USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1043 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 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 129 TYR OH : rot 180:sc= -0.363 USER MOD Set 2.1: A 4 SER OG : rot 120:sc= -2.17! USER MOD Set 2.2: A 72 LYS NZ :NH3+ 176:sc= 0.022 (180deg=0) USER MOD Set 3.1: A 45 SER OG : rot 48:sc= 1.55 USER MOD Set 3.2: A 66 ASN : amide:sc= -0.275 X(o=-0.034,f=-0.3) USER MOD Set 3.3: A 67 THR OG1 : rot 180:sc= 0.785 USER MOD Set 3.4: A 97 HIS : no HE2:sc= -2.09 K(o=-0.034,f=-2.7!) USER MOD Set 4.1: A 28 ASN : amide:sc=-0.000883 X(o=-0.18,f=-0.12) USER MOD Set 4.2: A 30 GLN : amide:sc= -0.184 X(o=-0.18,f=-0.12) USER MOD Set 5.1: A 19 HIS : no HD1:sc= -0.586 K(o=0.097,f=-1.3) USER MOD Set 5.2: A 53 TYR OH : rot 110:sc= 0.683 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.307) USER MOD Single : A 16 ASN : amide:sc= -0.0855 K(o=-0.086,f=-2.6!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -1.11 K(o=-1.1,f=-0.53) USER MOD Single : A 36 ASN : amide:sc= -0.0447 X(o=-0.045,f=-0.38) USER MOD Single : A 47 LYS NZ :NH3+ 149:sc= -0.25 (180deg=-1.21) USER MOD Single : A 54 TYR OH : rot 180:sc= -0.0174 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 138:sc= -0.144 (180deg=-0.687) USER MOD Single : A 69 SER OG : rot 119:sc= 1.27 USER MOD Single : A 70 THR OG1 : rot -48:sc= 0.237 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -0.0797 X(o=-0.08,f=-0.55) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0.4) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 33:sc= 1.24 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 159:sc= -0.686 USER MOD Single : A 99 TYR OH : rot 180:sc=-0.00153 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 81:sc= 0.887 USER MOD Single : A 109 GLN : amide:sc= -0.996 K(o=-1,f=-6.2!) USER MOD Single : A 115 SER OG : rot -140:sc= -0.228 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 ASN : amide:sc= -0.0127 X(o=-0.013,f=-0.46) USER MOD Single : A 127 TYR OH : rot 180:sc= -0.0272 USER MOD Single : A 130 THR OG1 : rot -170:sc= -0.0206 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 TYR OH : rot 81:sc= 0.24 USER MOD Single : A 140 ASN : amide:sc= -1.06 K(o=-1.1,f=-3.3!) USER MOD ----------------------------------------------------------------- ATOM 25 N GLU A 3 -1.556 -5.515 12.614 1.00 0.00 N ATOM 26 CA GLU A 3 -2.007 -6.932 12.717 1.00 0.00 C ATOM 27 C GLU A 3 -2.046 -7.575 11.327 1.00 0.00 C ATOM 28 O GLU A 3 -1.279 -7.226 10.451 1.00 0.00 O ATOM 29 CB GLU A 3 -3.411 -6.856 13.317 1.00 0.00 C ATOM 30 CG GLU A 3 -4.397 -6.364 12.254 1.00 0.00 C ATOM 31 CD GLU A 3 -5.606 -5.723 12.937 1.00 0.00 C ATOM 32 OE1 GLU A 3 -6.250 -6.404 13.719 1.00 0.00 O ATOM 33 OE2 GLU A 3 -5.870 -4.563 12.666 1.00 0.00 O ATOM 0 HA GLU A 3 -1.337 -7.538 13.327 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -3.715 -7.837 13.683 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -3.416 -6.181 14.173 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -3.911 -5.641 11.599 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -4.719 -7.196 11.628 1.00 0.00 H new ATOM 40 N SER A 4 -2.934 -8.507 11.118 1.00 0.00 N ATOM 41 CA SER A 4 -3.021 -9.167 9.783 1.00 0.00 C ATOM 42 C SER A 4 -3.992 -8.402 8.881 1.00 0.00 C ATOM 43 O SER A 4 -4.896 -7.737 9.348 1.00 0.00 O ATOM 44 CB SER A 4 -3.548 -10.573 10.070 1.00 0.00 C ATOM 45 OG SER A 4 -2.467 -11.408 10.464 1.00 0.00 O ATOM 0 H SER A 4 -3.603 -8.841 11.812 1.00 0.00 H new ATOM 0 HA SER A 4 -2.060 -9.191 9.269 1.00 0.00 H new ATOM 0 HB2 SER A 4 -4.301 -10.538 10.857 1.00 0.00 H new ATOM 0 HB3 SER A 4 -4.033 -10.980 9.183 1.00 0.00 H new ATOM 0 HG SER A 4 -2.632 -11.752 11.367 1.00 0.00 H new ATOM 51 N LEU A 5 -3.816 -8.491 7.591 1.00 0.00 N ATOM 52 CA LEU A 5 -4.732 -7.768 6.664 1.00 0.00 C ATOM 53 C LEU A 5 -6.074 -8.498 6.571 1.00 0.00 C ATOM 54 O LEU A 5 -7.073 -7.931 6.177 1.00 0.00 O ATOM 55 CB LEU A 5 -4.021 -7.781 5.311 1.00 0.00 C ATOM 56 CG LEU A 5 -3.709 -6.347 4.883 1.00 0.00 C ATOM 57 CD1 LEU A 5 -2.443 -6.333 4.025 1.00 0.00 C ATOM 58 CD2 LEU A 5 -4.881 -5.792 4.070 1.00 0.00 C ATOM 0 H LEU A 5 -3.079 -9.032 7.139 1.00 0.00 H new ATOM 0 HA LEU A 5 -4.944 -6.754 7.002 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -3.100 -8.360 5.378 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -4.649 -8.266 4.563 1.00 0.00 H new ATOM 0 HG LEU A 5 -3.554 -5.730 5.768 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -2.221 -5.310 3.720 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -1.608 -6.729 4.603 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -2.597 -6.950 3.140 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -4.660 -4.769 3.764 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -5.035 -6.410 3.185 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -5.784 -5.801 4.681 1.00 0.00 H new ATOM 70 N LYS A 6 -6.106 -9.754 6.927 1.00 0.00 N ATOM 71 CA LYS A 6 -7.384 -10.519 6.854 1.00 0.00 C ATOM 72 C LYS A 6 -8.237 -10.254 8.098 1.00 0.00 C ATOM 73 O LYS A 6 -9.447 -10.178 8.028 1.00 0.00 O ATOM 74 CB LYS A 6 -6.963 -11.988 6.795 1.00 0.00 C ATOM 75 CG LYS A 6 -7.723 -12.690 5.670 1.00 0.00 C ATOM 76 CD LYS A 6 -7.742 -14.199 5.930 1.00 0.00 C ATOM 77 CE LYS A 6 -9.168 -14.644 6.259 1.00 0.00 C ATOM 78 NZ LYS A 6 -9.786 -14.960 4.942 1.00 0.00 N ATOM 0 H LYS A 6 -5.302 -10.283 7.265 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.987 -10.231 5.992 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -5.889 -12.063 6.625 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -7.170 -12.475 7.748 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.742 -12.308 5.611 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -7.249 -12.481 4.711 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -7.376 -14.734 5.054 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.074 -14.445 6.755 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.168 -15.515 6.914 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.718 -13.857 6.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -10.767 -15.273 5.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -9.778 -14.111 4.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.245 -15.717 4.478 1.00 0.00 H new ATOM 92 N ASP A 7 -7.616 -10.116 9.237 1.00 0.00 N ATOM 93 CA ASP A 7 -8.394 -9.860 10.484 1.00 0.00 C ATOM 94 C ASP A 7 -8.750 -8.374 10.601 1.00 0.00 C ATOM 95 O ASP A 7 -9.616 -7.994 11.364 1.00 0.00 O ATOM 96 CB ASP A 7 -7.464 -10.277 11.622 1.00 0.00 C ATOM 97 CG ASP A 7 -8.262 -10.376 12.923 1.00 0.00 C ATOM 98 OD1 ASP A 7 -9.287 -11.038 12.916 1.00 0.00 O ATOM 99 OD2 ASP A 7 -7.837 -9.788 13.903 1.00 0.00 O ATOM 0 H ASP A 7 -6.605 -10.169 9.359 1.00 0.00 H new ATOM 0 HA ASP A 7 -9.335 -10.410 10.499 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -7.000 -11.237 11.394 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -6.658 -9.551 11.732 1.00 0.00 H new ATOM 104 N ALA A 8 -8.088 -7.530 9.857 1.00 0.00 N ATOM 105 CA ALA A 8 -8.391 -6.072 9.937 1.00 0.00 C ATOM 106 C ALA A 8 -9.488 -5.696 8.935 1.00 0.00 C ATOM 107 O ALA A 8 -10.333 -4.868 9.208 1.00 0.00 O ATOM 108 CB ALA A 8 -7.078 -5.376 9.580 1.00 0.00 C ATOM 0 H ALA A 8 -7.352 -7.786 9.199 1.00 0.00 H new ATOM 0 HA ALA A 8 -8.754 -5.782 10.923 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -7.217 -4.296 9.616 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -6.307 -5.666 10.293 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.772 -5.669 8.576 1.00 0.00 H new ATOM 114 N ILE A 9 -9.476 -6.293 7.774 1.00 0.00 N ATOM 115 CA ILE A 9 -10.516 -5.962 6.754 1.00 0.00 C ATOM 116 C ILE A 9 -11.920 -6.132 7.342 1.00 0.00 C ATOM 117 O ILE A 9 -12.870 -5.531 6.882 1.00 0.00 O ATOM 118 CB ILE A 9 -10.289 -6.955 5.613 1.00 0.00 C ATOM 119 CG1 ILE A 9 -10.178 -8.373 6.182 1.00 0.00 C ATOM 120 CG2 ILE A 9 -8.999 -6.600 4.874 1.00 0.00 C ATOM 121 CD1 ILE A 9 -10.895 -9.353 5.251 1.00 0.00 C ATOM 0 H ILE A 9 -8.793 -6.994 7.487 1.00 0.00 H new ATOM 0 HA ILE A 9 -10.440 -4.928 6.416 1.00 0.00 H new ATOM 0 HB ILE A 9 -11.129 -6.907 4.920 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.130 -8.654 6.286 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -10.619 -8.412 7.178 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -8.839 -7.308 4.061 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -9.079 -5.592 4.466 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.159 -6.646 5.567 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -10.817 -10.362 5.655 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -11.946 -9.075 5.170 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -10.434 -9.321 4.264 1.00 0.00 H new ATOM 133 N LYS A 10 -12.060 -6.947 8.350 1.00 0.00 N ATOM 134 CA LYS A 10 -13.407 -7.152 8.957 1.00 0.00 C ATOM 135 C LYS A 10 -13.662 -6.112 10.051 1.00 0.00 C ATOM 136 O LYS A 10 -13.821 -6.441 11.209 1.00 0.00 O ATOM 137 CB LYS A 10 -13.359 -8.559 9.555 1.00 0.00 C ATOM 138 CG LYS A 10 -13.477 -9.593 8.434 1.00 0.00 C ATOM 139 CD LYS A 10 -14.859 -9.489 7.786 1.00 0.00 C ATOM 140 CE LYS A 10 -15.359 -10.890 7.425 1.00 0.00 C ATOM 141 NZ LYS A 10 -14.414 -11.377 6.381 1.00 0.00 N ATOM 0 H LYS A 10 -11.303 -7.479 8.780 1.00 0.00 H new ATOM 0 HA LYS A 10 -14.209 -7.044 8.227 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -12.426 -8.703 10.100 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -14.170 -8.689 10.271 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -12.700 -9.426 7.688 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -13.325 -10.596 8.833 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -15.558 -9.007 8.470 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -14.808 -8.868 6.892 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -15.358 -11.546 8.295 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -16.382 -10.860 7.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -14.857 -12.151 5.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -14.181 -10.598 5.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -13.544 -11.722 6.834 1.00 0.00 H new ATOM 155 N ASP A 11 -13.705 -4.858 9.691 1.00 0.00 N ATOM 156 CA ASP A 11 -13.951 -3.797 10.710 1.00 0.00 C ATOM 157 C ASP A 11 -15.271 -3.072 10.412 1.00 0.00 C ATOM 158 O ASP A 11 -15.553 -2.751 9.275 1.00 0.00 O ATOM 159 CB ASP A 11 -12.770 -2.835 10.571 1.00 0.00 C ATOM 160 CG ASP A 11 -12.165 -2.562 11.949 1.00 0.00 C ATOM 161 OD1 ASP A 11 -12.845 -1.961 12.765 1.00 0.00 O ATOM 162 OD2 ASP A 11 -11.033 -2.960 12.166 1.00 0.00 O ATOM 0 H ASP A 11 -13.581 -4.522 8.736 1.00 0.00 H new ATOM 0 HA ASP A 11 -14.031 -4.203 11.718 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -12.016 -3.262 9.910 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -13.100 -1.901 10.116 1.00 0.00 H new ATOM 167 N PRO A 12 -16.039 -2.834 11.446 1.00 0.00 N ATOM 168 CA PRO A 12 -17.337 -2.137 11.278 1.00 0.00 C ATOM 169 C PRO A 12 -17.109 -0.647 11.007 1.00 0.00 C ATOM 170 O PRO A 12 -17.953 0.030 10.454 1.00 0.00 O ATOM 171 CB PRO A 12 -18.032 -2.344 12.621 1.00 0.00 C ATOM 172 CG PRO A 12 -16.924 -2.563 13.602 1.00 0.00 C ATOM 173 CD PRO A 12 -15.778 -3.185 12.847 1.00 0.00 C ATOM 0 HA PRO A 12 -17.922 -2.514 10.439 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -18.633 -1.476 12.892 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -18.705 -3.200 12.589 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -16.619 -1.620 14.055 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -17.250 -3.215 14.412 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -14.819 -2.792 13.184 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -15.747 -4.265 12.988 1.00 0.00 H new ATOM 181 N ALA A 13 -15.973 -0.133 11.392 1.00 0.00 N ATOM 182 CA ALA A 13 -15.689 1.311 11.158 1.00 0.00 C ATOM 183 C ALA A 13 -15.052 1.509 9.780 1.00 0.00 C ATOM 184 O ALA A 13 -15.130 2.572 9.196 1.00 0.00 O ATOM 185 CB ALA A 13 -14.708 1.706 12.262 1.00 0.00 C ATOM 0 H ALA A 13 -15.229 -0.651 11.859 1.00 0.00 H new ATOM 0 HA ALA A 13 -16.594 1.918 11.180 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -14.449 2.760 12.158 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -15.169 1.540 13.235 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -13.805 1.101 12.180 1.00 0.00 H new ATOM 191 N LEU A 14 -14.422 0.494 9.257 1.00 0.00 N ATOM 192 CA LEU A 14 -13.781 0.623 7.917 1.00 0.00 C ATOM 193 C LEU A 14 -14.737 0.139 6.824 1.00 0.00 