647 1.00 0.00 C ATOM 26 CG HIS A 3 65.442 34.906 -15.344 1.00 0.00 C ATOM 27 ND1 HIS A 3 65.876 33.674 -14.880 1.00 0.00 N ATOM 28 CD2 HIS A 3 66.566 35.690 -15.435 1.00 0.00 C ATOM 29 CE1 HIS A 3 67.209 33.752 -14.712 1.00 0.00 C ATOM 30 NE2 HIS A 3 67.680 34.959 -15.035 1.00 0.00 N ATOM 0 H HIS A 3 61.901 36.306 -16.420 1.00 0.00 H new ATOM 0 HA HIS A 3 64.769 36.326 -17.339 1.00 0.00 H new ATOM 0 HB2 HIS A 3 63.585 35.876 -14.911 1.00 0.00 H new ATOM 0 HB3 HIS A 3 63.414 34.265 -15.578 1.00 0.00 H new ATOM 0 HD2 HIS A 3 66.583 36.718 -15.767 1.00 0.00 H new ATOM 0 HE1 HIS A 3 67.823 32.937 -14.359 1.00 0.00 H new ATOM 0 HE2 HIS A 3 68.648 35.277 -14.997 1.00 0.00 H new ATOM 38 N MET A 4 64.267 33.530 -17.874 1.00 0.00 N ATOM 39 CA MET A 4 64.108 32.413 -18.848 1.00 0.00 C ATOM 40 C MET A 4 63.689 31.132 -18.121 1.00 0.00 C ATOM 41 O MET A 4 62.693 30.519 -18.449 1.00 0.00 O ATOM 42 CB MET A 4 65.489 32.242 -19.483 1.00 0.00 C ATOM 43 CG MET A 4 65.347 31.536 -20.832 1.00 0.00 C ATOM 44 SD MET A 4 65.031 32.762 -22.124 1.00 0.00 S ATOM 45 CE MET A 4 66.738 33.326 -22.326 1.00 0.00 C ATOM 0 H MET A 4 64.857 33.323 -17.068 1.00 0.00 H new ATOM 0 HA MET A 4 63.340 32.621 -19.593 1.00 0.00 H new ATOM 0 HB2 MET A 4 65.962 33.215 -19.618 1.00 0.00 H new ATOM 0 HB3 MET A 4 66.135 31.662 -18.824 1.00 0.00 H new ATOM 0 HG2 MET A 4 66.255 30.978 -21.060 1.00 0.00 H new ATOM 0 HG3 MET A 4 64.531 30.815 -20.793 1.00 0.00 H new ATOM 0 HE1 MET A 4 66.777 34.411 -22.229 1.00 0.00 H new ATOM 0 HE2 MET A 4 67.365 32.871 -21.559 1.00 0.00 H new ATOM 0 HE3 MET A 4 67.103 33.037 -23.312 1.00 0.00 H new ATOM 55 N LEU A 5 64.441 30.725 -17.135 1.00 0.00 N ATOM 56 CA LEU A 5 64.084 29.485 -16.388 1.00 0.00 C ATOM 57 C LEU A 5 63.851 28.328 -17.364 1.00 0.00 C ATOM 58 O LEU A 5 62.748 27.841 -17.511 1.00 0.00 O ATOM 59 CB LEU A 5 62.793 29.829 -15.645 1.00 0.00 C ATOM 60 CG LEU A 5 62.624 28.885 -14.453 1.00 0.00 C ATOM 61 CD1 LEU A 5 62.255 29.695 -13.209 1.00 0.00 C ATOM 62 CD2 LEU A 5 61.511 27.880 -14.754 1.00 0.00 C ATOM 0 H LEU A 5 65.287 31.197 -16.814 1.00 0.00 H new ATOM 0 HA LEU A 5 64.875 29.170 -15.707 1.00 0.00 H new ATOM 0 HB2 LEU A 5 62.823 30.863 -15.302 1.00 0.00 H new ATOM 0 HB3 LEU A 5 61.939 29.740 -16.317 1.00 0.00 H new ATOM 0 HG LEU A 5 63.558 28.352 -14.276 1.00 0.00 H new ATOM 0 HD11 LEU A 5 62.135 29.023 -12.360 1.00 0.00 H new ATOM 0 HD12 LEU A 5 63.047 30.413 -12.994 1.00 0.00 H new ATOM 0 HD13 LEU A 5 61.320 30.228 -13.386 1.00 0.00 H new ATOM 0 HD21 LEU A 5 61.390 27.207 -13.905 1.00 0.00 H new ATOM 0 HD22 LEU A 5 60.577 28.413 -14.931 1.00 0.00 H new ATOM 0 HD23 LEU A 5 61.772 27.303 -15.641 1.00 0.00 H new ATOM 74 N GLU A 6 64.882 27.887 -18.031 1.00 0.00 N ATOM 75 CA GLU A 6 64.719 26.762 -18.998 1.00 0.00 C ATOM 76 C GLU A 6 64.565 25.437 -18.245 1.00 0.00 C ATOM 77 O GLU A 6 63.469 24.971 -18.008 1.00 0.00 O ATOM 78 CB GLU A 6 66.002 26.763 -19.828 1.00 0.00 C ATOM 79 CG GLU A 6 65.848 27.726 -21.007 1.00 0.00 C ATOM 80 CD GLU A 6 64.701 27.255 -21.904 1.00 0.00 C ATOM 81 OE1 GLU A 6 64.819 26.180 -22.468 1.00 0.00 O ATOM 82 OE2 GLU A 6 63.723 27.978 -22.012 1.00 0.00 O ATOM 0 H GLU A 6 65.830 28.256 -17.949 1.00 0.00 H new ATOM 0 HA GLU A 6 63.832 26.878 -19.621 1.00 0.00 H new ATOM 0 HB2 GLU A 6 66.848 27.062 -19.209 1.00 0.00 H new ATOM 0 HB3 GLU A 6 66.213 25.757 -20.192 1.00 0.00 H new ATOM 0 HG2 GLU A 6 65.649 28.734 -20.643 1.00 0.00 H new ATOM 0 HG3 GLU A 6 66.776 27.770 -21.578 1.00 0.00 H new ATOM 89 N ASP A 7 65.657 24.828 -17.870 1.00 0.00 N ATOM 90 CA ASP A 7 65.573 23.534 -17.135 1.00 0.00 C ATOM 91 C ASP A 7 66.652 23.471 -16.049 1.00 0.00 C ATOM 92 O ASP A 7 67.629 24.190 -16.102 1.00 0.00 O ATOM 93 CB ASP A 7 65.815 22.460 -18.194 1.00 0.00 C ATOM 94 CG ASP A 7 67.107 22.771 -18.951 1.00 0.00 C ATOM 95 OD1 ASP A 7 68.155 22.338 -18.498 1.00 0.00 O ATOM 96 OD2 ASP A 7 67.029 23.437 -19.971 1.00 0.00 O ATOM 0 H ASP A 7 66.603 25.170 -18.041 1.00 0.00 H new ATOM 0 HA ASP A 7 64.613 23.404 -16.636 1.00 0.00 H new ATOM 0 HB2 ASP A 7 65.884 21.479 -17.723 1.00 0.00 H new ATOM 0 HB3 ASP A 7 64.975 22.422 -18.887 1.00 0.00 H new ATOM 101 N PRO A 8 66.432 22.606 -15.097 1.00 0.00 N ATOM 102 CA PRO A 8 67.388 22.436 -13.983 1.00 0.00 C ATOM 103 C PRO A 8 68.654 21.749 -14.480 1.00 0.00 C ATOM 104 O PRO A 8 68.983 21.781 -15.649 1.00 0.00 O ATOM 105 CB PRO A 8 66.633 21.543 -12.997 1.00 0.00 C ATOM 106 CG PRO A 8 65.650 20.800 -13.833 1.00 0.00 C ATOM 107 CD PRO A 8 65.282 21.710 -14.970 1.00 0.00 C ATOM 0 HA PRO A 8 67.705 23.378 -13.537 1.00 0.00 H new ATOM 0 HB2 PRO A 8 67.310 20.861 -12.482 1.00 0.00 H new ATOM 0 HB3 PRO A 8 66.133 22.135 -12.230 1.00 0.00 H new ATOM 0 HG2 PRO A 8 66.081 19.870 -14.204 1.00 0.00 H new ATOM 0 HG3 PRO A 8 64.769 20.532 -13.250 1.00 0.00 H new ATOM 0 HD2 PRO A 8 65.110 21.150 -15.889 1.00 0.00 H new ATOM 0 HD3 PRO A 8 64.367 22.263 -14.758 1.00 0.00 H new ATOM 115 N VAL A 9 69.357 21.131 -13.591 1.00 0.00 N ATOM 116 CA VAL A 9 70.612 20.428 -13.974 1.00 0.00 C ATOM 117 C VAL A 9 70.410 18.911 -13.879 1.00 0.00 C ATOM 118 O VAL A 9 69.301 18.418 -13.929 1.00 0.00 O ATOM 119 CB VAL A 9 71.660 20.922 -12.966 1.00 0.00 C ATOM 120 CG1 VAL A 9 71.589 20.096 -11.677 1.00 0.00 C ATOM 121 CG2 VAL A 9 73.057 20.796 -13.578 1.00 0.00 C ATOM 0 H VAL A 9 69.119 21.078 -12.601 1.00 0.00 H new ATOM 0 HA VAL A 9 70.919 20.633 -14.999 1.00 0.00 H new ATOM 0 HB VAL A 9 71.456 21.966 -12.728 1.00 0.00 H new ATOM 0 HG11 VAL A 9 72.337 20.457 -10.972 1.00 0.00 H new ATOM 0 HG12 VAL A 9 70.597 20.195 -11.236 1.00 0.00 H new ATOM 0 HG13 VAL A 9 71.782 19.048 -11.905 1.00 0.00 H new ATOM 0 HG21 VAL A 9 73.801 21.147 -12.862 1.00 0.00 H new ATOM 0 HG22 VAL A 9 73.254 19.752 -13.824 1.00 0.00 H new ATOM 0 HG23 VAL A 9 73.113 21.399 -14.484 1.00 0.00 H new ATOM 131 N GLU A 10 71.473 18.171 -13.744 1.00 0.00 N ATOM 132 CA GLU A 10 71.344 16.689 -13.646 1.00 0.00 C ATOM 133 C GLU A 10 70.669 16.301 -12.329 1.00 0.00 C ATOM 134 O GLU A 10 70.464 17.125 -11.459 1.00 0.00 O ATOM 135 CB GLU A 10 72.780 16.163 -13.689 1.00 0.00 C ATOM 136 CG GLU A 10 73.541 16.658 -12.456 1.00 0.00 C ATOM 137 CD GLU A 10 74.926 17.151 -12.876 1.00 0.00 C ATOM 138 OE1 GLU A 10 75.000 18.215 -13.469 1.00 0.00 O ATOM 139 OE2 GLU A 10 75.891 16.457 -12.596 1.00 0.00 O ATOM 0 H GLU A 10 72.428 18.527 -13.697 1.00 0.00 H new ATOM 0 HA GLU A 10 70.733 16.274 -14.448 1.00 0.00 H new ATOM 0 HB2 GLU A 10 72.779 15.073 -13.716 1.00 0.00 H new ATOM 0 HB3 GLU A 10 73.277 16.504 -14.597 1.00 0.00 H new ATOM 0 HG2 GLU A 10 72.988 17.463 -11.973 1.00 0.00 H new ATOM 0 HG3 GLU A 10 73.635 15.854 -11.726 1.00 0.00 H new ATOM 146 N GLY A 11 70.321 15.053 -12.174 1.00 0.00 N ATOM 147 CA GLY A 11 69.659 14.614 -10.913 1.00 0.00 C ATOM 148 C GLY A 11 70.719 14.140 -9.917 1.00 0.00 C ATOM 149 O GLY A 11 70.822 12.967 -9.616 1.00 0.00 O ATOM 0 H GLY A 11 70.467 14.318 -12.866 1.00 0.00 H new ATOM 0 HA2 GLY A 11 69.086 15.437 -10.486 1.00 0.00 H new ATOM 0 HA3 GLY A 11 68.955 13.809 -11.121 1.00 0.00 H new ATOM 153 N SER A 12 71.509 15.043 -9.403 1.00 0.00 N ATOM 154 CA SER A 12 72.562 14.643 -8.427 1.00 0.00 C ATOM 155 C SER A 12 72.052 14.821 -6.994 1.00 0.00 C ATOM 156 O SER A 12 72.818 14.867 -6.053 1.00 0.00 O ATOM 157 CB SER A 12 73.733 15.587 -8.698 1.00 0.00 C ATOM 158 OG SER A 12 73.262 16.728 -9.404 1.00 0.00 O ATOM 0 H SER A 12 71.471 16.040 -9.617 1.00 0.00 H new ATOM 0 HA SER A 12 72.847 13.597 -8.535 1.00 0.00 H new ATOM 0 HB2 SER A 12 74.195 15.891 -7.759 1.00 0.00 H new ATOM 0 HB3 SER A 12 74.500 15.076 -9.280 1.00 0.00 H new ATOM 0 HG SER A 12 74.010 17.337 -9.578 1.00 0.00 H new ATOM 164 N GLU A 13 70.763 14.926 -6.823 1.00 0.00 N ATOM 165 CA GLU A 13 70.203 15.104 -5.456 1.00 0.00 C ATOM 166 C GLU A 13 69.873 13.750 -4.840 1.00 0.00 C ATOM 167 O GLU A 13 68.993 13.621 -4.012 1.00 0.00 O ATOM 168 CB GLU A 13 68.934 15.919 -5.655 1.00 0.00 C ATOM 169 CG GLU A 13 69.102 17.299 -5.018 1.00 0.00 C ATOM 170 CD GLU A 13 67.739 17.983 -4.913 1.00 0.00 C ATOM 171 OE1 GLU A 13 66.740 17.297 -5.062 1.00 0.00 O ATOM 172 OE2 GLU A 13 67.714 19.181 -4.685 1.00 0.00 O ATOM 0 H GLU A 13 70.073 14.896 -7.573 1.00 0.00 H new ATOM 0 HA GLU A 13 70.906 15.596 -4.784 1.00 0.00 H new ATOM 0 HB2 GLU A 13 68.720 16.023 -6.719 1.00 0.00 H new ATOM 0 HB3 GLU A 13 68.085 15.402 -5.208 1.00 0.00 H new ATOM 0 HG2 GLU A 13 69.549 17.202 -4.029 1.00 0.00 H new ATOM 0 HG3 GLU A 13 69.780 17.907 -5.616 1.00 0.00 H new ATOM 179 N SER A 14 70.579 12.750 -5.246 1.00 0.00 N ATOM 180 CA SER A 14 70.336 11.382 -4.704 1.00 0.00 C ATOM 181 C SER A 14 70.365 11.407 -3.174 1.00 0.00 C ATOM 182 O SER A 14 70.442 12.455 -2.563 1.00 0.00 O ATOM 183 CB SER A 14 71.482 10.532 -5.249 1.00 0.00 C ATOM 184 OG SER A 14 70.978 9.640 -6.235 1.00 0.00 O ATOM 0 H SER A 14 71.325 12.812 -5.938 1.00 0.00 H new ATOM 0 HA SER A 14 69.362 10.988 -4.996 1.00 0.00 H new ATOM 0 HB2 SER A 14 72.251 11.172 -5.681 1.00 0.00 H new ATOM 0 HB3 SER A 14 71.951 9.971 -4.440 1.00 0.00 H new ATOM 0 HG SER A 14 71.711 9.094 -6.588 1.00 0.00 H new ATOM 190 N THR A 15 70.306 10.262 -2.550 1.00 0.00 N ATOM 191 CA THR A 15 70.332 10.224 -1.059 1.00 0.00 C ATOM 192 C THR A 15 71.741 10.530 -0.547 1.00 0.00 C ATOM 193 O THR A 15 71.966 10.654 0.641 1.00 0.00 O ATOM 194 CB THR A 15 69.924 8.796 -0.688 1.00 0.00 C ATOM 195 OG1 THR A 15 68.521 8.647 -0.858 1.00 0.00 O ATOM 196 CG2 THR A 15 70.297 8.516 0.769 1.00 0.00 C ATOM 0 H THR A 15 70.241 9.352 -3.007 1.00 0.00 H new ATOM 0 HA THR A 15 69.665 10.964 -0.617 1.00 0.00 H new ATOM 0 HB THR A 15 70.446 8.090 -1.334 1.00 0.00 H new ATOM 0 HG1 THR A 15 68.258 7.733 -0.623 1.00 0.00 H new ATOM 0 HG21 THR A 15 70.005 7.499 1.030 1.00 0.00 H new ATOM 0 HG22 THR A 15 71.374 8.629 0.897 1.00 0.00 H new ATOM 0 HG23 THR A 15 69.778 9.220 1.419 1.00 0.00 H new ATOM 204 N THR A 16 72.691 10.652 -1.432 1.00 0.00 N ATOM 205 CA THR A 16 74.083 10.947 -0.987 1.00 0.00 C ATOM 206 C THR A 16 74.952 11.352 -2.180 1.00 0.00 C ATOM 207 O THR A 16 74.642 11.041 -3.313 1.00 0.00 O ATOM 208 CB THR A 16 74.588 9.640 -0.379 1.00 0.00 C ATOM 209 OG1 THR A 16 73.901 8.547 -0.972 1.00 0.00 O ATOM 210 CG2 THR A 16 74.335 9.649 1.130 1.00 0.00 C ATOM 0 H THR A 16 72.565 10.561 -2.440 1.00 0.00 H new ATOM 0 HA THR A 16 74.120 11.772 -0.276 1.00 0.00 H new ATOM 0 HB THR A 16 75.657 9.539 -0.565 1.00 0.00 H new ATOM 0 HG1 THR A 16 74.293 8.351 -1.849 1.00 0.00 H new ATOM 0 HG21 THR A 16 74.695 8.717 1.565 1.00 0.00 H new ATOM 0 HG22 THR A 16 74.863 10.488 1.582 1.00 0.00 H new ATOM 0 