USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=18 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 26 ASN : amide:sc= -4.96! C(o=-5!,f=-15!) USER MOD Set 1.2: A 85 ASN : amide:sc= -0.0179 K(o=-5,f=-5.7) USER MOD Set 2.1: A 16 THR OG1 : rot 147:sc= -1.94! USER MOD Set 2.2: A 19 ASN : amide:sc= -4.11! C(o=-6!,f=-9.1!) 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= -0.0876 X(o=-0.088,f=-0.0095) USER MOD Single : A 4 MET CE :methyl 157:sc= -0.0264 (180deg=-1.06) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0.0896 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -1.26 K(o=-1.3,f=-0.19) USER MOD Single : A 28 ASN : amide:sc= -1.61! C(o=-1.6!,f=-6.8!) 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+ -129:sc= -5.12! (180deg=-10.2!) USER MOD Single : A 39 SER OG : rot 180:sc= -0.0655 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -2.53! K(o=-2.5!,f=-1.9) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 142:sc= -0.0399 USER MOD Single : A 57 ASN : amide:sc= -0.282 K(o=-0.28,f=-2.5!) USER MOD Single : A 59 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.168) USER MOD Single : A 62 TYR OH : rot 180:sc= -2.21 USER MOD Single : A 67 SER OG : rot 180:sc= -3.66! USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 THR OG1 : rot 85:sc= -0.873 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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+ 178:sc= 0 (180deg=-0.016) USER MOD Single : A 98 THR OG1 : rot -48:sc= 0.847 USER MOD Single : A 101 CYS SG : rot 180:sc= 0.0399 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 59.544 7.157 -23.747 1.00 0.00 N ATOM 2 CA GLY A 1 58.680 6.739 -24.889 1.00 0.00 C ATOM 3 C GLY A 1 57.426 6.047 -24.355 1.00 0.00 C ATOM 4 O GLY A 1 56.749 6.554 -23.482 1.00 0.00 O ATOM 0 H1 GLY A 1 60.397 7.628 -24.111 1.00 0.00 H new ATOM 0 H2 GLY A 1 59.019 7.816 -23.137 1.00 0.00 H new ATOM 0 H3 GLY A 1 59.820 6.319 -23.195 1.00 0.00 H new ATOM 0 HA2 GLY A 1 58.402 7.608 -25.485 1.00 0.00 H new ATOM 0 HA3 GLY A 1 59.229 6.064 -25.546 1.00 0.00 H new ATOM 10 N SER A 2 57.108 4.892 -24.872 1.00 0.00 N ATOM 11 CA SER A 2 55.895 4.168 -24.392 1.00 0.00 C ATOM 12 C SER A 2 56.087 3.719 -22.941 1.00 0.00 C ATOM 13 O SER A 2 57.159 3.834 -22.382 1.00 0.00 O ATOM 14 CB SER A 2 55.765 2.958 -25.316 1.00 0.00 C ATOM 15 OG SER A 2 56.735 1.984 -24.954 1.00 0.00 O ATOM 0 H SER A 2 57.635 4.418 -25.606 1.00 0.00 H new ATOM 0 HA SER A 2 55.003 4.795 -24.414 1.00 0.00 H new ATOM 0 HB2 SER A 2 54.763 2.535 -25.242 1.00 0.00 H new ATOM 0 HB3 SER A 2 55.907 3.261 -26.353 1.00 0.00 H new ATOM 0 HG SER A 2 56.653 1.206 -25.544 1.00 0.00 H new ATOM 21 N HIS A 3 55.055 3.206 -22.328 1.00 0.00 N ATOM 22 CA HIS A 3 55.179 2.749 -20.914 1.00 0.00 C ATOM 23 C HIS A 3 55.766 3.867 -20.048 1.00 0.00 C ATOM 24 O HIS A 3 56.630 3.639 -19.225 1.00 0.00 O ATOM 25 CB HIS A 3 56.132 1.555 -20.966 1.00 0.00 C ATOM 26 CG HIS A 3 55.574 0.431 -20.138 1.00 0.00 C ATOM 27 ND1 HIS A 3 55.686 -0.897 -20.521 1.00 0.00 N ATOM 28 CD2 HIS A 3 54.895 0.420 -18.945 1.00 0.00 C ATOM 29 CE1 HIS A 3 55.090 -1.644 -19.574 1.00 0.00 C ATOM 30 NE2 HIS A 3 54.591 -0.891 -18.591 1.00 0.00 N ATOM 0 H HIS A 3 54.132 3.084 -22.745 1.00 0.00 H new ATOM 0 HA HIS A 3 54.216 2.482 -20.479 1.00 0.00 H new ATOM 0 HB2 HIS A 3 56.267 1.229 -21.997 1.00 0.00 H new ATOM 0 HB3 HIS A 3 57.114 1.844 -20.592 1.00 0.00 H new ATOM 0 HD2 HIS A 3 54.636 1.296 -18.369 1.00 0.00 H new ATOM 0 HE1 HIS A 3 55.023 -2.721 -19.605 1.00 0.00 H new ATOM 0 HE2 HIS A 3 54.094 -1.209 -17.759 1.00 0.00 H new ATOM 38 N MET A 4 55.302 5.073 -20.225 1.00 0.00 N ATOM 39 CA MET A 4 55.834 6.204 -19.411 1.00 0.00 C ATOM 40 C MET A 4 54.712 6.829 -18.577 1.00 0.00 C ATOM 41 O MET A 4 54.093 7.795 -18.975 1.00 0.00 O ATOM 42 CB MET A 4 56.367 7.211 -20.432 1.00 0.00 C ATOM 43 CG MET A 4 57.360 8.153 -19.749 1.00 0.00 C ATOM 44 SD MET A 4 57.253 9.794 -20.506 1.00 0.00 S ATOM 45 CE MET A 4 55.767 10.349 -19.635 1.00 0.00 C ATOM 0 H MET A 4 54.578 5.325 -20.898 1.00 0.00 H new ATOM 0 HA MET A 4 56.607 5.882 -18.713 1.00 0.00 H new ATOM 0 HB2 MET A 4 56.853 6.688 -21.255 1.00 0.00 H new ATOM 0 HB3 MET A 4 55.543 7.782 -20.860 1.00 0.00 H new ATOM 0 HG2 MET A 4 57.142 8.218 -18.683 1.00 0.00 H new ATOM 0 HG3 MET A 4 58.373 7.762 -19.844 1.00 0.00 H new ATOM 0 HE1 MET A 4 55.738 11.439 -19.622 1.00 0.00 H new ATOM 0 HE2 MET A 4 54.882 9.969 -20.146 1.00 0.00 H new ATOM 0 HE3 MET A 4 55.784 9.974 -18.612 1.00 0.00 H new ATOM 55 N LEU A 5 54.446 6.283 -17.421 1.00 0.00 N ATOM 56 CA LEU A 5 53.364 6.846 -16.562 1.00 0.00 C ATOM 57 C LEU A 5 53.887 7.086 -15.144 1.00 0.00 C ATOM 58 O LEU A 5 53.540 6.382 -14.217 1.00 0.00 O ATOM 59 CB LEU A 5 52.269 5.780 -16.557 1.00 0.00 C ATOM 60 CG LEU A 5 51.163 6.178 -17.536 1.00 0.00 C ATOM 61 CD1 LEU A 5 50.692 4.943 -18.306 1.00 0.00 C ATOM 62 CD2 LEU A 5 49.986 6.774 -16.760 1.00 0.00 C ATOM 0 H LEU A 5 54.930 5.473 -17.035 1.00 0.00 H new ATOM 0 HA LEU A 5 52.998 7.804 -16.931 1.00 0.00 H new ATOM 0 HB2 LEU A 5 52.687 4.813 -16.838 1.00 0.00 H new ATOM 0 HB3 LEU A 5 51.858 5.670 -15.553 1.00 0.00 H new ATOM 0 HG LEU A 5 51.549 6.917 -18.238 1.00 0.00 H new ATOM 0 HD11 LEU A 5 49.904 5.228 -19.003 1.00 0.00 H new ATOM 0 HD12 LEU A 5 51.530 4.518 -18.859 1.00 0.00 H new ATOM 0 HD13 LEU A 5 50.306 4.202 -17.605 1.00 0.00 H new ATOM 0 HD21 LEU A 5 49.197 7.058 -17.457 1.00 0.00 H new ATOM 0 HD22 LEU A 5 49.601 6.034 -16.058 1.00 0.00 H new ATOM 0 HD23 LEU A 5 50.320 7.655 -16.212 1.00 0.00 H new ATOM 74 N GLU A 6 54.721 8.075 -14.968 1.00 0.00 N ATOM 75 CA GLU A 6 55.265 8.358 -13.609 1.00 0.00 C ATOM 76 C GLU A 6 55.765 7.065 -12.959 1.00 0.00 C ATOM 77 O GLU A 6 55.013 6.343 -12.335 1.00 0.00 O ATOM 78 CB GLU A 6 54.086 8.933 -12.822 1.00 0.00 C ATOM 79 CG GLU A 6 54.535 10.192 -12.077 1.00 0.00 C ATOM 80 CD GLU A 6 53.461 10.598 -11.067 1.00 0.00 C ATOM 81 OE1 GLU A 6 52.747 9.723 -10.607 1.00 0.00 O ATOM 82 OE2 GLU A 6 53.369 11.778 -10.772 1.00 0.00 O ATOM 0 H GLU A 6 55.049 8.699 -15.706 1.00 0.00 H new ATOM 0 HA GLU A 6 56.110 9.046 -13.638 1.00 0.00 H new ATOM 0 HB2 GLU A 6 53.265 9.171 -13.498 1.00 0.00 H new ATOM 0 HB3 GLU A 6 53.712 8.193 -12.115 1.00 0.00 H new ATOM 0 HG2 GLU A 6 55.479 10.007 -11.565 1.00 0.00 H new ATOM 0 HG3 GLU A 6 54.709 11.003 -12.784 1.00 0.00 H new ATOM 89 N ASP A 7 57.027 6.768 -13.103 1.00 0.00 N ATOM 90 CA ASP A 7 57.573 5.520 -12.494 1.00 0.00 C ATOM 91 C ASP A 7 59.064 5.385 -12.812 1.00 0.00 C ATOM 92 O ASP A 7 59.887 5.326 -11.921 1.00 0.00 O ATOM 93 CB ASP A 7 56.780 4.384 -13.139 1.00 0.00 C ATOM 94 CG ASP A 7 55.742 3.856 -12.147 1.00 0.00 C ATOM 95 OD1 ASP A 7 56.088 3.693 -10.989 1.00 0.00 O ATOM 96 OD2 ASP A 7 54.619 3.624 -12.562 1.00 0.00 O ATOM 0 H ASP A 7 57.704 7.334 -13.615 1.00 0.00 H new ATOM 0 HA ASP A 7 57.480 5.515 -11.408 1.00 0.00 H new ATOM 0 HB2 ASP A 7 56.286 4.739 -14.043 1.00 0.00 H new ATOM 0 HB3 ASP A 7 57.453 3.581 -13.438 1.00 0.00 H new ATOM 101 N PRO A 8 59.359 5.339 -14.084 1.00 0.00 N ATOM 102 CA PRO A 8 60.763 5.209 -14.536 1.00 0.00 C ATOM 103 C PRO A 8 61.523 6.507 -14.291 1.00 0.00 C ATOM 104 O PRO A 8 61.724 7.309 -15.182 1.00 0.00 O ATOM 105 CB PRO A 8 60.639 4.923 -16.022 1.00 0.00 C ATOM 106 CG PRO A 8 59.315 5.493 -16.417 1.00 0.00 C ATOM 107 CD PRO A 8 58.423 5.405 -15.206 1.00 0.00 C ATOM 0 HA PRO A 8 61.313 4.432 -14.005 1.00 0.00 H new ATOM 0 HB2 PRO A 8 61.451 5.387 -16.582 1.00 0.00 H new ATOM 0 HB3 PRO A 8 60.684 3.853 -16.223 1.00 0.00 H new ATOM 0 HG2 PRO A 8 59.422 6.527 -16.744 1.00 0.00 H new ATOM 0 HG3 PRO A 8 58.889 4.937 -17.252 1.00 0.00 H new ATOM 0 HD2 PRO A 8 57.767 6.272 -15.129 1.00 0.00 H new ATOM 0 HD3 PRO A 8 57.783 4.524 -15.245 1.00 0.00 H new ATOM 115 N VAL A 9 61.940 6.709 -13.083 1.00 0.00 N ATOM 116 CA VAL A 9 62.694 7.950 -12.742 1.00 0.00 C ATOM 117 C VAL A 9 64.015 7.594 -12.056 1.00 0.00 C ATOM 118 O VAL A 9 64.192 7.819 -10.876 1.00 0.00 O ATOM 119 CB VAL A 9 61.781 8.716 -11.785 1.00 0.00 C ATOM 120 CG1 VAL A 9 61.552 7.884 -10.522 1.00 0.00 C ATOM 121 CG2 VAL A 9 62.441 10.044 -11.407 1.00 0.00 C ATOM 0 H VAL A 9 61.793 6.066 -12.305 1.00 0.00 H new ATOM 0 HA VAL A 9 62.944 8.538 -13.625 1.00 0.00 H new ATOM 0 HB VAL A 9 60.825 8.909 -12.271 1.00 0.00 H new ATOM 0 HG11 VAL A 9 60.901 8.430 -9.840 1.00 0.00 H new ATOM 0 HG12 VAL A 9 61.084 6.937 -10.790 1.00 0.00 H new ATOM 0 HG13 VAL A 9 62.508 7.691 -10.035 1.00 0.00 H new ATOM 0 HG21 VAL A 9 61.791 10.592 -10.724 1.00 0.00 H new ATOM 0 HG22 VAL A 9 63.397 9.850 -10.921 1.00 0.00 H new ATOM 0 HG23 VAL A 9 62.605 10.638 -12.306 1.00 0.00 H new ATOM 131 N GLU A 10 64.944 7.041 -12.787 1.00 0.00 N ATOM 132 CA GLU A 10 66.253 6.672 -12.176 1.00 0.00 C ATOM 133 C GLU A 10 67.124 7.918 -11.998 1.00 0.00 C ATOM 134 O GLU A 10 66.713 9.022 -12.294 1.00 0.00 O ATOM 135 CB GLU A 10 66.895 5.705 -13.171 1.00 0.00 C ATOM 136 CG GLU A 10 66.925 4.298 -12.569 1.00 0.00 C ATOM 137 CD GLU A 10 67.783 3.385 -13.447 1.00 0.00 C ATOM 138 OE1 GLU A 10 67.605 3.417 -14.653 1.00 0.00 O ATOM 139 OE2 GLU A 10 68.603 2.668 -12.898 1.00 0.00 O ATOM 0 H GLU A 10 64.853 6.829 -13.781 1.00 0.00 H new ATOM 0 HA GLU A 10 66.137 6.224 -11.189 1.00 0.00 H new ATOM 0 HB2 GLU A 10 66.333 5.701 -14.105 1.00 0.00 H new ATOM 0 HB3 GLU A 10 67.907 6.031 -13.410 1.00 0.00 H new ATOM 0 HG2 GLU A 10 67.330 4.332 -11.557 1.00 0.00 H new ATOM 0 HG3 GLU A 10 65.912 3.901 -12.494 1.00 0.00 H new ATOM 146 N GLY A 11 68.326 7.749 -11.516 1.00 0.00 N ATOM 147 CA GLY A 11 69.221 8.924 -11.320 1.00 0.00 C ATOM 148 C GLY A 11 68.474 10.012 -10.547 1.00 0.00 C ATOM 149 O GLY A 11 68.816 11.176 -10.606 1.00 0.00 O ATOM 0 H GLY A 11 68.726 6.849 -11.250 1.00 0.00 H new ATOM 0 HA2 GLY A 11 70.116 8.625 -10.775 1.00 0.00 H new ATOM 0 HA3 GLY A 11 69.549 9.309 -12.285 1.00 0.00 H new ATOM 153 N SER A 12 67.453 9.643 -9.821 1.00 0.00 N ATOM 154 CA SER A 12 66.684 10.657 -9.046 1.00 0.00 C ATOM 155 C SER A 12 66.190 10.052 -7.729 1.00 0.00 C ATOM 156 O SER A 12 65.012 10.074 -7.428 1.00 0.00 O ATOM 157 CB SER A 12 65.503 11.028 -9.940 1.00 0.00 C ATOM 158 OG SER A 12 65.560 12.416 -10.243 1.00 0.00 O ATOM 0 H SER A 12 67.119 8.683 -9.732 1.00 0.00 H new ATOM 0 HA SER A 12 67.290 11.526 -8.790 1.00 0.00 H new ATOM 0 HB2 SER A 12 65.530 10.442 -10.859 1.00 0.00 H new ATOM 0 HB3 SER A 12 64.564 10.792 -9.439 1.00 0.00 H new ATOM 0 HG SER A 12 64.804 12.657 -10.818 1.00 0.00 H new ATOM 164 N GLU A 13 67.079 9.514 -6.942 1.00 0.00 N ATOM 165 CA GLU A 13 66.662 8.908 -5.647 1.00 0.00 C ATOM 166 C GLU A 13 67.885 8.616 -4.787 1.00 0.00 C ATOM 167 O GLU A 13 67.895 7.715 -3.972 1.00 0.00 O ATOM 168 CB GLU A 13 65.960 7.615 -6.026 1.00 0.00 C ATOM 169 CG GLU A 13 64.476 7.707 -5.663 1.00 0.00 C ATOM 170 CD GLU A 13 63.745 6.467 -6.181 1.00 0.00 C ATOM 171 OE1 GLU A 13 64.413 5.498 -6.496 1.00 0.00 O ATOM 172 OE2 GLU A 13 62.527 6.509 -6.255 1.00 0.00 O