USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=20 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 57 ASN : amide:sc= -3.72! K(o=-7!,f=1.6) USER MOD Set 1.2: A 59 LYS NZ :NH3+ 165:sc= -3.31! (180deg=0) USER MOD Set 2.1: A 16 THR OG1 : rot -135:sc= -3.29! USER MOD Set 2.2: A 19 ASN : amide:sc= -6.18! C(o=-9.5!,f=-16!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 43:sc= 0.0428 USER MOD Single : A 3 HIS : no HD1:sc= -0.18 X(o=-0.18,f=-0.017) USER MOD Single : A 4 MET CE :methyl 149:sc= -0.0521 (180deg=-0.211) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -2.29! USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -2.81 K(o=-2.8,f=-0.81) USER MOD Single : A 26 ASN : amide:sc= -3.22! C(o=-3.2!,f=-15!) USER MOD Single : A 28 ASN : amide:sc= -0.324 X(o=-0.32,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 162:sc= 0.0928 (180deg=0.0385) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -140:sc= -2.51! (180deg=-5.79!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -161:sc= 0.688 (180deg=0.104!) USER MOD Single : A 45 ASN : amide:sc= -3.26! K(o=-3.3!,f=-2.2) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0611 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -133:sc= -0.109 USER MOD Single : A 73 LYS NZ :NH3+ -119:sc= 0.515 (180deg=-2.03!) USER MOD Single : A 78 THR OG1 : rot 91:sc= 0.716 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -1.9! C(o=-1.9!,f=-9!) 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 180:sc= 0 USER MOD Single : A 101 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 61.101 26.569 -10.605 1.00 0.00 N ATOM 2 CA GLY A 1 60.950 25.116 -10.902 1.00 0.00 C ATOM 3 C GLY A 1 59.498 24.694 -10.669 1.00 0.00 C ATOM 4 O GLY A 1 58.959 24.859 -9.593 1.00 0.00 O ATOM 0 H1 GLY A 1 62.088 26.855 -10.764 1.00 0.00 H new ATOM 0 H2 GLY A 1 60.477 27.118 -11.230 1.00 0.00 H new ATOM 0 H3 GLY A 1 60.843 26.749 -9.614 1.00 0.00 H new ATOM 0 HA2 GLY A 1 61.237 24.913 -11.934 1.00 0.00 H new ATOM 0 HA3 GLY A 1 61.616 24.533 -10.265 1.00 0.00 H new ATOM 10 N SER A 2 58.860 24.151 -11.670 1.00 0.00 N ATOM 11 CA SER A 2 57.443 23.719 -11.505 1.00 0.00 C ATOM 12 C SER A 2 57.338 22.196 -11.620 1.00 0.00 C ATOM 13 O SER A 2 57.948 21.584 -12.475 1.00 0.00 O ATOM 14 CB SER A 2 56.687 24.396 -12.647 1.00 0.00 C ATOM 15 OG SER A 2 57.364 24.144 -13.871 1.00 0.00 O ATOM 0 H SER A 2 59.259 23.988 -12.595 1.00 0.00 H new ATOM 0 HA SER A 2 57.039 23.992 -10.530 1.00 0.00 H new ATOM 0 HB2 SER A 2 55.666 24.017 -12.698 1.00 0.00 H new ATOM 0 HB3 SER A 2 56.620 25.469 -12.469 1.00 0.00 H new ATOM 0 HG SER A 2 57.638 23.204 -13.906 1.00 0.00 H new ATOM 21 N HIS A 3 56.571 21.578 -10.763 1.00 0.00 N ATOM 22 CA HIS A 3 56.429 20.094 -10.825 1.00 0.00 C ATOM 23 C HIS A 3 57.808 19.434 -10.892 1.00 0.00 C ATOM 24 O HIS A 3 58.079 18.625 -11.757 1.00 0.00 O ATOM 25 CB HIS A 3 55.642 19.825 -12.108 1.00 0.00 C ATOM 26 CG HIS A 3 54.645 18.726 -11.864 1.00 0.00 C ATOM 27 ND1 HIS A 3 54.533 17.630 -12.704 1.00 0.00 N ATOM 28 CD2 HIS A 3 53.707 18.541 -10.878 1.00 0.00 C ATOM 29 CE1 HIS A 3 53.559 16.840 -12.213 1.00 0.00 C ATOM 30 NE2 HIS A 3 53.023 17.350 -11.101 1.00 0.00 N ATOM 0 H HIS A 3 56.037 22.035 -10.024 1.00 0.00 H new ATOM 0 HA HIS A 3 55.926 19.690 -9.947 1.00 0.00 H new ATOM 0 HB2 HIS A 3 55.129 20.731 -12.429 1.00 0.00 H new ATOM 0 HB3 HIS A 3 56.322 19.542 -12.912 1.00 0.00 H new ATOM 0 HD2 HIS A 3 53.528 19.217 -10.055 1.00 0.00 H new ATOM 0 HE1 HIS A 3 53.249 15.908 -12.663 1.00 0.00 H new ATOM 0 HE2 HIS A 3 52.273 16.952 -10.536 1.00 0.00 H new ATOM 38 N MET A 4 58.683 19.773 -9.985 1.00 0.00 N ATOM 39 CA MET A 4 60.045 19.164 -9.997 1.00 0.00 C ATOM 40 C MET A 4 59.955 17.657 -9.747 1.00 0.00 C ATOM 41 O MET A 4 60.492 16.861 -10.491 1.00 0.00 O ATOM 42 CB MET A 4 60.797 19.853 -8.857 1.00 0.00 C ATOM 43 CG MET A 4 61.388 21.171 -9.360 1.00 0.00 C ATOM 44 SD MET A 4 62.376 21.928 -8.045 1.00 0.00 S ATOM 45 CE MET A 4 61.146 23.141 -7.506 1.00 0.00 C ATOM 0 H MET A 4 58.515 20.445 -9.236 1.00 0.00 H new ATOM 0 HA MET A 4 60.547 19.296 -10.955 1.00 0.00 H new ATOM 0 HB2 MET A 4 60.122 20.040 -8.022 1.00 0.00 H new ATOM 0 HB3 MET A 4 61.590 19.204 -8.486 1.00 0.00 H new ATOM 0 HG2 MET A 4 62.008 20.992 -10.239 1.00 0.00 H new ATOM 0 HG3 MET A 4 60.590 21.847 -9.665 1.00 0.00 H new ATOM 0 HE1 MET A 4 61.266 23.331 -6.439 1.00 0.00 H new ATOM 0 HE2 MET A 4 61.285 24.070 -8.058 1.00 0.00 H new ATOM 0 HE3 MET A 4 60.145 22.753 -7.695 1.00 0.00 H new ATOM 55 N LEU A 5 59.279 17.259 -8.704 1.00 0.00 N ATOM 56 CA LEU A 5 59.157 15.803 -8.408 1.00 0.00 C ATOM 57 C LEU A 5 58.072 15.567 -7.353 1.00 0.00 C ATOM 58 O LEU A 5 57.340 16.466 -6.990 1.00 0.00 O ATOM 59 CB LEU A 5 60.526 15.393 -7.865 1.00 0.00 C ATOM 60 CG LEU A 5 61.360 14.782 -8.991 1.00 0.00 C ATOM 61 CD1 LEU A 5 62.661 15.572 -9.150 1.00 0.00 C ATOM 62 CD2 LEU A 5 61.688 13.327 -8.650 1.00 0.00 C ATOM 0 H LEU A 5 58.807 17.878 -8.045 1.00 0.00 H new ATOM 0 HA LEU A 5 58.877 15.225 -9.289 1.00 0.00 H new ATOM 0 HB2 LEU A 5 61.038 16.260 -7.448 1.00 0.00 H new ATOM 0 HB3 LEU A 5 60.407 14.674 -7.055 1.00 0.00 H new ATOM 0 HG LEU A 5 60.795 14.820 -9.922 1.00 0.00 H new ATOM 0 HD11 LEU A 5 63.256 15.136 -9.953 1.00 0.00 H new ATOM 0 HD12 LEU A 5 62.430 16.609 -9.392 1.00 0.00 H new ATOM 0 HD13 LEU A 5 63.226 15.534 -8.219 1.00 0.00 H new ATOM 0 HD21 LEU A 5 62.283 12.890 -9.452 1.00 0.00 H new ATOM 0 HD22 LEU A 5 62.253 13.290 -7.718 1.00 0.00 H new ATOM 0 HD23 LEU A 5 60.763 12.763 -8.536 1.00 0.00 H new ATOM 74 N GLU A 6 57.964 14.365 -6.859 1.00 0.00 N ATOM 75 CA GLU A 6 56.929 14.072 -5.827 1.00 0.00 C ATOM 76 C GLU A 6 57.586 13.899 -4.455 1.00 0.00 C ATOM 77 O GLU A 6 57.730 14.841 -3.702 1.00 0.00 O ATOM 78 CB GLU A 6 56.278 12.765 -6.279 1.00 0.00 C ATOM 79 CG GLU A 6 55.081 13.074 -7.181 1.00 0.00 C ATOM 80 CD GLU A 6 54.020 11.985 -7.013 1.00 0.00 C ATOM 81 OE1 GLU A 6 54.390 10.822 -7.001 1.00 0.00 O ATOM 82 OE2 GLU A 6 52.857 12.331 -6.900 1.00 0.00 O ATOM 0 H GLU A 6 58.548 13.572 -7.125 1.00 0.00 H new ATOM 0 HA GLU A 6 56.201 14.877 -5.731 1.00 0.00 H new ATOM 0 HB2 GLU A 6 57.002 12.153 -6.816 1.00 0.00 H new ATOM 0 HB3 GLU A 6 55.954 12.189 -5.412 1.00 0.00 H new ATOM 0 HG2 GLU A 6 54.662 14.047 -6.926 1.00 0.00 H new ATOM 0 HG3 GLU A 6 55.401 13.127 -8.222 1.00 0.00 H new ATOM 89 N ASP A 7 57.986 12.702 -4.127 1.00 0.00 N ATOM 90 CA ASP A 7 58.634 12.468 -2.804 1.00 0.00 C ATOM 91 C ASP A 7 60.067 13.010 -2.815 1.00 0.00 C ATOM 92 O ASP A 7 60.416 13.860 -2.020 1.00 0.00 O ATOM 93 CB ASP A 7 58.636 10.950 -2.626 1.00 0.00 C ATOM 94 CG ASP A 7 57.499 10.544 -1.686 1.00 0.00 C ATOM 95 OD1 ASP A 7 56.522 11.271 -1.623 1.00 0.00 O ATOM 96 OD2 ASP A 7 57.626 9.514 -1.045 1.00 0.00 O ATOM 0 H ASP A 7 57.893 11.875 -4.717 1.00 0.00 H new ATOM 0 HA ASP A 7 58.110 12.972 -1.992 1.00 0.00 H new ATOM 0 HB2 ASP A 7 58.516 10.460 -3.592 1.00 0.00 H new ATOM 0 HB3 ASP A 7 59.593 10.622 -2.219 1.00 0.00 H new ATOM 101 N PRO A 8 60.852 12.493 -3.720 1.00 0.00 N ATOM 102 CA PRO A 8 62.264 12.923 -3.842 1.00 0.00 C ATOM 103 C PRO A 8 62.344 14.323 -4.439 1.00 0.00 C ATOM 104 O PRO A 8 62.603 14.506 -5.611 1.00 0.00 O ATOM 105 CB PRO A 8 62.876 11.899 -4.781 1.00 0.00 C ATOM 106 CG PRO A 8 61.727 11.368 -5.578 1.00 0.00 C ATOM 107 CD PRO A 8 60.502 11.467 -4.705 1.00 0.00 C ATOM 0 HA PRO A 8 62.779 12.971 -2.882 1.00 0.00 H new ATOM 0 HB2 PRO A 8 63.627 12.355 -5.427 1.00 0.00 H new ATOM 0 HB3 PRO A 8 63.373 11.103 -4.227 1.00 0.00 H new ATOM 0 HG2 PRO A 8 61.595 11.943 -6.494 1.00 0.00 H new ATOM 0 HG3 PRO A 8 61.908 10.334 -5.873 1.00 0.00 H new ATOM 0 HD2 PRO A 8 59.622 11.751 -5.282 1.00 0.00 H new ATOM 0 HD3 PRO A 8 60.275 10.515 -4.226 1.00 0.00 H new ATOM 115 N VAL A 9 62.122 15.306 -3.628 1.00 0.00 N ATOM 116 CA VAL A 9 62.179 16.715 -4.116 1.00 0.00 C ATOM 117 C VAL A 9 63.510 17.359 -3.716 1.00 0.00 C ATOM 118 O VAL A 9 63.542 18.378 -3.054 1.00 0.00 O ATOM 119 CB VAL A 9 61.012 17.421 -3.428 1.00 0.00 C ATOM 120 CG1 VAL A 9 61.324 17.596 -1.941 1.00 0.00 C ATOM 121 CG2 VAL A 9 60.800 18.795 -4.068 1.00 0.00 C ATOM 0 H VAL A 9 61.901 15.201 -2.638 1.00 0.00 H new ATOM 0 HA VAL A 9 62.109 16.779 -5.202 1.00 0.00 H new ATOM 0 HB VAL A 9 60.108 16.822 -3.541 1.00 0.00 H new ATOM 0 HG11 VAL A 9 60.491 18.100 -1.451 1.00 0.00 H new ATOM 0 HG12 VAL A 9 61.476 16.618 -1.484 1.00 0.00 H new ATOM 0 HG13 VAL A 9 62.228 18.195 -1.827 1.00 0.00 H new ATOM 0 HG21 VAL A 9 59.968 19.300 -3.578 1.00 0.00 H new ATOM 0 HG22 VAL A 9 61.704 19.393 -3.955 1.00 0.00 H new ATOM 0 HG23 VAL A 9 60.577 18.672 -5.128 1.00 0.00 H new ATOM 131 N GLU A 10 64.606 16.772 -4.111 1.00 0.00 N ATOM 132 CA GLU A 10 65.933 17.352 -3.753 1.00 0.00 C ATOM 133 C GLU A 10 66.799 17.506 -5.006 1.00 0.00 C ATOM 134 O GLU A 10 66.876 16.618 -5.831 1.00 0.00 O ATOM 135 CB GLU A 10 66.558 16.342 -2.789 1.00 0.00 C ATOM 136 CG GLU A 10 65.688 16.226 -1.536 1.00 0.00 C ATOM 137 CD GLU A 10 66.583 16.021 -0.312 1.00 0.00 C ATOM 138 OE1 GLU A 10 67.746 16.382 -0.385 1.00 0.00 O ATOM 139 OE2 GLU A 10 66.089 15.508 0.679 1.00 0.00 O ATOM 0 H GLU A 10 64.641 15.917 -4.666 1.00 0.00 H new ATOM 0 HA GLU A 10 65.845 18.342 -3.306 1.00 0.00 H new ATOM 0 HB2 GLU A 10 66.649 15.370 -3.273 1.00 0.00 H new ATOM 0 HB3 GLU A 10 67.565 16.658 -2.517 1.00 0.00 H new ATOM 0 HG2 GLU A 10 65.086 17.126 -1.413 1.00 0.00 H new ATOM 0 HG3 GLU A 10 64.995 15.391 -1.637 1.00 0.00 H new ATOM 146 N GLY A 11 67.449 18.627 -5.154 1.00 0.00 N ATOM 147 CA GLY A 11 68.309 18.838 -6.354 1.00 0.00 C ATOM 148 C GLY A 11 69.770 18.564 -5.993 1.00 0.00 C ATOM 149 O GLY A 11 70.627 19.409 -6.151 1.00 0.00 O ATOM 0 H GLY A 11 67.422 19.406 -4.497 1.00 0.00 H new ATOM 0 HA2 GLY A 11 67.993 18.177 -7.161 1.00 0.00 H new ATOM 0 HA3 GLY A 11 68.199 19.860 -6.718 1.00 0.00 H new ATOM 153 N SER A 12 70.061 17.387 -5.507 1.00 0.00 N ATOM 154 CA SER A 12 71.468 17.060 -5.137 1.00 0.00 C ATOM 155 C SER A 12 71.933 15.807 -5.882 1.00 0.00 C ATOM 156 O SER A 12 72.602 15.890 -6.892 1.00 0.00 O ATOM 157 CB SER A 12 71.432 16.808 -3.631 1.00 0.00 C ATOM 158 OG SER A 12 71.292 18.048 -2.949 1.00 0.00 O ATOM 0 H SER A 12 69.386 16.639 -5.350 1.00 0.00 H new ATOM 0 HA SER A 12 72.161 17.859 -5.399 1.00 0.00 H new ATOM 0 HB2 SER A 12 70.602 16.147 -3.381 1.00 0.00 H new ATOM 0 HB3 SER A 12 72.346 16.306 -3.313 1.00 0.00 H new ATOM 0 HG SER A 12 71.267 17.889 -1.982 1.00 0.00 H new ATOM 164 N GLU A 13 71.572 14.649 -5.396 1.00 0.00 N ATOM 165 CA GLU A 13 71.970 13.385 -6.059 1.00 0.00 C ATOM 166 C GLU A 13 71.611 12.214 -5.166 1.00 0.00 C ATOM 167 O GLU A 13 72.020 12.123 -4.026 1.00 0.00 O ATOM 168 CB GLU A 13 73.472 13.442 -6.248 1.00 0.00 C ATOM 169 CG GLU A 13 73.985 12.068 -6.682 1.00 0.00 C ATOM 170 CD GLU A 13 73.519 11.777 -8.110 1.00 0.00 C ATOM 171 OE1 GLU A 13 73.838 12.561 -8.987 1.00 0.00 O ATOM 172 OE2 GLU A 13 72.850 10.774 -8.301 1.00 0.00 O