HG23 THR A 16 73.266 9.749 1.319 1.00 0.00 H new ATOM 218 N PRO A 17 76.017 12.041 -1.875 1.00 0.00 N ATOM 219 CA PRO A 17 76.952 12.508 -2.926 1.00 0.00 C ATOM 220 C PRO A 17 77.818 11.348 -3.429 1.00 0.00 C ATOM 221 O PRO A 17 78.166 11.282 -4.591 1.00 0.00 O ATOM 222 CB PRO A 17 77.809 13.545 -2.205 1.00 0.00 C ATOM 223 CG PRO A 17 77.750 13.165 -0.758 1.00 0.00 C ATOM 224 CD PRO A 17 76.441 12.452 -0.533 1.00 0.00 C ATOM 0 HA PRO A 17 76.443 12.911 -3.802 1.00 0.00 H new ATOM 0 HB2 PRO A 17 78.835 13.533 -2.574 1.00 0.00 H new ATOM 0 HB3 PRO A 17 77.425 14.553 -2.364 1.00 0.00 H new ATOM 0 HG2 PRO A 17 78.589 12.520 -0.496 1.00 0.00 H new ATOM 0 HG3 PRO A 17 77.819 14.050 -0.125 1.00 0.00 H new ATOM 0 HD2 PRO A 17 76.564 11.592 0.126 1.00 0.00 H new ATOM 0 HD3 PRO A 17 75.706 13.108 -0.067 1.00 0.00 H new ATOM 232 N PHE A 18 78.175 10.440 -2.562 1.00 0.00 N ATOM 233 CA PHE A 18 79.025 9.293 -2.995 1.00 0.00 C ATOM 234 C PHE A 18 78.236 7.982 -2.931 1.00 0.00 C ATOM 235 O PHE A 18 77.858 7.524 -1.871 1.00 0.00 O ATOM 236 CB PHE A 18 80.187 9.267 -2.003 1.00 0.00 C ATOM 237 CG PHE A 18 81.005 10.527 -2.152 1.00 0.00 C ATOM 238 CD1 PHE A 18 81.919 10.648 -3.206 1.00 0.00 C ATOM 239 CD2 PHE A 18 80.851 11.574 -1.236 1.00 0.00 C ATOM 240 CE1 PHE A 18 82.678 11.817 -3.344 1.00 0.00 C ATOM 241 CE2 PHE A 18 81.611 12.742 -1.373 1.00 0.00 C ATOM 242 CZ PHE A 18 82.523 12.863 -2.427 1.00 0.00 C ATOM 0 H PHE A 18 77.916 10.442 -1.575 1.00 0.00 H new ATOM 0 HA PHE A 18 79.366 9.402 -4.025 1.00 0.00 H new ATOM 0 HB2 PHE A 18 79.808 9.185 -0.984 1.00 0.00 H new ATOM 0 HB3 PHE A 18 80.812 8.392 -2.181 1.00 0.00 H new ATOM 0 HD1 PHE A 18 82.039 9.840 -3.912 1.00 0.00 H new ATOM 0 HD2 PHE A 18 80.146 11.481 -0.423 1.00 0.00 H new ATOM 0 HE1 PHE A 18 83.382 11.911 -4.157 1.00 0.00 H new ATOM 0 HE2 PHE A 18 81.493 13.549 -0.665 1.00 0.00 H new ATOM 0 HZ PHE A 18 83.108 13.765 -2.533 1.00 0.00 H new ATOM 252 N ASN A 19 77.993 7.372 -4.059 1.00 0.00 N ATOM 253 CA ASN A 19 77.242 6.088 -4.074 1.00 0.00 C ATOM 254 C ASN A 19 77.974 5.085 -4.964 1.00 0.00 C ATOM 255 O ASN A 19 78.621 5.452 -5.924 1.00 0.00 O ATOM 256 CB ASN A 19 75.871 6.423 -4.666 1.00 0.00 C ATOM 257 CG ASN A 19 75.375 7.763 -4.116 1.00 0.00 C ATOM 258 OD1 ASN A 19 75.572 8.052 -2.860 1.00 0.00 O flip ATOM 259 ND2 ASN A 19 74.800 8.553 -4.838 1.00 0.00 N flip ATOM 0 H ASN A 19 78.285 7.711 -4.975 1.00 0.00 H new ATOM 0 HA ASN A 19 77.151 5.648 -3.081 1.00 0.00 H new ATOM 0 HB2 ASN A 19 75.937 6.469 -5.753 1.00 0.00 H new ATOM 0 HB3 ASN A 19 75.158 5.635 -4.423 1.00 0.00 H new ATOM 0 HD21 ASN A 19 74.646 8.327 -5.821 1.00 0.00 H new ATOM 0 HD22 ASN A 19 74.471 9.442 -4.462 1.00 0.00 H new ATOM 266 N LEU A 20 77.882 3.826 -4.657 1.00 0.00 N ATOM 267 CA LEU A 20 78.580 2.809 -5.495 1.00 0.00 C ATOM 268 C LEU A 20 78.057 1.406 -5.186 1.00 0.00 C ATOM 269 O LEU A 20 77.155 1.227 -4.392 1.00 0.00 O ATOM 270 CB LEU A 20 80.055 2.927 -5.112 1.00 0.00 C ATOM 271 CG LEU A 20 80.235 2.559 -3.638 1.00 0.00 C ATOM 272 CD1 LEU A 20 80.268 1.036 -3.491 1.00 0.00 C ATOM 273 CD2 LEU A 20 81.550 3.146 -3.124 1.00 0.00 C ATOM 0 H LEU A 20 77.357 3.454 -3.866 1.00 0.00 H new ATOM 0 HA LEU A 20 78.417 2.975 -6.560 1.00 0.00 H new ATOM 0 HB2 LEU A 20 80.657 2.268 -5.738 1.00 0.00 H new ATOM 0 HB3 LEU A 20 80.407 3.943 -5.289 1.00 0.00 H new ATOM 0 HG LEU A 20 79.404 2.962 -3.060 1.00 0.00 H new ATOM 0 HD11 LEU A 20 80.396 0.775 -2.441 1.00 0.00 H new ATOM 0 HD12 LEU A 20 79.332 0.615 -3.858 1.00 0.00 H new ATOM 0 HD13 LEU A 20 81.099 0.633 -4.069 1.00 0.00 H new ATOM 0 HD21 LEU A 20 81.679 2.884 -2.074 1.00 0.00 H new ATOM 0 HD22 LEU A 20 82.380 2.742 -3.703 1.00 0.00 H new ATOM 0 HD23 LEU A 20 81.529 4.231 -3.228 1.00 0.00 H new ATOM 285 N PHE A 21 78.621 0.411 -5.813 1.00 0.00 N ATOM 286 CA PHE A 21 78.166 -0.985 -5.566 1.00 0.00 C ATOM 287 C PHE A 21 79.292 -1.795 -4.917 1.00 0.00 C ATOM 288 O PHE A 21 80.459 -1.545 -5.145 1.00 0.00 O ATOM 289 CB PHE A 21 77.828 -1.534 -6.956 1.00 0.00 C ATOM 290 CG PHE A 21 77.817 -3.044 -6.925 1.00 0.00 C ATOM 291 CD1 PHE A 21 79.020 -3.754 -7.027 1.00 0.00 C ATOM 292 CD2 PHE A 21 76.606 -3.734 -6.797 1.00 0.00 C ATOM 293 CE1 PHE A 21 79.010 -5.154 -7.001 1.00 0.00 C ATOM 294 CE2 PHE A 21 76.596 -5.133 -6.771 1.00 0.00 C ATOM 295 CZ PHE A 21 77.799 -5.844 -6.873 1.00 0.00 C ATOM 0 H PHE A 21 79.380 0.506 -6.488 1.00 0.00 H new ATOM 0 HA PHE A 21 77.312 -1.037 -4.890 1.00 0.00 H new ATOM 0 HB2 PHE A 21 76.855 -1.161 -7.277 1.00 0.00 H new ATOM 0 HB3 PHE A 21 78.560 -1.182 -7.683 1.00 0.00 H new ATOM 0 HD1 PHE A 21 79.955 -3.222 -7.126 1.00 0.00 H new ATOM 0 HD2 PHE A 21 75.679 -3.186 -6.718 1.00 0.00 H new ATOM 0 HE1 PHE A 21 79.937 -5.702 -7.080 1.00 0.00 H new ATOM 0 HE2 PHE A 21 75.661 -5.665 -6.672 1.00 0.00 H new ATOM 0 HZ PHE A 21 77.792 -6.924 -6.853 1.00 0.00 H new ATOM 305 N ILE A 22 78.951 -2.764 -4.117 1.00 0.00 N ATOM 306 CA ILE A 22 80.001 -3.591 -3.461 1.00 0.00 C ATOM 307 C ILE A 22 79.686 -5.074 -3.671 1.00 0.00 C ATOM 308 O ILE A 22 78.562 -5.448 -3.938 1.00 0.00 O ATOM 309 CB ILE A 22 79.940 -3.202 -1.976 1.00 0.00 C ATOM 310 CG1 ILE A 22 80.810 -1.964 -1.745 1.00 0.00 C ATOM 311 CG2 ILE A 22 80.455 -4.350 -1.102 1.00 0.00 C ATOM 312 CD1 ILE A 22 80.074 -0.987 -0.827 1.00 0.00 C ATOM 0 H ILE A 22 77.990 -3.020 -3.888 1.00 0.00 H new ATOM 0 HA ILE A 22 80.998 -3.423 -3.869 1.00 0.00 H new ATOM 0 HB ILE A 22 78.905 -2.990 -1.707 1.00 0.00 H new ATOM 0 HG12 ILE A 22 81.761 -2.253 -1.298 1.00 0.00 H new ATOM 0 HG13 ILE A 22 81.038 -1.484 -2.697 1.00 0.00 H new ATOM 0 HG21 ILE A 22 80.405 -4.059 -0.053 1.00 0.00 H new ATOM 0 HG22 ILE A 22 79.839 -5.234 -1.263 1.00 0.00 H new ATOM 0 HG23 ILE A 22 81.488 -4.575 -1.368 1.00 0.00 H new ATOM 0 HD11 ILE A 22 80.694 -0.105 -0.662 1.00 0.00 H new ATOM 0 HD12 ILE A 22 79.134 -0.689 -1.292 1.00 0.00 H new ATOM 0 HD13 ILE A 22 79.869 -1.470 0.128 1.00 0.00 H new ATOM 324 N GLY A 23 80.669 -5.920 -3.561 1.00 0.00 N ATOM 325 CA GLY A 23 80.421 -7.373 -3.762 1.00 0.00 C ATOM 326 C GLY A 23 81.127 -8.174 -2.670 1.00 0.00 C ATOM 327 O GLY A 23 81.675 -7.624 -1.736 1.00 0.00 O ATOM 0 H GLY A 23 81.633 -5.669 -3.341 1.00 0.00 H new ATOM 0 HA2 GLY A 23 79.350 -7.575 -3.739 1.00 0.00 H new ATOM 0 HA3 GLY A 23 80.783 -7.681 -4.743 1.00 0.00 H new ATOM 331 N ASN A 24 81.114 -9.474 -2.783 1.00 0.00 N ATOM 332 CA ASN A 24 81.781 -10.333 -1.758 1.00 0.00 C ATOM 333 C ASN A 24 80.969 -10.335 -0.461 1.00 0.00 C ATOM 334 O ASN A 24 81.359 -9.750 0.530 1.00 0.00 O ATOM 335 CB ASN A 24 83.159 -9.706 -1.532 1.00 0.00 C ATOM 336 CG ASN A 24 84.216 -10.809 -1.457 1.00 0.00 C ATOM 337 OD1 ASN A 24 84.546 -11.301 -0.295 1.00 0.00 O flip ATOM 338 ND2 ASN A 24 84.747 -11.228 -2.467 1.00 0.00 N flip ATOM 0 H ASN A 24 80.667 -9.983 -3.546 1.00 0.00 H new ATOM 0 HA ASN A 24 81.862 -11.370 -2.084 1.00 0.00 H new ATOM 0 HB2 ASN A 24 83.394 -9.017 -2.343 1.00 0.00 H new ATOM 0 HB3 ASN A 24 83.159 -9.125 -0.610 1.00 0.00 H new ATOM 0 HD21 ASN A 24 84.489 -10.843 -3.376 1.00 0.00 H new ATOM 0 HD22 ASN A 24 85.450 -11.964 -2.406 1.00 0.00 H new ATOM 345 N LEU A 25 79.842 -10.994 -0.462 1.00 0.00 N ATOM 346 CA LEU A 25 79.003 -11.041 0.768 1.00 0.00 C ATOM 347 C LEU A 25 78.897 -12.478 1.277 1.00 0.00 C ATOM 348 O LEU A 25 79.221 -13.420 0.582 1.00 0.00 O ATOM 349 CB LEU A 25 77.632 -10.520 0.333 1.00 0.00 C ATOM 350 CG LEU A 25 77.676 -8.995 0.223 1.00 0.00 C ATOM 351 CD1 LEU A 25 78.130 -8.397 1.555 1.00 0.00 C ATOM 352 CD2 LEU A 25 78.660 -8.592 -0.877 1.00 0.00 C ATOM 0 H LEU A 25 79.466 -11.502 -1.263 1.00 0.00 H new ATOM 0 HA LEU A 25 79.423 -10.447 1.580 1.00 0.00 H new ATOM 0 HB2 LEU A 25 77.353 -10.956 -0.626 1.00 0.00 H new ATOM 0 HB3 LEU A 25 76.872 -10.821 1.053 1.00 0.00 H new ATOM 0 HG LEU A 25 76.682 -8.621 -0.021 1.00 0.00 H new ATOM 0 HD11 LEU A 25 78.161 -7.310 1.474 1.00 0.00 H new ATOM 0 HD12 LEU A 25 77.430 -8.683 2.340 1.00 0.00 H new ATOM 0 HD13 LEU A 25 79.124 -8.771 1.802 1.00 0.00 H new ATOM 0 HD21 LEU A 25 78.692 -7.505 -0.956 1.00 0.00 H new ATOM 0 HD22 LEU A 25 79.653 -8.967 -0.632 1.00 0.00 H new ATOM 0 HD23 LEU A 25 78.336 -9.016 -1.828 1.00 0.00 H new ATOM 364 N ASN A 26 78.449 -12.652 2.487 1.00 0.00 N ATOM 365 CA ASN A 26 78.325 -14.025 3.047 1.00 0.00 C ATOM 366 C ASN A 26 76.902 -14.552 2.853 1.00 0.00 C ATOM 367 O ASN A 26 75.983 -14.124 3.523 1.00 0.00 O ATOM 368 CB ASN A 26 78.643 -13.862 4.532 1.00 0.00 C ATOM 369 CG ASN A 26 78.559 -15.222 5.227 1.00 0.00 C ATOM 370 OD1 ASN A 26 78.563 -16.251 4.578 1.00 0.00 O ATOM 371 ND2 ASN A 26 78.484 -15.273 6.529 1.00 0.00 N ATOM 0 H ASN A 26 78.162 -11.901 3.114 1.00 0.00 H new ATOM 0 HA ASN A 26 78.990 -14.738 2.559 1.00 0.00 H new ATOM 0 HB2 ASN A 26 79.640 -13.440 4.656 1.00 0.00 H new ATOM 0 HB3 ASN A 26 77.942 -13.164 4.990 1.00 0.00 H new ATOM 0 HD21 ASN A 26 78.429 -16.175 7.002 1.00 0.00 H new ATOM 0 HD22 ASN A 26 78.481 -14.411 7.074 1.00 0.00 H new ATOM 378 N PRO A 27 76.771 -15.469 1.935 1.00 0.00 N ATOM 379 CA PRO A 27 75.447 -16.070 1.639 1.00 0.00 C ATOM 380 C PRO A 27 75.032 -17.028 2.759 1.00 0.00 C ATOM 381 O PRO A 27 73.891 -17.433 2.852 1.00 0.00 O ATOM 382 CB PRO A 27 75.682 -16.826 0.334 1.00 0.00 C ATOM 383 CG PRO A 27 77.148 -17.122 0.314 1.00 0.00 C ATOM 384 CD PRO A 27 77.833 -16.027 1.093 1.00 0.00 C ATOM 0 HA PRO A 27 74.648 -15.332 1.561 1.00 0.00 H new ATOM 0 HB2 PRO A 27 75.094 -17.743 0.298 1.00 0.00 H new ATOM 0 HB3 PRO A 27 75.389 -16.226 -0.528 1.00 0.00 H new ATOM 0 HG2 PRO A 27 77.350 -18.096 0.760 1.00 0.00 H new ATOM 0 HG3 PRO A 27 77.520 -17.157 -0.710 1.00 0.00 H new ATOM 0 HD2 PRO A 27 78.654 -16.419 1.694 1.00 0.00 H new ATOM 0 HD3 PRO A 27 78.255 -15.271 0.431 1.00 0.00 H new ATOM 392 N ASN A 28 75.951 -17.392 3.613 1.00 0.00 N ATOM 393 CA ASN A 28 75.605 -18.321 4.728 1.00 0.00 C ATOM 394 C ASN A 28 74.894 -17.554 5.843 1.00 0.00 C ATOM 395 O ASN A 28 74.240 -18.130 6.691 1.00 0.00 O ATOM 396 CB ASN A 28 76.946 -18.868 5.220 1.00 0.00 C ATOM 397 CG ASN A 28 77.370 -20.045 4.340 1.00 0.00 C ATOM 398 OD1 ASN A 28 77.415 -19.893 3.045 1.00 0.00 O flip ATOM 399 ND2 ASN A 28 77.665 -21.114 4.837 1.00 0.00 N flip ATOM 0 H ASN A 28 76.924 -17.087 3.587 1.00 0.00 H new ATOM 0 HA ASN A 28 74.934 -19.120 4.412 1.00 0.00 H new ATOM 0 HB2 ASN A 28 77.704 -18.085 5.189 1.00 0.00 H new ATOM 0 HB3 ASN A 28 76.861 -19.188 6.258 1.00 0.00 H new ATOM 0 HD21 ASN A 28 77.630 -21.233 5.849 1.00 0.00 H new ATOM 0 HD22 ASN A 28 77.948 -21.892 4.242 1.00 0.00 H new ATOM 406 N LYS A 29 75.015 -16.257 5.843 1.00 0.00 N ATOM 407 CA LYS A 29 74.346 -15.440 6.893 1.00 0.00 C ATOM 408 C LYS A 29 73.249 -14.582 6.263 1.00 0.00 C ATOM 409 O LYS A 29 72.717 -14.907 5.221 1.00 0.00 O ATOM 410 CB LYS A 29 75.453 -14.561 7.475 1.00 0.00 C ATOM 411 CG LYS A 29 75.656 -14.911 8.951 1.00 0.00 C ATOM 412 CD LYS A 29 74.479 -14.377 9.769 1.00 0.00 C ATOM 413 CE LYS A 29 74.291 -15.241 11.019 1.00 0.00 C ATOM 414 NZ LYS A 29 72.979 -15.917 10.824 1.00 0.00 N ATOM 0 H LYS A 29 75.551 -15.725 5.158 1.00 0.00 H new ATOM 0 HA LYS A 29 73.871 -16.052 7.660 1.00 0.00 H new ATOM 0 HB2 LYS A 29 76.381 -14.712 6.923 1.00 0.00 H new ATOM 0 HB3 LYS A 29 75.189 -13.509 7.372 1.00 0.00 H new ATOM 0 HG2 LYS A 29 75.736 -15.991 9.072 1.00 0.00 H new ATOM 0 HG3 LYS A 29 76.589 -14.480 9.313 1.00 0.00 H new ATOM 0 HD2 LYS A 29 74.661 -13.341 10.054 1.00 0.00 H new ATOM 0 HD3 LYS A 29 73.570 -14.387 9.167 1.00 0.00 H new ATOM 0 HE2 LYS A 29 75.098 -15.967 11.123 1.00 0.00 H new ATOM 0 HE3 LYS A 29 74.291 -14.633 11.