C ATOM 194 O LEU A 14 -14.605 0.494 5.669 1.00 0.00 O ATOM 195 CB LEU A 14 -12.543 -0.273 7.982 1.00 0.00 C ATOM 196 CG LEU A 14 -11.706 0.098 9.209 1.00 0.00 C ATOM 197 CD1 LEU A 14 -10.471 -0.800 9.274 1.00 0.00 C ATOM 198 CD2 LEU A 14 -11.267 1.560 9.102 1.00 0.00 C ATOM 0 H LEU A 14 -14.323 -0.420 9.699 1.00 0.00 H new ATOM 0 HA LEU A 14 -13.525 1.656 7.680 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -12.842 -1.320 8.036 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -11.949 -0.157 7.075 1.00 0.00 H new ATOM 0 HG LEU A 14 -12.303 -0.039 10.111 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -9.875 -0.536 10.148 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -10.782 -1.842 9.348 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -9.874 -0.663 8.372 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -10.671 1.826 9.975 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -10.670 1.696 8.200 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -12.147 2.202 9.055 1.00 0.00 H new ATOM 210 N GLU A 15 -15.698 -0.669 7.178 1.00 0.00 N ATOM 211 CA GLU A 15 -16.661 -1.176 6.159 1.00 0.00 C ATOM 212 C GLU A 15 -17.276 -0.009 5.382 1.00 0.00 C ATOM 213 O GLU A 15 -18.226 0.610 5.821 1.00 0.00 O ATOM 214 CB GLU A 15 -17.736 -1.911 6.962 1.00 0.00 C ATOM 215 CG GLU A 15 -18.728 -2.570 6.002 1.00 0.00 C ATOM 216 CD GLU A 15 -18.329 -4.030 5.779 1.00 0.00 C ATOM 217 OE1 GLU A 15 -18.443 -4.804 6.715 1.00 0.00 O ATOM 218 OE2 GLU A 15 -17.916 -4.348 4.677 1.00 0.00 O ATOM 0 H GLU A 15 -15.858 -1.000 8.129 1.00 0.00 H new ATOM 0 HA GLU A 15 -16.182 -1.826 5.427 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.276 -2.665 7.601 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.257 -1.213 7.617 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -19.737 -2.516 6.411 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -18.740 -2.036 5.052 1.00 0.00 H new ATOM 225 N ASN A 16 -16.746 0.294 4.229 1.00 0.00 N ATOM 226 CA ASN A 16 -17.303 1.419 3.424 1.00 0.00 C ATOM 227 C ASN A 16 -17.383 2.690 4.273 1.00 0.00 C ATOM 228 O ASN A 16 -18.374 2.951 4.926 1.00 0.00 O ATOM 229 CB ASN A 16 -18.705 0.957 3.022 1.00 0.00 C ATOM 230 CG ASN A 16 -18.615 0.065 1.782 1.00 0.00 C ATOM 231 OD1 ASN A 16 -17.568 -0.051 1.176 1.00 0.00 O ATOM 232 ND2 ASN A 16 -19.677 -0.576 1.376 1.00 0.00 N ATOM 0 H ASN A 16 -15.951 -0.188 3.809 1.00 0.00 H new ATOM 0 HA ASN A 16 -16.684 1.654 2.558 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -19.168 0.410 3.843 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -19.338 1.820 2.817 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -19.628 -1.174 0.551 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -20.556 -0.479 1.884 1.00 0.00 H new ATOM 239 N LYS A 17 -16.348 3.485 4.269 1.00 0.00 N ATOM 240 CA LYS A 17 -16.370 4.739 5.077 1.00 0.00 C ATOM 241 C LYS A 17 -16.174 5.958 4.172 1.00 0.00 C ATOM 242 O LYS A 17 -16.390 5.898 2.978 1.00 0.00 O ATOM 243 CB LYS A 17 -15.200 4.604 6.053 1.00 0.00 C ATOM 244 CG LYS A 17 -15.612 5.154 7.420 1.00 0.00 C ATOM 245 CD LYS A 17 -14.360 5.448 8.250 1.00 0.00 C ATOM 246 CE LYS A 17 -13.520 6.518 7.547 1.00 0.00 C ATOM 247 NZ LYS A 17 -12.685 7.118 8.624 1.00 0.00 N ATOM 0 H LYS A 17 -15.490 3.322 3.743 1.00 0.00 H new ATOM 0 HA LYS A 17 -17.319 4.878 5.594 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -14.906 3.558 6.143 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -14.333 5.147 5.676 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -16.201 6.063 7.296 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -16.244 4.433 7.939 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -14.643 5.789 9.246 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -13.774 4.538 8.379 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -12.900 6.082 6.763 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -14.152 7.269 7.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -12.080 7.862 8.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -13.302 7.531 9.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -12.089 6.381 9.052 1.00 0.00 H new ATOM 261 N GLU A 18 -15.764 7.063 4.731 1.00 0.00 N ATOM 262 CA GLU A 18 -15.553 8.285 3.903 1.00 0.00 C ATOM 263 C GLU A 18 -14.082 8.705 3.949 1.00 0.00 C ATOM 264 O GLU A 18 -13.669 9.464 4.803 1.00 0.00 O ATOM 265 CB GLU A 18 -16.440 9.354 4.544 1.00 0.00 C ATOM 266 CG GLU A 18 -16.871 10.367 3.482 1.00 0.00 C ATOM 267 CD GLU A 18 -18.143 9.872 2.793 1.00 0.00 C ATOM 268 OE1 GLU A 18 -18.951 9.250 3.462 1.00 0.00 O ATOM 269 OE2 GLU A 18 -18.289 10.125 1.608 1.00 0.00 O ATOM 0 H GLU A 18 -15.566 7.173 5.725 1.00 0.00 H new ATOM 0 HA GLU A 18 -15.803 8.125 2.854 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -17.317 8.890 4.996 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -15.898 9.859 5.344 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -17.048 11.339 3.942 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -16.076 10.502 2.749 1.00 0.00 H new ATOM 276 N HIS A 19 -13.288 8.214 3.037 1.00 0.00 N ATOM 277 CA HIS A 19 -11.843 8.583 3.029 1.00 0.00 C ATOM 278 C HIS A 19 -11.606 9.776 2.098 1.00 0.00 C ATOM 279 O HIS A 19 -10.569 9.894 1.476 1.00 0.00 O ATOM 280 CB HIS A 19 -11.123 7.341 2.505 1.00 0.00 C ATOM 281 CG HIS A 19 -11.396 7.184 1.034 1.00 0.00 C ATOM 282 ND1 HIS A 19 -10.466 7.533 0.068 1.00 0.00 N ATOM 283 CD2 HIS A 19 -12.491 6.718 0.348 1.00 0.00 C ATOM 284 CE1 HIS A 19 -11.012 7.275 -1.134 1.00 0.00 C ATOM 285 NE2 HIS A 19 -12.246 6.776 -1.021 1.00 0.00 N ATOM 0 H HIS A 19 -13.577 7.574 2.297 1.00 0.00 H new ATOM 0 HA HIS A 19 -11.485 8.877 4.016 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -10.051 7.429 2.679 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -11.462 6.457 3.045 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -13.404 6.361 0.802 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -10.513 7.450 -2.076 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -12.874 6.497 -1.775 1.00 0.00 H new ATOM 293 N ASP A 20 -12.560 10.662 1.997 1.00 0.00 N ATOM 294 CA ASP A 20 -12.388 11.847 1.107 1.00 0.00 C ATOM 295 C ASP A 20 -12.343 13.131 1.941 1.00 0.00 C ATOM 296 O ASP A 20 -13.022 14.095 1.649 1.00 0.00 O ATOM 297 CB ASP A 20 -13.616 11.843 0.196 1.00 0.00 C ATOM 298 CG ASP A 20 -13.182 11.583 -1.247 1.00 0.00 C ATOM 299 OD1 ASP A 20 -12.595 10.541 -1.490 1.00 0.00 O ATOM 300 OD2 ASP A 20 -13.441 12.431 -2.084 1.00 0.00 O ATOM 0 H ASP A 20 -13.451 10.617 2.492 1.00 0.00 H new ATOM 0 HA ASP A 20 -11.460 11.804 0.538 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -14.319 11.075 0.519 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -14.135 12.799 0.264 1.00 0.00 H new ATOM 305 N ILE A 21 -11.550 13.150 2.976 1.00 0.00 N ATOM 306 CA ILE A 21 -11.463 14.372 3.826 1.00 0.00 C ATOM 307 C ILE A 21 -10.091 15.032 3.666 1.00 0.00 C ATOM 308 O ILE A 21 -9.184 14.798 4.440 1.00 0.00 O ATOM 309 CB ILE A 21 -11.652 13.873 5.259 1.00 0.00 C ATOM 310 CG1 ILE A 21 -12.867 12.945 5.318 1.00 0.00 C ATOM 311 CG2 ILE A 21 -11.878 15.065 6.191 1.00 0.00 C ATOM 312 CD1 ILE A 21 -13.073 12.468 6.757 1.00 0.00 C ATOM 0 H ILE A 21 -10.958 12.373 3.271 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.209 15.118 3.552 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.761 13.330 5.574 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -13.756 13.469 4.966 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -12.718 12.091 4.658 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -12.013 14.708 7.212 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -11.014 15.728 6.149 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.769 15.609 5.876 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.938 11.807 6.801 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -12.187 11.929 7.092 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -13.241 13.328 7.405 1.00 0.00 H new ATOM 324 N GLY A 22 -9.932 15.855 2.666 1.00 0.00 N ATOM 325 CA GLY A 22 -8.620 16.530 2.457 1.00 0.00 C ATOM 326 C GLY A 22 -8.209 16.412 0.989 1.00 0.00 C ATOM 327 O GLY A 22 -8.973 15.949 0.164 1.00 0.00 O ATOM 0 H GLY A 22 -10.654 16.089 1.985 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -8.691 17.580 2.742 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -7.861 16.077 3.095 1.00 0.00 H new ATOM 331 N PRO A 23 -7.007 16.839 0.713 1.00 0.00 N ATOM 332 CA PRO A 23 -6.477 16.785 -0.672 1.00 0.00 C ATOM 333 C PRO A 23 -6.136 15.343 -1.059 1.00 0.00 C ATOM 334 O PRO A 23 -6.388 14.415 -0.318 1.00 0.00 O ATOM 335 CB PRO A 23 -5.218 17.643 -0.606 1.00 0.00 C ATOM 336 CG PRO A 23 -4.793 17.601 0.828 1.00 0.00 C ATOM 337 CD PRO A 23 -6.038 17.406 1.655 1.00 0.00 C ATOM 0 HA PRO A 23 -7.189 17.138 -1.418 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -4.439 17.251 -1.260 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -5.420 18.665 -0.928 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -4.087 16.787 0.997 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -4.287 18.525 1.107 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -5.858 16.734 2.494 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -6.392 18.349 2.072 1.00 0.00 H new ATOM 345 N ARG A 24 -5.561 15.153 -2.216 1.00 0.00 N ATOM 346 CA ARG A 24 -5.199 13.774 -2.656 1.00 0.00 C ATOM 347 C ARG A 24 -4.440 13.832 -3.984 1.00 0.00 C ATOM 348 O ARG A 24 -4.523 14.799 -4.716 1.00 0.00 O ATOM 349 CB ARG A 24 -6.532 13.044 -2.831 1.00 0.00 C ATOM 350 CG ARG A 24 -7.254 13.582 -4.068 1.00 0.00 C ATOM 351 CD ARG A 24 -8.601 12.871 -4.223 1.00 0.00 C ATOM 352 NE ARG A 24 -8.768 12.674 -5.689 1.00 0.00 N ATOM 353 CZ ARG A 24 -9.903 12.968 -6.264 1.00 0.00 C ATOM 354 NH1 ARG A 24 -10.973 12.271 -5.992 1.00 0.00 N ATOM 355 NH2 ARG A 24 -9.968 13.958 -7.110 1.00 0.00 N ATOM 0 H ARG A 24 -5.326 15.894 -2.876 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.553 13.268 -1.938 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -6.360 11.973 -2.935 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -7.153 13.183 -1.946 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -7.407 14.657 -3.974 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.643 13.424 -4.956 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -8.607 11.918 -3.694 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -9.413 13.470 -3.811 1.00 0.00 H new ATOM 0 HE ARG A 24 -7.995 12.309 -6.245 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -10.923 11.497 -5.330 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -11.859 12.501 -6.441 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.132 14.503 -7.323 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.855 14.188 -7.559 1.00 0.00 H new ATOM 369 N GLU A 25 -3.699 12.806 -4.302 1.00 0.00 N ATOM 370 CA GLU A 25 -2.936 12.807 -5.584 1.00 0.00 C ATOM 371 C GLU A 25 -2.881 11.394 -6.172 1.00 0.00 C ATOM 372 O GLU A 25 -3.504 10.479 -5.674 1.00 0.00 O ATOM 373 CB GLU A 25 -1.533 13.286 -5.208 1.00 0.00 C ATOM 374 CG GLU A 25 -1.510 14.814 -5.148 1.00 0.00 C ATOM 375 CD GLU A 25 -0.366 15.341 -6.016 1.00 0.00 C ATOM 376 OE1 GLU A 25 0.608 14.625 -6.178 1.00 0.00 O ATOM 377 OE2 GLU A 25 -0.485 16.453 -6.505 1.00 0.00 O ATOM 0 H GLU A 25 -3.588 11.968 -3.731 1.00 0.00 H new ATOM 0 HA GLU A 25 -3.398 13.445 -6.338 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -1.242 12.870 -4.243 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.808 12.930 -5.940 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.461 15.217 -5.497 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -1.382 15.146 -4.118 1.00 0.00 H new ATOM 384 N GLN A 26 -2.135 11.213 -7.228 1.00 0.00 N ATOM 385 CA GLN A 26 -2.034 9.860 -7.850 1.00 0.00 C ATOM 386 C GLN A 26 -0.581 9.563 -8.225 1.00 0.00 C ATOM 387 O GLN A 26 0.033 10.285 -8.986 1.00 0.00 O ATOM 388 CB GLN A 26 -2.907 9.937 -9.103 1.00 0.00 C ATOM 389 CG GLN A 26 -3.085 11.401 -9.511 1.00 0.00 C ATOM 390 CD GLN A 26 -3.762 11.473 -10.881 1.00 0.00 C ATOM 391 OE1 GLN A 26 -4.970 11.576 -10.969 1.00 0.00 O ATOM 392 NE2 GLN A 26 -3.031 11.423 -11.961 1.00 0.00 N ATOM 0 H GLN A 26 -1.591 11.943 -7.688 1.00 0.00 H new ATOM 0 HA GLN A 26 -2.358 9.067 -7.176 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -2.446 9.375 -9.916 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -3.878 9.481 -8.911 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -3.687 11.925 -8.769 