ATOM 0 H GLU A 13 71.009 14.530 -4.554 1.00 0.00 H new ATOM 0 HA GLU A 13 71.461 13.261 -7.015 1.00 0.00 H new ATOM 0 HB2 GLU A 13 73.726 14.190 -6.998 1.00 0.00 H new ATOM 0 HB3 GLU A 13 73.955 13.745 -5.319 1.00 0.00 H new ATOM 0 HG2 GLU A 13 75.073 12.042 -6.631 1.00 0.00 H new ATOM 0 HG3 GLU A 13 73.615 11.299 -6.004 1.00 0.00 H new ATOM 179 N SER A 14 70.863 11.329 -5.712 1.00 0.00 N ATOM 180 CA SER A 14 70.421 10.106 -4.989 1.00 0.00 C ATOM 181 C SER A 14 70.326 10.353 -3.479 1.00 0.00 C ATOM 182 O SER A 14 70.024 11.443 -3.037 1.00 0.00 O ATOM 183 CB SER A 14 71.495 9.078 -5.304 1.00 0.00 C ATOM 184 OG SER A 14 72.165 9.448 -6.503 1.00 0.00 O ATOM 0 H SER A 14 70.518 11.394 -6.670 1.00 0.00 H new ATOM 0 HA SER A 14 69.427 9.782 -5.297 1.00 0.00 H new ATOM 0 HB2 SER A 14 72.207 9.015 -4.481 1.00 0.00 H new ATOM 0 HB3 SER A 14 71.048 8.090 -5.414 1.00 0.00 H new ATOM 0 HG SER A 14 72.859 8.787 -6.707 1.00 0.00 H new ATOM 190 N THR A 15 70.582 9.348 -2.688 1.00 0.00 N ATOM 191 CA THR A 15 70.508 9.527 -1.209 1.00 0.00 C ATOM 192 C THR A 15 71.810 10.142 -0.688 1.00 0.00 C ATOM 193 O THR A 15 71.972 10.364 0.496 1.00 0.00 O ATOM 194 CB THR A 15 70.321 8.117 -0.648 1.00 0.00 C ATOM 195 OG1 THR A 15 68.981 7.696 -0.868 1.00 0.00 O ATOM 196 CG2 THR A 15 70.618 8.117 0.853 1.00 0.00 C ATOM 0 H THR A 15 70.839 8.412 -3.000 1.00 0.00 H new ATOM 0 HA THR A 15 69.698 10.194 -0.913 1.00 0.00 H new ATOM 0 HB THR A 15 71.005 7.433 -1.150 1.00 0.00 H new ATOM 0 HG1 THR A 15 68.859 6.792 -0.511 1.00 0.00 H new ATOM 0 HG21 THR A 15 70.484 7.111 1.250 1.00 0.00 H new ATOM 0 HG22 THR A 15 71.646 8.439 1.021 1.00 0.00 H new ATOM 0 HG23 THR A 15 69.936 8.801 1.359 1.00 0.00 H new ATOM 204 N THR A 16 72.738 10.418 -1.562 1.00 0.00 N ATOM 205 CA THR A 16 74.031 11.016 -1.116 1.00 0.00 C ATOM 206 C THR A 16 74.904 11.345 -2.330 1.00 0.00 C ATOM 207 O THR A 16 74.632 10.904 -3.429 1.00 0.00 O ATOM 208 CB THR A 16 74.696 9.940 -0.254 1.00 0.00 C ATOM 209 OG1 THR A 16 73.947 8.735 -0.337 1.00 0.00 O ATOM 210 CG2 THR A 16 74.751 10.406 1.201 1.00 0.00 C ATOM 0 H THR A 16 72.658 10.256 -2.566 1.00 0.00 H new ATOM 0 HA THR A 16 73.886 11.945 -0.564 1.00 0.00 H new ATOM 0 HB THR A 16 75.709 9.765 -0.616 1.00 0.00 H new ATOM 0 HG1 THR A 16 73.839 8.354 0.560 1.00 0.00 H new ATOM 0 HG21 THR A 16 75.225 9.637 1.812 1.00 0.00 H new ATOM 0 HG22 THR A 16 75.328 11.328 1.266 1.00 0.00 H new ATOM 0 HG23 THR A 16 73.739 10.585 1.564 1.00 0.00 H new ATOM 218 N PRO A 17 75.926 12.119 -2.088 1.00 0.00 N ATOM 219 CA PRO A 17 76.850 12.521 -3.173 1.00 0.00 C ATOM 220 C PRO A 17 77.791 11.369 -3.541 1.00 0.00 C ATOM 221 O PRO A 17 78.201 11.231 -4.677 1.00 0.00 O ATOM 222 CB PRO A 17 77.628 13.685 -2.568 1.00 0.00 C ATOM 223 CG PRO A 17 77.565 13.473 -1.087 1.00 0.00 C ATOM 224 CD PRO A 17 76.308 12.694 -0.794 1.00 0.00 C ATOM 0 HA PRO A 17 76.332 12.790 -4.094 1.00 0.00 H new ATOM 0 HB2 PRO A 17 78.659 13.695 -2.921 1.00 0.00 H new ATOM 0 HB3 PRO A 17 77.186 14.641 -2.848 1.00 0.00 H new ATOM 0 HG2 PRO A 17 78.443 12.929 -0.740 1.00 0.00 H new ATOM 0 HG3 PRO A 17 77.555 14.429 -0.563 1.00 0.00 H new ATOM 0 HD2 PRO A 17 76.486 11.917 -0.051 1.00 0.00 H new ATOM 0 HD3 PRO A 17 75.524 13.339 -0.399 1.00 0.00 H new ATOM 232 N PHE A 18 78.143 10.542 -2.593 1.00 0.00 N ATOM 233 CA PHE A 18 79.063 9.407 -2.903 1.00 0.00 C ATOM 234 C PHE A 18 78.325 8.070 -2.795 1.00 0.00 C ATOM 235 O PHE A 18 78.023 7.601 -1.716 1.00 0.00 O ATOM 236 CB PHE A 18 80.168 9.497 -1.851 1.00 0.00 C ATOM 237 CG PHE A 18 80.966 10.760 -2.071 1.00 0.00 C ATOM 238 CD1 PHE A 18 81.954 10.800 -3.063 1.00 0.00 C ATOM 239 CD2 PHE A 18 80.716 11.892 -1.287 1.00 0.00 C ATOM 240 CE1 PHE A 18 82.692 11.970 -3.269 1.00 0.00 C ATOM 241 CE2 PHE A 18 81.454 13.064 -1.493 1.00 0.00 C ATOM 242 CZ PHE A 18 82.443 13.102 -2.484 1.00 0.00 C ATOM 0 H PHE A 18 77.836 10.602 -1.622 1.00 0.00 H new ATOM 0 HA PHE A 18 79.457 9.464 -3.918 1.00 0.00 H new ATOM 0 HB2 PHE A 18 79.734 9.497 -0.851 1.00 0.00 H new ATOM 0 HB3 PHE A 18 80.820 8.626 -1.916 1.00 0.00 H new ATOM 0 HD1 PHE A 18 82.146 9.927 -3.669 1.00 0.00 H new ATOM 0 HD2 PHE A 18 79.954 11.862 -0.523 1.00 0.00 H new ATOM 0 HE1 PHE A 18 83.454 12.000 -4.034 1.00 0.00 H new ATOM 0 HE2 PHE A 18 81.261 13.938 -0.888 1.00 0.00 H new ATOM 0 HZ PHE A 18 83.014 14.005 -2.643 1.00 0.00 H new ATOM 252 N ASN A 19 78.041 7.450 -3.909 1.00 0.00 N ATOM 253 CA ASN A 19 77.331 6.143 -3.881 1.00 0.00 C ATOM 254 C ASN A 19 77.929 5.206 -4.930 1.00 0.00 C ATOM 255 O ASN A 19 78.516 5.637 -5.903 1.00 0.00 O ATOM 256 CB ASN A 19 75.882 6.473 -4.228 1.00 0.00 C ATOM 257 CG ASN A 19 75.385 7.611 -3.334 1.00 0.00 C ATOM 258 OD1 ASN A 19 75.738 7.685 -2.175 1.00 0.00 O ATOM 259 ND2 ASN A 19 74.574 8.505 -3.828 1.00 0.00 N ATOM 0 H ASN A 19 78.272 7.796 -4.840 1.00 0.00 H new ATOM 0 HA ASN A 19 77.415 5.644 -2.915 1.00 0.00 H new ATOM 0 HB2 ASN A 19 75.805 6.761 -5.276 1.00 0.00 H new ATOM 0 HB3 ASN A 19 75.256 5.591 -4.093 1.00 0.00 H new ATOM 0 HD21 ASN A 19 74.236 9.267 -3.240 1.00 0.00 H new ATOM 0 HD22 ASN A 19 74.278 8.442 -4.802 1.00 0.00 H new ATOM 266 N LEU A 20 77.784 3.928 -4.740 1.00 0.00 N ATOM 267 CA LEU A 20 78.342 2.958 -5.725 1.00 0.00 C ATOM 268 C LEU A 20 77.833 1.546 -5.426 1.00 0.00 C ATOM 269 O LEU A 20 76.928 1.355 -4.638 1.00 0.00 O ATOM 270 CB LEU A 20 79.856 3.033 -5.535 1.00 0.00 C ATOM 271 CG LEU A 20 80.213 2.621 -4.106 1.00 0.00 C ATOM 272 CD1 LEU A 20 80.570 1.134 -4.078 1.00 0.00 C ATOM 273 CD2 LEU A 20 81.414 3.440 -3.626 1.00 0.00 C ATOM 0 H LEU A 20 77.303 3.509 -3.944 1.00 0.00 H new ATOM 0 HA LEU A 20 78.046 3.190 -6.748 1.00 0.00 H new ATOM 0 HB2 LEU A 20 80.355 2.378 -6.249 1.00 0.00 H new ATOM 0 HB3 LEU A 20 80.208 4.046 -5.731 1.00 0.00 H new ATOM 0 HG LEU A 20 79.361 2.803 -3.451 1.00 0.00 H new ATOM 0 HD11 LEU A 20 80.825 0.840 -3.060 1.00 0.00 H new ATOM 0 HD12 LEU A 20 79.717 0.549 -4.422 1.00 0.00 H new ATOM 0 HD13 LEU A 20 81.423 0.952 -4.732 1.00 0.00 H new ATOM 0 HD21 LEU A 20 81.670 3.148 -2.608 1.00 0.00 H new ATOM 0 HD22 LEU A 20 82.265 3.256 -4.281 1.00 0.00 H new ATOM 0 HD23 LEU A 20 81.163 4.500 -3.647 1.00 0.00 H new ATOM 285 N PHE A 21 78.407 0.557 -6.053 1.00 0.00 N ATOM 286 CA PHE A 21 77.958 -0.843 -5.810 1.00 0.00 C ATOM 287 C PHE A 21 79.051 -1.632 -5.084 1.00 0.00 C ATOM 288 O PHE A 21 80.213 -1.282 -5.123 1.00 0.00 O ATOM 289 CB PHE A 21 77.709 -1.420 -7.205 1.00 0.00 C ATOM 290 CG PHE A 21 77.617 -2.925 -7.127 1.00 0.00 C ATOM 291 CD1 PHE A 21 76.602 -3.527 -6.375 1.00 0.00 C ATOM 292 CD2 PHE A 21 78.546 -3.719 -7.810 1.00 0.00 C ATOM 293 CE1 PHE A 21 76.515 -4.923 -6.306 1.00 0.00 C ATOM 294 CE2 PHE A 21 78.459 -5.114 -7.742 1.00 0.00 C ATOM 295 CZ PHE A 21 77.444 -5.716 -6.990 1.00 0.00 C ATOM 0 H PHE A 21 79.169 0.658 -6.724 1.00 0.00 H new ATOM 0 HA PHE A 21 77.068 -0.892 -5.183 1.00 0.00 H new ATOM 0 HB2 PHE A 21 76.787 -1.011 -7.618 1.00 0.00 H new ATOM 0 HB3 PHE A 21 78.516 -1.130 -7.878 1.00 0.00 H new ATOM 0 HD1 PHE A 21 75.885 -2.915 -5.848 1.00 0.00 H new ATOM 0 HD2 PHE A 21 79.330 -3.255 -8.390 1.00 0.00 H new ATOM 0 HE1 PHE A 21 75.732 -5.388 -5.725 1.00 0.00 H new ATOM 0 HE2 PHE A 21 79.175 -5.726 -8.270 1.00 0.00 H new ATOM 0 HZ PHE A 21 77.377 -6.793 -6.937 1.00 0.00 H new ATOM 305 N ILE A 22 78.686 -2.698 -4.426 1.00 0.00 N ATOM 306 CA ILE A 22 79.699 -3.514 -3.701 1.00 0.00 C ATOM 307 C ILE A 22 79.363 -4.997 -3.872 1.00 0.00 C ATOM 308 O ILE A 22 78.251 -5.354 -4.201 1.00 0.00 O ATOM 309 CB ILE A 22 79.591 -3.066 -2.233 1.00 0.00 C ATOM 310 CG1 ILE A 22 80.569 -1.917 -1.984 1.00 0.00 C ATOM 311 CG2 ILE A 22 79.928 -4.226 -1.290 1.00 0.00 C ATOM 312 CD1 ILE A 22 80.473 -1.471 -0.524 1.00 0.00 C ATOM 0 H ILE A 22 77.727 -3.039 -4.359 1.00 0.00 H new ATOM 0 HA ILE A 22 80.714 -3.378 -4.073 1.00 0.00 H new ATOM 0 HB ILE A 22 78.569 -2.740 -2.040 1.00 0.00 H new ATOM 0 HG12 ILE A 22 81.586 -2.236 -2.212 1.00 0.00 H new ATOM 0 HG13 ILE A 22 80.341 -1.082 -2.646 1.00 0.00 H new ATOM 0 HG21 ILE A 22 79.846 -3.890 -0.256 1.00 0.00 H new ATOM 0 HG22 ILE A 22 79.232 -5.048 -1.461 1.00 0.00 H new ATOM 0 HG23 ILE A 22 80.946 -4.567 -1.481 1.00 0.00 H new ATOM 0 HD11 ILE A 22 81.170 -0.652 -0.347 1.00 0.00 H new ATOM 0 HD12 ILE A 22 79.458 -1.135 -0.312 1.00 0.00 H new ATOM 0 HD13 ILE A 22 80.722 -2.307 0.129 1.00 0.00 H new ATOM 324 N GLY A 23 80.313 -5.861 -3.663 1.00 0.00 N ATOM 325 CA GLY A 23 80.033 -7.313 -3.829 1.00 0.00 C ATOM 326 C GLY A 23 80.766 -8.111 -2.752 1.00 0.00 C ATOM 327 O GLY A 23 81.321 -7.560 -1.822 1.00 0.00 O ATOM 0 H GLY A 23 81.267 -5.628 -3.386 1.00 0.00 H new ATOM 0 HA2 GLY A 23 78.960 -7.495 -3.762 1.00 0.00 H new ATOM 0 HA3 GLY A 23 80.351 -7.643 -4.818 1.00 0.00 H new ATOM 331 N ASN A 24 80.770 -9.411 -2.879 1.00 0.00 N ATOM 332 CA ASN A 24 81.465 -10.276 -1.876 1.00 0.00 C ATOM 333 C ASN A 24 80.665 -10.339 -0.572 1.00 0.00 C ATOM 334 O ASN A 24 81.221 -10.425 0.504 1.00 0.00 O ATOM 335 CB ASN A 24 82.827 -9.619 -1.640 1.00 0.00 C ATOM 336 CG ASN A 24 83.886 -10.702 -1.430 1.00 0.00 C ATOM 337 OD1 ASN A 24 84.079 -11.554 -2.275 1.00 0.00 O ATOM 338 ND2 ASN A 24 84.587 -10.706 -0.329 1.00 0.00 N ATOM 0 H ASN A 24 80.318 -9.917 -3.641 1.00 0.00 H new ATOM 0 HA ASN A 24 81.568 -11.301 -2.232 1.00 0.00 H new ATOM 0 HB2 ASN A 24 83.094 -8.995 -2.493 1.00 0.00 H new ATOM 0 HB3 ASN A 24 82.782 -8.966 -0.768 1.00 0.00 H new ATOM 0 HD21 ASN A 24 85.296 -11.424 -0.178 1.00 0.00 H new ATOM 0 HD22 ASN A 24 84.426 -9.991 0.381 1.00 0.00 H new ATOM 345 N LEU A 25 79.362 -10.308 -0.659 1.00 0.00 N ATOM 346 CA LEU A 25 78.534 -10.380 0.579 1.00 0.00 C ATOM 347 C LEU A 25 78.312 -11.839 0.968 1.00 0.00 C ATOM 348 O LEU A 25 78.005 -12.676 0.143 1.00 0.00 O ATOM 349 CB LEU A 25 77.207 -9.714 0.219 1.00 0.00 C ATOM 350 CG LEU A 25 77.251 -8.234 0.606 1.00 0.00 C ATOM 351 CD1 LEU A 25 78.263 -7.504 -0.277 1.00 0.00 C ATOM 352 CD2 LEU A 25 75.865 -7.617 0.409 1.00 0.00 C ATOM 0 H LEU A 25 78.837 -10.236 -1.531 1.00 0.00 H new ATOM 0 HA LEU A 25 79.013 -9.888 1.425 1.00 0.00 H new ATOM 0 HB2 LEU A 25 77.016 -9.815 -0.849 1.00 0.00 H new ATOM 0 HB3 LEU A 25 76.387 -10.211 0.737 1.00 0.00 H new ATOM 0 HG LEU A 25 77.548 -8.140 1.651 1.00 0.00 H new ATOM 0 HD11 LEU A 25 78.294 -6.450 -0.001 1.00 0.00 H new ATOM 0 HD12 LEU A 25 79.251 -7.944 -0.139 1.00 0.00 H new ATOM 0 HD13 LEU A 25 77.967 -7.597 -1.322 1.00 0.00 H new ATOM 0 HD21 LEU A 25 75.894 -6.563 0.684 1.00 0.00 H new ATOM 0 HD22 LEU A 25 75.570 -7.712 -0.636 1.00 0.00 H new ATOM 0 HD23 LEU A 25 75.143 -8.137 1.038 1.00 0.00 H new ATOM 364 N ASN A 26 78.471 -12.147 2.221 1.00 0.00 N ATOM 365 CA ASN A 26 78.277 -13.551 2.678 1.00 0.00 C ATOM 366 C ASN A 26 76.847 -14.017 2.385 1.00 0.00 C ATOM 367 O ASN A 26 75.907 -13.561 3.006 1.00 0.00 O ATOM 368 CB ASN A 26 78.531 -13.499 4.183 1.00 0.00 C ATOM 369 CG ASN A 26 78.585 -14.922 4.743 1.00 0.00 C ATOM 370 OD1 ASN A 26 77.706 -15.721 4.488 