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 72.779 -16.529 11.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 72.230 -15.201 10.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 73.011 -16.494 9.959 1.00 0.00 H new ATOM 428 N SER A 30 72.907 -13.490 6.884 1.00 0.00 N ATOM 429 CA SER A 30 71.842 -12.618 6.314 1.00 0.00 C ATOM 430 C SER A 30 72.459 -11.424 5.591 1.00 0.00 C ATOM 431 O SER A 30 73.446 -10.857 6.026 1.00 0.00 O ATOM 432 CB SER A 30 71.035 -12.132 7.508 1.00 0.00 C ATOM 433 OG SER A 30 71.007 -13.145 8.505 1.00 0.00 O ATOM 0 H SER A 30 73.317 -13.163 7.759 1.00 0.00 H new ATOM 0 HA SER A 30 71.229 -13.156 5.591 1.00 0.00 H new ATOM 0 HB2 SER A 30 71.476 -11.221 7.912 1.00 0.00 H new ATOM 0 HB3 SER A 30 70.020 -11.884 7.198 1.00 0.00 H new ATOM 0 HG SER A 30 70.489 -12.832 9.275 1.00 0.00 H new ATOM 439 N VAL A 31 71.877 -11.024 4.499 1.00 0.00 N ATOM 440 CA VAL A 31 72.428 -9.856 3.768 1.00 0.00 C ATOM 441 C VAL A 31 72.237 -8.599 4.614 1.00 0.00 C ATOM 442 O VAL A 31 73.046 -7.693 4.591 1.00 0.00 O ATOM 443 CB VAL A 31 71.637 -9.769 2.462 1.00 0.00 C ATOM 444 CG1 VAL A 31 72.415 -8.919 1.455 1.00 0.00 C ATOM 445 CG2 VAL A 31 71.434 -11.173 1.884 1.00 0.00 C ATOM 0 H VAL A 31 71.050 -11.452 4.084 1.00 0.00 H new ATOM 0 HA VAL A 31 73.495 -9.954 3.565 1.00 0.00 H new ATOM 0 HB VAL A 31 70.666 -9.315 2.659 1.00 0.00 H new ATOM 0 HG11 VAL A 31 71.854 -8.855 0.523 1.00 0.00 H new ATOM 0 HG12 VAL A 31 72.561 -7.918 1.860 1.00 0.00 H new ATOM 0 HG13 VAL A 31 73.385 -9.378 1.264 1.00 0.00 H new ATOM 0 HG21 VAL A 31 70.870 -11.105 0.954 1.00 0.00 H new ATOM 0 HG22 VAL A 31 72.404 -11.629 1.688 1.00 0.00 H new ATOM 0 HG23 VAL A 31 70.883 -11.785 2.599 1.00 0.00 H new ATOM 455 N ALA A 32 71.181 -8.547 5.381 1.00 0.00 N ATOM 456 CA ALA A 32 70.952 -7.360 6.248 1.00 0.00 C ATOM 457 C ALA A 32 72.065 -7.286 7.293 1.00 0.00 C ATOM 458 O ALA A 32 72.566 -6.227 7.615 1.00 0.00 O ATOM 459 CB ALA A 32 69.597 -7.604 6.915 1.00 0.00 C ATOM 0 H ALA A 32 70.469 -9.275 5.443 1.00 0.00 H new ATOM 0 HA ALA A 32 70.956 -6.421 5.694 1.00 0.00 H new ATOM 0 HB1 ALA A 32 69.359 -6.768 7.572 1.00 0.00 H new ATOM 0 HB2 ALA A 32 68.826 -7.695 6.150 1.00 0.00 H new ATOM 0 HB3 ALA A 32 69.639 -8.523 7.499 1.00 0.00 H new ATOM 465 N GLU A 33 72.467 -8.416 7.807 1.00 0.00 N ATOM 466 CA GLU A 33 73.563 -8.428 8.815 1.00 0.00 C ATOM 467 C GLU A 33 74.847 -7.919 8.163 1.00 0.00 C ATOM 468 O GLU A 33 75.633 -7.221 8.773 1.00 0.00 O ATOM 469 CB GLU A 33 73.708 -9.894 9.229 1.00 0.00 C ATOM 470 CG GLU A 33 72.418 -10.367 9.902 1.00 0.00 C ATOM 471 CD GLU A 33 72.340 -9.792 11.317 1.00 0.00 C ATOM 472 OE1 GLU A 33 73.384 -9.478 11.866 1.00 0.00 O ATOM 473 OE2 GLU A 33 71.238 -9.673 11.827 1.00 0.00 O ATOM 0 H GLU A 33 72.083 -9.331 7.572 1.00 0.00 H new ATOM 0 HA GLU A 33 73.357 -7.791 9.675 1.00 0.00 H new ATOM 0 HB2 GLU A 33 73.921 -10.510 8.355 1.00 0.00 H new ATOM 0 HB3 GLU A 33 74.550 -10.008 9.912 1.00 0.00 H new ATOM 0 HG2 GLU A 33 71.553 -10.047 9.320 1.00 0.00 H new ATOM 0 HG3 GLU A 33 72.393 -11.456 9.939 1.00 0.00 H new ATOM 480 N LEU A 34 75.056 -8.249 6.917 1.00 0.00 N ATOM 481 CA LEU A 34 76.269 -7.771 6.215 1.00 0.00 C ATOM 482 C LEU A 34 76.249 -6.247 6.176 1.00 0.00 C ATOM 483 O LEU A 34 77.259 -5.592 6.344 1.00 0.00 O ATOM 484 CB LEU A 34 76.147 -8.355 4.812 1.00 0.00 C ATOM 485 CG LEU A 34 76.323 -9.873 4.875 1.00 0.00 C ATOM 486 CD1 LEU A 34 76.001 -10.483 3.510 1.00 0.00 C ATOM 487 CD2 LEU A 34 77.768 -10.202 5.253 1.00 0.00 C ATOM 0 H LEU A 34 74.433 -8.832 6.358 1.00 0.00 H new ATOM 0 HA LEU A 34 77.200 -8.071 6.696 1.00 0.00 H new ATOM 0 HB2 LEU A 34 75.174 -8.108 4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 34 76.901 -7.918 4.158 1.00 0.00 H new ATOM 0 HG LEU A 34 75.647 -10.286 5.624 1.00 0.00 H new ATOM 0 HD11 LEU A 34 76.127 -11.565 3.556 1.00 0.00 H new ATOM 0 HD12 LEU A 34 74.971 -10.249 3.241 1.00 0.00 H new ATOM 0 HD13 LEU A 34 76.675 -10.071 2.759 1.00 0.00 H new ATOM 0 HD21 LEU A 34 77.895 -11.284 5.298 1.00 0.00 H new ATOM 0 HD22 LEU A 34 78.443 -9.788 4.504 1.00 0.00 H new ATOM 0 HD23 LEU A 34 77.997 -9.769 6.227 1.00 0.00 H new ATOM 499 N LYS A 35 75.093 -5.680 5.973 1.00 0.00 N ATOM 500 CA LYS A 35 74.989 -4.198 5.942 1.00 0.00 C ATOM 501 C LYS A 35 75.478 -3.638 7.277 1.00 0.00 C ATOM 502 O LYS A 35 76.314 -2.758 7.331 1.00 0.00 O ATOM 503 CB LYS A 35 73.502 -3.900 5.741 1.00 0.00 C ATOM 504 CG LYS A 35 73.024 -4.540 4.435 1.00 0.00 C ATOM 505 CD LYS A 35 73.798 -3.943 3.259 1.00 0.00 C ATOM 506 CE LYS A 35 74.444 -5.070 2.449 1.00 0.00 C ATOM 507 NZ LYS A 35 75.833 -4.603 2.180 1.00 0.00 N ATOM 0 H LYS A 35 74.216 -6.180 5.827 1.00 0.00 H new ATOM 0 HA LYS A 35 75.591 -3.747 5.153 1.00 0.00 H new ATOM 0 HB2 LYS A 35 72.926 -4.288 6.581 1.00 0.00 H new ATOM 0 HB3 LYS A 35 73.337 -2.823 5.712 1.00 0.00 H new ATOM 0 HG2 LYS A 35 73.173 -5.619 4.471 1.00 0.00 H new ATOM 0 HG3 LYS A 35 71.955 -4.370 4.304 1.00 0.00 H new ATOM 0 HD2 LYS A 35 73.127 -3.363 2.625 1.00 0.00 H new ATOM 0 HD3 LYS A 35 74.563 -3.258 3.624 1.00 0.00 H new ATOM 0 HE2 LYS A 35 74.443 -6.007 3.006 1.00 0.00 H new ATOM 0 HE3 LYS A 35 73.901 -5.250 1.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 76.448 -5.424 2.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 75.836 -3.987 1.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 76.186 -4.072 3.002 1.00 0.00 H new ATOM 521 N VAL A 36 74.970 -4.163 8.359 1.00 0.00 N ATOM 522 CA VAL A 36 75.409 -3.692 9.701 1.00 0.00 C ATOM 523 C VAL A 36 76.903 -3.921 9.860 1.00 0.00 C ATOM 524 O VAL A 36 77.594 -3.117 10.432 1.00 0.00 O ATOM 525 CB VAL A 36 74.636 -4.550 10.693 1.00 0.00 C ATOM 526 CG1 VAL A 36 74.781 -3.967 12.099 1.00 0.00 C ATOM 527 CG2 VAL A 36 73.157 -4.580 10.301 1.00 0.00 C ATOM 0 H VAL A 36 74.266 -4.901 8.370 1.00 0.00 H new ATOM 0 HA VAL A 36 75.223 -2.629 9.851 1.00 0.00 H new ATOM 0 HB VAL A 36 75.035 -5.564 10.680 1.00 0.00 H new ATOM 0 HG11 VAL A 36 74.227 -4.583 12.807 1.00 0.00 H new ATOM 0 HG12 VAL A 36 75.834 -3.950 12.379 1.00 0.00 H new ATOM 0 HG13 VAL A 36 74.385 -2.951 12.114 1.00 0.00 H new ATOM 0 HG21 VAL A 36 72.605 -5.195 11.012 1.00 0.00 H new ATOM 0 HG22 VAL A 36 72.757 -3.566 10.311 1.00 0.00 H new ATOM 0 HG23 VAL A 36 73.054 -5.001 9.301 1.00 0.00 H new ATOM 537 N ALA A 37 77.414 -5.007 9.353 1.00 0.00 N ATOM 538 CA ALA A 37 78.874 -5.251 9.486 1.00 0.00 C ATOM 539 C ALA A 37 79.633 -4.133 8.781 1.00 0.00 C ATOM 540 O ALA A 37 80.734 -3.787 9.152 1.00 0.00 O ATOM 541 CB ALA A 37 79.126 -6.597 8.807 1.00 0.00 C ATOM 0 H ALA A 37 76.890 -5.728 8.858 1.00 0.00 H new ATOM 0 HA ALA A 37 79.207 -5.269 10.524 1.00 0.00 H new ATOM 0 HB1 ALA A 37 80.186 -6.842 8.867 1.00 0.00 H new ATOM 0 HB2 ALA A 37 78.546 -7.372 9.308 1.00 0.00 H new ATOM 0 HB3 ALA A 37 78.826 -6.539 7.761 1.00 0.00 H new ATOM 547 N ILE A 38 79.039 -3.551 7.779 1.00 0.00 N ATOM 548 CA ILE A 38 79.714 -2.437 7.065 1.00 0.00 C ATOM 549 C ILE A 38 79.382 -1.120 7.764 1.00 0.00 C ATOM 550 O ILE A 38 80.153 -0.181 7.745 1.00 0.00 O ATOM 551 CB ILE A 38 79.140 -2.461 5.649 1.00 0.00 C ATOM 552 CG1 ILE A 38 79.672 -3.687 4.903 1.00 0.00 C ATOM 553 CG2 ILE A 38 79.559 -1.192 4.905 1.00 0.00 C ATOM 554 CD1 ILE A 38 78.561 -4.280 4.035 1.00 0.00 C ATOM 0 H ILE A 38 78.115 -3.799 7.424 1.00 0.00 H new ATOM 0 HA ILE A 38 80.799 -2.537 7.053 1.00 0.00 H new ATOM 0 HB ILE A 38 78.052 -2.509 5.700 1.00 0.00 H new ATOM 0 HG12 ILE A 38 80.523 -3.407 4.282 1.00 0.00 H new ATOM 0 HG13 ILE A 38 80.029 -4.432 5.614 1.00 0.00 H new ATOM 0 HG21 ILE A 38 79.149 -1.210 3.895 1.00 0.00 H new ATOM 0 HG22 ILE A 38 79.180 -0.318 5.435 1.00 0.00 H new ATOM 0 HG23 ILE A 38 80.647 -1.142 4.854 1.00 0.00 H new ATOM 0 HD11 ILE A 38 78.941 -5.153 3.504 1.00 0.00 H new ATOM 0 HD12 ILE A 38 77.724 -4.576 4.667 1.00 0.00 H new ATOM 0 HD13 ILE A 38 78.225 -3.535 3.314 1.00 0.00 H new ATOM 566 N SER A 39 78.243 -1.050 8.402 1.00 0.00 N ATOM 567 CA SER A 39 77.877 0.204 9.118 1.00 0.00 C ATOM 568 C SER A 39 78.587 0.235 10.470 1.00 0.00 C ATOM 569 O SER A 39 78.838 1.280 11.038 1.00 0.00 O ATOM 570 CB SER A 39 76.362 0.133 9.303 1.00 0.00 C ATOM 571 OG SER A 39 75.968 1.060 10.306 1.00 0.00 O ATOM 0 H SER A 39 77.556 -1.802 8.457 1.00 0.00 H new ATOM 0 HA SER A 39 78.168 1.103 8.574 1.00 0.00 H new ATOM 0 HB2 SER A 39 75.858 0.360 8.363 1.00 0.00 H new ATOM 0 HB3 SER A 39 76.066 -0.877 9.588 1.00 0.00 H new ATOM 0 HG SER A 39 74.996 1.018 10.427 1.00 0.00 H new ATOM 577 N GLU A 40 78.926 -0.916 10.979 1.00 0.00 N ATOM 578 CA GLU A 40 79.630 -0.980 12.281 1.00 0.00 C ATOM 579 C GLU A 40 81.127 -0.818 12.048 1.00 0.00 C ATOM 580 O GLU A 40 81.823 -0.174 12.808 1.00 0.00 O ATOM 581 CB GLU A 40 79.304 -2.364 12.824 1.00 0.00 C ATOM 582 CG GLU A 40 78.459 -2.234 14.092 1.00 0.00 C ATOM 583 CD GLU A 40 77.149 -1.517 13.761 1.00 0.00 C ATOM 584 OE1 GLU A 40 77.191 -0.572 12.991 1.00 0.00 O ATOM 585 OE2 GLU A 40 76.125 -1.925 14.284 1.00 0.00 O ATOM 0 H GLU A 40 78.742 -1.819 10.543 1.00 0.00 H new ATOM 0 HA GLU A 40 79.328 -0.197 12.977 1.00 0.00 H new ATOM 0 HB2 GLU A 40 78.765 -2.942 12.074 1.00 0.00 H new ATOM 0 HB3 GLU A 40 80.224 -2.906 13.043 1.00 0.00 H new ATOM 0 HG2 GLU A 40 78.251 -3.221 14.506 1.00 0.00 H new ATOM 0 HG3 GLU A 40 79.008 -1.678 14.852 1.00 0.00 H new ATOM 592 N LEU A 41 81.618 -1.379 10.982 1.00 0.00 N ATOM 593 CA LEU A 41 83.065 -1.239 10.673 1.00 0.00 C ATOM 594 C LEU A 41 83.348 0.217 10.329 1.00 0.00 C ATOM 595 O LEU A 41 84.390 0.756 10.646 1.00 0.00 O ATOM 596 CB LEU A 41 83.315 -2.138 9.463 1.00 0.00 C ATOM 597 CG LEU A 41 84.738 -2.693 