ATOM 0 H GLU A 13 68.079 9.468 -7.140 1.00 0.00 H new ATOM 0 HA GLU A 13 66.016 9.570 -5.070 1.00 0.00 H new ATOM 0 HB2 GLU A 13 66.072 7.429 -7.094 1.00 0.00 H new ATOM 0 HB3 GLU A 13 66.420 6.775 -5.506 1.00 0.00 H new ATOM 0 HG2 GLU A 13 64.360 7.786 -4.582 1.00 0.00 H new ATOM 0 HG3 GLU A 13 64.040 8.607 -6.097 1.00 0.00 H new ATOM 179 N SER A 14 68.907 9.381 -4.971 1.00 0.00 N ATOM 180 CA SER A 14 70.154 9.180 -4.179 1.00 0.00 C ATOM 181 C SER A 14 70.060 9.930 -2.849 1.00 0.00 C ATOM 182 O SER A 14 69.539 11.025 -2.777 1.00 0.00 O ATOM 183 CB SER A 14 71.274 9.762 -5.044 1.00 0.00 C ATOM 184 OG SER A 14 70.803 9.935 -6.374 1.00 0.00 O ATOM 0 H SER A 14 68.942 10.149 -5.642 1.00 0.00 H new ATOM 0 HA SER A 14 70.327 8.130 -3.942 1.00 0.00 H new ATOM 0 HB2 SER A 14 71.604 10.718 -4.636 1.00 0.00 H new ATOM 0 HB3 SER A 14 72.137 9.097 -5.036 1.00 0.00 H new ATOM 0 HG SER A 14 71.519 10.309 -6.929 1.00 0.00 H new ATOM 190 N THR A 15 70.560 9.349 -1.792 1.00 0.00 N ATOM 191 CA THR A 15 70.496 10.031 -0.468 1.00 0.00 C ATOM 192 C THR A 15 71.825 10.726 -0.164 1.00 0.00 C ATOM 193 O THR A 15 71.952 11.451 0.804 1.00 0.00 O ATOM 194 CB THR A 15 70.232 8.913 0.542 1.00 0.00 C ATOM 195 OG1 THR A 15 68.896 8.451 0.395 1.00 0.00 O ATOM 196 CG2 THR A 15 70.437 9.446 1.962 1.00 0.00 C ATOM 0 H THR A 15 71.009 8.433 -1.788 1.00 0.00 H new ATOM 0 HA THR A 15 69.723 10.799 -0.437 1.00 0.00 H new ATOM 0 HB THR A 15 70.924 8.090 0.363 1.00 0.00 H new ATOM 0 HG1 THR A 15 68.725 7.733 1.040 1.00 0.00 H new ATOM 0 HG21 THR A 15 70.249 8.648 2.681 1.00 0.00 H new ATOM 0 HG22 THR A 15 71.462 9.800 2.073 1.00 0.00 H new ATOM 0 HG23 THR A 15 69.747 10.270 2.145 1.00 0.00 H new ATOM 204 N THR A 16 72.817 10.514 -0.984 1.00 0.00 N ATOM 205 CA THR A 16 74.136 11.165 -0.743 1.00 0.00 C ATOM 206 C THR A 16 74.897 11.326 -2.061 1.00 0.00 C ATOM 207 O THR A 16 74.587 10.680 -3.042 1.00 0.00 O ATOM 208 CB THR A 16 74.884 10.215 0.194 1.00 0.00 C ATOM 209 OG1 THR A 16 75.115 8.981 -0.472 1.00 0.00 O ATOM 210 CG2 THR A 16 74.048 9.971 1.451 1.00 0.00 C ATOM 0 H THR A 16 72.772 9.918 -1.811 1.00 0.00 H new ATOM 0 HA THR A 16 74.030 12.161 -0.314 1.00 0.00 H new ATOM 0 HB THR A 16 75.838 10.660 0.477 1.00 0.00 H new ATOM 0 HG1 THR A 16 75.965 8.600 -0.169 1.00 0.00 H new ATOM 0 HG21 THR A 16 74.582 9.294 2.118 1.00 0.00 H new ATOM 0 HG22 THR A 16 73.872 10.918 1.961 1.00 0.00 H new ATOM 0 HG23 THR A 16 73.093 9.527 1.172 1.00 0.00 H new ATOM 218 N PRO A 17 75.871 12.193 -2.036 1.00 0.00 N ATOM 219 CA PRO A 17 76.691 12.457 -3.243 1.00 0.00 C ATOM 220 C PRO A 17 77.666 11.302 -3.499 1.00 0.00 C ATOM 221 O PRO A 17 78.114 11.094 -4.610 1.00 0.00 O ATOM 222 CB PRO A 17 77.446 13.735 -2.889 1.00 0.00 C ATOM 223 CG PRO A 17 77.500 13.756 -1.394 1.00 0.00 C ATOM 224 CD PRO A 17 76.292 13.008 -0.891 1.00 0.00 C ATOM 0 HA PRO A 17 76.095 12.554 -4.150 1.00 0.00 H new ATOM 0 HB2 PRO A 17 78.447 13.733 -3.319 1.00 0.00 H new ATOM 0 HB3 PRO A 17 76.934 14.615 -3.277 1.00 0.00 H new ATOM 0 HG2 PRO A 17 78.418 13.289 -1.036 1.00 0.00 H new ATOM 0 HG3 PRO A 17 77.499 14.781 -1.024 1.00 0.00 H new ATOM 0 HD2 PRO A 17 76.538 12.387 -0.029 1.00 0.00 H new ATOM 0 HD3 PRO A 17 75.503 13.691 -0.577 1.00 0.00 H new ATOM 232 N PHE A 18 78.005 10.553 -2.483 1.00 0.00 N ATOM 233 CA PHE A 18 78.955 9.422 -2.682 1.00 0.00 C ATOM 234 C PHE A 18 78.215 8.082 -2.628 1.00 0.00 C ATOM 235 O PHE A 18 77.714 7.678 -1.598 1.00 0.00 O ATOM 236 CB PHE A 18 79.950 9.534 -1.527 1.00 0.00 C ATOM 237 CG PHE A 18 80.731 10.820 -1.663 1.00 0.00 C ATOM 238 CD1 PHE A 18 81.847 10.874 -2.507 1.00 0.00 C ATOM 239 CD2 PHE A 18 80.338 11.956 -0.947 1.00 0.00 C ATOM 240 CE1 PHE A 18 82.570 12.066 -2.635 1.00 0.00 C ATOM 241 CE2 PHE A 18 81.062 13.148 -1.074 1.00 0.00 C ATOM 242 CZ PHE A 18 82.178 13.203 -1.918 1.00 0.00 C ATOM 0 H PHE A 18 77.666 10.675 -1.529 1.00 0.00 H new ATOM 0 HA PHE A 18 79.448 9.467 -3.653 1.00 0.00 H new ATOM 0 HB2 PHE A 18 79.422 9.515 -0.574 1.00 0.00 H new ATOM 0 HB3 PHE A 18 80.628 8.681 -1.532 1.00 0.00 H new ATOM 0 HD1 PHE A 18 82.150 9.997 -3.059 1.00 0.00 H new ATOM 0 HD2 PHE A 18 79.477 11.914 -0.297 1.00 0.00 H new ATOM 0 HE1 PHE A 18 83.430 12.109 -3.287 1.00 0.00 H new ATOM 0 HE2 PHE A 18 80.760 14.025 -0.521 1.00 0.00 H new ATOM 0 HZ PHE A 18 82.736 14.122 -2.016 1.00 0.00 H new ATOM 252 N ASN A 19 78.147 7.391 -3.732 1.00 0.00 N ATOM 253 CA ASN A 19 77.448 6.078 -3.756 1.00 0.00 C ATOM 254 C ASN A 19 78.186 5.121 -4.695 1.00 0.00 C ATOM 255 O ASN A 19 78.853 5.538 -5.620 1.00 0.00 O ATOM 256 CB ASN A 19 76.054 6.387 -4.296 1.00 0.00 C ATOM 257 CG ASN A 19 75.495 7.630 -3.602 1.00 0.00 C ATOM 258 OD1 ASN A 19 76.004 8.720 -3.780 1.00 0.00 O ATOM 259 ND2 ASN A 19 74.464 7.514 -2.812 1.00 0.00 N ATOM 0 H ASN A 19 78.548 7.682 -4.623 1.00 0.00 H new ATOM 0 HA ASN A 19 77.408 5.604 -2.775 1.00 0.00 H new ATOM 0 HB2 ASN A 19 76.099 6.549 -5.373 1.00 0.00 H new ATOM 0 HB3 ASN A 19 75.392 5.537 -4.129 1.00 0.00 H new ATOM 0 HD21 ASN A 19 74.085 8.337 -2.344 1.00 0.00 H new ATOM 0 HD22 ASN A 19 74.037 6.600 -2.662 1.00 0.00 H new ATOM 266 N LEU A 20 78.075 3.845 -4.465 1.00 0.00 N ATOM 267 CA LEU A 20 78.776 2.870 -5.351 1.00 0.00 C ATOM 268 C LEU A 20 78.248 1.454 -5.112 1.00 0.00 C ATOM 269 O LEU A 20 77.346 1.240 -4.328 1.00 0.00 O ATOM 270 CB LEU A 20 80.250 2.966 -4.958 1.00 0.00 C ATOM 271 CG LEU A 20 80.429 2.485 -3.517 1.00 0.00 C ATOM 272 CD1 LEU A 20 80.490 0.957 -3.491 1.00 0.00 C ATOM 273 CD2 LEU A 20 81.730 3.055 -2.949 1.00 0.00 C ATOM 0 H LEU A 20 77.532 3.433 -3.706 1.00 0.00 H new ATOM 0 HA LEU A 20 78.619 3.090 -6.407 1.00 0.00 H new ATOM 0 HB2 LEU A 20 80.857 2.361 -5.632 1.00 0.00 H new ATOM 0 HB3 LEU A 20 80.596 3.995 -5.054 1.00 0.00 H new ATOM 0 HG LEU A 20 79.587 2.825 -2.914 1.00 0.00 H new ATOM 0 HD11 LEU A 20 80.618 0.615 -2.464 1.00 0.00 H new ATOM 0 HD12 LEU A 20 79.564 0.549 -3.897 1.00 0.00 H new ATOM 0 HD13 LEU A 20 81.332 0.616 -4.094 1.00 0.00 H new ATOM 0 HD21 LEU A 20 81.859 2.713 -1.922 1.00 0.00 H new ATOM 0 HD22 LEU A 20 82.571 2.714 -3.553 1.00 0.00 H new ATOM 0 HD23 LEU A 20 81.688 4.144 -2.966 1.00 0.00 H new ATOM 285 N PHE A 21 78.807 0.486 -5.785 1.00 0.00 N ATOM 286 CA PHE A 21 78.340 -0.917 -5.601 1.00 0.00 C ATOM 287 C PHE A 21 79.443 -1.759 -4.955 1.00 0.00 C ATOM 288 O PHE A 21 80.617 -1.497 -5.126 1.00 0.00 O ATOM 289 CB PHE A 21 78.037 -1.421 -7.013 1.00 0.00 C ATOM 290 CG PHE A 21 77.317 -2.746 -6.934 1.00 0.00 C ATOM 291 CD1 PHE A 21 78.045 -3.929 -6.759 1.00 0.00 C ATOM 292 CD2 PHE A 21 75.922 -2.791 -7.038 1.00 0.00 C ATOM 293 CE1 PHE A 21 77.377 -5.157 -6.686 1.00 0.00 C ATOM 294 CE2 PHE A 21 75.254 -4.019 -6.965 1.00 0.00 C ATOM 295 CZ PHE A 21 75.982 -5.202 -6.790 1.00 0.00 C ATOM 0 H PHE A 21 79.567 0.606 -6.454 1.00 0.00 H new ATOM 0 HA PHE A 21 77.468 -0.982 -4.950 1.00 0.00 H new ATOM 0 HB2 PHE A 21 77.424 -0.694 -7.546 1.00 0.00 H new ATOM 0 HB3 PHE A 21 78.963 -1.532 -7.577 1.00 0.00 H new ATOM 0 HD1 PHE A 21 79.122 -3.894 -6.680 1.00 0.00 H new ATOM 0 HD2 PHE A 21 75.361 -1.878 -7.175 1.00 0.00 H new ATOM 0 HE1 PHE A 21 77.938 -6.070 -6.549 1.00 0.00 H new ATOM 0 HE2 PHE A 21 74.177 -4.054 -7.044 1.00 0.00 H new ATOM 0 HZ PHE A 21 75.467 -6.150 -6.735 1.00 0.00 H new ATOM 305 N ILE A 22 79.075 -2.769 -4.216 1.00 0.00 N ATOM 306 CA ILE A 22 80.105 -3.625 -3.563 1.00 0.00 C ATOM 307 C ILE A 22 79.702 -5.099 -3.683 1.00 0.00 C ATOM 308 O ILE A 22 78.548 -5.423 -3.876 1.00 0.00 O ATOM 309 CB ILE A 22 80.131 -3.155 -2.098 1.00 0.00 C ATOM 310 CG1 ILE A 22 81.208 -2.080 -1.936 1.00 0.00 C ATOM 311 CG2 ILE A 22 80.443 -4.325 -1.158 1.00 0.00 C ATOM 312 CD1 ILE A 22 80.886 -1.213 -0.718 1.00 0.00 C ATOM 0 H ILE A 22 78.108 -3.038 -4.036 1.00 0.00 H new ATOM 0 HA ILE A 22 81.090 -3.539 -4.021 1.00 0.00 H new ATOM 0 HB ILE A 22 79.151 -2.752 -1.842 1.00 0.00 H new ATOM 0 HG12 ILE A 22 82.186 -2.546 -1.816 1.00 0.00 H new ATOM 0 HG13 ILE A 22 81.257 -1.462 -2.832 1.00 0.00 H new ATOM 0 HG21 ILE A 22 80.456 -3.970 -0.127 1.00 0.00 H new ATOM 0 HG22 ILE A 22 79.678 -5.094 -1.267 1.00 0.00 H new ATOM 0 HG23 ILE A 22 81.417 -4.744 -1.410 1.00 0.00 H new ATOM 0 HD11 ILE A 22 81.653 -0.448 -0.603 1.00 0.00 H new ATOM 0 HD12 ILE A 22 79.916 -0.736 -0.857 1.00 0.00 H new ATOM 0 HD13 ILE A 22 80.859 -1.837 0.176 1.00 0.00 H new ATOM 324 N GLY A 23 80.647 -5.990 -3.579 1.00 0.00 N ATOM 325 CA GLY A 23 80.318 -7.440 -3.694 1.00 0.00 C ATOM 326 C GLY A 23 81.005 -8.217 -2.571 1.00 0.00 C ATOM 327 O GLY A 23 81.526 -7.645 -1.634 1.00 0.00 O ATOM 0 H GLY A 23 81.632 -5.779 -3.420 1.00 0.00 H new ATOM 0 HA2 GLY A 23 79.239 -7.583 -3.640 1.00 0.00 H new ATOM 0 HA3 GLY A 23 80.642 -7.820 -4.663 1.00 0.00 H new ATOM 331 N ASN A 24 81.010 -9.519 -2.659 1.00 0.00 N ATOM 332 CA ASN A 24 81.663 -10.343 -1.598 1.00 0.00 C ATOM 333 C ASN A 24 80.861 -10.262 -0.297 1.00 0.00 C ATOM 334 O ASN A 24 81.398 -9.992 0.759 1.00 0.00 O ATOM 335 CB ASN A 24 83.053 -9.733 -1.412 1.00 0.00 C ATOM 336 CG ASN A 24 84.085 -10.852 -1.263 1.00 0.00 C ATOM 337 OD1 ASN A 24 84.365 -11.566 -2.205 1.00 0.00 O ATOM 338 ND2 ASN A 24 84.668 -11.036 -0.109 1.00 0.00 N ATOM 0 H ASN A 24 80.589 -10.050 -3.421 1.00 0.00 H new ATOM 0 HA ASN A 24 81.718 -11.396 -1.872 1.00 0.00 H new ATOM 0 HB2 ASN A 24 83.303 -9.104 -2.267 1.00 0.00 H new ATOM 0 HB3 ASN A 24 83.066 -9.092 -0.530 1.00 0.00 H new ATOM 0 HD21 ASN A 24 85.358 -11.779 0.001 1.00 0.00 H new ATOM 0 HD22 ASN A 24 84.433 -10.437 0.682 1.00 0.00 H new ATOM 345 N LEU A 25 79.579 -10.499 -0.363 1.00 0.00 N ATOM 346 CA LEU A 25 78.744 -10.438 0.870 1.00 0.00 C ATOM 347 C LEU A 25 78.486 -11.848 1.402 1.00 0.00 C ATOM 348 O LEU A 25 77.964 -12.700 0.713 1.00 0.00 O ATOM 349 CB LEU A 25 77.435 -9.782 0.433 1.00 0.00 C ATOM 350 CG LEU A 25 77.661 -8.285 0.202 1.00 0.00 C ATOM 351 CD1 LEU A 25 78.318 -7.668 1.437 1.00 0.00 C ATOM 352 CD2 LEU A 25 78.576 -8.091 -1.009 1.00 0.00 C ATOM 0 H LEU A 25 79.074 -10.732 -1.218 1.00 0.00 H new ATOM 0 HA LEU A 25 79.230 -9.880 1.670 1.00 0.00 H new ATOM 0 HB2 LEU A 25 77.070 -10.250 -0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 25 76.670 -9.931 1.195 1.00 0.00 H new ATOM 0 HG LEU A 25 76.703 -7.798 0.020 1.00 0.00 H new ATOM 0 HD11 LEU A 25 78.478 -6.603 1.270 1.00 0.00 H new ATOM 0 HD12 LEU A 25 77.669 -7.807 2.302 1.00 0.00 H new ATOM 0 HD13 LEU A 25 79.276 -8.154 1.621 1.00 0.00 H new ATOM 0 HD21 LEU A 25 78.738 -7.026 -1.175 1.00 0.00 H new ATOM 0 HD22 LEU A 25 79.533 -8.579 -0.824 1.00 0.00 H new ATOM 0 HD23 LEU A 25 78.110 -8.529 -1.891 1.00 0.00 H new ATOM 364 N ASN A 26 78.853 -12.092 2.627 1.00 0.00 N ATOM 365 CA ASN A 26 78.639 -13.441 3.222 1.00 0.00 C ATOM 366 C ASN A 26 77.250 -13.974 2.855 1.00 0.00 C ATOM 367 O ASN A 26 76.259 -13.574 3.432 1.00 0.00 O ATOM 368 CB ASN A 26 78.747 -13.217 4.729 1.00 0.00 C ATOM 369 CG ASN A 26 78.657 -14.559 5.455 1.00 0.00 C ATOM 370 OD1 ASN A 26 77.668 -15.256 5.348 