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -2.116 11.900 -9.546 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -2.017 11.337 -11.887 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -3.473 11.470 -12.879 1.00 0.00 H new ATOM 401 N VAL A 27 -0.020 8.511 -7.693 1.00 0.00 N ATOM 402 CA VAL A 27 1.397 8.181 -8.019 1.00 0.00 C ATOM 403 C VAL A 27 1.520 6.720 -8.464 1.00 0.00 C ATOM 404 O VAL A 27 0.753 5.871 -8.060 1.00 0.00 O ATOM 405 CB VAL A 27 2.157 8.402 -6.713 1.00 0.00 C ATOM 406 CG1 VAL A 27 3.584 7.869 -6.852 1.00 0.00 C ATOM 407 CG2 VAL A 27 2.201 9.899 -6.400 1.00 0.00 C ATOM 0 H VAL A 27 -0.480 7.868 -7.049 1.00 0.00 H new ATOM 0 HA VAL A 27 1.784 8.792 -8.834 1.00 0.00 H new ATOM 0 HB VAL A 27 1.651 7.873 -5.905 1.00 0.00 H new ATOM 0 HG11 VAL A 27 4.124 8.028 -5.919 1.00 0.00 H new ATOM 0 HG12 VAL A 27 3.554 6.803 -7.077 1.00 0.00 H new ATOM 0 HG13 VAL A 27 4.092 8.396 -7.660 1.00 0.00 H new ATOM 0 HG21 VAL A 27 2.743 10.060 -5.468 1.00 0.00 H new ATOM 0 HG22 VAL A 27 2.707 10.425 -7.210 1.00 0.00 H new ATOM 0 HG23 VAL A 27 1.185 10.280 -6.299 1.00 0.00 H new ATOM 417 N ASN A 28 2.488 6.423 -9.289 1.00 0.00 N ATOM 418 CA ASN A 28 2.666 5.017 -9.753 1.00 0.00 C ATOM 419 C ASN A 28 3.796 4.351 -8.963 1.00 0.00 C ATOM 420 O ASN A 28 4.598 5.012 -8.335 1.00 0.00 O ATOM 421 CB ASN A 28 3.034 5.129 -11.232 1.00 0.00 C ATOM 422 CG ASN A 28 2.773 3.790 -11.924 1.00 0.00 C ATOM 423 OD1 ASN A 28 1.641 3.371 -12.056 1.00 0.00 O ATOM 424 ND2 ASN A 28 3.782 3.094 -12.375 1.00 0.00 N ATOM 0 H ASN A 28 3.162 7.092 -9.661 1.00 0.00 H new ATOM 0 HA ASN A 28 1.771 4.412 -9.607 1.00 0.00 H new ATOM 0 HB2 ASN A 28 2.447 5.916 -11.705 1.00 0.00 H new ATOM 0 HB3 ASN A 28 4.083 5.407 -11.337 1.00 0.00 H new ATOM 0 HD21 ASN A 28 3.619 2.200 -12.837 1.00 0.00 H new ATOM 0 HD22 ASN A 28 4.733 3.445 -12.265 1.00 0.00 H new ATOM 431 N PHE A 29 3.866 3.048 -8.986 1.00 0.00 N ATOM 432 CA PHE A 29 4.946 2.351 -8.228 1.00 0.00 C ATOM 433 C PHE A 29 5.603 1.276 -9.096 1.00 0.00 C ATOM 434 O PHE A 29 4.945 0.569 -9.834 1.00 0.00 O ATOM 435 CB PHE A 29 4.240 1.714 -7.031 1.00 0.00 C ATOM 436 CG PHE A 29 2.894 1.186 -7.463 1.00 0.00 C ATOM 437 CD1 PHE A 29 2.809 -0.020 -8.169 1.00 0.00 C ATOM 438 CD2 PHE A 29 1.730 1.903 -7.160 1.00 0.00 C ATOM 439 CE1 PHE A 29 1.560 -0.510 -8.570 1.00 0.00 C ATOM 440 CE2 PHE A 29 0.481 1.414 -7.561 1.00 0.00 C ATOM 441 CZ PHE A 29 0.396 0.207 -8.267 1.00 0.00 C ATOM 0 H PHE A 29 3.226 2.438 -9.494 1.00 0.00 H new ATOM 0 HA PHE A 29 5.738 3.034 -7.922 1.00 0.00 H new ATOM 0 HB2 PHE A 29 4.847 0.904 -6.626 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.116 2.449 -6.235 1.00 0.00 H new ATOM 0 HD1 PHE A 29 3.707 -0.572 -8.404 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.796 2.834 -6.617 1.00 0.00 H new ATOM 0 HE1 PHE A 29 1.494 -1.441 -9.113 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -0.416 1.967 -7.326 1.00 0.00 H new ATOM 0 HZ PHE A 29 -0.567 -0.170 -8.578 1.00 0.00 H new ATOM 451 N GLN A 30 6.898 1.147 -9.011 1.00 0.00 N ATOM 452 CA GLN A 30 7.605 0.118 -9.826 1.00 0.00 C ATOM 453 C GLN A 30 7.875 -1.132 -8.981 1.00 0.00 C ATOM 454 O GLN A 30 8.634 -1.098 -8.033 1.00 0.00 O ATOM 455 CB GLN A 30 8.920 0.778 -10.244 1.00 0.00 C ATOM 456 CG GLN A 30 8.792 1.314 -11.671 1.00 0.00 C ATOM 457 CD GLN A 30 7.774 2.454 -11.698 1.00 0.00 C ATOM 458 OE1 GLN A 30 6.829 2.422 -12.462 1.00 0.00 O ATOM 459 NE2 GLN A 30 7.925 3.469 -10.892 1.00 0.00 N ATOM 0 H GLN A 30 7.499 1.711 -8.411 1.00 0.00 H new ATOM 0 HA GLN A 30 7.018 -0.202 -10.687 1.00 0.00 H new ATOM 0 HB2 GLN A 30 9.165 1.590 -9.560 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.735 0.057 -10.187 1.00 0.00 H new ATOM 0 HG2 GLN A 30 9.760 1.668 -12.026 1.00 0.00 H new ATOM 0 HG3 GLN A 30 8.478 0.516 -12.344 1.00 0.00 H new ATOM 0 HE21 GLN A 30 8.717 3.497 -10.250 1.00 0.00 H new ATOM 0 HE22 GLN A 30 7.251 4.234 -10.904 1.00 0.00 H new ATOM 468 N LEU A 31 7.259 -2.232 -9.316 1.00 0.00 N ATOM 469 CA LEU A 31 7.481 -3.480 -8.531 1.00 0.00 C ATOM 470 C LEU A 31 8.770 -4.171 -8.987 1.00 0.00 C ATOM 471 O LEU A 31 8.906 -4.562 -10.129 1.00 0.00 O ATOM 472 CB LEU A 31 6.268 -4.362 -8.832 1.00 0.00 C ATOM 473 CG LEU A 31 4.997 -3.665 -8.345 1.00 0.00 C ATOM 474 CD1 LEU A 31 3.790 -4.220 -9.103 1.00 0.00 C ATOM 475 CD2 LEU A 31 4.818 -3.920 -6.847 1.00 0.00 C ATOM 0 H LEU A 31 6.612 -2.321 -10.099 1.00 0.00 H new ATOM 0 HA LEU A 31 7.586 -3.281 -7.464 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.202 -4.555 -9.903 1.00 0.00 H new ATOM 0 HB3 LEU A 31 6.377 -5.329 -8.340 1.00 0.00 H new ATOM 0 HG LEU A 31 5.079 -2.593 -8.525 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.883 -3.724 -8.757 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.917 -4.040 -10.171 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.709 -5.292 -8.923 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.912 -3.423 -6.499 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.736 -4.992 -6.668 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.678 -3.526 -6.306 1.00 0.00 H new ATOM 487 N LEU A 32 9.717 -4.323 -8.102 1.00 0.00 N ATOM 488 CA LEU A 32 10.997 -4.986 -8.485 1.00 0.00 C ATOM 489 C LEU A 32 11.412 -5.998 -7.415 1.00 0.00 C ATOM 490 O LEU A 32 11.686 -5.644 -6.285 1.00 0.00 O ATOM 491 CB LEU A 32 12.018 -3.852 -8.578 1.00 0.00 C ATOM 492 CG LEU A 32 11.569 -2.845 -9.637 1.00 0.00 C ATOM 493 CD1 LEU A 32 12.452 -1.597 -9.565 1.00 0.00 C ATOM 494 CD2 LEU A 32 11.696 -3.477 -11.025 1.00 0.00 C ATOM 0 H LEU A 32 9.660 -4.017 -7.131 1.00 0.00 H new ATOM 0 HA LEU A 32 10.912 -5.536 -9.422 1.00 0.00 H new ATOM 0 HB2 LEU A 32 12.118 -3.359 -7.611 1.00 0.00 H new ATOM 0 HB3 LEU A 32 12.999 -4.252 -8.834 1.00 0.00 H new ATOM 0 HG LEU A 32 10.531 -2.566 -9.455 1.00 0.00 H new ATOM 0 HD11 LEU A 32 12.131 -0.880 -10.321 1.00 0.00 H new ATOM 0 HD12 LEU A 32 12.365 -1.146 -8.576 1.00 0.00 H new ATOM 0 HD13 LEU A 32 13.490 -1.875 -9.747 1.00 0.00 H new ATOM 0 HD21 LEU A 32 11.376 -2.761 -11.782 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.735 -3.755 -11.204 1.00 0.00 H new ATOM 0 HD23 LEU A 32 11.068 -4.366 -11.079 1.00 0.00 H new ATOM 506 N ASP A 33 11.459 -7.257 -7.760 1.00 0.00 N ATOM 507 CA ASP A 33 11.857 -8.292 -6.763 1.00 0.00 C ATOM 508 C ASP A 33 13.344 -8.152 -6.420 1.00 0.00 C ATOM 509 O ASP A 33 13.892 -7.068 -6.432 1.00 0.00 O ATOM 510 CB ASP A 33 11.586 -9.629 -7.457 1.00 0.00 C ATOM 511 CG ASP A 33 10.144 -9.658 -7.965 1.00 0.00 C ATOM 512 OD1 ASP A 33 9.297 -9.057 -7.323 1.00 0.00 O ATOM 513 OD2 ASP A 33 9.909 -10.281 -8.987 1.00 0.00 O ATOM 0 H ASP A 33 11.239 -7.613 -8.690 1.00 0.00 H new ATOM 0 HA ASP A 33 11.308 -8.200 -5.826 1.00 0.00 H new ATOM 0 HB2 ASP A 33 12.278 -9.766 -8.288 1.00 0.00 H new ATOM 0 HB3 ASP A 33 11.755 -10.452 -6.762 1.00 0.00 H new ATOM 518 N LYS A 34 14.001 -9.239 -6.112 1.00 0.00 N ATOM 519 CA LYS A 34 15.450 -9.164 -5.770 1.00 0.00 C ATOM 520 C LYS A 34 16.305 -9.338 -7.029 1.00 0.00 C ATOM 521 O LYS A 34 17.481 -9.636 -6.955 1.00 0.00 O ATOM 522 CB LYS A 34 15.685 -10.321 -4.798 1.00 0.00 C ATOM 523 CG LYS A 34 17.125 -10.275 -4.282 1.00 0.00 C ATOM 524 CD LYS A 34 17.161 -10.740 -2.824 1.00 0.00 C ATOM 525 CE LYS A 34 17.364 -12.257 -2.775 1.00 0.00 C ATOM 526 NZ LYS A 34 16.980 -12.651 -1.391 1.00 0.00 N ATOM 0 H LYS A 34 13.596 -10.175 -6.083 1.00 0.00 H new ATOM 0 HA LYS A 34 15.722 -8.202 -5.336 1.00 0.00 H new ATOM 0 HB2 LYS A 34 14.987 -10.255 -3.963 1.00 0.00 H new ATOM 0 HB3 LYS A 34 15.497 -11.272 -5.297 1.00 0.00 H new ATOM 0 HG2 LYS A 34 17.762 -10.913 -4.894 1.00 0.00 H new ATOM 0 HG3 LYS A 34 17.519 -9.262 -4.361 1.00 0.00 H new ATOM 0 HD2 LYS A 34 17.968 -10.237 -2.291 1.00 0.00 H new ATOM 0 HD3 LYS A 34 16.231 -10.471 -2.322 1.00 0.00 H new ATOM 0 HE2 LYS A 34 16.745 -12.763 -3.516 1.00 0.00 H new ATOM 0 HE3 LYS A 34 18.399 -12.524 -2.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 17.092 -13.679 -1.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 17.591 -12.159 -0.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 15.988 -12.390 -1.218 1.00 0.00 H new ATOM 540 N ASN A 35 15.727 -9.153 -8.186 1.00 0.00 N ATOM 541 CA ASN A 35 16.512 -9.307 -9.444 1.00 0.00 C ATOM 542 C ASN A 35 16.223 -8.141 -10.396 1.00 0.00 C ATOM 543 O ASN A 35 16.456 -8.228 -11.585 1.00 0.00 O ATOM 544 CB ASN A 35 16.031 -10.626 -10.051 1.00 0.00 C ATOM 545 CG ASN A 35 15.440 -11.512 -8.953 1.00 0.00 C ATOM 546 OD1 ASN A 35 14.244 -11.715 -8.897 1.00 0.00 O ATOM 547 ND2 ASN A 35 16.235 -12.054 -8.070 1.00 0.00 N ATOM 0 H ASN A 35 14.747 -8.902 -8.314 1.00 0.00 H new ATOM 0 HA ASN A 35 17.587 -9.309 -9.262 1.00 0.00 H new ATOM 0 HB2 ASN A 35 15.282 -10.433 -10.819 1.00 0.00 H new ATOM 0 HB3 ASN A 35 16.861 -11.138 -10.538 1.00 0.00 H new ATOM 0 HD21 ASN A 35 15.851 -12.647 -7.334 1.00 0.00 H new ATOM 0 HD22 ASN A 35 17.240 -11.884 -8.116 1.00 0.00 H new ATOM 554 N ASN A 36 15.719 -7.052 -9.883 1.00 0.00 N ATOM 555 CA ASN A 36 15.417 -5.883 -10.759 1.00 0.00 C ATOM 556 C ASN A 36 14.615 -6.331 -11.983 1.00 0.00 C ATOM 557 O ASN A 36 14.935 -5.993 -13.106 1.00 0.00 O ATOM 558 CB ASN A 36 16.782 -5.341 -11.182 1.00 0.00 C ATOM 559 CG ASN A 36 17.067 -4.034 -10.439 1.00 0.00 C ATOM 560 OD1 ASN A 36 16.235 -3.149 -10.404 1.00 0.00 O ATOM 561 ND2 ASN A 36 18.213 -3.876 -9.838 1.00 0.00 N ATOM 0 H ASN A 36 15.503 -6.921 -8.895 1.00 0.00 H new ATOM 0 HA ASN A 36 14.820 -5.128 -10.247 1.00 0.00 H new ATOM 0 HB2 ASN A 36 17.559 -6.073 -10.963 1.00 0.00 H new ATOM 0 HB3 ASN A 36 16.799 -5.171 -12.258 1.00 0.00 H new ATOM 0 HD21 ASN A 36 18.412 -3.009 -9.338 1.00 0.00 H new ATOM 0 HD22 ASN A 36 18.911 -4.619 -9.868 1.00 0.00 H new ATOM 568 N GLU A 37 13.574 -7.090 -11.776 1.00 0.00 N ATOM 569 CA GLU A 37 12.753 -7.559 -12.930 1.00 0.00 C ATOM 570 C GLU A 37 11.355 -6.936 -12.871 1.00 0.00 C ATOM 571 O GLU A 37 10.471 -7.434 -12.203 1.00 0.00 O ATOM 572 CB GLU A 37 12.672 -9.077 -12.769 1.00 0.00 C ATOM 573 CG GLU A 37 12.264 -9.710 -14.100 1.00 0.00 C ATOM 574 CD GLU A 37 10.986 -10.527 -13.906 1.00 0.00 C ATOM 575 OE1 GLU A 37 9.925 -9.927 -13.856 1.00 0.00 O ATOM 576 OE2 GLU A 37 11.090 -11.739 -13.812 1.00 0.00 O ATOM 0 H GLU A 37 13.256 -7.406 -10.860 1.00 0.00 H new ATOM 0 HA GLU A 37 13.187 -7.275 -13.889 1.00 0.00 H new ATOM 0 HB2 GLU A 37 13.636 -9.471 -12.447 1.00 0.00 H new ATOM 0 HB3 GLU A 37 11.948 -9.333 -11.995 1.00 0.00 H new ATOM 0 HG2 GLU A 37 12.102 -8.935 -14.849 1.00 0.00 H new ATOM 0 HG3 GLU A 37 13.065 -10.350 -14.471 1.00 0.00 H new ATOM 713 N SER A 45 -3.098 -8.138 -6.712 1.00 0.00 N ATOM 714 CA SER A 45 -4.003 -7.459 -5.738 1.00 0.00 C ATOM 715 C SER A 45 -4.097 -5.962 -6.050 1.00 0.00 C ATOM 716 O SER A 45 -5.117 -5.477 -6.495 1.00 0.00 O ATOM 717 CB SER A 45 -3.364 -7.687 -4.369 1.00 0.00 C ATOM 718 OG SER A 45 -4.374 -8.046 -3.434 1.00 0.00 O ATOM 0 HA SER A 45 -5.019 -7.852 -5.780 1.00 0.00 H new ATOM 0 HB2 SER A 45 -2.613 -8.475 -4.432 1.00 0.00 H new ATOM 0 HB3 SER A 45 -2.851 -6.784 -4.039 1.00 0.00 H new ATOM 0 HG SER A 45 -4.945 -8.742 -3.821 1.00 0.00 H new ATOM 724 N ILE A 46 -3.044 -5.226 -5.821 1.00 0.00 N ATOM 725 CA ILE A 46 -3.081 -3.763 -6.107 1.00 0.00 C ATOM 726 C ILE A 46 -3.458 -3.520 -7.571 1.00 0.00 C ATOM 727 O ILE A 46 -3.328 -4.391 -8.409 1.00 0.00 O ATOM 728 CB ILE A 46 -1.663 -3.268 -5.828 1.00 0.00 C ATOM 729 CG1 ILE A 46 -1.387 -3.339 -4.324 1.00 0.00 C ATOM 730 CG2 ILE A 46 -1.526 -1.820 -6.301 1.00 0.00 C ATOM 731 CD1 ILE A 46 -0.454 -4.516 -4.029 1.00 0.00 C ATOM 0 H ILE A 46 -2.160 -5.574 -5.449 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.820 -3.242 -5.499 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.948 -3.894 -6.361 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -0.934 -2.408 -3.983 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.323 -3.457 -3.777 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -0.514 -1.466 -6.102 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -1.725 -1.766 -7.371 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -2.241 -1.194 -5.767 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -0.258 -4.565 -2.958 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.924 -5.444 -4.355 1.00 0.00 H new ATOM 0 HD13 ILE A 46 0.486 -4.378 -4.564 1.00 0.00 H new ATOM 743 N LYS A 47 -3.926 -2.344 -7.885 1.00 0.00 N ATOM 744 CA LYS A 47 -4.312 -2.047 -9.295 1.00 0.00 C ATOM 745 C LYS A 47 -4.263 -0.538 -9.554 1.00 0.00 C ATOM 746 O LYS A 47 -3.832 -0.092 -10.599 1.00 0.00 O ATOM 747 CB LYS A 47 -5.742 -2.570 -9.434 1.00 0.00 C ATOM 748 CG LYS A 47 -6.268 -2.260 -10.837 1.00 0.00 C ATOM 749 CD LYS A 47 -7.624 -2.941 -11.038 1.00 0.00 C ATOM 750 CE LYS A 47 -8.547 -2.595 -9.868 1.00 0.00 C ATOM 751 NZ LYS A 47 -8.579 -1.107 -9.829 1.00 0.00 N ATOM 0 H LYS A 47 -4.058 -1.575 -7.227 1.00 0.00 H new ATOM 0 HA LYS A 47 -3.637 -2.512 -10.013 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.766 -3.645 -9.255 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.384 -2.108 -8.684 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.367 -1.183 -10.969 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.559 -2.609 -11.588 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -8.071 -2.614 -11.977 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -7.494 -4.021 -11.105 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -9.545 -3.007 -10.017 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -8.169 -3.006 -8.