9.526 1.00 0.00 C ATOM 598 CD1 LEU A 41 84.695 -4.220 9.476 1.00 0.00 C ATOM 599 CD2 LEU A 41 85.542 -2.167 8.335 1.00 0.00 C ATOM 0 H LEU A 41 81.080 -1.928 10.311 1.00 0.00 H new ATOM 0 HA LEU A 41 83.708 -1.521 11.507 1.00 0.00 H new ATOM 0 HB2 LEU A 41 82.595 -2.956 9.449 1.00 0.00 H new ATOM 0 HB3 LEU A 41 83.174 -1.573 8.541 1.00 0.00 H new ATOM 0 HG LEU A 41 85.211 -2.374 10.455 1.00 0.00 H new ATOM 0 HD11 LEU A 41 85.710 -4.614 9.521 1.00 0.00 H new ATOM 0 HD12 LEU A 41 84.122 -4.596 10.324 1.00 0.00 H new ATOM 0 HD13 LEU A 41 84.222 -4.540 8.548 1.00 0.00 H new ATOM 0 HD21 LEU A 41 86.557 -2.562 8.378 1.00 0.00 H new ATOM 0 HD22 LEU A 41 85.068 -2.486 7.407 1.00 0.00 H new ATOM 0 HD23 LEU A 41 85.574 -1.078 8.370 1.00 0.00 H new ATOM 611 N PHE A 42 82.411 0.861 9.696 1.00 0.00 N ATOM 612 CA PHE A 42 82.593 2.281 9.342 1.00 0.00 C ATOM 613 C PHE A 42 82.220 3.137 10.551 1.00 0.00 C ATOM 614 O PHE A 42 82.655 4.261 10.693 1.00 0.00 O ATOM 615 CB PHE A 42 81.622 2.510 8.192 1.00 0.00 C ATOM 616 CG PHE A 42 82.170 1.890 6.925 1.00 0.00 C ATOM 617 CD1 PHE A 42 82.465 0.521 6.881 1.00 0.00 C ATOM 618 CD2 PHE A 42 82.381 2.686 5.793 1.00 0.00 C ATOM 619 CE1 PHE A 42 82.970 -0.050 5.706 1.00 0.00 C ATOM 620 CE2 PHE A 42 82.886 2.114 4.619 1.00 0.00 C ATOM 621 CZ PHE A 42 83.181 0.747 4.575 1.00 0.00 C ATOM 0 H PHE A 42 81.521 0.455 9.409 1.00 0.00 H new ATOM 0 HA PHE A 42 83.615 2.537 9.061 1.00 0.00 H new ATOM 0 HB2 PHE A 42 80.652 2.074 8.431 1.00 0.00 H new ATOM 0 HB3 PHE A 42 81.463 3.578 8.045 1.00 0.00 H new ATOM 0 HD1 PHE A 42 82.303 -0.094 7.754 1.00 0.00 H new ATOM 0 HD2 PHE A 42 82.154 3.741 5.825 1.00 0.00 H new ATOM 0 HE1 PHE A 42 83.197 -1.105 5.673 1.00 0.00 H new ATOM 0 HE2 PHE A 42 83.048 2.729 3.746 1.00 0.00 H new ATOM 0 HZ PHE A 42 83.571 0.307 3.669 1.00 0.00 H new ATOM 631 N ALA A 43 81.424 2.595 11.435 1.00 0.00 N ATOM 632 CA ALA A 43 81.031 3.362 12.651 1.00 0.00 C ATOM 633 C ALA A 43 82.215 3.406 13.616 1.00 0.00 C ATOM 634 O ALA A 43 82.427 4.375 14.317 1.00 0.00 O ATOM 635 CB ALA A 43 79.866 2.580 13.258 1.00 0.00 C ATOM 0 H ALA A 43 81.030 1.656 11.367 1.00 0.00 H new ATOM 0 HA ALA A 43 80.746 4.391 12.432 1.00 0.00 H new ATOM 0 HB1 ALA A 43 79.520 3.084 14.160 1.00 0.00 H new ATOM 0 HB2 ALA A 43 79.050 2.525 12.538 1.00 0.00 H new ATOM 0 HB3 ALA A 43 80.196 1.572 13.509 1.00 0.00 H new ATOM 641 N LYS A 44 82.995 2.360 13.642 1.00 0.00 N ATOM 642 CA LYS A 44 84.180 2.330 14.542 1.00 0.00 C ATOM 643 C LYS A 44 85.396 2.882 13.797 1.00 0.00 C ATOM 644 O LYS A 44 86.383 3.268 14.392 1.00 0.00 O ATOM 645 CB LYS A 44 84.382 0.852 14.883 1.00 0.00 C ATOM 646 CG LYS A 44 83.681 0.532 16.204 1.00 0.00 C ATOM 647 CD LYS A 44 82.887 -0.768 16.059 1.00 0.00 C ATOM 648 CE LYS A 44 83.059 -1.617 17.321 1.00 0.00 C ATOM 649 NZ LYS A 44 84.460 -2.120 17.257 1.00 0.00 N ATOM 0 H LYS A 44 82.861 1.522 13.076 1.00 0.00 H new ATOM 0 HA LYS A 44 84.045 2.934 15.439 1.00 0.00 H new ATOM 0 HB2 LYS A 44 83.981 0.226 14.086 1.00 0.00 H new ATOM 0 HB3 LYS A 44 85.446 0.628 14.960 1.00 0.00 H new ATOM 0 HG2 LYS A 44 84.416 0.435 17.003 1.00 0.00 H new ATOM 0 HG3 LYS A 44 83.014 1.349 16.481 1.00 0.00 H new ATOM 0 HD2 LYS A 44 81.832 -0.546 15.899 1.00 0.00 H new ATOM 0 HD3 LYS A 44 83.232 -1.322 15.186 1.00 0.00 H new ATOM 0 HE2 LYS A 44 82.893 -1.025 18.221 1.00 0.00 H new ATOM 0 HE3 LYS A 44 82.345 -2.440 17.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 84.474 -3.136 17.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 84.840 -1.968 16.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 85.045 -1.607 17.947 1.00 0.00 H new ATOM 663 N ASN A 45 85.324 2.925 12.495 1.00 0.00 N ATOM 664 CA ASN A 45 86.461 3.454 11.696 1.00 0.00 C ATOM 665 C ASN A 45 86.401 4.982 11.655 1.00 0.00 C ATOM 666 O ASN A 45 87.380 5.635 11.354 1.00 0.00 O ATOM 667 CB ASN A 45 86.260 2.869 10.300 1.00 0.00 C ATOM 668 CG ASN A 45 87.093 1.596 10.154 1.00 0.00 C ATOM 669 OD1 ASN A 45 86.892 0.605 10.978 1.00 0.00 O flip ATOM 670 ND2 ASN A 45 87.934 1.502 9.283 1.00 0.00 N flip ATOM 0 H ASN A 45 84.521 2.614 11.949 1.00 0.00 H new ATOM 0 HA ASN A 45 87.431 3.185 12.114 1.00 0.00 H new ATOM 0 HB2 ASN A 45 85.206 2.647 10.136 1.00 0.00 H new ATOM 0 HB3 ASN A 45 86.554 3.597 9.544 1.00 0.00 H new ATOM 0 HD21 ASN A 45 88.090 2.278 8.639 1.00 0.00 H new ATOM 0 HD22 ASN A 45 88.484 0.647 9.195 1.00 0.00 H new ATOM 677 N ASP A 46 85.242 5.538 11.940 1.00 0.00 N ATOM 678 CA ASP A 46 85.040 7.026 11.923 1.00 0.00 C ATOM 679 C ASP A 46 84.561 7.440 10.543 1.00 0.00 C ATOM 680 O ASP A 46 84.802 8.537 10.080 1.00 0.00 O ATOM 681 CB ASP A 46 86.383 7.683 12.264 1.00 0.00 C ATOM 682 CG ASP A 46 86.135 9.064 12.873 1.00 0.00 C ATOM 683 OD1 ASP A 46 85.460 9.131 13.887 1.00 0.00 O ATOM 684 OD2 ASP A 46 86.626 10.032 12.316 1.00 0.00 O ATOM 0 H ASP A 46 84.408 5.007 12.190 1.00 0.00 H new ATOM 0 HA ASP A 46 84.291 7.338 12.651 1.00 0.00 H new ATOM 0 HB2 ASP A 46 86.938 7.059 12.965 1.00 0.00 H new ATOM 0 HB3 ASP A 46 86.994 7.774 11.366 1.00 0.00 H new ATOM 689 N LEU A 47 83.867 6.555 9.892 1.00 0.00 N ATOM 690 CA LEU A 47 83.338 6.862 8.542 1.00 0.00 C ATOM 691 C LEU A 47 81.968 7.528 8.681 1.00 0.00 C ATOM 692 O LEU A 47 81.745 8.334 9.563 1.00 0.00 O ATOM 693 CB LEU A 47 83.228 5.494 7.855 1.00 0.00 C ATOM 694 CG LEU A 47 83.861 5.564 6.465 1.00 0.00 C ATOM 695 CD1 LEU A 47 83.115 6.593 5.614 1.00 0.00 C ATOM 696 CD2 LEU A 47 85.330 5.978 6.595 1.00 0.00 C ATOM 0 H LEU A 47 83.642 5.624 10.242 1.00 0.00 H new ATOM 0 HA LEU A 47 83.967 7.545 7.971 1.00 0.00 H new ATOM 0 HB2 LEU A 47 83.728 4.734 8.455 1.00 0.00 H new ATOM 0 HB3 LEU A 47 82.182 5.200 7.774 1.00 0.00 H new ATOM 0 HG LEU A 47 83.799 4.586 5.988 1.00 0.00 H new ATOM 0 HD11 LEU A 47 83.567 6.642 4.623 1.00 0.00 H new ATOM 0 HD12 LEU A 47 82.069 6.299 5.522 1.00 0.00 H new ATOM 0 HD13 LEU A 47 83.176 7.572 6.090 1.00 0.00 H new ATOM 0 HD21 LEU A 47 85.783 6.028 5.605 1.00 0.00 H new ATOM 0 HD22 LEU A 47 85.392 6.956 7.072 1.00 0.00 H new ATOM 0 HD23 LEU A 47 85.862 5.245 7.201 1.00 0.00 H new ATOM 708 N ALA A 48 81.051 7.196 7.827 1.00 0.00 N ATOM 709 CA ALA A 48 79.693 7.801 7.910 1.00 0.00 C ATOM 710 C ALA A 48 78.802 7.210 6.822 1.00 0.00 C ATOM 711 O ALA A 48 78.285 7.908 5.973 1.00 0.00 O ATOM 712 CB ALA A 48 79.904 9.297 7.689 1.00 0.00 C ATOM 0 H ALA A 48 81.180 6.527 7.068 1.00 0.00 H new ATOM 0 HA ALA A 48 79.206 7.606 8.865 1.00 0.00 H new ATOM 0 HB1 ALA A 48 78.944 9.811 7.736 1.00 0.00 H new ATOM 0 HB2 ALA A 48 80.564 9.690 8.462 1.00 0.00 H new ATOM 0 HB3 ALA A 48 80.355 9.460 6.710 1.00 0.00 H new ATOM 718 N VAL A 49 78.627 5.922 6.847 1.00 0.00 N ATOM 719 CA VAL A 49 77.784 5.260 5.833 1.00 0.00 C ATOM 720 C VAL A 49 76.392 5.874 5.826 1.00 0.00 C ATOM 721 O VAL A 49 75.658 5.820 6.793 1.00 0.00 O ATOM 722 CB VAL A 49 77.736 3.798 6.263 1.00 0.00 C ATOM 723 CG1 VAL A 49 79.082 3.134 5.970 1.00 0.00 C ATOM 724 CG2 VAL A 49 77.440 3.715 7.763 1.00 0.00 C ATOM 0 H VAL A 49 79.040 5.296 7.538 1.00 0.00 H new ATOM 0 HA VAL A 49 78.177 5.372 4.822 1.00 0.00 H new ATOM 0 HB VAL A 49 76.950 3.283 5.710 1.00 0.00 H new ATOM 0 HG11 VAL A 49 79.047 2.089 6.278 1.00 0.00 H new ATOM 0 HG12 VAL A 49 79.291 3.191 4.902 1.00 0.00 H new ATOM 0 HG13 VAL A 49 79.869 3.648 6.521 1.00 0.00 H new ATOM 0 HG21 VAL A 49 77.406 2.670 8.070 1.00 0.00 H new ATOM 0 HG22 VAL A 49 78.224 4.230 8.318 1.00 0.00 H new ATOM 0 HG23 VAL A 49 76.479 4.186 7.971 1.00 0.00 H new ATOM 734 N VAL A 50 76.038 6.461 4.731 1.00 0.00 N ATOM 735 CA VAL A 50 74.697 7.104 4.609 1.00 0.00 C ATOM 736 C VAL A 50 73.680 6.081 4.105 1.00 0.00 C ATOM 737 O VAL A 50 72.533 6.084 4.508 1.00 0.00 O ATOM 738 CB VAL A 50 74.871 8.235 3.584 1.00 0.00 C ATOM 739 CG1 VAL A 50 73.911 9.380 3.913 1.00 0.00 C ATOM 740 CG2 VAL A 50 76.305 8.764 3.626 1.00 0.00 C ATOM 0 H VAL A 50 76.623 6.528 3.898 1.00 0.00 H new ATOM 0 HA VAL A 50 74.335 7.484 5.564 1.00 0.00 H new ATOM 0 HB VAL A 50 74.656 7.844 2.590 1.00 0.00 H new ATOM 0 HG11 VAL A 50 74.037 10.181 3.184 1.00 0.00 H new ATOM 0 HG12 VAL A 50 72.884 9.015 3.878 1.00 0.00 H new ATOM 0 HG13 VAL A 50 74.127 9.761 4.911 1.00 0.00 H new ATOM 0 HG21 VAL A 50 76.419 9.565 2.896 1.00 0.00 H new ATOM 0 HG22 VAL A 50 76.522 9.148 4.623 1.00 0.00 H new ATOM 0 HG23 VAL A 50 76.998 7.957 3.389 1.00 0.00 H new ATOM 750 N ASP A 51 74.086 5.204 3.227 1.00 0.00 N ATOM 751 CA ASP A 51 73.126 4.187 2.708 1.00 0.00 C ATOM 752 C ASP A 51 73.821 2.842 2.480 1.00 0.00 C ATOM 753 O ASP A 51 74.982 2.780 2.128 1.00 0.00 O ATOM 754 CB ASP A 51 72.619 4.758 1.384 1.00 0.00 C ATOM 755 CG ASP A 51 71.355 4.010 0.956 1.00 0.00 C ATOM 756 OD1 ASP A 51 70.453 3.895 1.769 1.00 0.00 O ATOM 757 OD2 ASP A 51 71.312 3.564 -0.179 1.00 0.00 O ATOM 0 H ASP A 51 75.032 5.147 2.849 1.00 0.00 H new ATOM 0 HA ASP A 51 72.316 4.000 3.413 1.00 0.00 H new ATOM 0 HB2 ASP A 51 72.406 5.821 1.492 1.00 0.00 H new ATOM 0 HB3 ASP A 51 73.388 4.663 0.617 1.00 0.00 H new ATOM 762 N VAL A 52 73.106 1.767 2.672 1.00 0.00 N ATOM 763 CA VAL A 52 73.696 0.412 2.461 1.00 0.00 C ATOM 764 C VAL A 52 72.584 -0.578 2.095 1.00 0.00 C ATOM 765 O VAL A 52 71.502 -0.538 2.644 1.00 0.00 O ATOM 766 CB VAL A 52 74.338 0.020 3.798 1.00 0.00 C ATOM 767 CG1 VAL A 52 75.368 -1.086 3.562 1.00 0.00 C ATOM 768 CG2 VAL A 52 75.037 1.234 4.416 1.00 0.00 C ATOM 0 H VAL A 52 72.130 1.769 2.969 1.00 0.00 H new ATOM 0 HA VAL A 52 74.428 0.405 1.654 1.00 0.00 H new ATOM 0 HB VAL A 52 73.562 -0.335 4.477 1.00 0.00 H new ATOM 0 HG11 VAL A 52 75.825 -1.366 4.511 1.00 0.00 H new ATOM 0 HG12 VAL A 52 74.875 -1.955 3.126 1.00 0.00 H new ATOM 0 HG13 VAL A 52 76.139 -0.726 2.880 1.00 0.00 H new ATOM 0 HG21 VAL A 52 75.491 0.949 5.365 1.00 0.00 H new ATOM 0 HG22 VAL A 52 75.811 1.593 3.737 1.00 0.00 H new ATOM 0 HG23 VAL A 52 74.308 2.026 4.586 1.00 0.00 H new ATOM 778 N ARG A 53 72.837 -1.460 1.168 1.00 0.00 N ATOM 779 CA ARG A 53 71.789 -2.441 0.769 1.00 0.00 C ATOM 780 C ARG A 53 72.432 -3.666 0.113 1.00 0.00 C ATOM 781 O ARG A 53 73.637 -3.755 -0.013 1.00 0.00 O ATOM 782 CB ARG A 53 70.909 -1.695 -0.234 1.00 0.00 C ATOM 783 CG ARG A 53 69.503 -1.526 0.345 1.00 0.00 C ATOM 784 CD ARG A 53 69.032 -0.086 0.132 1.00 0.00 C ATOM 785 NE ARG A 53 67.593 -0.092 0.511 1.00 0.00 N ATOM 786 CZ ARG A 53 67.020 1.008 0.917 1.00 0.00 C ATOM 787 NH1 ARG A 53 66.633 1.901 0.048 1.00 0.00 N ATOM 788 NH2 ARG A 53 66.835 1.214 2.193 1.00 0.00 N ATOM 0 H ARG A 53 73.723 -1.544 0.670 1.00 0.00 H new ATOM 0 HA ARG A 53 71.216 -2.803 1.623 1.00 0.00 H new ATOM 0 HB2 ARG A 53 71.341 -0.720 -0.458 