1.00 0.00 O ATOM 371 ND2 ASN A 26 79.656 -14.954 6.197 1.00 0.00 N ATOM 0 H ASN A 26 79.295 -11.412 3.246 1.00 0.00 H new ATOM 0 HA ASN A 26 79.360 -14.174 2.860 1.00 0.00 H new ATOM 0 HB2 ASN A 26 79.691 -12.726 4.967 1.00 0.00 H new ATOM 0 HB3 ASN A 26 77.949 -12.555 5.067 1.00 0.00 H new ATOM 0 HD21 ASN A 26 79.606 -15.847 6.686 1.00 0.00 H new ATOM 0 HD22 ASN A 26 80.487 -14.369 6.287 1.00 0.00 H new ATOM 378 N PRO A 27 77.230 -14.864 1.901 1.00 0.00 N ATOM 379 CA PRO A 27 75.954 -15.464 1.445 1.00 0.00 C ATOM 380 C PRO A 27 75.453 -16.493 2.466 1.00 0.00 C ATOM 381 O PRO A 27 74.315 -16.915 2.427 1.00 0.00 O ATOM 382 CB PRO A 27 76.330 -16.146 0.133 1.00 0.00 C ATOM 383 CG PRO A 27 77.795 -16.426 0.242 1.00 0.00 C ATOM 384 CD PRO A 27 78.385 -15.388 1.165 1.00 0.00 C ATOM 0 HA PRO A 27 75.154 -14.733 1.329 1.00 0.00 H new ATOM 0 HB2 PRO A 27 75.763 -17.066 -0.009 1.00 0.00 H new ATOM 0 HB3 PRO A 27 76.114 -15.503 -0.721 1.00 0.00 H new ATOM 0 HG2 PRO A 27 77.966 -17.429 0.633 1.00 0.00 H new ATOM 0 HG3 PRO A 27 78.268 -16.381 -0.739 1.00 0.00 H new ATOM 0 HD2 PRO A 27 79.121 -15.826 1.839 1.00 0.00 H new ATOM 0 HD3 PRO A 27 78.892 -14.601 0.607 1.00 0.00 H new ATOM 392 N ASN A 28 76.296 -16.897 3.379 1.00 0.00 N ATOM 393 CA ASN A 28 75.866 -17.898 4.399 1.00 0.00 C ATOM 394 C ASN A 28 75.073 -17.210 5.510 1.00 0.00 C ATOM 395 O ASN A 28 74.337 -17.839 6.244 1.00 0.00 O ATOM 396 CB ASN A 28 77.166 -18.486 4.949 1.00 0.00 C ATOM 397 CG ASN A 28 77.953 -19.139 3.812 1.00 0.00 C ATOM 398 OD1 ASN A 28 78.006 -18.617 2.716 1.00 0.00 O ATOM 399 ND2 ASN A 28 78.572 -20.268 4.027 1.00 0.00 N ATOM 0 H ASN A 28 77.261 -16.578 3.463 1.00 0.00 H new ATOM 0 HA ASN A 28 75.219 -18.667 3.978 1.00 0.00 H new ATOM 0 HB2 ASN A 28 77.763 -17.702 5.415 1.00 0.00 H new ATOM 0 HB3 ASN A 28 76.946 -19.222 5.722 1.00 0.00 H new ATOM 0 HD21 ASN A 28 79.100 -20.711 3.275 1.00 0.00 H new ATOM 0 HD22 ASN A 28 78.528 -20.707 4.947 1.00 0.00 H new ATOM 406 N LYS A 29 75.216 -15.922 5.634 1.00 0.00 N ATOM 407 CA LYS A 29 74.470 -15.183 6.690 1.00 0.00 C ATOM 408 C LYS A 29 73.348 -14.364 6.055 1.00 0.00 C ATOM 409 O LYS A 29 72.884 -14.664 4.972 1.00 0.00 O ATOM 410 CB LYS A 29 75.509 -14.267 7.336 1.00 0.00 C ATOM 411 CG LYS A 29 75.705 -14.671 8.798 1.00 0.00 C ATOM 412 CD LYS A 29 74.572 -14.091 9.645 1.00 0.00 C ATOM 413 CE LYS A 29 74.442 -14.889 10.943 1.00 0.00 C ATOM 414 NZ LYS A 29 73.034 -14.682 11.383 1.00 0.00 N ATOM 0 H LYS A 29 75.820 -15.346 5.047 1.00 0.00 H new ATOM 0 HA LYS A 29 74.006 -15.847 7.419 1.00 0.00 H new ATOM 0 HB2 LYS A 29 76.455 -14.336 6.798 1.00 0.00 H new ATOM 0 HB3 LYS A 29 75.183 -13.229 7.275 1.00 0.00 H new ATOM 0 HG2 LYS A 29 75.720 -15.757 8.887 1.00 0.00 H new ATOM 0 HG3 LYS A 29 76.667 -14.308 9.161 1.00 0.00 H new ATOM 0 HD2 LYS A 29 74.771 -13.043 9.869 1.00 0.00 H new ATOM 0 HD3 LYS A 29 73.635 -14.125 9.090 1.00 0.00 H new ATOM 0 HE2 LYS A 29 74.653 -15.946 10.779 1.00 0.00 H new ATOM 0 HE3 LYS A 29 75.147 -14.536 11.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 72.868 -15.200 12.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 72.864 -13.668 11.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 72.386 -15.034 10.650 1.00 0.00 H new ATOM 428 N SER A 30 72.913 -13.330 6.712 1.00 0.00 N ATOM 429 CA SER A 30 71.824 -12.491 6.138 1.00 0.00 C ATOM 430 C SER A 30 72.403 -11.202 5.568 1.00 0.00 C ATOM 431 O SER A 30 73.320 -10.623 6.118 1.00 0.00 O ATOM 432 CB SER A 30 70.901 -12.168 7.305 1.00 0.00 C ATOM 433 OG SER A 30 70.869 -13.270 8.202 1.00 0.00 O ATOM 0 H SER A 30 73.262 -13.027 7.621 1.00 0.00 H new ATOM 0 HA SER A 30 71.300 -13.004 5.331 1.00 0.00 H new ATOM 0 HB2 SER A 30 71.250 -11.274 7.822 1.00 0.00 H new ATOM 0 HB3 SER A 30 69.897 -11.953 6.940 1.00 0.00 H new ATOM 0 HG SER A 30 70.276 -13.062 8.954 1.00 0.00 H new ATOM 439 N VAL A 31 71.870 -10.735 4.478 1.00 0.00 N ATOM 440 CA VAL A 31 72.399 -9.474 3.897 1.00 0.00 C ATOM 441 C VAL A 31 72.094 -8.318 4.849 1.00 0.00 C ATOM 442 O VAL A 31 72.716 -7.276 4.799 1.00 0.00 O ATOM 443 CB VAL A 31 71.687 -9.292 2.553 1.00 0.00 C ATOM 444 CG1 VAL A 31 72.501 -8.340 1.676 1.00 0.00 C ATOM 445 CG2 VAL A 31 71.565 -10.643 1.842 1.00 0.00 C ATOM 0 H VAL A 31 71.099 -11.166 3.968 1.00 0.00 H new ATOM 0 HA VAL A 31 73.479 -9.502 3.752 1.00 0.00 H new ATOM 0 HB VAL A 31 70.692 -8.882 2.727 1.00 0.00 H new ATOM 0 HG11 VAL A 31 71.998 -8.208 0.718 1.00 0.00 H new ATOM 0 HG12 VAL A 31 72.593 -7.375 2.174 1.00 0.00 H new ATOM 0 HG13 VAL A 31 73.494 -8.758 1.509 1.00 0.00 H new ATOM 0 HG21 VAL A 31 71.058 -10.507 0.887 1.00 0.00 H new ATOM 0 HG22 VAL A 31 72.559 -11.054 1.669 1.00 0.00 H new ATOM 0 HG23 VAL A 31 70.991 -11.330 2.463 1.00 0.00 H new ATOM 455 N ALA A 32 71.152 -8.507 5.734 1.00 0.00 N ATOM 456 CA ALA A 32 70.822 -7.431 6.710 1.00 0.00 C ATOM 457 C ALA A 32 71.958 -7.315 7.725 1.00 0.00 C ATOM 458 O ALA A 32 72.374 -6.234 8.094 1.00 0.00 O ATOM 459 CB ALA A 32 69.532 -7.890 7.390 1.00 0.00 C ATOM 0 H ALA A 32 70.598 -9.359 5.822 1.00 0.00 H new ATOM 0 HA ALA A 32 70.697 -6.455 6.242 1.00 0.00 H new ATOM 0 HB1 ALA A 32 69.224 -7.147 8.125 1.00 0.00 H new ATOM 0 HB2 ALA A 32 68.748 -8.007 6.642 1.00 0.00 H new ATOM 0 HB3 ALA A 32 69.703 -8.844 7.888 1.00 0.00 H new ATOM 465 N GLU A 33 72.472 -8.431 8.162 1.00 0.00 N ATOM 466 CA GLU A 33 73.598 -8.405 9.137 1.00 0.00 C ATOM 467 C GLU A 33 74.833 -7.805 8.466 1.00 0.00 C ATOM 468 O GLU A 33 75.582 -7.062 9.068 1.00 0.00 O ATOM 469 CB GLU A 33 73.835 -9.871 9.506 1.00 0.00 C ATOM 470 CG GLU A 33 72.546 -10.471 10.069 1.00 0.00 C ATOM 471 CD GLU A 33 72.350 -9.998 11.510 1.00 0.00 C ATOM 472 OE1 GLU A 33 73.143 -10.383 12.352 1.00 0.00 O ATOM 473 OE2 GLU A 33 71.409 -9.258 11.748 1.00 0.00 O ATOM 0 H GLU A 33 72.160 -9.362 7.885 1.00 0.00 H new ATOM 0 HA GLU A 33 73.384 -7.802 10.019 1.00 0.00 H new ATOM 0 HB2 GLU A 33 74.156 -10.431 8.627 1.00 0.00 H new ATOM 0 HB3 GLU A 33 74.636 -9.947 10.242 1.00 0.00 H new ATOM 0 HG2 GLU A 33 71.695 -10.171 9.458 1.00 0.00 H new ATOM 0 HG3 GLU A 33 72.594 -11.559 10.036 1.00 0.00 H new ATOM 480 N LEU A 34 75.038 -8.105 7.210 1.00 0.00 N ATOM 481 CA LEU A 34 76.204 -7.534 6.494 1.00 0.00 C ATOM 482 C LEU A 34 76.053 -6.016 6.443 1.00 0.00 C ATOM 483 O LEU A 34 77.015 -5.278 6.528 1.00 0.00 O ATOM 484 CB LEU A 34 76.131 -8.140 5.094 1.00 0.00 C ATOM 485 CG LEU A 34 76.812 -9.510 5.093 1.00 0.00 C ATOM 486 CD1 LEU A 34 75.817 -10.576 5.551 1.00 0.00 C ATOM 487 CD2 LEU A 34 77.289 -9.836 3.678 1.00 0.00 C ATOM 0 H LEU A 34 74.445 -8.721 6.654 1.00 0.00 H new ATOM 0 HA LEU A 34 77.159 -7.752 6.972 1.00 0.00 H new ATOM 0 HB2 LEU A 34 75.091 -8.239 4.783 1.00 0.00 H new ATOM 0 HB3 LEU A 34 76.617 -7.480 4.375 1.00 0.00 H new ATOM 0 HG LEU A 34 77.664 -9.493 5.773 1.00 0.00 H new ATOM 0 HD11 LEU A 34 76.303 -11.552 5.550 1.00 0.00 H new ATOM 0 HD12 LEU A 34 75.473 -10.343 6.559 1.00 0.00 H new ATOM 0 HD13 LEU A 34 74.965 -10.594 4.871 1.00 0.00 H new ATOM 0 HD21 LEU A 34 77.775 -10.812 3.674 1.00 0.00 H new ATOM 0 HD22 LEU A 34 76.435 -9.853 3.001 1.00 0.00 H new ATOM 0 HD23 LEU A 34 77.998 -9.076 3.349 1.00 0.00 H new ATOM 499 N LYS A 35 74.841 -5.549 6.329 1.00 0.00 N ATOM 500 CA LYS A 35 74.605 -4.080 6.299 1.00 0.00 C ATOM 501 C LYS A 35 75.120 -3.473 7.602 1.00 0.00 C ATOM 502 O LYS A 35 75.969 -2.604 7.607 1.00 0.00 O ATOM 503 CB LYS A 35 73.086 -3.926 6.195 1.00 0.00 C ATOM 504 CG LYS A 35 72.694 -3.612 4.750 1.00 0.00 C ATOM 505 CD LYS A 35 71.378 -4.314 4.415 1.00 0.00 C ATOM 506 CE LYS A 35 71.532 -5.097 3.108 1.00 0.00 C ATOM 507 NZ LYS A 35 70.152 -5.536 2.747 1.00 0.00 N ATOM 0 H LYS A 35 74.002 -6.124 6.255 1.00 0.00 H new ATOM 0 HA LYS A 35 75.113 -3.580 5.475 1.00 0.00 H new ATOM 0 HB2 LYS A 35 72.595 -4.842 6.524 1.00 0.00 H new ATOM 0 HB3 LYS A 35 72.746 -3.128 6.855 1.00 0.00 H new ATOM 0 HG2 LYS A 35 72.589 -2.535 4.616 1.00 0.00 H new ATOM 0 HG3 LYS A 35 73.478 -3.942 4.069 1.00 0.00 H new ATOM 0 HD2 LYS A 35 71.098 -4.989 5.224 1.00 0.00 H new ATOM 0 HD3 LYS A 35 70.577 -3.581 4.319 1.00 0.00 H new ATOM 0 HE2 LYS A 35 71.964 -4.474 2.325 1.00 0.00 H new ATOM 0 HE3 LYS A 35 72.196 -5.952 3.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 70.152 -6.558 2.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 69.505 -5.332 3.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 69.836 -5.024 1.899 1.00 0.00 H new ATOM 521 N VAL A 36 74.622 -3.948 8.710 1.00 0.00 N ATOM 522 CA VAL A 36 75.090 -3.431 10.025 1.00 0.00 C ATOM 523 C VAL A 36 76.580 -3.697 10.173 1.00 0.00 C ATOM 524 O VAL A 36 77.301 -2.917 10.749 1.00 0.00 O ATOM 525 CB VAL A 36 74.312 -4.234 11.056 1.00 0.00 C ATOM 526 CG1 VAL A 36 74.584 -3.677 12.454 1.00 0.00 C ATOM 527 CG2 VAL A 36 72.816 -4.147 10.750 1.00 0.00 C ATOM 0 H VAL A 36 73.908 -4.675 8.761 1.00 0.00 H new ATOM 0 HA VAL A 36 74.933 -2.358 10.136 1.00 0.00 H new ATOM 0 HB VAL A 36 74.629 -5.276 11.016 1.00 0.00 H new ATOM 0 HG11 VAL A 36 74.025 -4.254 13.191 1.00 0.00 H new ATOM 0 HG12 VAL A 36 75.650 -3.745 12.672 1.00 0.00 H new ATOM 0 HG13 VAL A 36 74.271 -2.634 12.497 1.00 0.00 H new ATOM 0 HG21 VAL A 36 72.259 -4.723 11.489 1.00 0.00 H new ATOM 0 HG22 VAL A 36 72.497 -3.105 10.786 1.00 0.00 H new ATOM 0 HG23 VAL A 36 72.624 -4.551 9.756 1.00 0.00 H new ATOM 537 N ALA A 37 77.052 -4.793 9.648 1.00 0.00 N ATOM 538 CA ALA A 37 78.504 -5.088 9.756 1.00 0.00 C ATOM 539 C ALA A 37 79.278 -4.011 9.007 1.00 0.00 C ATOM 540 O ALA A 37 80.362 -3.627 9.393 1.00 0.00 O ATOM 541 CB ALA A 37 78.692 -6.455 9.100 1.00 0.00 C ATOM 0 H ALA A 37 76.498 -5.492 9.152 1.00 0.00 H new ATOM 0 HA ALA A 37 78.863 -5.099 10.785 1.00 0.00 H new ATOM 0 HB1 ALA A 37 79.744 -6.738 9.143 1.00 0.00 H new ATOM 0 HB2 ALA A 37 78.094 -7.198 9.629 1.00 0.00 H new ATOM 0 HB3 ALA A 37 78.372 -6.406 8.059 1.00 0.00 H new ATOM 547 N ILE A 38 78.715 -3.506 7.946 1.00 0.00 N ATOM 548 CA ILE A 38 79.405 -2.434 7.181 1.00 0.00 C ATOM 549 C ILE A 38 79.172 -1.091 7.873 1.00 0.00 C ATOM 550 O ILE A 38 79.989 -0.193 7.803 1.00 0.00 O ATOM 551 CB ILE A 38 78.758 -2.450 5.796 1.00 0.00 C ATOM 552 CG1 ILE A 38 79.114 -3.758 5.084 1.00 0.00 C ATOM 553 CG2 ILE A 38 79.277 -1.268 4.976 1.00 0.00 C ATOM 554 CD1 ILE A 38 78.046 -4.074 4.034 1.00 0.00 C ATOM 0 H ILE A 38 77.808 -3.789 7.576 1.00 0.00 H new ATOM 0 HA ILE A 38 80.482 -2.586 7.118 1.00 0.00 H new ATOM 0 HB ILE A 38 77.676 -2.373 5.900 1.00 0.00 H new ATOM 0 HG12 ILE A 38 80.092 -3.672 4.610 1.00 0.00 H new ATOM 0 HG13 ILE A 38 79.181 -4.571 5.807 1.00 0.00 H new ATOM 0 HG21 ILE A 38 78.816 -1.280 3.989 1.00 0.00 H new ATOM 0 HG22 ILE A 38 79.027 -0.336 5.483 1.00 0.00 H new ATOM 0 HG23 ILE A 38 80.359 -1.345 4.872 1.00 0.00 H new ATOM 0 HD11 ILE A 38 78.299 -5.005 3.527 1.00 0.00 H new ATOM 0 HD12 ILE A 38 77.076 -4.178 4.521 1.00 0.00 H new ATOM 0 HD13 ILE A 38 78.001 -3.264 3.305 1.00 0.00 H new ATOM 566 N SER A 39 78.068 -0.951 8.561 1.00 