USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 946 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 63 LYS NZ :NH3+ -134:sc= 0.654 (180deg=0) USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0.599 USER MOD Set 2.1: A 37 THR OG1 : rot 110:sc= 0.448 USER MOD Set 2.2: A 69 THR OG1 : rot -35:sc= 0.0896 USER MOD Set 3.1: A 12 MET CE :methyl -111:sc= -0.602 (180deg=-3.79!) USER MOD Set 3.2: A 68 THR OG1 : rot -70:sc= 1.49 USER MOD Single : A 1 GLY N :NH3+ -144:sc= 1.23 (180deg=0.318) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 120:sc= -0.257 USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.0307 USER MOD Single : A 19 GLN : amide:sc= -0.212 K(o=-0.21,f=-1.7) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 16:sc= 0.236 USER MOD Single : A 28 LYS NZ :NH3+ -170:sc= 2.62 (180deg=2.39) USER MOD Single : A 29 SER OG : rot 12:sc= 0.158 USER MOD Single : A 35 ASN : amide:sc= -0.17 K(o=-0.17,f=-2.4!) USER MOD Single : A 38 GLN : amide:sc= -0.0544 X(o=-0.054,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 145:sc= 1.03 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 140:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0.115 USER MOD Single : A 71 LYS NZ :NH3+ -105:sc= -1.45 (180deg=-3.99!) USER MOD Single : A 78 SER OG : rot 180:sc= -0.0151 USER MOD Single : A 90 ASN : amide:sc= -0.247 X(o=-0.25,f=-0.25) USER MOD Single : A 93 MET CE :methyl 167:sc= -1.69 (180deg=-2.12) USER MOD Single : A 94 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -0.118 X(o=-0.12,f=-0.16) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00032) USER MOD Single : A 109 LYS NZ :NH3+ 150:sc= 0.217 (180deg=-2.26!) USER MOD Single : A 110 SER OG : rot 21:sc= 0.0704 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 149:sc= 1.2 USER MOD Single : A 125 ASN : amide:sc= -0.0117 X(o=-0.012,f=0) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 150:sc= -0.424 USER MOD Single : A 129 ASN : amide:sc= -0.222 X(o=-0.22,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 22.175 -9.650 11.180 1.00 0.00 N ATOM 2 CA GLY A 1 23.238 -10.586 10.800 1.00 0.00 C ATOM 3 C GLY A 1 22.620 -11.641 9.918 1.00 0.00 C ATOM 4 O GLY A 1 21.894 -12.505 10.416 1.00 0.00 O ATOM 0 H1 GLY A 1 22.562 -8.686 11.227 1.00 0.00 H new ATOM 0 H2 GLY A 1 21.414 -9.684 10.472 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.795 -9.916 12.111 1.00 0.00 H new ATOM 0 HA2 GLY A 1 24.037 -10.065 10.272 1.00 0.00 H new ATOM 0 HA3 GLY A 1 23.684 -11.040 11.685 1.00 0.00 H new ATOM 8 N ASP A 2 22.819 -11.515 8.608 1.00 0.00 N ATOM 9 CA ASP A 2 21.960 -12.120 7.594 1.00 0.00 C ATOM 10 C ASP A 2 22.840 -12.421 6.395 1.00 0.00 C ATOM 11 O ASP A 2 23.082 -13.581 6.062 1.00 0.00 O ATOM 12 CB ASP A 2 20.786 -11.183 7.217 1.00 0.00 C ATOM 13 CG ASP A 2 19.847 -10.811 8.371 1.00 0.00 C ATOM 14 OD1 ASP A 2 20.232 -9.942 9.195 1.00 0.00 O ATOM 15 OD2 ASP A 2 18.717 -11.346 8.439 1.00 0.00 O ATOM 0 H ASP A 2 23.594 -10.981 8.215 1.00 0.00 H new ATOM 0 HA ASP A 2 21.503 -13.035 7.972 1.00 0.00 H new ATOM 0 HB2 ASP A 2 21.196 -10.266 6.794 1.00 0.00 H new ATOM 0 HB3 ASP A 2 20.199 -11.661 6.433 1.00 0.00 H new ATOM 20 N ASP A 3 23.355 -11.357 5.794 1.00 0.00 N ATOM 21 CA ASP A 3 23.960 -11.247 4.486 1.00 0.00 C ATOM 22 C ASP A 3 24.554 -9.844 4.462 1.00 0.00 C ATOM 23 O ASP A 3 24.137 -8.982 5.249 1.00 0.00 O ATOM 24 CB ASP A 3 22.892 -11.386 3.398 1.00 0.00 C ATOM 25 CG ASP A 3 21.934 -10.190 3.357 1.00 0.00 C ATOM 26 OD1 ASP A 3 22.205 -9.183 2.661 1.00 0.00 O ATOM 27 OD2 ASP A 3 20.872 -10.274 4.009 1.00 0.00 O ATOM 0 H ASP A 3 23.356 -10.454 6.269 1.00 0.00 H new ATOM 0 HA ASP A 3 24.706 -12.021 4.303 1.00 0.00 H new ATOM 0 HB2 ASP A 3 23.378 -11.491 2.428 1.00 0.00 H new ATOM 0 HB3 ASP A 3 22.321 -12.299 3.569 1.00 0.00 H new ATOM 32 N ASP A 4 25.561 -9.637 3.628 1.00 0.00 N ATOM 33 CA ASP A 4 26.326 -8.401 3.602 1.00 0.00 C ATOM 34 C ASP A 4 26.647 -8.048 2.153 1.00 0.00 C ATOM 35 O ASP A 4 27.613 -8.550 1.574 1.00 0.00 O ATOM 36 CB ASP A 4 27.577 -8.524 4.496 1.00 0.00 C ATOM 37 CG ASP A 4 27.342 -7.836 5.841 1.00 0.00 C ATOM 38 OD1 ASP A 4 27.533 -6.599 5.903 1.00 0.00 O ATOM 39 OD2 ASP A 4 26.950 -8.521 6.815 1.00 0.00 O ATOM 0 H ASP A 4 25.872 -10.328 2.945 1.00 0.00 H new ATOM 0 HA ASP A 4 25.743 -7.579 4.017 1.00 0.00 H new ATOM 0 HB2 ASP A 4 27.816 -9.576 4.655 1.00 0.00 H new ATOM 0 HB3 ASP A 4 28.435 -8.075 3.996 1.00 0.00 H new ATOM 44 N GLU A 5 25.859 -7.137 1.581 1.00 0.00 N ATOM 45 CA GLU A 5 25.989 -6.675 0.202 1.00 0.00 C ATOM 46 C GLU A 5 25.442 -5.238 0.064 1.00 0.00 C ATOM 47 O GLU A 5 24.563 -4.967 -0.754 1.00 0.00 O ATOM 48 CB GLU A 5 25.313 -7.675 -0.766 1.00 0.00 C ATOM 49 CG GLU A 5 23.815 -7.934 -0.506 1.00 0.00 C ATOM 50 CD GLU A 5 23.013 -8.048 -1.805 1.00 0.00 C ATOM 51 OE1 GLU A 5 23.111 -9.094 -2.472 1.00 0.00 O ATOM 52 OE2 GLU A 5 22.253 -7.103 -2.149 1.00 0.00 O ATOM 0 H GLU A 5 25.091 -6.688 2.080 1.00 0.00 H new ATOM 0 HA GLU A 5 27.043 -6.637 -0.073 1.00 0.00 H new ATOM 0 HB2 GLU A 5 25.429 -7.304 -1.784 1.00 0.00 H new ATOM 0 HB3 GLU A 5 25.844 -8.625 -0.710 1.00 0.00 H new ATOM 0 HG2 GLU A 5 23.702 -8.852 0.071 1.00 0.00 H new ATOM 0 HG3 GLU A 5 23.408 -7.125 0.100 1.00 0.00 H new ATOM 59 N PRO A 6 25.967 -4.264 0.836 1.00 0.00 N ATOM 60 CA PRO A 6 25.493 -2.887 0.784 1.00 0.00 C ATOM 61 C PRO A 6 25.824 -2.232 -0.545 1.00 0.00 C ATOM 62 O PRO A 6 26.992 -1.985 -0.878 1.00 0.00 O ATOM 63 CB PRO A 6 26.138 -2.167 1.949 1.00 0.00 C ATOM 64 CG PRO A 6 27.410 -2.966 2.211 1.00 0.00 C ATOM 65 CD PRO A 6 27.015 -4.392 1.841 1.00 0.00 C ATOM 0 HA PRO A 6 24.407 -2.845 0.863 1.00 0.00 H new ATOM 0 HB2 PRO A 6 26.361 -1.129 1.704 1.00 0.00 H new ATOM 0 HB3 PRO A 6 25.486 -2.155 2.822 1.00 0.00 H new ATOM 0 HG2 PRO A 6 28.241 -2.609 1.603 1.00 0.00 H new ATOM 0 HG3 PRO A 6 27.723 -2.893 3.253 1.00 0.00 H new ATOM 0 HD2 PRO A 6 27.868 -4.945 1.448 1.00 0.00 H new ATOM 0 HD3 PRO A 6 26.656 -4.938 2.714 1.00 0.00 H new ATOM 73 N GLY A 7 24.777 -1.978 -1.323 1.00 0.00 N ATOM 74 CA GLY A 7 24.945 -1.838 -2.746 1.00 0.00 C ATOM 75 C GLY A 7 25.465 -0.467 -3.166 1.00 0.00 C ATOM 76 O GLY A 7 26.337 -0.369 -4.033 1.00 0.00 O ATOM 0 H GLY A 7 23.820 -1.868 -0.989 1.00 0.00 H new ATOM 0 HA2 GLY A 7 25.636 -2.604 -3.099 1.00 0.00 H new ATOM 0 HA3 GLY A 7 23.989 -2.021 -3.236 1.00 0.00 H new ATOM 80 N GLY A 8 24.973 0.602 -2.544 1.00 0.00 N ATOM 81 CA GLY A 8 25.297 1.977 -2.894 1.00 0.00 C ATOM 82 C GLY A 8 24.431 2.919 -2.066 1.00 0.00 C ATOM 83 O GLY A 8 23.849 2.495 -1.066 1.00 0.00 O ATOM 0 H GLY A 8 24.321 0.531 -1.763 1.00 0.00 H new ATOM 0 HA2 GLY A 8 26.353 2.174 -2.707 1.00 0.00 H new ATOM 0 HA3 GLY A 8 25.125 2.145 -3.957 1.00 0.00 H new ATOM 87 N LYS A 9 24.285 4.175 -2.500 1.00 0.00 N ATOM 88 CA LYS A 9 23.496 5.188 -1.834 1.00 0.00 C ATOM 89 C LYS A 9 22.226 5.430 -2.628 1.00 0.00 C ATOM 90 O LYS A 9 22.254 5.598 -3.845 1.00 0.00 O ATOM 91 CB LYS A 9 24.288 6.477 -1.548 1.00 0.00 C ATOM 92 CG LYS A 9 24.853 7.298 -2.726 1.00 0.00 C ATOM 93 CD LYS A 9 26.125 6.754 -3.396 1.00 0.00 C ATOM 94 CE LYS A 9 27.289 6.751 -2.399 1.00 0.00 C ATOM 95 NZ LYS A 9 28.592 6.482 -3.035 1.00 0.00 N ATOM 0 H LYS A 9 24.731 4.514 -3.352 1.00 0.00 H new ATOM 0 HA LYS A 9 23.220 4.821 -0.845 1.00 0.00 H new ATOM 0 HB2 LYS A 9 23.641 7.137 -0.971 1.00 0.00 H new ATOM 0 HB3 LYS A 9 25.126 6.210 -0.904 1.00 0.00 H new ATOM 0 HG2 LYS A 9 24.077 7.382 -3.486 1.00 0.00 H new ATOM 0 HG3 LYS A 9 25.060 8.307 -2.370 1.00 0.00 H new ATOM 0 HD2 LYS A 9 25.948 5.743 -3.762 1.00 0.00 H new ATOM 0 HD3 LYS A 9 26.379 7.366 -4.261 1.00 0.00 H new ATOM 0 HE2 LYS A 9 27.330 7.716 -1.894 1.00 0.00 H new ATOM 0 HE3 LYS A 9 27.102 5.998 -1.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 29.340 6.493 -2.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 28.568 5.549 -3.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 28.788 7.214 -3.747 1.00 0.00 H new ATOM 109 N GLY A 10 21.116 5.410 -1.919 1.00 0.00 N ATOM 110 CA GLY A 10 19.809 5.911 -2.307 1.00 0.00 C ATOM 111 C GLY A 10 19.015 6.128 -1.029 1.00 0.00 C ATOM 112 O GLY A 10 19.520 6.782 -0.110 1.00 0.00 O ATOM 0 H GLY A 10 21.101 5.011 -0.980 1.00 0.00 H new ATOM 0 HA2 GLY A 10 19.904 6.843 -2.864 1.00 0.00 H new ATOM 0 HA3 GLY A 10 19.302 5.200 -2.959 1.00 0.00 H new ATOM 116 N ALA A 11 17.821 5.542 -0.946 1.00 0.00 N ATOM 117 CA ALA A 11 16.936 5.662 0.213 1.00 0.00 C ATOM 118 C ALA A 11 16.362 4.298 0.604 1.00 0.00 C ATOM 119 O ALA A 11 16.334 3.377 -0.217 1.00 0.00 O ATOM 120 CB ALA A 11 15.806 6.658 -0.090 1.00 0.00 C ATOM 0 H ALA A 11 17.436 4.963 -1.692 1.00 0.00 H new ATOM 0 HA ALA A 11 17.517 6.035 1.056 1.00 0.00 H new ATOM 0 HB1 ALA A 11 15.152 6.741 0.778 1.00 0.00 H new ATOM 0 HB2 ALA A 11 16.233 7.635 -0.318 1.00 0.00 H new ATOM 0 HB3 ALA A 11 15.230 6.306 -0.946 1.00 0.00 H new ATOM 126 N MET A 12 15.861 4.182 1.837 1.00 0.00 N ATOM 127 CA MET A 12 14.905 3.154 2.214 1.00 0.00 C ATOM 128 C MET A 12 13.512 3.733 2.016 1.00 0.00 C ATOM 129 O MET A 12 13.304 4.953 2.076 1.00 0.00 O ATOM 130 CB MET A 12 15.101 2.677 3.661 1.00 0.00 C ATOM 131 CG MET A 12 16.544 2.211 3.879 1.00 0.00 C ATOM 132 SD MET A 12 16.797 0.797 4.969 1.00 0.00 S ATOM 133 CE MET A 12 15.920 -0.470 4.016 1.00 0.00 C ATOM 0 H MET A 12 16.114 4.807 2.603 1.00 0.00 H new ATOM 0 HA MET A 12 15.053 2.274 1.588 1.00 0.00 H new ATOM 0 HB2 MET A 12 14.865 3.486 4.352 1.00 0.00 H new ATOM 0 HB3 MET A 12 14.412 1.861 3.878 1.00 0.00 H new ATOM 0 HG2 MET A 12 16.971 1.968 2.906 1.00 0.00 H new ATOM 0 HG3 MET A 12 17.114 3.051 4.277 1.00 0.00 H new ATOM 0 HE1 MET A 12 15.014 -0.762 4.546 1.00 0.00 H new ATOM 0 HE2 MET A 12 15.655 -0.070 3.037 1.00 0.00 H new ATOM 0 HE3 MET A 12 16.563 -1.341 3.890 1.00 0.00 H new ATOM 143 N TYR A 13 12.574 2.834 1.779 1.00 0.00 N ATOM 144 CA TYR A 13 11.220 3.103 1.365 1.00 0.00 C ATOM 145 C TYR A 13 10.343 2.066 2.057 1.00 0.00 C ATOM 146 O TYR A 13 10.494 0.873 1.778 1.00 0.00 O ATOM 147 CB TYR A 13 11.140 3.006 -0.170 1.00 0.00 C ATOM 148 CG TYR A 13 11.387 4.314 -0.904 1.00 0.00 C ATOM 149 CD1 TYR A 13 10.465 5.359 -0.722 1.00 0.00 C ATOM 150 CD2 TYR A 13 12.459 4.483 -1.808 1.00 0.00 C ATOM 151 CE1 TYR A 13 10.633 6.583 -1.381 1.00 0.00 C ATOM 152 CE2 TYR A 13 12.618 5.703 -2.502 1.00 0.00 C ATOM 153 CZ TYR A 13 11.727 6.768 -2.247 1.00 0.00 C ATOM 154 OH TYR A 13 11.911 7.997 -2.788 1.00 0.00 O ATOM 0 H TYR A 13 12.755 1.835 1.879 1.00 0.00 H new ATOM 0 HA TYR A 13 10.884 4.103 1.640 1.00 0.00 H new ATOM 0 HB2 TYR A 13 11.868 2.270 -0.512 1.00 0.00 H new ATOM 0 HB3 TYR A 13 10.154 2.631 -0.446 1.00 0.00 H new ATOM 0 HD1 TYR A 13 9.618 5.216 -0.067 1.00 0.00 H new ATOM 0 HD2 TYR A 13 13.159 3.677 -1.969 1.00 0.00 H new ATOM 0 HE1 TYR A 13 9.925 7.383 -1.225 1.00 0.00 H new ATOM 0 HE2 TYR A 13 13.415 5.820 -3.222 1.00 0.00 H new ATOM 0 HH TYR A 13 12.787 8.345 -2.519 1.00 0.00 H new ATOM 164 N GLU A 14 9.468 2.517 2.958 1.00 0.00 N ATOM 165 CA GLU A 14 8.430 1.746 3.625 1.00 0.00 C ATOM 166 C GLU A 14 7.114 2.499 3.417 1.00 0.00 C ATOM 167 O GLU A 14 7.103 3.734 3.388 1.00 0.00 O ATOM 168 CB GLU A 14 8.777 1.590 5.115 1.00 0.00 C ATOM 169 CG GLU A 14 7.671 0.964 5.980 1.00 0.00 C ATOM 170 CD GLU A 14 7.985 1.046 7.477 1.00 0.00 C ATOM 171 OE1 GLU A 14 9.174 1.162 7.858 1.00 0.00 O ATOM 172 OE2 GLU A 14 7.035 0.982 8.292 1.00 0.00 O ATOM 0 H GLU A 14 9.470 3.492 3.256 1.00 0.00 H new ATOM 0 HA GLU A 14 8.343 0.740 3.215 1.00 0.00 H new ATOM 0 HB2 GLU A 14 9.674 0.977 5.201 1.00 0.00 H new ATOM 0 HB3 GLU A 14 9.021 2.572 5.520 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.727 1.471 5.781 1.00 0.00 H new ATOM 0 HG3 GLU A 14 7.538 -0.080 5.696 1.00 0.00 H new ATOM 179 N VAL A 15 6.021 1.757 3.263 1.00 0.00 N ATOM 180 CA VAL A 15 4.655 2.229 3.103 1.00 0.00 C ATOM 181 C VAL A 15 3.721 1.328 3.915 1.00 0.00 C ATOM 182 O VAL A 15 3.803 0.097 3.827 1.00 0.00 O ATOM 183 CB VAL A 15 4.318 2.254 1.594 1.00 0.00 C ATOM 184 CG1 VAL A 15 4.460 0.893 0.873 1.00 0.00 C ATOM 185 CG2 VAL A 15 2.901 2.772 1.357 1.00 0.00 C ATOM 0 H VAL A 15 6.074 0.739 3.246 1.00 0.00 H new ATOM 0 HA VAL A 15 4.529 3.243 3.482 1.00 0.00 H new ATOM 0 HB VAL A 15 5.063 2.925 1.167 1.00 0.00 H new ATOM 0 HG11 VAL A 15 4.203 1.010 -0.180 1.00 0.00 H new ATOM 0 HG12 VAL A 15 5.488 0.542 0.958 1.00 0.00 H new ATOM 0 HG13 VAL A 15 3.789 0.167 1.332 1.00 0.00 H new ATOM 0 HG21 VAL A 15 2.690 2.779 0.288 1.00 0.00 H new ATOM 0 HG22 VAL A 15 2.187 2.123 1.863 1.00 0.00 H new ATOM 0 HG23 VAL A 15 2.813 3.785 1.751 1.00 0.00 H new ATOM 195 N THR A 16 2.813 1.919 4.688 1.00 0.00 N ATOM 196 CA THR A 16 1.784 1.183 5.403 1.00 0.00 C ATOM 197 C THR A 16 0.500 1.177 4.598 1.00 0.00 C ATOM 198 O THR A 16 0.307 1.978 3.672 1.00 0.00 O ATOM 199 CB THR A 16 1.545 1.817 6.781 1.00 0.00 C ATOM 200 OG1 THR A 16 1.386 3.216 6.657 1.00 0.00 O ATOM 201 CG2 THR A 16 2.704 1.532 7.735 1.00 0.00 C ATOM 0 H THR A 16 2.774 2.928 4.834 1.00 0.00 H new ATOM 0 HA THR A 16 2.115 0.154 5.544 1.00 0.00 H new ATOM 0 HB THR A 16 0.637 1.375 7.190 1.00 0.00 H new ATOM 0 HG1 THR A 16 1.233 3.608 7.542 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.502 1.995 8.701 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.812 0.455 7.864 1.00 0.00 H new ATOM 0 HG23 THR A 16 3.625 1.942 7.321 1.00 0.00 H new ATOM 209 N ILE A 17 -0.386 0.266 4.977 1.00 0.00 N ATOM 210 CA ILE A 17 -1.751 0.256 4.522 1.00 0.00 C ATOM 211 C ILE A 17 -2.606 -0.136 5.713 1.00 0.00 C ATOM 212 O ILE A 17 -2.454 -1.245 6.209 1.00 0.00 O ATOM 213 CB ILE A 17 -1.871 -0.664 3.291 1.00 0.00 C ATOM 214 CG1 ILE A 17 -3.328 -0.799 2.825 1.00 0.00 C ATOM 215 CG2 ILE A 17 -1.279 -2.071 3.453 1.00 0.00 C ATOM 216 CD1 ILE A 17 -4.005 0.543 2.568 1.00 0.00 C ATOM 0 H ILE A 17 -0.163 -0.494 5.619 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.103 1.228 4.176 1.00 0.00 H new ATOM 0 HB ILE A 17 -1.265 -0.155 2.541 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -3.357 -1.394 1.912 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -3.894 -1.346 3.579 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -1.418 -2.633 2.529 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -0.215 -1.995 3.675 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.784 -2.586 4.270 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.032 