1.00 0.00 H new ATOM 0 HB3 ARG A 53 70.863 -2.246 -1.173 1.00 0.00 H new ATOM 0 HG2 ARG A 53 68.814 -2.220 -0.137 1.00 0.00 H new ATOM 0 HG3 ARG A 53 69.505 -1.765 1.408 1.00 0.00 H new ATOM 0 HD2 ARG A 53 69.600 0.610 0.749 1.00 0.00 H new ATOM 0 HD3 ARG A 53 69.166 0.224 -0.904 1.00 0.00 H new ATOM 0 HE ARG A 53 67.054 -0.956 0.453 1.00 0.00 H new ATOM 0 HH11 ARG A 53 66.778 1.739 -0.949 1.00 0.00 H new ATOM 0 HH12 ARG A 53 66.185 2.761 0.365 1.00 0.00 H new ATOM 0 HH21 ARG A 53 67.138 0.515 2.872 1.00 0.00 H new ATOM 0 HH22 ARG A 53 66.387 2.073 2.511 1.00 0.00 H new ATOM 802 N THR A 54 71.636 -4.613 -0.298 1.00 0.00 N ATOM 803 CA THR A 54 72.189 -5.833 -0.938 1.00 0.00 C ATOM 804 C THR A 54 72.423 -5.598 -2.434 1.00 0.00 C ATOM 805 O THR A 54 72.129 -4.543 -2.962 1.00 0.00 O ATOM 806 CB THR A 54 71.105 -6.889 -0.728 1.00 0.00 C ATOM 807 OG1 THR A 54 70.025 -6.638 -1.617 1.00 0.00 O ATOM 808 CG2 THR A 54 70.602 -6.835 0.717 1.00 0.00 C ATOM 0 H THR A 54 70.620 -4.592 -0.216 1.00 0.00 H new ATOM 0 HA THR A 54 73.150 -6.127 -0.516 1.00 0.00 H new ATOM 0 HB THR A 54 71.520 -7.877 -0.926 1.00 0.00 H new ATOM 0 HG1 THR A 54 69.329 -7.315 -1.485 1.00 0.00 H new ATOM 0 HG21 THR A 54 69.829 -7.590 0.862 1.00 0.00 H new ATOM 0 HG22 THR A 54 71.431 -7.029 1.398 1.00 0.00 H new ATOM 0 HG23 THR A 54 70.188 -5.848 0.921 1.00 0.00 H new ATOM 816 N GLY A 55 72.947 -6.577 -3.117 1.00 0.00 N ATOM 817 CA GLY A 55 73.202 -6.424 -4.577 1.00 0.00 C ATOM 818 C GLY A 55 72.780 -7.702 -5.304 1.00 0.00 C ATOM 819 O GLY A 55 73.115 -8.797 -4.897 1.00 0.00 O ATOM 0 H GLY A 55 73.211 -7.481 -2.725 1.00 0.00 H new ATOM 0 HA2 GLY A 55 72.647 -5.571 -4.967 1.00 0.00 H new ATOM 0 HA3 GLY A 55 74.259 -6.224 -4.754 1.00 0.00 H new ATOM 823 N THR A 56 72.046 -7.568 -6.374 1.00 0.00 N ATOM 824 CA THR A 56 71.596 -8.772 -7.133 1.00 0.00 C ATOM 825 C THR A 56 70.798 -9.709 -6.223 1.00 0.00 C ATOM 826 O THR A 56 69.596 -9.587 -6.094 1.00 0.00 O ATOM 827 CB THR A 56 72.883 -9.448 -7.610 1.00 0.00 C ATOM 828 OG1 THR A 56 73.555 -8.590 -8.523 1.00 0.00 O ATOM 829 CG2 THR A 56 72.541 -10.767 -8.305 1.00 0.00 C ATOM 0 H THR A 56 71.737 -6.675 -6.757 1.00 0.00 H new ATOM 0 HA THR A 56 70.942 -8.512 -7.965 1.00 0.00 H new ATOM 0 HB THR A 56 73.528 -9.647 -6.755 1.00 0.00 H new ATOM 0 HG1 THR A 56 74.518 -8.608 -8.341 1.00 0.00 H new ATOM 0 HG21 THR A 56 73.458 -11.248 -8.645 1.00 0.00 H new ATOM 0 HG22 THR A 56 72.025 -11.424 -7.605 1.00 0.00 H new ATOM 0 HG23 THR A 56 71.896 -10.570 -9.161 1.00 0.00 H new ATOM 837 N ASN A 57 71.452 -10.646 -5.591 1.00 0.00 N ATOM 838 CA ASN A 57 70.720 -11.587 -4.694 1.00 0.00 C ATOM 839 C ASN A 57 71.651 -12.115 -3.599 1.00 0.00 C ATOM 840 O ASN A 57 72.408 -13.042 -3.807 1.00 0.00 O ATOM 841 CB ASN A 57 70.265 -12.726 -5.606 1.00 0.00 C ATOM 842 CG ASN A 57 68.737 -12.801 -5.607 1.00 0.00 C ATOM 843 OD1 ASN A 57 68.127 -12.971 -6.643 1.00 0.00 O ATOM 844 ND2 ASN A 57 68.089 -12.679 -4.481 1.00 0.00 N ATOM 0 H ASN A 57 72.458 -10.801 -5.656 1.00 0.00 H new ATOM 0 HA ASN A 57 69.882 -11.106 -4.189 1.00 0.00 H new ATOM 0 HB2 ASN A 57 70.632 -12.563 -6.619 1.00 0.00 H new ATOM 0 HB3 ASN A 57 70.686 -13.671 -5.262 1.00 0.00 H new ATOM 0 HD21 ASN A 57 67.070 -12.726 -4.471 1.00 0.00 H new ATOM 0 HD22 ASN A 57 68.601 -12.536 -3.611 1.00 0.00 H new ATOM 851 N ARG A 58 71.596 -11.534 -2.430 1.00 0.00 N ATOM 852 CA ARG A 58 72.472 -12.003 -1.318 1.00 0.00 C ATOM 853 C ARG A 58 73.882 -12.298 -1.836 1.00 0.00 C ATOM 854 O ARG A 58 74.600 -13.106 -1.281 1.00 0.00 O ATOM 855 CB ARG A 58 71.812 -13.284 -0.809 1.00 0.00 C ATOM 856 CG ARG A 58 70.358 -12.997 -0.433 1.00 0.00 C ATOM 857 CD ARG A 58 69.426 -13.713 -1.411 1.00 0.00 C ATOM 858 NE ARG A 58 69.295 -15.096 -0.875 1.00 0.00 N ATOM 859 CZ ARG A 58 68.682 -15.301 0.260 1.00 0.00 C ATOM 860 NH1 ARG A 58 67.396 -15.514 0.278 1.00 0.00 N ATOM 861 NH2 ARG A 58 69.359 -15.292 1.377 1.00 0.00 N ATOM 0 H ARG A 58 70.981 -10.754 -2.197 1.00 0.00 H new ATOM 0 HA ARG A 58 72.575 -11.254 -0.533 1.00 0.00 H new ATOM 0 HB2 ARG A 58 71.854 -14.057 -1.577 1.00 0.00 H new ATOM 0 HB3 ARG A 58 72.354 -13.665 0.057 1.00 0.00 H new ATOM 0 HG2 ARG A 58 70.162 -13.333 0.585 1.00 0.00 H new ATOM 0 HG3 ARG A 58 70.171 -11.923 -0.456 1.00 0.00 H new ATOM 0 HD2 ARG A 58 68.457 -13.218 -1.467 1.00 0.00 H new ATOM 0 HD3 ARG A 58 69.840 -13.718 -2.419 1.00 0.00 H new ATOM 0 HE ARG A 58 69.684 -15.883 -1.394 1.00 0.00 H new ATOM 0 HH11 ARG A 58 66.868 -15.521 -0.595 1.00 0.00 H new ATOM 0 HH12 ARG A 58 66.918 -15.674 1.165 1.00 0.00 H new ATOM 0 HH21 ARG A 58 70.365 -15.125 1.362 1.00 0.00 H new ATOM 0 HH22 ARG A 58 68.882 -15.452 2.264 1.00 0.00 H new ATOM 875 N LYS A 59 74.285 -11.650 -2.893 1.00 0.00 N ATOM 876 CA LYS A 59 75.648 -11.896 -3.438 1.00 0.00 C ATOM 877 C LYS A 59 76.490 -10.623 -3.341 1.00 0.00 C ATOM 878 O LYS A 59 77.690 -10.673 -3.153 1.00 0.00 O ATOM 879 CB LYS A 59 75.427 -12.286 -4.900 1.00 0.00 C ATOM 880 CG LYS A 59 76.219 -13.557 -5.216 1.00 0.00 C ATOM 881 CD LYS A 59 75.483 -14.772 -4.648 1.00 0.00 C ATOM 882 CE LYS A 59 76.492 -15.723 -4.000 1.00 0.00 C ATOM 883 NZ LYS A 59 77.432 -16.091 -5.095 1.00 0.00 N ATOM 0 H LYS A 59 73.730 -10.962 -3.402 1.00 0.00 H new ATOM 0 HA LYS A 59 76.181 -12.672 -2.888 1.00 0.00 H new ATOM 0 HB2 LYS A 59 74.366 -12.450 -5.087 1.00 0.00 H new ATOM 0 HB3 LYS A 59 75.744 -11.475 -5.556 1.00 0.00 H new ATOM 0 HG2 LYS A 59 76.341 -13.664 -6.294 1.00 0.00 H new ATOM 0 HG3 LYS A 59 77.219 -13.491 -4.787 1.00 0.00 H new ATOM 0 HD2 LYS A 59 74.745 -14.452 -3.913 1.00 0.00 H new ATOM 0 HD3 LYS A 59 74.941 -15.286 -5.442 1.00 0.00 H new ATOM 0 HE2 LYS A 59 77.016 -15.240 -3.175 1.00 0.00 H new ATOM 0 HE3 LYS A 59 75.998 -16.604 -3.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 77.841 -17.027 -4.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 76.919 -16.118 -5.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 78.194 -15.385 -5.150 1.00 0.00 H new ATOM 897 N PHE A 60 75.869 -9.483 -3.461 1.00 0.00 N ATOM 898 CA PHE A 60 76.632 -8.202 -3.370 1.00 0.00 C ATOM 899 C PHE A 60 75.863 -7.211 -2.496 1.00 0.00 C ATOM 900 O PHE A 60 74.837 -7.535 -1.932 1.00 0.00 O ATOM 901 CB PHE A 60 76.745 -7.666 -4.805 1.00 0.00 C ATOM 902 CG PHE A 60 76.783 -8.806 -5.796 1.00 0.00 C ATOM 903 CD1 PHE A 60 77.841 -9.721 -5.772 1.00 0.00 C ATOM 904 CD2 PHE A 60 75.756 -8.947 -6.736 1.00 0.00 C ATOM 905 CE1 PHE A 60 77.873 -10.777 -6.690 1.00 0.00 C ATOM 906 CE2 PHE A 60 75.787 -10.003 -7.654 1.00 0.00 C ATOM 907 CZ PHE A 60 76.846 -10.918 -7.631 1.00 0.00 C ATOM 0 H PHE A 60 74.866 -9.380 -3.618 1.00 0.00 H new ATOM 0 HA PHE A 60 77.617 -8.348 -2.926 1.00 0.00 H new ATOM 0 HB2 PHE A 60 75.899 -7.015 -5.024 1.00 0.00 H new ATOM 0 HB3 PHE A 60 77.646 -7.061 -4.903 1.00 0.00 H new ATOM 0 HD1 PHE A 60 78.633 -9.613 -5.045 1.00 0.00 H new ATOM 0 HD2 PHE A 60 74.939 -8.241 -6.753 1.00 0.00 H new ATOM 0 HE1 PHE A 60 78.690 -11.483 -6.672 1.00 0.00 H new ATOM 0 HE2 PHE A 60 74.994 -10.112 -8.380 1.00 0.00 H new ATOM 0 HZ PHE A 60 76.871 -11.733 -8.339 1.00 0.00 H new ATOM 917 N GLY A 61 76.347 -6.008 -2.377 1.00 0.00 N ATOM 918 CA GLY A 61 75.632 -5.008 -1.536 1.00 0.00 C ATOM 919 C GLY A 61 75.942 -3.592 -2.025 1.00 0.00 C ATOM 920 O GLY A 61 77.030 -3.303 -2.476 1.00 0.00 O ATOM 0 H GLY A 61 77.202 -5.674 -2.822 1.00 0.00 H new ATOM 0 HA2 GLY A 61 74.558 -5.188 -1.577 1.00 0.00 H new ATOM 0 HA3 GLY A 61 75.934 -5.115 -0.494 1.00 0.00 H new ATOM 924 N TYR A 62 74.990 -2.704 -1.928 1.00 0.00 N ATOM 925 CA TYR A 62 75.222 -1.297 -2.371 1.00 0.00 C ATOM 926 C TYR A 62 75.482 -0.418 -1.157 1.00 0.00 C ATOM 927 O TYR A 62 75.177 -0.782 -0.041 1.00 0.00 O ATOM 928 CB TYR A 62 73.929 -0.880 -3.074 1.00 0.00 C ATOM 929 CG TYR A 62 74.198 -0.644 -4.540 1.00 0.00 C ATOM 930 CD1 TYR A 62 74.737 0.576 -4.966 1.00 0.00 C ATOM 931 CD2 TYR A 62 73.903 -1.643 -5.476 1.00 0.00 C ATOM 932 CE1 TYR A 62 74.983 0.796 -6.326 1.00 0.00 C ATOM 933 CE2 TYR A 62 74.150 -1.423 -6.836 1.00 0.00 C ATOM 934 CZ TYR A 62 74.690 -0.203 -7.261 1.00 0.00 C ATOM 935 OH TYR A 62 74.932 0.014 -8.603 1.00 0.00 O ATOM 0 H TYR A 62 74.058 -2.892 -1.560 1.00 0.00 H new ATOM 0 HA TYR A 62 76.084 -1.202 -3.031 1.00 0.00 H new ATOM 0 HB2 TYR A 62 73.172 -1.655 -2.954 1.00 0.00 H new ATOM 0 HB3 TYR A 62 73.532 0.026 -2.617 1.00 0.00 H new ATOM 0 HD1 TYR A 62 74.963 1.348 -4.245 1.00 0.00 H new ATOM 0 HD2 TYR A 62 73.485 -2.583 -5.148 1.00 0.00 H new ATOM 0 HE1 TYR A 62 75.399 1.737 -6.654 1.00 0.00 H new ATOM 0 HE2 TYR A 62 73.924 -2.194 -7.558 1.00 0.00 H new ATOM 0 HH TYR A 62 74.673 -0.781 -9.115 1.00 0.00 H new ATOM 945 N VAL A 63 76.058 0.729 -1.358 1.00 0.00 N ATOM 946 CA VAL A 63 76.346 1.610 -0.199 1.00 0.00 C ATOM 947 C VAL A 63 76.585 3.049 -0.664 1.00 0.00 C ATOM 948 O VAL A 63 76.895 3.304 -1.811 1.00 0.00 O ATOM 949 CB VAL A 63 77.614 1.018 0.416 1.00 0.00 C ATOM 950 CG1 VAL A 63 78.333 2.073 1.248 1.00 0.00 C ATOM 951 CG2 VAL A 63 77.254 -0.169 1.311 1.00 0.00 C ATOM 0 H VAL A 63 76.340 1.093 -2.268 1.00 0.00 H new ATOM 0 HA VAL A 63 75.521 1.653 0.512 1.00 0.00 H new ATOM 0 HB VAL A 63 78.269 0.683 -0.388 1.00 0.00 H new ATOM 0 HG11 VAL A 63 79.235 1.642 1.682 1.00 0.00 H new ATOM 0 HG12 VAL A 63 78.604 2.916 0.612 1.00 0.00 H new ATOM 0 HG13 VAL A 63 77.675 2.417 2.046 1.00 0.00 H new ATOM 0 HG21 VAL A 63 78.163 -0.586 1.746 1.00 0.00 H new ATOM 0 HG22 VAL A 63 76.590 0.165 2.109 1.00 0.00 H new ATOM 0 HG23 VAL A 63 76.752 -0.933 0.717 1.00 0.00 H new ATOM 961 N ASP A 64 76.448 3.982 0.230 1.00 0.00 N ATOM 962 CA ASP A 64 76.666 5.407 -0.122 1.00 0.00 C ATOM 963 C ASP A 64 77.384 6.113 1.028 1.00 0.00 C ATOM 964 O ASP A 64 77.121 5.854 2.188 1.00 0.00 O ATOM 965 CB ASP A 64 75.271 5.983 -0.302 1.00 0.00 C ATOM 966 CG ASP A 64 74.524 5.202 -1.385 1.00 0.00 C ATOM 967 OD1 ASP A 64 74.266 4.029 -1.172 1.00 0.00 O ATOM 968 OD2 ASP A 64 74.222 5.791 -2.410 1.00 0.00 O ATOM 0 H ASP A 64 76.191 3.815 1.203 1.00 0.00 H new ATOM 0 HA ASP A 64 77.277 5.530 -1.016 1.00 0.00 H new ATOM 0 HB2 ASP A 64 74.723 5.933 0.639 1.00 0.00 H new ATOM 0 HB3 ASP A 64 75.335 7.035 -0.578 1.00 0.00 H new ATOM 973 N PHE A 65 78.284 7.002 0.711 1.00 0.00 N ATOM 974 CA PHE A 65 79.030 7.730 1.779 1.00 0.00 C ATOM 975 C PHE A 65 78.536 9.172 1.892 1.00 0.00 C ATOM 976 O PHE A 65 77.700 9.613 1.129 1.00 0.00 O ATOM 977 CB PHE A 65 80.492 7.677 1.345 1.00 0.00 C ATOM 978 CG PHE A 65 80.986 6.261 1.503 1.00 0.00 C ATOM 979 CD1 PHE A 65 81.124 5.713 2.782 1.00 0.00 C ATOM 980 CD2 PHE A 65 81.289 5.491 0.374 1.00 0.00 C ATOM 981 CE1 PHE A 65 81.565 