0.00 N ATOM 567 CA SER A 39 77.804 0.333 9.269 1.00 0.00 C ATOM 568 C SER A 39 78.617 0.367 10.561 1.00 0.00 C ATOM 569 O SER A 39 79.038 1.407 11.029 1.00 0.00 O ATOM 570 CB SER A 39 76.306 0.322 9.572 1.00 0.00 C ATOM 571 OG SER A 39 75.782 1.632 9.396 1.00 0.00 O ATOM 0 H SER A 39 77.345 -1.664 8.662 1.00 0.00 H new ATOM 0 HA SER A 39 78.083 1.207 8.681 1.00 0.00 H new ATOM 0 HB2 SER A 39 75.795 -0.378 8.912 1.00 0.00 H new ATOM 0 HB3 SER A 39 76.132 -0.018 10.593 1.00 0.00 H new ATOM 0 HG SER A 39 74.821 1.628 9.588 1.00 0.00 H new ATOM 577 N GLU A 40 78.852 -0.781 11.127 1.00 0.00 N ATOM 578 CA GLU A 40 79.643 -0.855 12.380 1.00 0.00 C ATOM 579 C GLU A 40 81.127 -0.768 12.049 1.00 0.00 C ATOM 580 O GLU A 40 81.900 -0.147 12.752 1.00 0.00 O ATOM 581 CB GLU A 40 79.293 -2.215 12.964 1.00 0.00 C ATOM 582 CG GLU A 40 79.066 -2.086 14.470 1.00 0.00 C ATOM 583 CD GLU A 40 80.319 -2.543 15.218 1.00 0.00 C ATOM 584 OE1 GLU A 40 81.388 -2.488 14.632 1.00 0.00 O ATOM 585 OE2 GLU A 40 80.189 -2.941 16.364 1.00 0.00 O ATOM 0 H GLU A 40 78.526 -1.679 10.770 1.00 0.00 H new ATOM 0 HA GLU A 40 79.426 -0.046 13.077 1.00 0.00 H new ATOM 0 HB2 GLU A 40 78.397 -2.608 12.484 1.00 0.00 H new ATOM 0 HB3 GLU A 40 80.097 -2.924 12.767 1.00 0.00 H new ATOM 0 HG2 GLU A 40 78.834 -1.052 14.726 1.00 0.00 H new ATOM 0 HG3 GLU A 40 78.210 -2.689 14.772 1.00 0.00 H new ATOM 592 N LEU A 41 81.527 -1.374 10.968 1.00 0.00 N ATOM 593 CA LEU A 41 82.960 -1.314 10.574 1.00 0.00 C ATOM 594 C LEU A 41 83.302 0.110 10.154 1.00 0.00 C ATOM 595 O LEU A 41 84.408 0.574 10.337 1.00 0.00 O ATOM 596 CB LEU A 41 83.100 -2.273 9.392 1.00 0.00 C ATOM 597 CG LEU A 41 84.481 -2.928 9.432 1.00 0.00 C ATOM 598 CD1 LEU A 41 84.342 -4.431 9.181 1.00 0.00 C ATOM 599 CD2 LEU A 41 85.369 -2.311 8.347 1.00 0.00 C ATOM 0 H LEU A 41 80.925 -1.907 10.341 1.00 0.00 H new ATOM 0 HA LEU A 41 83.631 -1.591 11.387 1.00 0.00 H new ATOM 0 HB2 LEU A 41 82.322 -3.035 9.434 1.00 0.00 H new ATOM 0 HB3 LEU A 41 82.968 -1.734 8.454 1.00 0.00 H new ATOM 0 HG LEU A 41 84.932 -2.763 10.410 1.00 0.00 H new ATOM 0 HD11 LEU A 41 85.327 -4.897 9.210 1.00 0.00 H new ATOM 0 HD12 LEU A 41 83.709 -4.872 9.952 1.00 0.00 H new ATOM 0 HD13 LEU A 41 83.891 -4.596 8.203 1.00 0.00 H new ATOM 0 HD21 LEU A 41 86.354 -2.777 8.374 1.00 0.00 H new ATOM 0 HD22 LEU A 41 84.917 -2.476 7.369 1.00 0.00 H new ATOM 0 HD23 LEU A 41 85.469 -1.240 8.524 1.00 0.00 H new ATOM 611 N PHE A 42 82.353 0.814 9.599 1.00 0.00 N ATOM 612 CA PHE A 42 82.616 2.210 9.179 1.00 0.00 C ATOM 613 C PHE A 42 82.338 3.153 10.348 1.00 0.00 C ATOM 614 O PHE A 42 82.748 4.289 10.353 1.00 0.00 O ATOM 615 CB PHE A 42 81.625 2.463 8.054 1.00 0.00 C ATOM 616 CG PHE A 42 82.137 1.852 6.770 1.00 0.00 C ATOM 617 CD1 PHE A 42 82.303 0.466 6.673 1.00 0.00 C ATOM 618 CD2 PHE A 42 82.440 2.673 5.678 1.00 0.00 C ATOM 619 CE1 PHE A 42 82.772 -0.100 5.481 1.00 0.00 C ATOM 620 CE2 PHE A 42 82.910 2.107 4.487 1.00 0.00 C ATOM 621 CZ PHE A 42 83.076 0.721 4.389 1.00 0.00 C ATOM 0 H PHE A 42 81.407 0.477 9.420 1.00 0.00 H new ATOM 0 HA PHE A 42 83.647 2.372 8.864 1.00 0.00 H new ATOM 0 HB2 PHE A 42 80.655 2.035 8.309 1.00 0.00 H new ATOM 0 HB3 PHE A 42 81.476 3.535 7.923 1.00 0.00 H new ATOM 0 HD1 PHE A 42 82.070 -0.167 7.517 1.00 0.00 H new ATOM 0 HD2 PHE A 42 82.311 3.743 5.754 1.00 0.00 H new ATOM 0 HE1 PHE A 42 82.899 -1.170 5.404 1.00 0.00 H new ATOM 0 HE2 PHE A 42 83.144 2.740 3.644 1.00 0.00 H new ATOM 0 HZ PHE A 42 83.439 0.285 3.470 1.00 0.00 H new ATOM 631 N ALA A 43 81.633 2.690 11.338 1.00 0.00 N ATOM 632 CA ALA A 43 81.333 3.568 12.501 1.00 0.00 C ATOM 633 C ALA A 43 82.438 3.441 13.551 1.00 0.00 C ATOM 634 O ALA A 43 82.723 4.367 14.285 1.00 0.00 O ATOM 635 CB ALA A 43 80.013 3.051 13.054 1.00 0.00 C ATOM 0 H ALA A 43 81.252 1.745 11.394 1.00 0.00 H new ATOM 0 HA ALA A 43 81.274 4.620 12.222 1.00 0.00 H new ATOM 0 HB1 ALA A 43 79.721 3.648 13.918 1.00 0.00 H new ATOM 0 HB2 ALA A 43 79.243 3.124 12.286 1.00 0.00 H new ATOM 0 HB3 ALA A 43 80.128 2.010 13.355 1.00 0.00 H new ATOM 641 N LYS A 44 83.066 2.302 13.620 1.00 0.00 N ATOM 642 CA LYS A 44 84.159 2.112 14.613 1.00 0.00 C ATOM 643 C LYS A 44 85.496 2.474 13.973 1.00 0.00 C ATOM 644 O LYS A 44 86.473 2.735 14.646 1.00 0.00 O ATOM 645 CB LYS A 44 84.116 0.626 14.973 1.00 0.00 C ATOM 646 CG LYS A 44 83.454 0.450 16.341 1.00 0.00 C ATOM 647 CD LYS A 44 83.929 -0.858 16.974 1.00 0.00 C ATOM 648 CE LYS A 44 83.240 -1.050 18.328 1.00 0.00 C ATOM 649 NZ LYS A 44 84.322 -0.875 19.337 1.00 0.00 N ATOM 0 H LYS A 44 82.870 1.493 13.031 1.00 0.00 H new ATOM 0 HA LYS A 44 84.041 2.741 15.495 1.00 0.00 H new ATOM 0 HB2 LYS A 44 83.561 0.073 14.215 1.00 0.00 H new ATOM 0 HB3 LYS A 44 85.126 0.216 14.991 1.00 0.00 H new ATOM 0 HG2 LYS A 44 83.703 1.291 16.988 1.00 0.00 H new ATOM 0 HG3 LYS A 44 82.369 0.441 16.233 1.00 0.00 H new ATOM 0 HD2 LYS A 44 83.701 -1.697 16.316 1.00 0.00 H new ATOM 0 HD3 LYS A 44 85.011 -0.840 17.104 1.00 0.00 H new ATOM 0 HE2 LYS A 44 82.443 -0.321 18.473 1.00 0.00 H new ATOM 0 HE3 LYS A 44 82.785 -2.038 18.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 83.928 -0.992 20.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 85.063 -1.587 19.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 84.731 0.077 19.246 1.00 0.00 H new ATOM 663 N ASN A 45 85.539 2.502 12.671 1.00 0.00 N ATOM 664 CA ASN A 45 86.799 2.856 11.970 1.00 0.00 C ATOM 665 C ASN A 45 86.960 4.373 11.935 1.00 0.00 C ATOM 666 O ASN A 45 87.920 4.912 12.444 1.00 0.00 O ATOM 667 CB ASN A 45 86.611 2.314 10.555 1.00 0.00 C ATOM 668 CG ASN A 45 87.168 0.893 10.473 1.00 0.00 C ATOM 669 OD1 ASN A 45 88.128 0.643 9.772 1.00 0.00 O ATOM 670 ND2 ASN A 45 86.600 -0.053 11.166 1.00 0.00 N ATOM 0 H ASN A 45 84.749 2.293 12.060 1.00 0.00 H new ATOM 0 HA ASN A 45 87.684 2.447 12.458 1.00 0.00 H new ATOM 0 HB2 ASN A 45 85.553 2.317 10.291 1.00 0.00 H new ATOM 0 HB3 ASN A 45 87.120 2.957 9.837 1.00 0.00 H new ATOM 0 HD21 ASN A 45 86.961 -1.006 11.121 1.00 0.00 H new ATOM 0 HD22 ASN A 45 85.794 0.159 11.754 1.00 0.00 H new ATOM 677 N ASP A 46 85.993 5.043 11.346 1.00 0.00 N ATOM 678 CA ASP A 46 85.991 6.540 11.238 1.00 0.00 C ATOM 679 C ASP A 46 85.290 6.967 9.945 1.00 0.00 C ATOM 680 O ASP A 46 85.606 7.986 9.363 1.00 0.00 O ATOM 681 CB ASP A 46 87.449 7.011 11.203 1.00 0.00 C ATOM 682 CG ASP A 46 87.880 7.455 12.603 1.00 0.00 C ATOM 683 OD1 ASP A 46 87.142 7.195 13.538 1.00 0.00 O ATOM 684 OD2 ASP A 46 88.940 8.050 12.714 1.00 0.00 O ATOM 0 H ASP A 46 85.179 4.597 10.922 1.00 0.00 H new ATOM 0 HA ASP A 46 85.464 6.978 12.085 1.00 0.00 H new ATOM 0 HB2 ASP A 46 88.094 6.205 10.852 1.00 0.00 H new ATOM 0 HB3 ASP A 46 87.558 7.836 10.499 1.00 0.00 H new ATOM 689 N LEU A 47 84.343 6.197 9.495 1.00 0.00 N ATOM 690 CA LEU A 47 83.620 6.549 8.248 1.00 0.00 C ATOM 691 C LEU A 47 82.218 7.052 8.593 1.00 0.00 C ATOM 692 O LEU A 47 81.954 7.472 9.702 1.00 0.00 O ATOM 693 CB LEU A 47 83.551 5.237 7.461 1.00 0.00 C ATOM 694 CG LEU A 47 84.774 5.121 6.551 1.00 0.00 C ATOM 695 CD1 LEU A 47 84.797 6.295 5.573 1.00 0.00 C ATOM 696 CD2 LEU A 47 86.046 5.142 7.402 1.00 0.00 C ATOM 0 H LEU A 47 84.037 5.333 9.942 1.00 0.00 H new ATOM 0 HA LEU A 47 84.110 7.338 7.678 1.00 0.00 H new ATOM 0 HB2 LEU A 47 83.514 4.391 8.147 1.00 0.00 H new ATOM 0 HB3 LEU A 47 82.638 5.205 6.866 1.00 0.00 H new ATOM 0 HG LEU A 47 84.724 4.186 5.994 1.00 0.00 H new ATOM 0 HD11 LEU A 47 85.669 6.211 4.925 1.00 0.00 H new ATOM 0 HD12 LEU A 47 83.891 6.281 4.967 1.00 0.00 H new ATOM 0 HD13 LEU A 47 84.847 7.231 6.129 1.00 0.00 H new ATOM 0 HD21 LEU A 47 86.919 5.059 6.754 1.00 0.00 H new ATOM 0 HD22 LEU A 47 86.095 6.077 7.960 1.00 0.00 H new ATOM 0 HD23 LEU A 47 86.031 4.304 8.099 1.00 0.00 H new ATOM 708 N ALA A 48 81.319 7.007 7.658 1.00 0.00 N ATOM 709 CA ALA A 48 79.933 7.476 7.932 1.00 0.00 C ATOM 710 C ALA A 48 78.972 6.895 6.897 1.00 0.00 C ATOM 711 O ALA A 48 78.339 7.611 6.146 1.00 0.00 O ATOM 712 CB ALA A 48 79.995 8.999 7.821 1.00 0.00 C ATOM 0 H ALA A 48 81.482 6.665 6.711 1.00 0.00 H new ATOM 0 HA ALA A 48 79.574 7.160 8.912 1.00 0.00 H new ATOM 0 HB1 ALA A 48 79.007 9.418 8.011 1.00 0.00 H new ATOM 0 HB2 ALA A 48 80.701 9.389 8.554 1.00 0.00 H new ATOM 0 HB3 ALA A 48 80.321 9.278 6.819 1.00 0.00 H new ATOM 718 N VAL A 49 78.860 5.599 6.856 1.00 0.00 N ATOM 719 CA VAL A 49 77.952 4.954 5.889 1.00 0.00 C ATOM 720 C VAL A 49 76.558 5.554 6.009 1.00 0.00 C ATOM 721 O VAL A 49 75.915 5.484 7.039 1.00 0.00 O ATOM 722 CB VAL A 49 77.954 3.481 6.283 1.00 0.00 C ATOM 723 CG1 VAL A 49 79.278 2.841 5.865 1.00 0.00 C ATOM 724 CG2 VAL A 49 77.786 3.356 7.801 1.00 0.00 C ATOM 0 H VAL A 49 79.369 4.956 7.463 1.00 0.00 H new ATOM 0 HA VAL A 49 78.263 5.094 4.854 1.00 0.00 H new ATOM 0 HB VAL A 49 77.130 2.973 5.782 1.00 0.00 H new ATOM 0 HG11 VAL A 49 79.278 1.788 6.147 1.00 0.00 H new ATOM 0 HG12 VAL A 49 79.399 2.927 4.785 1.00 0.00 H new ATOM 0 HG13 VAL A 49 80.102 3.351 6.364 1.00 0.00 H new ATOM 0 HG21 VAL A 49 77.788 2.303 8.082 1.00 0.00 H new ATOM 0 HG22 VAL A 49 78.609 3.866 8.301 1.00 0.00 H new ATOM 0 HG23 VAL A 49 76.842 3.810 8.101 1.00 0.00 H new ATOM 734 N VAL A 50 76.101 6.153 4.958 1.00 0.00 N ATOM 735 CA VAL A 50 74.749 6.787 4.973 1.00 0.00 C ATOM 736 C VAL A 50 73.686 5.759 4.591 1.00 0.00 C ATOM 737 O VAL A 50 72.633 5.691 5.192 1.00 0.00 O ATOM 738 CB VAL A 50 74.798 7.914 3.928 1.00 0.00 C ATOM 739 CG1 VAL A 50 73.904 9.070 4.377 1.00 0.00 C ATOM 740 CG2 VAL A 50 76.229 8.430 3.770 1.00 0.00 C ATOM 0 H VAL A 50 76.605 6.236 4.075 1.00 0.00 H new ATOM 0 HA VAL A 50 74.495 7.171 5.961 1.00 0.00 H new ATOM 0 HB VAL A 50 74.448 7.519 2.974 1.00 0.00 H new ATOM 0 HG11 VAL A 50 73.940 9.868 3.635 1.00 0.00 H new ATOM 0 HG12 VAL A 50 72.878 8.717 4.481 1.00 0.00 H new ATOM 0 HG13 VAL A 50 74.256 9.451 5.336 1.00 0.00 H new ATOM 0 HG21 VAL A 50 76.248 9.227 3.027 1.00 0.00 H new ATOM 0 HG22 VAL A 50 76.584 8.816 4.726 1.00 0.00 H new ATOM 0 HG23 VAL A 50 76.876 7.615 3.445 1.00 0.00 H new ATOM 750 N ASP A 51 73.946 4.958 3.592 1.00 0.00 N ATOM 751 CA ASP A 51 72.931 3.944 3.185 1.00 0.00 C ATOM 752 C ASP A 51 73.604 2.649 2.720 1.00 0.00 C ATOM 753 O ASP A 51 74.753 2.635 2.329 1.00 0.00 O ATOM 754 CB ASP A 51 72.168 4.593 2.030 1.00 0.00 C ATOM 755 CG ASP A 51 70.688 4.216 2.121 1.00 0.00 C ATOM 756 OD1 ASP A 51 70.296 3.676 3.142 1.00 0.00 O ATOM 757 OD2 ASP A 51 69.972 4.473 1.166 1.00 0.00 O ATOM 0 H ASP A 51 74.807 4.961 3.046 1.00 0.00 H new ATOM 0 HA ASP A 51 72.277 3.671 4.013 1.00 0.00 H new ATOM 0 HB2 ASP A 51 72.281 5.676 2.068 1.00 0.00 H new ATOM 0 HB3 ASP A 51 72.580 4.263 1.077 1.00 0.00 H new ATOM 762 N VAL A 52 72.884 1.560 2.755 1.00 0.00 N ATOM 763 CA VAL A 52 73.459 0.259 2.309 1.00 0.00 C ATOM 764 C VAL A 52 72.352 -0.621 1.724 1.00 0.00 C ATOM 765 O VAL A 52 71.188 -0.454 2.033 1.00 0.00 O ATOM 766 CB VAL A 52 74.039 -0.382 3.570 1.00 0.00 C ATOM 767 CG1 VAL A 52 73.030 -0.267 