0.376 2.242 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -4.007 1.131 3.486 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -3.461 1.082 1.793 1.00 0.00 H new ATOM 228 N GLU A 18 -3.430 0.775 6.226 1.00 0.00 N ATOM 229 CA GLU A 18 -4.247 0.548 7.413 1.00 0.00 C ATOM 230 C GLU A 18 -5.711 0.566 7.011 1.00 0.00 C ATOM 231 O GLU A 18 -6.132 1.425 6.229 1.00 0.00 O ATOM 232 CB GLU A 18 -3.980 1.605 8.486 1.00 0.00 C ATOM 233 CG GLU A 18 -2.477 1.779 8.766 1.00 0.00 C ATOM 234 CD GLU A 18 -2.143 2.281 10.172 1.00 0.00 C ATOM 235 OE1 GLU A 18 -3.029 2.338 11.052 1.00 0.00 O ATOM 236 OE2 GLU A 18 -0.941 2.498 10.443 1.00 0.00 O ATOM 0 H GLU A 18 -3.550 1.704 5.822 1.00 0.00 H new ATOM 0 HA GLU A 18 -3.988 -0.421 7.839 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.402 2.558 8.168 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -4.490 1.323 9.407 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -1.979 0.822 8.609 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.064 2.477 8.038 1.00 0.00 H new ATOM 243 N GLN A 19 -6.476 -0.389 7.533 1.00 0.00 N ATOM 244 CA GLN A 19 -7.761 -0.781 7.005 1.00 0.00 C ATOM 245 C GLN A 19 -8.813 -0.612 8.099 1.00 0.00 C ATOM 246 O GLN A 19 -8.757 -1.291 9.125 1.00 0.00 O ATOM 247 CB GLN A 19 -7.698 -2.241 6.511 1.00 0.00 C ATOM 248 CG GLN A 19 -6.536 -2.529 5.546 1.00 0.00 C ATOM 249 CD GLN A 19 -6.286 -4.023 5.394 1.00 0.00 C ATOM 250 OE1 GLN A 19 -5.247 -4.527 5.809 1.00 0.00 O ATOM 251 NE2 GLN A 19 -7.204 -4.734 4.753 1.00 0.00 N ATOM 0 H GLN A 19 -6.203 -0.921 8.359 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.031 -0.152 6.156 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.612 -2.902 7.374 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -8.637 -2.486 6.015 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.758 -2.096 4.570 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -5.631 -2.044 5.912 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -8.057 -4.284 4.421 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.057 -5.730 4.592 1.00 0.00 H new ATOM 260 N SER A 20 -9.771 0.296 7.900 1.00 0.00 N ATOM 261 CA SER A 20 -10.859 0.536 8.836 1.00 0.00 C ATOM 262 C SER A 20 -12.247 0.326 8.254 1.00 0.00 C ATOM 263 O SER A 20 -12.380 -0.057 7.092 1.00 0.00 O ATOM 264 CB SER A 20 -10.705 1.936 9.455 1.00 0.00 C ATOM 265 OG SER A 20 -9.394 2.172 9.925 1.00 0.00 O ATOM 0 H SER A 20 -9.809 0.890 7.072 1.00 0.00 H new ATOM 0 HA SER A 20 -10.777 -0.222 9.615 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.964 2.690 8.712 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.410 2.046 10.279 1.00 0.00 H new ATOM 0 HG SER A 20 -9.341 3.072 10.308 1.00 0.00 H new ATOM 271 N GLY A 21 -13.261 0.562 9.094 1.00 0.00 N ATOM 272 CA GLY A 21 -14.678 0.519 8.794 1.00 0.00 C ATOM 273 C GLY A 21 -15.114 -0.901 8.508 1.00 0.00 C ATOM 274 O GLY A 21 -15.281 -1.679 9.449 1.00 0.00 O ATOM 0 H GLY A 21 -13.089 0.805 10.070 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.246 0.918 9.634 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -14.893 1.153 7.934 1.00 0.00 H new ATOM 278 N ASP A 22 -15.231 -1.249 7.234 1.00 0.00 N ATOM 279 CA ASP A 22 -15.641 -2.552 6.738 1.00 0.00 C ATOM 280 C ASP A 22 -14.737 -2.863 5.560 1.00 0.00 C ATOM 281 O ASP A 22 -14.776 -2.152 4.559 1.00 0.00 O ATOM 282 CB ASP A 22 -17.111 -2.524 6.299 1.00 0.00 C ATOM 283 CG ASP A 22 -17.978 -3.422 7.181 1.00 0.00 C ATOM 284 OD1 ASP A 22 -17.828 -3.426 8.426 1.00 0.00 O ATOM 285 OD2 ASP A 22 -18.765 -4.218 6.618 1.00 0.00 O ATOM 0 H ASP A 22 -15.031 -0.593 6.479 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.555 -3.314 7.512 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -17.485 -1.501 6.342 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -17.188 -2.849 5.261 1.00 0.00 H new ATOM 290 N PHE A 23 -13.878 -3.875 5.680 1.00 0.00 N ATOM 291 CA PHE A 23 -12.838 -4.132 4.685 1.00 0.00 C ATOM 292 C PHE A 23 -12.974 -5.489 3.981 1.00 0.00 C ATOM 293 O PHE A 23 -12.060 -5.884 3.257 1.00 0.00 O ATOM 294 CB PHE A 23 -11.452 -3.833 5.291 1.00 0.00 C ATOM 295 CG PHE A 23 -11.003 -4.604 6.524 1.00 0.00 C ATOM 296 CD1 PHE A 23 -10.747 -5.988 6.465 1.00 0.00 C ATOM 297 CD2 PHE A 23 -10.716 -3.902 7.713 1.00 0.00 C ATOM 298 CE1 PHE A 23 -10.202 -6.652 7.579 1.00 0.00 C ATOM 299 CE2 PHE A 23 -10.161 -4.566 8.820 1.00 0.00 C ATOM 300 CZ PHE A 23 -9.885 -5.941 8.749 1.00 0.00 C ATOM 0 H PHE A 23 -13.883 -4.532 6.460 1.00 0.00 H new ATOM 0 HA PHE A 23 -12.971 -3.438 3.855 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -10.709 -3.999 4.511 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -11.423 -2.772 5.538 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -10.969 -6.540 5.564 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -10.925 -2.844 7.773 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.026 -7.717 7.535 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -9.947 -4.019 9.726 1.00 0.00 H new ATOM 0 HZ PHE A 23 -9.432 -6.449 9.588 1.00 0.00 H new ATOM 310 N ARG A 24 -14.108 -6.182 4.161 1.00 0.00 N ATOM 311 CA ARG A 24 -14.315 -7.587 3.763 1.00 0.00 C ATOM 312 C ARG A 24 -15.132 -7.755 2.481 1.00 0.00 C ATOM 313 O ARG A 24 -15.322 -8.887 2.023 1.00 0.00 O ATOM 314 CB ARG A 24 -14.994 -8.371 4.901 1.00 0.00 C ATOM 315 CG ARG A 24 -14.365 -8.164 6.281 1.00 0.00 C ATOM 316 CD ARG A 24 -15.131 -8.958 7.339 1.00 0.00 C ATOM 317 NE ARG A 24 -14.680 -8.546 8.671 1.00 0.00 N ATOM 318 CZ ARG A 24 -15.383 -8.593 9.802 1.00 0.00 C ATOM 319 NH1 ARG A 24 -16.567 -9.181 9.884 1.00 0.00 N ATOM 320 NH2 ARG A 24 -14.874 -8.019 10.874 1.00 0.00 N ATOM 0 H ARG A 24 -14.932 -5.771 4.600 1.00 0.00 H new ATOM 0 HA ARG A 24 -13.321 -7.984 3.560 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -16.044 -8.082 4.948 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -14.966 -9.434 4.659 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -13.322 -8.480 6.264 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -14.372 -7.104 6.536 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -16.202 -8.786 7.235 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -14.965 -10.026 7.200 1.00 0.00 H new ATOM 0 HE ARG A 24 -13.728 -8.185 8.740 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -16.976 -9.622 9.060 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -17.070 -9.193 10.771 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -13.967 -7.556 10.822 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -15.388 -8.038 11.755 1.00 0.00 H new ATOM 334 N SER A 25 -15.581 -6.655 1.881 1.00 0.00 N ATOM 335 CA SER A 25 -16.094 -6.575 0.529 1.00 0.00 C ATOM 336 C SER A 25 -15.609 -5.231 0.026 1.00 0.00 C ATOM 337 O SER A 25 -16.164 -4.209 0.411 1.00 0.00 O ATOM 338 CB SER A 25 -17.619 -6.695 0.519 1.00 0.00 C ATOM 339 OG SER A 25 -17.958 -8.052 0.714 1.00 0.00 O ATOM 0 H SER A 25 -15.594 -5.752 2.356 1.00 0.00 H new ATOM 0 HA SER A 25 -15.747 -7.386 -0.111 1.00 0.00 H new ATOM 0 HB2 SER A 25 -18.054 -6.078 1.306 1.00 0.00 H new ATOM 0 HB3 SER A 25 -18.022 -6.335 -0.428 1.00 0.00 H new ATOM 0 HG SER A 25 -17.177 -8.539 1.052 1.00 0.00 H new ATOM 345 N PHE A 26 -14.470 -5.252 -0.671 1.00 0.00 N ATOM 346 CA PHE A 26 -13.818 -4.144 -1.366 1.00 0.00 C ATOM 347 C PHE A 26 -12.585 -4.735 -2.065 1.00 0.00 C ATOM 348 O PHE A 26 -11.641 -5.155 -1.384 1.00 0.00 O ATOM 349 CB PHE A 26 -13.411 -3.000 -0.407 1.00 0.00 C ATOM 350 CG PHE A 26 -14.450 -1.908 -0.183 1.00 0.00 C ATOM 351 CD1 PHE A 26 -14.824 -1.088 -1.265 1.00 0.00 C ATOM 352 CD2 PHE A 26 -15.002 -1.656 1.091 1.00 0.00 C ATOM 353 CE1 PHE A 26 -15.681 0.010 -1.073 1.00 0.00 C ATOM 354 CE2 PHE A 26 -15.892 -0.582 1.276 1.00 0.00 C ATOM 355 CZ PHE A 26 -16.218 0.264 0.201 1.00 0.00 C ATOM 0 H PHE A 26 -13.938 -6.117 -0.771 1.00 0.00 H new ATOM 0 HA PHE A 26 -14.509 -3.694 -2.079 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -13.159 -3.437 0.559 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -12.504 -2.536 -0.793 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -14.448 -1.305 -2.254 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -14.741 -2.289 1.926 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -15.926 0.657 -1.902 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.327 -0.406 2.249 1.00 0.00 H new ATOM 0 HZ PHE A 26 -16.878 1.105 0.354 1.00 0.00 H new ATOM 365 N ILE A 27 -12.612 -4.794 -3.400 1.00 0.00 N ATOM 366 CA ILE A 27 -11.564 -5.312 -4.287 1.00 0.00 C ATOM 367 C ILE A 27 -10.289 -4.452 -4.251 1.00 0.00 C ATOM 368 O ILE A 27 -10.123 -3.539 -5.062 1.00 0.00 O ATOM 369 CB ILE A 27 -12.096 -5.441 -5.739 1.00 0.00 C ATOM 370 CG1 ILE A 27 -12.929 -4.240 -6.239 1.00 0.00 C ATOM 371 CG2 ILE A 27 -12.890 -6.743 -5.896 1.00 0.00 C ATOM 372 CD1 ILE A 27 -12.793 -3.996 -7.746 1.00 0.00 C ATOM 0 H ILE A 27 -13.420 -4.459 -3.925 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.292 -6.301 -3.920 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.209 -5.455 -6.372 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -13.979 -4.409 -5.998 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.619 -3.343 -5.703 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -13.259 -6.823 -6.919 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.243 -7.592 -5.676 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -13.733 -6.740 -5.205 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -13.403 -3.139 -8.032 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -11.749 -3.796 -7.990 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -13.130 -4.879 -8.289 1.00 0.00 H new ATOM 384 N LYS A 28 -9.375 -4.717 -3.313 1.00 0.00 N ATOM 385 CA LYS A 28 -8.122 -3.961 -3.248 1.00 0.00 C ATOM 386 C LYS A 28 -7.258 -4.276 -4.472 1.00 0.00 C ATOM 387 O LYS A 28 -7.219 -5.433 -4.911 1.00 0.00 O ATOM 388 CB LYS A 28 -7.312 -4.225 -1.968 1.00 0.00 C ATOM 389 CG LYS A 28 -8.112 -4.325 -0.657 1.00 0.00 C ATOM 390 CD LYS A 28 -8.386 -5.792 -0.310 1.00 0.00 C ATOM 391 CE LYS A 28 -9.006 -5.952 1.079 1.00 0.00 C ATOM 392 NZ LYS A 28 -10.400 -6.387 0.955 1.00 0.00 N ATOM 0 H LYS A 28 -9.476 -5.438 -2.599 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.400 -2.907 -3.235 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.757 -5.154 -2.101 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.577 -3.428 -1.859 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.557 -3.851 0.152 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -9.054 -3.786 -0.756 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -9.055 -6.221 -1.056 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -7.454 -6.355 -0.357 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.439 -6.680 1.658 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.957 -5.007 1.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.865 -6.331 1.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -10.897 -5.770 0.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.428 -7.368 0.612 1.00 0.00 H new ATOM 406 N SER A 29 -6.523 -3.289 -4.981 1.00 0.00 N ATOM 407 CA SER A 29 -5.513 -3.448 -6.001 1.00 0.00 C ATOM 408 C SER A 29 -4.449 -2.389 -5.733 1.00 0.00 C ATOM 409 O SER A 29 -4.791 -1.216 -5.554 1.00 0.00 O ATOM 410 CB SER A 29 -6.160 -3.210 -7.364 1.00 0.00 C ATOM 411 OG SER A 29 -6.958 -4.301 -7.780 1.00 0.00 O ATOM 0 H SER A 29 -6.626 -2.321 -4.675 1.00 0.00 H new ATOM 0 HA SER A 29 -5.072 -4.445 -5.990 1.00 0.00 H new ATOM 0 HB2 SER A 29 -6.774 -2.310 -7.320 1.00 0.00 H new ATOM 0 HB3 SER A 29 -5.382 -3.029 -8.106 1.00 0.00 H new ATOM 0 HG SER A 29 -7.096 -4.911 -7.026 1.00 0.00 H new ATOM 417 N VAL A 30 -3.172 -2.774 -5.691 1.00 0.00 N ATOM 418 CA VAL A 30 -2.057 -1.837 -5.539 1.00 0.00 C ATOM 419 C VAL A 30 -0.906 -2.308 -6.453 1.00 0.00 C ATOM 420 O VAL A 30 -0.958 -3.424 -6.966 1.00 0.00 O ATOM 421 CB VAL A 30 -1.642 -1.714 -4.051 1.00 0.00 C ATOM 422 CG1 VAL A 30 -0.975 -0.359 -3.771 1.00 0.00 C ATOM 423 CG2 VAL A 30 -2.777 -1.803 -3.017 1.00 0.00 C ATOM 0 H VAL A 30 -2.881 -3.749 -5.762 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.349 -0.833 -5.845 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.983 -2.573 -3.929 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.695 -0.302 -2.719 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.084 -0.257 -4.390 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.673 0.445 -4.005 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.363 -1.704 -2.013 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.495 -1.002 -3.195 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -3.278 -2.766 -3.109 1.00 0.00 H new ATOM 433 N VAL A 31 0.106 -1.471 -6.710 1.00 0.00 N ATOM 434 CA VAL A 31 1.002 -1.542 -7.862 1.00 0.00 C ATOM 435 C VAL A 31 2.459 -1.195 -7.450 1.00 0.00 C ATOM 436 O VAL A 31 3.041 -0.273 -8.021 1.00 0.00 O ATOM 437 CB VAL A 31 0.436 -0.548 -8.928 1.00 0.00 C ATOM 438 CG1 VAL A 31 1.173 -0.600 -10.279 1.00 0.00 C ATOM 439 CG2 VAL A 31 -1.078 -0.653 -9.207 1.00 0.00 C ATOM 0 H VAL A 31 0.330 -0.692 -6.091 1.00 0.00 H new ATOM 0 HA VAL A 31 1.043 -2.550 -8.275 1.00 0.00 H new ATOM 0 HB VAL A 31 0.618 0.409 -8.440 1.00 0.00 H new ATOM 0 HG11 VAL A 31 0.724 0.117 -10.966 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.224 -0.351 -10.130 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.094 -1.603 -10.698 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.361 0.082 -9.961 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.313 -1.654 -9.569 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.632 -0.461 -8.288 1.00 0.00 H new ATOM 449 N VAL A 32 3.064 -1.819 -6.428 1.00 0.00 N ATOM 450 CA VAL A 32 4.357 -1.347 -5.912 1.00 0.00 C ATOM 451 C VAL A 32 5.462 -1.518 -6.951 1.00 0.00 C ATOM 452 O VAL A 32 5.606 -2.566 -7.587 1.00 0.00 O ATOM 453 CB VAL A 32 4.718 -1.917 -4.524 1.00 0.00 C ATOM 454 CG1 VAL A 32 4.962 -3.420 -4.546 1.00 0.00 C ATOM 455 CG2 VAL A 32 5.912 -1.190 -3.888 1.00 0.00 C ATOM 0 H VAL A 32 2.687 -2.637 -5.950 1.00 0.00 H new ATOM 0 HA VAL A 32 4.253 -0.276 -5.735 1.00 0.00 H new ATOM 0 HB VAL A 32 3.841 -1.737 -3.902 1.00 0.00 H new ATOM 0 HG11 VAL A 32 5.212 -3.763 -3.542 1.00 0.00 H new ATOM 0 HG12 VAL A 32 4.062 -3.930 -4.890 1.00 0.00 H new ATOM 0 HG13 VAL A 32 5.787 -3.645 -5.222 1.00 0.00 H new ATOM 0 HG21 VAL A 32 