1.00 0.00 O ATOM 371 ND2 ASN A 26 79.587 -15.273 5.501 1.00 0.00 N ATOM 0 H ASN A 26 78.728 -11.485 2.953 1.00 0.00 H new ATOM 0 HA ASN A 26 78.940 -14.252 2.170 1.00 0.00 H new ATOM 0 HB2 ASN A 26 79.468 -12.981 4.386 1.00 0.00 H new ATOM 0 HB3 ASN A 26 77.741 -12.933 4.676 1.00 0.00 H new ATOM 0 HD21 ASN A 26 79.633 -16.219 5.880 1.00 0.00 H new ATOM 0 HD22 ASN A 26 80.325 -14.602 5.715 1.00 0.00 H new ATOM 378 N PRO A 27 76.735 -14.914 1.443 1.00 0.00 N ATOM 379 CA PRO A 27 75.408 -15.453 1.057 1.00 0.00 C ATOM 380 C PRO A 27 74.900 -16.429 2.123 1.00 0.00 C ATOM 381 O PRO A 27 73.711 -16.625 2.283 1.00 0.00 O ATOM 382 CB PRO A 27 75.685 -16.181 -0.254 1.00 0.00 C ATOM 383 CG PRO A 27 77.138 -16.538 -0.203 1.00 0.00 C ATOM 384 CD PRO A 27 77.823 -15.505 0.656 1.00 0.00 C ATOM 0 HA PRO A 27 74.644 -14.682 0.958 1.00 0.00 H new ATOM 0 HB2 PRO A 27 75.064 -17.071 -0.349 1.00 0.00 H new ATOM 0 HB3 PRO A 27 75.465 -15.545 -1.112 1.00 0.00 H new ATOM 0 HG2 PRO A 27 77.274 -17.536 0.214 1.00 0.00 H new ATOM 0 HG3 PRO A 27 77.566 -16.550 -1.205 1.00 0.00 H new ATOM 0 HD2 PRO A 27 78.578 -15.958 1.298 1.00 0.00 H new ATOM 0 HD3 PRO A 27 78.329 -14.754 0.049 1.00 0.00 H new ATOM 392 N ASN A 28 75.791 -17.044 2.854 1.00 0.00 N ATOM 393 CA ASN A 28 75.359 -18.007 3.907 1.00 0.00 C ATOM 394 C ASN A 28 74.816 -17.246 5.117 1.00 0.00 C ATOM 395 O ASN A 28 74.015 -17.752 5.877 1.00 0.00 O ATOM 396 CB ASN A 28 76.622 -18.783 4.281 1.00 0.00 C ATOM 397 CG ASN A 28 76.749 -20.015 3.382 1.00 0.00 C ATOM 398 OD1 ASN A 28 76.905 -21.119 3.865 1.00 0.00 O ATOM 399 ND2 ASN A 28 76.687 -19.872 2.087 1.00 0.00 N ATOM 0 H ASN A 28 76.800 -16.921 2.767 1.00 0.00 H new ATOM 0 HA ASN A 28 74.565 -18.670 3.563 1.00 0.00 H new ATOM 0 HB2 ASN A 28 77.499 -18.146 4.169 1.00 0.00 H new ATOM 0 HB3 ASN A 28 76.579 -19.086 5.327 1.00 0.00 H new ATOM 0 HD21 ASN A 28 76.769 -20.687 1.479 1.00 0.00 H new ATOM 0 HD22 ASN A 28 76.556 -18.945 1.682 1.00 0.00 H new ATOM 406 N LYS A 29 75.246 -16.031 5.292 1.00 0.00 N ATOM 407 CA LYS A 29 74.758 -15.221 6.440 1.00 0.00 C ATOM 408 C LYS A 29 73.530 -14.420 6.018 1.00 0.00 C ATOM 409 O LYS A 29 72.818 -14.791 5.106 1.00 0.00 O ATOM 410 CB LYS A 29 75.918 -14.285 6.783 1.00 0.00 C ATOM 411 CG LYS A 29 76.383 -14.551 8.216 1.00 0.00 C ATOM 412 CD LYS A 29 75.409 -13.897 9.198 1.00 0.00 C ATOM 413 CE LYS A 29 75.877 -14.158 10.632 1.00 0.00 C ATOM 414 NZ LYS A 29 74.955 -13.359 11.487 1.00 0.00 N ATOM 0 H LYS A 29 75.918 -15.561 4.686 1.00 0.00 H new ATOM 0 HA LYS A 29 74.467 -15.834 7.293 1.00 0.00 H new ATOM 0 HB2 LYS A 29 76.742 -14.441 6.087 1.00 0.00 H new ATOM 0 HB3 LYS A 29 75.604 -13.246 6.678 1.00 0.00 H new ATOM 0 HG2 LYS A 29 76.435 -15.624 8.399 1.00 0.00 H new ATOM 0 HG3 LYS A 29 77.387 -14.153 8.364 1.00 0.00 H new ATOM 0 HD2 LYS A 29 75.354 -12.824 9.012 1.00 0.00 H new ATOM 0 HD3 LYS A 29 74.406 -14.298 9.053 1.00 0.00 H new ATOM 0 HE2 LYS A 29 75.824 -15.219 10.878 1.00 0.00 H new ATOM 0 HE3 LYS A 29 76.913 -13.849 10.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 75.000 -13.707 12.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 75.238 -12.358 11.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 73.982 -13.453 11.131 1.00 0.00 H new ATOM 428 N SER A 30 73.280 -13.324 6.667 1.00 0.00 N ATOM 429 CA SER A 30 72.100 -12.498 6.293 1.00 0.00 C ATOM 430 C SER A 30 72.555 -11.191 5.656 1.00 0.00 C ATOM 431 O SER A 30 73.516 -10.578 6.084 1.00 0.00 O ATOM 432 CB SER A 30 71.376 -12.207 7.599 1.00 0.00 C ATOM 433 OG SER A 30 71.565 -13.292 8.498 1.00 0.00 O ATOM 0 H SER A 30 73.839 -12.962 7.440 1.00 0.00 H new ATOM 0 HA SER A 30 71.461 -13.011 5.575 1.00 0.00 H new ATOM 0 HB2 SER A 30 71.755 -11.285 8.040 1.00 0.00 H new ATOM 0 HB3 SER A 30 70.313 -12.057 7.412 1.00 0.00 H new ATOM 0 HG SER A 30 71.100 -13.104 9.340 1.00 0.00 H new ATOM 439 N VAL A 31 71.869 -10.746 4.647 1.00 0.00 N ATOM 440 CA VAL A 31 72.270 -9.472 4.007 1.00 0.00 C ATOM 441 C VAL A 31 72.029 -8.324 4.985 1.00 0.00 C ATOM 442 O VAL A 31 72.787 -7.377 5.045 1.00 0.00 O ATOM 443 CB VAL A 31 71.392 -9.336 2.763 1.00 0.00 C ATOM 444 CG1 VAL A 31 72.019 -8.318 1.810 1.00 0.00 C ATOM 445 CG2 VAL A 31 71.287 -10.690 2.056 1.00 0.00 C ATOM 0 H VAL A 31 71.054 -11.206 4.241 1.00 0.00 H new ATOM 0 HA VAL A 31 73.325 -9.451 3.735 1.00 0.00 H new ATOM 0 HB VAL A 31 70.397 -9.002 3.058 1.00 0.00 H new ATOM 0 HG11 VAL A 31 71.395 -8.219 0.922 1.00 0.00 H new ATOM 0 HG12 VAL A 31 72.096 -7.352 2.309 1.00 0.00 H new ATOM 0 HG13 VAL A 31 73.013 -8.656 1.519 1.00 0.00 H new ATOM 0 HG21 VAL A 31 70.661 -10.590 1.170 1.00 0.00 H new ATOM 0 HG22 VAL A 31 72.282 -11.025 1.762 1.00 0.00 H new ATOM 0 HG23 VAL A 31 70.844 -11.421 2.733 1.00 0.00 H new ATOM 455 N ALA A 32 70.990 -8.412 5.771 1.00 0.00 N ATOM 456 CA ALA A 32 70.718 -7.335 6.763 1.00 0.00 C ATOM 457 C ALA A 32 71.893 -7.240 7.736 1.00 0.00 C ATOM 458 O ALA A 32 72.230 -6.179 8.223 1.00 0.00 O ATOM 459 CB ALA A 32 69.446 -7.771 7.488 1.00 0.00 C ATOM 0 H ALA A 32 70.320 -9.181 5.769 1.00 0.00 H new ATOM 0 HA ALA A 32 70.595 -6.355 6.302 1.00 0.00 H new ATOM 0 HB1 ALA A 32 69.181 -7.025 8.238 1.00 0.00 H new ATOM 0 HB2 ALA A 32 68.633 -7.868 6.769 1.00 0.00 H new ATOM 0 HB3 ALA A 32 69.616 -8.731 7.975 1.00 0.00 H new ATOM 465 N GLU A 33 72.527 -8.348 8.010 1.00 0.00 N ATOM 466 CA GLU A 33 73.692 -8.332 8.937 1.00 0.00 C ATOM 467 C GLU A 33 74.890 -7.700 8.229 1.00 0.00 C ATOM 468 O GLU A 33 75.690 -7.013 8.832 1.00 0.00 O ATOM 469 CB GLU A 33 73.966 -9.803 9.258 1.00 0.00 C ATOM 470 CG GLU A 33 72.748 -10.411 9.957 1.00 0.00 C ATOM 471 CD GLU A 33 72.710 -9.946 11.414 1.00 0.00 C ATOM 472 OE1 GLU A 33 73.680 -9.348 11.850 1.00 0.00 O ATOM 473 OE2 GLU A 33 71.712 -10.195 12.069 1.00 0.00 O ATOM 0 H GLU A 33 72.287 -9.264 7.631 1.00 0.00 H new ATOM 0 HA GLU A 33 73.505 -7.755 9.843 1.00 0.00 H new ATOM 0 HB2 GLU A 33 74.183 -10.351 8.341 1.00 0.00 H new ATOM 0 HB3 GLU A 33 74.845 -9.889 9.897 1.00 0.00 H new ATOM 0 HG2 GLU A 33 71.834 -10.111 9.445 1.00 0.00 H new ATOM 0 HG3 GLU A 33 72.796 -11.499 9.913 1.00 0.00 H new ATOM 480 N LEU A 34 75.009 -7.915 6.946 1.00 0.00 N ATOM 481 CA LEU A 34 76.141 -7.311 6.197 1.00 0.00 C ATOM 482 C LEU A 34 75.979 -5.793 6.187 1.00 0.00 C ATOM 483 O LEU A 34 76.940 -5.050 6.170 1.00 0.00 O ATOM 484 CB LEU A 34 76.025 -7.882 4.785 1.00 0.00 C ATOM 485 CG LEU A 34 76.839 -9.173 4.688 1.00 0.00 C ATOM 486 CD1 LEU A 34 76.006 -10.250 3.990 1.00 0.00 C ATOM 487 CD2 LEU A 34 78.113 -8.914 3.882 1.00 0.00 C ATOM 0 H LEU A 34 74.371 -8.482 6.388 1.00 0.00 H new ATOM 0 HA LEU A 34 77.114 -7.531 6.637 1.00 0.00 H new ATOM 0 HB2 LEU A 34 74.980 -8.080 4.546 1.00 0.00 H new ATOM 0 HB3 LEU A 34 76.387 -7.156 4.057 1.00 0.00 H new ATOM 0 HG LEU A 34 77.105 -9.510 5.690 1.00 0.00 H new ATOM 0 HD11 LEU A 34 76.586 -11.170 3.921 1.00 0.00 H new ATOM 0 HD12 LEU A 34 75.098 -10.436 4.563 1.00 0.00 H new ATOM 0 HD13 LEU A 34 75.740 -9.912 2.988 1.00 0.00 H new ATOM 0 HD21 LEU A 34 78.693 -9.834 3.813 1.00 0.00 H new ATOM 0 HD22 LEU A 34 77.847 -8.576 2.880 1.00 0.00 H new ATOM 0 HD23 LEU A 34 78.708 -8.147 4.378 1.00 0.00 H new ATOM 499 N LYS A 35 74.759 -5.331 6.218 1.00 0.00 N ATOM 500 CA LYS A 35 74.513 -3.864 6.230 1.00 0.00 C ATOM 501 C LYS A 35 74.979 -3.291 7.568 1.00 0.00 C ATOM 502 O LYS A 35 75.809 -2.406 7.625 1.00 0.00 O ATOM 503 CB LYS A 35 72.996 -3.716 6.082 1.00 0.00 C ATOM 504 CG LYS A 35 72.623 -3.653 4.598 1.00 0.00 C ATOM 505 CD LYS A 35 72.733 -5.046 3.977 1.00 0.00 C ATOM 506 CE LYS A 35 72.895 -4.917 2.461 1.00 0.00 C ATOM 507 NZ LYS A 35 74.347 -4.661 2.249 1.00 0.00 N ATOM 0 H LYS A 35 73.920 -5.910 6.236 1.00 0.00 H new ATOM 0 HA LYS A 35 75.047 -3.336 5.440 1.00 0.00 H new ATOM 0 HB2 LYS A 35 72.491 -4.557 6.558 1.00 0.00 H new ATOM 0 HB3 LYS A 35 72.658 -2.813 6.590 1.00 0.00 H new ATOM 0 HG2 LYS A 35 71.608 -3.273 4.485 1.00 0.00 H new ATOM 0 HG3 LYS A 35 73.283 -2.959 4.077 1.00 0.00 H new ATOM 0 HD2 LYS A 35 73.585 -5.578 4.401 1.00 0.00 H new ATOM 0 HD3 LYS A 35 71.843 -5.631 4.210 1.00 0.00 H new ATOM 0 HE2 LYS A 35 72.576 -5.826 1.951 1.00 0.00 H new ATOM 0 HE3 LYS A 35 72.289 -4.101 2.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 74.468 -3.950 1.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 74.770 -4.309 3.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 74.818 -5.545 1.967 1.00 0.00 H new ATOM 521 N VAL A 36 74.460 -3.810 8.645 1.00 0.00 N ATOM 522 CA VAL A 36 74.880 -3.323 9.989 1.00 0.00 C ATOM 523 C VAL A 36 76.361 -3.608 10.189 1.00 0.00 C ATOM 524 O VAL A 36 77.079 -2.822 10.763 1.00 0.00 O ATOM 525 CB VAL A 36 74.054 -4.136 10.973 1.00 0.00 C ATOM 526 CG1 VAL A 36 74.169 -3.523 12.369 1.00 0.00 C ATOM 527 CG2 VAL A 36 72.589 -4.142 10.533 1.00 0.00 C ATOM 0 H VAL A 36 73.761 -4.553 8.653 1.00 0.00 H new ATOM 0 HA VAL A 36 74.728 -2.251 10.115 1.00 0.00 H new ATOM 0 HB VAL A 36 74.427 -5.160 10.997 1.00 0.00 H new ATOM 0 HG11 VAL A 36 73.576 -4.107 13.073 1.00 0.00 H new ATOM 0 HG12 VAL A 36 75.213 -3.527 12.683 1.00 0.00 H new ATOM 0 HG13 VAL A 36 73.800 -2.498 12.348 1.00 0.00 H new ATOM 0 HG21 VAL A 36 71.999 -4.725 11.240 1.00 0.00 H new ATOM 0 HG22 VAL A 36 72.214 -3.119 10.504 1.00 0.00 H new ATOM 0 HG23 VAL A 36 72.509 -4.586 9.541 1.00 0.00 H new ATOM 537 N ALA A 37 76.828 -4.726 9.709 1.00 0.00 N ATOM 538 CA ALA A 37 78.270 -5.042 9.868 1.00 0.00 C ATOM 539 C ALA A 37 79.088 -4.004 9.109 1.00 0.00 C ATOM 540 O ALA A 37 80.171 -3.637 9.511 1.00 0.00 O ATOM 541 CB ALA A 37 78.451 -6.434 9.261 1.00 0.00 C ATOM 0 H ALA A 37 76.276 -5.429 9.217 1.00 0.00 H new ATOM 0 HA ALA A 37 78.598 -5.025 10.907 1.00 0.00 H new ATOM 0 HB1 ALA A 37 79.496 -6.734 9.343 1.00 0.00 H new ATOM 0 HB2 ALA A 37 77.825 -7.148 9.796 1.00 0.00 H new ATOM 0 HB3 ALA A 37 78.161 -6.413 8.210 1.00 0.00 H new ATOM 547 N ILE A 38 78.563 -3.512 8.022 1.00 0.00 N ATOM 548 CA ILE A 38 79.298 -2.479 7.248 1.00 0.00 C ATOM 549 C ILE A 38 79.075 -1.114 7.898 1.00 0.00 C ATOM 550 O ILE A 38 79.918 -0.238 7.835 1.00 0.00 O ATOM 551 CB ILE A 38 78.690 -2.519 5.847 1.00 0.00 C ATOM 552 CG1 ILE A 38 79.222 -3.741 5.095 1.00 0.00 C ATOM 553 CG2 ILE A 38 79.073 -1.248 5.087 1.00 0.00 C ATOM 554 CD1 ILE A 38 78.179 -4.213 4.081 1.00 0.00 C ATOM 0 H ILE A 38 77.657 -3.782 7.638 1.00 0.00 H new ATOM 0 HA ILE A 38 80.373 -2.657 7.218 1.00 0.00 H new ATOM 0 HB ILE A 38 77.605 -2.583 5.925 1.00 0.00 H new ATOM 0 HG12 ILE A 38 80.152 -3.490 4.585 1.00 0.00 H new ATOM 0 HG13 ILE A 38 79.450 -4.543 5.798 1.00 0.00 H new ATOM 0 HG21 ILE A 38 78.639 -1.277 4.088 1.00 0.00 H new ATOM 0 HG22 ILE A 38 78.695 -0.377 5.622 1.00 0.00 H new ATOM 0 HG23 ILE A 38 80.158 -1.183 5.010 1.00 0.00 H new ATOM 0 HD11 ILE A 38 78.559 -5.083 3.546 1.00 0.00 H new ATOM 0 HD12 ILE A 38 77.260 -4.480 4.602 1.00 0.00 H new ATOM 0 HD13 ILE A 38 77.973 -3.412 3.371 1.00 0.00 H new ATOM 566 N SER A 39 77.952 -0.930 8.540 1.00 