4.396 2.936 1.00 0.00 C ATOM 982 CE2 PHE A 65 81.734 4.172 0.527 1.00 0.00 C ATOM 983 CZ PHE A 65 81.871 3.624 1.808 1.00 0.00 C ATOM 0 H PHE A 65 78.537 7.257 -0.244 1.00 0.00 H new ATOM 0 HA PHE A 65 78.887 7.283 2.763 1.00 0.00 H new ATOM 0 HB2 PHE A 65 80.592 8.000 0.309 1.00 0.00 H new ATOM 0 HB3 PHE A 65 81.092 8.357 1.950 1.00 0.00 H new ATOM 0 HD1 PHE A 65 80.889 6.308 3.652 1.00 0.00 H new ATOM 0 HD2 PHE A 65 81.180 5.914 -0.614 1.00 0.00 H new ATOM 0 HE1 PHE A 65 81.670 3.974 3.924 1.00 0.00 H new ATOM 0 HE2 PHE A 65 81.971 3.578 -0.343 1.00 0.00 H new ATOM 0 HZ PHE A 65 82.213 2.606 1.926 1.00 0.00 H new ATOM 993 N GLU A 66 79.019 9.901 2.860 1.00 0.00 N ATOM 994 CA GLU A 66 78.539 11.299 3.036 1.00 0.00 C ATOM 995 C GLU A 66 79.652 12.319 2.786 1.00 0.00 C ATOM 996 O GLU A 66 79.516 13.483 3.106 1.00 0.00 O ATOM 997 CB GLU A 66 78.059 11.363 4.489 1.00 0.00 C ATOM 998 CG GLU A 66 79.259 11.347 5.442 1.00 0.00 C ATOM 999 CD GLU A 66 78.863 12.001 6.766 1.00 0.00 C ATOM 1000 OE1 GLU A 66 77.747 12.485 6.857 1.00 0.00 O ATOM 1001 OE2 GLU A 66 79.684 12.008 7.670 1.00 0.00 O ATOM 0 H GLU A 66 79.721 9.591 3.532 1.00 0.00 H new ATOM 0 HA GLU A 66 77.752 11.546 2.323 1.00 0.00 H new ATOM 0 HB2 GLU A 66 77.472 12.268 4.647 1.00 0.00 H new ATOM 0 HB3 GLU A 66 77.405 10.517 4.701 1.00 0.00 H new ATOM 0 HG2 GLU A 66 79.588 10.322 5.614 1.00 0.00 H new ATOM 0 HG3 GLU A 66 80.099 11.881 4.997 1.00 0.00 H new ATOM 1008 N SER A 67 80.747 11.907 2.217 1.00 0.00 N ATOM 1009 CA SER A 67 81.844 12.889 1.958 1.00 0.00 C ATOM 1010 C SER A 67 82.940 12.309 1.081 1.00 0.00 C ATOM 1011 O SER A 67 82.946 11.145 0.727 1.00 0.00 O ATOM 1012 CB SER A 67 82.429 13.220 3.326 1.00 0.00 C ATOM 1013 OG SER A 67 82.746 12.014 4.005 1.00 0.00 O ATOM 0 H SER A 67 80.933 10.949 1.922 1.00 0.00 H new ATOM 0 HA SER A 67 81.450 13.760 1.435 1.00 0.00 H new ATOM 0 HB2 SER A 67 83.323 13.833 3.213 1.00 0.00 H new ATOM 0 HB3 SER A 67 81.715 13.802 3.909 1.00 0.00 H new ATOM 0 HG SER A 67 82.017 11.782 4.617 1.00 0.00 H new ATOM 1019 N ALA A 68 83.894 13.133 0.775 1.00 0.00 N ATOM 1020 CA ALA A 68 85.052 12.691 -0.034 1.00 0.00 C ATOM 1021 C ALA A 68 85.978 11.919 0.881 1.00 0.00 C ATOM 1022 O ALA A 68 86.769 11.098 0.466 1.00 0.00 O ATOM 1023 CB ALA A 68 85.724 13.985 -0.470 1.00 0.00 C ATOM 0 H ALA A 68 83.920 14.113 1.057 1.00 0.00 H new ATOM 0 HA ALA A 68 84.786 12.063 -0.884 1.00 0.00 H new ATOM 0 HB1 ALA A 68 86.598 13.754 -1.079 1.00 0.00 H new ATOM 0 HB2 ALA A 68 85.022 14.580 -1.054 1.00 0.00 H new ATOM 0 HB3 ALA A 68 86.033 14.549 0.410 1.00 0.00 H new ATOM 1029 N GLU A 69 85.864 12.201 2.143 1.00 0.00 N ATOM 1030 CA GLU A 69 86.708 11.525 3.146 1.00 0.00 C ATOM 1031 C GLU A 69 86.152 10.129 3.422 1.00 0.00 C ATOM 1032 O GLU A 69 86.878 9.212 3.756 1.00 0.00 O ATOM 1033 CB GLU A 69 86.597 12.427 4.368 1.00 0.00 C ATOM 1034 CG GLU A 69 87.981 12.626 4.978 1.00 0.00 C ATOM 1035 CD GLU A 69 88.012 12.038 6.390 1.00 0.00 C ATOM 1036 OE1 GLU A 69 86.989 12.086 7.053 1.00 0.00 O ATOM 1037 OE2 GLU A 69 89.057 11.547 6.783 1.00 0.00 O ATOM 0 H GLU A 69 85.209 12.884 2.524 1.00 0.00 H new ATOM 0 HA GLU A 69 87.743 11.385 2.835 1.00 0.00 H new ATOM 0 HB2 GLU A 69 86.170 13.389 4.086 1.00 0.00 H new ATOM 0 HB3 GLU A 69 85.924 11.983 5.102 1.00 0.00 H new ATOM 0 HG2 GLU A 69 88.736 12.144 4.356 1.00 0.00 H new ATOM 0 HG3 GLU A 69 88.225 13.688 5.010 1.00 0.00 H new ATOM 1044 N ASP A 70 84.871 9.949 3.247 1.00 0.00 N ATOM 1045 CA ASP A 70 84.280 8.606 3.461 1.00 0.00 C ATOM 1046 C ASP A 70 84.488 7.807 2.187 1.00 0.00 C ATOM 1047 O ASP A 70 84.596 6.597 2.200 1.00 0.00 O ATOM 1048 CB ASP A 70 82.791 8.846 3.714 1.00 0.00 C ATOM 1049 CG ASP A 70 82.611 9.657 4.997 1.00 0.00 C ATOM 1050 OD1 ASP A 70 83.492 9.603 5.839 1.00 0.00 O ATOM 1051 OD2 ASP A 70 81.595 10.322 5.114 1.00 0.00 O ATOM 0 H ASP A 70 84.212 10.675 2.965 1.00 0.00 H new ATOM 0 HA ASP A 70 84.726 8.061 4.293 1.00 0.00 H new ATOM 0 HB2 ASP A 70 82.350 9.378 2.871 1.00 0.00 H new ATOM 0 HB3 ASP A 70 82.268 7.893 3.798 1.00 0.00 H new ATOM 1056 N LEU A 71 84.564 8.493 1.080 1.00 0.00 N ATOM 1057 CA LEU A 71 84.785 7.797 -0.208 1.00 0.00 C ATOM 1058 C LEU A 71 86.240 7.324 -0.284 1.00 0.00 C ATOM 1059 O LEU A 71 86.531 6.243 -0.761 1.00 0.00 O ATOM 1060 CB LEU A 71 84.490 8.849 -1.284 1.00 0.00 C ATOM 1061 CG LEU A 71 84.855 8.304 -2.671 1.00 0.00 C ATOM 1062 CD1 LEU A 71 86.369 8.377 -2.873 1.00 0.00 C ATOM 1063 CD2 LEU A 71 84.393 6.848 -2.797 1.00 0.00 C ATOM 0 H LEU A 71 84.482 9.508 1.017 1.00 0.00 H new ATOM 0 HA LEU A 71 84.153 6.917 -0.331 1.00 0.00 H new ATOM 0 HB2 LEU A 71 83.435 9.121 -1.258 1.00 0.00 H new ATOM 0 HB3 LEU A 71 85.058 9.757 -1.081 1.00 0.00 H new ATOM 0 HG LEU A 71 84.358 8.907 -3.431 1.00 0.00 H new ATOM 0 HD11 LEU A 71 86.624 7.989 -3.859 1.00 0.00 H new ATOM 0 HD12 LEU A 71 86.697 9.414 -2.795 1.00 0.00 H new ATOM 0 HD13 LEU A 71 86.867 7.781 -2.109 1.00 0.00 H new ATOM 0 HD21 LEU A 71 84.655 6.467 -3.784 1.00 0.00 H new ATOM 0 HD22 LEU A 71 84.882 6.244 -2.033 1.00 0.00 H new ATOM 0 HD23 LEU A 71 83.312 6.796 -2.663 1.00 0.00 H new ATOM 1075 N GLU A 72 87.154 8.124 0.199 1.00 0.00 N ATOM 1076 CA GLU A 72 88.589 7.720 0.172 1.00 0.00 C ATOM 1077 C GLU A 72 88.820 6.604 1.190 1.00 0.00 C ATOM 1078 O GLU A 72 89.561 5.667 0.947 1.00 0.00 O ATOM 1079 CB GLU A 72 89.366 8.978 0.563 1.00 0.00 C ATOM 1080 CG GLU A 72 90.615 9.100 -0.314 1.00 0.00 C ATOM 1081 CD GLU A 72 91.739 9.757 0.486 1.00 0.00 C ATOM 1082 OE1 GLU A 72 91.732 10.974 0.591 1.00 0.00 O ATOM 1083 OE2 GLU A 72 92.589 9.036 0.982 1.00 0.00 O ATOM 0 H GLU A 72 86.968 9.039 0.610 1.00 0.00 H new ATOM 0 HA GLU A 72 88.903 7.344 -0.802 1.00 0.00 H new ATOM 0 HB2 GLU A 72 88.736 9.859 0.442 1.00 0.00 H new ATOM 0 HB3 GLU A 72 89.650 8.931 1.614 1.00 0.00 H new ATOM 0 HG2 GLU A 72 90.928 8.114 -0.658 1.00 0.00 H new ATOM 0 HG3 GLU A 72 90.392 9.692 -1.202 1.00 0.00 H new ATOM 1090 N LYS A 73 88.162 6.674 2.315 1.00 0.00 N ATOM 1091 CA LYS A 73 88.314 5.601 3.322 1.00 0.00 C ATOM 1092 C LYS A 73 87.470 4.425 2.861 1.00 0.00 C ATOM 1093 O LYS A 73 87.679 3.293 3.249 1.00 0.00 O ATOM 1094 CB LYS A 73 87.774 6.186 4.626 1.00 0.00 C ATOM 1095 CG LYS A 73 88.943 6.545 5.548 1.00 0.00 C ATOM 1096 CD LYS A 73 89.115 8.065 5.588 1.00 0.00 C ATOM 1097 CE LYS A 73 90.283 8.471 4.688 1.00 0.00 C ATOM 1098 NZ LYS A 73 91.336 8.958 5.622 1.00 0.00 N ATOM 0 H LYS A 73 87.528 7.429 2.575 1.00 0.00 H new ATOM 0 HA LYS A 73 89.341 5.262 3.455 1.00 0.00 H new ATOM 0 HB2 LYS A 73 87.175 7.073 4.419 1.00 0.00 H new ATOM 0 HB3 LYS A 73 87.118 5.466 5.116 1.00 0.00 H new ATOM 0 HG2 LYS A 73 88.758 6.163 6.552 1.00 0.00 H new ATOM 0 HG3 LYS A 73 89.859 6.074 5.191 1.00 0.00 H new ATOM 0 HD2 LYS A 73 88.199 8.554 5.256 1.00 0.00 H new ATOM 0 HD3 LYS A 73 89.299 8.394 6.611 1.00 0.00 H new ATOM 0 HE2 LYS A 73 90.639 7.627 4.097 1.00 0.00 H new ATOM 0 HE3 LYS A 73 89.988 9.250 3.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 92.171 9.255 5.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 90.971 9.766 6.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 91.602 8.193 6.275 1.00 0.00 H new ATOM 1112 N ALA A 74 86.521 4.697 2.006 1.00 0.00 N ATOM 1113 CA ALA A 74 85.662 3.615 1.484 1.00 0.00 C ATOM 1114 C ALA A 74 86.479 2.752 0.526 1.00 0.00 C ATOM 1115 O ALA A 74 86.279 1.560 0.413 1.00 0.00 O ATOM 1116 CB ALA A 74 84.528 4.321 0.744 1.00 0.00 C ATOM 0 H ALA A 74 86.309 5.629 1.650 1.00 0.00 H new ATOM 0 HA ALA A 74 85.275 2.964 2.268 1.00 0.00 H new ATOM 0 HB1 ALA A 74 83.847 3.578 0.328 1.00 0.00 H new ATOM 0 HB2 ALA A 74 83.985 4.963 1.438 1.00 0.00 H new ATOM 0 HB3 ALA A 74 84.941 4.927 -0.062 1.00 0.00 H new ATOM 1122 N LEU A 75 87.415 3.356 -0.157 1.00 0.00 N ATOM 1123 CA LEU A 75 88.270 2.587 -1.099 1.00 0.00 C ATOM 1124 C LEU A 75 89.310 1.804 -0.303 1.00 0.00 C ATOM 1125 O LEU A 75 89.563 0.645 -0.564 1.00 0.00 O ATOM 1126 CB LEU A 75 88.944 3.642 -1.979 1.00 0.00 C ATOM 1127 CG LEU A 75 90.004 2.973 -2.855 1.00 0.00 C ATOM 1128 CD1 LEU A 75 90.073 3.685 -4.208 1.00 0.00 C ATOM 1129 CD2 LEU A 75 91.366 3.063 -2.163 1.00 0.00 C ATOM 0 H LEU A 75 87.623 4.353 -0.101 1.00 0.00 H new ATOM 0 HA LEU A 75 87.706 1.872 -1.698 1.00 0.00 H new ATOM 0 HB2 LEU A 75 88.201 4.139 -2.603 1.00 0.00 H new ATOM 0 HB3 LEU A 75 89.403 4.411 -1.357 1.00 0.00 H new ATOM 0 HG LEU A 75 89.741 1.926 -3.008 1.00 0.00 H new ATOM 0 HD11 LEU A 75 90.829 3.208 -4.832 1.00 0.00 H new ATOM 0 HD12 LEU A 75 89.103 3.623 -4.701 1.00 0.00 H new ATOM 0 HD13 LEU A 75 90.337 4.732 -4.055 1.00 0.00 H new ATOM 0 HD21 LEU A 75 92.123 2.587 -2.786 1.00 0.00 H new ATOM 0 HD22 LEU A 75 91.628 4.110 -2.010 1.00 0.00 H new ATOM 0 HD23 LEU A 75 91.318 2.557 -1.199 1.00 0.00 H new ATOM 1141 N GLU A 76 89.907 2.427 0.677 1.00 0.00 N ATOM 1142 CA GLU A 76 90.918 1.712 1.499 1.00 0.00 C ATOM 1143 C GLU A 76 90.234 0.608 2.307 1.00 0.00 C ATOM 1144 O GLU A 76 90.842 -0.374 2.684 1.00 0.00 O ATOM 1145 CB GLU A 76 91.500 2.773 2.429 1.00 0.00 C ATOM 1146 CG GLU A 76 92.979 2.986 2.103 1.00 0.00 C ATOM 1147 CD GLU A 76 93.136 4.237 1.235 1.00 0.00 C ATOM 1148 OE1 GLU A 76 92.129 4.862 0.944 1.00 0.00 O ATOM 1149 OE2 GLU A 76 94.259 4.547 0.876 1.00 0.00 O ATOM 0 H GLU A 76 89.737 3.397 0.941 1.00 0.00 H new ATOM 0 HA GLU A 76 91.692 1.241 0.893 1.00 0.00 H new ATOM 0 HB2 GLU A 76 90.954 3.709 2.316 1.00 0.00 H new ATOM 0 HB3 GLU A 76 91.387 2.462 3.468 1.00 0.00 H new ATOM 0 HG2 GLU A 76 93.553 3.095 3.023 1.00 0.00 H new ATOM 0 HG3 GLU A 76 93.376 2.116 1.580 1.00 0.00 H new ATOM 1156 N LEU A 77 88.964 0.766 2.567 1.00 0.00 N ATOM 1157 CA LEU A 77 88.220 -0.266 3.343 1.00 0.00 C ATOM 1158 C LEU A 77 88.122 -1.559 2.538 1.00 0.00 C ATOM 1159 O LEU A 77 87.688 -2.581 3.029 1.00 0.00 O ATOM 1160 CB LEU A 77 86.837 0.337 3.548 1.00 0.00 C ATOM 1161 CG LEU A 77 86.871 1.264 4.755 1.00 0.00 C ATOM 1162 CD1 LEU A 77 85.689 2.227 4.681 1.00 0.00 C ATOM 1163 CD2 LEU A 77 86.783 0.427 6.029 1.00 0.00 C ATOM 0 H LEU A 77 88.408 1.569 2.274 1.00 0.00 H new ATOM 0 HA LEU A 77 88.708 -0.515 4.285 1.00 0.00 H new ATOM 0 HB2 LEU A 77 86.532 0.889 2.659 1.00 0.00 H new ATOM 0 HB3 LEU A 77 86.101 -0.453 3.701 1.00 0.00 H new ATOM 0 HG LEU A 77 87.799 1.836 4.763 1.00 0.00 H new ATOM 0 HD11 LEU A 77 85.708 2.894 5.543 1.00 0.00 H new ATOM 0 HD12 LEU A 77 85.756 2.815 3.766 1.00 0.00 H new ATOM 0 HD13 LEU A 77 84.758 1.661 4.681 1.00 0.00 H new ATOM 0 HD21 LEU A 77 86.807 1.084 6.898 1.00 0.00 H new ATOM 0 HD22 LEU A 77 85.852 -0.140 6.028 1.00 0.00 H new ATOM 0 HD23 LEU A 77 87.627 -0.261 6.071 1.00 0.00 H new ATOM 1175 N THR A 78 88.525 -1.516 1.302 1.00 0.00 N ATOM 1176 CA THR A 78 88.463 -2.737 0.445 1.00 0.00 C ATOM 1177 C THR A 78 89.062 -3.935 1.172 1.00 0.00 C ATOM 1178 O THR A 78 88.799 -5.076 0.845 1.00 0.00 O ATOM 1179 CB THR A 78 89.274 -2.396 -0.806 1.00 0.00 C ATOM 1180 OG1 THR A 78 88.522 -1.516 -1.630 1.00 0.00 O ATOM 1181 CG2 THR A 78 89.588 -3.679 -1.579 1.00 0.00 C ATOM 0 H THR A 78 88.897 -0.685 0.843 1.00 0.00 H new ATOM 0 HA THR A 78 87.437 -3.008 0.197 1.00 0.00 H new ATOM 0 HB THR A 78 90.207 -1.913 -0.514 1.00 0.00 H new ATOM 0 HG1 THR A 78 88.746 -0.588 -1.408 1.00 0.00 H new ATOM 0 HG21 THR A 78 90.166 -3.435 -2.470 1.00 0.00 H new ATOM 0 HG22 THR A 78 90.165 -4.353 -0.946 1.00 0.00 H new ATOM 0 HG23 THR A 78 88.657 -4.164 -1.872 1.00 0.00 H new ATOM 1189 N GLY A 79 89.849 -3.677 2.160 1.00 0.00 N ATOM 1190 CA GLY A 79 90.469 -4.785 2.942 1.00 0.00 C ATOM 1191 C GLY A 79 89.525 -5.186 4.081 1.00 0.00 C ATOM 1192 O GLY A 79 89.953 -5.544 5.160 1.00 0.00 O ATOM 0 H GLY A 79 90.099 -2.738 2.471 1.00 0.00 H new ATOM 0 HA2 GLY A 79 90.661 -5.640 2.294 1.00 0.00 H new ATOM 0 HA3 GLY A 79 91.431 -4.468 3.345 1.00 0.00 H new ATOM 1196 N LEU A 80 88.242 -5.122 3.845 1.00 0.00 N ATOM 1197 CA LEU A 80 87.259 -5.490 4.905 1.00 0.00 C ATOM 1198 C LEU A 80 87.063 -7.002 4.957 1.00 0.00 C ATOM 1199 O LEU A 80 87.835 -7.764 4.410 1.00 0.00 O ATOM 1200 CB LEU A 80 85.961 -4.800 4.485 1.00 0.00 C ATOM 1201 CG LEU A 80 85.649 -3.664 5.458 1.00 0.00 C ATOM 1202 CD1 LEU A 80 85.182 -2.435 4.677 1.00 0.00 C ATOM 1203 CD2 LEU A 80 84.544 -4.107 6.420 1.00 0.00 C ATOM 0 H LEU A 80 87.830 -4.829 2.959 1.00 0.00 H new ATOM 0 HA LEU A 80 87.591 -5.184 5.897 1.00 0.00 H new ATOM 0 HB2 LEU A 80 86.056 -4.409 3.472 1.00 0.00 H new ATOM 0 HB3 LEU A 80 85.142 -5.519 4.474 1.00 0.00 H new ATOM 0 HG LEU A 80 86.546 -3.414 6.024 1.00 0.00 H new ATOM 0 HD11 LEU A 80 84.960 -1.625 5.372 1.00 0.00 H new ATOM 0 HD12 LEU A 80 85.968 -2.119 3.991 1.00 0.00 H new ATOM 0 HD13 LEU A 80 84.285 -2.683 4.110 1.00 0.00 H new ATOM 0 HD21 LEU A 80 84.320 -3.297 7.115 1.00 0.00 H new ATOM 0 HD22 LEU A 80 83.647 -4.357 5.853 1.00 0.00 H new ATOM 0 HD23 LEU A 80 84.877 -4.982 6.978 1.00 0.00 H new ATOM 1215 N LYS A 81 86.029 -7.432 5.618 1.00 0.00 N ATOM 1216 CA LYS A 81 85.750 -8.893 5.725 1.00 0.00 C ATOM 1217 C LYS A 81 84.372 -9.107 6.317 1.00 0.00 C ATOM 1218 O LYS A 81 84.174 -9.880 7.234 1.00 0.00 O ATOM 1219 CB LYS A 81 86.802 -9.427 6.667 1.00 0.00 C ATOM 1220 CG LYS A 81 87.810 -10.279 5.895 1.00 0.00 C ATOM 1221 CD LYS A 81 89.051 -10.508 6.760 1.00 0.00 C ATOM 1222 CE LYS A 81 90.121 -9.474 6.402 1.00 0.00 C ATOM 1223 NZ LYS A 81 90.988 -9.384 7.610 1.00 0.00 N ATOM 0 H LYS A 81 85.357 -6.830 6.094 1.00 0.00 H new ATOM 0 HA LYS A 81 85.776 -9.391 4.756 1.00 0.00 H new ATOM 0 HB2 LYS A 81 87.314 -8.601 7.160 1.00 0.00 H new ATOM 0 HB3 LYS A 81 86.333 -10.023 7.449 1.00 0.00 H new ATOM 0 HG2 LYS A 81 87.362 -11.235 5.623 1.00 0.00 H new ATOM 0 HG3 LYS A 81 88.088 -9.781 4.966 1.00 0.00 H new ATOM 0 HD2 LYS A 81 88.791 -10.428 7.816 1.00 0.00 H new ATOM 0 HD3 LYS A 81 89.436 -11.515 6.602 1.00 0.00 H new ATOM 0 HE2 LYS A 81 90.693 -9.784 5.528 1.00 0.00 H new ATOM 0 HE3 LYS A 81 89.674 -8.509 6.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 91.747 -8.693 7.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 90.418 -9.080 8.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 91.405 -10.316 7.808 1.00 0.00 H new ATOM 1237 N VAL A 82 83.434 -8.408 5.790 1.00 0.00 N ATOM 1238 CA VAL A 82 82.027 -8.513 6.283 1.00 0.00 C ATOM 1239 C VAL A 82 81.701 -9.966 6.646 1.00 0.00 C ATOM 1240 O VAL A 82 81.864 -10.867 5.849 1.00 0.00 O ATOM 1241 CB VAL A 82 81.155 -8.029 5.120 1.00 0.00 C ATOM 1242 CG1 VAL A 82 80.973 -9.153 4.095 1.00 0.00 C ATOM 1243 CG2 VAL A 82 79.785 -7.606 5.655 1.00 0.00 C ATOM 0 H VAL A 82 83.569 -7.750 5.022 1.00 0.00 H new ATOM 0 HA VAL A 82 81.859 -7.920 7.182 1.00 0.00 H new ATOM 0 HB VAL A 82 81.643 -7.182 4.638 1.00 0.00 H new ATOM 0 HG11 VAL A 82 80.352 -8.798 3.273 1.00 0.00 H new ATOM 0 HG12 VAL A 82 81.947 -9.455 3.710 1.00 0.00 H new ATOM 0 HG13 VAL A 82 80.491 -10.006 4.572 1.00 0.00 H new ATOM 0 HG21 VAL A 82 79.163 -7.261 4.829 1.00 0.00 H new ATOM 0 HG22 VAL A 82 79.306 -8.456 6.140 1.00 0.00 H new ATOM 0 HG23 VAL A 82 79.910 -6.799 6.377 1.00 0.00 H new ATOM 1253 N PHE A 83 81.249 -10.200 7.847 1.00 0.00 N ATOM 1254 CA PHE A 83 80.924 -11.595 8.264 1.00 0.00 C ATOM 1255 C PHE A 83 81.997 -12.568 7.762 1.00 0.00 C ATOM 1256 O PHE A 83 81.738 -13.737 7.555 1.00 0.00 O ATOM 1257 CB PHE A 83 79.572 -11.896 7.618 1.00 0.00 C ATOM 1258 CG PHE A 83 78.475 -11.655 8.626 1.00 0.00 C ATOM 1259 CD1 PHE A 83 78.076 -12.685 9.486 1.00 0.00 C ATOM 1260 CD2 PHE A 83 77.859 -10.400 8.704 1.00 0.00 C ATOM 1261 CE1 PHE A 83 77.060 -12.461 10.423 1.00 0.00 C ATOM 1262 CE2 PHE A 83 76.844 -10.176 9.642 1.00 0.00 C ATOM 1263 CZ PHE A 83 76.445 -11.207 10.502 1.00 0.00 C ATOM 0 H PHE A 83 81.090 -9.486 8.558 1.00 0.00 H new ATOM 0 HA PHE A 83 80.889 -11.704 9.348 1.00 0.00 H new ATOM 0 HB2 PHE A 83 79.424 -11.262 6.744 1.00 0.00 H new ATOM 0 HB3 PHE A 83 79.543 -12.929 7.271 1.00 0.00 H new ATOM 0 HD1 PHE A 83 78.552 -13.653 9.427 1.00 0.00 H new ATOM 0 HD2 PHE A 83 78.167 -9.605 8.041 1.00 0.00 H new ATOM 0 HE1 PHE A 83 76.751 -13.257 11.085 1.00 0.00 H new ATOM 0 HE2 PHE A 83 76.369 -9.208 9.702 1.00 0.00 H new ATOM 0 HZ PHE A 83 75.663 -11.034 11.226 1.00 0.00 H new ATOM 1273 N GLY A 84 83.200 -12.095 7.569 1.00 0.00 N ATOM 1274 CA GLY A 84 84.288 -12.993 7.086 1.00 0.00 C ATOM 1275 C GLY A 84 84.324 -12.992 5.556 1.00 0.00 C ATOM 1276 O GLY A 84 84.796 -13.924 4.935 1.00 0.00 O ATOM 0 H GLY A 84 83.475 -11.125 7.725 1.00 0.00 H new ATOM 0 HA2 GLY A 84 85.248 -12.661 7.481 1.00 0.00 H new ATOM 0 HA3 GLY A 84 84.125 -14.006 7.454 1.00 0.00 H new ATOM 1280 N ASN A 85 83.835 -11.949 4.944 1.00 0.00 N ATOM 1281 CA ASN A 85 83.846 -11.882 3.453 1.00 0.00 C ATOM 1282 C ASN A 85 84.319 -10.498 3.006 1.00 0.00 C ATOM 1283 O ASN A 85 83.535 -9.586 2.840 1.00 0.00 O ATOM 1284 CB ASN A 85 82.395 -12.119 3.031 1.00 0.00 C ATOM 1285 CG ASN A 85 82.087 -13.616 3.083 1.00 0.00 C ATOM 1286 OD1 ASN A 85 81.589 -14.112 4.075 1.00 0.00 O ATOM 1287 ND2 ASN A 85 82.364 -14.363 2.049 1.00 0.00 N ATOM 0 H ASN A 85 83.428 -11.139 5.411 1.00 0.00 H new ATOM 0 HA ASN A 85 84.518 -12.614 3.005 1.00 0.00 H new ATOM 0 HB2 ASN A 85 81.720 -11.575 3.691 1.00 0.00 H new ATOM 0 HB3 ASN A 85 82.231 -11.738 2.023 1.00 0.00 H new ATOM 0 HD21 ASN A 85 82.163 -15.363 2.073 1.00 0.00 H new ATOM 0 HD22 ASN A 85 82.782 -13.947 1.217 1.00 0.00 H new ATOM 1294 N GLU A 86 85.600 -10.330 2.825 1.00 0.00 N ATOM 1295 CA GLU A 86 86.125 -9.001 2.405 1.00 0.00 C ATOM 1296 C GLU A 86 85.222 -8.369 1.347 1.00 0.00 C ATOM 1297 O GLU A 86 85.205 -8.775 0.201 1.00 0.00 O ATOM 1298 CB GLU A 86 87.516 -9.279 1.840 1.00 0.00 C ATOM 1299 CG GLU A 86 87.392 -10.074 0.538 1.00 0.00 C ATOM 1300 CD GLU A 86 88.598 -11.004 0.390 1.00 0.00 C ATOM 1301 OE1 GLU A 86 89.074 -11.490 1.403 1.00 0.00 O ATOM 1302 OE2 GLU A 86 89.025 -11.214 -0.734 1.00 0.00 O ATOM 0 H GLU A 86 86.306 -11.056 2.950 1.00 0.00 H new ATOM 0 HA GLU A 86 86.160 -8.297 3.237 1.00 0.00 H new ATOM 0 HB2 GLU A 86 88.039 -8.341 1.656 1.00 0.00 H new ATOM 0 HB3 GLU A 86 88.109 -9.838 2.564 1.00 0.00 H new ATOM 0 HG2 GLU A 86 86.470 -10.655 0.541 1.00 0.00 H new ATOM 0 HG3 GLU A 86 87.338 -9.394 -0.312 1.00 0.00 H new ATOM 1309 N ILE A 87 84.470 -7.376 1.728 1.00 0.00 N ATOM 1310 CA ILE A 87 83.564 -6.708 0.753 1.00 0.00 C ATOM 1311 C ILE A 87 84.373 -5.859 -0.226 1.00 0.00 C ATOM 1312 O ILE A 87 85.267 -5.130 0.154 1.00 0.00 O ATOM 1313 CB ILE A 87 82.642 -5.819 1.588 1.00 0.00 C ATOM 1314 CG1 ILE A 87 83.476 -4.991 2.570 1.00 0.00 C ATOM 1315 CG2 ILE A 87 81.656 -6.691 2.363 1.00 0.00 C ATOM 1316 CD1 ILE A 87 83.081 -3.518 2.460 1.00 0.00 C ATOM 0 H ILE A 87 84.443 -6.997 2.675 1.00 0.00 H new ATOM 0 HA ILE A 87 83.001 -7.432 0.164 1.00 0.00 H new ATOM 0 HB ILE A 87 82.092 -5.149 0.928 1.00 0.00 H new ATOM 0 HG12 ILE A 87 83.317 -5.346 3.588 1.00 0.00 H new ATOM 0 HG13 ILE A 87 84.537 -5.111 2.353 1.00 0.00 H new ATOM 0 HG21 ILE A 87 80.999 -6.057 2.958 1.00 0.00 H new ATOM 0 HG22 ILE A 87 81.059 -7.276 1.663 1.00 0.00 H new ATOM 0 HG23 ILE A 87 82.205 -7.364 3.022 1.00 0.00 H new ATOM 0 HD11 ILE A 87 83.675 -2.929 3.159 1.00 0.00 H new ATOM 0 HD12 ILE A 87 83.263 -3.167 1.444 1.00 0.00 H new ATOM 0 HD13 ILE A 87 82.023 -3.406 2.698 1.00 0.00 H new ATOM 1328 N LYS A 88 84.053 -5.943 -1.483 1.00 0.00 N ATOM 1329 CA LYS A 88 84.781 -5.142 -2.501 1.00 0.00 C ATOM 1330 C LYS A 88 83.838 -4.087 -3.077 1.00 0.00 C ATOM 1331 O LYS A 88 82.638 -4.205 -2.983 1.00 0.00 O ATOM 1332 CB LYS A 88 85.192 -6.145 -3.579 1.00 0.00 C ATOM 1333 CG LYS A 88 86.423 -6.922 -3.110 1.00 0.00 C ATOM 1334 CD LYS A 88 86.890 -7.860 -4.225 1.00 0.00 C ATOM 1335 CE LYS A 88 88.255 -7.400 -4.741 1.00 0.00 C ATOM 1336 NZ LYS A 88 87.998 -6.918 -6.127 1.00 0.00 N ATOM 0 H LYS A 88 83.311 -6.538 -1.853 1.00 0.00 H new ATOM 0 HA LYS A 88 85.646 -4.621 -2.091 1.00 0.00 H new ATOM 0 HB2 LYS A 88 84.371 -6.832 -3.783 1.00 0.00 H new ATOM 0 HB3 LYS A 88 85.411 -5.624 -4.511 1.00 0.00 H new ATOM 0 HG2 LYS A 88 87.222 -6.231 -2.843 1.00 0.00 H new ATOM 0 HG3 LYS A 88 86.185 -7.495 -2.214 1.00 0.00 H new ATOM 0 HD2 LYS A 88 86.956 -8.882 -3.851 1.00 0.00 H new ATOM 0 HD3 LYS A 88 86.165 -7.865 -5.039 1.00 0.00 H new ATOM 0 HE2 LYS A 88 88.667 -6.607 -4.117 1.00 0.00 H new ATOM 0 HE3 LYS A 88 88.976 -8.217 -4.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 88.888 -6.585 -6.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 87.613 -7.696 -6.