4.713 1.00 0.00 C ATOM 768 CG2 VAL A 52 74.336 -1.857 3.292 1.00 0.00 C ATOM 0 H VAL A 52 71.917 1.516 3.075 1.00 0.00 H new ATOM 0 HA VAL A 52 74.218 0.385 1.537 1.00 0.00 H new ATOM 0 HB VAL A 52 74.959 0.129 3.852 1.00 0.00 H new ATOM 0 HG11 VAL A 52 73.444 -0.724 5.612 1.00 0.00 H new ATOM 0 HG12 VAL A 52 72.817 0.784 4.906 1.00 0.00 H new ATOM 0 HG13 VAL A 52 72.108 -0.779 4.437 1.00 0.00 H new ATOM 0 HG21 VAL A 52 74.750 -2.320 4.188 1.00 0.00 H new ATOM 0 HG22 VAL A 52 73.414 -2.367 3.013 1.00 0.00 H new ATOM 0 HG23 VAL A 52 75.056 -1.936 2.477 1.00 0.00 H new ATOM 778 N ARG A 53 72.700 -1.557 0.886 1.00 0.00 N ATOM 779 CA ARG A 53 71.659 -2.442 0.288 1.00 0.00 C ATOM 780 C ARG A 53 72.313 -3.665 -0.355 1.00 0.00 C ATOM 781 O ARG A 53 73.509 -3.706 -0.559 1.00 0.00 O ATOM 782 CB ARG A 53 70.969 -1.585 -0.773 1.00 0.00 C ATOM 783 CG ARG A 53 69.557 -2.120 -1.020 1.00 0.00 C ATOM 784 CD ARG A 53 69.558 -3.013 -2.263 1.00 0.00 C ATOM 785 NE ARG A 53 69.287 -2.090 -3.400 1.00 0.00 N ATOM 786 CZ ARG A 53 68.188 -2.213 -4.093 1.00 0.00 C ATOM 787 NH1 ARG A 53 67.072 -2.529 -3.496 1.00 0.00 N ATOM 788 NH2 ARG A 53 68.205 -2.020 -5.384 1.00 0.00 N ATOM 0 H ARG A 53 73.657 -1.748 0.589 1.00 0.00 H new ATOM 0 HA ARG A 53 70.955 -2.812 1.033 1.00 0.00 H new ATOM 0 HB2 ARG A 53 70.924 -0.547 -0.444 1.00 0.00 H new ATOM 0 HB3 ARG A 53 71.543 -1.602 -1.699 1.00 0.00 H new ATOM 0 HG2 ARG A 53 69.215 -2.686 -0.153 1.00 0.00 H new ATOM 0 HG3 ARG A 53 68.862 -1.292 -1.155 1.00 0.00 H new ATOM 0 HD2 ARG A 53 70.516 -3.519 -2.385 1.00 0.00 H new ATOM 0 HD3 ARG A 53 68.795 -3.788 -2.193 1.00 0.00 H new ATOM 0 HE ARG A 53 69.960 -1.362 -3.637 1.00 0.00 H new ATOM 0 HH11 ARG A 53 67.058 -2.680 -2.487 1.00 0.00 H new ATOM 0 HH12 ARG A 53 66.213 -2.625 -4.038 1.00 0.00 H new ATOM 0 HH21 ARG A 53 69.077 -1.773 -5.851 1.00 0.00 H new ATOM 0 HH22 ARG A 53 67.346 -2.116 -5.925 1.00 0.00 H new ATOM 802 N THR A 54 71.536 -4.663 -0.669 1.00 0.00 N ATOM 803 CA THR A 54 72.101 -5.886 -1.291 1.00 0.00 C ATOM 804 C THR A 54 72.341 -5.660 -2.787 1.00 0.00 C ATOM 805 O THR A 54 72.070 -4.600 -3.315 1.00 0.00 O ATOM 806 CB THR A 54 71.028 -6.952 -1.073 1.00 0.00 C ATOM 807 OG1 THR A 54 69.964 -6.749 -1.993 1.00 0.00 O ATOM 808 CG2 THR A 54 70.493 -6.862 0.358 1.00 0.00 C ATOM 0 H THR A 54 70.527 -4.681 -0.519 1.00 0.00 H new ATOM 0 HA THR A 54 73.061 -6.170 -0.861 1.00 0.00 H new ATOM 0 HB THR A 54 71.463 -7.939 -1.232 1.00 0.00 H new ATOM 0 HG1 THR A 54 69.277 -7.434 -1.854 1.00 0.00 H new ATOM 0 HG21 THR A 54 69.728 -7.624 0.509 1.00 0.00 H new ATOM 0 HG22 THR A 54 71.309 -7.023 1.062 1.00 0.00 H new ATOM 0 HG23 THR A 54 70.060 -5.875 0.523 1.00 0.00 H new ATOM 816 N GLY A 55 72.848 -6.648 -3.471 1.00 0.00 N ATOM 817 CA GLY A 55 73.107 -6.490 -4.931 1.00 0.00 C ATOM 818 C GLY A 55 72.778 -7.795 -5.657 1.00 0.00 C ATOM 819 O GLY A 55 73.136 -8.870 -5.216 1.00 0.00 O ATOM 0 H GLY A 55 73.094 -7.558 -3.083 1.00 0.00 H new ATOM 0 HA2 GLY A 55 72.501 -5.677 -5.332 1.00 0.00 H new ATOM 0 HA3 GLY A 55 74.150 -6.223 -5.098 1.00 0.00 H new ATOM 823 N THR A 56 72.097 -7.702 -6.767 1.00 0.00 N ATOM 824 CA THR A 56 71.734 -8.927 -7.538 1.00 0.00 C ATOM 825 C THR A 56 70.888 -9.869 -6.678 1.00 0.00 C ATOM 826 O THR A 56 69.676 -9.868 -6.754 1.00 0.00 O ATOM 827 CB THR A 56 73.069 -9.575 -7.911 1.00 0.00 C ATOM 828 OG1 THR A 56 73.818 -8.672 -8.713 1.00 0.00 O ATOM 829 CG2 THR A 56 72.810 -10.862 -8.695 1.00 0.00 C ATOM 0 H THR A 56 71.774 -6.825 -7.176 1.00 0.00 H new ATOM 0 HA THR A 56 71.138 -8.696 -8.421 1.00 0.00 H new ATOM 0 HB THR A 56 73.628 -9.811 -7.006 1.00 0.00 H new ATOM 0 HG1 THR A 56 74.766 -8.731 -8.474 1.00 0.00 H new ATOM 0 HG21 THR A 56 73.761 -11.324 -8.961 1.00 0.00 H new ATOM 0 HG22 THR A 56 72.231 -11.552 -8.081 1.00 0.00 H new ATOM 0 HG23 THR A 56 72.253 -10.629 -9.603 1.00 0.00 H new ATOM 837 N ASN A 57 71.511 -10.677 -5.863 1.00 0.00 N ATOM 838 CA ASN A 57 70.724 -11.614 -5.010 1.00 0.00 C ATOM 839 C ASN A 57 71.572 -12.121 -3.841 1.00 0.00 C ATOM 840 O ASN A 57 72.335 -13.058 -3.975 1.00 0.00 O ATOM 841 CB ASN A 57 70.344 -12.768 -5.937 1.00 0.00 C ATOM 842 CG ASN A 57 68.831 -12.762 -6.166 1.00 0.00 C ATOM 843 OD1 ASN A 57 68.087 -12.213 -5.378 1.00 0.00 O ATOM 844 ND2 ASN A 57 68.341 -13.355 -7.221 1.00 0.00 N ATOM 0 H ASN A 57 72.523 -10.729 -5.751 1.00 0.00 H new ATOM 0 HA ASN A 57 69.849 -11.132 -4.574 1.00 0.00 H new ATOM 0 HB2 ASN A 57 70.867 -12.671 -6.889 1.00 0.00 H new ATOM 0 HB3 ASN A 57 70.652 -13.717 -5.499 1.00 0.00 H new ATOM 0 HD21 ASN A 57 67.334 -13.357 -7.383 1.00 0.00 H new ATOM 0 HD22 ASN A 57 68.965 -13.816 -7.883 1.00 0.00 H new ATOM 851 N ARG A 58 71.439 -11.515 -2.693 1.00 0.00 N ATOM 852 CA ARG A 58 72.228 -11.968 -1.511 1.00 0.00 C ATOM 853 C ARG A 58 73.673 -12.268 -1.910 1.00 0.00 C ATOM 854 O ARG A 58 74.341 -13.071 -1.291 1.00 0.00 O ATOM 855 CB ARG A 58 71.532 -13.243 -1.042 1.00 0.00 C ATOM 856 CG ARG A 58 71.355 -13.202 0.476 1.00 0.00 C ATOM 857 CD ARG A 58 71.228 -14.629 1.015 1.00 0.00 C ATOM 858 NE ARG A 58 70.338 -14.513 2.202 1.00 0.00 N ATOM 859 CZ ARG A 58 69.288 -15.282 2.307 1.00 0.00 C ATOM 860 NH1 ARG A 58 69.404 -16.571 2.138 1.00 0.00 N ATOM 861 NH2 ARG A 58 68.123 -14.761 2.583 1.00 0.00 N ATOM 0 H ARG A 58 70.817 -10.725 -2.522 1.00 0.00 H new ATOM 0 HA ARG A 58 72.270 -11.207 -0.731 1.00 0.00 H new ATOM 0 HB2 ARG A 58 70.562 -13.340 -1.529 1.00 0.00 H new ATOM 0 HB3 ARG A 58 72.120 -14.116 -1.326 1.00 0.00 H new ATOM 0 HG2 ARG A 58 72.206 -12.702 0.938 1.00 0.00 H new ATOM 0 HG3 ARG A 58 70.467 -12.624 0.734 1.00 0.00 H new ATOM 0 HD2 ARG A 58 70.803 -15.298 0.266 1.00 0.00 H new ATOM 0 HD3 ARG A 58 72.201 -15.036 1.289 1.00 0.00 H new ATOM 0 HE ARG A 58 70.548 -13.833 2.933 1.00 0.00 H new ATOM 0 HH11 ARG A 58 70.315 -16.977 1.924 1.00 0.00 H new ATOM 0 HH12 ARG A 58 68.584 -17.172 2.220 1.00 0.00 H new ATOM 0 HH21 ARG A 58 68.033 -13.754 2.716 1.00 0.00 H new ATOM 0 HH22 ARG A 58 67.302 -15.361 2.665 1.00 0.00 H new ATOM 875 N LYS A 59 74.164 -11.632 -2.936 1.00 0.00 N ATOM 876 CA LYS A 59 75.568 -11.892 -3.359 1.00 0.00 C ATOM 877 C LYS A 59 76.389 -10.604 -3.281 1.00 0.00 C ATOM 878 O LYS A 59 77.567 -10.624 -2.987 1.00 0.00 O ATOM 879 CB LYS A 59 75.466 -12.382 -4.804 1.00 0.00 C ATOM 880 CG LYS A 59 75.998 -13.814 -4.896 1.00 0.00 C ATOM 881 CD LYS A 59 74.823 -14.789 -4.988 1.00 0.00 C ATOM 882 CE LYS A 59 74.106 -14.602 -6.327 1.00 0.00 C ATOM 883 NZ LYS A 59 74.933 -15.354 -7.312 1.00 0.00 N ATOM 0 H LYS A 59 73.658 -10.947 -3.497 1.00 0.00 H new ATOM 0 HA LYS A 59 76.064 -12.622 -2.719 1.00 0.00 H new ATOM 0 HB2 LYS A 59 74.429 -12.346 -5.139 1.00 0.00 H new ATOM 0 HB3 LYS A 59 76.037 -11.727 -5.462 1.00 0.00 H new ATOM 0 HG2 LYS A 59 76.641 -13.919 -5.770 1.00 0.00 H new ATOM 0 HG3 LYS A 59 76.608 -14.044 -4.022 1.00 0.00 H new ATOM 0 HD2 LYS A 59 75.180 -15.815 -4.895 1.00 0.00 H new ATOM 0 HD3 LYS A 59 74.129 -14.617 -4.165 1.00 0.00 H new ATOM 0 HE2 LYS A 59 73.088 -14.990 -6.288 1.00 0.00 H new ATOM 0 HE3 LYS A 59 74.035 -13.547 -6.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 75.105 -14.759 -8.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 75.842 -15.611 -6.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 74.430 -16.218 -7.600 1.00 0.00 H new ATOM 897 N PHE A 60 75.775 -9.483 -3.539 1.00 0.00 N ATOM 898 CA PHE A 60 76.526 -8.193 -3.473 1.00 0.00 C ATOM 899 C PHE A 60 75.760 -7.197 -2.602 1.00 0.00 C ATOM 900 O PHE A 60 74.683 -7.486 -2.118 1.00 0.00 O ATOM 901 CB PHE A 60 76.619 -7.682 -4.916 1.00 0.00 C ATOM 902 CG PHE A 60 76.751 -8.844 -5.873 1.00 0.00 C ATOM 903 CD1 PHE A 60 77.802 -9.754 -5.726 1.00 0.00 C ATOM 904 CD2 PHE A 60 75.820 -9.009 -6.904 1.00 0.00 C ATOM 905 CE1 PHE A 60 77.922 -10.832 -6.610 1.00 0.00 C ATOM 906 CE2 PHE A 60 75.939 -10.086 -7.789 1.00 0.00 C ATOM 907 CZ PHE A 60 76.990 -10.997 -7.642 1.00 0.00 C ATOM 0 H PHE A 60 74.790 -9.402 -3.792 1.00 0.00 H new ATOM 0 HA PHE A 60 77.517 -8.320 -3.037 1.00 0.00 H new ATOM 0 HB2 PHE A 60 75.731 -7.099 -5.161 1.00 0.00 H new ATOM 0 HB3 PHE A 60 77.476 -7.017 -5.020 1.00 0.00 H new ATOM 0 HD1 PHE A 60 78.521 -9.625 -4.931 1.00 0.00 H new ATOM 0 HD2 PHE A 60 75.009 -8.305 -7.017 1.00 0.00 H new ATOM 0 HE1 PHE A 60 78.733 -11.536 -6.496 1.00 0.00 H new ATOM 0 HE2 PHE A 60 75.220 -10.214 -8.585 1.00 0.00 H new ATOM 0 HZ PHE A 60 77.083 -11.828 -8.325 1.00 0.00 H new ATOM 917 N GLY A 61 76.302 -6.031 -2.392 1.00 0.00 N ATOM 918 CA GLY A 61 75.592 -5.033 -1.547 1.00 0.00 C ATOM 919 C GLY A 61 76.010 -3.617 -1.944 1.00 0.00 C ATOM 920 O GLY A 61 77.180 -3.303 -2.020 1.00 0.00 O ATOM 0 H GLY A 61 77.201 -5.727 -2.767 1.00 0.00 H new ATOM 0 HA2 GLY A 61 74.514 -5.148 -1.662 1.00 0.00 H new ATOM 0 HA3 GLY A 61 75.821 -5.207 -0.495 1.00 0.00 H new ATOM 924 N TYR A 62 75.060 -2.756 -2.187 1.00 0.00 N ATOM 925 CA TYR A 62 75.401 -1.353 -2.565 1.00 0.00 C ATOM 926 C TYR A 62 75.436 -0.482 -1.319 1.00 0.00 C ATOM 927 O TYR A 62 74.955 -0.862 -0.271 1.00 0.00 O ATOM 928 CB TYR A 62 74.283 -0.910 -3.511 1.00 0.00 C ATOM 929 CG TYR A 62 74.633 0.427 -4.121 1.00 0.00 C ATOM 930 CD1 TYR A 62 74.464 1.602 -3.378 1.00 0.00 C ATOM 931 CD2 TYR A 62 75.127 0.491 -5.429 1.00 0.00 C ATOM 932 CE1 TYR A 62 74.787 2.840 -3.944 1.00 0.00 C ATOM 933 CE2 TYR A 62 75.452 1.730 -5.995 1.00 0.00 C ATOM 934 CZ TYR A 62 75.282 2.905 -5.252 1.00 0.00 C ATOM 935 OH TYR A 62 75.601 4.126 -5.810 1.00 0.00 O ATOM 0 H TYR A 62 74.062 -2.962 -2.140 1.00 0.00 H new ATOM 0 HA TYR A 62 76.379 -1.272 -3.040 1.00 0.00 H new ATOM 0 HB2 TYR A 62 74.142 -1.653 -4.296 1.00 0.00 H new ATOM 0 HB3 TYR A 62 73.341 -0.837 -2.968 1.00 0.00 H new ATOM 0 HD1 TYR A 62 74.084 1.552 -2.368 1.00 0.00 H new ATOM 0 HD2 TYR A 62 75.258 -0.415 -6.002 1.00 0.00 H new ATOM 0 HE1 TYR A 62 74.654 3.746 -3.372 1.00 0.00 H new ATOM 0 HE2 TYR A 62 75.834 1.779 -7.004 1.00 0.00 H new ATOM 0 HH TYR A 62 75.931 3.992 -6.723 1.00 0.00 H new ATOM 945 N VAL A 63 76.020 0.673 -1.415 1.00 0.00 N ATOM 946 CA VAL A 63 76.103 1.546 -0.220 1.00 0.00 C ATOM 947 C VAL A 63 76.307 3.005 -0.625 1.00 0.00 C ATOM 948 O VAL A 63 76.750 3.309 -1.714 1.00 0.00 O ATOM 949 CB VAL A 63 77.318 1.019 0.535 1.00 0.00 C ATOM 950 CG1 VAL A 63 77.754 2.039 1.575 1.00 0.00 C ATOM 951 CG2 VAL A 63 76.962 -0.297 1.232 1.00 0.00 C ATOM 0 H VAL A 63 76.442 1.049 -2.264 1.00 0.00 H new ATOM 0 HA VAL A 63 75.193 1.525 0.379 1.00 0.00 H new ATOM 0 HB VAL A 63 78.131 0.847 -0.170 1.00 0.00 H new ATOM 0 HG11 VAL A 63 78.623 1.661 2.114 1.00 0.00 H new ATOM 0 HG12 VAL A 63 78.013 2.975 1.080 1.00 0.00 H new ATOM 0 HG13 VAL A 63 76.939 2.214 2.277 1.00 0.00 H new ATOM 0 HG21 VAL A 63 77.833 -0.671 1.771 1.00 0.00 H new ATOM 0 HG22 VAL A 63 76.146 -0.127 1.935 1.00 0.00 H new ATOM 0 HG23 VAL A 63 76.653 -1.031 0.488 1.00 0.00 H new ATOM 961 N ASP A 64 75.988 3.907 0.258 1.00 0.00 N ATOM 962 CA ASP A 64 76.156 5.351 -0.042 1.00 0.00 C ATOM 963 C