0.00 N ATOM 567 CA SER A 39 77.692 0.377 9.207 1.00 0.00 C ATOM 568 C SER A 39 78.471 0.434 10.518 1.00 0.00 C ATOM 569 O SER A 39 78.905 1.479 10.963 1.00 0.00 O ATOM 570 CB SER A 39 76.187 0.399 9.470 1.00 0.00 C ATOM 571 OG SER A 39 75.511 0.850 8.304 1.00 0.00 O ATOM 0 H SER A 39 77.209 -1.623 8.631 1.00 0.00 H new ATOM 0 HA SER A 39 78.002 1.230 8.604 1.00 0.00 H new ATOM 0 HB2 SER A 39 75.840 -0.598 9.743 1.00 0.00 H new ATOM 0 HB3 SER A 39 75.963 1.056 10.311 1.00 0.00 H new ATOM 0 HG SER A 39 74.545 0.863 8.470 1.00 0.00 H new ATOM 577 N GLU A 40 78.661 -0.699 11.128 1.00 0.00 N ATOM 578 CA GLU A 40 79.416 -0.746 12.404 1.00 0.00 C ATOM 579 C GLU A 40 80.912 -0.700 12.114 1.00 0.00 C ATOM 580 O GLU A 40 81.676 -0.073 12.821 1.00 0.00 O ATOM 581 CB GLU A 40 79.023 -2.079 13.022 1.00 0.00 C ATOM 582 CG GLU A 40 78.724 -1.889 14.510 1.00 0.00 C ATOM 583 CD GLU A 40 79.784 -2.607 15.347 1.00 0.00 C ATOM 584 OE1 GLU A 40 80.547 -3.369 14.777 1.00 0.00 O ATOM 585 OE2 GLU A 40 79.816 -2.383 16.546 1.00 0.00 O ATOM 0 H GLU A 40 78.322 -1.601 10.794 1.00 0.00 H new ATOM 0 HA GLU A 40 79.196 0.091 13.066 1.00 0.00 H new ATOM 0 HB2 GLU A 40 78.147 -2.482 12.514 1.00 0.00 H new ATOM 0 HB3 GLU A 40 79.828 -2.802 12.892 1.00 0.00 H new ATOM 0 HG2 GLU A 40 78.712 -0.827 14.755 1.00 0.00 H new ATOM 0 HG3 GLU A 40 77.735 -2.282 14.745 1.00 0.00 H new ATOM 592 N LEU A 41 81.330 -1.348 11.067 1.00 0.00 N ATOM 593 CA LEU A 41 82.774 -1.330 10.715 1.00 0.00 C ATOM 594 C LEU A 41 83.167 0.077 10.279 1.00 0.00 C ATOM 595 O LEU A 41 84.275 0.521 10.501 1.00 0.00 O ATOM 596 CB LEU A 41 82.928 -2.318 9.558 1.00 0.00 C ATOM 597 CG LEU A 41 84.299 -2.992 9.645 1.00 0.00 C ATOM 598 CD1 LEU A 41 84.241 -4.359 8.962 1.00 0.00 C ATOM 599 CD2 LEU A 41 85.340 -2.116 8.944 1.00 0.00 C ATOM 0 H LEU A 41 80.735 -1.889 10.440 1.00 0.00 H new ATOM 0 HA LEU A 41 83.412 -1.606 11.554 1.00 0.00 H new ATOM 0 HB2 LEU A 41 82.138 -3.068 9.598 1.00 0.00 H new ATOM 0 HB3 LEU A 41 82.826 -1.798 8.605 1.00 0.00 H new ATOM 0 HG LEU A 41 84.575 -3.121 10.691 1.00 0.00 H new ATOM 0 HD11 LEU A 41 85.218 -4.839 9.024 1.00 0.00 H new ATOM 0 HD12 LEU A 41 83.498 -4.983 9.459 1.00 0.00 H new ATOM 0 HD13 LEU A 41 83.966 -4.231 7.915 1.00 0.00 H new ATOM 0 HD21 LEU A 41 86.318 -2.594 9.005 1.00 0.00 H new ATOM 0 HD22 LEU A 41 85.063 -1.988 7.898 1.00 0.00 H new ATOM 0 HD23 LEU A 41 85.382 -1.141 9.430 1.00 0.00 H new ATOM 611 N PHE A 42 82.260 0.789 9.669 1.00 0.00 N ATOM 612 CA PHE A 42 82.576 2.169 9.236 1.00 0.00 C ATOM 613 C PHE A 42 82.283 3.137 10.378 1.00 0.00 C ATOM 614 O PHE A 42 82.736 4.258 10.387 1.00 0.00 O ATOM 615 CB PHE A 42 81.641 2.430 8.065 1.00 0.00 C ATOM 616 CG PHE A 42 82.203 1.799 6.813 1.00 0.00 C ATOM 617 CD1 PHE A 42 82.314 0.406 6.721 1.00 0.00 C ATOM 618 CD2 PHE A 42 82.610 2.605 5.744 1.00 0.00 C ATOM 619 CE1 PHE A 42 82.832 -0.180 5.561 1.00 0.00 C ATOM 620 CE2 PHE A 42 83.129 2.019 4.584 1.00 0.00 C ATOM 621 CZ PHE A 42 83.241 0.627 4.492 1.00 0.00 C ATOM 0 H PHE A 42 81.315 0.470 9.454 1.00 0.00 H new ATOM 0 HA PHE A 42 83.622 2.298 8.958 1.00 0.00 H new ATOM 0 HB2 PHE A 42 80.653 2.021 8.278 1.00 0.00 H new ATOM 0 HB3 PHE A 42 81.517 3.503 7.919 1.00 0.00 H new ATOM 0 HD1 PHE A 42 82.000 -0.216 7.546 1.00 0.00 H new ATOM 0 HD2 PHE A 42 82.524 3.679 5.814 1.00 0.00 H new ATOM 0 HE1 PHE A 42 82.916 -1.254 5.490 1.00 0.00 H new ATOM 0 HE2 PHE A 42 83.443 2.641 3.759 1.00 0.00 H new ATOM 0 HZ PHE A 42 83.643 0.175 3.597 1.00 0.00 H new ATOM 631 N ALA A 43 81.525 2.712 11.345 1.00 0.00 N ATOM 632 CA ALA A 43 81.213 3.614 12.487 1.00 0.00 C ATOM 633 C ALA A 43 82.286 3.474 13.565 1.00 0.00 C ATOM 634 O ALA A 43 82.570 4.399 14.300 1.00 0.00 O ATOM 635 CB ALA A 43 79.866 3.137 13.008 1.00 0.00 C ATOM 0 H ALA A 43 81.108 1.782 11.396 1.00 0.00 H new ATOM 0 HA ALA A 43 81.185 4.664 12.195 1.00 0.00 H new ATOM 0 HB1 ALA A 43 79.564 3.754 13.855 1.00 0.00 H new ATOM 0 HB2 ALA A 43 79.121 3.217 12.217 1.00 0.00 H new ATOM 0 HB3 ALA A 43 79.946 2.098 13.327 1.00 0.00 H new ATOM 641 N LYS A 44 82.888 2.323 13.657 1.00 0.00 N ATOM 642 CA LYS A 44 83.952 2.116 14.678 1.00 0.00 C ATOM 643 C LYS A 44 85.311 2.455 14.070 1.00 0.00 C ATOM 644 O LYS A 44 86.266 2.737 14.766 1.00 0.00 O ATOM 645 CB LYS A 44 83.878 0.631 15.041 1.00 0.00 C ATOM 646 CG LYS A 44 82.945 0.443 16.238 1.00 0.00 C ATOM 647 CD LYS A 44 82.538 -1.028 16.343 1.00 0.00 C ATOM 648 CE LYS A 44 82.754 -1.516 17.778 1.00 0.00 C ATOM 649 NZ LYS A 44 81.791 -2.639 17.952 1.00 0.00 N ATOM 0 H LYS A 44 82.689 1.514 13.068 1.00 0.00 H new ATOM 0 HA LYS A 44 83.820 2.748 15.556 1.00 0.00 H new ATOM 0 HB2 LYS A 44 83.515 0.056 14.190 1.00 0.00 H new ATOM 0 HB3 LYS A 44 84.873 0.254 15.279 1.00 0.00 H new ATOM 0 HG2 LYS A 44 83.444 0.759 17.154 1.00 0.00 H new ATOM 0 HG3 LYS A 44 82.060 1.069 16.124 1.00 0.00 H new ATOM 0 HD2 LYS A 44 81.492 -1.148 16.060 1.00 0.00 H new ATOM 0 HD3 LYS A 44 83.127 -1.630 15.650 1.00 0.00 H new ATOM 0 HE2 LYS A 44 83.781 -1.849 17.931 1.00 0.00 H new ATOM 0 HE3 LYS A 44 82.566 -0.720 18.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 81.641 -2.814 18.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 80.885 -2.392 17.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 82.174 -3.497 17.506 1.00 0.00 H new ATOM 663 N ASN A 45 85.397 2.437 12.769 1.00 0.00 N ATOM 664 CA ASN A 45 86.682 2.765 12.101 1.00 0.00 C ATOM 665 C ASN A 45 86.872 4.279 12.070 1.00 0.00 C ATOM 666 O ASN A 45 87.827 4.799 12.610 1.00 0.00 O ATOM 667 CB ASN A 45 86.524 2.224 10.682 1.00 0.00 C ATOM 668 CG ASN A 45 87.058 0.795 10.615 1.00 0.00 C ATOM 669 OD1 ASN A 45 88.021 0.524 9.927 1.00 0.00 O ATOM 670 ND2 ASN A 45 86.467 -0.136 11.308 1.00 0.00 N ATOM 0 H ASN A 45 84.628 2.208 12.139 1.00 0.00 H new ATOM 0 HA ASN A 45 87.545 2.339 12.612 1.00 0.00 H new ATOM 0 HB2 ASN A 45 85.474 2.245 10.389 1.00 0.00 H new ATOM 0 HB3 ASN A 45 87.064 2.858 9.978 1.00 0.00 H new ATOM 0 HD21 ASN A 45 86.813 -1.095 11.273 1.00 0.00 H new ATOM 0 HD22 ASN A 45 85.658 0.094 11.885 1.00 0.00 H new ATOM 677 N ASP A 46 85.938 4.969 11.454 1.00 0.00 N ATOM 678 CA ASP A 46 85.969 6.465 11.349 1.00 0.00 C ATOM 679 C ASP A 46 85.313 6.913 10.041 1.00 0.00 C ATOM 680 O ASP A 46 85.662 7.930 9.477 1.00 0.00 O ATOM 681 CB ASP A 46 87.438 6.906 11.354 1.00 0.00 C ATOM 682 CG ASP A 46 87.838 7.344 12.766 1.00 0.00 C ATOM 683 OD1 ASP A 46 87.012 7.944 13.435 1.00 0.00 O ATOM 684 OD2 ASP A 46 88.963 7.073 13.152 1.00 0.00 O ATOM 0 H ASP A 46 85.129 4.541 11.005 1.00 0.00 H new ATOM 0 HA ASP A 46 85.426 6.910 12.183 1.00 0.00 H new ATOM 0 HB2 ASP A 46 88.075 6.086 11.022 1.00 0.00 H new ATOM 0 HB3 ASP A 46 87.584 7.727 10.652 1.00 0.00 H new ATOM 689 N LEU A 47 84.366 6.163 9.555 1.00 0.00 N ATOM 690 CA LEU A 47 83.688 6.541 8.290 1.00 0.00 C ATOM 691 C LEU A 47 82.262 7.004 8.591 1.00 0.00 C ATOM 692 O LEU A 47 81.945 7.388 9.700 1.00 0.00 O ATOM 693 CB LEU A 47 83.682 5.257 7.457 1.00 0.00 C ATOM 694 CG LEU A 47 84.860 5.278 6.481 1.00 0.00 C ATOM 695 CD1 LEU A 47 85.518 3.898 6.443 1.00 0.00 C ATOM 696 CD2 LEU A 47 84.357 5.640 5.083 1.00 0.00 C ATOM 0 H LEU A 47 84.032 5.300 9.983 1.00 0.00 H new ATOM 0 HA LEU A 47 84.184 7.359 7.768 1.00 0.00 H new ATOM 0 HB2 LEU A 47 83.752 4.387 8.110 1.00 0.00 H new ATOM 0 HB3 LEU A 47 82.744 5.170 6.909 1.00 0.00 H new ATOM 0 HG LEU A 47 85.589 6.019 6.809 1.00 0.00 H new ATOM 0 HD11 LEU A 47 86.357 3.914 5.747 1.00 0.00 H new ATOM 0 HD12 LEU A 47 85.877 3.639 7.439 1.00 0.00 H new ATOM 0 HD13 LEU A 47 84.789 3.156 6.116 1.00 0.00 H new ATOM 0 HD21 LEU A 47 85.196 5.655 4.387 1.00 0.00 H new ATOM 0 HD22 LEU A 47 83.627 4.899 4.756 1.00 0.00 H new ATOM 0 HD23 LEU A 47 83.889 6.624 5.108 1.00 0.00 H new ATOM 708 N ALA A 48 81.403 6.970 7.618 1.00 0.00 N ATOM 709 CA ALA A 48 79.996 7.405 7.850 1.00 0.00 C ATOM 710 C ALA A 48 79.087 6.837 6.762 1.00 0.00 C ATOM 711 O ALA A 48 78.519 7.561 5.968 1.00 0.00 O ATOM 712 CB ALA A 48 80.035 8.930 7.781 1.00 0.00 C ATOM 0 H ALA A 48 81.611 6.660 6.669 1.00 0.00 H new ATOM 0 HA ALA A 48 79.605 7.055 8.805 1.00 0.00 H new ATOM 0 HB1 ALA A 48 79.033 9.327 7.943 1.00 0.00 H new ATOM 0 HB2 ALA A 48 80.705 9.312 8.551 1.00 0.00 H new ATOM 0 HB3 ALA A 48 80.395 9.241 6.800 1.00 0.00 H new ATOM 718 N VAL A 49 78.946 5.543 6.722 1.00 0.00 N ATOM 719 CA VAL A 49 78.084 4.912 5.703 1.00 0.00 C ATOM 720 C VAL A 49 76.684 5.514 5.757 1.00 0.00 C ATOM 721 O VAL A 49 75.969 5.387 6.732 1.00 0.00 O ATOM 722 CB VAL A 49 78.059 3.440 6.085 1.00 0.00 C ATOM 723 CG1 VAL A 49 79.413 2.803 5.764 1.00 0.00 C ATOM 724 CG2 VAL A 49 77.778 3.307 7.584 1.00 0.00 C ATOM 0 H VAL A 49 79.400 4.892 7.363 1.00 0.00 H new ATOM 0 HA VAL A 49 78.449 5.063 4.687 1.00 0.00 H new ATOM 0 HB VAL A 49 77.277 2.933 5.520 1.00 0.00 H new ATOM 0 HG11 VAL A 49 79.393 1.748 6.038 1.00 0.00 H new ATOM 0 HG12 VAL A 49 79.615 2.897 4.697 1.00 0.00 H new ATOM 0 HG13 VAL A 49 80.196 3.310 6.328 1.00 0.00 H new ATOM 0 HG21 VAL A 49 77.760 2.252 7.859 1.00 0.00 H new ATOM 0 HG22 VAL A 49 78.561 3.815 8.147 1.00 0.00 H new ATOM 0 HG23 VAL A 49 76.813 3.759 7.815 1.00 0.00 H new ATOM 734 N VAL A 50 76.302 6.171 4.711 1.00 0.00 N ATOM 735 CA VAL A 50 74.954 6.807 4.664 1.00 0.00 C ATOM 736 C VAL A 50 73.891 5.780 4.269 1.00 0.00 C ATOM 737 O VAL A 50 72.774 5.817 4.746 1.00 0.00 O ATOM 738 CB VAL A 50 75.077 7.895 3.601 1.00 0.00 C ATOM 739 CG1 VAL A 50 73.859 8.817 3.658 1.00 0.00 C ATOM 740 CG2 VAL A 50 76.338 8.714 3.870 1.00 0.00 C ATOM 0 H VAL A 50 76.868 6.301 3.872 1.00 0.00 H new ATOM 0 HA VAL A 50 74.651 7.210 5.630 1.00 0.00 H new ATOM 0 HB VAL A 50 75.133 7.433 2.615 1.00 0.00 H new ATOM 0 HG11 VAL A 50 73.953 9.591 2.897 1.00 0.00 H new ATOM 0 HG12 VAL A 50 72.955 8.237 3.476 1.00 0.00 H new ATOM 0 HG13 VAL A 50 73.800 9.281 4.642 1.00 0.00 H new ATOM 0 HG21 VAL A 50 76.433 9.494 3.115 1.00 0.00 H new ATOM 0 HG22 VAL A 50 76.271 9.171 4.857 1.00 0.00 H new ATOM 0 HG23 VAL A 50 77.211 8.062 3.830 1.00 0.00 H new ATOM 750 N ASP A 51 74.222 4.863 3.400 1.00 0.00 N ATOM 751 CA ASP A 51 73.214 3.845 2.985 1.00 0.00 C ATOM 752 C ASP A 51 73.902 2.548 2.547 1.00 0.00 C ATOM 753 O ASP A 51 75.087 2.518 2.279 1.00 0.00 O ATOM 754 CB ASP A 51 72.472 4.479 1.809 1.00 0.00 C ATOM 755 CG ASP A 51 70.971 4.507 2.106 1.00 0.00 C ATOM 756 OD1 ASP A 51 70.617 4.441 3.271 1.00 0.00 O ATOM 757 OD2 ASP A 51 70.203 4.592 1.163 1.00 0.00 O ATOM 0 H ASP A 51 75.139 4.775 2.962 1.00 0.00 H new ATOM 0 HA ASP A 51 72.542 3.581 3.802 1.00 0.00 H new ATOM 0 HB2 ASP A 51 72.838 5.491 1.638 1.00 0.00 H new ATOM 0 HB3 ASP A 51 72.662 3.913 0.897 1.00 0.00 H new ATOM 762 N VAL A 52 73.159 1.479 2.466 1.00 0.00 N ATOM 763 CA VAL A 52 73.748 0.179 2.039 1.00 0.00 C ATOM 764 C VAL A 52 72.641 -0.747 1.529 1.00 0.00 C ATOM 765 O VAL A 52 71.902 -1.332 2.295 1.00 0.00 O ATOM 766 CB VAL A 52 74.410 -0.397 3.292 1.00 0.00 C ATOM 767 CG1 VAL A 52 73.391 -0.464 