6.127 -1.627 -2.913 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.785 -1.292 -4.532 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.672 -0.134 -3.767 1.00 0.00 H new ATOM 465 N VAL A 33 6.278 -0.475 -7.074 1.00 0.00 N ATOM 466 CA VAL A 33 7.494 -0.453 -7.861 1.00 0.00 C ATOM 467 C VAL A 33 8.645 -0.209 -6.881 1.00 0.00 C ATOM 468 O VAL A 33 8.447 0.482 -5.880 1.00 0.00 O ATOM 469 CB VAL A 33 7.384 0.653 -8.936 1.00 0.00 C ATOM 470 CG1 VAL A 33 8.651 0.743 -9.793 1.00 0.00 C ATOM 471 CG2 VAL A 33 6.179 0.437 -9.866 1.00 0.00 C ATOM 0 H VAL A 33 6.097 0.413 -6.606 1.00 0.00 H new ATOM 0 HA VAL A 33 7.667 -1.389 -8.392 1.00 0.00 H new ATOM 0 HB VAL A 33 7.250 1.585 -8.387 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.533 1.532 -10.536 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.506 0.970 -9.156 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.817 -0.209 -10.298 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.142 1.238 -10.605 1.00 0.00 H new ATOM 0 HG22 VAL A 33 6.279 -0.522 -10.375 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.261 0.442 -9.279 1.00 0.00 H new ATOM 481 N ALA A 34 9.835 -0.754 -7.155 1.00 0.00 N ATOM 482 CA ALA A 34 11.055 -0.458 -6.415 1.00 0.00 C ATOM 483 C ALA A 34 12.235 -0.512 -7.380 1.00 0.00 C ATOM 484 O ALA A 34 12.354 -1.460 -8.164 1.00 0.00 O ATOM 485 CB ALA A 34 11.258 -1.460 -5.275 1.00 0.00 C ATOM 0 H ALA A 34 9.974 -1.424 -7.911 1.00 0.00 H new ATOM 0 HA ALA A 34 10.978 0.536 -5.974 1.00 0.00 H new ATOM 0 HB1 ALA A 34 12.175 -1.219 -4.737 1.00 0.00 H new ATOM 0 HB2 ALA A 34 10.411 -1.409 -4.590 1.00 0.00 H new ATOM 0 HB3 ALA A 34 11.332 -2.467 -5.685 1.00 0.00 H new ATOM 491 N ASN A 35 13.103 0.497 -7.301 1.00 0.00 N ATOM 492 CA ASN A 35 14.273 0.668 -8.155 1.00 0.00 C ATOM 493 C ASN A 35 15.516 0.257 -7.381 1.00 0.00 C ATOM 494 O ASN A 35 16.178 1.095 -6.763 1.00 0.00 O ATOM 495 CB ASN A 35 14.384 2.135 -8.585 1.00 0.00 C ATOM 496 CG ASN A 35 15.473 2.430 -9.619 1.00 0.00 C ATOM 497 OD1 ASN A 35 16.477 1.727 -9.746 1.00 0.00 O ATOM 498 ND2 ASN A 35 15.332 3.520 -10.351 1.00 0.00 N ATOM 0 H ASN A 35 13.004 1.244 -6.614 1.00 0.00 H new ATOM 0 HA ASN A 35 14.177 0.045 -9.045 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.424 2.451 -8.992 1.00 0.00 H new ATOM 0 HB3 ASN A 35 14.571 2.743 -7.700 1.00 0.00 H new ATOM 0 HD21 ASN A 35 16.054 3.781 -11.022 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.501 4.101 -10.245 1.00 0.00 H new ATOM 505 N GLY A 36 15.848 -1.024 -7.387 1.00 0.00 N ATOM 506 CA GLY A 36 17.170 -1.494 -7.017 1.00 0.00 C ATOM 507 C GLY A 36 17.070 -2.781 -6.219 1.00 0.00 C ATOM 508 O GLY A 36 17.214 -3.875 -6.769 1.00 0.00 O ATOM 0 H GLY A 36 15.203 -1.769 -7.650 1.00 0.00 H new ATOM 0 HA2 GLY A 36 17.768 -1.660 -7.913 1.00 0.00 H new ATOM 0 HA3 GLY A 36 17.682 -0.733 -6.429 1.00 0.00 H new ATOM 512 N THR A 37 16.742 -2.629 -4.943 1.00 0.00 N ATOM 513 CA THR A 37 16.553 -3.735 -4.009 1.00 0.00 C ATOM 514 C THR A 37 15.196 -4.407 -4.262 1.00 0.00 C ATOM 515 O THR A 37 14.429 -3.991 -5.144 1.00 0.00 O ATOM 516 CB THR A 37 16.751 -3.221 -2.572 1.00 0.00 C ATOM 517 OG1 THR A 37 16.832 -4.245 -1.614 1.00 0.00 O ATOM 518 CG2 THR A 37 15.618 -2.309 -2.123 1.00 0.00 C ATOM 0 H THR A 37 16.596 -1.714 -4.517 1.00 0.00 H new ATOM 0 HA THR A 37 17.299 -4.515 -4.163 1.00 0.00 H new ATOM 0 HB THR A 37 17.697 -2.683 -2.622 1.00 0.00 H new ATOM 0 HG1 THR A 37 17.748 -4.301 -1.271 1.00 0.00 H new ATOM 0 HG21 THR A 37 15.804 -1.973 -1.103 1.00 0.00 H new ATOM 0 HG22 THR A 37 15.562 -1.445 -2.785 1.00 0.00 H new ATOM 0 HG23 THR A 37 14.675 -2.855 -2.159 1.00 0.00 H new ATOM 526 N GLN A 38 14.899 -5.443 -3.482 1.00 0.00 N ATOM 527 CA GLN A 38 13.624 -6.137 -3.475 1.00 0.00 C ATOM 528 C GLN A 38 12.716 -5.617 -2.358 1.00 0.00 C ATOM 529 O GLN A 38 13.124 -4.851 -1.480 1.00 0.00 O ATOM 530 CB GLN A 38 13.886 -7.650 -3.383 1.00 0.00 C ATOM 531 CG GLN A 38 13.955 -8.219 -4.807 1.00 0.00 C ATOM 532 CD GLN A 38 14.287 -9.705 -4.871 1.00 0.00 C ATOM 533 OE1 GLN A 38 15.068 -10.153 -5.706 1.00 0.00 O ATOM 534 NE2 GLN A 38 13.685 -10.525 -4.031 1.00 0.00 N ATOM 0 H GLN A 38 15.566 -5.832 -2.816 1.00 0.00 H new ATOM 0 HA GLN A 38 13.086 -5.941 -4.402 1.00 0.00 H new ATOM 0 HB2 GLN A 38 14.819 -7.841 -2.853 1.00 0.00 H new ATOM 0 HB3 GLN A 38 13.092 -8.138 -2.818 1.00 0.00 H new ATOM 0 HG2 GLN A 38 12.998 -8.051 -5.300 1.00 0.00 H new ATOM 0 HG3 GLN A 38 14.706 -7.666 -5.371 1.00 0.00 H new ATOM 0 HE21 GLN A 38 13.036 -10.157 -3.336 1.00 0.00 H new ATOM 0 HE22 GLN A 38 13.869 -11.527 -4.077 1.00 0.00 H new ATOM 543 N LEU A 39 11.449 -6.018 -2.435 1.00 0.00 N ATOM 544 CA LEU A 39 10.408 -5.724 -1.454 1.00 0.00 C ATOM 545 C LEU A 39 10.472 -6.749 -0.325 1.00 0.00 C ATOM 546 O LEU A 39 11.183 -7.740 -0.446 1.00 0.00 O ATOM 547 CB LEU A 39 9.041 -5.766 -2.166 1.00 0.00 C ATOM 548 CG LEU A 39 8.354 -4.414 -2.421 1.00 0.00 C ATOM 549 CD1 LEU A 39 7.517 -3.968 -1.220 1.00 0.00 C ATOM 550 CD2 LEU A 39 9.334 -3.304 -2.808 1.00 0.00 C ATOM 0 H LEU A 39 11.106 -6.579 -3.214 1.00 0.00 H new ATOM 0 HA LEU A 39 10.553 -4.734 -1.021 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.172 -6.267 -3.125 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.367 -6.384 -1.573 1.00 0.00 H new ATOM 0 HG LEU A 39 7.695 -4.582 -3.273 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.048 -3.009 -1.439 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.746 -4.711 -1.018 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.160 -3.866 -0.346 1.00 0.00 H new ATOM 0 HD21 LEU A 39 8.786 -2.376 -2.974 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.056 -3.160 -2.004 1.00 0.00 H new ATOM 0 HD23 LEU A 39 9.859 -3.584 -3.721 1.00 0.00 H new ATOM 562 N LYS A 40 9.761 -6.514 0.784 1.00 0.00 N ATOM 563 CA LYS A 40 9.579 -7.449 1.902 1.00 0.00 C ATOM 564 C LYS A 40 8.132 -7.428 2.349 1.00 0.00 C ATOM 565 O LYS A 40 7.592 -6.357 2.648 1.00 0.00 O ATOM 566 CB LYS A 40 10.506 -7.158 3.088 1.00 0.00 C ATOM 567 CG LYS A 40 10.413 -8.147 4.255 1.00 0.00 C ATOM 568 CD LYS A 40 11.442 -7.750 5.324 1.00 0.00 C ATOM 569 CE LYS A 40 11.365 -8.703 6.518 1.00 0.00 C ATOM 570 NZ LYS A 40 12.101 -8.185 7.692 1.00 0.00 N ATOM 0 H LYS A 40 9.276 -5.629 0.934 1.00 0.00 H new ATOM 0 HA LYS A 40 9.847 -8.441 1.539 1.00 0.00 H new ATOM 0 HB2 LYS A 40 11.535 -7.143 2.728 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.285 -6.159 3.463 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.408 -8.139 4.677 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.604 -9.162 3.906 1.00 0.00 H new ATOM 0 HD2 LYS A 40 12.445 -7.771 4.898 1.00 0.00 H new ATOM 0 HD3 LYS A 40 11.257 -6.728 5.654 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.321 -8.863 6.787 1.00 0.00 H new ATOM 0 HE3 LYS A 40 11.773 -9.673 6.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.022 -8.862 8.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 13.103 -8.057 7.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 11.696 -7.272 7.980 1.00 0.00 H new ATOM 584 N ASP A 41 7.559 -8.619 2.422 1.00 0.00 N ATOM 585 CA ASP A 41 6.146 -8.887 2.538 1.00 0.00 C ATOM 586 C ASP A 41 5.771 -9.001 4.008 1.00 0.00 C ATOM 587 O ASP A 41 6.220 -9.930 4.676 1.00 0.00 O ATOM 588 CB ASP A 41 5.821 -10.160 1.735 1.00 0.00 C ATOM 589 CG ASP A 41 4.339 -10.089 1.374 1.00 0.00 C ATOM 590 OD1 ASP A 41 4.002 -9.265 0.484 1.00 0.00 O ATOM 591 OD2 ASP A 41 3.494 -10.743 2.025 1.00 0.00 O ATOM 0 H ASP A 41 8.111 -9.476 2.400 1.00 0.00 H new ATOM 0 HA ASP A 41 5.552 -8.072 2.123 1.00 0.00 H new ATOM 0 HB2 ASP A 41 6.435 -10.217 0.836 1.00 0.00 H new ATOM 0 HB3 ASP A 41 6.033 -11.053 2.323 1.00 0.00 H new ATOM 596 N GLY A 42 5.022 -8.040 4.563 1.00 0.00 N ATOM 597 CA GLY A 42 4.802 -7.937 6.004 1.00 0.00 C ATOM 598 C GLY A 42 4.177 -9.183 6.644 1.00 0.00 C ATOM 599 O GLY A 42 4.342 -9.390 7.848 1.00 0.00 O ATOM 0 H GLY A 42 4.553 -7.313 4.022 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.756 -7.734 6.491 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.156 -7.081 6.200 1.00 0.00 H new ATOM 603 N ALA A 43 3.474 -10.016 5.875 1.00 0.00 N ATOM 604 CA ALA A 43 2.892 -11.280 6.313 1.00 0.00 C ATOM 605 C ALA A 43 3.956 -12.248 6.853 1.00 0.00 C ATOM 606 O ALA A 43 3.885 -12.700 7.999 1.00 0.00 O ATOM 607 CB ALA A 43 2.143 -11.884 5.122 1.00 0.00 C ATOM 0 H ALA A 43 3.289 -9.818 4.892 1.00 0.00 H new ATOM 0 HA ALA A 43 2.206 -11.100 7.141 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.695 -12.833 5.417 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.360 -11.198 4.799 1.00 0.00 H new ATOM 0 HB3 ALA A 43 2.840 -12.052 4.301 1.00 0.00 H new ATOM 613 N THR A 44 4.958 -12.565 6.039 1.00 0.00 N ATOM 614 CA THR A 44 5.881 -13.687 6.220 1.00 0.00 C ATOM 615 C THR A 44 7.339 -13.213 6.197 1.00 0.00 C ATOM 616 O THR A 44 8.272 -14.002 6.356 1.00 0.00 O ATOM 617 CB THR A 44 5.570 -14.737 5.134 1.00 0.00 C ATOM 618 OG1 THR A 44 5.304 -14.107 3.902 1.00 0.00 O ATOM 619 CG2 THR A 44 4.314 -15.533 5.496 1.00 0.00 C ATOM 0 H THR A 44 5.160 -12.025 5.198 1.00 0.00 H new ATOM 0 HA THR A 44 5.743 -14.146 7.199 1.00 0.00 H new ATOM 0 HB THR A 44 6.439 -15.391 5.063 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.643 -14.664 3.170 1.00 0.00 H new ATOM 0 HG21 THR A 44 4.112 -16.268 4.717 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.468 -16.044 6.446 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.466 -14.854 5.583 1.00 0.00 H new ATOM 627 N GLY A 45 7.555 -11.908 6.027 1.00 0.00 N ATOM 628 CA GLY A 45 8.854 -11.277 5.950 1.00 0.00 C ATOM 629 C GLY A 45 9.694 -11.832 4.814 1.00 0.00 C ATOM 630 O GLY A 45 10.917 -11.804 4.919 1.00 0.00 O ATOM 0 H GLY A 45 6.789 -11.241 5.936 1.00 0.00 H new ATOM 0 HA2 GLY A 45 8.727 -10.203 5.815 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.382 -11.419 6.893 1.00 0.00 H new ATOM 634 N GLU A 46 9.069 -12.421 3.799 1.00 0.00 N ATOM 635 CA GLU A 46 9.743 -12.880 2.602 1.00 0.00 C ATOM 636 C GLU A 46 9.976 -11.707 1.677 1.00 0.00 C ATOM 637 O GLU A 46 9.280 -10.699 1.788 1.00 0.00 O ATOM 638 CB GLU A 46 8.931 -13.976 1.938 1.00 0.00 C ATOM 639 CG GLU A 46 7.521 -13.657 1.486 1.00 0.00 C ATOM 640 CD GLU A 46 6.884 -14.988 1.079 1.00 0.00 C ATOM 641 OE1 GLU A 46 6.407 -15.693 2.003 1.00 0.00 O ATOM 642 OE2 GLU A 46 7.025 -15.413 -0.090 1.00 0.00 O ATOM 0 H GLU A 46 8.064 -12.593 3.791 1.00 0.00 H new ATOM 0 HA GLU A 46 10.714 -13.305 2.858 1.00 0.00 H new ATOM 0 HB2 GLU A 46 9.489 -14.320 1.067 1.00 0.00 H new ATOM 0 HB3 GLU A 46 8.875 -14.814 2.632 1.00 0.00 H new ATOM 0 HG2 GLU A 46 6.954 -13.185 2.288 1.00 0.00 H new ATOM 0 HG3 GLU A 46 7.530 -12.959 0.649 1.00 0.00 H new ATOM 649 N SER A 47 10.939 -11.829 0.771 1.00 0.00 N ATOM 650 CA SER A 47 11.426 -10.693 0.021 1.00 0.00 C ATOM 651 C SER A 47 11.157 -10.888 -1.459 1.00 0.00 C ATOM 652 O SER A 47 11.771 -11.708 -2.137 1.00 0.00 O ATOM 653 CB SER A 47 12.886 -10.423 0.309 1.00 0.00 C ATOM 654 OG SER A 47 13.162 -10.446 1.704 1.00 0.00 O ATOM 0 H SER A 47 11.396 -12.712 0.542 1.00 0.00 H new ATOM 0 HA SER A 47 10.882 -9.805 0.343 1.00 0.00 H new ATOM 0 HB2 SER A 47 13.500 -11.169 -0.195 1.00 0.00 H new ATOM 0 HB3 SER A 47 13.164 -9.452 -0.101 1.00 0.00 H new ATOM 0 HG SER A 47 14.115 -10.269 1.852 1.00 0.00 H new ATOM 660 N LEU A 48 10.179 -10.149 -1.945 1.00 0.00 N ATOM 661 CA LEU A 48 9.521 -10.367 -3.228 1.00 0.00 C ATOM 662 C LEU A 48 10.160 -9.541 -4.343 1.00 0.00 C ATOM 663 O LEU A 48 10.843 -8.544 -4.097 1.00 0.00 O ATOM 664 CB LEU A 48 8.015 -10.079 -3.118 1.00 0.00 C ATOM 665 CG LEU A 48 7.279 -10.905 -2.044 1.00 0.00 C ATOM 666 CD1 LEU A 48 5.778 -10.644 -2.175 1.00 0.00 C ATOM 667 CD2 LEU A 48 7.542 -12.414 -2.132 1.00 0.00 C ATOM 0 H LEU A 48 9.803 -9.347 -1.440 1.00 0.00 H new ATOM 0 HA LEU A 48 9.653 -11.416 -3.493 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.876 -9.020 -2.901 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.551 -10.270 -4.085 1.00 0.00 H new ATOM 0 HG LEU A 48 7.663 -10.585 -1.075 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.241 -11.221 -1.422 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.579 -9.582 -2.028 1.00 0.00 H new ATOM 0 HD13 LEU A 48 5.442 -10.942 -3.168 1.00 0.00 H new ATOM 0 HD21 LEU A 48 6.990 -12.926 -1.344 1.00 0.00 H new ATOM 0 HD22 LEU A 48 7.215 -12.784 -3.104 1.00 0.00 H new ATOM 0 HD23 LEU A 48 8.608 -12.605 -2.011 1.00 0.00 H new ATOM 679 N ALA A 49 9.925 -9.979 -5.579 1.00 0.00 N ATOM 680 CA ALA A 49 10.522 -9.488 -6.805 1.00 0.00 C ATOM 681 C ALA A 49 9.616 -8.410 -7.395 1.00 0.00 C ATOM 682 O ALA A 49 8.648 -8.706 -8.096 1.00 0.00 O ATOM 683 CB ALA A 49 10.699 -10.662 -7.779 1.00 0.00 C ATOM 0 H ALA A 49 9.267 -10.738 -5.754 1.00 0.00 H new ATOM 0 HA ALA A 49 11.502 -9.051 -6.613 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.148 -10.302 -8.705 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.348 -11.413 -7.329 1.00 0.00 H new ATOM 0 HB3 ALA A 49 9.727 -11.105 -7.995 1.00 0.00 H new ATOM 689 N SER A 50 9.924 -7.154 -7.098 1.00 0.00 N ATOM 690 CA SER A 50 9.274 -5.995 -7.688 1.00 0.00 C ATOM 691 C SER A 50 9.421 -5.986 -9.223 1.00 0.00 C ATOM 692 O SER A 50 10.291 -6.688 -9.752 1.00 0.00 O ATOM 693 CB SER A 50 9.905 -4.749 -7.051 1.00 0.00 C ATOM 694 OG SER A 50 11.321 -4.739 -7.176 1.00 0.00 O ATOM 0 H SER A 50 10.650 -6.909 -6.424 1.00 0.00 H new ATOM 0 HA SER A 50 8.202 -6.018 -7.492 1.00 0.00 H new ATOM 0 HB2 SER A 50 9.494 -3.855 -7.521 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.635 -4.707 -5.996 1.00 0.00 H new ATOM 0 HG SER A 50 11.625 -3.830 -7.381 1.00 0.00 H new ATOM 700 N PRO A 51 8.676 -5.131 -9.945 1.00 0.00 N ATOM 701 CA PRO A 51 7.452 -4.458 -9.515 1.00 0.00 C ATOM 702 C PRO A 51 6.271 -5.439 -9.578 1.00 0.00 C ATOM 703 O PRO A 51 6.206 -6.272 -10.483 1.00 0.00 O ATOM 704 CB PRO A 51 7.292 -3.314 -10.516 1.00 0.00 C ATOM 705 CG PRO A 51 7.863 -3.882 -11.814 1.00 0.00 C ATOM 706 CD PRO A 51 8.957 -4.834 -11.343 1.00 0.00 C ATOM 0 HA PRO A 51 7.489 -4.094 -8.488 1.00 0.00 H new ATOM 0 HB2 PRO A 51 6.247 -3.026 -10.631 1.00 0.00 H new ATOM 0 HB3 PRO A 51 7.834 -2.424 -10.196 1.00 0.00 H new ATOM 0 HG2 PRO A 51 7.100 -4.404 -12.392 1.00 0.00 H new ATOM 0 HG3 PRO A 51 8.265 -3.095 -12.453 1.00 0.00 H new ATOM 0 HD2 PRO A 51 8.960 -5.746 -11.940 