ASP A 64 76.993 6.008 1.055 1.00 0.00 C ATOM 964 O ASP A 64 76.819 5.734 2.228 1.00 0.00 O ATOM 965 CB ASP A 64 74.742 5.916 -0.036 1.00 0.00 C ATOM 966 CG ASP A 64 73.834 5.043 -0.906 1.00 0.00 C ATOM 967 OD1 ASP A 64 73.726 3.862 -0.619 1.00 0.00 O ATOM 968 OD2 ASP A 64 73.260 5.571 -1.845 1.00 0.00 O ATOM 0 H ASP A 64 75.614 3.701 1.184 1.00 0.00 H new ATOM 0 HA ASP A 64 76.663 5.527 -0.990 1.00 0.00 H new ATOM 0 HB2 ASP A 64 74.359 5.953 0.984 1.00 0.00 H new ATOM 0 HB3 ASP A 64 74.747 6.939 -0.411 1.00 0.00 H new ATOM 973 N PHE A 65 77.897 6.869 0.680 1.00 0.00 N ATOM 974 CA PHE A 65 78.755 7.546 1.692 1.00 0.00 C ATOM 975 C PHE A 65 78.269 8.976 1.928 1.00 0.00 C ATOM 976 O PHE A 65 77.343 9.441 1.294 1.00 0.00 O ATOM 977 CB PHE A 65 80.157 7.522 1.092 1.00 0.00 C ATOM 978 CG PHE A 65 80.700 6.118 1.200 1.00 0.00 C ATOM 979 CD1 PHE A 65 80.702 5.468 2.441 1.00 0.00 C ATOM 980 CD2 PHE A 65 81.187 5.460 0.065 1.00 0.00 C ATOM 981 CE1 PHE A 65 81.192 4.163 2.547 1.00 0.00 C ATOM 982 CE2 PHE A 65 81.677 4.153 0.171 1.00 0.00 C ATOM 983 CZ PHE A 65 81.679 3.504 1.413 1.00 0.00 C ATOM 0 H PHE A 65 78.079 7.134 -0.288 1.00 0.00 H new ATOM 0 HA PHE A 65 78.728 7.054 2.664 1.00 0.00 H new ATOM 0 HB2 PHE A 65 80.128 7.838 0.049 1.00 0.00 H new ATOM 0 HB3 PHE A 65 80.807 8.221 1.619 1.00 0.00 H new ATOM 0 HD1 PHE A 65 80.325 5.975 3.317 1.00 0.00 H new ATOM 0 HD2 PHE A 65 81.185 5.960 -0.892 1.00 0.00 H new ATOM 0 HE1 PHE A 65 81.195 3.663 3.505 1.00 0.00 H new ATOM 0 HE2 PHE A 65 82.054 3.645 -0.704 1.00 0.00 H new ATOM 0 HZ PHE A 65 82.056 2.495 1.495 1.00 0.00 H new ATOM 993 N GLU A 66 78.864 9.665 2.859 1.00 0.00 N ATOM 994 CA GLU A 66 78.405 11.050 3.158 1.00 0.00 C ATOM 995 C GLU A 66 79.509 12.074 2.905 1.00 0.00 C ATOM 996 O GLU A 66 79.420 13.209 3.330 1.00 0.00 O ATOM 997 CB GLU A 66 78.031 11.021 4.640 1.00 0.00 C ATOM 998 CG GLU A 66 79.290 10.806 5.484 1.00 0.00 C ATOM 999 CD GLU A 66 79.155 11.570 6.802 1.00 0.00 C ATOM 1000 OE1 GLU A 66 78.032 11.824 7.206 1.00 0.00 O ATOM 1001 OE2 GLU A 66 80.178 11.889 7.386 1.00 0.00 O ATOM 0 H GLU A 66 79.645 9.332 3.424 1.00 0.00 H new ATOM 0 HA GLU A 66 77.572 11.345 2.520 1.00 0.00 H new ATOM 0 HB2 GLU A 66 77.548 11.956 4.922 1.00 0.00 H new ATOM 0 HB3 GLU A 66 77.314 10.222 4.829 1.00 0.00 H new ATOM 0 HG2 GLU A 66 79.433 9.743 5.680 1.00 0.00 H new ATOM 0 HG3 GLU A 66 80.169 11.151 4.940 1.00 0.00 H new ATOM 1008 N SER A 67 80.546 11.698 2.217 1.00 0.00 N ATOM 1009 CA SER A 67 81.639 12.683 1.950 1.00 0.00 C ATOM 1010 C SER A 67 82.680 12.137 0.989 1.00 0.00 C ATOM 1011 O SER A 67 82.682 10.977 0.624 1.00 0.00 O ATOM 1012 CB SER A 67 82.293 12.948 3.302 1.00 0.00 C ATOM 1013 OG SER A 67 82.470 11.718 3.993 1.00 0.00 O ATOM 0 H SER A 67 80.689 10.765 1.830 1.00 0.00 H new ATOM 0 HA SER A 67 81.230 13.583 1.490 1.00 0.00 H new ATOM 0 HB2 SER A 67 83.255 13.440 3.162 1.00 0.00 H new ATOM 0 HB3 SER A 67 81.673 13.623 3.892 1.00 0.00 H new ATOM 0 HG SER A 67 82.892 11.888 4.861 1.00 0.00 H new ATOM 1019 N ALA A 68 83.593 12.982 0.615 1.00 0.00 N ATOM 1020 CA ALA A 68 84.692 12.563 -0.287 1.00 0.00 C ATOM 1021 C ALA A 68 85.720 11.836 0.556 1.00 0.00 C ATOM 1022 O ALA A 68 86.491 11.025 0.084 1.00 0.00 O ATOM 1023 CB ALA A 68 85.276 13.870 -0.809 1.00 0.00 C ATOM 0 H ALA A 68 83.624 13.961 0.901 1.00 0.00 H new ATOM 0 HA ALA A 68 84.375 11.910 -1.100 1.00 0.00 H new ATOM 0 HB1 ALA A 68 86.101 13.654 -1.488 1.00 0.00 H new ATOM 0 HB2 ALA A 68 84.504 14.427 -1.340 1.00 0.00 H new ATOM 0 HB3 ALA A 68 85.642 14.465 0.028 1.00 0.00 H new ATOM 1029 N GLU A 69 85.716 12.137 1.819 1.00 0.00 N ATOM 1030 CA GLU A 69 86.662 11.493 2.752 1.00 0.00 C ATOM 1031 C GLU A 69 86.085 10.150 3.197 1.00 0.00 C ATOM 1032 O GLU A 69 86.804 9.229 3.537 1.00 0.00 O ATOM 1033 CB GLU A 69 86.752 12.476 3.912 1.00 0.00 C ATOM 1034 CG GLU A 69 88.212 12.646 4.323 1.00 0.00 C ATOM 1035 CD GLU A 69 88.414 12.107 5.741 1.00 0.00 C ATOM 1036 OE1 GLU A 69 87.674 12.517 6.620 1.00 0.00 O ATOM 1037 OE2 GLU A 69 89.304 11.293 5.923 1.00 0.00 O ATOM 0 H GLU A 69 85.085 12.814 2.248 1.00 0.00 H new ATOM 0 HA GLU A 69 87.642 11.286 2.322 1.00 0.00 H new ATOM 0 HB2 GLU A 69 86.331 13.438 3.621 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.165 12.114 4.756 1.00 0.00 H new ATOM 0 HG2 GLU A 69 88.860 12.115 3.626 1.00 0.00 H new ATOM 0 HG3 GLU A 69 88.492 13.699 4.280 1.00 0.00 H new ATOM 1044 N ASP A 70 84.786 10.024 3.156 1.00 0.00 N ATOM 1045 CA ASP A 70 84.151 8.741 3.532 1.00 0.00 C ATOM 1046 C ASP A 70 84.221 7.828 2.320 1.00 0.00 C ATOM 1047 O ASP A 70 84.243 6.617 2.426 1.00 0.00 O ATOM 1048 CB ASP A 70 82.706 9.104 3.871 1.00 0.00 C ATOM 1049 CG ASP A 70 81.827 7.856 3.819 1.00 0.00 C ATOM 1050 OD1 ASP A 70 82.368 6.767 3.904 1.00 0.00 O ATOM 1051 OD2 ASP A 70 80.623 8.016 3.696 1.00 0.00 O ATOM 0 H ASP A 70 84.139 10.762 2.876 1.00 0.00 H new ATOM 0 HA ASP A 70 84.626 8.232 4.371 1.00 0.00 H new ATOM 0 HB2 ASP A 70 82.658 9.551 4.864 1.00 0.00 H new ATOM 0 HB3 ASP A 70 82.335 9.849 3.168 1.00 0.00 H new ATOM 1056 N LEU A 71 84.287 8.422 1.160 1.00 0.00 N ATOM 1057 CA LEU A 71 84.390 7.620 -0.079 1.00 0.00 C ATOM 1058 C LEU A 71 85.849 7.215 -0.284 1.00 0.00 C ATOM 1059 O LEU A 71 86.149 6.144 -0.776 1.00 0.00 O ATOM 1060 CB LEU A 71 83.915 8.548 -1.201 1.00 0.00 C ATOM 1061 CG LEU A 71 84.049 7.847 -2.557 1.00 0.00 C ATOM 1062 CD1 LEU A 71 85.515 7.844 -2.994 1.00 0.00 C ATOM 1063 CD2 LEU A 71 83.550 6.403 -2.445 1.00 0.00 C ATOM 0 H LEU A 71 84.274 9.433 1.023 1.00 0.00 H new ATOM 0 HA LEU A 71 83.795 6.707 -0.049 1.00 0.00 H new ATOM 0 HB2 LEU A 71 82.877 8.834 -1.032 1.00 0.00 H new ATOM 0 HB3 LEU A 71 84.503 9.466 -1.198 1.00 0.00 H new ATOM 0 HG LEU A 71 83.451 8.382 -3.295 1.00 0.00 H new ATOM 0 HD11 LEU A 71 85.606 7.345 -3.959 1.00 0.00 H new ATOM 0 HD12 LEU A 71 85.871 8.871 -3.082 1.00 0.00 H new ATOM 0 HD13 LEU A 71 86.114 7.315 -2.253 1.00 0.00 H new ATOM 0 HD21 LEU A 71 83.647 5.908 -3.411 1.00 0.00 H new ATOM 0 HD22 LEU A 71 84.144 5.869 -1.703 1.00 0.00 H new ATOM 0 HD23 LEU A 71 82.503 6.402 -2.141 1.00 0.00 H new ATOM 1075 N GLU A 72 86.761 8.065 0.110 1.00 0.00 N ATOM 1076 CA GLU A 72 88.207 7.737 -0.037 1.00 0.00 C ATOM 1077 C GLU A 72 88.583 6.644 0.962 1.00 0.00 C ATOM 1078 O GLU A 72 89.389 5.774 0.681 1.00 0.00 O ATOM 1079 CB GLU A 72 88.946 9.038 0.279 1.00 0.00 C ATOM 1080 CG GLU A 72 89.550 9.609 -1.004 1.00 0.00 C ATOM 1081 CD GLU A 72 90.983 10.071 -0.733 1.00 0.00 C ATOM 1082 OE1 GLU A 72 91.875 9.241 -0.799 1.00 0.00 O ATOM 1083 OE2 GLU A 72 91.164 11.247 -0.463 1.00 0.00 O ATOM 0 H GLU A 72 86.564 8.974 0.528 1.00 0.00 H new ATOM 0 HA GLU A 72 88.457 7.368 -1.032 1.00 0.00 H new ATOM 0 HB2 GLU A 72 88.260 9.759 0.722 1.00 0.00 H new ATOM 0 HB3 GLU A 72 89.731 8.853 1.012 1.00 0.00 H new ATOM 0 HG2 GLU A 72 89.543 8.853 -1.789 1.00 0.00 H new ATOM 0 HG3 GLU A 72 88.949 10.445 -1.361 1.00 0.00 H new ATOM 1090 N LYS A 73 87.977 6.654 2.121 1.00 0.00 N ATOM 1091 CA LYS A 73 88.277 5.596 3.109 1.00 0.00 C ATOM 1092 C LYS A 73 87.535 4.355 2.662 1.00 0.00 C ATOM 1093 O LYS A 73 87.952 3.236 2.889 1.00 0.00 O ATOM 1094 CB LYS A 73 87.736 6.112 4.442 1.00 0.00 C ATOM 1095 CG LYS A 73 88.901 6.379 5.397 1.00 0.00 C ATOM 1096 CD LYS A 73 88.408 7.204 6.586 1.00 0.00 C ATOM 1097 CE LYS A 73 89.423 8.307 6.899 1.00 0.00 C ATOM 1098 NZ LYS A 73 90.273 7.749 7.988 1.00 0.00 N ATOM 0 H LYS A 73 87.292 7.349 2.418 1.00 0.00 H new ATOM 0 HA LYS A 73 89.337 5.360 3.202 1.00 0.00 H new ATOM 0 HB2 LYS A 73 87.164 7.026 4.285 1.00 0.00 H new ATOM 0 HB3 LYS A 73 87.055 5.381 4.878 1.00 0.00 H new ATOM 0 HG2 LYS A 73 89.323 5.436 5.745 1.00 0.00 H new ATOM 0 HG3 LYS A 73 89.697 6.912 4.876 1.00 0.00 H new ATOM 0 HD2 LYS A 73 87.436 7.643 6.360 1.00 0.00 H new ATOM 0 HD3 LYS A 73 88.273 6.562 7.456 1.00 0.00 H new ATOM 0 HE2 LYS A 73 90.019 8.556 6.021 1.00 0.00 H new ATOM 0 HE3 LYS A 73 88.925 9.223 7.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 90.994 8.448 8.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 89.679 7.528 8.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 90.739 6.881 7.654 1.00 0.00 H new ATOM 1112 N ALA A 74 86.438 4.560 1.989 1.00 0.00 N ATOM 1113 CA ALA A 74 85.663 3.413 1.483 1.00 0.00 C ATOM 1114 C ALA A 74 86.483 2.707 0.406 1.00 0.00 C ATOM 1115 O ALA A 74 86.358 1.519 0.185 1.00 0.00 O ATOM 1116 CB ALA A 74 84.388 4.013 0.895 1.00 0.00 C ATOM 0 H ALA A 74 86.050 5.478 1.771 1.00 0.00 H new ATOM 0 HA ALA A 74 85.427 2.681 2.255 1.00 0.00 H new ATOM 0 HB1 ALA A 74 83.760 3.215 0.498 1.00 0.00 H new ATOM 0 HB2 ALA A 74 83.845 4.549 1.674 1.00 0.00 H new ATOM 0 HB3 ALA A 74 84.647 4.704 0.093 1.00 0.00 H new ATOM 1122 N LEU A 75 87.344 3.440 -0.250 1.00 0.00 N ATOM 1123 CA LEU A 75 88.204 2.832 -1.293 1.00 0.00 C ATOM 1124 C LEU A 75 89.271 1.996 -0.602 1.00 0.00 C ATOM 1125 O LEU A 75 89.488 0.846 -0.929 1.00 0.00 O ATOM 1126 CB LEU A 75 88.830 4.019 -2.025 1.00 0.00 C ATOM 1127 CG LEU A 75 89.079 3.649 -3.485 1.00 0.00 C ATOM 1128 CD1 LEU A 75 90.141 2.551 -3.559 1.00 0.00 C ATOM 1129 CD2 LEU A 75 87.779 3.146 -4.113 1.00 0.00 C ATOM 0 H LEU A 75 87.485 4.439 -0.103 1.00 0.00 H new ATOM 0 HA LEU A 75 87.664 2.184 -1.984 1.00 0.00 H new ATOM 0 HB2 LEU A 75 88.170 4.884 -1.966 1.00 0.00 H new ATOM 0 HB3 LEU A 75 89.768 4.301 -1.546 1.00 0.00 H new ATOM 0 HG LEU A 75 89.427 4.528 -4.028 1.00 0.00 H new ATOM 0 HD11 LEU A 75 90.319 2.287 -4.601 1.00 0.00 H new ATOM 0 HD12 LEU A 75 91.068 2.911 -3.113 1.00 0.00 H new ATOM 0 HD13 LEU A 75 89.794 1.672 -3.016 1.00 0.00 H new ATOM 0 HD21 LEU A 75 87.957 2.882 -5.155 1.00 0.00 H new ATOM 0 HD22 LEU A 75 87.429 2.268 -3.571 1.00 0.00 H new ATOM 0 HD23 LEU A 75 87.023 3.929 -4.061 1.00 0.00 H new ATOM 1141 N GLU A 76 89.923 2.562 0.377 1.00 0.00 N ATOM 1142 CA GLU A 76 90.953 1.792 1.115 1.00 0.00 C ATOM 1143 C GLU A 76 90.267 0.776 2.027 1.00 0.00 C ATOM 1144 O GLU A 76 90.908 -0.018 2.686 1.00 0.00 O ATOM 1145 CB GLU A 76 91.706 2.825 1.944 1.00 0.00 C ATOM 1146 CG GLU A 76 93.108 3.026 1.367 1.00 0.00 C ATOM 1147 CD GLU A 76 93.000 3.518 -0.078 1.00 0.00 C ATOM 1148 OE1 GLU A 76 92.325 4.510 -0.296 1.00 0.00 O ATOM 1149 OE2 GLU A 76 93.592 2.893 -0.942 1.00 0.00 O ATOM 0 H GLU A 76 89.785 3.522 0.694 1.00 0.00 H new ATOM 0 HA GLU A 76 91.622 1.243 0.452 1.00 0.00 H new ATOM 0 HB2 GLU A 76 91.164 3.770 1.945 1.00 0.00 H new ATOM 0 HB3 GLU A 76 91.773 2.495 2.981 1.00 0.00 H new ATOM 0 HG2 GLU A 76 93.660 3.749 1.968 1.00 0.00 H new ATOM 0 HG3 GLU A 76 93.665 2.090 1.403 1.00 0.00 H new ATOM 1156 N LEU A 77 88.959 0.800 2.068 1.00 0.00 N ATOM 1157 CA LEU A 77 88.219 -0.158 2.933 1.00 0.00 C ATOM 1158 C LEU A 77 88.192 -1.549 2.291 1.00 0.00 C ATOM 1159 O LEU A 77 87.511 -2.441 2.756 1.00 0.00 O ATOM 1160 CB LEU A 77 86.802 0.412 3.031 1.00 0.00 C ATOM 1161 CG LEU A 77 86.459 0.696 4.495 1.00 0.00 C ATOM 1162 CD1 LEU A 77 86.848 -0.507 5.357 1.00 0.00 C