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -9.503 -0.789 -9.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -7.827 -0.760 -9.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -8.429 -0.731 -10.787 1.00 0.00 H new ATOM 765 N ASP A 48 -4.700 0.253 -8.611 1.00 0.00 N ATOM 766 CA ASP A 48 -4.674 1.731 -8.807 1.00 0.00 C ATOM 767 C ASP A 48 -3.306 2.286 -8.414 1.00 0.00 C ATOM 768 O ASP A 48 -2.521 1.610 -7.780 1.00 0.00 O ATOM 769 CB ASP A 48 -5.760 2.272 -7.876 1.00 0.00 C ATOM 770 CG ASP A 48 -7.073 2.413 -8.649 1.00 0.00 C ATOM 771 OD1 ASP A 48 -7.014 2.548 -9.859 1.00 0.00 O ATOM 772 OD2 ASP A 48 -8.115 2.384 -8.016 1.00 0.00 O ATOM 0 H ASP A 48 -5.073 -0.060 -7.715 1.00 0.00 H new ATOM 0 HA ASP A 48 -4.849 2.016 -9.844 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -5.895 1.600 -7.029 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -5.459 3.238 -7.471 1.00 0.00 H new ATOM 777 N PRO A 49 -3.066 3.504 -8.808 1.00 0.00 N ATOM 778 CA PRO A 49 -1.776 4.160 -8.494 1.00 0.00 C ATOM 779 C PRO A 49 -1.715 4.533 -7.010 1.00 0.00 C ATOM 780 O PRO A 49 -2.711 4.874 -6.404 1.00 0.00 O ATOM 781 CB PRO A 49 -1.785 5.408 -9.374 1.00 0.00 C ATOM 782 CG PRO A 49 -3.231 5.697 -9.623 1.00 0.00 C ATOM 783 CD PRO A 49 -3.962 4.378 -9.574 1.00 0.00 C ATOM 0 HA PRO A 49 -0.912 3.522 -8.681 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -1.295 6.245 -8.876 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -1.251 5.236 -10.308 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -3.622 6.382 -8.871 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -3.367 6.177 -10.592 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -4.933 4.478 -9.089 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -4.144 3.985 -10.574 1.00 0.00 H new ATOM 791 N ALA A 50 -0.554 4.465 -6.423 1.00 0.00 N ATOM 792 CA ALA A 50 -0.425 4.811 -4.978 1.00 0.00 C ATOM 793 C ALA A 50 -0.818 6.273 -4.743 1.00 0.00 C ATOM 794 O ALA A 50 0.016 7.153 -4.712 1.00 0.00 O ATOM 795 CB ALA A 50 1.051 4.594 -4.650 1.00 0.00 C ATOM 0 H ALA A 50 0.313 4.185 -6.881 1.00 0.00 H new ATOM 0 HA ALA A 50 -1.077 4.204 -4.350 1.00 0.00 H new ATOM 0 HB1 ALA A 50 1.229 4.828 -3.600 1.00 0.00 H new ATOM 0 HB2 ALA A 50 1.317 3.554 -4.840 1.00 0.00 H new ATOM 0 HB3 ALA A 50 1.662 5.245 -5.275 1.00 0.00 H new ATOM 801 N ASP A 51 -2.084 6.538 -4.573 1.00 0.00 N ATOM 802 CA ASP A 51 -2.525 7.942 -4.334 1.00 0.00 C ATOM 803 C ASP A 51 -1.798 8.515 -3.114 1.00 0.00 C ATOM 804 O ASP A 51 -1.141 7.803 -2.382 1.00 0.00 O ATOM 805 CB ASP A 51 -4.029 7.846 -4.070 1.00 0.00 C ATOM 806 CG ASP A 51 -4.753 7.464 -5.362 1.00 0.00 C ATOM 807 OD1 ASP A 51 -4.592 6.335 -5.796 1.00 0.00 O ATOM 808 OD2 ASP A 51 -5.454 8.307 -5.896 1.00 0.00 O ATOM 0 H ASP A 51 -2.832 5.844 -4.589 1.00 0.00 H new ATOM 0 HA ASP A 51 -2.304 8.598 -5.176 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -4.226 7.103 -3.297 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -4.405 8.799 -3.699 1.00 0.00 H new ATOM 813 N VAL A 52 -1.906 9.796 -2.891 1.00 0.00 N ATOM 814 CA VAL A 52 -1.215 10.404 -1.718 1.00 0.00 C ATOM 815 C VAL A 52 -2.101 11.469 -1.066 1.00 0.00 C ATOM 816 O VAL A 52 -2.552 12.396 -1.709 1.00 0.00 O ATOM 817 CB VAL A 52 0.051 11.039 -2.292 1.00 0.00 C ATOM 818 CG1 VAL A 52 0.827 11.736 -1.174 1.00 0.00 C ATOM 819 CG2 VAL A 52 0.928 9.951 -2.918 1.00 0.00 C ATOM 0 H VAL A 52 -2.440 10.446 -3.467 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.991 9.667 -0.947 1.00 0.00 H new ATOM 0 HB VAL A 52 -0.224 11.770 -3.053 1.00 0.00 H new ATOM 0 HG11 VAL A 52 1.730 12.188 -1.585 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.204 12.511 -0.727 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.101 11.006 -0.412 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.831 10.403 -3.328 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.201 9.221 -2.156 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.377 9.454 -3.716 1.00 0.00 H new ATOM 829 N TYR A 53 -2.347 11.345 0.210 1.00 0.00 N ATOM 830 CA TYR A 53 -3.198 12.352 0.909 1.00 0.00 C ATOM 831 C TYR A 53 -2.317 13.301 1.725 1.00 0.00 C ATOM 832 O TYR A 53 -2.081 13.091 2.898 1.00 0.00 O ATOM 833 CB TYR A 53 -4.107 11.535 1.826 1.00 0.00 C ATOM 834 CG TYR A 53 -5.280 11.010 1.033 1.00 0.00 C ATOM 835 CD1 TYR A 53 -5.063 10.141 -0.043 1.00 0.00 C ATOM 836 CD2 TYR A 53 -6.582 11.391 1.374 1.00 0.00 C ATOM 837 CE1 TYR A 53 -6.149 9.654 -0.779 1.00 0.00 C ATOM 838 CE2 TYR A 53 -7.669 10.904 0.638 1.00 0.00 C ATOM 839 CZ TYR A 53 -7.453 10.035 -0.437 1.00 0.00 C ATOM 840 OH TYR A 53 -8.524 9.555 -1.162 1.00 0.00 O ATOM 0 H TYR A 53 -1.996 10.590 0.799 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.772 12.967 0.216 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.550 10.707 2.264 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -4.460 12.153 2.651 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -4.058 9.846 -0.305 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -6.749 12.061 2.205 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -5.982 8.985 -1.610 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -8.674 11.199 0.900 1.00 0.00 H new ATOM 0 HH TYR A 53 -9.033 8.922 -0.614 1.00 0.00 H new ATOM 850 N TYR A 54 -1.826 14.340 1.109 1.00 0.00 N ATOM 851 CA TYR A 54 -0.953 15.302 1.843 1.00 0.00 C ATOM 852 C TYR A 54 -1.746 16.010 2.947 1.00 0.00 C ATOM 853 O TYR A 54 -2.865 16.437 2.746 1.00 0.00 O ATOM 854 CB TYR A 54 -0.494 16.303 0.783 1.00 0.00 C ATOM 855 CG TYR A 54 0.450 15.621 -0.181 1.00 0.00 C ATOM 856 CD1 TYR A 54 1.477 14.800 0.302 1.00 0.00 C ATOM 857 CD2 TYR A 54 0.296 15.809 -1.560 1.00 0.00 C ATOM 858 CE1 TYR A 54 2.349 14.168 -0.593 1.00 0.00 C ATOM 859 CE2 TYR A 54 1.168 15.177 -2.455 1.00 0.00 C ATOM 860 CZ TYR A 54 2.194 14.357 -1.971 1.00 0.00 C ATOM 861 OH TYR A 54 3.054 13.733 -2.853 1.00 0.00 O ATOM 0 H TYR A 54 -1.991 14.566 0.128 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.113 14.807 2.330 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.355 16.700 0.245 1.00 0.00 H new ATOM 0 HB3 TYR A 54 0.003 17.149 1.258 1.00 0.00 H new ATOM 0 HD1 TYR A 54 1.596 14.654 1.365 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -0.496 16.442 -1.933 1.00 0.00 H new ATOM 0 HE1 TYR A 54 3.141 13.535 -0.220 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.049 15.322 -3.519 1.00 0.00 H new ATOM 0 HH TYR A 54 2.808 13.968 -3.772 1.00 0.00 H new ATOM 871 N THR A 55 -1.169 16.138 4.111 1.00 0.00 N ATOM 872 CA THR A 55 -1.881 16.818 5.231 1.00 0.00 C ATOM 873 C THR A 55 -0.916 17.728 5.995 1.00 0.00 C ATOM 874 O THR A 55 0.188 17.986 5.557 1.00 0.00 O ATOM 875 CB THR A 55 -2.376 15.686 6.133 1.00 0.00 C ATOM 876 OG1 THR A 55 -1.311 14.777 6.374 1.00 0.00 O ATOM 877 CG2 THR A 55 -3.532 14.953 5.453 1.00 0.00 C ATOM 0 H THR A 55 -0.233 15.800 4.335 1.00 0.00 H new ATOM 0 HA THR A 55 -2.699 17.446 4.879 1.00 0.00 H new ATOM 0 HB THR A 55 -2.723 16.101 7.079 1.00 0.00 H new ATOM 0 HG1 THR A 55 -1.625 14.051 6.953 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.882 14.147 6.098 1.00 0.00 H new ATOM 0 HG22 THR A 55 -4.348 15.652 5.270 1.00 0.00 H new ATOM 0 HG23 THR A 55 -3.191 14.536 4.505 1.00 0.00 H new ATOM 885 N LYS A 56 -1.321 18.214 7.137 1.00 0.00 N ATOM 886 CA LYS A 56 -0.422 19.103 7.930 1.00 0.00 C ATOM 887 C LYS A 56 0.662 18.274 8.623 1.00 0.00 C ATOM 888 O LYS A 56 1.742 18.755 8.902 1.00 0.00 O ATOM 889 CB LYS A 56 -1.331 19.766 8.965 1.00 0.00 C ATOM 890 CG LYS A 56 -1.740 18.734 10.018 1.00 0.00 C ATOM 891 CD LYS A 56 -2.998 19.215 10.744 1.00 0.00 C ATOM 892 CE LYS A 56 -4.139 18.226 10.503 1.00 0.00 C ATOM 893 NZ LYS A 56 -4.832 18.110 11.816 1.00 0.00 N ATOM 0 H LYS A 56 -2.234 18.035 7.555 1.00 0.00 H new ATOM 0 HA LYS A 56 0.088 19.837 7.306 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -0.813 20.600 9.439 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -2.216 20.176 8.478 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.927 17.770 9.544 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.930 18.587 10.732 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -2.801 19.306 11.812 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -3.280 20.205 10.387 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -4.817 18.586 9.729 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.760 17.260 10.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -5.629 17.447 11.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.164 17.758 12.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -5.188 19.044 12.104 1.00 0.00 H new ATOM 907 N LYS A 57 0.381 17.031 8.906 1.00 0.00 N ATOM 908 CA LYS A 57 1.395 16.172 9.582 1.00 0.00 C ATOM 909 C LYS A 57 2.408 15.646 8.561 1.00 0.00 C ATOM 910 O LYS A 57 3.554 16.048 8.546 1.00 0.00 O ATOM 911 CB LYS A 57 0.597 15.020 10.190 1.00 0.00 C ATOM 912 CG LYS A 57 0.104 15.419 11.582 1.00 0.00 C ATOM 913 CD LYS A 57 0.197 14.216 12.523 1.00 0.00 C ATOM 914 CE LYS A 57 0.323 14.706 13.968 1.00 0.00 C ATOM 915 NZ LYS A 57 0.919 13.562 14.712 1.00 0.00 N ATOM 0 H LYS A 57 -0.507 16.573 8.698 1.00 0.00 H new ATOM 0 HA LYS A 57 1.961 16.717 10.337 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -0.250 14.773 9.550 1.00 0.00 H new ATOM 0 HB3 LYS A 57 1.219 14.127 10.255 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.703 16.243 11.969 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -0.926 15.772 11.527 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -0.688 13.588 12.417 1.00 0.00 H new ATOM 0 HD3 LYS A 57 1.058 13.601 12.260 1.00 0.00 H new ATOM 0 HE2 LYS A 57 0.957 15.591 14.031 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -0.649 14.980 14.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 1.036 13.822 15.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 0.291 12.736 14.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 1.847 13.328 14.304 1.00 0.00 H new ATOM 929 N LYS A 58 1.995 14.749 7.709 1.00 0.00 N ATOM 930 CA LYS A 58 2.938 14.200 6.692 1.00 0.00 C ATOM 931 C LYS A 58 2.163 13.608 5.510 1.00 0.00 C ATOM 932 O LYS A 58 0.984 13.334 5.603 1.00 0.00 O ATOM 933 CB LYS A 58 3.717 13.107 7.423 1.00 0.00 C ATOM 934 CG LYS A 58 4.975 12.761 6.626 1.00 0.00 C ATOM 935 CD LYS A 58 5.891 13.984 6.565 1.00 0.00 C ATOM 936 CE LYS A 58 6.070 14.420 5.109 1.00 0.00 C ATOM 937 NZ LYS A 58 7.393 15.100 5.070 1.00 0.00 N ATOM 0 H LYS A 58 1.048 14.372 7.672 1.00 0.00 H new ATOM 0 HA LYS A 58 3.596 14.968 6.285 1.00 0.00 H new ATOM 0 HB2 LYS A 58 3.988 13.445 8.423 1.00 0.00 H new ATOM 0 HB3 LYS A 58 3.095 12.220 7.544 1.00 0.00 H new ATOM 0 HG2 LYS A 58 5.496 11.926 7.093 1.00 0.00 H new ATOM 0 HG3 LYS A 58 4.705 12.445 5.618 1.00 0.00 H new ATOM 0 HD2 LYS A 58 5.465 14.799 7.149 1.00 0.00 H new ATOM 0 HD3 LYS A 58 6.859 13.748 7.006 1.00 0.00 H new ATOM 0 HE2 LYS A 58 6.046 13.564 4.435 1.00 0.00 H new ATOM 0 HE3 LYS A 58 5.271 15.093 4.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 7.906 14.812 4.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 7.253 16.131 5.