4.431 1.00 0.00 C ATOM 768 CG2 VAL A 52 74.936 -1.801 2.985 1.00 0.00 C ATOM 0 H VAL A 52 72.162 1.450 2.679 1.00 0.00 H new ATOM 0 HA VAL A 52 74.468 0.293 1.228 1.00 0.00 H new ATOM 0 HB VAL A 52 75.238 0.244 3.594 1.00 0.00 H new ATOM 0 HG11 VAL A 52 73.867 -0.875 5.321 1.00 0.00 H new ATOM 0 HG12 VAL A 52 73.021 0.538 4.647 1.00 0.00 H new ATOM 0 HG13 VAL A 52 72.558 -1.103 4.137 1.00 0.00 H new ATOM 0 HG21 VAL A 52 75.409 -2.215 3.876 1.00 0.00 H new ATOM 0 HG22 VAL A 52 74.108 -2.442 2.682 1.00 0.00 H new ATOM 0 HG23 VAL A 52 75.667 -1.747 2.178 1.00 0.00 H new ATOM 778 N ARG A 53 72.516 -0.878 0.236 1.00 0.00 N ATOM 779 CA ARG A 53 71.451 -1.758 -0.324 1.00 0.00 C ATOM 780 C ARG A 53 72.006 -3.160 -0.588 1.00 0.00 C ATOM 781 O ARG A 53 73.202 -3.368 -0.626 1.00 0.00 O ATOM 782 CB ARG A 53 71.032 -1.088 -1.633 1.00 0.00 C ATOM 783 CG ARG A 53 69.858 -0.143 -1.369 1.00 0.00 C ATOM 784 CD ARG A 53 68.836 -0.267 -2.502 1.00 0.00 C ATOM 785 NE ARG A 53 67.797 -1.198 -1.981 1.00 0.00 N ATOM 786 CZ ARG A 53 67.072 -0.857 -0.950 1.00 0.00 C ATOM 787 NH1 ARG A 53 66.137 0.044 -1.080 1.00 0.00 N ATOM 788 NH2 ARG A 53 67.282 -1.416 0.209 1.00 0.00 N ATOM 0 H ARG A 53 73.105 -0.414 -0.456 1.00 0.00 H new ATOM 0 HA ARG A 53 70.610 -1.876 0.360 1.00 0.00 H new ATOM 0 HB2 ARG A 53 71.871 -0.534 -2.055 1.00 0.00 H new ATOM 0 HB3 ARG A 53 70.747 -1.843 -2.366 1.00 0.00 H new ATOM 0 HG2 ARG A 53 69.390 -0.386 -0.415 1.00 0.00 H new ATOM 0 HG3 ARG A 53 70.214 0.885 -1.297 1.00 0.00 H new ATOM 0 HD2 ARG A 53 68.407 0.703 -2.755 1.00 0.00 H new ATOM 0 HD3 ARG A 53 69.297 -0.658 -3.409 1.00 0.00 H new ATOM 0 HE ARG A 53 67.652 -2.102 -2.430 1.00 0.00 H new ATOM 0 HH11 ARG A 53 65.973 0.481 -1.987 1.00 0.00 H new ATOM 0 HH12 ARG A 53 65.570 0.311 -0.275 1.00 0.00 H new ATOM 0 HH21 ARG A 53 68.013 -2.120 0.311 1.00 0.00 H new ATOM 0 HH22 ARG A 53 66.715 -1.149 1.014 1.00 0.00 H new ATOM 802 N THR A 54 71.144 -4.125 -0.758 1.00 0.00 N ATOM 803 CA THR A 54 71.616 -5.510 -1.005 1.00 0.00 C ATOM 804 C THR A 54 71.903 -5.727 -2.493 1.00 0.00 C ATOM 805 O THR A 54 71.449 -4.986 -3.342 1.00 0.00 O ATOM 806 CB THR A 54 70.453 -6.391 -0.551 1.00 0.00 C ATOM 807 OG1 THR A 54 69.417 -6.342 -1.522 1.00 0.00 O ATOM 808 CG2 THR A 54 69.920 -5.894 0.794 1.00 0.00 C ATOM 0 H THR A 54 70.131 -4.010 -0.736 1.00 0.00 H new ATOM 0 HA THR A 54 72.543 -5.733 -0.477 1.00 0.00 H new ATOM 0 HB THR A 54 70.800 -7.418 -0.440 1.00 0.00 H new ATOM 0 HG1 THR A 54 68.671 -6.908 -1.233 1.00 0.00 H new ATOM 0 HG21 THR A 54 69.091 -6.526 1.113 1.00 0.00 H new ATOM 0 HG22 THR A 54 70.715 -5.936 1.538 1.00 0.00 H new ATOM 0 HG23 THR A 54 69.574 -4.866 0.691 1.00 0.00 H new ATOM 816 N GLY A 55 72.656 -6.744 -2.808 1.00 0.00 N ATOM 817 CA GLY A 55 72.983 -7.027 -4.233 1.00 0.00 C ATOM 818 C GLY A 55 72.370 -8.367 -4.639 1.00 0.00 C ATOM 819 O GLY A 55 72.651 -9.388 -4.039 1.00 0.00 O ATOM 0 H GLY A 55 73.061 -7.395 -2.135 1.00 0.00 H new ATOM 0 HA2 GLY A 55 72.599 -6.231 -4.871 1.00 0.00 H new ATOM 0 HA3 GLY A 55 74.064 -7.052 -4.371 1.00 0.00 H new ATOM 823 N THR A 56 71.532 -8.343 -5.650 1.00 0.00 N ATOM 824 CA THR A 56 70.845 -9.580 -6.154 1.00 0.00 C ATOM 825 C THR A 56 71.584 -10.861 -5.759 1.00 0.00 C ATOM 826 O THR A 56 72.798 -10.919 -5.750 1.00 0.00 O ATOM 827 CB THR A 56 70.836 -9.425 -7.674 1.00 0.00 C ATOM 828 OG1 THR A 56 70.415 -8.112 -8.013 1.00 0.00 O ATOM 829 CG2 THR A 56 69.877 -10.446 -8.289 1.00 0.00 C ATOM 0 H THR A 56 71.289 -7.494 -6.161 1.00 0.00 H new ATOM 0 HA THR A 56 69.847 -9.674 -5.725 1.00 0.00 H new ATOM 0 HB THR A 56 71.840 -9.596 -8.062 1.00 0.00 H new ATOM 0 HG1 THR A 56 70.411 -8.011 -8.988 1.00 0.00 H new ATOM 0 HG21 THR A 56 69.872 -10.334 -9.373 1.00 0.00 H new ATOM 0 HG22 THR A 56 70.203 -11.453 -8.030 1.00 0.00 H new ATOM 0 HG23 THR A 56 68.872 -10.280 -7.903 1.00 0.00 H new ATOM 837 N ASN A 57 70.848 -11.895 -5.439 1.00 0.00 N ATOM 838 CA ASN A 57 71.482 -13.186 -5.044 1.00 0.00 C ATOM 839 C ASN A 57 72.101 -13.059 -3.652 1.00 0.00 C ATOM 840 O ASN A 57 72.944 -13.844 -3.264 1.00 0.00 O ATOM 841 CB ASN A 57 72.563 -13.449 -6.096 1.00 0.00 C ATOM 842 CG ASN A 57 72.407 -14.868 -6.642 1.00 0.00 C ATOM 843 OD1 ASN A 57 72.542 -15.094 -7.828 1.00 0.00 O ATOM 844 ND2 ASN A 57 72.127 -15.842 -5.820 1.00 0.00 N ATOM 0 H ASN A 57 69.828 -11.899 -5.435 1.00 0.00 H new ATOM 0 HA ASN A 57 70.761 -14.002 -5.001 1.00 0.00 H new ATOM 0 HB2 ASN A 57 72.481 -12.725 -6.906 1.00 0.00 H new ATOM 0 HB3 ASN A 57 73.552 -13.324 -5.656 1.00 0.00 H new ATOM 0 HD21 ASN A 57 72.022 -16.793 -6.173 1.00 0.00 H new ATOM 0 HD22 ASN A 57 72.014 -15.652 -4.824 1.00 0.00 H new ATOM 851 N ARG A 58 71.688 -12.076 -2.897 1.00 0.00 N ATOM 852 CA ARG A 58 72.255 -11.896 -1.530 1.00 0.00 C ATOM 853 C ARG A 58 73.767 -12.110 -1.565 1.00 0.00 C ATOM 854 O ARG A 58 74.375 -12.498 -0.588 1.00 0.00 O ATOM 855 CB ARG A 58 71.580 -12.965 -0.669 1.00 0.00 C ATOM 856 CG ARG A 58 70.085 -13.016 -0.991 1.00 0.00 C ATOM 857 CD ARG A 58 69.489 -11.612 -0.883 1.00 0.00 C ATOM 858 NE ARG A 58 68.305 -11.764 0.008 1.00 0.00 N ATOM 859 CZ ARG A 58 68.212 -11.052 1.097 1.00 0.00 C ATOM 860 NH1 ARG A 58 68.624 -9.813 1.105 1.00 0.00 N ATOM 861 NH2 ARG A 58 67.709 -11.577 2.180 1.00 0.00 N ATOM 0 H ARG A 58 70.983 -11.391 -3.168 1.00 0.00 H new ATOM 0 HA ARG A 58 72.079 -10.895 -1.137 1.00 0.00 H new ATOM 0 HB2 ARG A 58 72.036 -13.937 -0.856 1.00 0.00 H new ATOM 0 HB3 ARG A 58 71.727 -12.741 0.388 1.00 0.00 H new ATOM 0 HG2 ARG A 58 69.932 -13.411 -1.996 1.00 0.00 H new ATOM 0 HG3 ARG A 58 69.577 -13.692 -0.303 1.00 0.00 H new ATOM 0 HD2 ARG A 58 70.209 -10.908 -0.466 1.00 0.00 H new ATOM 0 HD3 ARG A 58 69.200 -11.229 -1.862 1.00 0.00 H new ATOM 0 HE ARG A 58 67.567 -12.425 -0.234 1.00 0.00 H new ATOM 0 HH11 ARG A 58 69.019 -9.401 0.259 1.00 0.00 H new ATOM 0 HH12 ARG A 58 68.551 -9.257 1.957 1.00 0.00 H new ATOM 0 HH21 ARG A 58 67.388 -12.545 2.176 1.00 0.00 H new ATOM 0 HH22 ARG A 58 67.637 -11.019 3.031 1.00 0.00 H new ATOM 875 N LYS A 59 74.379 -11.861 -2.692 1.00 0.00 N ATOM 876 CA LYS A 59 75.850 -12.053 -2.795 1.00 0.00 C ATOM 877 C LYS A 59 76.549 -10.699 -2.936 1.00 0.00 C ATOM 878 O LYS A 59 77.736 -10.580 -2.710 1.00 0.00 O ATOM 879 CB LYS A 59 76.053 -12.899 -4.053 1.00 0.00 C ATOM 880 CG LYS A 59 76.349 -14.346 -3.652 1.00 0.00 C ATOM 881 CD LYS A 59 75.132 -15.222 -3.956 1.00 0.00 C ATOM 882 CE LYS A 59 75.598 -16.549 -4.558 1.00 0.00 C ATOM 883 NZ LYS A 59 74.599 -16.862 -5.617 1.00 0.00 N ATOM 0 H LYS A 59 73.922 -11.533 -3.543 1.00 0.00 H new ATOM 0 HA LYS A 59 76.268 -12.535 -1.911 1.00 0.00 H new ATOM 0 HB2 LYS A 59 75.162 -12.859 -4.679 1.00 0.00 H new ATOM 0 HB3 LYS A 59 76.876 -12.499 -4.645 1.00 0.00 H new ATOM 0 HG2 LYS A 59 77.219 -14.714 -4.195 1.00 0.00 H new ATOM 0 HG3 LYS A 59 76.591 -14.398 -2.590 1.00 0.00 H new ATOM 0 HD2 LYS A 59 74.564 -15.404 -3.044 1.00 0.00 H new ATOM 0 HD3 LYS A 59 74.466 -14.710 -4.650 1.00 0.00 H new ATOM 0 HE2 LYS A 59 76.601 -16.463 -4.975 1.00 0.00 H new ATOM 0 HE3 LYS A 59 75.633 -17.335 -3.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 74.974 -17.606 -6.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 73.717 -17.192 -5.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 74.407 -16.007 -6.177 1.00 0.00 H new ATOM 897 N PHE A 60 75.827 -9.674 -3.302 1.00 0.00 N ATOM 898 CA PHE A 60 76.470 -8.334 -3.443 1.00 0.00 C ATOM 899 C PHE A 60 75.652 -7.291 -2.685 1.00 0.00 C ATOM 900 O PHE A 60 74.769 -7.620 -1.920 1.00 0.00 O ATOM 901 CB PHE A 60 76.487 -8.020 -4.947 1.00 0.00 C ATOM 902 CG PHE A 60 76.620 -9.293 -5.751 1.00 0.00 C ATOM 903 CD1 PHE A 60 75.477 -10.034 -6.075 1.00 0.00 C ATOM 904 CD2 PHE A 60 77.880 -9.731 -6.169 1.00 0.00 C ATOM 905 CE1 PHE A 60 75.594 -11.212 -6.820 1.00 0.00 C ATOM 906 CE2 PHE A 60 77.999 -10.911 -6.914 1.00 0.00 C ATOM 907 CZ PHE A 60 76.856 -11.651 -7.240 1.00 0.00 C ATOM 0 H PHE A 60 74.828 -9.704 -3.508 1.00 0.00 H new ATOM 0 HA PHE A 60 77.480 -8.323 -3.033 1.00 0.00 H new ATOM 0 HB2 PHE A 60 75.571 -7.500 -5.227 1.00 0.00 H new ATOM 0 HB3 PHE A 60 77.316 -7.350 -5.176 1.00 0.00 H new ATOM 0 HD1 PHE A 60 74.504 -9.696 -5.749 1.00 0.00 H new ATOM 0 HD2 PHE A 60 78.761 -9.160 -5.918 1.00 0.00 H new ATOM 0 HE1 PHE A 60 74.712 -11.783 -7.071 1.00 0.00 H new ATOM 0 HE2 PHE A 60 78.972 -11.250 -7.237 1.00 0.00 H new ATOM 0 HZ PHE A 60 76.947 -12.560 -7.815 1.00 0.00 H new ATOM 917 N GLY A 61 75.935 -6.039 -2.889 1.00 0.00 N ATOM 918 CA GLY A 61 75.167 -4.981 -2.177 1.00 0.00 C ATOM 919 C GLY A 61 75.719 -3.606 -2.542 1.00 0.00 C ATOM 920 O GLY A 61 76.862 -3.466 -2.924 1.00 0.00 O ATOM 0 H GLY A 61 76.664 -5.700 -3.517 1.00 0.00 H new ATOM 0 HA2 GLY A 61 74.112 -5.042 -2.445 1.00 0.00 H new ATOM 0 HA3 GLY A 61 75.232 -5.135 -1.100 1.00 0.00 H new ATOM 924 N TYR A 62 74.914 -2.588 -2.421 1.00 0.00 N ATOM 925 CA TYR A 62 75.393 -1.213 -2.753 1.00 0.00 C ATOM 926 C TYR A 62 75.547 -0.399 -1.479 1.00 0.00 C ATOM 927 O TYR A 62 75.028 -0.750 -0.438 1.00 0.00 O ATOM 928 CB TYR A 62 74.315 -0.613 -3.657 1.00 0.00 C ATOM 929 CG TYR A 62 74.139 -1.480 -4.880 1.00 0.00 C ATOM 930 CD1 TYR A 62 73.564 -2.751 -4.761 1.00 0.00 C ATOM 931 CD2 TYR A 62 74.549 -1.012 -6.134 1.00 0.00 C ATOM 932 CE1 TYR A 62 73.399 -3.554 -5.897 1.00 0.00 C ATOM 933 CE2 TYR A 62 74.384 -1.815 -7.269 1.00 0.00 C ATOM 934 CZ TYR A 62 73.809 -3.086 -7.150 1.00 0.00 C ATOM 935 OH TYR A 62 73.647 -3.878 -8.269 1.00 0.00 O ATOM 0 H TYR A 62 73.945 -2.646 -2.107 1.00 0.00 H new ATOM 0 HA TYR A 62 76.365 -1.221 -3.247 1.00 0.00 H new ATOM 0 HB2 TYR A 62 73.373 -0.536 -3.115 1.00 0.00 H new ATOM 0 HB3 TYR A 62 74.596 0.398 -3.953 1.00 0.00 H new ATOM 0 HD1 TYR A 62 73.248 -3.112 -3.794 1.00 0.00 H new ATOM 0 HD2 TYR A 62 74.993 -0.032 -6.226 1.00 0.00 H new ATOM 0 HE1 TYR A 62 72.955 -4.534 -5.805 1.00 0.00 H new ATOM 0 HE2 TYR A 62 74.700 -1.454 -8.236 1.00 0.00 H new ATOM 0 HH TYR A 62 73.983 -3.403 -9.057 1.00 0.00 H new ATOM 945 N VAL A 63 76.278 0.676 -1.543 1.00 0.00 N ATOM 946 CA VAL A 63 76.484 1.492 -0.321 1.00 0.00 C ATOM 947 C VAL A 63 76.684 2.967 -0.677 1.00 0.00 C ATOM 948 O VAL A 63 77.303 3.302 -1.667 1.00 0.00 O ATOM 949 CB VAL A 63 77.749 0.916 0.315 1.00 0.00 C ATOM 950 CG1 VAL A 63 77.827 1.357 1.768 1.00 0.00 C ATOM 951 CG2 VAL A 63 77.716 -0.615 0.262 1.00 0.00 C ATOM 0 H VAL A 63 76.739 1.022 -2.384 1.00 0.00 H new ATOM 0 HA VAL A 63 75.626 1.453 0.350 1.00 0.00 H new ATOM 0 HB VAL A 63 78.618 1.278 -0.235 1.00 0.00 H new ATOM 0 HG11 VAL A 63 78.728 0.948 2.225 1.00 0.00 H new ATOM 0 HG12 VAL A 63 77.858 2.445 1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 63 76.951 0.994 2.306 1.00 0.00 H new ATOM 0 HG21 VAL A 63 78.622 -1.014 0.718 1.00 0.00 H new ATOM 0 HG22 VAL A 63 76.845 -0.979 0.807 1.00 0.00 H new ATOM 0 HG23 VAL A 63 77.658 -0.942 -0.776 1.00 0.00 H new ATOM 961 N ASP A 64 76.166 3.847 0.134 1.00 0.00 N ATOM 962 CA ASP A 64 76.318 5.301 -0.133 1.00 0.00 C ATOM 963 C ASP A 64 77.178 5.940 0.961 1.00 0.00 C ATOM 964 O ASP A 64 77.121 5.550 2.111 1.00 0.00 O ATOM 965 CB ASP A 64 74.897 5.857 -0.086 1.00 0.00 C ATOM 966 CG ASP A 64 73.991 5.021 -0.992 1.00 0.00 C ATOM 967 OD1 ASP A 64 73.902 3.825 -0.768 1.00 0.00 O ATOM 968 OD2 ASP A 64 73.401 5.592 -1.895 1.00 0.00 O ATOM 0 H ASP A 64 75.640 3.617 0.977 1.00 0.00 H new ATOM 0 HA ASP A 64 76.804 5.504 -1.087 1.00 0.00 H new ATOM 0 HB2 ASP A 64 74.522 5.839 0.937 1.00 0.00 H new ATOM 0 HB3 ASP A 64 74.892 6.898 -0.409 1.00 0.00 H new ATOM 973 N PHE A 65 77.976 6.912 0.615 1.00 0.00 N ATOM 974 CA PHE A 65 78.838 7.565 1.642 1.00 0.00 C ATOM 975 C PHE A 65 78.346 8.986 1.923 1.00 0.00 C ATOM 976 O PHE A 65 77.393 9.451 1.331 1.00 0.00 O ATOM 977 CB PHE A 65 80.239 7.573 1.033 1.00 0.00 C ATOM 978 CG PHE A 65 80.822 6.185 1.140 1.00 0.00 C ATOM 979 CD1 PHE A 65 80.725 5.480 2.346 1.00 0.00 C ATOM 980 CD2 PHE A 65 81.451 5.599 0.036 1.00 0.00 C ATOM 981 CE1 PHE A 65 81.255 4.191 2.449 1.00 0.00 C ATOM 982 CE2 PHE A 65 81.983 4.307 0.139 1.00 0.00 C ATOM 983 CZ PHE A 65 81.885 3.603 1.347 1.00 0.00 C ATOM 0 H PHE A 65 78.069 7.282 -0.331 1.00 0.00 H new ATOM 0 HA PHE A 65 78.820 7.040 2.597 1.00 0.00 H new ATOM 0 HB2 PHE A 65 80.195 7.885 -0.010 1.00 0.00 H new ATOM 0 HB3 PHE A 65 80.873 8.290 1.554 1.00 0.00 H new ATOM 0 HD1 PHE A 65 80.240 5.933 3.198 1.00 0.00 H new ATOM 0 HD2 PHE A 65 81.526 6.142 -0.894 1.00 0.00 H new ATOM 0 HE1 PHE A 65 81.178 3.649 3.380 1.00 0.00 H new ATOM 0 HE2 PHE A 65 82.469 3.854 -0.712 1.00 0.00 H new ATOM 0 HZ PHE A 65 82.296 2.607 1.427 1.00 0.00 H new ATOM 993 N GLU A 66 78.975 9.675 2.837 1.00 0.00 N ATOM 994 CA GLU A 66 78.520 11.056 3.164 1.00 0.00 C ATOM 995 C GLU A 66 79.573 12.094 2.775 1.00 0.00 C ATOM 996 O GLU A 66 79.455 13.260 3.096 1.00 0.00 O ATOM 997 CB GLU A 66 78.300 11.053 4.681 1.00 0.00 C ATOM 998 CG GLU A 66 79.646 11.154 5.403 1.00 0.00 C ATOM 999 CD GLU A 66 80.069 12.621 5.501 1.00 0.00 C ATOM 1000 OE1 GLU A 66 79.197 13.473 5.445 1.00 0.00 O ATOM 1001 OE2 GLU A 66 81.258 12.867 5.628 1.00 0.00 O ATOM 0 H GLU A 66 79.780 9.343 3.368 1.00 0.00 H new ATOM 0 HA GLU A 66 77.616 11.321 2.616 1.00 0.00 H new ATOM 0 HB2 GLU A 66 77.661 11.889 4.966 1.00 0.00 H new ATOM 0 HB3 GLU A 66 77.784 10.141 4.981 1.00 0.00 H new ATOM 0 HG2 GLU A 66 79.568 10.720 6.400 1.00 0.00 H new ATOM 0 HG3 GLU A 66 80.402 10.582 4.865 1.00 0.00 H new ATOM 1008 N SER A 67 80.597 11.689 2.089 1.00 0.00 N ATOM 1009 CA SER A 67 81.647 12.675 1.691 1.00 0.00 C ATOM 1010 C SER A 67 82.708 12.048 0.802 1.00 0.00 C ATOM 1011 O SER A 67 82.721 10.860 0.546 1.00 0.00 O ATOM 1012 CB SER A 67 82.292 13.126 2.996 1.00 0.00 C ATOM 1013 OG SER A 67 82.568 11.987 3.802 1.00 0.00 O ATOM 0 H SER A 67 80.758 10.729 1.786 1.00 0.00 H new ATOM 0 HA SER A 67 81.205 13.494 1.124 1.00 0.00 H new ATOM 0 HB2 SER A 67 83.213 13.672 2.790 1.00 0.00 H new ATOM 0 HB3 SER A 67 81.628 13.809 3.526 1.00 0.00 H new ATOM 0 HG SER A 67 82.263 12.153 4.718 1.00 0.00 H new ATOM 1019 N ALA A 68 83.624 12.859 0.368 1.00 0.00 N ATOM 1020 CA ALA A 68 84.741 12.364 -0.470 1.00 0.00 C ATOM 1021 C ALA A 68 85.751 11.714 0.455 1.00 0.00 C ATOM 1022 O ALA A 68 86.544 10.879 0.067 1.00 0.00 O ATOM 1023 CB ALA A 68 85.340 13.620 -1.088 1.00 0.00 C ATOM 0 H ALA A 68 83.646 13.860 0.562 1.00 0.00 H new ATOM 0 HA ALA A 68 84.439 11.643 -1.230 1.00 0.00 H new ATOM 0 HB1 ALA A 68 86.179 13.346 -1.728 1.00 0.00 H new ATOM 0 HB2 ALA A 68 84.582 14.130 -1.682 1.00 0.00 H new ATOM 0 HB3 ALA A 68 85.689 14.284 -0.297 1.00 0.00 H new ATOM 1029 N GLU A 69 85.705 12.110 1.690 1.00 0.00 N ATOM 1030 CA GLU A 69 86.631 11.555 2.696 1.00 0.00 C ATOM 1031 C GLU A 69 86.087 10.219 3.199 1.00 0.00 C ATOM 1032 O GLU A 69 86.826 9.341 3.600 1.00 0.00 O ATOM 1033 CB GLU A 69 86.639 12.609 3.795 1.00 0.00 C ATOM 1034 CG GLU A 69 88.074 12.857 4.250 1.00 0.00 C ATOM 1035 CD GLU A 69 88.230 12.433 5.712 1.00 0.00 C ATOM 1036 OE1 GLU A 69 87.787 13.174 6.574 1.00 0.00 O ATOM 1037 OE2 GLU A 69 88.789 11.374 5.945 1.00 0.00 O ATOM 0 H GLU A 69 85.052 12.807 2.048 1.00 0.00 H new ATOM 0 HA GLU A 69 87.634 11.356 2.318 1.00 0.00 H new ATOM 0 HB2 GLU A 69 86.197 13.535 3.429 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.031 12.277 4.637 1.00 0.00 H new ATOM 0 HG2 GLU A 69 88.767 12.297 3.622 1.00 0.00 H new ATOM 0 HG3 GLU A 69 88.324 13.912 4.138 1.00 0.00 H new ATOM 1044 N ASP A 70 84.794 10.046 3.137 1.00 0.00 N ATOM 1045 CA ASP A 70 84.194 8.761 3.566 1.00 0.00 C ATOM 1046 C ASP A 70 84.320 7.797 2.397 1.00 0.00 C ATOM 1047 O ASP A 70 84.401 6.595 2.558 1.00 0.00 O ATOM 1048 CB ASP A 70 82.730 9.088 3.871 1.00 0.00 C ATOM 1049 CG ASP A 70 81.871 7.828 3.752 1.00 0.00 C ATOM 1050 OD1 ASP A 70 82.431 6.746 3.793 1.00 0.00 O ATOM 1051 OD2 ASP A 70 80.665 7.968 3.625 1.00 0.00 O ATOM 0 H ASP A 70 84.129 10.745 2.806 1.00 0.00 H new ATOM 0 HA ASP A 70 84.669 8.308 4.436 1.00 0.00 H new ATOM 0 HB2 ASP A 70 82.644 9.502 4.876 1.00 0.00 H new ATOM 0 HB3 ASP A 70 82.369 9.850 3.180 1.00 0.00 H new ATOM 1056 N LEU A 71 84.371 8.338 1.211 1.00 0.00 N ATOM 1057 CA LEU A 71 84.525 7.485 0.011 1.00 0.00 C ATOM 1058 C LEU A 71 86.000 7.111 -0.145 1.00 0.00 C ATOM 1059 O LEU A 71 86.338 6.028 -0.580 1.00 0.00 O ATOM 1060 CB LEU A 71 84.056 8.348 -1.161 1.00 0.00 C ATOM 1061 CG LEU A 71 84.358 7.630 -2.477 1.00 0.00 C ATOM 1062 CD1 LEU A 71 83.126 6.845 -2.928 1.00 0.00 C ATOM 1063 CD2 LEU A 71 84.722 8.662 -3.548 1.00 0.00 C ATOM 0 H LEU A 71 84.312 9.339 1.026 1.00 0.00 H new ATOM 0 HA LEU A 71 83.953 6.559 0.071 1.00 0.00 H new ATOM 0 HB2 LEU A 71 82.987 8.543 -1.078 1.00 0.00 H new ATOM 0 HB3 LEU A 71 84.559 9.315 -1.138 1.00 0.00 H new ATOM 0 HG LEU A 71 85.192 6.944 -2.331 1.00 0.00 H new ATOM 0 HD11 LEU A 71 83.343 6.334 -3.866 1.00 0.00 H new ATOM 0 HD12 LEU A 71 82.864 6.110 -2.167 1.00 0.00 H new ATOM 0 HD13 LEU A 71 82.291 7.530 -3.073 1.00 0.00 H new ATOM 0 HD21 LEU A 71 84.938 8.152 -4.487 1.00 0.00 H new ATOM 0 HD22 LEU A 71 83.887 9.348 -3.691 1.00 0.00 H new ATOM 0 HD23 LEU A 71 85.601 9.222 -3.230 1.00 0.00 H new ATOM 1075 N GLU A 72 86.881 8.003 0.229 1.00 0.00 N ATOM 1076 CA GLU A 72 88.338 7.707 0.124 1.00 0.00 C ATOM 1077 C GLU A 72 88.724 6.677 1.187 1.00 0.00 C ATOM 1078 O GLU A 72 89.554 5.813 0.963 1.00 0.00 O ATOM 1079 CB GLU A 72 89.037 9.042 0.386 1.00 0.00 C ATOM 1080 CG GLU A 72 90.522 8.915 0.045 1.00 0.00 C ATOM 1081 CD GLU A 72 91.344 9.768 1.013 1.00 0.00 C ATOM 1082 OE1 GLU A 72 90.819 10.762 1.487 1.00 0.00 O ATOM 1083 OE2 GLU A 72 92.484 9.413 1.263 1.00 0.00 O ATOM 0 H GLU A 72 86.652 8.924 0.603 1.00 0.00 H new ATOM 0 HA GLU A 72 88.616 7.295 -0.846 1.00 0.00 H new ATOM 0 HB2 GLU A 72 88.581 9.828 -0.216 1.00 0.00 H new ATOM 0 HB3 GLU A 72 88.916 9.329 1.430 1.00 0.00 H new ATOM 0 HG2 GLU A 72 90.833 7.872 0.109 1.00 0.00 H new ATOM 0 HG3 GLU A 72 90.699 9.238 -0.981 1.00 0.00 H new ATOM 1090 N LYS A 73 88.098 6.735 2.333 1.00 0.00 N ATOM 1091 CA LYS A 73 88.404 5.737 3.380 1.00 0.00 C ATOM 1092 C LYS A 73 87.738 4.446 2.956 1.00 0.00 C ATOM 1093 O LYS A 73 88.194 3.357 3.245 1.00 0.00 O ATOM 1094 CB LYS A 73 87.779 6.283 4.664 1.00 0.00 C ATOM 1095 CG LYS A 73 88.836 6.332 5.768 1.00 0.00 C ATOM 1096 CD LYS A 73 88.868 7.732 6.383 1.00 0.00 C ATOM 1097 CE LYS A 73 89.028 8.774 5.274 1.00 0.00 C ATOM 1098 NZ LYS A 73 90.292 9.491 5.599 1.00 0.00 N ATOM 0 H LYS A 73 87.393 7.429 2.581 1.00 0.00 H new ATOM 0 HA LYS A 73 89.468 5.557 3.530 1.00 0.00 H new ATOM 0 HB2 LYS A 73 87.375 7.280 4.489 1.00 0.00 H new ATOM 0 HB3 LYS A 73 86.946 5.651 4.972 1.00 0.00 H new ATOM 0 HG2 LYS A 73 88.610 5.591 6.535 1.00 0.00 H new ATOM 0 HG3 LYS A 73 89.815 6.080 5.360 1.00 0.00 H new ATOM 0 HD2 LYS A 73 87.950 7.917 6.940 1.00 0.00 H new ATOM 0 HD3 LYS A 73 89.692 7.810 7.092 1.00 0.00 H new ATOM 0 HE2 LYS A 73 89.083 8.301 4.293 1.00 0.00 H new ATOM 0 HE3 LYS A 73 88.180 9.459 5.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 90.088 10.498 5.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 90.712 9.082 6.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 90.959 9.394 4.807 1.00 0.00 H new ATOM 1112 N ALA A 74 86.661 4.575 2.236 1.00 0.00 N ATOM 1113 CA ALA A 74 85.954 3.377 1.750 1.00 0.00 C ATOM 1114 C ALA A 74 86.825 2.679 0.707 1.00 0.00 C ATOM 1115 O ALA A 74 86.755 1.480 0.520 1.00 0.00 O ATOM 1116 CB ALA A 74 84.662 3.895 1.123 1.00 0.00 C ATOM 0 H ALA A 74 86.244 5.466 1.966 1.00 0.00 H new ATOM 0 HA ALA A 74 85.743 2.657 2.541 1.00 0.00 H new ATOM 0 HB1 ALA A 74 84.082 3.056 0.738 1.00 0.00 H new ATOM 0 HB2 ALA A 74 84.079 4.424 1.877 1.00 0.00 H new ATOM 0 HB3 ALA A 74 84.901 4.575 0.306 1.00 0.00 H new ATOM 1122 N LEU A 75 87.670 3.425 0.045 1.00 0.00 N ATOM 1123 CA LEU A 75 88.573 2.814 -0.963 1.00 0.00 C ATOM 1124 C LEU A 75 89.646 2.030 -0.223 1.00 0.00 C ATOM 1125 O LEU A 75 89.929 0.889 -0.533 1.00 0.00 O ATOM 1126 CB LEU A 75 89.185 3.990 -1.726 1.00 0.00 C ATOM 1127 CG LEU A 75 90.255 3.475 -2.689 1.00 0.00 C ATOM 1128 CD1 LEU A 75 90.313 4.379 -3.921 1.00 0.00 C ATOM 1129 CD2 LEU A 75 91.617 3.482 -1.989 1.00 0.00 C ATOM 0 H LEU A 75 87.771 4.433 0.162 1.00 0.00 H new ATOM 0 HA LEU A 75 88.064 2.133 -1.645 1.00 0.00 H new ATOM 0 HB2 LEU A 75 88.410 4.521 -2.278 1.00 0.00 H new ATOM 0 HB3 LEU A 75 89.623 4.702 -1.027 1.00 0.00 H new ATOM 0 HG LEU A 75 90.007 2.459 -2.996 1.00 0.00 H new ATOM 0 HD11 LEU A 75 91.076 4.011 -4.607 1.00 0.00 H new ATOM 0 HD12 LEU A 75 89.344 4.376 -4.421 1.00 0.00 H new ATOM 0 HD13 LEU A 75 90.560 5.396 -3.615 1.00 0.00 H new ATOM 0 HD21 LEU A 75 92.380 3.115 -2.675 1.00 0.00 H new ATOM 0 HD22 LEU A 75 91.863 4.499 -1.682 1.00 0.00 H new ATOM 0 HD23 LEU A 75 91.578 2.837 -1.111 1.00 0.00 H new ATOM 1141 N GLU A 76 90.226 2.626 0.784 1.00 0.00 N ATOM 1142 CA GLU A 76 91.254 1.904 1.570 1.00 0.00 C ATOM 1143 C GLU A 76 90.574 0.808 2.391 1.00 0.00 C ATOM 1144 O GLU A 76 91.217 -0.046 2.968 1.00 0.00 O ATOM 1145 CB GLU A 76 91.866 2.953 2.492 1.00 0.00 C ATOM 1146 CG GLU A 76 93.297 3.258 2.046 1.00 0.00 C ATOM 1147 CD GLU A 76 94.247 2.210 2.629 1.00 0.00 C ATOM 1148 OE1 GLU A 76 94.082 1.045 2.307 1.00 0.00 O ATOM 1149 OE2 GLU A 76 95.124 2.591 3.387 1.00 0.00 O ATOM 0 H GLU A 76 90.030 3.579 1.092 1.00 0.00 H new ATOM 0 HA GLU A 76 92.011 1.433 0.942 1.00 0.00 H new ATOM 0 HB2 GLU A 76 91.267 3.863 2.472 1.00 0.00 H new ATOM 0 HB3 GLU A 76 91.864 2.593 3.521 1.00 0.00 H new ATOM 0 HG2 GLU A 76 93.359 3.255 0.958 1.00 0.00 H new ATOM 0 HG3 GLU A 76 93.589 4.254 2.379 1.00 0.00 H new ATOM 1156 N LEU A 77 89.267 0.832 2.441 1.00 0.00 N ATOM 1157 CA LEU A 77 88.522 -0.201 3.213 1.00 0.00 C ATOM 1158 C LEU A 77 88.558 -1.546 2.478 1.00 0.00 C ATOM 1159 O LEU A 77 87.948 -2.507 2.901 1.00 0.00 O ATOM 1160 CB LEU A 77 87.088 0.326 3.292 1.00 0.00 C ATOM 1161 CG LEU A 77 86.745 0.682 4.741 1.00 0.00 C ATOM 1162 CD1 LEU A 77 86.951 -0.542 5.633 1.00 0.00 C ATOM 1163 CD2 LEU A 77 87.653 1.816 5.218 1.00 0.00 C ATOM 0 H LEU A 77 88.683 1.528 1.977 1.00 0.00 H new ATOM 0 HA LEU A 77 88.953 -0.369 4.200 1.00 0.00 H new ATOM 0 HB2 LEU A 77 86.978 1.205 2.656 1.00 0.00 H new ATOM 0 HB3 LEU A 77 86.393 -0.426 2.919 1.00 0.00 H new ATOM 0 HG LEU A 77 85.704 1.001 4.797 1.00 0.00 H new ATOM 0 HD11 LEU A 77 86.706 -0.286 6.664 1.00 0.00 H new ATOM 0 HD12 LEU A 77 86.303 -1.351 5.296 1.00 0.00 H new ATOM 0 HD13 LEU A 77 87.991 -0.863 5.576 1.00 0.00 H new ATOM 0 HD21 LEU A 77 87.408 2.069 6.250 1.00 0.00 H new ATOM 0 HD22 LEU A 77 88.694 1.498 5.160 1.00 0.00 H new ATOM 0 HD23 LEU A 77 87.505 2.691 4.585 1.00 0.00 H new ATOM 1175 N THR A 78 89.271 -1.626 1.382 1.00 0.00 N ATOM 1176 CA THR A 78 89.340 -2.912 0.633 1.00 0.00 C ATOM 1177 C THR A 78 89.876 -4.019 1.532 1.00 0.00 C ATOM 1178 O THR A 78 89.768 -5.193 1.233 1.00 0.00 O ATOM 1179 CB THR A 78 90.289 -2.651 -0.538 1.00 0.00 C ATOM 1180 OG1 THR A 78 89.939 -1.424 -1.163 1.00 0.00 O ATOM 1181 CG2 THR A 78 90.180 -3.792 -1.551 1.00 0.00 C ATOM 0 H THR A 78 89.806 -0.857 0.977 1.00 0.00 H new ATOM 0 HA THR A 78 88.359 -3.237 0.286 1.00 0.00 H new ATOM 0 HB THR A 78 91.313 -2.593 -0.170 1.00 0.00 H new ATOM 0 HG1 THR A 78 90.443 -0.691 -0.751 1.00 0.00 H new ATOM 0 HG21 THR A 78 90.857 -3.604 -2.385 1.00 0.00 H new ATOM 0 HG22 THR A 78 90.449 -4.732 -1.070 1.00 0.00 H new ATOM 0 HG23 THR A 78 89.157 -3.853 -1.921 1.00 0.00 H new ATOM 1189 N GLY A 79 90.435 -3.648 2.635 1.00 0.00 N ATOM 1190 CA GLY A 79 90.969 -4.663 3.588 1.00 0.00 C ATOM 1191 C GLY A 79 89.863 -5.035 4.577 1.00 0.00 C ATOM 1192 O GLY A 79 90.103 -5.236 5.751 1.00 0.00 O ATOM 0 H GLY A 79 90.550 -2.678 2.928 1.00 0.00 H new ATOM 0 HA2 GLY A 79 91.307 -5.548 3.048 1.00 0.00 H new ATOM 0 HA3 GLY A 79 91.833 -4.265 4.120 1.00 0.00 H new ATOM 1196 N LEU A 80 88.648 -5.114 4.105 1.00 0.00 N ATOM 1197 CA LEU A 80 87.509 -5.455 5.005 1.00 0.00 C ATOM 1198 C LEU A 80 87.284 -6.966 5.062 1.00 0.00 C ATOM 1199 O LEU A 80 88.088 -7.750 4.602 1.00 0.00 O ATOM 1200 CB LEU A 80 86.297 -4.770 4.371 1.00 0.00 C ATOM 1201 CG LEU A 80 86.006 -3.462 5.104 1.00 0.00 C ATOM 1202 CD1 LEU A 80 85.080 -2.595 4.249 1.00 0.00 C ATOM 1203 CD2 LEU A 80 85.325 -3.768 6.440 1.00 0.00 C ATOM 0 H LEU A 80 88.394 -4.956 3.130 1.00 0.00 H new ATOM 0 HA LEU A 80 87.692 -5.129 6.029 1.00 0.00 H new ATOM 0 HB2 LEU A 80 86.489 -4.573 3.316 1.00 0.00 H new ATOM 0 HB3 LEU A 80 85.429 -5.427 4.420 1.00 0.00 H new ATOM 0 HG LEU A 80 86.940 -2.930 5.284 1.00 0.00 H new ATOM 0 HD11 LEU A 80 84.871 -1.661 4.771 1.00 0.00 H new ATOM 0 HD12 LEU A 80 85.562 -2.378 3.296 1.00 0.00 H new ATOM 0 HD13 LEU A 80 84.146 -3.127 4.070 1.00 0.00 H new ATOM 0 HD21 LEU A 80 85.117 -2.835 6.964 1.00 0.00 H new ATOM 0 HD22 LEU A 80 84.390 -4.299 6.259 1.00 0.00 H new ATOM 0 HD23 LEU A 80 85.982 -4.388 7.050 1.00 0.00 H new ATOM 1215 N LYS A 81 86.180 -7.364 5.629 1.00 0.00 N ATOM 1216 CA LYS A 81 85.850 -8.814 5.741 1.00 0.00 C ATOM 1217 C LYS A 81 84.638 -8.974 6.632 1.00 0.00 C ATOM 1218 O LYS A 81 84.648 -9.702 7.601 1.00 0.00 O ATOM 1219 CB LYS A 81 87.046 -9.456 6.391 1.00 0.00 C ATOM 1220 CG LYS A 81 87.742 -10.396 5.404 1.00 0.00 C ATOM 1221 CD LYS A 81 88.955 -11.040 6.081 1.00 0.00 C ATOM 1222 CE LYS A 81 89.557 -12.096 5.152 1.00 0.00 C ATOM 1223 NZ LYS A 81 90.808 -12.536 5.832 1.00 0.00 N ATOM 0 H LYS A 81 85.481 -6.737 6.026 1.00 0.00 H new ATOM 0 HA LYS A 81 85.630 -9.264 4.773 1.00 0.00 H new ATOM 0 HB2 LYS A 81 87.743 -8.688 6.726 1.00 0.00 H new ATOM 0 HB3 LYS A 81 86.734 -10.011 7.275 1.00 0.00 H new ATOM 0 HG2 LYS A 81 87.048 -11.166 5.068 1.00 0.00 H new ATOM 0 HG3 LYS A 81 88.057 -9.843 4.519 1.00 0.00 H new ATOM 0 HD2 LYS A 81 89.700 -10.280 6.316 1.00 0.00 H new ATOM 0 HD3 LYS A 81 88.658 -11.497 7.025 1.00 0.00 H new ATOM 0 HE2 LYS A 81 88.872 -12.931 5.006 1.00 0.00 H new ATOM 0 HE3 LYS A 81 89.768 -11.681 4.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 91.280 -13.262 5.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 91.443 -11.721 5.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 90.575 -12.932 6.765 1.00 0.00 H new ATOM 1237 N VAL A 82 83.615 -8.272 6.282 1.00 0.00 N ATOM 1238 CA VAL A 82 82.325 -8.293 7.053 1.00 0.00 C ATOM 1239 C VAL A 82 82.172 -9.598 7.826 1.00 0.00 C ATOM 1240 O VAL A 82 82.752 -9.786 8.878 1.00 0.00 O ATOM 1241 CB VAL A 82 81.237 -8.147 5.987 1.00 0.00 C ATOM 1242 CG1 VAL A 82 79.860 -8.270 6.641 1.00 0.00 C ATOM 1243 CG2 VAL A 82 81.361 -6.777 5.316 1.00 0.00 C ATOM 0 H VAL A 82 83.603 -7.658 5.467 1.00 0.00 H new ATOM 0 HA VAL A 82 82.275 -7.500 7.799 1.00 0.00 H new ATOM 0 HB VAL A 82 81.355 -8.931 5.239 1.00 0.00 H new ATOM 0 HG11 VAL A 82 79.086 -8.166 5.881 1.00 0.00 H new ATOM 0 HG12 VAL A 82 79.770 -9.245 7.119 1.00 0.00 H new ATOM 0 HG13 VAL A 82 79.741 -7.487 7.389 1.00 0.00 H new ATOM 0 HG21 VAL A 82 80.586 -6.672 4.556 1.00 0.00 H new ATOM 0 HG22 VAL A 82 81.244 -5.993 6.064 1.00 0.00 H new ATOM 0 HG23 VAL A 82 82.342 -6.688 4.849 1.00 0.00 H new ATOM 1253 N PHE A 83 81.415 -10.503 7.309 1.00 0.00 N ATOM 1254 CA PHE A 83 81.245 -11.811 7.996 1.00 0.00 C ATOM 1255 C PHE A 83 82.331 -12.767 7.495 1.00 0.00 C ATOM 1256 O PHE A 83 82.091 -13.933 7.254 1.00 0.00 O ATOM 1257 CB PHE A 83 79.854 -12.301 7.591 1.00 0.00 C ATOM 1258 CG PHE A 83 78.832 -11.757 8.562 1.00 0.00 C ATOM 1259 CD1 PHE A 83 78.820 -12.205 9.888 1.00 0.00 C ATOM 1260 CD2 PHE A 83 77.900 -10.801 8.138 1.00 0.00 C ATOM 1261 CE1 PHE A 83 77.877 -11.700 10.790 1.00 0.00 C ATOM 1262 CE2 PHE A 83 76.956 -10.297 9.040 1.00 0.00 C ATOM 1263 CZ PHE A 83 76.945 -10.746 10.367 1.00 0.00 C ATOM 0 H PHE A 83 80.899 -10.401 6.435 1.00 0.00 H new ATOM 0 HA PHE A 83 81.333 -11.744 9.080 1.00 0.00 H new ATOM 0 HB2 PHE A 83 79.621 -11.973 6.578 1.00 0.00 H new ATOM 0 HB3 PHE A 83 79.826 -13.391 7.588 1.00 0.00 H new ATOM 0 HD1 PHE A 83 79.539 -12.941 10.215 1.00 0.00 H new ATOM 0 HD2 PHE A 83 77.910 -10.453 7.116 1.00 0.00 H new ATOM 0 HE1 PHE A 83 77.869 -12.047 11.813 1.00 0.00 H new ATOM 0 HE2 PHE A 83 76.236 -9.562 8.713 1.00 0.00 H new ATOM 0 HZ PHE A 83 76.217 -10.356 11.063 1.00 0.00 H new ATOM 1273 N GLY A 84 83.525 -12.261 7.319 1.00 0.00 N ATOM 1274 CA GLY A 84 84.638 -13.107 6.814 1.00 0.00 C ATOM 1275 C GLY A 84 84.659 -13.029 5.287 1.00 0.00 C ATOM 1276 O GLY A 84 85.143 -13.916 4.613 1.00 0.00 O ATOM 0 H GLY A 84 83.774 -11.290 7.506 1.00 0.00 H new ATOM 0 HA2 GLY A 84 85.589 -12.765 7.223 1.00 0.00 H new ATOM 0 HA3 GLY A 84 84.505 -14.139 7.138 1.00 0.00 H new ATOM 1280 N ASN A 85 84.136 -11.964 4.741 1.00 0.00 N ATOM 1281 CA ASN A 85 84.120 -11.809 3.260 1.00 0.00 C ATOM 1282 C ASN A 85 84.470 -10.365 2.907 1.00 0.00 C ATOM 1283 O ASN A 85 83.604 -9.525 2.755 1.00 0.00 O ATOM 1284 CB ASN A 85 82.688 -12.137 2.837 1.00 0.00 C ATOM 1285 CG ASN A 85 81.712 -11.228 3.586 1.00 0.00 C ATOM 1286 OD1 ASN A 85 81.424 -11.449 4.745 1.00 0.00 O ATOM 1287 ND2 ASN A 85 81.188 -10.204 2.968 1.00 0.00 N ATOM 0 H ASN A 85 83.718 -11.192 5.260 1.00 0.00 H new ATOM 0 HA ASN A 85 84.839 -12.456 2.758 1.00 0.00 H new ATOM 0 HB2 ASN A 85 82.575 -12.001 1.761 1.00 0.00 H new ATOM 0 HB3 ASN A 85 82.465 -13.182 3.051 1.00 0.00 H new ATOM 0 HD21 ASN A 85 80.537 -9.590 3.459 1.00 0.00 H new ATOM 0 HD22 ASN A 85 81.429 -10.018 1.995 1.00 0.00 H new ATOM 1294 N GLU A 86 85.733 -10.066 2.802 1.00 0.00 N ATOM 1295 CA GLU A 86 86.144 -8.670 2.489 1.00 0.00 C ATOM 1296 C GLU A 86 85.239 -8.069 1.416 1.00 0.00 C ATOM 1297 O GLU A 86 85.455 -8.243 0.234 1.00 0.00 O ATOM 1298 CB GLU A 86 87.581 -8.781 1.993 1.00 0.00 C ATOM 1299 CG GLU A 86 87.613 -9.576 0.685 1.00 0.00 C ATOM 1300 CD GLU A 86 88.714 -10.636 0.757 1.00 0.00 C ATOM 1301 OE1 GLU A 86 88.528 -11.607 1.471 1.00 0.00 O ATOM 1302 OE2 GLU A 86 89.724 -10.457 0.097 1.00 0.00 O ATOM 0 H GLU A 86 86.500 -10.728 2.919 1.00 0.00 H new ATOM 0 HA GLU A 86 86.066 -8.015 3.357 1.00 0.00 H new ATOM 0 HB2 GLU A 86 88.000 -7.787 1.837 1.00 0.00 H new ATOM 0 HB3 GLU A 86 88.199 -9.273 2.744 1.00 0.00 H new ATOM 0 HG2 GLU A 86 86.647 -10.051 0.512 1.00 0.00 H new ATOM 0 HG3 GLU A 86 87.793 -8.906 -0.156 1.00 0.00 H new ATOM 1309 N ILE A 87 84.227 -7.358 1.828 1.00 0.00 N ATOM 1310 CA ILE A 87 83.303 -6.736 0.842 1.00 0.00 C ATOM 1311 C ILE A 87 84.101 -5.947 -0.194 1.00 0.00 C ATOM 1312 O ILE A 87 85.126 -5.366 0.101 1.00 0.00 O ATOM 1313 CB ILE A 87 82.404 -5.798 1.651 1.00 0.00 C ATOM 1314 CG1 ILE A 87 83.238 -5.054 2.699 1.00 0.00 C ATOM 1315 CG2 ILE A 87 81.315 -6.613 2.350 1.00 0.00 C ATOM 1316 CD1 ILE A 87 82.520 -3.765 3.101 1.00 0.00 C ATOM 0 H ILE A 87 84.000 -7.181 2.807 1.00 0.00 H new ATOM 0 HA ILE A 87 82.719 -7.483 0.304 1.00 0.00 H new ATOM 0 HB ILE A 87 81.944 -5.074 0.979 1.00 0.00 H new ATOM 0 HG12 ILE A 87 83.390 -5.686 3.574 1.00 0.00 H new ATOM 0 HG13 ILE A 87 84.225 -4.823 2.297 1.00 0.00 H new ATOM 0 HG21 ILE A 87 80.674 -5.945 2.926 1.00 0.00 H new ATOM 0 HG22 ILE A 87 80.716 -7.136 1.604 1.00 0.00 H new ATOM 0 HG23 ILE A 87 81.777 -7.339 3.019 1.00 0.00 H new ATOM 0 HD11 ILE A 87 83.113 -3.235 3.847 1.00 0.00 H new ATOM 0 HD12 ILE A 87 82.391 -3.132 2.223 1.00 0.00 H new ATOM 0 HD13 ILE A 87 81.543 -4.008 3.520 1.00 0.00 H new ATOM 1328 N LYS A 88 83.631 -5.924 -1.402 1.00 0.00 N ATOM 1329 CA LYS A 88 84.347 -5.176 -2.471 1.00 0.00 C ATOM 1330 C LYS A 88 83.442 -4.081 -3.033 1.00 0.00 C ATOM 1331 O LYS A 88 82.235 -4.156 -2.945 1.00 0.00 O ATOM 1332 CB LYS A 88 84.658 -6.217 -3.546 1.00 0.00 C ATOM 1333 CG LYS A 88 85.234 -5.521 -4.780 1.00 0.00 C ATOM 1334 CD LYS A 88 86.656 -5.042 -4.482 1.00 0.00 C ATOM 1335 CE LYS A 88 87.449 -4.953 -5.787 1.00 0.00 C ATOM 1336 NZ LYS A 88 88.868 -5.166 -5.390 1.00 0.00 N ATOM 0 H LYS A 88 82.776 -6.393 -1.701 1.00 0.00 H new ATOM 0 HA LYS A 88 85.251 -4.691 -2.104 1.00 0.00 H new ATOM 0 HB2 LYS A 88 85.369 -6.949 -3.163 1.00 0.00 H new ATOM 0 HB3 LYS A 88 83.752 -6.762 -3.812 1.00 0.00 H new ATOM 0 HG2 LYS A 88 85.241 -6.207 -5.627 1.00 0.00 H new ATOM 0 HG3 LYS A 88 84.606 -4.675 -5.060 1.00 0.00 H new ATOM 0 HD2 LYS A 88 86.628 -4.068 -3.994 1.00 0.00 H new ATOM 0 HD3 LYS A 88 87.146 -5.730 -3.793 1.00 0.00 H new ATOM 0 HE2 LYS A 88 87.121 -5.709 -6.501 1.00 0.00 H new ATOM 0 HE3 LYS A 88 87.314 -3.983 -6.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 89.475 -5.119 -6.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 89.154 -4.428 -4.