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.941 -4.378 -11.452 1.00 0.00 H new ATOM 714 N VAL A 52 5.309 -5.338 -8.661 1.00 0.00 N ATOM 715 CA VAL A 52 4.244 -6.332 -8.506 1.00 0.00 C ATOM 716 C VAL A 52 2.899 -5.632 -8.343 1.00 0.00 C ATOM 717 O VAL A 52 2.844 -4.467 -7.936 1.00 0.00 O ATOM 718 CB VAL A 52 4.604 -7.295 -7.349 1.00 0.00 C ATOM 719 CG1 VAL A 52 4.611 -6.587 -5.994 1.00 0.00 C ATOM 720 CG2 VAL A 52 3.686 -8.518 -7.227 1.00 0.00 C ATOM 0 H VAL A 52 5.245 -4.562 -8.002 1.00 0.00 H new ATOM 0 HA VAL A 52 4.151 -6.948 -9.401 1.00 0.00 H new ATOM 0 HB VAL A 52 5.603 -7.643 -7.613 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.869 -7.301 -5.212 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.346 -5.783 -6.008 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.623 -6.172 -5.795 1.00 0.00 H new ATOM 0 HG21 VAL A 52 4.013 -9.136 -6.391 1.00 0.00 H new ATOM 0 HG22 VAL A 52 2.661 -8.188 -7.056 1.00 0.00 H new ATOM 0 HG23 VAL A 52 3.731 -9.100 -8.148 1.00 0.00 H new ATOM 730 N ILE A 53 1.823 -6.346 -8.663 1.00 0.00 N ATOM 731 CA ILE A 53 0.452 -5.907 -8.495 1.00 0.00 C ATOM 732 C ILE A 53 -0.161 -6.819 -7.441 1.00 0.00 C ATOM 733 O ILE A 53 -0.096 -8.040 -7.549 1.00 0.00 O ATOM 734 CB ILE A 53 -0.314 -5.973 -9.832 1.00 0.00 C ATOM 735 CG1 ILE A 53 0.401 -5.248 -10.991 1.00 0.00 C ATOM 736 CG2 ILE A 53 -1.749 -5.434 -9.682 1.00 0.00 C ATOM 737 CD1 ILE A 53 0.810 -3.804 -10.695 1.00 0.00 C ATOM 0 H ILE A 53 1.892 -7.282 -9.062 1.00 0.00 H new ATOM 0 HA ILE A 53 0.401 -4.866 -8.175 1.00 0.00 H new ATOM 0 HB ILE A 53 -0.349 -7.031 -10.093 1.00 0.00 H new ATOM 0 HG12 ILE A 53 1.293 -5.815 -11.259 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -0.254 -5.253 -11.862 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.262 -5.494 -10.642 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.287 -6.031 -8.945 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -1.715 -4.395 -9.353 1.00 0.00 H new ATOM 0 HD11 ILE A 53 1.305 -3.380 -11.569 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.077 -3.216 -10.459 1.00 0.00 H new ATOM 0 HD13 ILE A 53 1.494 -3.786 -9.846 1.00 0.00 H new ATOM 749 N LEU A 54 -0.732 -6.200 -6.422 1.00 0.00 N ATOM 750 CA LEU A 54 -1.395 -6.790 -5.269 1.00 0.00 C ATOM 751 C LEU A 54 -2.899 -6.934 -5.535 1.00 0.00 C ATOM 752 O LEU A 54 -3.440 -6.342 -6.476 1.00 0.00 O ATOM 753 CB LEU A 54 -1.068 -5.895 -4.071 1.00 0.00 C ATOM 754 CG LEU A 54 0.408 -5.984 -3.626 1.00 0.00 C ATOM 755 CD1 LEU A 54 0.655 -5.118 -2.388 1.00 0.00 C ATOM 756 CD2 LEU A 54 0.850 -7.415 -3.293 1.00 0.00 C ATOM 0 H LEU A 54 -0.745 -5.181 -6.375 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.044 -7.801 -5.062 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -1.302 -4.861 -4.324 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.710 -6.171 -3.234 1.00 0.00 H new ATOM 0 HG LEU A 54 0.991 -5.628 -4.475 1.00 0.00 H new ATOM 0 HD11 LEU A 54 1.701 -5.196 -2.092 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.419 -4.079 -2.618 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.020 -5.462 -1.571 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.896 -7.411 -2.987 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.236 -7.806 -2.481 1.00 0.00 H new ATOM 0 HD23 LEU A 54 0.732 -8.046 -4.174 1.00 0.00 H new ATOM 768 N SER A 55 -3.564 -7.735 -4.703 1.00 0.00 N ATOM 769 CA SER A 55 -4.902 -8.281 -4.881 1.00 0.00 C ATOM 770 C SER A 55 -5.748 -8.102 -3.608 1.00 0.00 C ATOM 771 O SER A 55 -5.441 -7.302 -2.730 1.00 0.00 O ATOM 772 CB SER A 55 -4.765 -9.758 -5.304 1.00 0.00 C ATOM 773 OG SER A 55 -3.991 -10.511 -4.377 1.00 0.00 O ATOM 0 H SER A 55 -3.148 -8.039 -3.823 1.00 0.00 H new ATOM 0 HA SER A 55 -5.433 -7.740 -5.664 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.756 -10.202 -5.393 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.302 -9.811 -6.289 1.00 0.00 H new ATOM 0 HG SER A 55 -3.930 -11.441 -4.681 1.00 0.00 H new ATOM 779 N ASP A 56 -6.846 -8.834 -3.500 1.00 0.00 N ATOM 780 CA ASP A 56 -7.738 -8.899 -2.346 1.00 0.00 C ATOM 781 C ASP A 56 -7.258 -9.978 -1.361 1.00 0.00 C ATOM 782 O ASP A 56 -7.558 -9.920 -0.173 1.00 0.00 O ATOM 783 CB ASP A 56 -9.142 -9.207 -2.892 1.00 0.00 C ATOM 784 CG ASP A 56 -10.291 -9.149 -1.883 1.00 0.00 C ATOM 785 OD1 ASP A 56 -10.173 -8.515 -0.811 1.00 0.00 O ATOM 786 OD2 ASP A 56 -11.390 -9.627 -2.256 1.00 0.00 O ATOM 0 H ASP A 56 -7.160 -9.436 -4.261 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.749 -7.960 -1.793 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -9.358 -8.504 -3.697 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -9.126 -10.203 -3.335 1.00 0.00 H new ATOM 791 N GLU A 57 -6.455 -10.933 -1.842 1.00 0.00 N ATOM 792 CA GLU A 57 -5.934 -12.067 -1.074 1.00 0.00 C ATOM 793 C GLU A 57 -4.812 -11.650 -0.132 1.00 0.00 C ATOM 794 O GLU A 57 -4.717 -12.194 0.966 1.00 0.00 O ATOM 795 CB GLU A 57 -5.376 -13.115 -2.046 1.00 0.00 C ATOM 796 CG GLU A 57 -6.453 -13.868 -2.828 1.00 0.00 C ATOM 797 CD GLU A 57 -7.105 -14.959 -1.982 1.00 0.00 C ATOM 798 OE1 GLU A 57 -7.989 -14.649 -1.157 1.00 0.00 O ATOM 799 OE2 GLU A 57 -6.756 -16.145 -2.177 1.00 0.00 O ATOM 0 H GLU A 57 -6.139 -10.937 -2.812 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.755 -12.469 -0.480 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -4.706 -12.623 -2.751 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -4.778 -13.834 -1.486 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.215 -13.166 -3.167 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.011 -14.314 -3.719 1.00 0.00 H new ATOM 806 N GLU A 58 -3.968 -10.708 -0.560 1.00 0.00 N ATOM 807 CA GLU A 58 -2.812 -10.213 0.147 1.00 0.00 C ATOM 808 C GLU A 58 -3.207 -9.257 1.291 1.00 0.00 C ATOM 809 O GLU A 58 -2.579 -9.238 2.352 1.00 0.00 O ATOM 810 CB GLU A 58 -1.984 -9.582 -0.978 1.00 0.00 C ATOM 811 CG GLU A 58 -2.515 -8.256 -1.502 1.00 0.00 C ATOM 812 CD GLU A 58 -2.069 -6.983 -0.732 1.00 0.00 C ATOM 813 OE1 GLU A 58 -1.156 -7.027 0.125 1.00 0.00 O ATOM 814 OE2 GLU A 58 -2.570 -5.889 -1.084 1.00 0.00 O ATOM 0 H GLU A 58 -4.091 -10.252 -1.464 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.241 -10.973 0.680 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.966 -9.432 -0.619 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.929 -10.287 -1.807 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -2.208 -8.152 -2.543 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -3.604 -8.297 -1.494 1.00 0.00 H new ATOM 821 N LEU A 59 -4.309 -8.520 1.089 1.00 0.00 N ATOM 822 CA LEU A 59 -4.805 -7.499 2.014 1.00 0.00 C ATOM 823 C LEU A 59 -5.894 -8.035 2.960 1.00 0.00 C ATOM 824 O LEU A 59 -6.711 -7.272 3.473 1.00 0.00 O ATOM 825 CB LEU A 59 -5.205 -6.224 1.231 1.00 0.00 C ATOM 826 CG LEU A 59 -4.210 -5.067 1.430 1.00 0.00 C ATOM 827 CD1 LEU A 59 -4.471 -3.913 0.451 1.00 0.00 C ATOM 828 CD2 LEU A 59 -4.326 -4.489 2.831 1.00 0.00 C ATOM 0 H LEU A 59 -4.891 -8.622 0.258 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.997 -7.213 2.687 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -5.272 -6.461 0.169 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.197 -5.903 1.550 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.220 -5.488 1.258 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.747 -3.117 0.625 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.373 -4.275 -0.572 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.479 -3.527 0.604 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.613 -3.673 2.948 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.337 -4.113 2.987 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.111 -5.266 3.564 1.00 0.00 H new ATOM 840 N ALA A 60 -5.926 -9.345 3.208 1.00 0.00 N ATOM 841 CA ALA A 60 -6.889 -10.051 4.059 1.00 0.00 C ATOM 842 C ALA A 60 -6.606 -9.893 5.572 1.00 0.00 C ATOM 843 O ALA A 60 -6.841 -10.820 6.356 1.00 0.00 O ATOM 844 CB ALA A 60 -6.896 -11.526 3.641 1.00 0.00 C ATOM 0 H ALA A 60 -5.241 -9.980 2.797 1.00 0.00 H new ATOM 0 HA ALA A 60 -7.873 -9.605 3.912 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -7.605 -12.076 4.259 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -7.189 -11.606 2.594 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.899 -11.946 3.772 1.00 0.00 H new ATOM 850 N VAL A 61 -6.081 -8.740 5.990 1.00 0.00 N ATOM 851 CA VAL A 61 -5.710 -8.400 7.363 1.00 0.00 C ATOM 852 C VAL A 61 -6.305 -7.035 7.742 1.00 0.00 C ATOM 853 O VAL A 61 -7.193 -6.542 7.052 1.00 0.00 O ATOM 854 CB VAL A 61 -4.178 -8.467 7.542 1.00 0.00 C ATOM 855 CG1 VAL A 61 -3.652 -9.896 7.428 1.00 0.00 C ATOM 856 CG2 VAL A 61 -3.409 -7.580 6.560 1.00 0.00 C ATOM 0 H VAL A 61 -5.893 -7.975 5.342 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.130 -9.132 8.052 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.002 -8.088 8.549 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -2.570 -9.897 7.560 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -4.112 -10.516 8.198 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.898 -10.297 6.445 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.339 -7.677 6.743 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.632 -7.890 5.539 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.708 -6.541 6.697 1.00 0.00 H new ATOM 866 N GLU A 62 -5.866 -6.455 8.863 1.00 0.00 N ATOM 867 CA GLU A 62 -6.262 -5.133 9.341 1.00 0.00 C ATOM 868 C GLU A 62 -5.246 -4.035 8.997 1.00 0.00 C ATOM 869 O GLU A 62 -5.605 -2.858 8.925 1.00 0.00 O ATOM 870 CB GLU A 62 -6.539 -5.217 10.845 1.00 0.00 C ATOM 871 CG GLU A 62 -5.302 -5.505 11.708 1.00 0.00 C ATOM 872 CD GLU A 62 -5.600 -5.641 13.213 1.00 0.00 C ATOM 873 OE1 GLU A 62 -6.785 -5.703 13.621 1.00 0.00 O ATOM 874 OE2 GLU A 62 -4.626 -5.761 14.001 1.00 0.00 O ATOM 0 H GLU A 62 -5.199 -6.914 9.484 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.172 -4.837 8.820 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.983 -4.277 11.172 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.279 -5.998 11.022 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.834 -6.425 11.357 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.577 -4.704 11.563 1.00 0.00 H new ATOM 881 N LYS A 63 -3.978 -4.394 8.784 1.00 0.00 N ATOM 882 CA LYS A 63 -2.953 -3.494 8.271 1.00 0.00 C ATOM 883 C LYS A 63 -1.822 -4.317 7.692 1.00 0.00 C ATOM 884 O LYS A 63 -1.504 -5.356 8.281 1.00 0.00 O ATOM 885 CB LYS A 63 -2.465 -2.584 9.413 1.00 0.00 C ATOM 886 CG LYS A 63 -1.086 -1.933 9.209 1.00 0.00 C ATOM 887 CD LYS A 63 -0.776 -1.046 10.410 1.00 0.00 C ATOM 888 CE LYS A 63 0.534 -0.265 10.248 1.00 0.00 C ATOM 889 NZ LYS A 63 1.743 -1.106 10.392 1.00 0.00 N ATOM 0 H LYS A 63 -3.633 -5.336 8.968 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.354 -2.860 7.480 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.200 -1.793 9.561 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -2.437 -3.170 10.332 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -0.320 -2.700 9.099 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.080 -1.343 8.293 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -1.596 -0.344 10.559 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.718 -1.663 11.307 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.546 0.210 9.267 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.566 0.534 10.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 2.427 -0.627 11.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 1.481 -2.022 10.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.172 -1.261 9.457 1.00 0.00 H new ATOM 903 N VAL A 64 -1.142 -3.800 6.666 1.00 0.00 N ATOM 904 CA VAL A 64 0.140 -4.330 6.226 1.00 0.00 C ATOM 905 C VAL A 64 1.174 -3.188 6.296 1.00 0.00 C ATOM 906 O VAL A 64 0.842 -2.001 6.398 1.00 0.00 O ATOM 907 CB VAL A 64 0.052 -4.989 4.820 1.00 0.00 C ATOM 908 CG1 VAL A 64 1.139 -6.062 4.636 1.00 0.00 C ATOM 909 CG2 VAL A 64 -1.288 -5.657 4.479 1.00 0.00 C ATOM 0 H VAL A 64 -1.469 -3.003 6.120 1.00 0.00 H new ATOM 0 HA VAL A 64 0.457 -5.138 6.886 1.00 0.00 H new ATOM 0 HB VAL A 64 0.183 -4.141 4.147 1.00 0.00 H new ATOM 0 HG11 VAL A 64 1.050 -6.503 3.643 1.00 0.00 H new ATOM 0 HG12 VAL A 64 2.123 -5.605 4.743 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.015 -6.839 5.391 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -1.238 -6.083 3.477 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -1.494 -6.448 5.200 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -2.085 -4.914 4.518 1.00 0.00 H new ATOM 919 N THR A 65 2.444 -3.563 6.225 1.00 0.00 N ATOM 920 CA THR A 65 3.625 -2.733 6.094 1.00 0.00 C ATOM 921 C THR A 65 4.482 -3.400 5.015 1.00 0.00 C ATOM 922 O THR A 65 4.834 -4.575 5.158 1.00 0.00 O ATOM 923 CB THR A 65 4.382 -2.705 7.431 1.00 0.00 C ATOM 924 OG1 THR A 65 3.626 -2.129 8.486 1.00 0.00 O ATOM 925 CG2 THR A 65 5.696 -1.935 7.288 1.00 0.00 C ATOM 0 H THR A 65 2.692 -4.552 6.262 1.00 0.00 H new ATOM 0 HA THR A 65 3.378 -1.705 5.829 1.00 0.00 H new ATOM 0 HB THR A 65 4.576 -3.746 7.689 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.155 -2.139 9.311 1.00 0.00 H new ATOM 0 HG21 THR A 65 6.218 -1.926 8.245 1.00 0.00 H new ATOM 0 HG22 THR A 65 6.321 -2.419 6.538 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.486 -0.911 6.979 1.00 0.00 H new ATOM 933 N LEU A 66 4.838 -2.669 3.958 1.00 0.00 N ATOM 934 CA LEU A 66 5.739 -3.135 2.906 1.00 0.00 C ATOM 935 C LEU A 66 6.958 -2.226 2.925 1.00 0.00 C ATOM 936 O LEU A 66 6.809 -1.022 3.135 1.00 0.00 O ATOM 937 CB LEU A 66 5.044 -3.123 1.530 1.00 0.00 C ATOM 938 CG LEU A 66 4.028 -4.254 1.256 1.00 0.00 C ATOM 939 CD1 LEU A 66 4.615 -5.649 1.487 1.00 0.00 C ATOM 940 CD2 LEU A 66 2.758 -4.134 2.096 1.00 0.00 C ATOM 0 H LEU A 66 4.501 -1.718 3.807 1.00 0.00 H new ATOM 0 HA LEU A 66 6.036 -4.168 3.085 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.530 -2.169 1.417 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.814 -3.163 0.760 1.00 0.00 H new ATOM 0 HG LEU A 66 3.777 -4.133 0.202 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.855 -6.402 1.279 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.467 -5.800 0.824 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.941 -5.739 2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.085 -4.957 1.857 1.00 0.00 H new ATOM 0 HD22 