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 7.945 14.834 5.910 1.00 0.00 H new ATOM 951 N ALA A 59 2.820 13.409 4.400 1.00 0.00 N ATOM 952 CA ALA A 59 2.126 12.835 3.211 1.00 0.00 C ATOM 953 C ALA A 59 1.593 11.436 3.534 1.00 0.00 C ATOM 954 O ALA A 59 2.220 10.671 4.241 1.00 0.00 O ATOM 955 CB ALA A 59 3.198 12.761 2.125 1.00 0.00 C ATOM 0 H ALA A 59 3.809 13.619 4.265 1.00 0.00 H new ATOM 0 HA ALA A 59 1.272 13.437 2.901 1.00 0.00 H new ATOM 0 HB1 ALA A 59 2.765 12.347 1.214 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.581 13.761 1.923 1.00 0.00 H new ATOM 0 HB3 ALA A 59 4.014 12.121 2.462 1.00 0.00 H new ATOM 961 N GLU A 60 0.443 11.096 3.024 1.00 0.00 N ATOM 962 CA GLU A 60 -0.126 9.748 3.305 1.00 0.00 C ATOM 963 C GLU A 60 -0.427 9.012 1.996 1.00 0.00 C ATOM 964 O GLU A 60 -1.410 9.279 1.336 1.00 0.00 O ATOM 965 CB GLU A 60 -1.419 10.016 4.076 1.00 0.00 C ATOM 966 CG GLU A 60 -1.133 10.006 5.578 1.00 0.00 C ATOM 967 CD GLU A 60 -2.431 10.266 6.346 1.00 0.00 C ATOM 968 OE1 GLU A 60 -3.331 9.449 6.242 1.00 0.00 O ATOM 969 OE2 GLU A 60 -2.502 11.278 7.023 1.00 0.00 O ATOM 0 H GLU A 60 -0.128 11.692 2.425 1.00 0.00 H new ATOM 0 HA GLU A 60 0.565 9.121 3.869 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -1.837 10.979 3.782 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -2.163 9.258 3.832 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.710 9.045 5.872 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -0.394 10.768 5.823 1.00 0.00 H new ATOM 976 N VAL A 61 0.410 8.083 1.620 1.00 0.00 N ATOM 977 CA VAL A 61 0.164 7.331 0.357 1.00 0.00 C ATOM 978 C VAL A 61 -1.014 6.372 0.544 1.00 0.00 C ATOM 979 O VAL A 61 -1.401 6.061 1.653 1.00 0.00 O ATOM 980 CB VAL A 61 1.453 6.553 0.099 1.00 0.00 C ATOM 981 CG1 VAL A 61 1.315 5.751 -1.198 1.00 0.00 C ATOM 982 CG2 VAL A 61 2.618 7.533 -0.030 1.00 0.00 C ATOM 0 H VAL A 61 1.251 7.813 2.131 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.085 7.988 -0.476 1.00 0.00 H new ATOM 0 HB VAL A 61 1.640 5.871 0.929 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.235 5.196 -1.382 1.00 0.00 H new ATOM 0 HG12 VAL A 61 0.482 5.054 -1.108 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.130 6.432 -2.029 1.00 0.00 H new ATOM 0 HG21 VAL A 61 3.539 6.981 -0.214 1.00 0.00 H new ATOM 0 HG22 VAL A 61 2.431 8.214 -0.861 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.716 8.105 0.893 1.00 0.00 H new ATOM 992 N GLU A 62 -1.592 5.904 -0.528 1.00 0.00 N ATOM 993 CA GLU A 62 -2.746 4.970 -0.397 1.00 0.00 C ATOM 994 C GLU A 62 -2.762 3.972 -1.555 1.00 0.00 C ATOM 995 O GLU A 62 -2.695 4.342 -2.711 1.00 0.00 O ATOM 996 CB GLU A 62 -3.984 5.864 -0.441 1.00 0.00 C ATOM 997 CG GLU A 62 -5.235 5.020 -0.181 1.00 0.00 C ATOM 998 CD GLU A 62 -6.153 5.080 -1.402 1.00 0.00 C ATOM 999 OE1 GLU A 62 -6.441 6.177 -1.849 1.00 0.00 O ATOM 1000 OE2 GLU A 62 -6.553 4.027 -1.870 1.00 0.00 O ATOM 0 H GLU A 62 -1.317 6.126 -1.485 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.697 4.383 0.520 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.903 6.652 0.307 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.058 6.353 -1.412 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.954 3.987 0.025 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.759 5.390 0.700 1.00 0.00 H new ATOM 1007 N LEU A 63 -2.856 2.707 -1.251 1.00 0.00 N ATOM 1008 CA LEU A 63 -2.884 1.678 -2.329 1.00 0.00 C ATOM 1009 C LEU A 63 -4.223 0.935 -2.307 1.00 0.00 C ATOM 1010 O LEU A 63 -4.731 0.587 -1.259 1.00 0.00 O ATOM 1011 CB LEU A 63 -1.733 0.727 -2.001 1.00 0.00 C ATOM 1012 CG LEU A 63 -0.500 1.116 -2.818 1.00 0.00 C ATOM 1013 CD1 LEU A 63 0.660 0.181 -2.471 1.00 0.00 C ATOM 1014 CD2 LEU A 63 -0.820 0.998 -4.310 1.00 0.00 C ATOM 0 H LEU A 63 -2.915 2.341 -0.301 1.00 0.00 H new ATOM 0 HA LEU A 63 -2.777 2.113 -3.323 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.505 0.769 -0.936 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.021 -0.300 -2.225 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.220 2.143 -2.585 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.538 0.459 -3.054 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.889 0.264 -1.408 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.381 -0.847 -2.703 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.058 1.275 -4.893 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.100 -0.029 -4.542 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -1.646 1.664 -4.559 1.00 0.00 H new ATOM 1026 N ASP A 64 -4.799 0.697 -3.452 1.00 0.00 N ATOM 1027 CA ASP A 64 -6.107 -0.019 -3.493 1.00 0.00 C ATOM 1028 C ASP A 64 -5.890 -1.515 -3.728 1.00 0.00 C ATOM 1029 O ASP A 64 -5.375 -1.926 -4.748 1.00 0.00 O ATOM 1030 CB ASP A 64 -6.861 0.606 -4.668 1.00 0.00 C ATOM 1031 CG ASP A 64 -6.712 2.128 -4.617 1.00 0.00 C ATOM 1032 OD1 ASP A 64 -5.637 2.609 -4.937 1.00 0.00 O ATOM 1033 OD2 ASP A 64 -7.674 2.786 -4.258 1.00 0.00 O ATOM 0 H ASP A 64 -4.422 0.966 -4.361 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.657 0.074 -2.557 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -6.470 0.223 -5.610 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -7.915 0.331 -4.625 1.00 0.00 H new ATOM 1038 N ILE A 65 -6.284 -2.334 -2.791 1.00 0.00 N ATOM 1039 CA ILE A 65 -6.104 -3.804 -2.960 1.00 0.00 C ATOM 1040 C ILE A 65 -7.389 -4.428 -3.515 1.00 0.00 C ATOM 1041 O ILE A 65 -8.472 -3.911 -3.324 1.00 0.00 O ATOM 1042 CB ILE A 65 -5.811 -4.332 -1.555 1.00 0.00 C ATOM 1043 CG1 ILE A 65 -4.329 -4.122 -1.233 1.00 0.00 C ATOM 1044 CG2 ILE A 65 -6.139 -5.825 -1.490 1.00 0.00 C ATOM 1045 CD1 ILE A 65 -4.157 -2.817 -0.451 1.00 0.00 C ATOM 0 H ILE A 65 -6.723 -2.049 -1.916 1.00 0.00 H new ATOM 0 HA ILE A 65 -5.304 -4.048 -3.659 1.00 0.00 H new ATOM 0 HB ILE A 65 -6.423 -3.795 -0.830 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -3.950 -4.961 -0.649 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.747 -4.086 -2.154 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -5.930 -6.200 -0.488 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -7.193 -5.976 -1.721 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.528 -6.364 -2.214 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.102 -2.667 -0.221 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -4.520 -1.983 -1.051 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -4.726 -2.871 0.477 1.00 0.00 H new ATOM 1057 N ASN A 66 -7.279 -5.530 -4.204 1.00 0.00 N ATOM 1058 CA ASN A 66 -8.498 -6.177 -4.772 1.00 0.00 C ATOM 1059 C ASN A 66 -8.736 -7.541 -4.118 1.00 0.00 C ATOM 1060 O ASN A 66 -9.850 -8.022 -4.056 1.00 0.00 O ATOM 1061 CB ASN A 66 -8.200 -6.341 -6.262 1.00 0.00 C ATOM 1062 CG ASN A 66 -9.001 -7.520 -6.816 1.00 0.00 C ATOM 1063 OD1 ASN A 66 -10.175 -7.392 -7.100 1.00 0.00 O ATOM 1064 ND2 ASN A 66 -8.412 -8.672 -6.983 1.00 0.00 N ATOM 0 H ASN A 66 -6.401 -6.011 -4.399 1.00 0.00 H new ATOM 0 HA ASN A 66 -9.396 -5.585 -4.597 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -8.459 -5.428 -6.798 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -7.134 -6.509 -6.414 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -8.937 -9.465 -7.352 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -7.426 -8.780 -6.745 1.00 0.00 H new ATOM 1071 N THR A 67 -7.700 -8.170 -3.634 1.00 0.00 N ATOM 1072 CA THR A 67 -7.874 -9.503 -2.990 1.00 0.00 C ATOM 1073 C THR A 67 -7.534 -9.423 -1.499 1.00 0.00 C ATOM 1074 O THR A 67 -6.696 -10.149 -1.004 1.00 0.00 O ATOM 1075 CB THR A 67 -6.894 -10.426 -3.716 1.00 0.00 C ATOM 1076 OG1 THR A 67 -5.944 -9.641 -4.422 1.00 0.00 O ATOM 1077 CG2 THR A 67 -7.659 -11.313 -4.698 1.00 0.00 C ATOM 0 H THR A 67 -6.742 -7.819 -3.656 1.00 0.00 H new ATOM 0 HA THR A 67 -8.901 -9.863 -3.060 1.00 0.00 H new ATOM 0 HB THR A 67 -6.378 -11.055 -2.990 1.00 0.00 H new ATOM 0 HG1 THR A 67 -5.314 -10.230 -4.887 1.00 0.00 H new ATOM 0 HG21 THR A 67 -6.960 -11.970 -5.215 1.00 0.00 H new ATOM 0 HG22 THR A 67 -8.388 -11.914 -4.154 1.00 0.00 H new ATOM 0 HG23 THR A 67 -8.176 -10.688 -5.426 1.00 0.00 H new ATOM 1085 N ALA A 68 -8.180 -8.545 -0.783 1.00 0.00 N ATOM 1086 CA ALA A 68 -7.897 -8.415 0.677 1.00 0.00 C ATOM 1087 C ALA A 68 -8.081 -9.765 1.377 1.00 0.00 C ATOM 1088 O ALA A 68 -7.504 -10.020 2.416 1.00 0.00 O ATOM 1089 CB ALA A 68 -8.925 -7.405 1.187 1.00 0.00 C ATOM 0 H ALA A 68 -8.892 -7.911 -1.145 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.874 -8.094 0.872 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -8.785 -7.252 2.257 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.794 -6.457 0.665 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -9.930 -7.785 1.003 1.00 0.00 H new ATOM 1095 N SER A 69 -8.884 -10.629 0.819 1.00 0.00 N ATOM 1096 CA SER A 69 -9.110 -11.959 1.455 1.00 0.00 C ATOM 1097 C SER A 69 -7.859 -12.840 1.337 1.00 0.00 C ATOM 1098 O SER A 69 -7.782 -13.900 1.927 1.00 0.00 O ATOM 1099 CB SER A 69 -10.270 -12.576 0.674 1.00 0.00 C ATOM 1100 OG SER A 69 -11.500 -12.149 1.246 1.00 0.00 O ATOM 0 H SER A 69 -9.394 -10.472 -0.050 1.00 0.00 H new ATOM 0 HA SER A 69 -9.328 -11.869 2.519 1.00 0.00 H new ATOM 0 HB2 SER A 69 -10.219 -12.277 -0.373 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.202 -13.664 0.698 1.00 0.00 H new ATOM 0 HG SER A 69 -12.013 -11.646 0.580 1.00 0.00 H new ATOM 1106 N THR A 70 -6.879 -12.420 0.581 1.00 0.00 N ATOM 1107 CA THR A 70 -5.647 -13.248 0.434 1.00 0.00 C ATOM 1108 C THR A 70 -4.440 -12.552 1.073 1.00 0.00 C ATOM 1109 O THR A 70 -3.321 -13.010 0.957 1.00 0.00 O ATOM 1110 CB THR A 70 -5.445 -13.386 -1.075 1.00 0.00 C ATOM 1111 OG1 THR A 70 -4.953 -12.161 -1.599 1.00 0.00 O ATOM 1112 CG2 THR A 70 -6.779 -13.730 -1.739 1.00 0.00 C ATOM 0 H THR A 70 -6.878 -11.543 0.061 1.00 0.00 H new ATOM 0 HA THR A 70 -5.745 -14.214 0.930 1.00 0.00 H new ATOM 0 HB THR A 70 -4.727 -14.181 -1.276 1.00 0.00 H new ATOM 0 HG1 THR A 70 -5.491 -11.418 -1.254 1.00 0.00 H new ATOM 0 HG21 THR A 70 -6.635 -13.828 -2.815 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.154 -14.670 -1.336 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.500 -12.937 -1.540 1.00 0.00 H new ATOM 1120 N TRP A 71 -4.649 -11.451 1.745 1.00 0.00 N ATOM 1121 CA TRP A 71 -3.501 -10.741 2.381 1.00 0.00 C ATOM 1122 C TRP A 71 -3.329 -11.198 3.832 1.00 0.00 C ATOM 1123 O TRP A 71 -4.232 -11.090 4.638 1.00 0.00 O ATOM 1124 CB TRP A 71 -3.876 -9.260 2.329 1.00 0.00 C ATOM 1125 CG TRP A 71 -3.398 -8.667 1.043 1.00 0.00 C ATOM 1126 CD1 TRP A 71 -4.151 -8.522 -0.071 1.00 0.00 C ATOM 1127 CD2 TRP A 71 -2.080 -8.136 0.719 1.00 0.00 C ATOM 1128 NE1 TRP A 71 -3.379 -7.936 -1.058 1.00 0.00 N ATOM 1129 CE2 TRP A 71 -2.095 -7.680 -0.620 1.00 0.00 C ATOM 1130 CE3 TRP A 71 -0.885 -8.008 1.450 1.00 0.00 C ATOM 1131 CZ2 TRP A 71 -0.966 -7.116 -1.214 1.00 0.00 C ATOM 1132 CZ3 TRP A 71 0.254 -7.440 0.855 1.00 0.00 C ATOM 1133 CH2 TRP A 71 0.214 -6.996 -0.474 1.00 0.00 C ATOM 0 H TRP A 71 -5.561 -11.014 1.881 1.00 0.00 H new ATOM 0 HA TRP A 71 -2.559 -10.944 1.872 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -4.956 -9.145 2.415 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -3.431 -8.732 3.172 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -5.185 -8.816 -0.173 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -3.717 -7.719 -1.996 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -0.843 -8.348 2.474 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -1.003 -6.775 -2.238 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 1.166 -7.345 1.425 1.00 0.00 H new ATOM 0 HH2 TRP A 71 1.094 -6.562 -0.926 1.00 0.00 H new ATOM 1144 N LYS A 72 -2.175 -11.705 4.172 1.00 0.00 N ATOM 1145 CA LYS A 72 -1.946 -12.164 5.573 1.00 0.00 C ATOM 1146 C LYS A 72 -1.339 -11.028 6.403 1.00 0.00 C ATOM 1147 O LYS A 72 -1.973 -10.483 7.283 1.00 0.00 O ATOM 1148 CB LYS A 72 -0.964 -13.330 5.454 1.00 0.00 C ATOM 1149 CG LYS A 72 -0.542 -13.789 6.851 1.00 0.00 C ATOM 1150 CD LYS A 72 -1.751 -14.376 7.583 1.00 0.00 C ATOM 1151 CE LYS A 72 -2.211 -13.403 8.671 1.00 0.00 C ATOM 1152 NZ LYS A 72 -2.682 -14.270 9.787 1.00 0.00 N ATOM 0 H LYS A 72 -1.382 -11.821 3.542 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.869 -12.463 6.069 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.427 -14.155 4.913 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.089 -13.025 4.880 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.249 -14.535 6.777 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.135 -12.949 7.414 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.562 -14.560 6.878 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.490 -15.337 8.026 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.396 -12.755 8.992 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -3.010 -12.755 8.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.951 -13.677 10.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -3.506 -14.822 9.