ATOM 1163 CD2 LEU A 77 87.227 1.931 4.971 1.00 0.00 C ATOM 0 H LEU A 77 88.373 1.445 1.537 1.00 0.00 H new ATOM 0 HA LEU A 77 88.685 -0.271 3.912 1.00 0.00 H new ATOM 0 HB2 LEU A 77 86.727 1.329 2.446 1.00 0.00 H new ATOM 0 HB3 LEU A 77 86.086 -0.294 2.610 1.00 0.00 H new ATOM 0 HG LEU A 77 85.388 0.876 4.585 1.00 0.00 H new ATOM 0 HD11 LEU A 77 86.603 -0.302 6.399 1.00 0.00 H new ATOM 0 HD12 LEU A 77 86.300 -1.387 5.021 1.00 0.00 H new ATOM 0 HD13 LEU A 77 87.919 -0.689 5.265 1.00 0.00 H new ATOM 0 HD21 LEU A 77 86.982 2.132 6.014 1.00 0.00 H new ATOM 0 HD22 LEU A 77 88.298 1.752 4.878 1.00 0.00 H new ATOM 0 HD23 LEU A 77 86.949 2.790 4.361 1.00 0.00 H new ATOM 1175 N THR A 78 88.932 -1.747 1.229 1.00 0.00 N ATOM 1176 CA THR A 78 88.942 -3.086 0.576 1.00 0.00 C ATOM 1177 C THR A 78 89.534 -4.127 1.519 1.00 0.00 C ATOM 1178 O THR A 78 89.486 -5.315 1.269 1.00 0.00 O ATOM 1179 CB THR A 78 89.809 -2.922 -0.673 1.00 0.00 C ATOM 1180 OG1 THR A 78 89.075 -2.221 -1.668 1.00 0.00 O ATOM 1181 CG2 THR A 78 90.205 -4.300 -1.207 1.00 0.00 C ATOM 0 H THR A 78 89.525 -1.043 0.790 1.00 0.00 H new ATOM 0 HA THR A 78 87.939 -3.428 0.322 1.00 0.00 H new ATOM 0 HB THR A 78 90.708 -2.361 -0.420 1.00 0.00 H new ATOM 0 HG1 THR A 78 89.162 -1.256 -1.520 1.00 0.00 H new ATOM 0 HG21 THR A 78 90.823 -4.181 -2.097 1.00 0.00 H new ATOM 0 HG22 THR A 78 90.767 -4.838 -0.444 1.00 0.00 H new ATOM 0 HG23 THR A 78 89.307 -4.864 -1.461 1.00 0.00 H new ATOM 1189 N GLY A 79 90.075 -3.684 2.609 1.00 0.00 N ATOM 1190 CA GLY A 79 90.661 -4.632 3.597 1.00 0.00 C ATOM 1191 C GLY A 79 89.570 -5.058 4.582 1.00 0.00 C ATOM 1192 O GLY A 79 89.846 -5.556 5.656 1.00 0.00 O ATOM 0 H GLY A 79 90.140 -2.699 2.865 1.00 0.00 H new ATOM 0 HA2 GLY A 79 91.069 -5.504 3.086 1.00 0.00 H new ATOM 0 HA3 GLY A 79 91.486 -4.159 4.130 1.00 0.00 H new ATOM 1196 N LEU A 80 88.330 -4.858 4.223 1.00 0.00 N ATOM 1197 CA LEU A 80 87.209 -5.240 5.130 1.00 0.00 C ATOM 1198 C LEU A 80 87.054 -6.761 5.186 1.00 0.00 C ATOM 1199 O LEU A 80 87.865 -7.502 4.670 1.00 0.00 O ATOM 1200 CB LEU A 80 85.967 -4.603 4.505 1.00 0.00 C ATOM 1201 CG LEU A 80 85.386 -3.566 5.468 1.00 0.00 C ATOM 1202 CD1 LEU A 80 84.762 -2.422 4.668 1.00 0.00 C ATOM 1203 CD2 LEU A 80 84.314 -4.224 6.337 1.00 0.00 C ATOM 0 H LEU A 80 88.044 -4.444 3.336 1.00 0.00 H new ATOM 0 HA LEU A 80 87.378 -4.904 6.153 1.00 0.00 H new ATOM 0 HB2 LEU A 80 86.225 -4.130 3.557 1.00 0.00 H new ATOM 0 HB3 LEU A 80 85.223 -5.369 4.287 1.00 0.00 H new ATOM 0 HG LEU A 80 86.180 -3.174 6.104 1.00 0.00 H new ATOM 0 HD11 LEU A 80 84.348 -1.682 5.353 1.00 0.00 H new ATOM 0 HD12 LEU A 80 85.525 -1.954 4.047 1.00 0.00 H new ATOM 0 HD13 LEU A 80 83.967 -2.813 4.033 1.00 0.00 H new ATOM 0 HD21 LEU A 80 83.899 -3.486 7.024 1.00 0.00 H new ATOM 0 HD22 LEU A 80 83.520 -4.615 5.701 1.00 0.00 H new ATOM 0 HD23 LEU A 80 84.758 -5.041 6.906 1.00 0.00 H new ATOM 1215 N LYS A 81 86.010 -7.225 5.814 1.00 0.00 N ATOM 1216 CA LYS A 81 85.781 -8.694 5.917 1.00 0.00 C ATOM 1217 C LYS A 81 84.401 -8.956 6.484 1.00 0.00 C ATOM 1218 O LYS A 81 84.214 -9.712 7.416 1.00 0.00 O ATOM 1219 CB LYS A 81 86.829 -9.186 6.879 1.00 0.00 C ATOM 1220 CG LYS A 81 87.859 -10.038 6.136 1.00 0.00 C ATOM 1221 CD LYS A 81 88.965 -10.463 7.104 1.00 0.00 C ATOM 1222 CE LYS A 81 89.918 -11.429 6.398 1.00 0.00 C ATOM 1223 NZ LYS A 81 89.994 -12.617 7.293 1.00 0.00 N ATOM 0 H LYS A 81 85.301 -6.646 6.263 1.00 0.00 H new ATOM 0 HA LYS A 81 85.844 -9.192 4.949 1.00 0.00 H new ATOM 0 HB2 LYS A 81 87.322 -8.340 7.358 1.00 0.00 H new ATOM 0 HB3 LYS A 81 86.362 -9.772 7.670 1.00 0.00 H new ATOM 0 HG2 LYS A 81 87.378 -10.918 5.708 1.00 0.00 H new ATOM 0 HG3 LYS A 81 88.284 -9.472 5.307 1.00 0.00 H new ATOM 0 HD2 LYS A 81 89.512 -9.588 7.455 1.00 0.00 H new ATOM 0 HD3 LYS A 81 88.531 -10.941 7.982 1.00 0.00 H new ATOM 0 HE2 LYS A 81 89.544 -11.702 5.411 1.00 0.00 H new ATOM 0 HE3 LYS A 81 90.901 -10.980 6.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 90.631 -13.326 6.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 90.359 -12.328 8.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 89.045 -13.028 7.406 1.00 0.00 H new ATOM 1237 N VAL A 82 83.447 -8.320 5.914 1.00 0.00 N ATOM 1238 CA VAL A 82 82.037 -8.483 6.377 1.00 0.00 C ATOM 1239 C VAL A 82 81.764 -9.950 6.720 1.00 0.00 C ATOM 1240 O VAL A 82 81.953 -10.832 5.909 1.00 0.00 O ATOM 1241 CB VAL A 82 81.175 -8.034 5.198 1.00 0.00 C ATOM 1242 CG1 VAL A 82 79.743 -8.533 5.389 1.00 0.00 C ATOM 1243 CG2 VAL A 82 81.174 -6.505 5.126 1.00 0.00 C ATOM 0 H VAL A 82 83.569 -7.678 5.131 1.00 0.00 H new ATOM 0 HA VAL A 82 81.826 -7.902 7.275 1.00 0.00 H new ATOM 0 HB VAL A 82 81.581 -8.446 4.274 1.00 0.00 H new ATOM 0 HG11 VAL A 82 79.130 -8.211 4.547 1.00 0.00 H new ATOM 0 HG12 VAL A 82 79.741 -9.622 5.444 1.00 0.00 H new ATOM 0 HG13 VAL A 82 79.335 -8.122 6.312 1.00 0.00 H new ATOM 0 HG21 VAL A 82 80.560 -6.181 4.286 1.00 0.00 H new ATOM 0 HG22 VAL A 82 80.767 -6.097 6.051 1.00 0.00 H new ATOM 0 HG23 VAL A 82 82.194 -6.147 4.989 1.00 0.00 H new ATOM 1253 N PHE A 83 81.325 -10.216 7.919 1.00 0.00 N ATOM 1254 CA PHE A 83 81.051 -11.627 8.314 1.00 0.00 C ATOM 1255 C PHE A 83 82.171 -12.544 7.811 1.00 0.00 C ATOM 1256 O PHE A 83 81.956 -13.707 7.534 1.00 0.00 O ATOM 1257 CB PHE A 83 79.722 -11.976 7.646 1.00 0.00 C ATOM 1258 CG PHE A 83 78.597 -11.746 8.625 1.00 0.00 C ATOM 1259 CD1 PHE A 83 78.315 -12.704 9.605 1.00 0.00 C ATOM 1260 CD2 PHE A 83 77.837 -10.572 8.554 1.00 0.00 C ATOM 1261 CE1 PHE A 83 77.273 -12.489 10.515 1.00 0.00 C ATOM 1262 CE2 PHE A 83 76.796 -10.356 9.466 1.00 0.00 C ATOM 1263 CZ PHE A 83 76.514 -11.315 10.446 1.00 0.00 C ATOM 0 H PHE A 83 81.144 -9.519 8.642 1.00 0.00 H new ATOM 0 HA PHE A 83 81.004 -11.753 9.396 1.00 0.00 H new ATOM 0 HB2 PHE A 83 79.577 -11.363 6.757 1.00 0.00 H new ATOM 0 HB3 PHE A 83 79.728 -13.016 7.319 1.00 0.00 H new ATOM 0 HD1 PHE A 83 78.901 -13.609 9.659 1.00 0.00 H new ATOM 0 HD2 PHE A 83 78.053 -9.833 7.796 1.00 0.00 H new ATOM 0 HE1 PHE A 83 77.055 -13.229 11.270 1.00 0.00 H new ATOM 0 HE2 PHE A 83 76.211 -9.450 9.413 1.00 0.00 H new ATOM 0 HZ PHE A 83 75.711 -11.149 11.149 1.00 0.00 H new ATOM 1273 N GLY A 84 83.365 -12.027 7.692 1.00 0.00 N ATOM 1274 CA GLY A 84 84.499 -12.866 7.208 1.00 0.00 C ATOM 1275 C GLY A 84 84.529 -12.852 5.679 1.00 0.00 C ATOM 1276 O GLY A 84 85.032 -13.760 5.048 1.00 0.00 O ATOM 0 H GLY A 84 83.604 -11.059 7.909 1.00 0.00 H new ATOM 0 HA2 GLY A 84 85.441 -12.486 7.604 1.00 0.00 H new ATOM 0 HA3 GLY A 84 84.390 -13.888 7.571 1.00 0.00 H new ATOM 1280 N ASN A 85 83.997 -11.823 5.081 1.00 0.00 N ATOM 1281 CA ASN A 85 83.993 -11.736 3.593 1.00 0.00 C ATOM 1282 C ASN A 85 84.430 -10.337 3.160 1.00 0.00 C ATOM 1283 O ASN A 85 83.618 -9.457 2.953 1.00 0.00 O ATOM 1284 CB ASN A 85 82.544 -12.001 3.182 1.00 0.00 C ATOM 1285 CG ASN A 85 82.238 -13.493 3.318 1.00 0.00 C ATOM 1286 OD1 ASN A 85 81.889 -13.959 4.385 1.00 0.00 O ATOM 1287 ND2 ASN A 85 82.356 -14.270 2.276 1.00 0.00 N ATOM 0 H ASN A 85 83.563 -11.035 5.561 1.00 0.00 H new ATOM 0 HA ASN A 85 84.678 -12.446 3.129 1.00 0.00 H new ATOM 0 HB2 ASN A 85 81.866 -11.422 3.808 1.00 0.00 H new ATOM 0 HB3 ASN A 85 82.382 -11.678 2.154 1.00 0.00 H new ATOM 0 HD21 ASN A 85 82.155 -15.267 2.358 1.00 0.00 H new ATOM 0 HD22 ASN A 85 82.649 -13.880 1.380 1.00 0.00 H new ATOM 1294 N GLU A 86 85.710 -10.120 3.037 1.00 0.00 N ATOM 1295 CA GLU A 86 86.205 -8.775 2.632 1.00 0.00 C ATOM 1296 C GLU A 86 85.336 -8.199 1.516 1.00 0.00 C ATOM 1297 O GLU A 86 85.477 -8.544 0.360 1.00 0.00 O ATOM 1298 CB GLU A 86 87.632 -9.013 2.148 1.00 0.00 C ATOM 1299 CG GLU A 86 88.101 -7.824 1.307 1.00 0.00 C ATOM 1300 CD GLU A 86 89.597 -7.960 1.018 1.00 0.00 C ATOM 1301 OE1 GLU A 86 90.299 -8.486 1.866 1.00 0.00 O ATOM 1302 OE2 GLU A 86 90.017 -7.535 -0.046 1.00 0.00 O ATOM 0 H GLU A 86 86.436 -10.818 3.200 1.00 0.00 H new ATOM 0 HA GLU A 86 86.169 -8.056 3.450 1.00 0.00 H new ATOM 0 HB2 GLU A 86 88.296 -9.151 3.001 1.00 0.00 H new ATOM 0 HB3 GLU A 86 87.677 -9.928 1.557 1.00 0.00 H new ATOM 0 HG2 GLU A 86 87.542 -7.783 0.372 1.00 0.00 H new ATOM 0 HG3 GLU A 86 87.906 -6.891 1.836 1.00 0.00 H new ATOM 1309 N ILE A 87 84.438 -7.320 1.859 1.00 0.00 N ATOM 1310 CA ILE A 87 83.554 -6.715 0.826 1.00 0.00 C ATOM 1311 C ILE A 87 84.385 -5.975 -0.219 1.00 0.00 C ATOM 1312 O ILE A 87 85.347 -5.302 0.093 1.00 0.00 O ATOM 1313 CB ILE A 87 82.655 -5.731 1.575 1.00 0.00 C ATOM 1314 CG1 ILE A 87 83.496 -4.904 2.551 1.00 0.00 C ATOM 1315 CG2 ILE A 87 81.587 -6.503 2.346 1.00 0.00 C ATOM 1316 CD1 ILE A 87 83.400 -3.424 2.179 1.00 0.00 C ATOM 0 H ILE A 87 84.278 -6.994 2.812 1.00 0.00 H new ATOM 0 HA ILE A 87 82.975 -7.474 0.301 1.00 0.00 H new ATOM 0 HB ILE A 87 82.175 -5.063 0.860 1.00 0.00 H new ATOM 0 HG12 ILE A 87 83.144 -5.057 3.571 1.00 0.00 H new ATOM 0 HG13 ILE A 87 84.535 -5.231 2.520 1.00 0.00 H new ATOM 0 HG21 ILE A 87 80.946 -5.802 2.880 1.00 0.00 H new ATOM 0 HG22 ILE A 87 80.985 -7.086 1.649 1.00 0.00 H new ATOM 0 HG23 ILE A 87 82.066 -7.173 3.060 1.00 0.00 H new ATOM 0 HD11 ILE A 87 83.999 -2.835 2.874 1.00 0.00 H new ATOM 0 HD12 ILE A 87 83.773 -3.279 1.165 1.00 0.00 H new ATOM 0 HD13 ILE A 87 82.360 -3.102 2.233 1.00 0.00 H new ATOM 1328 N LYS A 88 84.004 -6.087 -1.454 1.00 0.00 N ATOM 1329 CA LYS A 88 84.743 -5.385 -2.537 1.00 0.00 C ATOM 1330 C LYS A 88 83.858 -4.283 -3.110 1.00 0.00 C ATOM 1331 O LYS A 88 82.651 -4.333 -3.005 1.00 0.00 O ATOM 1332 CB LYS A 88 85.023 -6.453 -3.593 1.00 0.00 C ATOM 1333 CG LYS A 88 85.662 -5.802 -4.822 1.00 0.00 C ATOM 1334 CD LYS A 88 87.053 -5.281 -4.459 1.00 0.00 C ATOM 1335 CE LYS A 88 88.093 -6.371 -4.723 1.00 0.00 C ATOM 1336 NZ LYS A 88 88.926 -5.846 -5.840 1.00 0.00 N ATOM 0 H LYS A 88 83.205 -6.639 -1.765 1.00 0.00 H new ATOM 0 HA LYS A 88 85.666 -4.922 -2.187 1.00 0.00 H new ATOM 0 HB2 LYS A 88 85.687 -7.216 -3.186 1.00 0.00 H new ATOM 0 HB3 LYS A 88 84.096 -6.953 -3.874 1.00 0.00 H new ATOM 0 HG2 LYS A 88 85.734 -6.526 -5.634 1.00 0.00 H new ATOM 0 HG3 LYS A 88 85.037 -4.983 -5.179 1.00 0.00 H new ATOM 0 HD2 LYS A 88 87.285 -4.393 -5.047 1.00 0.00 H new ATOM 0 HD3 LYS A 88 87.080 -4.985 -3.410 1.00 0.00 H new ATOM 0 HE2 LYS A 88 88.697 -6.563 -3.836 1.00 0.00 H new ATOM 0 HE3 LYS A 88 87.617 -7.313 -4.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 89.663 -6.539 -6.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 88.325 -5.679 -6.