LEU A 66 3.017 -4.172 3.154 1.00 0.00 H new ATOM 0 HD23 LEU A 66 2.265 -3.187 1.877 1.00 0.00 H new ATOM 952 N SER A 67 8.154 -2.788 2.733 1.00 0.00 N ATOM 953 CA SER A 67 9.413 -2.052 2.840 1.00 0.00 C ATOM 954 C SER A 67 10.430 -2.584 1.827 1.00 0.00 C ATOM 955 O SER A 67 10.109 -3.484 1.046 1.00 0.00 O ATOM 956 CB SER A 67 9.927 -2.100 4.292 1.00 0.00 C ATOM 957 OG SER A 67 10.967 -1.162 4.488 1.00 0.00 O ATOM 0 H SER A 67 8.275 -3.773 2.497 1.00 0.00 H new ATOM 0 HA SER A 67 9.250 -1.003 2.593 1.00 0.00 H new ATOM 0 HB2 SER A 67 9.108 -1.890 4.980 1.00 0.00 H new ATOM 0 HB3 SER A 67 10.287 -3.103 4.522 1.00 0.00 H new ATOM 0 HG SER A 67 11.278 -1.207 5.416 1.00 0.00 H new ATOM 963 N THR A 68 11.648 -2.047 1.849 1.00 0.00 N ATOM 964 CA THR A 68 12.795 -2.366 1.001 1.00 0.00 C ATOM 965 C THR A 68 13.901 -3.012 1.828 1.00 0.00 C ATOM 966 O THR A 68 14.186 -2.537 2.925 1.00 0.00 O ATOM 967 CB THR A 68 13.332 -1.084 0.369 1.00 0.00 C ATOM 968 OG1 THR A 68 13.119 0.068 1.169 1.00 0.00 O ATOM 969 CG2 THR A 68 12.650 -0.818 -0.971 1.00 0.00 C ATOM 0 H THR A 68 11.878 -1.313 2.519 1.00 0.00 H new ATOM 0 HA THR A 68 12.475 -3.061 0.225 1.00 0.00 H new ATOM 0 HB THR A 68 14.403 -1.250 0.256 1.00 0.00 H new ATOM 0 HG1 THR A 68 12.164 0.286 1.181 1.00 0.00 H new ATOM 0 HG21 THR A 68 13.046 0.100 -1.405 1.00 0.00 H new ATOM 0 HG22 THR A 68 12.840 -1.651 -1.648 1.00 0.00 H new ATOM 0 HG23 THR A 68 11.576 -0.713 -0.818 1.00 0.00 H new ATOM 977 N THR A 69 14.525 -4.084 1.325 1.00 0.00 N ATOM 978 CA THR A 69 15.453 -4.821 2.178 1.00 0.00 C ATOM 979 C THR A 69 16.762 -4.032 2.319 1.00 0.00 C ATOM 980 O THR A 69 17.312 -3.878 3.415 1.00 0.00 O ATOM 981 CB THR A 69 15.647 -6.297 1.739 1.00 0.00 C ATOM 982 OG1 THR A 69 16.557 -6.439 0.670 1.00 0.00 O ATOM 983 CG2 THR A 69 14.387 -7.062 1.329 1.00 0.00 C ATOM 0 H THR A 69 14.411 -4.445 0.378 1.00 0.00 H new ATOM 0 HA THR A 69 15.014 -4.908 3.172 1.00 0.00 H new ATOM 0 HB THR A 69 16.025 -6.733 2.664 1.00 0.00 H new ATOM 0 HG1 THR A 69 16.477 -5.670 0.068 1.00 0.00 H new ATOM 0 HG21 THR A 69 14.655 -8.079 1.044 1.00 0.00 H new ATOM 0 HG22 THR A 69 13.690 -7.091 2.167 1.00 0.00 H new ATOM 0 HG23 THR A 69 13.916 -6.561 0.483 1.00 0.00 H new ATOM 991 N GLY A 70 17.239 -3.486 1.198 1.00 0.00 N ATOM 992 CA GLY A 70 18.508 -2.785 1.090 1.00 0.00 C ATOM 993 C GLY A 70 18.254 -1.300 0.930 1.00 0.00 C ATOM 994 O GLY A 70 18.019 -0.576 1.894 1.00 0.00 O ATOM 0 H GLY A 70 16.731 -3.524 0.314 1.00 0.00 H new ATOM 0 HA2 GLY A 70 19.113 -2.967 1.978 1.00 0.00 H new ATOM 0 HA3 GLY A 70 19.072 -3.162 0.237 1.00 0.00 H new ATOM 998 N LYS A 71 18.303 -0.814 -0.301 1.00 0.00 N ATOM 999 CA LYS A 71 17.978 0.543 -0.694 1.00 0.00 C ATOM 1000 C LYS A 71 17.376 0.549 -2.089 1.00 0.00 C ATOM 1001 O LYS A 71 17.787 -0.232 -2.951 1.00 0.00 O ATOM 1002 CB LYS A 71 19.247 1.395 -0.634 1.00 0.00 C ATOM 1003 CG LYS A 71 20.438 0.884 -1.471 1.00 0.00 C ATOM 1004 CD LYS A 71 21.083 1.968 -2.343 1.00 0.00 C ATOM 1005 CE LYS A 71 20.224 2.435 -3.534 1.00 0.00 C ATOM 1006 NZ LYS A 71 20.858 2.079 -4.836 1.00 0.00 N ATOM 0 H LYS A 71 18.586 -1.390 -1.094 1.00 0.00 H new ATOM 0 HA LYS A 71 17.240 0.964 -0.012 1.00 0.00 H new ATOM 0 HB2 LYS A 71 19.001 2.404 -0.965 1.00 0.00 H new ATOM 0 HB3 LYS A 71 19.563 1.469 0.406 1.00 0.00 H new ATOM 0 HG2 LYS A 71 21.192 0.472 -0.801 1.00 0.00 H new ATOM 0 HG3 LYS A 71 20.099 0.069 -2.110 1.00 0.00 H new ATOM 0 HD2 LYS A 71 21.310 2.831 -1.717 1.00 0.00 H new ATOM 0 HD3 LYS A 71 22.032 1.591 -2.723 1.00 0.00 H new ATOM 0 HE2 LYS A 71 19.236 1.979 -3.472 1.00 0.00 H new ATOM 0 HE3 LYS A 71 20.081 3.514 -3.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 21.268 2.932 -5.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 21.608 1.377 -4.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 20.140 1.680 -5.474 1.00 0.00 H new ATOM 1020 N ALA A 72 16.467 1.477 -2.346 1.00 0.00 N ATOM 1021 CA ALA A 72 15.928 1.752 -3.665 1.00 0.00 C ATOM 1022 C ALA A 72 16.073 3.237 -3.962 1.00 0.00 C ATOM 1023 O ALA A 72 16.661 3.978 -3.168 1.00 0.00 O ATOM 1024 CB ALA A 72 14.469 1.292 -3.747 1.00 0.00 C ATOM 0 H ALA A 72 16.074 2.076 -1.620 1.00 0.00 H new ATOM 0 HA ALA A 72 16.483 1.196 -4.420 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.076 1.504 -4.741 1.00 0.00 H new ATOM 0 HB2 ALA A 72 14.414 0.220 -3.556 1.00 0.00 H new ATOM 0 HB3 ALA A 72 13.877 1.824 -3.002 1.00 0.00 H new ATOM 1030 N ILE A 73 15.591 3.646 -5.135 1.00 0.00 N ATOM 1031 CA ILE A 73 15.571 5.037 -5.561 1.00 0.00 C ATOM 1032 C ILE A 73 14.145 5.483 -5.896 1.00 0.00 C ATOM 1033 O ILE A 73 13.988 6.623 -6.294 1.00 0.00 O ATOM 1034 CB ILE A 73 16.497 5.267 -6.783 1.00 0.00 C ATOM 1035 CG1 ILE A 73 17.645 4.264 -6.953 1.00 0.00 C ATOM 1036 CG2 ILE A 73 17.125 6.669 -6.722 1.00 0.00 C ATOM 1037 CD1 ILE A 73 18.617 4.191 -5.778 1.00 0.00 C ATOM 0 H ILE A 73 15.198 3.006 -5.825 1.00 0.00 H new ATOM 0 HA ILE A 73 15.943 5.637 -4.731 1.00 0.00 H new ATOM 0 HB ILE A 73 15.831 5.137 -7.636 1.00 0.00 H new ATOM 0 HG12 ILE A 73 17.221 3.273 -7.116 1.00 0.00 H new ATOM 0 HG13 ILE A 73 18.204 4.523 -7.852 1.00 0.00 H new ATOM 0 HG21 ILE A 73 17.772 6.816 -7.587 1.00 0.00 H new ATOM 0 HG22 ILE A 73 16.336 7.421 -6.727 1.00 0.00 H new ATOM 0 HG23 ILE A 73 17.712 6.765 -5.809 1.00 0.00 H new ATOM 0 HD11 ILE A 73 19.392 3.455 -5.992 1.00 0.00 H new ATOM 0 HD12 ILE A 73 19.076 5.168 -5.624 1.00 0.00 H new ATOM 0 HD13 ILE A 73 18.078 3.898 -4.877 1.00 0.00 H new ATOM 1049 N GLU A 74 13.118 4.628 -5.780 1.00 0.00 N ATOM 1050 CA GLU A 74 11.740 5.001 -6.102 1.00 0.00 C ATOM 1051 C GLU A 74 10.763 4.219 -5.239 1.00 0.00 C ATOM 1052 O GLU A 74 11.096 3.114 -4.796 1.00 0.00 O ATOM 1053 CB GLU A 74 11.414 4.693 -7.572 1.00 0.00 C ATOM 1054 CG GLU A 74 12.126 5.662 -8.512 1.00 0.00 C ATOM 1055 CD GLU A 74 11.604 5.557 -9.943 1.00 0.00 C ATOM 1056 OE1 GLU A 74 10.391 5.735 -10.190 1.00 0.00 O ATOM 1057 OE2 GLU A 74 12.427 5.292 -10.847 1.00 0.00 O ATOM 0 H GLU A 74 13.222 3.665 -5.462 1.00 0.00 H new ATOM 0 HA GLU A 74 11.644 6.071 -5.916 1.00 0.00 H new ATOM 0 HB2 GLU A 74 11.711 3.671 -7.806 1.00 0.00 H new ATOM 0 HB3 GLU A 74 10.337 4.756 -7.729 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.992 6.682 -8.151 1.00 0.00 H new ATOM 0 HG3 GLU A 74 13.197 5.458 -8.501 1.00 0.00 H new ATOM 1064 N PHE A 75 9.547 4.748 -5.085 1.00 0.00 N ATOM 1065 CA PHE A 75 8.386 4.044 -4.553 1.00 0.00 C ATOM 1066 C PHE A 75 7.151 4.713 -5.141 1.00 0.00 C ATOM 1067 O PHE A 75 6.924 5.901 -4.911 1.00 0.00 O ATOM 1068 CB PHE A 75 8.382 4.100 -3.010 1.00 0.00 C ATOM 1069 CG PHE A 75 8.076 2.825 -2.229 1.00 0.00 C ATOM 1070 CD1 PHE A 75 8.486 1.565 -2.713 1.00 0.00 C ATOM 1071 CD2 PHE A 75 7.549 2.904 -0.922 1.00 0.00 C ATOM 1072 CE1 PHE A 75 8.397 0.416 -1.911 1.00 0.00 C ATOM 1073 CE2 PHE A 75 7.484 1.754 -0.120 1.00 0.00 C ATOM 1074 CZ PHE A 75 7.901 0.507 -0.604 1.00 0.00 C ATOM 0 H PHE A 75 9.340 5.714 -5.338 1.00 0.00 H new ATOM 0 HA PHE A 75 8.405 2.989 -4.826 1.00 0.00 H new ATOM 0 HB2 PHE A 75 9.361 4.456 -2.690 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.655 4.854 -2.709 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.875 1.483 -3.717 1.00 0.00 H new ATOM 0 HD2 PHE A 75 7.196 3.850 -0.539 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.712 -0.540 -2.303 1.00 0.00 H new ATOM 0 HE2 PHE A 75 7.106 1.832 0.889 1.00 0.00 H new ATOM 0 HZ PHE A 75 7.841 -0.371 0.022 1.00 0.00 H new ATOM 1084 N ALA A 76 6.368 3.970 -5.915 1.00 0.00 N ATOM 1085 CA ALA A 76 5.150 4.458 -6.537 1.00 0.00 C ATOM 1086 C ALA A 76 4.006 3.580 -6.069 1.00 0.00 C ATOM 1087 O ALA A 76 4.141 2.353 -6.108 1.00 0.00 O ATOM 1088 CB ALA A 76 5.298 4.393 -8.055 1.00 0.00 C ATOM 0 H ALA A 76 6.569 2.993 -6.130 1.00 0.00 H new ATOM 0 HA ALA A 76 4.954 5.494 -6.259 1.00 0.00 H new ATOM 0 HB1 ALA A 76 4.385 4.759 -8.526 1.00 0.00 H new ATOM 0 HB2 ALA A 76 6.140 5.012 -8.365 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.475 3.361 -8.359 1.00 0.00 H new ATOM 1094 N VAL A 77 2.880 4.177 -5.695 1.00 0.00 N ATOM 1095 CA VAL A 77 1.747 3.497 -5.087 1.00 0.00 C ATOM 1096 C VAL A 77 0.493 4.069 -5.743 1.00 0.00 C ATOM 1097 O VAL A 77 0.171 5.239 -5.548 1.00 0.00 O ATOM 1098 CB VAL A 77 1.760 3.701 -3.552 1.00 0.00 C ATOM 1099 CG1 VAL A 77 0.711 2.827 -2.845 1.00 0.00 C ATOM 1100 CG2 VAL A 77 3.126 3.385 -2.921 1.00 0.00 C ATOM 0 H VAL A 77 2.728 5.179 -5.811 1.00 0.00 H new ATOM 0 HA VAL A 77 1.785 2.419 -5.246 1.00 0.00 H new ATOM 0 HB VAL A 77 1.529 4.757 -3.411 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.756 3.003 -1.770 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.283 3.082 -3.213 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.915 1.776 -3.050 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.075 3.546 -1.844 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.387 2.346 -3.121 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.885 4.039 -3.350 1.00 0.00 H new ATOM 1110 N SER A 78 -0.225 3.253 -6.516 1.00 0.00 N ATOM 1111 CA SER A 78 -1.512 3.626 -7.094 1.00 0.00 C ATOM 1112 C SER A 78 -2.509 2.477 -6.944 1.00 0.00 C ATOM 1113 O SER A 78 -2.157 1.413 -6.430 1.00 0.00 O ATOM 1114 CB SER A 78 -1.345 4.016 -8.569 1.00 0.00 C ATOM 1115 OG SER A 78 -0.378 5.031 -8.734 1.00 0.00 O ATOM 0 H SER A 78 0.074 2.309 -6.759 1.00 0.00 H new ATOM 0 HA SER A 78 -1.901 4.491 -6.558 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.054 3.139 -9.147 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.301 4.356 -8.966 1.00 0.00 H new ATOM 0 HG SER A 78 -0.296 5.254 -9.685 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.749 2.669 -7.394 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.631 1.588 -7.807 1.00 0.00 C ATOM 1123 C GLY A 79 -6.080 2.036 -7.719 1.00 0.00 C ATOM 1124 O GLY A 79 -6.631 2.526 -8.712 1.00 0.00 O ATOM 0 H GLY A 79 -4.171 3.594 -7.481 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.397 1.286 -8.828 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.472 0.716 -7.173 1.00 0.00 H new ATOM 1128 N GLY A 80 -6.647 1.905 -6.520 1.00 0.00 N ATOM 1129 CA GLY A 80 -8.001 2.291 -6.133 1.00 0.00 C ATOM 1130 C GLY A 80 -8.783 1.022 -5.788 1.00 0.00 C ATOM 1131 O GLY A 80 -8.231 -0.080 -5.871 1.00 0.00 O ATOM 0 H GLY A 80 -6.134 1.497 -5.739 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.973 2.965 -5.276 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.489 2.829 -6.946 1.00 0.00 H new ATOM 1135 N VAL A 81 -10.048 1.142 -5.388 1.00 0.00 N ATOM 1136 CA VAL A 81 -10.913 0.007 -5.066 1.00 0.00 C ATOM 1137 C VAL A 81 -12.377 0.419 -5.239 1.00 0.00 C ATOM 1138 O VAL A 81 -12.708 1.601 -5.191 1.00 0.00 O ATOM 1139 CB VAL A 81 -10.538 -0.571 -3.676 1.00 0.00 C ATOM 1140 CG1 VAL A 81 -10.292 0.480 -2.594 1.00 0.00 C ATOM 1141 CG2 VAL A 81 -11.547 -1.547 -3.094 1.00 0.00 C ATOM 0 H VAL A 81 -10.509 2.045 -5.277 1.00 0.00 H new ATOM 0 HA VAL A 81 -10.761 -0.821 -5.759 1.00 0.00 H new ATOM 0 HB VAL A 81 -9.611 -1.091 -3.919 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -10.036 -0.015 -1.657 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -9.471 1.129 -2.897 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -11.194 1.077 -2.455 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -11.197 -1.896 -2.122 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -12.509 -1.048 -2.976 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -11.660 -2.398 -3.766 1.00 0.00 H new ATOM 1151 N VAL A 82 -13.251 -0.562 -5.461 1.00 0.00 N ATOM 1152 CA VAL A 82 -14.698 -0.459 -5.576 1.00 0.00 C ATOM 1153 C VAL A 82 -15.275 -1.601 -4.752 1.00 0.00 C ATOM 1154 O VAL A 82 -14.542 -2.503 -4.332 1.00 0.00 O ATOM 1155 CB VAL A 82 -15.120 -0.573 -7.065 1.00 0.00 C ATOM 1156 CG1 VAL A 82 -16.595 -0.213 -7.283 1.00 0.00 C ATOM 1157 CG2 VAL A 82 -14.252 0.280 -7.994 1.00 0.00 C ATOM 0 H VAL A 82 -12.936 -1.525 -5.574 1.00 0.00 H new ATOM 0 HA VAL A 82 -15.066 0.500 -5.212 1.00 0.00 H new ATOM 0 HB VAL A 82 -14.971 -1.622 -7.320 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -16.840 -0.308 -8.341 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -17.224 -0.888 -6.702 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -16.770 0.814 -6.961 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.593 0.160 -9.022 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -14.331 1.328 -7.705 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.213 -0.040 -7.917 1.00 0.00 H new ATOM 1167 N ASP A 83 -16.587 -1.585 -4.546 1.00 0.00 N ATOM 1168 CA ASP A 83 -17.296 -2.760 -4.087 1.00 0.00 C ATOM 1169 C ASP A 83 -18.383 -3.065 -5.096 1.00 0.00 C ATOM 1170 O ASP A 83 -19.384 -2.360 -5.172 1.00 0.00 O ATOM 1171 CB ASP A 83 -17.861 -2.569 -2.683 1.00 0.00 C ATOM 1172 CG ASP A 83 -18.246 -3.910 -2.065 1.00 0.00 C ATOM 1173 OD1 ASP A 83 -17.500 -4.895 -2.278 1.00 0.00 O ATOM 1174 OD2 ASP A 83 -19.328 -3.949 -1.429 1.00 0.00 O ATOM 0 H ASP A 83 -17.177 -0.766 -4.692 1.00 0.00 H new ATOM 0 HA ASP A 83 -16.610 -3.604 -4.015 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -17.122 -2.072 -2.054 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -18.734 -1.918 -2.723 1.00 0.00 H new ATOM 1179 N GLY A 84 -18.116 -4.046 -5.945 1.00 0.00 N ATOM 1180 CA GLY A 84 -18.917 -4.404 -7.111 1.00 0.00 C ATOM 1181 C GLY A 84 -19.971 -5.476 -6.832 1.00 0.00 C ATOM 1182 O GLY A 84 -20.503 -6.053 -7.782 1.00 0.00 O ATOM 0 H GLY A 84 -17.297 -4.644 -5.836 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -19.413 -3.509 -7.487 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -18.254 -4.757 -7.901 1.00 0.00 H new ATOM 1186 N GLU A 85 -20.238 -5.768 -5.559 1.00 0.00 N ATOM 1187 CA GLU A 85 -21.209 -6.742 -5.091 1.00 0.00 C ATOM 1188 C GLU A 85 -22.627 -6.342 -5.517 1.00 0.00 C ATOM 1189 O GLU A 85 -22.869 -5.259 -6.053 1.00 0.00 O ATOM 1190 CB GLU A 85 -21.125 -6.825 -3.557 1.00 0.00 C ATOM 1191 CG GLU A 85 -19.735 -7.178 -3.011 1.00 0.00 C ATOM 1192 CD GLU A 85 -19.377 -8.649 -3.179 1.00 0.00 C ATOM 1193 OE1 GLU A 85 -18.768 -9.035 -4.200 1.00 0.00 O ATOM 1194 OE2 GLU A 85 -19.607 -9.419 -2.215 1.00 0.00 O ATOM 0 H GLU A 85 -19.754 -5.304 -4.790 1.00 0.00 H new ATOM 0 HA GLU A 85 -20.986 -7.714 -5.531 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -21.433 -5.868 -3.137 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -21.838 -7.571 -3.207 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -18.987 -6.569 -3.519 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -19.691 -6.919 -1.953 1.00 0.00 H new ATOM 1201 N ASP A 86 -23.584 -7.225 -5.258 1.00 0.00 N ATOM 1202 CA ASP A 86 -24.997 -7.089 -5.548 1.00 0.00 C ATOM 1203 C ASP A 86 -25.674 -8.186 -4.737 1.00 0.00 C ATOM 1204 O ASP A 86 -25.236 -9.336 -4.778 1.00 0.00 O ATOM 1205 CB ASP A 86 -25.279 -7.286 -7.040 1.00 0.00 C ATOM 1206 CG ASP A 86 -26.776 -7.185 -7.311 1.00 0.00 C ATOM 1207 OD1 ASP A 86 -27.470 -8.223 -7.226 1.00 0.00 O ATOM 1208 OD2 ASP A 86 -27.236 -6.074 -7.669 1.00 0.00 O ATOM 0 H ASP A 86 -23.373 -8.116 -4.808 1.00 0.00 H new ATOM 0 HA ASP A 86 -25.363 -6.094 -5.293 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -24.745 -6.534 -7.621 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -24.909 -8.259 -7.362 1.00 0.00 H new ATOM 1213 N GLY A 87 -26.652 -7.835 -3.912 1.00 0.00 N ATOM 1214 CA GLY A 87 -27.468 -8.788 -3.159 1.00 0.00 C ATOM 1215 C GLY A 87 -27.175 -8.790 -1.661 1.00 0.00 C ATOM 1216 O GLY A 87 -27.894 -9.442 -0.900 1.00 0.00 O ATOM 0 H GLY A 87 -26.908 -6.862 -3.742 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -28.521 -8.555 -3.315 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -27.301 -9.790 -3.555 1.00 0.00 H new ATOM 1220 N VAL A 88 -26.160 -8.052 -1.217 1.00 0.00 N ATOM 1221 CA VAL A 88 -25.858 -7.796 0.182 1.00 0.00 C ATOM 1222 C VAL A 88 -25.271 -6.389 0.258 1.00 0.00 C ATOM 1223 O VAL A 88 -24.520 -5.981 -0.634 1.00 0.00 O ATOM 1224 CB VAL A 88 -24.954 -8.908 0.759 1.00 0.00 C ATOM 1225 CG1 VAL A 88 -23.713 -9.190 -0.090 1.00 0.00 C ATOM 1226 CG2 VAL A 88 -24.538 -8.654 2.212 1.00 0.00 C ATOM 0 H VAL A 88 -25.501 -7.600 -1.851 1.00 0.00 H new ATOM 0 HA VAL A 88 -26.748 -7.826 0.811 1.00 0.00 H new ATOM 0 HB VAL A 88 -25.585 -9.797 0.734 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -23.126 -9.981 0.376 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -24.019 -9.504 -1.088 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -23.109 -8.285 -0.164 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -23.905 -9.471 2.557 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -23.986 -7.716 2.274 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -25.427 -8.594 2.840 1.00 0.00 H new ATOM 1236 N VAL A 89 -25.634 -5.629 1.287 1.00 0.00 N ATOM 1237 CA VAL A 89 -24.988 -4.368 1.612 1.00 0.00 C ATOM 1238 C VAL A 89 -23.918 -4.666 2.658 1.00 0.00 C ATOM 1239 O VAL A 89 -24.160 -5.429 3.600 1.00 0.00 O ATOM 1240 CB VAL A 89 -26.055 -3.338 2.034 1.00 0.00 C ATOM 1241 CG1 VAL A 89 -26.634 -3.582 3.431 1.00 0.00 C ATOM 1242 CG2 VAL A 89 -25.550 -1.895 1.923 1.00 0.00 C ATOM 0 H VAL A 89 -26.392 -5.876 1.923 1.00 0.00 H new ATOM 0 HA VAL A 89 -24.484 -3.911 0.760 1.00 0.00 H new ATOM 0 HB VAL A 89 -26.866 -3.482 1.320 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -27.377 -2.817 3.656 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -27.104 -4.565 3.464 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -25.833 -3.538 4.169 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -26.339 -1.209 2.231 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -24.681 -1.763 2.568 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -25.270 -1.686 0.890 1.00 0.00 H new ATOM 1252 N ASN A 90 -22.738 -4.074 2.473 1.00 0.00 N ATOM 1253 CA ASN A 90 -21.654 -4.068 3.452 1.00 0.00 C ATOM 1254 C ASN A 90 -21.570 -2.626 3.985 1.00 0.00 C ATOM 1255 O ASN A 90 -22.550 -1.883 3.860 1.00 0.00 O ATOM 1256 CB ASN A 90 -20.359 -4.644 2.850 1.00 0.00 C ATOM 1257 CG ASN A 90 -20.534 -6.099 2.408 1.00 0.00 C ATOM 1258 OD1 ASN A 90 -20.268 -7.040 3.152 1.00 0.00 O ATOM 1259 ND2 ASN A 90 -20.972 -6.328 1.182 1.00 0.00 N ATOM 0 H ASN A 90 -22.505 -3.573 1.616 1.00 0.00 H new ATOM 0 HA ASN A 90 -21.836 -4.730 4.299 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -20.055 -4.039 1.996 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -19.557 -4.582 3.586 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -21.089 -7.286 0.853 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -21.193 -5.546 0.565 1.00 0.00 H new ATOM 1266 N GLU A 91 -20.485 -2.196 4.627 1.00 0.00 N ATOM 1267 CA GLU A 91 -20.354 -0.848 5.193 1.00 0.00 C ATOM 1268 C GLU A 91 -19.116 -0.114 4.656 1.00 0.00 C ATOM 1269 O GLU A 91 -18.271 -0.737 4.010 1.00 0.00 O ATOM 1270 CB GLU A 91 -20.396 -0.929 6.730 1.00 0.00 C ATOM 1271 CG GLU A 91 -21.824 -0.798 7.277 1.00 0.00 C ATOM 1272 CD GLU A 91 -21.938 0.324 8.306 1.00 0.00 C ATOM 1273 OE1 GLU A 91 -21.618 0.091 9.497 1.00 0.00 O ATOM 1274 OE2 GLU A 91 -22.409 1.432 7.952 1.00 0.00 O ATOM 0 H GLU A 91 -19.660 -2.779 4.772 1.00 0.00 H new ATOM 0 HA GLU A 91 -21.201 -0.242 4.870 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -19.970 -1.878 7.054 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -19.773 -0.140 7.151 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.512 -0.607 6.454 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -22.126 -1.741 7.733 1.00 0.00 H new ATOM 1281 N PRO A 92 -19.027 1.215 4.857 1.00 0.00 N ATOM 1282 CA PRO A 92 -17.925 2.020 4.352 1.00 0.00 C ATOM 1283 C PRO A 92 -16.661 1.927 5.204 1.00 0.00 C ATOM 1284 O PRO A 92 -16.670 1.372 6.306 1.00 0.00 O ATOM 1285 CB PRO A 92 -18.458 3.455 4.345 1.00 0.00 C ATOM 1286 CG PRO A 92 -19.451 3.468 5.499 1.00 0.00 C ATOM 1287 CD PRO A 92 -20.051 2.071 5.442 1.00 0.00 C ATOM 0 HA PRO A 92 -17.621 1.666 3.367 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -17.659 4.181 4.494 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -18.939 3.700 3.398 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -18.960 3.659 6.453 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -20.210 4.240 5.371 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -20.326 1.724 6.438 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -20.959 2.061 4.839 1.00 0.00 H new ATOM 1295 N MET A 93 -15.570 2.548 4.739 1.00 0.00 N ATOM 1296 CA MET A 93 -14.242 2.366 5.283 1.00 0.00 C ATOM 1297 C MET A 93 -13.419 3.640 5.159 1.00 0.00 C ATOM 1298 O MET A 93 -13.921 4.685 4.734 1.00 0.00 O ATOM 1299 CB MET A 93 -13.562 1.191 4.571 1.00 0.00 C ATOM 1300 CG MET A 93 -13.277 1.402 3.087 1.00 0.00 C ATOM 1301 SD MET A 93 -11.744 0.576 2.591 1.00 0.00 S ATOM 1302 CE MET A 93 -12.066 -1.076 3.270 1.00 0.00 C ATOM 0 H MET A 93 -15.599 3.202 3.957 1.00 0.00 H new ATOM 0 HA MET A 93 -14.319 2.139 6.346 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.621 0.977 5.078 1.00 0.00 H new ATOM 0 HB3 MET A 93 -14.192 0.308 4.681 1.00 0.00 H new ATOM 0 HG2 MET A 93 -14.108 1.017 2.496 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.203 2.469 2.876 1.00 0.00 H new ATOM 0 HE1 MET A 93 -11.341 -1.783 2.867 1.00 0.00 H new ATOM 0 HE2 MET A 93 -11.979 -1.046 4.356 1.00 0.00 H new ATOM 0 HE3 MET A 93 -13.072 -1.393 2.995 1.00 0.00 H new ATOM 1312 N GLN A 94 -12.158 3.527 5.562 1.00 0.00 N ATOM 1313 CA GLN A 94 -11.074 4.467 5.379 1.00 0.00 C ATOM 1314 C GLN A 94 -9.824 3.640 5.082 1.00 0.00 C ATOM 1315 O GLN A 94 -9.785 2.439 5.380 1.00 0.00 O ATOM 1316 CB GLN A 94 -10.888 5.291 6.657 1.00 0.00 C ATOM 1317 CG GLN A 94 -12.050 6.267 6.877 1.00 0.00 C ATOM 1318 CD GLN A 94 -12.022 6.906 8.265 1.00 0.00 C ATOM 1319 OE1 GLN A 94 -11.354 6.443 9.186 1.00 0.00 O ATOM 1320 NE2 GLN A 94 -12.783 7.971 8.454 1.00 0.00 N ATOM 0 H GLN A 94 -11.848 2.699 6.070 1.00 0.00 H new ATOM 0 HA GLN A 94 -11.276 5.162 4.564 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -10.808 4.621 7.513 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -9.952 5.847 6.599 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -12.011 7.050 6.119 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.994 5.739 6.742 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -13.334 8.348 7.683 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -12.819 8.416 9.371 1.00 0.00 H new ATOM 1329 N TRP A 95 -8.813 4.287 4.511 1.00 0.00 N ATOM 1330 CA TRP A 95 -7.479 3.762 4.261 1.00 0.00 C ATOM 1331 C TRP A 95 -6.535 4.818 4.801 1.00 0.00 C ATOM 1332 O TRP A 95 -6.506 5.916 4.239 1.00 0.00 O ATOM 1333 CB TRP A 95 -7.216 3.552 2.757 1.00 0.00 C ATOM 1334 CG TRP A 95 -7.420 2.188 2.177 1.00 0.00 C ATOM 1335 CD1 TRP A 95 -8.101 1.160 2.737 1.00 0.00 C ATOM 1336 CD2 TRP A 95 -6.766 1.632 0.991 1.00 0.00 C ATOM 1337 NE1 TRP A 95 -8.057 0.069 1.896 1.00 0.00 N ATOM 1338 CE2 TRP A 95 -7.176 0.270 0.855 1.00 0.00 C ATOM 1339 CE3 TRP A 95 -5.750 2.089 0.113 1.00 0.00 C ATOM 1340 CZ2 TRP A 95 -6.633 -0.584 -0.114 1.00 0.00 C ATOM 1341 CZ3 TRP A 95 -5.144 1.209 -0.807 1.00 0.00 C ATOM 1342 CH2 TRP A 95 -5.598 -0.117 -0.937 1.00 0.00 C ATOM 0 H TRP A 95 -8.911 5.251 4.192 1.00 0.00 H new ATOM 0 HA TRP A 95 -7.349 2.789 4.734 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -7.856 4.243 2.209 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -6.186 3.846 2.557 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -8.601 1.190 3.694 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -8.607 -0.780 2.027 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -5.437 3.122 0.150 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -7.007 -1.591 -0.226 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -4.324 1.556 -1.418 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -5.150 -0.773 -1.669 1.00 0.00 H new ATOM 1353 N VAL A 96 -5.799 4.534 5.873 1.00 0.00 N ATOM 1354 CA VAL A 96 -4.703 5.404 6.298 1.00 0.00 C ATOM 1355 C VAL A 96 -3.458 4.826 5.628 1.00 0.00 C ATOM 1356 O VAL A 96 -3.235 3.612 5.675 1.00 0.00 O ATOM 1357 CB VAL A 96 -4.579 5.512 7.835 1.00 0.00 C ATOM 1358 CG1 VAL A 96 -3.847 6.811 8.201 1.00 0.00 C ATOM 1359 CG2 VAL A 96 -5.943 5.496 8.550 1.00 0.00 C ATOM 0 H VAL A 96 -5.940 3.713 6.461 1.00 0.00 H new ATOM 0 HA VAL A 96 -4.870 6.438 5.995 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.020 4.637 8.168 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.760 6.887 9.285 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.852 6.805 7.756 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -4.409 7.665 7.822 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.791 5.575 9.626 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -6.544 6.338 8.206 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.461 4.564 8.324 1.00 0.00 H new ATOM 1369 N VAL A 97 -2.706 5.657 4.911 1.00 0.00 N ATOM 1370 CA VAL A 97 -1.657 5.229 4.013 1.00 0.00 C ATOM 1371 C VAL A 97 -0.496 6.203 4.196 1.00 0.00 C ATOM 1372 O VAL A 97 -0.543 7.360 3.760 1.00 0.00 O ATOM 1373 CB VAL A 97 -2.222 5.138 2.580 1.00 0.00 C ATOM 1374 CG1 VAL A 97 -3.032 3.849 2.402 1.00 0.00 C ATOM 1375 CG2 VAL A 97 -3.104 6.320 2.124 1.00 0.00 C ATOM 0 H VAL A 97 -2.818 6.670 4.945 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.279 4.229 4.227 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.331 5.158 1.952 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.423 3.802 1.385 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -2.390 2.987 2.584 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -3.861 3.839 3.110 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.444 6.147 1.103 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.967 6.406 2.784 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -2.525 7.242 2.162 1.00 0.00 H new ATOM 1385 N THR A 98 0.535 5.745 4.892 1.00 0.00 N ATOM 1386 CA THR A 98 1.635 6.561 5.376 1.00 0.00 C ATOM 1387 C THR A 98 2.906 6.028 4.720 1.00 0.00 C ATOM 1388 O THR A 98 2.968 4.855 4.338 1.00 0.00 O ATOM 1389 CB THR A 98 1.673 6.455 6.910 1.00 0.00 C ATOM 1390 OG1 THR A 98 0.354 6.481 7.435 1.00 0.00 O ATOM 1391 CG2 THR A 98 2.436 7.595 7.579 1.00 0.00 C ATOM 0 H THR A 98 0.630 4.761 5.143 1.00 0.00 H new ATOM 0 HA THR A 98 1.527 7.616 5.124 1.00 0.00 H new ATOM 0 HB THR A 98 2.184 5.516 7.123 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.389 6.411 8.412 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.423 7.457 8.660 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.467 7.599 7.226 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.964 8.545 7.329 1.00 0.00 H new ATOM 1399 N VAL A 99 3.917 6.877 4.554 1.00 0.00 N ATOM 1400 CA VAL A 99 5.136 6.519 3.839 1.00 0.00 C ATOM 1401 C VAL A 99 6.299 6.982 4.706 1.00 0.00 C ATOM 1402 O VAL A 99 6.350 8.151 5.099 1.00 0.00 O ATOM 1403 CB VAL A 99 5.125 7.112 2.413 1.00 0.00 C ATOM 1404 CG1 VAL A 99 6.353 6.676 1.617 1.00 0.00 C ATOM 1405 CG2 VAL A 99 3.871 6.697 1.626 1.00 0.00 C ATOM 0 H VAL A 99 3.913 7.832 4.912 1.00 0.00 H new ATOM 0 HA VAL A 99 5.228 5.444 3.682 1.00 0.00 H new ATOM 0 HB VAL A 99 5.130 8.195 2.540 1.00 0.00 H new ATOM 0 HG11 VAL A 99 6.313 7.111 0.619 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.255 7.016 2.125 1.00 0.00 H new ATOM 0 HG13 VAL A 99 6.369 5.589 1.538 1.00 0.00 H new ATOM 0 HG21 VAL A 99 3.905 7.136 0.629 1.00 0.00 H new ATOM 0 HG22 VAL A 99 3.837 5.611 1.543 1.00 0.00 H new ATOM 0 HG23 VAL A 99 2.981 7.049 2.148 1.00 0.00 H new ATOM 1415 N TYR A 100 7.201 6.055 5.029 1.00 0.00 N ATOM 1416 CA TYR A 100 8.296 6.221 5.970 1.00 0.00 C ATOM 1417 C TYR A 100 9.611 5.960 5.227 1.00 0.00 C ATOM 1418 O TYR A 100 9.784 4.910 4.599 1.00 0.00 O ATOM 1419 CB TYR A 100 8.126 5.247 7.144 1.00 0.00 C ATOM 1420 CG TYR A 100 6.978 5.594 8.073 1.00 0.00 C ATOM 1421 CD1 TYR A 100 7.153 6.584 9.057 1.00 0.00 C ATOM 1422 CD2 TYR A 100 5.738 4.935 7.956 1.00 0.00 C ATOM 1423 CE1 TYR A 100 6.096 6.918 9.920 1.00 0.00 C ATOM 1424 CE2 TYR A 100 4.677 5.257 8.826 1.00 0.00 C ATOM 1425 CZ TYR A 100 4.852 6.258 9.813 1.00 0.00 C ATOM 1426 OH TYR A 100 3.857 6.600 10.679 1.00 0.00 O ATOM 0 H TYR A 100 7.182 5.122 4.617 1.00 0.00 H new ATOM 0 HA TYR A 100 8.303 7.233 6.375 1.00 0.00 H new ATOM 0 HB2 TYR A 100 7.970 4.243 6.750 1.00 0.00 H new ATOM 0 HB3 TYR A 100 9.051 5.223 7.720 1.00 0.00 H new ATOM 0 HD1 TYR A 100 8.103 7.089 9.149 1.00 0.00 H new ATOM 0 HD2 TYR A 100 5.600 4.180 7.196 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.235 7.683 10.669 1.00 0.00 H new ATOM 0 HE2 TYR A 100 3.732 4.741 8.740 1.00 0.00 H new ATOM 0 HH TYR A 100 3.058 6.065 10.487 1.00 0.00 H new ATOM 1436 N LYS A 101 10.515 6.938 5.195 1.00 0.00 N ATOM 1437 CA LYS A 101 11.861 6.861 4.635 1.00 0.00 C ATOM 1438 C LYS A 101 12.759 6.022 5.555 1.00 0.00 C ATOM 1439 O LYS A 101 12.261 5.332 6.444 1.00 0.00 O ATOM 1440 CB LYS A 101 12.332 8.314 4.422 1.00 0.00 C ATOM 1441 CG LYS A 101 13.643 8.471 3.642 1.00 0.00 C ATOM 1442 CD LYS A 101 13.654 9.715 2.749 1.00 0.00 C ATOM 1443 CE LYS A 101 14.967 9.833 1.963 1.00 0.00 C ATOM 1444 NZ LYS A 101 15.940 10.716 2.636 1.00 0.00 N ATOM 0 H LYS A 101 10.314 7.860 5.583 1.00 0.00 H new ATOM 0 HA LYS A 101 11.897 6.350 3.673 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.548 8.859 3.896 1.00 0.00 H new ATOM 0 HB3 LYS A 101 12.450 8.787 5.397 1.00 0.00 H new ATOM 0 HG2 LYS A 101 14.475 8.526 4.344 1.00 0.00 H new ATOM 0 HG3 LYS A 101 13.803 7.586 3.027 1.00 0.00 H new ATOM 0 HD2 LYS A 101 12.815 9.672 2.054 1.00 0.00 H new ATOM 0 HD3 LYS A 101 13.515 10.605 3.362 1.00 0.00 H new ATOM 0 HE2 LYS A 101 15.404 8.842 1.837 1.00 0.00 H new ATOM 0 HE3 LYS A 101 14.758 10.218 0.