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.919 -14.917 10.069 1.00 0.00 H new ATOM 1166 N LYS A 73 -0.115 -10.666 6.126 1.00 0.00 N ATOM 1167 CA LYS A 73 0.529 -9.562 6.894 1.00 0.00 C ATOM 1168 C LYS A 73 1.046 -8.488 5.933 1.00 0.00 C ATOM 1169 O LYS A 73 0.977 -8.638 4.730 1.00 0.00 O ATOM 1170 CB LYS A 73 1.687 -10.221 7.646 1.00 0.00 C ATOM 1171 CG LYS A 73 2.778 -10.633 6.656 1.00 0.00 C ATOM 1172 CD LYS A 73 3.967 -11.218 7.421 1.00 0.00 C ATOM 1173 CE LYS A 73 3.999 -12.736 7.234 1.00 0.00 C ATOM 1174 NZ LYS A 73 5.237 -13.182 7.931 1.00 0.00 N ATOM 0 H LYS A 73 0.466 -11.087 5.401 1.00 0.00 H new ATOM 0 HA LYS A 73 -0.165 -9.070 7.576 1.00 0.00 H new ATOM 0 HB2 LYS A 73 2.094 -9.530 8.384 1.00 0.00 H new ATOM 0 HB3 LYS A 73 1.329 -11.094 8.191 1.00 0.00 H new ATOM 0 HG2 LYS A 73 2.387 -11.368 5.953 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.097 -9.771 6.071 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.897 -10.777 7.061 1.00 0.00 H new ATOM 0 HD3 LYS A 73 3.887 -10.973 8.480 1.00 0.00 H new ATOM 0 HE2 LYS A 73 3.113 -13.206 7.662 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.022 -13.004 6.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 5.330 -14.214 7.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.064 -12.724 7.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 5.183 -12.920 8.936 1.00 0.00 H new ATOM 1188 N PHE A 74 1.563 -7.406 6.450 1.00 0.00 N ATOM 1189 CA PHE A 74 2.082 -6.333 5.555 1.00 0.00 C ATOM 1190 C PHE A 74 2.757 -5.230 6.376 1.00 0.00 C ATOM 1191 O PHE A 74 2.202 -4.728 7.332 1.00 0.00 O ATOM 1192 CB PHE A 74 0.849 -5.787 4.831 1.00 0.00 C ATOM 1193 CG PHE A 74 1.259 -4.691 3.870 1.00 0.00 C ATOM 1194 CD1 PHE A 74 2.540 -4.695 3.298 1.00 0.00 C ATOM 1195 CD2 PHE A 74 0.354 -3.671 3.548 1.00 0.00 C ATOM 1196 CE1 PHE A 74 2.911 -3.680 2.407 1.00 0.00 C ATOM 1197 CE2 PHE A 74 0.729 -2.658 2.657 1.00 0.00 C ATOM 1198 CZ PHE A 74 2.007 -2.662 2.087 1.00 0.00 C ATOM 0 H PHE A 74 1.648 -7.219 7.449 1.00 0.00 H new ATOM 0 HA PHE A 74 2.831 -6.708 4.858 1.00 0.00 H new ATOM 0 HB2 PHE A 74 0.350 -6.590 4.289 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.133 -5.398 5.556 1.00 0.00 H new ATOM 0 HD1 PHE A 74 3.239 -5.480 3.544 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -0.633 -3.666 3.987 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.897 -3.683 1.966 1.00 0.00 H new ATOM 0 HE2 PHE A 74 0.031 -1.872 2.409 1.00 0.00 H new ATOM 0 HZ PHE A 74 2.295 -1.880 1.401 1.00 0.00 H new ATOM 1208 N GLU A 75 3.949 -4.849 6.005 1.00 0.00 N ATOM 1209 CA GLU A 75 4.661 -3.777 6.760 1.00 0.00 C ATOM 1210 C GLU A 75 5.803 -3.208 5.913 1.00 0.00 C ATOM 1211 O GLU A 75 6.916 -3.694 5.945 1.00 0.00 O ATOM 1212 CB GLU A 75 5.211 -4.468 8.009 1.00 0.00 C ATOM 1213 CG GLU A 75 5.464 -3.425 9.099 1.00 0.00 C ATOM 1214 CD GLU A 75 5.344 -4.084 10.474 1.00 0.00 C ATOM 1215 OE1 GLU A 75 5.311 -5.304 10.525 1.00 0.00 O ATOM 1216 OE2 GLU A 75 5.287 -3.359 11.454 1.00 0.00 O ATOM 0 H GLU A 75 4.461 -5.234 5.211 1.00 0.00 H new ATOM 0 HA GLU A 75 4.006 -2.944 7.013 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.503 -5.217 8.365 1.00 0.00 H new ATOM 0 HB3 GLU A 75 6.137 -4.992 7.770 1.00 0.00 H new ATOM 0 HG2 GLU A 75 6.456 -2.990 8.978 1.00 0.00 H new ATOM 0 HG3 GLU A 75 4.746 -2.610 9.011 1.00 0.00 H new ATOM 1223 N VAL A 76 5.534 -2.182 5.152 1.00 0.00 N ATOM 1224 CA VAL A 76 6.602 -1.584 4.299 1.00 0.00 C ATOM 1225 C VAL A 76 7.741 -1.041 5.167 1.00 0.00 C ATOM 1226 O VAL A 76 7.546 -0.683 6.313 1.00 0.00 O ATOM 1227 CB VAL A 76 5.914 -0.446 3.546 1.00 0.00 C ATOM 1228 CG1 VAL A 76 6.967 0.403 2.830 1.00 0.00 C ATOM 1229 CG2 VAL A 76 4.945 -1.029 2.516 1.00 0.00 C ATOM 0 H VAL A 76 4.621 -1.732 5.084 1.00 0.00 H new ATOM 0 HA VAL A 76 7.044 -2.315 3.623 1.00 0.00 H new ATOM 0 HB VAL A 76 5.364 0.176 4.252 1.00 0.00 H new ATOM 0 HG11 VAL A 76 6.476 1.215 2.293 1.00 0.00 H new ATOM 0 HG12 VAL A 76 7.659 0.819 3.563 1.00 0.00 H new ATOM 0 HG13 VAL A 76 7.517 -0.219 2.124 1.00 0.00 H new ATOM 0 HG21 VAL A 76 4.454 -0.218 1.979 1.00 0.00 H new ATOM 0 HG22 VAL A 76 5.495 -1.651 1.810 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.194 -1.634 3.024 1.00 0.00 H new ATOM 1239 N TYR A 77 8.928 -0.973 4.628 1.00 0.00 N ATOM 1240 CA TYR A 77 10.081 -0.451 5.419 1.00 0.00 C ATOM 1241 C TYR A 77 11.068 0.272 4.497 1.00 0.00 C ATOM 1242 O TYR A 77 11.324 -0.154 3.389 1.00 0.00 O ATOM 1243 CB TYR A 77 10.731 -1.688 6.042 1.00 0.00 C ATOM 1244 CG TYR A 77 12.159 -1.808 5.566 1.00 0.00 C ATOM 1245 CD1 TYR A 77 13.150 -0.984 6.113 1.00 0.00 C ATOM 1246 CD2 TYR A 77 12.492 -2.744 4.581 1.00 0.00 C ATOM 1247 CE1 TYR A 77 14.474 -1.096 5.674 1.00 0.00 C ATOM 1248 CE2 TYR A 77 13.816 -2.856 4.141 1.00 0.00 C ATOM 1249 CZ TYR A 77 14.807 -2.032 4.688 1.00 0.00 C ATOM 1250 OH TYR A 77 16.113 -2.142 4.255 1.00 0.00 O ATOM 0 H TYR A 77 9.150 -1.256 3.674 1.00 0.00 H new ATOM 0 HA TYR A 77 9.771 0.268 6.178 1.00 0.00 H new ATOM 0 HB2 TYR A 77 10.705 -1.616 7.129 1.00 0.00 H new ATOM 0 HB3 TYR A 77 10.170 -2.582 5.769 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.893 -0.262 6.874 1.00 0.00 H new ATOM 0 HD2 TYR A 77 11.727 -3.380 4.160 1.00 0.00 H new ATOM 0 HE1 TYR A 77 15.239 -0.460 6.096 1.00 0.00 H new ATOM 0 HE2 TYR A 77 14.073 -3.578 3.380 1.00 0.00 H new ATOM 0 HH TYR A 77 16.173 -2.839 3.569 1.00 0.00 H new ATOM 1260 N GLU A 78 11.622 1.365 4.948 1.00 0.00 N ATOM 1261 CA GLU A 78 12.592 2.116 4.097 1.00 0.00 C ATOM 1262 C GLU A 78 13.793 2.562 4.934 1.00 0.00 C ATOM 1263 O GLU A 78 13.664 2.880 6.099 1.00 0.00 O ATOM 1264 CB GLU A 78 11.813 3.330 3.591 1.00 0.00 C ATOM 1265 CG GLU A 78 11.033 3.955 4.750 1.00 0.00 C ATOM 1266 CD GLU A 78 11.016 5.476 4.595 1.00 0.00 C ATOM 1267 OE1 GLU A 78 11.433 5.949 3.550 1.00 0.00 O ATOM 1268 OE2 GLU A 78 10.586 6.142 5.521 1.00 0.00 O ATOM 0 H GLU A 78 11.446 1.771 5.867 1.00 0.00 H new ATOM 0 HA GLU A 78 12.982 1.510 3.279 1.00 0.00 H new ATOM 0 HB2 GLU A 78 12.498 4.062 3.163 1.00 0.00 H new ATOM 0 HB3 GLU A 78 11.128 3.031 2.797 1.00 0.00 H new ATOM 0 HG2 GLU A 78 10.014 3.569 4.765 1.00 0.00 H new ATOM 0 HG3 GLU A 78 11.492 3.681 5.700 1.00 0.00 H new ATOM 1275 N ASN A 79 14.961 2.587 4.345 1.00 0.00 N ATOM 1276 CA ASN A 79 16.179 3.012 5.099 1.00 0.00 C ATOM 1277 C ASN A 79 16.497 2.004 6.207 1.00 0.00 C ATOM 1278 O ASN A 79 17.449 1.254 6.121 1.00 0.00 O ATOM 1279 CB ASN A 79 15.827 4.376 5.694 1.00 0.00 C ATOM 1280 CG ASN A 79 16.929 5.380 5.355 1.00 0.00 C ATOM 1281 OD1 ASN A 79 17.410 5.419 4.239 1.00 0.00 O ATOM 1282 ND2 ASN A 79 17.354 6.199 6.277 1.00 0.00 N ATOM 0 H ASN A 79 15.124 2.331 3.371 1.00 0.00 H new ATOM 0 HA ASN A 79 17.060 3.065 4.459 1.00 0.00 H new ATOM 0 HB2 ASN A 79 14.872 4.721 5.299 1.00 0.00 H new ATOM 0 HB3 ASN A 79 15.714 4.295 6.775 1.00 0.00 H new ATOM 0 HD21 ASN A 79 18.090 6.872 6.062 1.00 0.00 H new ATOM 0 HD22 ASN A 79 16.951 6.167 7.213 1.00 0.00 H new ATOM 1289 N ASN A 80 15.711 1.981 7.248 1.00 0.00 N ATOM 1290 CA ASN A 80 15.974 1.022 8.359 1.00 0.00 C ATOM 1291 C ASN A 80 14.828 1.056 9.373 1.00 0.00 C ATOM 1292 O ASN A 80 15.041 0.975 10.566 1.00 0.00 O ATOM 1293 CB ASN A 80 17.274 1.509 9.000 1.00 0.00 C ATOM 1294 CG ASN A 80 18.223 0.326 9.194 1.00 0.00 C ATOM 1295 OD1 ASN A 80 18.888 -0.093 8.267 1.00 0.00 O ATOM 1296 ND2 ASN A 80 18.314 -0.237 10.368 1.00 0.00 N ATOM 0 H ASN A 80 14.899 2.584 7.378 1.00 0.00 H new ATOM 0 HA ASN A 80 16.052 -0.007 8.007 1.00 0.00 H new ATOM 0 HB2 ASN A 80 17.742 2.264 8.369 1.00 0.00 H new ATOM 0 HB3 ASN A 80 17.064 1.981 9.960 1.00 0.00 H new ATOM 0 HD21 ASN A 80 18.943 -1.028 10.507 1.00 0.00 H new ATOM 0 HD22 ASN A 80 17.756 0.114 11.147 1.00 0.00 H new ATOM 1303 N GLN A 81 13.614 1.178 8.909 1.00 0.00 N ATOM 1304 CA GLN A 81 12.458 1.217 9.849 1.00 0.00 C ATOM 1305 C GLN A 81 11.176 0.766 9.141 1.00 0.00 C ATOM 1306 O GLN A 81 10.846 1.240 8.071 1.00 0.00 O ATOM 1307 CB GLN A 81 12.346 2.680 10.277 1.00 0.00 C ATOM 1308 CG GLN A 81 11.924 2.751 11.746 1.00 0.00 C ATOM 1309 CD GLN A 81 12.535 3.995 12.395 1.00 0.00 C ATOM 1310 OE1 GLN A 81 11.898 5.025 12.477 1.00 0.00 O ATOM 1311 NE2 GLN A 81 13.753 3.941 12.861 1.00 0.00 N ATOM 0 H GLN A 81 13.373 1.252 7.921 1.00 0.00 H new ATOM 0 HA GLN A 81 12.599 0.550 10.700 1.00 0.00 H new ATOM 0 HB2 GLN A 81 13.302 3.185 10.137 1.00 0.00 H new ATOM 0 HB3 GLN A 81 11.618 3.198 9.653 1.00 0.00 H new ATOM 0 HG2 GLN A 81 10.837 2.785 11.822 1.00 0.00 H new ATOM 0 HG3 GLN A 81 12.252 1.855 12.273 1.00 0.00 H new ATOM 0 HE21 GLN A 81 14.288 3.075 12.792 1.00 0.00 H new ATOM 0 HE22 GLN A 81 14.170 4.765 13.294 1.00 0.00 H new ATOM 1320 N LYS A 82 10.452 -0.146 9.731 1.00 0.00 N ATOM 1321 CA LYS A 82 9.191 -0.627 9.096 1.00 0.00 C ATOM 1322 C LYS A 82 8.016 0.259 9.517 1.00 0.00 C ATOM 1323 O LYS A 82 7.731 0.410 10.690 1.00 0.00 O ATOM 1324 CB LYS A 82 9.002 -2.050 9.624 1.00 0.00 C ATOM 1325 CG LYS A 82 9.396 -3.057 8.540 1.00 0.00 C ATOM 1326 CD LYS A 82 8.927 -4.455 8.947 1.00 0.00 C ATOM 1327 CE LYS A 82 9.832 -5.507 8.301 1.00 0.00 C ATOM 1328 NZ LYS A 82 10.125 -6.482 9.387 1.00 0.00 N ATOM 0 H LYS A 82 10.679 -0.579 10.626 1.00 0.00 H new ATOM 0 HA LYS A 82 9.239 -0.597 8.007 1.00 0.00 H new ATOM 0 HB2 LYS A 82 9.612 -2.202 10.515 1.00 0.00 H new ATOM 0 HB3 LYS A 82 7.964 -2.205 9.918 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.949 -2.775 7.587 1.00 0.00 H new ATOM 0 HG3 LYS A 82 10.477 -3.051 8.399 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.951 -4.556 10.032 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.894 -4.608 8.635 1.00 0.00 H new ATOM 0 HE2 LYS A 82 9.336 -5.991 7.459 1.00 0.00 H new ATOM 0 HE3 LYS A 82 10.748 -5.058 7.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.742 -7.235 9.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.603 -5.994 10.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.236 -6.899 9.729 1.00 0.00 H new ATOM 1342 N LEU A 83 7.331 0.847 8.575 1.00 0.00 N ATOM 1343 CA LEU A 83 6.177 1.720 8.934 1.00 0.00 C ATOM 1344 C LEU A 83 4.909 0.875 9.098 1.00 0.00 C ATOM 1345 O LEU A 83 4.677 -0.044 8.337 1.00 0.00 O ATOM 1346 CB LEU A 83 6.030 2.686 7.758 1.00 0.00 C ATOM 1347 CG LEU A 83 7.279 3.564 7.660 1.00 0.00 C ATOM 1348 CD1 LEU A 83 7.228 4.386 6.371 1.00 0.00 C ATOM 1349 CD2 LEU A 83 7.330 4.508 8.863 1.00 0.00 C ATOM 0 H LEU A 83 7.519 0.762 7.576 1.00 0.00 H new ATOM 0 HA LEU A 83 6.333 2.247 9.875 1.00 0.00 H new ATOM 0 HB2 LEU A 83 5.890 2.129 6.831 1.00 0.00 H new ATOM 0 HB3 LEU A 83 5.145 3.308 7.893 1.00 0.00 H new ATOM 0 HG LEU A 83 8.167 2.932 7.652 1.00 0.00 H new ATOM 0 HD11 LEU A 83 8.118 5.011 6.303 1.00 0.00 H new ATOM 0 HD12 LEU A 83 7.189 3.715 5.513 1.00 0.00 H new ATOM 0 HD13 LEU A 83 6.340 5.019 6.378 1.00 0.00 H new ATOM 0 HD21 LEU A 83 8.219 5.135 8.796 1.00 0.00 H new ATOM 0 HD22 LEU A 83 6.441 5.138 8.869 1.00 0.00 H new ATOM 0 HD23 LEU A 83 7.366 3.924 9.783 1.00 0.00 H new ATOM 1361 N PRO A 84 4.126 1.211 10.090 1.00 0.00 N ATOM 1362 CA PRO A 84 2.870 0.468 10.350 1.00 0.00 C ATOM 1363 C PRO A 84 1.807 0.832 9.310 1.00 0.00 C ATOM 1364 O PRO A 84 1.373 1.963 9.223 1.00 0.00 O ATOM 1365 CB PRO A 84 2.454 0.941 11.739 1.00 0.00 C ATOM 1366 CG PRO A 84 3.085 2.289 11.897 1.00 0.00 C ATOM 1367 CD PRO A 84 4.332 2.302 11.050 1.00 0.00 C ATOM 0 HA PRO A 84 2.993 -0.613 10.292 1.00 0.00 H new ATOM 0 HB2 PRO A 84 1.369 1.001 11.827 1.00 0.00 H new ATOM 0 HB3 PRO A 84 2.799 0.252 12.510 1.00 0.00 H new ATOM 0 HG2 PRO A 84 2.398 3.074 11.582 1.00 0.00 H new ATOM 0 HG3 PRO A 84 3.328 2.479 12.942 1.00 0.00 H new ATOM 0 HD2 PRO A 84 4.460 3.259 10.544 1.00 0.00 H new ATOM 0 HD3 PRO A 84 5.225 2.139 11.653 1.00 0.00 H new ATOM 1375 N VAL A 85 1.386 -0.116 8.519 1.00 0.00 N ATOM 1376 CA VAL A 85 0.353 0.179 7.486 1.00 0.00 C ATOM 1377 C VAL A 85 -1.031 0.280 8.135 1.00 0.00 C ATOM 1378 O VAL A 85 -1.436 -0.578 8.893 1.00 0.00 O ATOM 1379 CB VAL A 85 0.410 -1.004 6.521 1.00 0.00 C ATOM 1380 CG1 VAL A 85 -0.230 -2.230 7.174 1.00 0.00 C ATOM 1381 CG2 VAL A 85 -0.352 -0.652 5.244 1.00 0.00 C ATOM 0 H VAL A 85 1.712 -1.082 8.543 1.00 0.00 H new ATOM 0 HA VAL A 85 0.534 1.127 6.979 1.00 0.00 H new ATOM 0 HB VAL A 85 1.449 -1.225 6.278 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.188 -3.073 6.484 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.311 -2.481 8.086 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -1.270 -2.011 7.418 