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 87.313 -6.136 -6.101 1.00 0.00 H new ATOM 1350 N LEU A 89 84.362 -3.054 -3.665 1.00 0.00 N ATOM 1351 CA LEU A 89 83.476 -2.005 -4.231 1.00 0.00 C ATOM 1352 C LEU A 89 83.658 -1.908 -5.746 1.00 0.00 C ATOM 1353 O LEU A 89 84.528 -2.531 -6.321 1.00 0.00 O ATOM 1354 CB LEU A 89 83.912 -0.704 -3.553 1.00 0.00 C ATOM 1355 CG LEU A 89 85.435 -0.665 -3.407 1.00 0.00 C ATOM 1356 CD1 LEU A 89 85.925 0.777 -3.541 1.00 0.00 C ATOM 1357 CD2 LEU A 89 85.829 -1.212 -2.033 1.00 0.00 C ATOM 0 H LEU A 89 85.362 -2.890 -3.779 1.00 0.00 H new ATOM 0 HA LEU A 89 82.423 -2.223 -4.055 1.00 0.00 H new ATOM 0 HB2 LEU A 89 83.574 0.150 -4.139 1.00 0.00 H new ATOM 0 HB3 LEU A 89 83.444 -0.623 -2.572 1.00 0.00 H new ATOM 0 HG LEU A 89 85.890 -1.276 -4.187 1.00 0.00 H new ATOM 0 HD11 LEU A 89 87.010 0.804 -3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 89 85.645 1.167 -4.519 1.00 0.00 H new ATOM 0 HD13 LEU A 89 85.471 1.390 -2.762 1.00 0.00 H new ATOM 0 HD21 LEU A 89 86.914 -1.185 -1.928 1.00 0.00 H new ATOM 0 HD22 LEU A 89 85.373 -0.601 -1.254 1.00 0.00 H new ATOM 0 HD23 LEU A 89 85.481 -2.241 -1.937 1.00 0.00 H new ATOM 1369 N GLU A 90 82.837 -1.129 -6.396 1.00 0.00 N ATOM 1370 CA GLU A 90 82.952 -0.985 -7.877 1.00 0.00 C ATOM 1371 C GLU A 90 81.986 0.090 -8.380 1.00 0.00 C ATOM 1372 O GLU A 90 80.798 0.036 -8.132 1.00 0.00 O ATOM 1373 CB GLU A 90 82.567 -2.356 -8.437 1.00 0.00 C ATOM 1374 CG GLU A 90 83.689 -2.872 -9.338 1.00 0.00 C ATOM 1375 CD GLU A 90 83.085 -3.543 -10.574 1.00 0.00 C ATOM 1376 OE1 GLU A 90 82.437 -2.852 -11.342 1.00 0.00 O ATOM 1377 OE2 GLU A 90 83.280 -4.737 -10.729 1.00 0.00 O ATOM 0 H GLU A 90 82.090 -0.585 -5.965 1.00 0.00 H new ATOM 0 HA GLU A 90 83.952 -0.683 -8.187 1.00 0.00 H new ATOM 0 HB2 GLU A 90 82.390 -3.057 -7.621 1.00 0.00 H new ATOM 0 HB3 GLU A 90 81.638 -2.282 -9.002 1.00 0.00 H new ATOM 0 HG2 GLU A 90 84.336 -2.048 -9.638 1.00 0.00 H new ATOM 0 HG3 GLU A 90 84.310 -3.583 -8.792 1.00 0.00 H new ATOM 1384 N LYS A 91 82.486 1.068 -9.086 1.00 0.00 N ATOM 1385 CA LYS A 91 81.593 2.146 -9.602 1.00 0.00 C ATOM 1386 C LYS A 91 80.572 1.563 -10.586 1.00 0.00 C ATOM 1387 O LYS A 91 80.925 1.139 -11.668 1.00 0.00 O ATOM 1388 CB LYS A 91 82.527 3.124 -10.317 1.00 0.00 C ATOM 1389 CG LYS A 91 82.300 4.536 -9.772 1.00 0.00 C ATOM 1390 CD LYS A 91 81.968 5.482 -10.927 1.00 0.00 C ATOM 1391 CE LYS A 91 80.560 6.051 -10.732 1.00 0.00 C ATOM 1392 NZ LYS A 91 80.609 7.412 -11.335 1.00 0.00 N ATOM 0 H LYS A 91 83.472 1.167 -9.328 1.00 0.00 H new ATOM 0 HA LYS A 91 81.027 2.629 -8.806 1.00 0.00 H new ATOM 0 HB2 LYS A 91 83.565 2.827 -10.168 1.00 0.00 H new ATOM 0 HB3 LYS A 91 82.341 3.103 -11.391 1.00 0.00 H new ATOM 0 HG2 LYS A 91 81.486 4.531 -9.047 1.00 0.00 H new ATOM 0 HG3 LYS A 91 83.191 4.883 -9.249 1.00 0.00 H new ATOM 0 HD2 LYS A 91 82.696 6.292 -10.969 1.00 0.00 H new ATOM 0 HD3 LYS A 91 82.028 4.950 -11.876 1.00 0.00 H new ATOM 0 HE2 LYS A 91 79.811 5.429 -11.222 1.00 0.00 H new ATOM 0 HE3 LYS A 91 80.295 6.096 -9.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 79.679 7.867 -11.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 81.326 7.984 -10.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 80.857 7.337 -12.342 1.00 0.00 H new ATOM 1406 N PRO A 92 79.334 1.560 -10.169 1.00 0.00 N ATOM 1407 CA PRO A 92 78.247 1.022 -11.019 1.00 0.00 C ATOM 1408 C PRO A 92 77.892 2.018 -12.128 1.00 0.00 C ATOM 1409 O PRO A 92 78.525 3.043 -12.280 1.00 0.00 O ATOM 1410 CB PRO A 92 77.083 0.854 -10.047 1.00 0.00 C ATOM 1411 CG PRO A 92 77.347 1.830 -8.943 1.00 0.00 C ATOM 1412 CD PRO A 92 78.839 2.051 -8.880 1.00 0.00 C ATOM 0 HA PRO A 92 78.515 0.092 -11.521 1.00 0.00 H new ATOM 0 HB2 PRO A 92 76.130 1.060 -10.535 1.00 0.00 H new ATOM 0 HB3 PRO A 92 77.032 -0.166 -9.666 1.00 0.00 H new ATOM 0 HG2 PRO A 92 76.828 2.770 -9.130 1.00 0.00 H new ATOM 0 HG3 PRO A 92 76.976 1.444 -7.993 1.00 0.00 H new ATOM 0 HD2 PRO A 92 79.079 3.105 -8.737 1.00 0.00 H new ATOM 0 HD3 PRO A 92 79.287 1.506 -8.049 1.00 0.00 H new ATOM 1420 N LYS A 93 76.884 1.723 -12.903 1.00 0.00 N ATOM 1421 CA LYS A 93 76.490 2.652 -14.001 1.00 0.00 C ATOM 1422 C LYS A 93 75.101 3.236 -13.727 1.00 0.00 C ATOM 1423 O LYS A 93 74.501 3.860 -14.580 1.00 0.00 O ATOM 1424 CB LYS A 93 76.470 1.789 -15.262 1.00 0.00 C ATOM 1425 CG LYS A 93 77.654 2.162 -16.157 1.00 0.00 C ATOM 1426 CD LYS A 93 77.286 1.920 -17.621 1.00 0.00 C ATOM 1427 CE LYS A 93 78.494 1.345 -18.364 1.00 0.00 C ATOM 1428 NZ LYS A 93 78.532 2.079 -19.660 1.00 0.00 N ATOM 0 H LYS A 93 76.316 0.879 -12.824 1.00 0.00 H new ATOM 0 HA LYS A 93 77.175 3.494 -14.095 1.00 0.00 H new ATOM 0 HB2 LYS A 93 76.522 0.734 -14.994 1.00 0.00 H new ATOM 0 HB3 LYS A 93 75.534 1.935 -15.800 1.00 0.00 H new ATOM 0 HG2 LYS A 93 77.921 3.208 -16.007 1.00 0.00 H new ATOM 0 HG3 LYS A 93 78.528 1.568 -15.888 1.00 0.00 H new ATOM 0 HD2 LYS A 93 76.444 1.231 -17.686 1.00 0.00 H new ATOM 0 HD3 LYS A 93 76.970 2.854 -18.087 1.00 0.00 H new ATOM 0 HE2 LYS A 93 79.414 1.494 -17.798 1.00 0.00 H new ATOM 0 HE3 LYS A 93 78.387 0.272 -18.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 79.335 1.740 -20.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 77.646 1.913 -20.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 78.641 3.097 -19.479 1.00 0.00 H new ATOM 1442 N GLY A 94 74.587 3.038 -12.545 1.00 0.00 N ATOM 1443 CA GLY A 94 73.238 3.583 -12.218 1.00 0.00 C ATOM 1444 C GLY A 94 72.163 2.594 -12.669 1.00 0.00 C ATOM 1445 O GLY A 94 71.059 2.973 -13.004 1.00 0.00 O ATOM 0 H GLY A 94 75.042 2.523 -11.791 1.00 0.00 H new ATOM 0 HA2 GLY A 94 73.156 3.761 -11.146 1.00 0.00 H new ATOM 0 HA3 GLY A 94 73.093 4.544 -12.712 1.00 0.00 H new ATOM 1449 N ARG A 95 72.476 1.327 -12.679 1.00 0.00 N ATOM 1450 CA ARG A 95 71.469 0.313 -13.109 1.00 0.00 C ATOM 1451 C ARG A 95 70.249 0.355 -12.184 1.00 0.00 C ATOM 1452 O ARG A 95 70.374 0.364 -10.976 1.00 0.00 O ATOM 1453 CB ARG A 95 72.186 -1.032 -12.990 1.00 0.00 C ATOM 1454 CG ARG A 95 71.810 -1.917 -14.180 1.00 0.00 C ATOM 1455 CD ARG A 95 71.331 -3.280 -13.672 1.00 0.00 C ATOM 1456 NE ARG A 95 70.045 -3.524 -14.381 1.00 0.00 N ATOM 1457 CZ ARG A 95 70.028 -3.645 -15.679 1.00 0.00 C ATOM 1458 NH1 ARG A 95 71.003 -4.261 -16.290 1.00 0.00 N ATOM 1459 NH2 ARG A 95 69.036 -3.152 -16.369 1.00 0.00 N ATOM 0 H ARG A 95 73.384 0.950 -12.409 1.00 0.00 H new ATOM 0 HA ARG A 95 71.107 0.493 -14.121 1.00 0.00 H new ATOM 0 HB2 ARG A 95 73.265 -0.880 -12.963 1.00 0.00 H new ATOM 0 HB3 ARG A 95 71.910 -1.522 -12.057 1.00 0.00 H new ATOM 0 HG2 ARG A 95 71.026 -1.440 -14.768 1.00 0.00 H new ATOM 0 HG3 ARG A 95 72.669 -2.044 -14.838 1.00 0.00 H new ATOM 0 HD2 ARG A 95 72.058 -4.061 -13.893 1.00 0.00 H new ATOM 0 HD3 ARG A 95 71.191 -3.271 -12.591 1.00 0.00 H new ATOM 0 HE ARG A 95 69.177 -3.597 -13.851 1.00 0.00 H new ATOM 0 HH11 ARG A 95 71.778 -4.648 -15.752 1.00 0.00 H new ATOM 0 HH12 ARG A 95 70.990 -4.356 -17.306 1.00 0.00 H new ATOM 0 HH21 ARG A 95 68.273 -2.671 -15.893 1.00 0.00 H new ATOM 0 HH22 ARG A 95 69.024 -3.247 -17.384 1.00 0.00 H new ATOM 1473 N ASP A 96 69.070 0.383 -12.743 1.00 0.00 N ATOM 1474 CA ASP A 96 67.844 0.426 -11.895 1.00 0.00 C ATOM 1475 C ASP A 96 66.652 -0.155 -12.659 1.00 0.00 C ATOM 1476 O ASP A 96 66.794 -0.681 -13.745 1.00 0.00 O ATOM 1477 CB ASP A 96 67.620 1.909 -11.597 1.00 0.00 C ATOM 1478 CG ASP A 96 67.283 2.087 -10.116 1.00 0.00 C ATOM 1479 OD1 ASP A 96 67.456 1.136 -9.371 1.00 0.00 O ATOM 1480 OD2 ASP A 96 66.856 3.170 -9.751 1.00 0.00 O ATOM 0 H ASP A 96 68.902 0.378 -13.749 1.00 0.00 H new ATOM 0 HA ASP A 96 67.952 -0.161 -10.983 1.00 0.00 H new ATOM 0 HB2 ASP A 96 68.514 2.480 -11.849 1.00 0.00 H new ATOM 0 HB3 ASP A 96 66.810 2.296 -12.214 1.00 0.00 H new ATOM 1485 N GLY A 97 65.476 -0.064 -12.102 1.00 0.00 N ATOM 1486 CA GLY A 97 64.276 -0.610 -12.796 1.00 0.00 C ATOM 1487 C GLY A 97 63.834 -1.905 -12.112 1.00 0.00 C ATOM 1488 O GLY A 97 63.219 -2.760 -12.717 1.00 0.00 O ATOM 0 H GLY A 97 65.294 0.366 -11.195 1.00 0.00 H new ATOM 0 HA2 GLY A 97 63.467 0.120 -12.774 1.00 0.00 H new ATOM 0 HA3 GLY A 97 64.505 -0.800 -13.845 1.00 0.00 H new ATOM 1492 N THR A 98 64.142 -2.057 -10.853 1.00 0.00 N ATOM 1493 CA THR A 98 63.737 -3.298 -10.131 1.00 0.00 C ATOM 1494 C THR A 98 63.063 -2.943 -8.804 1.00 0.00 C ATOM 1495 O THR A 98 63.699 -2.483 -7.875 1.00 0.00 O ATOM 1496 CB THR A 98 65.030 -4.071 -9.879 1.00 0.00 C ATOM 1497 OG1 THR A 98 65.660 -3.574 -8.706 1.00 0.00 O ATOM 1498 CG2 THR A 98 65.976 -3.924 -11.075 1.00 0.00 C ATOM 0 H THR A 98 64.656 -1.377 -10.293 1.00 0.00 H new ATOM 0 HA THR A 98 63.023 -3.886 -10.709 1.00 0.00 H new ATOM 0 HB THR A 98 64.792 -5.126 -9.746 1.00 0.00 H new ATOM 0 HG1 THR A 98 65.338 -2.667 -8.521 1.00 0.00 H new ATOM 0 HG21 THR A 98 66.894 -4.479 -10.883 1.00 0.00 H new ATOM 0 HG22 THR A 98 65.494 -4.317 -11.970 1.00 0.00 H new ATOM 0 HG23 THR A 98 66.214 -2.871 -11.224 1.00 0.00 H new ATOM 1506 N ARG A 99 61.779 -3.152 -8.706 1.00 0.00 N ATOM 1507 CA ARG A 99 61.064 -2.825 -7.438 1.00 0.00 C ATOM 1508 C ARG A 99 59.701 -3.520 -7.405 1.00 0.00 C ATOM 1509 O ARG A 99 59.248 -4.068 -8.390 1.00 0.00 O ATOM 1510 CB ARG A 99 60.893 -1.306 -7.460 1.00 0.00 C ATOM 1511 CG ARG A 99 60.802 -0.781 -6.026 1.00 0.00 C ATOM 1512 CD ARG A 99 61.226 0.689 -5.993 1.00 0.00 C ATOM 1513 NE ARG A 99 60.420 1.297 -4.897 1.00 0.00 N ATOM 1514 CZ ARG A 99 59.327 1.953 -5.179 1.00 0.00 C ATOM 1515 NH1 ARG A 99 58.201 1.313 -5.330 1.00 0.00 N ATOM 1516 NH2 ARG A 99 59.363 3.252 -5.309 1.00 0.00 N ATOM 0 H ARG A 99 61.193 -3.535 -9.448 1.00 0.00 H new ATOM 0 HA ARG A 99 61.611 -3.160 -6.557 1.00 0.00 H new ATOM 0 HB2 ARG A 99 61.734 -0.842 -7.975 1.00 0.00 H new ATOM 0 HB3 ARG A 99 59.993 -1.039 -8.014 1.00 0.00 H new ATOM 0 HG2 ARG A 99 59.783 -0.885 -5.653 1.00 0.00 H new ATOM 0 HG3 ARG A 99 61.443 -1.370 -5.370 1.00 0.00 H new ATOM 0 HD2 ARG A 99 62.294 0.788 -5.799 1.00 0.00 H new ATOM 0 HD3 ARG A 99 61.029 1.178 -6.947 1.00 0.00 H new ATOM 0 HE ARG A 99 60.722 1.201 -3.927 1.00 0.00 H new ATOM 0 HH11 ARG A 99 58.173 0.299 -5.228 1.00 0.00 H new ATOM 0 HH12 ARG A 99 57.348 1.827 -5.550 1.00 0.00 H new ATOM 0 HH21 ARG A 99 60.244 3.752 -5.190 1.00 0.00 H new ATOM 0 HH22 ARG A 99 58.510 3.766 -5.529 1.00 0.00 H new ATOM 1530 N GLY A 100 59.042 -3.501 -6.278 1.00 0.00 N ATOM 1531 CA GLY A 100 57.709 -4.160 -6.184 1.00 0.00 C ATOM 1532 C GLY A 100 56.667 -3.315 -6.919 1.00 0.00 C ATOM 1533 O GLY A 100 56.578 -3.339 -8.130 1.00 0.00 O ATOM 0 H GLY A 100 59.369 -3.058 -5.419 1.00 0.00 H new ATOM 0 HA2 GLY A 100 57.754 -5.159 -6.618 1.00 0.00 H new ATOM 0 HA3 GLY A 100 57.424 -4.279 -5.139 1.00 0.00 H new ATOM 1537 N CYS A 101 55.879 -2.567 -6.196 1.00 0.00 N ATOM 1538 CA CYS A 101 54.843 -1.721 -6.856 1.00 0.00 C ATOM 1539 C CYS A 101 54.649 -0.418 -6.074 1.00 0.00 C ATOM 1540 O CYS A 101 55.420 -0.178 -5.161 1.00 0.00 O ATOM 1541 CB CYS A 101 53.567 -2.561 -6.824 1.00 0.00 C ATOM 1542 SG CYS A 101 52.639 -2.306 -8.357 1.00 0.00 S ATOM 1543 OXT CYS A 101 53.732 0.315 -6.404 1.00 0.00 O ATOM 0 H CYS A 101 55.907 -2.505 -5.178 1.00 0.00 H new ATOM 0 HA CYS A 101 55.122 -1.443 -7.872 1.00 0.00 H new ATOM 0 HB2 CYS A 101 53.816 -3.616 -6.708 1.00 0.00 H new ATOM 0 HB3 CYS A 101 52.956 -2.281 -5.966 1.00 0.00 H new ATOM 0 HG CYS A 101 51.554 -3.022 -8.332 1.00 0.00 H new TER 1549 CYS A 101