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 89.372 -4.952 -5.550 1.00 0.00 H new ATOM 1350 N LEU A 89 84.437 -3.285 -3.702 1.00 0.00 N ATOM 1351 CA LEU A 89 83.616 -2.184 -4.264 1.00 0.00 C ATOM 1352 C LEU A 89 83.853 -2.050 -5.770 1.00 0.00 C ATOM 1353 O LEU A 89 84.750 -2.650 -6.326 1.00 0.00 O ATOM 1354 CB LEU A 89 84.082 -0.921 -3.533 1.00 0.00 C ATOM 1355 CG LEU A 89 85.587 -0.985 -3.256 1.00 0.00 C ATOM 1356 CD1 LEU A 89 86.157 0.434 -3.211 1.00 0.00 C ATOM 1357 CD2 LEU A 89 85.829 -1.673 -1.911 1.00 0.00 C ATOM 0 H LEU A 89 85.445 -3.182 -3.822 1.00 0.00 H new ATOM 0 HA LEU A 89 82.549 -2.363 -4.129 1.00 0.00 H new ATOM 0 HB2 LEU A 89 83.854 -0.041 -4.134 1.00 0.00 H new ATOM 0 HB3 LEU A 89 83.538 -0.815 -2.594 1.00 0.00 H new ATOM 0 HG LEU A 89 86.079 -1.550 -4.048 1.00 0.00 H new ATOM 0 HD11 LEU A 89 87.228 0.390 -3.014 1.00 0.00 H new ATOM 0 HD12 LEU A 89 85.984 0.926 -4.168 1.00 0.00 H new ATOM 0 HD13 LEU A 89 85.665 0.999 -2.419 1.00 0.00 H new ATOM 0 HD21 LEU A 89 86.900 -1.719 -1.713 1.00 0.00 H new ATOM 0 HD22 LEU A 89 85.338 -1.107 -1.119 1.00 0.00 H new ATOM 0 HD23 LEU A 89 85.422 -2.684 -1.941 1.00 0.00 H new ATOM 1369 N GLU A 90 83.049 -1.263 -6.432 1.00 0.00 N ATOM 1370 CA GLU A 90 83.217 -1.082 -7.902 1.00 0.00 C ATOM 1371 C GLU A 90 82.361 0.093 -8.387 1.00 0.00 C ATOM 1372 O GLU A 90 81.382 0.457 -7.766 1.00 0.00 O ATOM 1373 CB GLU A 90 82.732 -2.392 -8.522 1.00 0.00 C ATOM 1374 CG GLU A 90 83.649 -2.777 -9.684 1.00 0.00 C ATOM 1375 CD GLU A 90 82.937 -3.791 -10.582 1.00 0.00 C ATOM 1376 OE1 GLU A 90 81.970 -3.410 -11.220 1.00 0.00 O ATOM 1377 OE2 GLU A 90 83.371 -4.930 -10.616 1.00 0.00 O ATOM 0 H GLU A 90 82.281 -0.736 -6.017 1.00 0.00 H new ATOM 0 HA GLU A 90 84.248 -0.861 -8.177 1.00 0.00 H new ATOM 0 HB2 GLU A 90 82.727 -3.182 -7.771 1.00 0.00 H new ATOM 0 HB3 GLU A 90 81.707 -2.282 -8.875 1.00 0.00 H new ATOM 0 HG2 GLU A 90 83.916 -1.891 -10.259 1.00 0.00 H new ATOM 0 HG3 GLU A 90 84.578 -3.202 -9.303 1.00 0.00 H new ATOM 1384 N LYS A 91 82.725 0.688 -9.490 1.00 0.00 N ATOM 1385 CA LYS A 91 81.934 1.839 -10.012 1.00 0.00 C ATOM 1386 C LYS A 91 80.757 1.336 -10.856 1.00 0.00 C ATOM 1387 O LYS A 91 80.948 0.808 -11.933 1.00 0.00 O ATOM 1388 CB LYS A 91 82.914 2.631 -10.878 1.00 0.00 C ATOM 1389 CG LYS A 91 82.487 4.101 -10.918 1.00 0.00 C ATOM 1390 CD LYS A 91 83.404 4.872 -11.871 1.00 0.00 C ATOM 1391 CE LYS A 91 83.372 6.360 -11.516 1.00 0.00 C ATOM 1392 NZ LYS A 91 83.938 7.052 -12.708 1.00 0.00 N ATOM 0 H LYS A 91 83.535 0.427 -10.052 1.00 0.00 H new ATOM 0 HA LYS A 91 81.512 2.447 -9.211 1.00 0.00 H new ATOM 0 HB2 LYS A 91 83.923 2.545 -10.475 1.00 0.00 H new ATOM 0 HB3 LYS A 91 82.938 2.220 -11.887 1.00 0.00 H new ATOM 0 HG2 LYS A 91 81.451 4.181 -11.248 1.00 0.00 H new ATOM 0 HG3 LYS A 91 82.537 4.533 -9.919 1.00 0.00 H new ATOM 0 HD2 LYS A 91 84.423 4.492 -11.800 1.00 0.00 H new ATOM 0 HD3 LYS A 91 83.081 4.726 -12.902 1.00 0.00 H new ATOM 0 HE2 LYS A 91 82.355 6.695 -11.311 1.00 0.00 H new ATOM 0 HE3 LYS A 91 83.962 6.566 -10.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 83.949 8.078 -12.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 84.909 6.718 -12.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 83.352 6.843 -13.541 1.00 0.00 H new ATOM 1406 N PRO A 92 79.576 1.521 -10.332 1.00 0.00 N ATOM 1407 CA PRO A 92 78.350 1.082 -11.044 1.00 0.00 C ATOM 1408 C PRO A 92 78.057 2.010 -12.226 1.00 0.00 C ATOM 1409 O PRO A 92 78.861 2.848 -12.584 1.00 0.00 O ATOM 1410 CB PRO A 92 77.260 1.195 -9.981 1.00 0.00 C ATOM 1411 CG PRO A 92 77.765 2.216 -9.014 1.00 0.00 C ATOM 1412 CD PRO A 92 79.271 2.149 -9.042 1.00 0.00 C ATOM 0 HA PRO A 92 78.432 0.078 -11.460 1.00 0.00 H new ATOM 0 HB2 PRO A 92 76.311 1.503 -10.420 1.00 0.00 H new ATOM 0 HB3 PRO A 92 77.088 0.238 -9.489 1.00 0.00 H new ATOM 0 HG2 PRO A 92 77.419 3.212 -9.290 1.00 0.00 H new ATOM 0 HG3 PRO A 92 77.389 2.015 -8.011 1.00 0.00 H new ATOM 0 HD2 PRO A 92 79.716 3.141 -8.966 1.00 0.00 H new ATOM 0 HD3 PRO A 92 79.660 1.561 -8.210 1.00 0.00 H new ATOM 1420 N LYS A 93 76.911 1.868 -12.834 1.00 0.00 N ATOM 1421 CA LYS A 93 76.568 2.743 -13.992 1.00 0.00 C ATOM 1422 C LYS A 93 75.143 3.283 -13.843 1.00 0.00 C ATOM 1423 O LYS A 93 74.859 4.414 -14.180 1.00 0.00 O ATOM 1424 CB LYS A 93 76.674 1.837 -15.219 1.00 0.00 C ATOM 1425 CG LYS A 93 78.062 1.983 -15.845 1.00 0.00 C ATOM 1426 CD LYS A 93 78.420 0.701 -16.601 1.00 0.00 C ATOM 1427 CE LYS A 93 78.854 1.052 -18.025 1.00 0.00 C ATOM 1428 NZ LYS A 93 80.253 1.545 -17.890 1.00 0.00 N ATOM 0 H LYS A 93 76.198 1.185 -12.580 1.00 0.00 H new ATOM 0 HA LYS A 93 77.228 3.607 -14.066 1.00 0.00 H new ATOM 0 HB2 LYS A 93 76.500 0.799 -14.934 1.00 0.00 H new ATOM 0 HB3 LYS A 93 75.906 2.101 -15.946 1.00 0.00 H new ATOM 0 HG2 LYS A 93 78.078 2.835 -16.525 1.00 0.00 H new ATOM 0 HG3 LYS A 93 78.803 2.180 -15.070 1.00 0.00 H new ATOM 0 HD2 LYS A 93 79.222 0.174 -16.085 1.00 0.00 H new ATOM 0 HD3 LYS A 93 77.562 0.029 -16.626 1.00 0.00 H new ATOM 0 HE2 LYS A 93 78.803 0.182 -18.679 1.00 0.00 H new ATOM 0 HE3 LYS A 93 78.207 1.814 -18.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 80.633 1.774 -18.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 80.265 2.398 -17.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 80.840 0.808 -17.450 1.00 0.00 H new ATOM 1442 N GLY A 94 74.245 2.481 -13.341 1.00 0.00 N ATOM 1443 CA GLY A 94 72.840 2.948 -13.171 1.00 0.00 C ATOM 1444 C GLY A 94 71.995 2.469 -14.352 1.00 0.00 C ATOM 1445 O GLY A 94 71.023 3.094 -14.728 1.00 0.00 O ATOM 0 H GLY A 94 74.423 1.522 -13.041 1.00 0.00 H new ATOM 0 HA2 GLY A 94 72.429 2.564 -12.237 1.00 0.00 H new ATOM 0 HA3 GLY A 94 72.813 4.036 -13.108 1.00 0.00 H new ATOM 1449 N ARG A 95 72.357 1.363 -14.943 1.00 0.00 N ATOM 1450 CA ARG A 95 71.572 0.844 -16.100 1.00 0.00 C ATOM 1451 C ARG A 95 71.979 -0.599 -16.410 1.00 0.00 C ATOM 1452 O ARG A 95 71.160 -1.497 -16.423 1.00 0.00 O ATOM 1453 CB ARG A 95 71.931 1.765 -17.266 1.00 0.00 C ATOM 1454 CG ARG A 95 71.462 1.135 -18.579 1.00 0.00 C ATOM 1455 CD ARG A 95 69.936 1.017 -18.571 1.00 0.00 C ATOM 1456 NE ARG A 95 69.445 2.367 -18.962 1.00 0.00 N ATOM 1457 CZ ARG A 95 68.194 2.535 -19.296 1.00 0.00 C ATOM 1458 NH1 ARG A 95 67.621 1.699 -20.120 1.00 0.00 N ATOM 1459 NH2 ARG A 95 67.516 3.536 -18.807 1.00 0.00 N ATOM 0 H ARG A 95 73.162 0.796 -14.675 1.00 0.00 H new ATOM 0 HA ARG A 95 70.500 0.836 -15.902 1.00 0.00 H new ATOM 0 HB2 ARG A 95 71.462 2.740 -17.131 1.00 0.00 H new ATOM 0 HB3 ARG A 95 73.008 1.930 -17.294 1.00 0.00 H new ATOM 0 HG2 ARG A 95 71.786 1.744 -19.423 1.00 0.00 H new ATOM 0 HG3 ARG A 95 71.913 0.151 -18.704 1.00 0.00 H new ATOM 0 HD2 ARG A 95 69.595 0.255 -19.271 1.00 0.00 H new ATOM 0 HD3 ARG A 95 69.567 0.733 -17.586 1.00 0.00 H new ATOM 0 HE ARG A 95 70.086 3.161 -18.969 1.00 0.00 H new ATOM 0 HH11 ARG A 95 68.151 0.916 -20.502 1.00 0.00 H new ATOM 0 HH12 ARG A 95 66.644 1.830 -20.381 1.00 0.00 H new ATOM 0 HH21 ARG A 95 67.963 4.189 -18.163 1.00 0.00 H new ATOM 0 HH22 ARG A 95 66.539 3.666 -19.069 1.00 0.00 H new ATOM 1473 N ASP A 96 73.239 -0.830 -16.662 1.00 0.00 N ATOM 1474 CA ASP A 96 73.696 -2.214 -16.971 1.00 0.00 C ATOM 1475 C ASP A 96 75.226 -2.265 -17.032 1.00 0.00 C ATOM 1476 O ASP A 96 75.905 -1.394 -16.528 1.00 0.00 O ATOM 1477 CB ASP A 96 73.094 -2.535 -18.340 1.00 0.00 C ATOM 1478 CG ASP A 96 71.920 -3.500 -18.168 1.00 0.00 C ATOM 1479 OD1 ASP A 96 72.171 -4.679 -17.979 1.00 0.00 O ATOM 1480 OD2 ASP A 96 70.790 -3.045 -18.229 1.00 0.00 O ATOM 0 H ASP A 96 73.971 -0.120 -16.667 1.00 0.00 H new ATOM 0 HA ASP A 96 73.384 -2.930 -16.211 1.00 0.00 H new ATOM 0 HB2 ASP A 96 72.757 -1.619 -18.825 1.00 0.00 H new ATOM 0 HB3 ASP A 96 73.851 -2.978 -18.987 1.00 0.00 H new ATOM 1485 N GLY A 97 75.771 -3.279 -17.647 1.00 0.00 N ATOM 1486 CA GLY A 97 77.255 -3.385 -17.739 1.00 0.00 C ATOM 1487 C GLY A 97 77.641 -4.802 -18.164 1.00 0.00 C ATOM 1488 O GLY A 97 76.856 -5.520 -18.752 1.00 0.00 O ATOM 0 H GLY A 97 75.253 -4.038 -18.090 1.00 0.00 H new ATOM 0 HA2 GLY A 97 77.638 -2.661 -18.459 1.00 0.00 H new ATOM 0 HA3 GLY A 97 77.707 -3.147 -16.776 1.00 0.00 H new ATOM 1492 N THR A 98 78.846 -5.211 -17.872 1.00 0.00 N ATOM 1493 CA THR A 98 79.282 -6.584 -18.260 1.00 0.00 C ATOM 1494 C THR A 98 78.812 -6.909 -19.679 1.00 0.00 C ATOM 1495 O THR A 98 78.447 -6.033 -20.438 1.00 0.00 O ATOM 1496 CB THR A 98 78.626 -7.527 -17.254 1.00 0.00 C ATOM 1497 OG1 THR A 98 77.302 -7.822 -17.672 1.00 0.00 O ATOM 1498 CG2 THR A 98 78.597 -6.883 -15.864 1.00 0.00 C ATOM 0 H THR A 98 79.547 -4.655 -17.382 1.00 0.00 H new ATOM 0 HA THR A 98 80.368 -6.679 -18.251 1.00 0.00 H new ATOM 0 HB THR A 98 79.206 -8.449 -17.203 1.00 0.00 H new ATOM 0 HG1 THR A 98 76.840 -6.990 -17.908 1.00 0.00 H new ATOM 0 HG21 THR A 98 78.127 -7.566 -15.156 1.00 0.00 H new ATOM 0 HG22 THR A 98 79.616 -6.670 -15.540 1.00 0.00 H new ATOM 0 HG23 THR A 98 78.028 -5.954 -15.905 1.00 0.00 H new ATOM 1506 N ARG A 99 78.819 -8.162 -20.044 1.00 0.00 N ATOM 1507 CA ARG A 99 78.372 -8.543 -21.416 1.00 0.00 C ATOM 1508 C ARG A 99 76.874 -8.273 -21.577 1.00 0.00 C ATOM 1509 O ARG A 99 76.130 -8.250 -20.617 1.00 0.00 O ATOM 1510 CB ARG A 99 78.663 -10.039 -21.526 1.00 0.00 C ATOM 1511 CG ARG A 99 77.798 -10.803 -20.520 1.00 0.00 C ATOM 1512 CD ARG A 99 78.699 -11.590 -19.566 1.00 0.00 C ATOM 1513 NE ARG A 99 78.504 -13.018 -19.945 1.00 0.00 N ATOM 1514 CZ ARG A 99 79.540 -13.792 -20.121 1.00 0.00 C ATOM 1515 NH1 ARG A 99 80.497 -13.814 -19.233 1.00 0.00 N ATOM 1516 NH2 ARG A 99 79.618 -14.546 -21.184 1.00 0.00 N ATOM 0 H ARG A 99 79.115 -8.939 -19.453 1.00 0.00 H new ATOM 0 HA ARG A 99 78.882 -7.971 -22.191 1.00 0.00 H new ATOM 0 HB2 ARG A 99 78.456 -10.387 -22.538 1.00 0.00 H new ATOM 0 HB3 ARG A 99 79.719 -10.230 -21.333 1.00 0.00 H new ATOM 0 HG2 ARG A 99 77.175 -10.107 -19.958 1.00 0.00 H new ATOM 0 HG3 ARG A 99 77.125 -11.481 -21.044 1.00 0.00 H new ATOM 0 HD2 ARG A 99 79.742 -11.292 -19.672 1.00 0.00 H new ATOM 0 HD3 ARG A 99 78.422 -11.416 -18.526 1.00 0.00 H new ATOM 0 HE ARG A 99 77.562 -13.390 -20.067 1.00 0.00 H new ATOM 0 HH11 ARG A 99 80.435 -13.226 -18.402 1.00 0.00 H new ATOM 0 HH12 ARG A 99 81.307 -14.419 -19.371 1.00 0.00 H new ATOM 0 HH21 ARG A 99 78.869 -14.530 -21.877 1.00 0.00 H new ATOM 0 HH22 ARG A 99 80.428 -15.151 -21.322 1.00 0.00 H new ATOM 1530 N GLY A 100 76.426 -8.067 -22.786 1.00 0.00 N ATOM 1531 CA GLY A 100 74.977 -7.799 -23.007 1.00 0.00 C ATOM 1532 C GLY A 100 74.756 -6.295 -23.183 1.00 0.00 C ATOM 1533 O GLY A 100 74.453 -5.589 -22.241 1.00 0.00 O ATOM 0 H GLY A 100 77.000 -8.073 -23.629 1.00 0.00 H new ATOM 0 HA2 GLY A 100 74.628 -8.334 -23.890 1.00 0.00 H new ATOM 0 HA3 GLY A 100 74.395 -8.166 -22.161 1.00 0.00 H new ATOM 1537 N CYS A 101 74.902 -5.800 -24.381 1.00 0.00 N ATOM 1538 CA CYS A 101 74.700 -4.341 -24.615 1.00 0.00 C ATOM 1539 C CYS A 101 73.445 -4.111 -25.461 1.00 0.00 C ATOM 1540 O CYS A 101 73.209 -2.975 -25.838 1.00 0.00 O ATOM 1541 CB CYS A 101 75.948 -3.885 -25.371 1.00 0.00 C ATOM 1542 SG CYS A 101 75.947 -4.608 -27.029 1.00 0.00 S ATOM 1543 OXT CYS A 101 72.742 -5.074 -25.718 1.00 0.00 O ATOM 0 H CYS A 101 75.152 -6.342 -25.208 1.00 0.00 H new ATOM 0 HA CYS A 101 74.562 -3.788 -23.686 1.00 0.00 H new ATOM 0 HB2 CYS A 101 75.969 -2.797 -25.437 1.00 0.00 H new ATOM 0 HB3 CYS A 101 76.845 -4.189 -24.831 1.00 0.00 H new ATOM 0 HG CYS A 101 77.007 -4.219 -27.673 1.00 0.00 H new TER 1549 CYS A 101