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -0.313 -1.494 4.553 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.391 -0.431 5.489 1.00 0.00 H new ATOM 0 HG23 VAL A 85 0.104 0.221 4.777 1.00 0.00 H new ATOM 1391 N ARG A 86 -1.759 1.322 7.839 1.00 0.00 N ATOM 1392 CA ARG A 86 -3.118 1.476 8.436 1.00 0.00 C ATOM 1393 C ARG A 86 -4.187 1.307 7.353 1.00 0.00 C ATOM 1394 O ARG A 86 -3.893 1.309 6.175 1.00 0.00 O ATOM 1395 CB ARG A 86 -3.145 2.896 9.000 1.00 0.00 C ATOM 1396 CG ARG A 86 -2.903 3.900 7.872 1.00 0.00 C ATOM 1397 CD ARG A 86 -3.924 5.035 7.973 1.00 0.00 C ATOM 1398 NE ARG A 86 -3.301 6.031 8.888 1.00 0.00 N ATOM 1399 CZ ARG A 86 -3.924 7.144 9.162 1.00 0.00 C ATOM 1400 NH1 ARG A 86 -4.697 7.697 8.269 1.00 0.00 N ATOM 1401 NH2 ARG A 86 -3.776 7.704 10.332 1.00 0.00 N ATOM 0 H ARG A 86 -1.473 2.073 7.211 1.00 0.00 H new ATOM 0 HA ARG A 86 -3.321 0.731 9.205 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -4.107 3.092 9.475 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.381 3.007 9.770 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -1.891 4.300 7.937 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -2.988 3.404 6.905 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.128 5.471 6.995 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.875 4.677 8.367 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.387 5.843 9.300 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -4.815 7.259 7.355 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -5.184 8.567 8.484 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -3.173 7.271 11.032 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -4.263 8.574 10.546 1.00 0.00 H new ATOM 1415 N LEU A 87 -5.424 1.158 7.742 1.00 0.00 N ATOM 1416 CA LEU A 87 -6.504 0.986 6.730 1.00 0.00 C ATOM 1417 C LEU A 87 -7.507 2.139 6.819 1.00 0.00 C ATOM 1418 O LEU A 87 -8.005 2.462 7.880 1.00 0.00 O ATOM 1419 CB LEU A 87 -7.178 -0.337 7.091 1.00 0.00 C ATOM 1420 CG LEU A 87 -6.540 -1.470 6.286 1.00 0.00 C ATOM 1421 CD1 LEU A 87 -5.297 -1.978 7.018 1.00 0.00 C ATOM 1422 CD2 LEU A 87 -7.544 -2.616 6.134 1.00 0.00 C ATOM 0 H LEU A 87 -5.733 1.148 8.714 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.115 0.983 5.712 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.074 -0.531 8.158 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.246 -0.283 6.880 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.257 -1.100 5.300 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.842 -2.786 6.445 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -4.581 -1.163 7.128 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -5.581 -2.348 8.003 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.090 -3.424 5.560 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.827 -2.985 7.120 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.431 -2.256 5.614 1.00 0.00 H new ATOM 1434 N VAL A 88 -7.811 2.761 5.712 1.00 0.00 N ATOM 1435 CA VAL A 88 -8.784 3.889 5.733 1.00 0.00 C ATOM 1436 C VAL A 88 -10.200 3.368 5.473 1.00 0.00 C ATOM 1437 O VAL A 88 -11.171 3.912 5.958 1.00 0.00 O ATOM 1438 CB VAL A 88 -8.338 4.820 4.604 1.00 0.00 C ATOM 1439 CG1 VAL A 88 -6.821 5.005 4.661 1.00 0.00 C ATOM 1440 CG2 VAL A 88 -8.724 4.206 3.256 1.00 0.00 C ATOM 0 H VAL A 88 -7.427 2.536 4.794 1.00 0.00 H new ATOM 0 HA VAL A 88 -8.805 4.400 6.696 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.826 5.788 4.719 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -6.505 5.668 3.856 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.543 5.441 5.621 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.332 4.038 4.547 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -8.407 4.868 2.450 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.235 3.238 3.144 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.805 4.074 3.213 1.00 0.00 H new ATOM 1450 N SER A 89 -10.323 2.316 4.708 1.00 0.00 N ATOM 1451 CA SER A 89 -11.676 1.759 4.418 1.00 0.00 C ATOM 1452 C SER A 89 -11.550 0.345 3.847 1.00 0.00 C ATOM 1453 O SER A 89 -10.481 -0.088 3.466 1.00 0.00 O ATOM 1454 CB SER A 89 -12.277 2.704 3.379 1.00 0.00 C ATOM 1455 OG SER A 89 -12.969 3.754 4.043 1.00 0.00 O ATOM 0 H SER A 89 -9.546 1.819 4.272 1.00 0.00 H new ATOM 0 HA SER A 89 -12.296 1.688 5.312 1.00 0.00 H new ATOM 0 HB2 SER A 89 -11.490 3.115 2.746 1.00 0.00 H new ATOM 0 HB3 SER A 89 -12.959 2.159 2.726 1.00 0.00 H new ATOM 0 HG SER A 89 -12.517 3.960 4.888 1.00 0.00 H new ATOM 1461 N TYR A 90 -12.634 -0.380 3.782 1.00 0.00 N ATOM 1462 CA TYR A 90 -12.568 -1.764 3.232 1.00 0.00 C ATOM 1463 C TYR A 90 -13.872 -2.121 2.517 1.00 0.00 C ATOM 1464 O TYR A 90 -14.941 -2.065 3.092 1.00 0.00 O ATOM 1465 CB TYR A 90 -12.377 -2.675 4.443 1.00 0.00 C ATOM 1466 CG TYR A 90 -12.920 -4.046 4.116 1.00 0.00 C ATOM 1467 CD1 TYR A 90 -12.113 -4.974 3.446 1.00 0.00 C ATOM 1468 CD2 TYR A 90 -14.231 -4.388 4.471 1.00 0.00 C ATOM 1469 CE1 TYR A 90 -12.614 -6.242 3.133 1.00 0.00 C ATOM 1470 CE2 TYR A 90 -14.735 -5.658 4.159 1.00 0.00 C ATOM 1471 CZ TYR A 90 -13.925 -6.587 3.491 1.00 0.00 C ATOM 1472 OH TYR A 90 -14.419 -7.838 3.183 1.00 0.00 O ATOM 0 H TYR A 90 -13.559 -0.075 4.085 1.00 0.00 H new ATOM 0 HA TYR A 90 -11.761 -1.867 2.506 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -11.320 -2.740 4.702 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -12.893 -2.262 5.310 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -11.103 -4.710 3.171 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -14.854 -3.672 4.986 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -11.990 -6.956 2.615 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -15.746 -5.921 4.433 1.00 0.00 H new ATOM 0 HH TYR A 90 -15.342 -7.913 3.503 1.00 0.00 H new ATOM 1482 N SER A 91 -13.793 -2.507 1.275 1.00 0.00 N ATOM 1483 CA SER A 91 -15.029 -2.887 0.537 1.00 0.00 C ATOM 1484 C SER A 91 -15.545 -4.220 1.081 1.00 0.00 C ATOM 1485 O SER A 91 -14.779 -5.025 1.559 1.00 0.00 O ATOM 1486 CB SER A 91 -14.596 -3.028 -0.916 1.00 0.00 C ATOM 1487 OG SER A 91 -15.383 -2.166 -1.727 1.00 0.00 O ATOM 0 H SER A 91 -12.928 -2.576 0.739 1.00 0.00 H new ATOM 0 HA SER A 91 -15.830 -2.156 0.643 1.00 0.00 H new ATOM 0 HB2 SER A 91 -13.540 -2.778 -1.018 1.00 0.00 H new ATOM 0 HB3 SER A 91 -14.713 -4.061 -1.244 1.00 0.00 H new ATOM 0 HG SER A 91 -14.914 -1.992 -2.570 1.00 0.00 H new ATOM 1493 N PRO A 92 -16.833 -4.399 1.009 1.00 0.00 N ATOM 1494 CA PRO A 92 -17.463 -5.640 1.530 1.00 0.00 C ATOM 1495 C PRO A 92 -17.132 -6.874 0.675 1.00 0.00 C ATOM 1496 O PRO A 92 -16.650 -6.774 -0.435 1.00 0.00 O ATOM 1497 CB PRO A 92 -18.952 -5.326 1.496 1.00 0.00 C ATOM 1498 CG PRO A 92 -19.101 -4.270 0.449 1.00 0.00 C ATOM 1499 CD PRO A 92 -17.820 -3.476 0.441 1.00 0.00 C ATOM 0 HA PRO A 92 -17.100 -5.896 2.525 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -19.537 -6.212 1.249 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -19.303 -4.973 2.466 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -19.283 -4.718 -0.528 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -19.953 -3.626 0.669 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -17.546 -3.169 -0.568 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -17.908 -2.568 1.038 1.00 0.00 H new ATOM 1507 N VAL A 93 -17.392 -8.034 1.231 1.00 0.00 N ATOM 1508 CA VAL A 93 -17.122 -9.345 0.550 1.00 0.00 C ATOM 1509 C VAL A 93 -17.231 -9.284 -0.984 1.00 0.00 C ATOM 1510 O VAL A 93 -16.301 -9.661 -1.669 1.00 0.00 O ATOM 1511 CB VAL A 93 -18.186 -10.288 1.110 1.00 0.00 C ATOM 1512 CG1 VAL A 93 -18.431 -11.427 0.119 1.00 0.00 C ATOM 1513 CG2 VAL A 93 -17.703 -10.867 2.442 1.00 0.00 C ATOM 0 H VAL A 93 -17.795 -8.130 2.163 1.00 0.00 H new ATOM 0 HA VAL A 93 -16.098 -9.665 0.741 1.00 0.00 H new ATOM 0 HB VAL A 93 -19.113 -9.737 1.267 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -19.190 -12.100 0.518 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -18.774 -11.016 -0.830 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -17.504 -11.978 -0.038 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -18.461 -11.540 2.843 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -16.776 -11.418 2.284 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -17.528 -10.056 3.149 1.00 0.00 H new ATOM 1523 N PRO A 94 -18.358 -8.845 -1.490 1.00 0.00 N ATOM 1524 CA PRO A 94 -18.544 -8.789 -2.966 1.00 0.00 C ATOM 1525 C PRO A 94 -17.473 -7.919 -3.627 1.00 0.00 C ATOM 1526 O PRO A 94 -17.004 -8.222 -4.706 1.00 0.00 O ATOM 1527 CB PRO A 94 -19.954 -8.213 -3.125 1.00 0.00 C ATOM 1528 CG PRO A 94 -20.207 -7.499 -1.841 1.00 0.00 C ATOM 1529 CD PRO A 94 -19.545 -8.344 -0.785 1.00 0.00 C ATOM 0 HA PRO A 94 -18.442 -9.759 -3.453 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -20.013 -7.534 -3.976 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -20.689 -9.000 -3.294 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -19.788 -6.493 -1.860 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -21.275 -7.396 -1.651 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -19.279 -7.760 0.096 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -20.191 -9.155 -0.448 1.00 0.00 H new ATOM 1537 N GLU A 95 -17.061 -6.861 -2.993 1.00 0.00 N ATOM 1538 CA GLU A 95 -15.999 -6.010 -3.602 1.00 0.00 C ATOM 1539 C GLU A 95 -14.622 -6.550 -3.190 1.00 0.00 C ATOM 1540 O GLU A 95 -13.664 -6.475 -3.933 1.00 0.00 O ATOM 1541 CB GLU A 95 -16.229 -4.608 -3.042 1.00 0.00 C ATOM 1542 CG GLU A 95 -17.270 -3.879 -3.895 1.00 0.00 C ATOM 1543 CD GLU A 95 -18.517 -4.752 -4.044 1.00 0.00 C ATOM 1544 OE1 GLU A 95 -19.317 -4.771 -3.123 1.00 0.00 O ATOM 1545 OE2 GLU A 95 -18.650 -5.389 -5.077 1.00 0.00 O ATOM 0 H GLU A 95 -17.408 -6.548 -2.087 1.00 0.00 H new ATOM 0 HA GLU A 95 -16.034 -6.005 -4.691 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -16.570 -4.670 -2.008 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -15.293 -4.050 -3.036 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -17.533 -2.928 -3.431 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -16.855 -3.651 -4.877 1.00 0.00 H new ATOM 1552 N ASP A 96 -14.530 -7.107 -2.010 1.00 0.00 N ATOM 1553 CA ASP A 96 -13.232 -7.674 -1.530 1.00 0.00 C ATOM 1554 C ASP A 96 -12.074 -6.707 -1.796 1.00 0.00 C ATOM 1555 O ASP A 96 -10.935 -7.111 -1.920 1.00 0.00 O ATOM 1556 CB ASP A 96 -13.047 -8.965 -2.329 1.00 0.00 C ATOM 1557 CG ASP A 96 -11.962 -9.821 -1.673 1.00 0.00 C ATOM 1558 OD1 ASP A 96 -12.264 -10.473 -0.688 1.00 0.00 O ATOM 1559 OD2 ASP A 96 -10.847 -9.810 -2.167 1.00 0.00 O ATOM 0 H ASP A 96 -15.305 -7.194 -1.352 1.00 0.00 H new ATOM 0 HA ASP A 96 -13.241 -7.850 -0.454 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -13.986 -9.518 -2.370 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -12.769 -8.732 -3.357 1.00 0.00 H new ATOM 1564 N HIS A 97 -12.352 -5.437 -1.874 1.00 0.00 N ATOM 1565 CA HIS A 97 -11.262 -4.451 -2.115 1.00 0.00 C ATOM 1566 C HIS A 97 -10.805 -3.856 -0.782 1.00 0.00 C ATOM 1567 O HIS A 97 -11.608 -3.442 0.030 1.00 0.00 O ATOM 1568 CB HIS A 97 -11.889 -3.373 -3.003 1.00 0.00 C ATOM 1569 CG HIS A 97 -11.728 -3.756 -4.448 1.00 0.00 C ATOM 1570 ND1 HIS A 97 -10.532 -3.592 -5.129 1.00 0.00 N ATOM 1571 CD2 HIS A 97 -12.604 -4.297 -5.357 1.00 0.00 C ATOM 1572 CE1 HIS A 97 -10.719 -4.025 -6.389 1.00 0.00 C ATOM 1573 NE2 HIS A 97 -11.965 -4.466 -6.582 1.00 0.00 N ATOM 0 H HIS A 97 -13.286 -5.038 -1.781 1.00 0.00 H new ATOM 0 HA HIS A 97 -10.387 -4.899 -2.586 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -12.946 -3.258 -2.762 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -11.413 -2.411 -2.816 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -9.667 -3.212 -4.745 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -13.633 -4.553 -5.152 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -9.954 -4.017 -7.152 1.00 0.00 H new ATOM 1581 N ALA A 98 -9.523 -3.815 -0.544 1.00 0.00 N ATOM 1582 CA ALA A 98 -9.025 -3.251 0.743 1.00 0.00 C ATOM 1583 C ALA A 98 -8.290 -1.932 0.494 1.00 0.00 C ATOM 1584 O ALA A 98 -7.798 -1.680 -0.588 1.00 0.00 O ATOM 1585 CB ALA A 98 -8.061 -4.303 1.290 1.00 0.00 C ATOM 0 H ALA A 98 -8.800 -4.147 -1.183 1.00 0.00 H new ATOM 0 HA ALA A 98 -9.836 -3.037 1.440 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -7.650 -3.961 2.240 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -8.594 -5.241 1.442 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -7.250 -4.458 0.579 1.00 0.00 H new ATOM 1591 N