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 16.812 10.767 2.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 15.535 11.669 2.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 16.160 10.335 3.578 1.00 0.00 H new ATOM 1458 N ASN A 102 14.080 6.065 5.357 1.00 0.00 N ATOM 1459 CA ASN A 102 15.082 5.625 6.316 1.00 0.00 C ATOM 1460 C ASN A 102 14.869 6.455 7.593 1.00 0.00 C ATOM 1461 O ASN A 102 15.334 7.587 7.737 1.00 0.00 O ATOM 1462 CB ASN A 102 16.524 5.667 5.772 1.00 0.00 C ATOM 1463 CG ASN A 102 17.075 7.025 5.375 1.00 0.00 C ATOM 1464 OD1 ASN A 102 17.718 7.715 6.155 1.00 0.00 O ATOM 1465 ND2 ASN A 102 16.889 7.425 4.127 1.00 0.00 N ATOM 0 H ASN A 102 14.489 6.420 4.493 1.00 0.00 H new ATOM 0 HA ASN A 102 14.950 4.566 6.537 1.00 0.00 H new ATOM 0 HB2 ASN A 102 17.183 5.243 6.529 1.00 0.00 H new ATOM 0 HB3 ASN A 102 16.576 5.013 4.901 1.00 0.00 H new ATOM 0 HD21 ASN A 102 17.282 8.312 3.812 1.00 0.00 H new ATOM 0 HD22 ASN A 102 16.352 6.846 3.481 1.00 0.00 H new ATOM 1472 N GLY A 103 14.036 5.913 8.469 1.00 0.00 N ATOM 1473 CA GLY A 103 13.778 6.380 9.822 1.00 0.00 C ATOM 1474 C GLY A 103 13.110 7.749 9.936 1.00 0.00 C ATOM 1475 O GLY A 103 13.372 8.447 10.910 1.00 0.00 O ATOM 0 H GLY A 103 13.488 5.084 8.239 1.00 0.00 H new ATOM 0 HA2 GLY A 103 13.149 5.646 10.326 1.00 0.00 H new ATOM 0 HA3 GLY A 103 14.724 6.412 10.362 1.00 0.00 H new ATOM 1479 N LYS A 104 12.290 8.175 8.971 1.00 0.00 N ATOM 1480 CA LYS A 104 11.381 9.312 9.111 1.00 0.00 C ATOM 1481 C LYS A 104 10.101 9.044 8.338 1.00 0.00 C ATOM 1482 O LYS A 104 10.031 8.043 7.640 1.00 0.00 O ATOM 1483 CB LYS A 104 12.063 10.596 8.680 1.00 0.00 C ATOM 1484 CG LYS A 104 12.201 10.813 7.171 1.00 0.00 C ATOM 1485 CD LYS A 104 12.204 12.313 6.959 1.00 0.00 C ATOM 1486 CE LYS A 104 12.444 12.671 5.491 1.00 0.00 C ATOM 1487 NZ LYS A 104 12.374 14.128 5.279 1.00 0.00 N ATOM 0 H LYS A 104 12.240 7.730 8.055 1.00 0.00 H new ATOM 0 HA LYS A 104 11.111 9.438 10.159 1.00 0.00 H new ATOM 0 HB2 LYS A 104 11.508 11.436 9.098 1.00 0.00 H new ATOM 0 HB3 LYS A 104 13.059 10.620 9.122 1.00 0.00 H new ATOM 0 HG2 LYS A 104 13.121 10.365 6.796 1.00 0.00 H new ATOM 0 HG3 LYS A 104 11.376 10.345 6.633 1.00 0.00 H new ATOM 0 HD2 LYS A 104 11.251 12.730 7.285 1.00 0.00 H new ATOM 0 HD3 LYS A 104 12.979 12.767 7.577 1.00 0.00 H new ATOM 0 HE2 LYS A 104 13.421 12.302 5.179 1.00 0.00 H new ATOM 0 HE3 LYS A 104 11.701 12.174 4.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 12.541 14.341 4.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 11.433 14.474 5.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 13.099 14.598 5.858 1.00 0.00 H new ATOM 1501 N GLU A 105 9.119 9.928 8.399 1.00 0.00 N ATOM 1502 CA GLU A 105 7.915 9.933 7.569 1.00 0.00 C ATOM 1503 C GLU A 105 8.130 10.925 6.413 1.00 0.00 C ATOM 1504 O GLU A 105 8.895 11.880 6.562 1.00 0.00 O ATOM 1505 CB GLU A 105 6.770 10.358 8.488 1.00 0.00 C ATOM 1506 CG GLU A 105 5.359 10.460 7.897 1.00 0.00 C ATOM 1507 CD GLU A 105 4.471 11.324 8.797 1.00 0.00 C ATOM 1508 OE1 GLU A 105 4.126 10.912 9.928 1.00 0.00 O ATOM 1509 OE2 GLU A 105 4.192 12.492 8.427 1.00 0.00 O ATOM 0 H GLU A 105 9.136 10.703 9.061 1.00 0.00 H new ATOM 0 HA GLU A 105 7.689 8.962 7.128 1.00 0.00 H new ATOM 0 HB2 GLU A 105 6.732 9.653 9.318 1.00 0.00 H new ATOM 0 HB3 GLU A 105 7.025 11.331 8.908 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.406 10.892 6.897 1.00 0.00 H new ATOM 0 HG3 GLU A 105 4.927 9.465 7.795 1.00 0.00 H new ATOM 1516 N ILE A 106 7.449 10.745 5.276 1.00 0.00 N ATOM 1517 CA ILE A 106 7.365 11.725 4.190 1.00 0.00 C ATOM 1518 C ILE A 106 5.926 11.946 3.699 1.00 0.00 C ATOM 1519 O ILE A 106 5.670 12.948 3.027 1.00 0.00 O ATOM 1520 CB ILE A 106 8.305 11.342 3.025 1.00 0.00 C ATOM 1521 CG1 ILE A 106 7.968 9.945 2.459 1.00 0.00 C ATOM 1522 CG2 ILE A 106 9.772 11.442 3.477 1.00 0.00 C ATOM 1523 CD1 ILE A 106 8.786 9.601 1.215 1.00 0.00 C ATOM 0 H ILE A 106 6.927 9.890 5.082 1.00 0.00 H new ATOM 0 HA ILE A 106 7.699 12.678 4.600 1.00 0.00 H new ATOM 0 HB ILE A 106 8.153 12.050 2.210 1.00 0.00 H new ATOM 0 HG12 ILE A 106 8.148 9.193 3.227 1.00 0.00 H new ATOM 0 HG13 ILE A 106 6.907 9.903 2.214 1.00 0.00 H new ATOM 0 HG21 ILE A 106 10.427 11.170 2.649 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.987 12.464 3.790 1.00 0.00 H new ATOM 0 HG23 ILE A 106 9.942 10.763 4.313 1.00 0.00 H new ATOM 0 HD11 ILE A 106 8.508 8.609 0.860 1.00 0.00 H new ATOM 0 HD12 ILE A 106 8.587 10.335 0.434 1.00 0.00 H new ATOM 0 HD13 ILE A 106 9.847 9.614 1.462 1.00 0.00 H new ATOM 1535 N GLU A 107 4.962 11.093 4.062 1.00 0.00 N ATOM 1536 CA GLU A 107 3.558 11.214 3.664 1.00 0.00 C ATOM 1537 C GLU A 107 2.696 10.827 4.852 1.00 0.00 C ATOM 1538 O GLU A 107 3.113 9.975 5.633 1.00 0.00 O ATOM 1539 CB GLU A 107 3.255 10.239 2.516 1.00 0.00 C ATOM 1540 CG GLU A 107 1.886 10.384 1.828 1.00 0.00 C ATOM 1541 CD GLU A 107 1.489 11.830 1.524 1.00 0.00 C ATOM 1542 OE1 GLU A 107 1.046 12.519 2.471 1.00 0.00 O ATOM 1543 OE2 GLU A 107 1.569 12.267 0.356 1.00 0.00 O ATOM 0 H GLU A 107 5.142 10.282 4.654 1.00 0.00 H new ATOM 0 HA GLU A 107 3.355 12.235 3.341 1.00 0.00 H new ATOM 0 HB2 GLU A 107 4.030 10.354 1.758 1.00 0.00 H new ATOM 0 HB3 GLU A 107 3.335 9.223 2.903 1.00 0.00 H new ATOM 0 HG2 GLU A 107 1.898 9.818 0.896 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.123 9.935 2.464 1.00 0.00 H new ATOM 1550 N LYS A 108 1.501 11.403 4.961 1.00 0.00 N ATOM 1551 CA LYS A 108 0.475 11.008 5.914 1.00 0.00 C ATOM 1552 C LYS A 108 -0.891 11.229 5.260 1.00 0.00 C ATOM 1553 O LYS A 108 -1.745 11.928 5.814 1.00 0.00 O ATOM 1554 CB LYS A 108 0.674 11.777 7.240 1.00 0.00 C ATOM 1555 CG LYS A 108 0.061 11.006 8.417 1.00 0.00 C ATOM 1556 CD LYS A 108 0.140 11.748 9.758 1.00 0.00 C ATOM 1557 CE LYS A 108 -1.012 12.744 9.970 1.00 0.00 C ATOM 1558 NZ LYS A 108 -0.680 14.145 9.645 1.00 0.00 N ATOM 0 H LYS A 108 1.214 12.182 4.368 1.00 0.00 H new ATOM 0 HA LYS A 108 0.543 9.952 6.174 1.00 0.00 H new ATOM 0 HB2 LYS A 108 1.738 11.934 7.418 1.00 0.00 H new ATOM 0 HB3 LYS A 108 0.214 12.762 7.166 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.984 10.792 8.193 1.00 0.00 H new ATOM 0 HG3 LYS A 108 0.569 10.047 8.514 1.00 0.00 H new ATOM 0 HD2 LYS A 108 0.136 11.020 10.569 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.088 12.282 9.814 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.860 12.434 9.359 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -1.333 12.692 11.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -1.505 14.750 9.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 0.119 14.458 10.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.419 14.216 8.641 1.00 0.00 H new ATOM 1572 N LYS A 109 -1.116 10.686 4.058 1.00 0.00 N ATOM 1573 CA LYS A 109 -2.434 10.766 3.428 1.00 0.00 C ATOM 1574 C LYS A 109 -3.388 9.774 4.091 1.00 0.00 C ATOM 1575 O LYS A 109 -2.999 8.926 4.897 1.00 0.00 O ATOM 1576 CB LYS A 109 -2.376 10.596 1.889 1.00 0.00 C ATOM 1577 CG LYS A 109 -2.979 11.845 1.214 1.00 0.00 C ATOM 1578 CD LYS A 109 -3.232 11.723 -0.294 1.00 0.00 C ATOM 1579 CE LYS A 109 -4.411 10.831 -0.699 1.00 0.00 C ATOM 1580 NZ LYS A 109 -5.736 11.332 -0.260 1.00 0.00 N ATOM 0 H LYS A 109 -0.411 10.193 3.510 1.00 0.00 H new ATOM 0 HA LYS A 109 -2.822 11.772 3.587 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.344 10.456 1.566 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.927 9.705 1.589 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -3.923 12.082 1.705 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -2.310 12.688 1.386 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -3.400 12.721 -0.698 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -2.329 11.336 -0.765 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -4.416 10.727 -1.784 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -4.257 9.835 -0.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -6.464 11.027 -0.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -5.957 10.950 0.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -5.717 12.371 -0.217 1.00 0.00 H new ATOM 1594 N SER A 110 -4.661 9.900 3.755 1.00 0.00 N ATOM 1595 CA SER A 110 -5.729 8.990 4.106 1.00 0.00 C ATOM 1596 C SER A 110 -6.781 9.106 2.996 1.00 0.00 C ATOM 1597 O SER A 110 -6.735 10.059 2.205 1.00 0.00 O ATOM 1598 CB SER A 110 -6.252 9.382 5.497 1.00 0.00 C ATOM 1599 OG SER A 110 -7.224 8.498 6.009 1.00 0.00 O ATOM 0 H SER A 110 -4.992 10.687 3.197 1.00 0.00 H new ATOM 0 HA SER A 110 -5.417 7.948 4.173 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.413 9.426 6.191 1.00 0.00 H new ATOM 0 HB3 SER A 110 -6.677 10.385 5.446 1.00 0.00 H new ATOM 0 HG SER A 110 -7.156 7.635 5.550 1.00 0.00 H new ATOM 1605 N LEU A 111 -7.711 8.149 2.933 1.00 0.00 N ATOM 1606 CA LEU A 111 -8.850 8.085 2.019 1.00 0.00 C ATOM 1607 C LEU A 111 -10.098 7.682 2.805 1.00 0.00 C ATOM 1608 O LEU A 111 -10.014 7.401 4.006 1.00 0.00 O ATOM 1609 CB LEU A 111 -8.615 7.047 0.915 1.00 0.00 C ATOM 1610 CG LEU A 111 -7.279 7.113 0.167 1.00 0.00 C ATOM 1611 CD1 LEU A 111 -7.288 5.990 -0.858 1.00 0.00 C ATOM 1612 CD2 LEU A 111 -7.038 8.421 -0.580 1.00 0.00 C ATOM 0 H LEU A 111 -7.684 7.346 3.562 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.977 9.066 1.560 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.706 6.055 1.358 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.417 7.144 0.184 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.487 7.030 0.911 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.352 5.999 -1.416 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -7.397 5.033 -0.348 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -8.122 6.132 -1.546 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -6.070 8.381 -1.080 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -7.824 8.567 -1.321 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -7.047 9.251 0.127 1.00 0.00 H new ATOM 1624 N VAL A 112 -11.266 7.679 2.163 1.00 0.00 N ATOM 1625 CA VAL A 112 -12.549 7.418 2.794 1.00 0.00 C ATOM 1626 C VAL A 112 -13.516 6.837 1.750 1.00 0.00 C ATOM 1627 O VAL A 112 -14.482 7.479 1.318 1.00 0.00 O ATOM 1628 CB VAL A 112 -12.971 8.706 3.530 1.00 0.00 C ATOM 1629 CG1 VAL A 112 -13.083 9.960 2.646 1.00 0.00 C ATOM 1630 CG2 VAL A 112 -14.209 8.493 4.409 1.00 0.00 C ATOM 0 H VAL A 112 -11.342 7.864 1.163 1.00 0.00 H new ATOM 0 HA VAL A 112 -12.525 6.647 3.564 1.00 0.00 H new ATOM 0 HB VAL A 112 -12.133 8.926 4.191 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -13.385 10.810 3.257 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -12.117 10.169 2.186 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -13.827 9.791 1.867 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -14.467 9.428 4.906 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -15.045 8.169 3.788 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -13.997 7.730 5.158 1.00 0.00 H new ATOM 1640 N PHE A 113 -13.212 5.612 1.310 1.00 0.00 N ATOM 1641 CA PHE A 113 -13.992 4.854 0.340 1.00 0.00 C ATOM 1642 C PHE A 113 -15.346 4.489 0.947 1.00 0.00 C ATOM 1643 O PHE A 113 -15.409 3.842 1.998 1.00 0.00 O ATOM 1644 CB PHE A 113 -13.263 3.572 -0.091 1.00 0.00 C ATOM 1645 CG PHE A 113 -11.953 3.746 -0.839 1.00 0.00 C ATOM 1646 CD1 PHE A 113 -11.909 4.534 -1.999 1.00 0.00 C ATOM 1647 CD2 PHE A 113 -10.795 3.050 -0.436 1.00 0.00 C ATOM 1648 CE1 PHE A 113 -10.730 4.624 -2.754 1.00 0.00 C ATOM 1649 CE2 PHE A 113 -9.597 3.186 -1.157 1.00 0.00 C ATOM 1650 CZ PHE A 113 -9.570 3.953 -2.333 1.00 0.00 C ATOM 0 H PHE A 113 -12.387 5.108 1.634 1.00 0.00 H new ATOM 0 HA PHE A 113 -14.131 5.478 -0.543 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -13.068 2.976 0.801 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -13.939 2.992 -0.720 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -12.789 5.075 -2.313 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -10.829 2.408 0.432 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -10.714 5.210 -3.661 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -8.698 2.701 -0.807 1.00 0.00 H new ATOM 0 HZ PHE A 113 -8.661 4.027 -2.911 1.00 0.00 H new ATOM 1660 N ARG A 114 -16.429 4.886 0.279 1.00 0.00 N ATOM 1661 CA ARG A 114 -17.802 4.563 0.654 1.00 0.00 C ATOM 1662 C ARG A 114 -18.595 4.161 -0.576 1.00 0.00 C ATOM 1663 O ARG A 114 -18.157 4.421 -1.703 1.00 0.00 O ATOM 1664 CB ARG A 114 -18.486 5.762 1.336 1.00 0.00 C ATOM 1665 CG ARG A 114 -17.640 6.334 2.474 1.00 0.00 C ATOM 1666 CD ARG A 114 -18.473 7.120 3.482 1.00 0.00 C ATOM 1667 NE ARG A 114 -17.705 7.315 4.722 1.00 0.00 N ATOM 1668 CZ ARG A 114 -17.574 8.427 5.445 1.00 0.00 C ATOM 1669 NH1 ARG A 114 -18.030 9.592 4.998 1.00 0.00 N ATOM 1670 NH2 ARG A 114 -16.967 8.338 6.617 1.00 0.00 N ATOM 0 H ARG A 114 -16.371 5.458 -0.563 1.00 0.00 H new ATOM 0 HA ARG A 114 -17.773 3.733 1.359 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -18.673 6.541 0.597 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -19.456 5.452 1.726 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -17.128 5.520 2.987 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -16.870 6.984 2.059 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -18.753 8.086 3.061 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -19.399 6.586 3.697 1.00 0.00 H new ATOM 0 HE ARG A 114 -17.210 