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 88.967 -6.100 -4.944 1.00 0.00 H new ATOM 1350 N LEU A 89 84.011 -3.061 -3.604 1.00 0.00 N ATOM 1351 CA LEU A 89 83.179 -1.967 -4.163 1.00 0.00 C ATOM 1352 C LEU A 89 83.432 -1.822 -5.665 1.00 0.00 C ATOM 1353 O LEU A 89 84.318 -2.441 -6.219 1.00 0.00 O ATOM 1354 CB LEU A 89 83.624 -0.705 -3.419 1.00 0.00 C ATOM 1355 CG LEU A 89 85.132 -0.740 -3.158 1.00 0.00 C ATOM 1356 CD1 LEU A 89 85.679 0.688 -3.133 1.00 0.00 C ATOM 1357 CD2 LEU A 89 85.400 -1.411 -1.810 1.00 0.00 C ATOM 0 H LEU A 89 85.018 -2.938 -3.708 1.00 0.00 H new ATOM 0 HA LEU A 89 82.113 -2.158 -4.038 1.00 0.00 H new ATOM 0 HB2 LEU A 89 83.371 0.178 -4.005 1.00 0.00 H new ATOM 0 HB3 LEU A 89 83.087 -0.625 -2.474 1.00 0.00 H new ATOM 0 HG LEU A 89 85.625 -1.304 -3.950 1.00 0.00 H new ATOM 0 HD11 LEU A 89 86.753 0.663 -2.947 1.00 0.00 H new ATOM 0 HD12 LEU A 89 85.488 1.168 -4.093 1.00 0.00 H new ATOM 0 HD13 LEU A 89 85.187 1.252 -2.341 1.00 0.00 H new ATOM 0 HD21 LEU A 89 86.474 -1.436 -1.623 1.00 0.00 H new ATOM 0 HD22 LEU A 89 84.907 -0.847 -1.018 1.00 0.00 H new ATOM 0 HD23 LEU A 89 85.010 -2.429 -1.826 1.00 0.00 H new ATOM 1369 N GLU A 90 82.655 -1.009 -6.327 1.00 0.00 N ATOM 1370 CA GLU A 90 82.848 -0.823 -7.795 1.00 0.00 C ATOM 1371 C GLU A 90 82.094 0.421 -8.272 1.00 0.00 C ATOM 1372 O GLU A 90 81.233 0.938 -7.588 1.00 0.00 O ATOM 1373 CB GLU A 90 82.263 -2.082 -8.433 1.00 0.00 C ATOM 1374 CG GLU A 90 83.267 -2.663 -9.432 1.00 0.00 C ATOM 1375 CD GLU A 90 82.928 -2.172 -10.840 1.00 0.00 C ATOM 1376 OE1 GLU A 90 81.750 -2.050 -11.136 1.00 0.00 O ATOM 1377 OE2 GLU A 90 83.851 -1.927 -11.599 1.00 0.00 O ATOM 0 H GLU A 90 81.896 -0.466 -5.916 1.00 0.00 H new ATOM 0 HA GLU A 90 83.896 -0.681 -8.060 1.00 0.00 H new ATOM 0 HB2 GLU A 90 82.032 -2.819 -7.663 1.00 0.00 H new ATOM 0 HB3 GLU A 90 81.327 -1.845 -8.938 1.00 0.00 H new ATOM 0 HG2 GLU A 90 84.279 -2.361 -9.164 1.00 0.00 H new ATOM 0 HG3 GLU A 90 83.240 -3.752 -9.399 1.00 0.00 H new ATOM 1384 N LYS A 91 82.412 0.907 -9.441 1.00 0.00 N ATOM 1385 CA LYS A 91 81.712 2.118 -9.959 1.00 0.00 C ATOM 1386 C LYS A 91 80.673 1.719 -11.011 1.00 0.00 C ATOM 1387 O LYS A 91 81.005 1.496 -12.158 1.00 0.00 O ATOM 1388 CB LYS A 91 82.811 2.974 -10.587 1.00 0.00 C ATOM 1389 CG LYS A 91 82.748 4.390 -10.012 1.00 0.00 C ATOM 1390 CD LYS A 91 81.853 5.262 -10.895 1.00 0.00 C ATOM 1391 CE LYS A 91 81.266 6.402 -10.060 1.00 0.00 C ATOM 1392 NZ LYS A 91 79.983 6.749 -10.732 1.00 0.00 N ATOM 0 H LYS A 91 83.125 0.519 -10.059 1.00 0.00 H new ATOM 0 HA LYS A 91 81.178 2.654 -9.174 1.00 0.00 H new ATOM 0 HB2 LYS A 91 83.788 2.533 -10.389 1.00 0.00 H new ATOM 0 HB3 LYS A 91 82.689 3.004 -11.670 1.00 0.00 H new ATOM 0 HG2 LYS A 91 82.358 4.363 -8.995 1.00 0.00 H new ATOM 0 HG3 LYS A 91 83.750 4.817 -9.958 1.00 0.00 H new ATOM 0 HD2 LYS A 91 82.429 5.666 -11.728 1.00 0.00 H new ATOM 0 HD3 LYS A 91 81.051 4.661 -11.324 1.00 0.00 H new ATOM 0 HE2 LYS A 91 81.100 6.091 -9.029 1.00 0.00 H new ATOM 0 HE3 LYS A 91 81.940 7.258 -10.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 79.520 7.525 -10.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 80.173 7.048 -11.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 79.359 5.917 -10.739 1.00 0.00 H new ATOM 1406 N PRO A 92 79.444 1.643 -10.578 1.00 0.00 N ATOM 1407 CA PRO A 92 78.337 1.267 -11.488 1.00 0.00 C ATOM 1408 C PRO A 92 78.009 2.422 -12.437 1.00 0.00 C ATOM 1409 O PRO A 92 78.649 3.455 -12.417 1.00 0.00 O ATOM 1410 CB PRO A 92 77.173 0.993 -10.540 1.00 0.00 C ATOM 1411 CG PRO A 92 77.476 1.788 -9.311 1.00 0.00 C ATOM 1412 CD PRO A 92 78.977 1.897 -9.211 1.00 0.00 C ATOM 0 HA PRO A 92 78.574 0.413 -12.122 1.00 0.00 H new ATOM 0 HB2 PRO A 92 76.224 1.297 -10.982 1.00 0.00 H new ATOM 0 HB3 PRO A 92 77.092 -0.070 -10.312 1.00 0.00 H new ATOM 0 HG2 PRO A 92 77.021 2.777 -9.370 1.00 0.00 H new ATOM 0 HG3 PRO A 92 77.066 1.301 -8.426 1.00 0.00 H new ATOM 0 HD2 PRO A 92 79.283 2.883 -8.862 1.00 0.00 H new ATOM 0 HD3 PRO A 92 79.384 1.170 -8.509 1.00 0.00 H new ATOM 1420 N LYS A 93 77.017 2.254 -13.266 1.00 0.00 N ATOM 1421 CA LYS A 93 76.644 3.341 -14.218 1.00 0.00 C ATOM 1422 C LYS A 93 77.902 3.973 -14.822 1.00 0.00 C ATOM 1423 O LYS A 93 78.179 5.139 -14.621 1.00 0.00 O ATOM 1424 CB LYS A 93 75.882 4.363 -13.374 1.00 0.00 C ATOM 1425 CG LYS A 93 75.513 5.568 -14.241 1.00 0.00 C ATOM 1426 CD LYS A 93 74.182 6.153 -13.763 1.00 0.00 C ATOM 1427 CE LYS A 93 74.439 7.150 -12.631 1.00 0.00 C ATOM 1428 NZ LYS A 93 73.100 7.396 -12.025 1.00 0.00 N ATOM 0 H LYS A 93 76.447 1.410 -13.327 1.00 0.00 H new ATOM 0 HA LYS A 93 76.045 2.972 -15.050 1.00 0.00 H new ATOM 0 HB2 LYS A 93 74.981 3.910 -12.961 1.00 0.00 H new ATOM 0 HB3 LYS A 93 76.494 4.682 -12.530 1.00 0.00 H new ATOM 0 HG2 LYS A 93 76.296 6.324 -14.184 1.00 0.00 H new ATOM 0 HG3 LYS A 93 75.436 5.268 -15.286 1.00 0.00 H new ATOM 0 HD2 LYS A 93 73.673 6.649 -14.590 1.00 0.00 H new ATOM 0 HD3 LYS A 93 73.525 5.355 -13.417 1.00 0.00 H new ATOM 0 HE2 LYS A 93 75.136 6.744 -11.898 1.00 0.00 H new ATOM 0 HE3 LYS A 93 74.877 8.074 -13.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 73.193 8.071 -11.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 72.460 7.788 -12.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 72.711 6.500 -11.667 1.00 0.00 H new ATOM 1442 N GLY A 94 78.665 3.213 -15.560 1.00 0.00 N ATOM 1443 CA GLY A 94 79.901 3.774 -16.174 1.00 0.00 C ATOM 1444 C GLY A 94 80.886 2.640 -16.467 1.00 0.00 C ATOM 1445 O GLY A 94 80.723 1.892 -17.411 1.00 0.00 O ATOM 0 H GLY A 94 78.486 2.230 -15.764 1.00 0.00 H new ATOM 0 HA2 GLY A 94 79.655 4.303 -17.095 1.00 0.00 H new ATOM 0 HA3 GLY A 94 80.356 4.501 -15.501 1.00 0.00 H new ATOM 1449 N ARG A 95 81.908 2.508 -15.666 1.00 0.00 N ATOM 1450 CA ARG A 95 82.902 1.421 -15.901 1.00 0.00 C ATOM 1451 C ARG A 95 82.186 0.116 -16.257 1.00 0.00 C ATOM 1452 O ARG A 95 81.041 -0.091 -15.907 1.00 0.00 O ATOM 1453 CB ARG A 95 83.652 1.278 -14.575 1.00 0.00 C ATOM 1454 CG ARG A 95 84.803 2.283 -14.527 1.00 0.00 C ATOM 1455 CD ARG A 95 86.082 1.576 -14.074 1.00 0.00 C ATOM 1456 NE ARG A 95 86.876 2.627 -13.379 1.00 0.00 N ATOM 1457 CZ ARG A 95 87.305 2.424 -12.164 1.00 0.00 C ATOM 1458 NH1 ARG A 95 86.455 2.184 -11.203 1.00 0.00 N ATOM 1459 NH2 ARG A 95 88.585 2.462 -11.909 1.00 0.00 N ATOM 0 H ARG A 95 82.098 3.104 -14.860 1.00 0.00 H new ATOM 0 HA ARG A 95 83.575 1.648 -16.728 1.00 0.00 H new ATOM 0 HB2 ARG A 95 82.972 1.448 -13.740 1.00 0.00 H new ATOM 0 HB3 ARG A 95 84.037 0.264 -14.471 1.00 0.00 H new ATOM 0 HG2 ARG A 95 84.951 2.729 -15.510 1.00 0.00 H new ATOM 0 HG3 ARG A 95 84.562 3.095 -13.841 1.00 0.00 H new ATOM 0 HD2 ARG A 95 85.858 0.744 -13.406 1.00 0.00 H new ATOM 0 HD3 ARG A 95 86.628 1.165 -14.923 1.00 0.00 H new ATOM 0 HE ARG A 95 87.084 3.506 -13.853 1.00 0.00 H new ATOM 0 HH11 ARG A 95 85.455 2.155 -11.402 1.00 0.00 H new ATOM 0 HH12 ARG A 95 86.791 2.025 -10.253 1.00 0.00 H new ATOM 0 HH21 ARG A 95 89.249 2.650 -12.660 1.00 0.00 H new ATOM 0 HH22 ARG A 95 88.921 2.303 -10.959 1.00 0.00 H new ATOM 1473 N ASP A 96 82.852 -0.767 -16.952 1.00 0.00 N ATOM 1474 CA ASP A 96 82.209 -2.057 -17.330 1.00 0.00 C ATOM 1475 C ASP A 96 82.893 -3.221 -16.608 1.00 0.00 C ATOM 1476 O ASP A 96 83.522 -3.045 -15.583 1.00 0.00 O ATOM 1477 CB ASP A 96 82.409 -2.171 -18.842 1.00 0.00 C ATOM 1478 CG ASP A 96 81.060 -2.024 -19.548 1.00 0.00 C ATOM 1479 OD1 ASP A 96 80.328 -1.110 -19.201 1.00 0.00 O ATOM 1480 OD2 ASP A 96 80.781 -2.826 -20.422 1.00 0.00 O ATOM 0 H ASP A 96 83.813 -0.650 -17.274 1.00 0.00 H new ATOM 0 HA ASP A 96 81.155 -2.089 -17.055 1.00 0.00 H new ATOM 0 HB2 ASP A 96 83.098 -1.400 -19.187 1.00 0.00 H new ATOM 0 HB3 ASP A 96 82.858 -3.133 -19.089 1.00 0.00 H new ATOM 1485 N GLY A 97 82.777 -4.410 -17.134 1.00 0.00 N ATOM 1486 CA GLY A 97 83.420 -5.582 -16.478 1.00 0.00 C ATOM 1487 C GLY A 97 84.908 -5.299 -16.266 1.00 0.00 C ATOM 1488 O GLY A 97 85.308 -4.748 -15.260 1.00 0.00 O ATOM 0 H GLY A 97 82.264 -4.620 -17.990 1.00 0.00 H new ATOM 0 HA2 GLY A 97 82.938 -5.786 -15.522 1.00 0.00 H new ATOM 0 HA3 GLY A 97 83.293 -6.472 -17.095 1.00 0.00 H new ATOM 1492 N THR A 98 85.732 -5.672 -17.208 1.00 0.00 N ATOM 1493 CA THR A 98 87.197 -5.424 -17.060 1.00 0.00 C ATOM 1494 C THR A 98 87.448 -4.025 -16.493 1.00 0.00 C ATOM 1495 O THR A 98 86.736 -3.087 -16.790 1.00 0.00 O ATOM 1496 CB THR A 98 87.776 -5.545 -18.467 1.00 0.00 C ATOM 1497 OG1 THR A 98 89.018 -4.857 -18.523 1.00 0.00 O ATOM 1498 CG2 THR A 98 86.812 -4.944 -19.494 1.00 0.00 C ATOM 0 H THR A 98 85.456 -6.137 -18.073 1.00 0.00 H new ATOM 0 HA THR A 98 87.660 -6.131 -16.372 1.00 0.00 H new ATOM 0 HB THR A 98 87.925 -6.599 -18.701 1.00 0.00 H new ATOM 0 HG1 THR A 98 89.394 -4.934 -19.425 1.00 0.00 H new ATOM 0 HG21 THR A 98 87.239 -5.038 -20.492 1.00 0.00 H new ATOM 0 HG22 THR A 98 85.861 -5.475 -19.455 1.00 0.00 H new ATOM 0 HG23 THR A 98 86.649 -3.890 -19.267 1.00 0.00 H new ATOM 1506 N ARG A 99 88.457 -3.878 -15.677 1.00 0.00 N ATOM 1507 CA ARG A 99 88.753 -2.539 -15.092 1.00 0.00 C ATOM 1508 C ARG A 99 89.160 -1.558 -16.194 1.00 0.00 C ATOM 1509 O ARG A 99 88.349 -0.808 -16.701 1.00 0.00 O ATOM 1510 CB ARG A 99 89.916 -2.777 -14.129 1.00 0.00 C ATOM 1511 CG ARG A 99 89.416 -3.541 -12.901 1.00 0.00 C ATOM 1512 CD ARG A 99 89.992 -2.906 -11.634 1.00 0.00 C ATOM 1513 NE ARG A 99 90.309 -4.054 -10.740 1.00 0.00 N ATOM 1514 CZ ARG A 99 91.371 -4.017 -9.982 1.00 0.00 C ATOM 1515 NH1 ARG A 99 91.601 -2.974 -9.232 1.00 0.00 N ATOM 1516 NH2 ARG A 99 92.202 -5.023 -9.974 1.00 0.00 N ATOM 0 H ARG A 99 89.088 -4.626 -15.391 1.00 0.00 H new ATOM 0 HA ARG A 99 87.888 -2.108 -14.588 1.00 0.00 H new ATOM 0 HB2 ARG A 99 90.704 -3.343 -14.626 1.00 0.00 H new ATOM 0 HB3 ARG A 99 90.351 -1.825 -13.825 1.00 0.00 H new ATOM 0 HG2 ARG A 99 88.327 -3.522 -12.867 1.00 0.00 H new ATOM 0 HG3 ARG A 99 89.715 -4.587 -12.964 1.00 0.00 H new ATOM 0 HD2 ARG A 99 90.884 -2.320 -11.856 1.00 0.00 H new ATOM 0 HD3 ARG A 99 89.274 -2.230 -11.169 1.00 0.00 H new ATOM 0 HE ARG A 99 89.696 -4.869 -10.720 1.00 0.00 H new ATOM 0 HH11 ARG A 99 90.951 -2.188 -9.238 1.00 0.00 H new ATOM 0 HH12 ARG A 99 92.431 -2.945 -8.640 1.00 0.00 H new ATOM 0 HH21 ARG A 99 92.022 -5.838 -10.560 1.00 0.00 H new ATOM 0 HH22 ARG A 99 93.032 -4.994 -9.382 1.00 0.00 H new ATOM 1530 N GLY A 100 90.410 -1.557 -16.568 1.00 0.00 N ATOM 1531 CA GLY A 100 90.867 -0.625 -17.637 1.00 0.00 C ATOM 1532 C GLY A 100 91.719 0.484 -17.018 1.00 0.00 C ATOM 1533 O GLY A 100 91.461 1.657 -17.207 1.00 0.00 O ATOM 0 H GLY A 100 91.134 -2.161 -16.180 1.00 0.00 H new ATOM 0 HA2 GLY A 100 91.445 -1.168 -18.385 1.00 0.00 H new ATOM 0 HA3 GLY A 100 90.007 -0.194 -18.150 1.00 0.00 H new ATOM 1537 N CYS A 101 92.733 0.125 -16.280 1.00 0.00 N ATOM 1538 CA CYS A 101 93.600 1.161 -15.649 1.00 0.00 C ATOM 1539 C CYS A 101 95.049 0.671 -15.586 1.00 0.00 C ATOM 1540 O CYS A 101 95.857 1.345 -14.967 1.00 0.00 O ATOM 1541 CB CYS A 101 93.036 1.346 -14.240 1.00 0.00 C ATOM 1542 SG CYS A 101 93.277 -0.175 -13.289 1.00 0.00 S ATOM 1543 OXT CYS A 101 95.328 -0.370 -16.158 1.00 0.00 O ATOM 0 H CYS A 101 92.999 -0.840 -16.086 1.00 0.00 H new ATOM 0 HA CYS A 101 93.604 2.094 -16.212 1.00 0.00 H new ATOM 0 HB2 CYS A 101 93.533 2.180 -13.744 1.00 0.00 H new ATOM 0 HB3 CYS A 101 91.975 1.592 -14.291 1.00 0.00 H new ATOM 0 HG CYS A 101 92.800 -0.017 -12.090 1.00 0.00 H new TER 1549 CYS A 101