6.495 5.073 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -18.489 9.645 4.089 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -17.921 10.433 5.564 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -16.616 7.437 6.942 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -16.850 9.170 7.195 1.00 0.00 H new ATOM 1684 N ASP A 115 -19.768 3.595 -0.312 1.00 0.00 N ATOM 1685 CA ASP A 115 -20.863 3.271 -1.206 1.00 0.00 C ATOM 1686 C ASP A 115 -20.377 2.482 -2.413 1.00 0.00 C ATOM 1687 O ASP A 115 -20.030 3.040 -3.459 1.00 0.00 O ATOM 1688 CB ASP A 115 -21.703 4.516 -1.515 1.00 0.00 C ATOM 1689 CG ASP A 115 -22.354 5.180 -0.295 1.00 0.00 C ATOM 1690 OD1 ASP A 115 -23.519 4.847 0.048 1.00 0.00 O ATOM 1691 OD2 ASP A 115 -21.737 6.106 0.280 1.00 0.00 O ATOM 0 H ASP A 115 -19.995 3.323 0.645 1.00 0.00 H new ATOM 0 HA ASP A 115 -21.555 2.592 -0.709 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -21.068 5.249 -2.013 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -22.487 4.241 -2.221 1.00 0.00 H new ATOM 1696 N GLY A 116 -20.318 1.158 -2.229 1.00 0.00 N ATOM 1697 CA GLY A 116 -20.164 0.091 -3.199 1.00 0.00 C ATOM 1698 C GLY A 116 -21.110 0.146 -4.383 1.00 0.00 C ATOM 1699 O GLY A 116 -21.998 -0.695 -4.509 1.00 0.00 O ATOM 0 H GLY A 116 -20.386 0.776 -1.286 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -19.140 0.108 -3.573 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -20.302 -0.863 -2.690 1.00 0.00 H new ATOM 1703 N LYS A 117 -20.908 1.136 -5.243 1.00 0.00 N ATOM 1704 CA LYS A 117 -21.555 1.303 -6.536 1.00 0.00 C ATOM 1705 C LYS A 117 -20.503 1.390 -7.629 1.00 0.00 C ATOM 1706 O LYS A 117 -19.306 1.441 -7.345 1.00 0.00 O ATOM 1707 CB LYS A 117 -22.432 2.564 -6.502 1.00 0.00 C ATOM 1708 CG LYS A 117 -23.440 2.579 -5.346 1.00 0.00 C ATOM 1709 CD LYS A 117 -24.413 1.401 -5.400 1.00 0.00 C ATOM 1710 CE LYS A 117 -25.141 1.351 -4.058 1.00 0.00 C ATOM 1711 NZ LYS A 117 -26.015 0.174 -3.926 1.00 0.00 N ATOM 0 H LYS A 117 -20.249 1.888 -5.044 1.00 0.00 H new ATOM 0 HA LYS A 117 -22.192 0.445 -6.751 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -21.790 3.441 -6.425 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -22.972 2.647 -7.445 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -22.901 2.558 -4.399 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -24.003 3.512 -5.372 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -25.123 1.526 -6.218 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -23.878 0.469 -5.582 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -24.407 1.345 -3.252 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -25.737 2.256 -3.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -26.483 0.192 -2.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -26.735 0.190 -4.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -25.446 -0.692 -4.010 1.00 0.00 H new ATOM 1725 N GLU A 118 -20.948 1.437 -8.882 1.00 0.00 N ATOM 1726 CA GLU A 118 -20.051 1.624 -10.018 1.00 0.00 C ATOM 1727 C GLU A 118 -19.395 2.999 -9.928 1.00 0.00 C ATOM 1728 O GLU A 118 -20.052 4.015 -10.174 1.00 0.00 O ATOM 1729 CB GLU A 118 -20.814 1.507 -11.342 1.00 0.00 C ATOM 1730 CG GLU A 118 -20.946 0.071 -11.840 1.00 0.00 C ATOM 1731 CD GLU A 118 -21.827 0.065 -13.083 1.00 0.00 C ATOM 1732 OE1 GLU A 118 -21.318 0.405 -14.177 1.00 0.00 O ATOM 1733 OE2 GLU A 118 -23.042 -0.211 -12.963 1.00 0.00 O ATOM 0 H GLU A 118 -21.932 1.347 -9.137 1.00 0.00 H new ATOM 0 HA GLU A 118 -19.288 0.846 -9.988 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -21.809 1.934 -11.218 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -20.304 2.101 -12.100 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -19.964 -0.341 -12.071 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -21.382 -0.559 -11.065 1.00 0.00 H new ATOM 1740 N ILE A 119 -18.105 3.034 -9.604 1.00 0.00 N ATOM 1741 CA ILE A 119 -17.269 4.223 -9.470 1.00 0.00 C ATOM 1742 C ILE A 119 -15.876 3.913 -10.024 1.00 0.00 C ATOM 1743 O ILE A 119 -15.506 2.744 -10.164 1.00 0.00 O ATOM 1744 CB ILE A 119 -17.217 4.685 -7.996 1.00 0.00 C ATOM 1745 CG1 ILE A 119 -16.515 3.648 -7.100 1.00 0.00 C ATOM 1746 CG2 ILE A 119 -18.609 4.992 -7.411 1.00 0.00 C ATOM 1747 CD1 ILE A 119 -15.022 3.912 -6.925 1.00 0.00 C ATOM 0 H ILE A 119 -17.583 2.178 -9.416 1.00 0.00 H new ATOM 0 HA ILE A 119 -17.694 5.047 -10.043 1.00 0.00 H new ATOM 0 HB ILE A 119 -16.641 5.610 -8.005 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -16.993 3.642 -6.120 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -16.653 2.655 -7.528 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -18.506 5.311 -6.374 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -19.080 5.787 -7.990 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -19.228 4.096 -7.455 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -14.590 3.145 -6.283 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -14.532 3.889 -7.898 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -14.877 4.891 -6.469 1.00 0.00 H new ATOM 1759 N SER A 120 -15.074 4.947 -10.256 1.00 0.00 N ATOM 1760 CA SER A 120 -13.626 4.878 -10.400 1.00 0.00 C ATOM 1761 C SER A 120 -13.064 6.247 -10.007 1.00 0.00 C ATOM 1762 O SER A 120 -13.661 7.269 -10.354 1.00 0.00 O ATOM 1763 CB SER A 120 -13.245 4.490 -11.839 1.00 0.00 C ATOM 1764 OG SER A 120 -13.906 5.264 -12.828 1.00 0.00 O ATOM 0 H SER A 120 -15.432 5.897 -10.353 1.00 0.00 H new ATOM 0 HA SER A 120 -13.203 4.109 -9.753 1.00 0.00 H new ATOM 0 HB2 SER A 120 -12.168 4.600 -11.963 1.00 0.00 H new ATOM 0 HB3 SER A 120 -13.479 3.437 -11.997 1.00 0.00 H new ATOM 0 HG SER A 120 -13.620 4.970 -13.718 1.00 0.00 H new ATOM 1770 N THR A 121 -11.937 6.298 -9.300 1.00 0.00 N ATOM 1771 CA THR A 121 -11.181 7.523 -9.049 1.00 0.00 C ATOM 1772 C THR A 121 -9.685 7.210 -9.055 1.00 0.00 C ATOM 1773 O THR A 121 -9.269 6.054 -8.902 1.00 0.00 O ATOM 1774 CB THR A 121 -11.613 8.196 -7.724 1.00 0.00 C ATOM 1775 OG1 THR A 121 -11.523 7.279 -6.657 1.00 0.00 O ATOM 1776 CG2 THR A 121 -13.034 8.761 -7.739 1.00 0.00 C ATOM 0 H THR A 121 -11.515 5.471 -8.877 1.00 0.00 H new ATOM 0 HA THR A 121 -11.394 8.235 -9.846 1.00 0.00 H new ATOM 0 HB THR A 121 -10.927 9.034 -7.596 1.00 0.00 H new ATOM 0 HG1 THR A 121 -11.311 7.760 -5.830 1.00 0.00 H new ATOM 0 HG21 THR A 121 -13.256 9.214 -6.773 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.117 9.515 -8.521 1.00 0.00 H new ATOM 0 HG23 THR A 121 -13.743 7.957 -7.934 1.00 0.00 H new ATOM 1784 N ASP A 122 -8.857 8.247 -9.187 1.00 0.00 N ATOM 1785 CA ASP A 122 -7.410 8.155 -8.997 1.00 0.00 C ATOM 1786 C ASP A 122 -7.091 8.426 -7.515 1.00 0.00 C ATOM 1787 O ASP A 122 -6.142 9.131 -7.182 1.00 0.00 O ATOM 1788 CB ASP A 122 -6.649 9.051 -9.999 1.00 0.00 C ATOM 1789 CG ASP A 122 -6.596 8.495 -11.430 1.00 0.00 C ATOM 1790 OD1 ASP A 122 -6.849 7.285 -11.666 1.00 0.00 O ATOM 1791 OD2 ASP A 122 -6.315 9.280 -12.363 1.00 0.00 O ATOM 0 H ASP A 122 -9.176 9.184 -9.432 1.00 0.00 H new ATOM 0 HA ASP A 122 -7.054 7.150 -9.223 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -7.120 10.034 -10.021 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -5.630 9.194 -9.639 1.00 0.00 H new ATOM 1796 N ASP A 123 -7.932 7.888 -6.618 1.00 0.00 N ATOM 1797 CA ASP A 123 -7.868 8.026 -5.159 1.00 0.00 C ATOM 1798 C ASP A 123 -6.493 7.647 -4.615 1.00 0.00 C ATOM 1799 O ASP A 123 -5.955 8.319 -3.731 1.00 0.00 O ATOM 1800 CB ASP A 123 -8.923 7.119 -4.502 1.00 0.00 C ATOM 1801 CG ASP A 123 -9.971 7.944 -3.742 1.00 0.00 C ATOM 1802 OD1 ASP A 123 -10.961 8.411 -4.345 1.00 0.00 O ATOM 1803 OD2 ASP A 123 -9.819 8.167 -2.520 1.00 0.00 O ATOM 0 H ASP A 123 -8.721 7.311 -6.912 1.00 0.00 H new ATOM 0 HA ASP A 123 -8.061 9.072 -4.922 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -9.415 6.517 -5.266 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -8.435 6.427 -3.816 1.00 0.00 H new ATOM 1808 N LEU A 124 -5.919 6.558 -5.132 1.00 0.00 N ATOM 1809 CA LEU A 124 -4.586 6.105 -4.784 1.00 0.00 C ATOM 1810 C LEU A 124 -3.716 6.379 -5.993 1.00 0.00 C ATOM 1811 O LEU A 124 -3.861 5.702 -7.014 1.00 0.00 O ATOM 1812 CB LEU A 124 -4.575 4.621 -4.384 1.00 0.00 C ATOM 1813 CG LEU A 124 -3.670 4.278 -3.185 1.00 0.00 C ATOM 1814 CD1 LEU A 124 -2.235 4.765 -3.319 1.00 0.00 C ATOM 1815 CD2 LEU A 124 -4.207 4.837 -1.878 1.00 0.00 C ATOM 0 H LEU A 124 -6.383 5.961 -5.816 1.00 0.00 H new ATOM 0 HA LEU A 124 -4.207 6.635 -3.910 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -5.595 4.316 -4.150 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -4.255 4.031 -5.243 1.00 0.00 H new ATOM 0 HG LEU A 124 -3.673 3.188 -3.178 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -1.670 4.481 -2.431 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -1.778 4.314 -4.200 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -2.227 5.850 -3.422 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -3.534 4.568 -1.064 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -4.277 5.923 -1.948 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -5.196 4.422 -1.684 1.00 0.00 H new ATOM 1827 N ASN A 125 -2.864 7.396 -5.902 1.00 0.00 N ATOM 1828 CA ASN A 125 -1.958 7.764 -6.992 1.00 0.00 C ATOM 1829 C ASN A 125 -0.814 8.641 -6.482 1.00 0.00 C ATOM 1830 O ASN A 125 -0.918 9.871 -6.493 1.00 0.00 O ATOM 1831 CB ASN A 125 -2.720 8.446 -8.148 1.00 0.00 C ATOM 1832 CG ASN A 125 -2.002 8.170 -9.458 1.00 0.00 C ATOM 1833 OD1 ASN A 125 -2.480 7.367 -10.260 1.00 0.00 O ATOM 1834 ND2 ASN A 125 -0.856 8.786 -9.702 1.00 0.00 N ATOM 0 H ASN A 125 -2.780 7.988 -5.075 1.00 0.00 H new ATOM 0 HA ASN A 125 -1.521 6.847 -7.387 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -3.743 8.071 -8.195 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -2.782 9.520 -7.974 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.351 8.599 -10.568 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.478 9.448 -9.024 1.00 0.00 H new ATOM 1841 N LEU A 126 0.269 8.020 -6.011 1.00 0.00 N ATOM 1842 CA LEU A 126 1.396 8.677 -5.349 1.00 0.00 C ATOM 1843 C LEU A 126 2.709 8.146 -5.928 1.00 0.00 C ATOM 1844 O LEU A 126 2.785 6.983 -6.333 1.00 0.00 O ATOM 1845 CB LEU A 126 1.356 8.401 -3.834 1.00 0.00 C ATOM 1846 CG LEU A 126 0.098 8.899 -3.094 1.00 0.00 C ATOM 1847 CD1 LEU A 126 0.117 8.354 -1.665 1.00 0.00 C ATOM 1848 CD2 LEU A 126 -0.011 10.428 -3.023 1.00 0.00 C ATOM 0 H LEU A 126 0.389 7.010 -6.083 1.00 0.00 H new ATOM 0 HA LEU A 126 1.328 9.752 -5.517 1.00 0.00 H new ATOM 0 HB2 LEU A 126 1.445 7.326 -3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.231 8.863 -3.376 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.760 8.539 -3.662 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -0.769 8.700 -1.132 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.122 7.264 -1.691 1.00 0.00 H new ATOM 0 HD13 LEU A 126 1.011 8.709 -1.152 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.920 10.704 -2.489 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.855 10.830 -2.497 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -0.045 10.838 -4.033 1.00 0.00 H new ATOM 1860 N TYR A 127 3.751 8.978 -5.935 1.00 0.00 N ATOM 1861 CA TYR A 127 5.070 8.692 -6.493 1.00 0.00 C ATOM 1862 C TYR A 127 6.143 9.332 -5.613 1.00 0.00 C ATOM 1863 O TYR A 127 5.938 10.415 -5.059 1.00 0.00 O ATOM 1864 CB TYR A 127 5.155 9.239 -7.930 1.00 0.00 C ATOM 1865 CG TYR A 127 4.534 8.327 -8.970 1.00 0.00 C ATOM 1866 CD1 TYR A 127 3.151 8.378 -9.233 1.00 0.00 C ATOM 1867 CD2 TYR A 127 5.334 7.375 -9.629 1.00 0.00 C ATOM 1868 CE1 TYR A 127 2.563 7.455 -10.116 1.00 0.00 C ATOM 1869 CE2 TYR A 127 4.755 6.459 -10.522 1.00 0.00 C ATOM 1870 CZ TYR A 127 3.365 6.492 -10.766 1.00 0.00 C ATOM 1871 OH TYR A 127 2.819 5.570 -11.603 1.00 0.00 O ATOM 0 H TYR A 127 3.694 9.913 -5.532 1.00 0.00 H new ATOM 0 HA TYR A 127 5.232 7.614 -6.521 1.00 0.00 H new ATOM 0 HB2 TYR A 127 4.660 10.209 -7.969 1.00 0.00 H new ATOM 0 HB3 TYR A 127 6.202 9.405 -8.184 1.00 0.00 H new ATOM 0 HD1 TYR A 127 2.540 9.129 -8.755 1.00 0.00 H new ATOM 0 HD2 TYR A 127 6.398 7.349 -9.447 1.00 0.00 H new ATOM 0 HE1 TYR A 127 1.499 7.483 -10.297 1.00 0.00 H new ATOM 0 HE2 TYR A 127 5.374 5.729 -11.023 1.00 0.00 H new ATOM 0 HH TYR A 127 3.526 4.991 -11.958 1.00 0.00 H new ATOM 1881 N TYR A 128 7.305 8.691 -5.514 1.00 0.00 N ATOM 1882 CA TYR A 128 8.498 9.205 -4.860 1.00 0.00 C ATOM 1883 C TYR A 128 9.725 8.709 -5.605 1.00 0.00 C ATOM 1884 O TYR A 128 9.693 7.646 -6.237 1.00 0.00 O ATOM 1885 CB TYR A 128 8.577 8.734 -3.400 1.00 0.00 C ATOM 1886 CG TYR A 128 7.582 9.401 -2.480 1.00 0.00 C ATOM 1887 CD1 TYR A 128 7.649 10.794 -2.305 1.00 0.00 C ATOM 1888 CD2 TYR A 128 6.583 8.653 -1.831 1.00 0.00 C ATOM 1889 CE1 TYR A 128 6.675 11.452 -1.545 1.00 0.00 C ATOM 1890 CE2 TYR A 128 5.592 9.314 -1.084 1.00 0.00 C ATOM 1891 CZ TYR A 128 5.629 10.720 -0.956 1.00 0.00 C ATOM 1892 OH TYR A 128 4.666 11.374 -0.264 1.00 0.00 O ATOM 0 H TYR A 128 7.443 7.759 -5.905 1.00 0.00 H new ATOM 0 HA TYR A 128 8.455 10.294 -4.871 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.418 7.656 -3.369 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.583 8.919 -3.024 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.452 11.357 -2.757 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.577 7.576 -1.906 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.727 12.522 -1.411 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.804 8.748 -0.609 1.00 0.00 H new ATOM 0 HH TYR A 128 3.823 10.877 -0.327 1.00 0.00 H new ATOM 1902 N ASN A 129 10.806 9.472 -5.470 1.00 0.00 N ATOM 1903 CA ASN A 129 12.138 9.174 -5.953 1.00 0.00 C ATOM 1904 C ASN A 129 13.103 9.680 -4.904 1.00 0.00 C ATOM 1905 O ASN A 129 13.046 10.879 -4.558 1.00 0.00 O ATOM 1906 CB ASN A 129 12.401 9.776 -7.342 1.00 0.00 C ATOM 1907 CG ASN A 129 12.433 11.300 -7.354 1.00 0.00 C ATOM 1908 OD1 ASN A 129 11.397 11.964 -7.379 1.00 0.00 O ATOM 1909 ND2 ASN A 129 13.605 11.908 -7.421 1.00 0.00 N ATOM 0 H ASN A 129 10.765 10.370 -4.989 1.00 0.00 H new ATOM 0 HA ASN A 129 12.266 8.101 -6.095 1.00 0.00 H new ATOM 0 HB2 ASN A 129 13.352 9.399 -7.717 1.00 0.00 H new ATOM 0 HB3 ASN A 129 11.628 9.432 -8.029 1.00 0.00 H new ATOM 0 HD21 ASN A 129 13.649 12.925 -7.493 1.00 0.00 H new ATOM 0 HD22 ASN A 129 14.465 11.361 -7.400 1.00 0.00 H new TER 1916 ASN A 129