TYR A 99 -8.214 -1.088 1.485 1.00 0.00 N ATOM 1592 CA TYR A 99 -7.512 0.214 1.302 1.00 0.00 C ATOM 1593 C TYR A 99 -6.553 0.469 2.468 1.00 0.00 C ATOM 1594 O TYR A 99 -6.928 0.388 3.622 1.00 0.00 O ATOM 1595 CB TYR A 99 -8.627 1.260 1.277 1.00 0.00 C ATOM 1596 CG TYR A 99 -9.600 0.926 0.173 1.00 0.00 C ATOM 1597 CD1 TYR A 99 -9.145 0.790 -1.144 1.00 0.00 C ATOM 1598 CD2 TYR A 99 -10.958 0.747 0.465 1.00 0.00 C ATOM 1599 CE1 TYR A 99 -10.047 0.477 -2.168 1.00 0.00 C ATOM 1600 CE2 TYR A 99 -11.860 0.434 -0.559 1.00 0.00 C ATOM 1601 CZ TYR A 99 -11.404 0.298 -1.876 1.00 0.00 C ATOM 1602 OH TYR A 99 -12.293 -0.011 -2.884 1.00 0.00 O ATOM 0 H TYR A 99 -8.607 -1.243 2.413 1.00 0.00 H new ATOM 0 HA TYR A 99 -6.911 0.238 0.393 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -9.142 1.282 2.237 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -8.206 2.253 1.118 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -8.098 0.927 -1.370 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -11.310 0.850 1.481 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -9.695 0.374 -3.184 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -12.907 0.297 -0.333 1.00 0.00 H new ATOM 0 HH TYR A 99 -13.194 -0.102 -2.509 1.00 0.00 H new ATOM 1612 N ILE A 100 -5.320 0.775 2.176 1.00 0.00 N ATOM 1613 CA ILE A 100 -4.335 1.034 3.268 1.00 0.00 C ATOM 1614 C ILE A 100 -3.635 2.378 3.046 1.00 0.00 C ATOM 1615 O ILE A 100 -3.767 2.994 2.007 1.00 0.00 O ATOM 1616 CB ILE A 100 -3.330 -0.117 3.187 1.00 0.00 C ATOM 1617 CG1 ILE A 100 -2.645 -0.107 1.818 1.00 0.00 C ATOM 1618 CG2 ILE A 100 -4.059 -1.448 3.377 1.00 0.00 C ATOM 1619 CD1 ILE A 100 -1.167 0.252 1.986 1.00 0.00 C ATOM 0 H ILE A 100 -4.950 0.857 1.229 1.00 0.00 H new ATOM 0 HA ILE A 100 -4.813 1.085 4.246 1.00 0.00 H new ATOM 0 HB ILE A 100 -2.581 0.005 3.970 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -2.741 -1.084 1.345 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -3.132 0.614 1.162 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.342 -2.267 3.319 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -4.546 -1.460 4.352 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.809 -1.567 2.595 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -0.681 0.259 1.010 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -1.082 1.239 2.441 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -0.684 -0.486 2.627 1.00 0.00 H new ATOM 1631 N ARG A 101 -2.892 2.841 4.019 1.00 0.00 N ATOM 1632 CA ARG A 101 -2.191 4.148 3.862 1.00 0.00 C ATOM 1633 C ARG A 101 -0.987 4.233 4.809 1.00 0.00 C ATOM 1634 O ARG A 101 -1.038 3.781 5.935 1.00 0.00 O ATOM 1635 CB ARG A 101 -3.235 5.199 4.239 1.00 0.00 C ATOM 1636 CG ARG A 101 -3.920 5.721 2.975 1.00 0.00 C ATOM 1637 CD ARG A 101 -3.759 7.241 2.899 1.00 0.00 C ATOM 1638 NE ARG A 101 -4.548 7.768 4.046 1.00 0.00 N ATOM 1639 CZ ARG A 101 -5.321 8.806 3.883 1.00 0.00 C ATOM 1640 NH1 ARG A 101 -6.561 8.644 3.510 1.00 0.00 N ATOM 1641 NH2 ARG A 101 -4.855 10.006 4.094 1.00 0.00 N ATOM 0 H ARG A 101 -2.742 2.371 4.912 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.807 4.287 2.851 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -3.974 4.766 4.913 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -2.760 6.022 4.773 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -3.483 5.254 2.092 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -4.977 5.457 2.986 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -2.711 7.531 2.974 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -4.131 7.631 1.951 1.00 0.00 H new ATOM 0 HE ARG A 101 -4.484 7.318 4.959 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -6.926 7.706 3.346 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -7.165 9.456 3.383 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -3.886 10.133 4.386 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -5.460 10.818 3.966 1.00 0.00 H new ATOM 1655 N PHE A 102 0.090 4.823 4.362 1.00 0.00 N ATOM 1656 CA PHE A 102 1.292 4.952 5.237 1.00 0.00 C ATOM 1657 C PHE A 102 1.977 6.299 4.983 1.00 0.00 C ATOM 1658 O PHE A 102 1.920 6.827 3.889 1.00 0.00 O ATOM 1659 CB PHE A 102 2.211 3.794 4.848 1.00 0.00 C ATOM 1660 CG PHE A 102 2.262 3.667 3.346 1.00 0.00 C ATOM 1661 CD1 PHE A 102 1.282 2.931 2.672 1.00 0.00 C ATOM 1662 CD2 PHE A 102 3.291 4.287 2.626 1.00 0.00 C ATOM 1663 CE1 PHE A 102 1.330 2.812 1.278 1.00 0.00 C ATOM 1664 CE2 PHE A 102 3.339 4.169 1.232 1.00 0.00 C ATOM 1665 CZ PHE A 102 2.359 3.431 0.557 1.00 0.00 C ATOM 0 H PHE A 102 0.189 5.221 3.428 1.00 0.00 H new ATOM 0 HA PHE A 102 1.037 4.915 6.296 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.213 3.964 5.242 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.848 2.865 5.289 1.00 0.00 H new ATOM 0 HD1 PHE A 102 0.488 2.454 3.227 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.047 4.856 3.146 1.00 0.00 H new ATOM 0 HE1 PHE A 102 0.573 2.243 0.758 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.132 4.647 0.677 1.00 0.00 H new ATOM 0 HZ PHE A 102 2.397 3.339 -0.518 1.00 0.00 H new ATOM 1675 N PRO A 103 2.593 6.815 6.010 1.00 0.00 N ATOM 1676 CA PRO A 103 3.289 8.124 5.908 1.00 0.00 C ATOM 1677 C PRO A 103 4.575 8.000 5.084 1.00 0.00 C ATOM 1678 O PRO A 103 5.255 6.994 5.121 1.00 0.00 O ATOM 1679 CB PRO A 103 3.609 8.470 7.359 1.00 0.00 C ATOM 1680 CG PRO A 103 3.654 7.154 8.070 1.00 0.00 C ATOM 1681 CD PRO A 103 2.701 6.235 7.352 1.00 0.00 C ATOM 0 HA PRO A 103 2.688 8.885 5.409 1.00 0.00 H new ATOM 0 HB2 PRO A 103 4.561 8.995 7.439 1.00 0.00 H new ATOM 0 HB3 PRO A 103 2.848 9.123 7.786 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.664 6.745 8.062 1.00 0.00 H new ATOM 0 HG3 PRO A 103 3.365 7.270 9.115 1.00 0.00 H new ATOM 0 HD2 PRO A 103 3.081 5.214 7.316 1.00 0.00 H new ATOM 0 HD3 PRO A 103 1.732 6.197 7.850 1.00 0.00 H new ATOM 1689 N VAL A 104 4.912 9.022 4.345 1.00 0.00 N ATOM 1690 CA VAL A 104 6.156 8.976 3.521 1.00 0.00 C ATOM 1691 C VAL A 104 6.849 10.339 3.544 1.00 0.00 C ATOM 1692 O VAL A 104 6.571 11.203 2.737 1.00 0.00 O ATOM 1693 CB VAL A 104 5.691 8.648 2.107 1.00 0.00 C ATOM 1694 CG1 VAL A 104 5.382 7.154 2.002 1.00 0.00 C ATOM 1695 CG2 VAL A 104 4.432 9.455 1.786 1.00 0.00 C ATOM 0 H VAL A 104 4.379 9.889 4.276 1.00 0.00 H new ATOM 0 HA VAL A 104 6.868 8.241 3.896 1.00 0.00 H new ATOM 0 HB VAL A 104 6.478 8.904 1.398 1.00 0.00 H new ATOM 0 HG11 VAL A 104 5.050 6.921 0.990 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.280 6.580 2.230 1.00 0.00 H new ATOM 0 HG13 VAL A 104 4.596 6.894 2.711 1.00 0.00 H new ATOM 0 HG21 VAL A 104 4.098 9.222 0.775 1.00 0.00 H new ATOM 0 HG22 VAL A 104 3.645 9.200 2.496 1.00 0.00 H new ATOM 0 HG23 VAL A 104 4.654 10.520 1.858 1.00 0.00 H new ATOM 1705 N SER A 105 7.747 10.536 4.464 1.00 0.00 N ATOM 1706 CA SER A 105 8.460 11.843 4.545 1.00 0.00 C ATOM 1707 C SER A 105 9.778 11.787 3.768 1.00 0.00 C ATOM 1708 O SER A 105 10.104 10.794 3.149 1.00 0.00 O ATOM 1709 CB SER A 105 8.726 12.056 6.034 1.00 0.00 C ATOM 1710 OG SER A 105 9.641 11.070 6.492 1.00 0.00 O ATOM 0 H SER A 105 8.021 9.849 5.166 1.00 0.00 H new ATOM 0 HA SER A 105 7.876 12.655 4.112 1.00 0.00 H new ATOM 0 HB2 SER A 105 9.132 13.053 6.204 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.794 11.992 6.595 1.00 0.00 H new ATOM 0 HG SER A 105 9.816 11.204 7.447 1.00 0.00 H new ATOM 1716 N ASP A 106 10.539 12.844 3.806 1.00 0.00 N ATOM 1717 CA ASP A 106 11.842 12.857 3.082 1.00 0.00 C ATOM 1718 C ASP A 106 11.648 12.510 1.604 1.00 0.00 C ATOM 1719 O ASP A 106 12.567 12.083 0.935 1.00 0.00 O ATOM 1720 CB ASP A 106 12.690 11.791 3.776 1.00 0.00 C ATOM 1721 CG ASP A 106 14.170 12.165 3.668 1.00 0.00 C ATOM 1722 OD1 ASP A 106 14.751 11.909 2.627 1.00 0.00 O ATOM 1723 OD2 ASP A 106 14.698 12.700 4.630 1.00 0.00 O ATOM 0 H ASP A 106 10.315 13.703 4.309 1.00 0.00 H new ATOM 0 HA ASP A 106 12.312 13.840 3.109 1.00 0.00 H new ATOM 0 HB2 ASP A 106 12.401 11.707 4.824 1.00 0.00 H new ATOM 0 HB3 ASP A 106 12.516 10.817 3.318 1.00 0.00 H new ATOM 1728 N GLY A 107 10.465 12.694 1.083 1.00 0.00 N ATOM 1729 CA GLY A 107 10.237 12.376 -0.355 1.00 0.00 C ATOM 1730 C GLY A 107 10.403 10.874 -0.586 1.00 0.00 C ATOM 1731 O GLY A 107 10.790 10.449 -1.657 1.00 0.00 O ATOM 0 H GLY A 107 9.652 13.048 1.587 1.00 0.00 H new ATOM 0 HA2 GLY A 107 9.237 12.691 -0.652 1.00 0.00 H new ATOM 0 HA3 GLY A 107 10.942 12.929 -0.975 1.00 0.00 H new ATOM 1735 N THR A 108 10.128 10.075 0.417 1.00 0.00 N ATOM 1736 CA THR A 108 10.272 8.588 0.282 1.00 0.00 C ATOM 1737 C THR A 108 9.813 8.112 -1.098 1.00 0.00 C ATOM 1738 O THR A 108 8.633 8.033 -1.379 1.00 0.00 O ATOM 1739 CB THR A 108 9.362 8.006 1.360 1.00 0.00 C ATOM 1740 OG1 THR A 108 9.794 8.449 2.638 1.00 0.00 O ATOM 1741 CG2 THR A 108 9.416 6.478 1.303 1.00 0.00 C ATOM 0 H THR A 108 9.807 10.391 1.332 1.00 0.00 H new ATOM 0 HA THR A 108 11.310 8.275 0.392 1.00 0.00 H new ATOM 0 HB THR A 108 8.339 8.340 1.189 1.00 0.00 H new ATOM 0 HG1 THR A 108 9.450 9.351 2.805 1.00 0.00 H new ATOM 0 HG21 THR A 108 8.766 6.062 2.073 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.081 6.138 0.323 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.439 6.144 1.473 1.00 0.00 H new ATOM 1749 N GLN A 109 10.737 7.795 -1.960 1.00 0.00 N ATOM 1750 CA GLN A 109 10.357 7.325 -3.320 1.00 0.00 C ATOM 1751 C GLN A 109 10.649 5.828 -3.475 1.00 0.00 C ATOM 1752 O GLN A 109 10.255 5.209 -4.443 1.00 0.00 O ATOM 1753 CB GLN A 109 11.227 8.144 -4.275 1.00 0.00 C ATOM 1754 CG GLN A 109 10.772 7.909 -5.716 1.00 0.00 C ATOM 1755 CD GLN A 109 11.722 8.630 -6.674 1.00 0.00 C ATOM 1756 OE1 GLN A 109 11.341 9.585 -7.321 1.00 0.00 O ATOM 1757 NE2 GLN A 109 12.952 8.210 -6.793 1.00 0.00 N ATOM 0 H GLN A 109 11.740 7.841 -1.781 1.00 0.00 H new ATOM 0 HA GLN A 109 9.293 7.456 -3.518 1.00 0.00 H new ATOM 0 HB2 GLN A 109 11.156 9.204 -4.029 1.00 0.00 H new ATOM 0 HB3 GLN A 109 12.273 7.860 -4.163 1.00 0.00 H new ATOM 0 HG2 GLN A 109 10.759 6.841 -5.935 1.00 0.00 H new ATOM 0 HG3 GLN A 109 9.754 8.275 -5.852 1.00 0.00 H new ATOM 0 HE21 GLN A 109 13.272 7.408 -6.250 1.00 0.00 H new ATOM 0 HE22 GLN A 109 13.593 8.684 -7.429 1.00 0.00 H new ATOM 1766 N GLU A 110 11.337 5.237 -2.533 1.00 0.00 N ATOM 1767 CA GLU A 110 11.648 3.783 -2.637 1.00 0.00 C ATOM 1768 C GLU A 110 11.480 3.111 -1.273 1.00 0.00 C ATOM 1769 O GLU A 110 12.069 3.523 -0.293 1.00 0.00 O ATOM 1770 CB GLU A 110 13.107 3.719 -3.090 1.00 0.00 C ATOM 1771 CG GLU A 110 13.521 5.070 -3.679 1.00 0.00 C ATOM 1772 CD GLU A 110 14.931 4.960 -4.263 1.00 0.00 C ATOM 1773 OE1 GLU A 110 15.216 3.950 -4.885 1.00 0.00 O ATOM 1774 OE2 GLU A 110 15.701 5.888 -4.079 1.00 0.00 O ATOM 0 H GLU A 110 11.696 5.699 -1.698 1.00 0.00 H new ATOM 0 HA GLU A 110 10.985 3.267 -3.331 1.00 0.00 H new ATOM 0 HB2 GLU A 110 13.750 3.466 -2.247 1.00 0.00 H new ATOM 0 HB3 GLU A 110 13.233 2.932 -3.834 1.00 0.00 H new ATOM 0 HG2 GLU A 110 12.817 5.372 -4.454 1.00 0.00 H new ATOM 0 HG3 GLU A 110 13.494 5.839 -2.907 1.00 0.00 H new ATOM 1781 N LEU A 111 10.681 2.081 -1.197 1.00 0.00 N ATOM 1782 CA LEU A 111 10.483 1.392 0.110 1.00 0.00 C ATOM 1783 C LEU A 111 10.404 -0.123 -0.092 1.00 0.00 C ATOM 1784 O LEU A 111 10.117 -0.602 -1.171 1.00 0.00 O ATOM 1785 CB LEU A 111 9.159 1.922 0.673 1.00 0.00 C ATOM 1786 CG LEU A 111 8.293 2.495 -0.449 1.00 0.00 C ATOM 1787 CD1 LEU A 111 6.825 2.463 -0.022 1.00 0.00 C ATOM 1788 CD2 LEU A 111 8.712 3.941 -0.718 1.00 0.00 C ATOM 0 H LEU A 111 10.159 1.688 -1.980 1.00 0.00 H new ATOM 0 HA LEU A 111 11.313 1.585 0.790 1.00 0.00 H new ATOM 0 HB2 LEU A 111 8.624 1.118 1.179 1.00 0.00 H new ATOM 0 HB3 LEU A 111 9.356 2.693 1.418 1.00 0.00 H new ATOM 0 HG LEU A 111 8.422 1.901 -1.354 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.205 2.871 -0.820 1.00 0.00 H new ATOM 0 HD12 LEU A 111 6.527 1.434 0.179 1.00 0.00 H new ATOM 0 HD13 LEU A 111 6.695 3.061 0.880 1.00 0.00 H new ATOM 0 HD21 LEU A 111 8.098 4.355 -1.518 1.00 0.00 H new ATOM 0 HD22 LEU A 111 8.577 4.533 0.187 1.00 0.00 H new ATOM 0 HD23 LEU A 111 9.760 3.967 -1.016 1.00 0.00 H new ATOM 1800 N LYS A 112 10.651 -0.880 0.941 1.00 0.00 N ATOM 1801 CA LYS A 112 10.587 -2.364 0.814 1.00 0.00 C ATOM 1802 C LYS A 112 9.265 -2.882 1.383 1.00 0.00 C ATOM 1803 O LYS A 112 8.811 -2.442 2.419 1.00 0.00 O ATOM 1804 CB LYS A 112 11.765 -2.881 1.637 1.00 0.00 C ATOM 1805 CG LYS A 112 12.882 -3.343 0.701 1.00 0.00 C ATOM 1806 CD LYS A 112 13.844 -2.182 0.442 1.00 0.00 C ATOM 1807 CE LYS A 112 13.672 -1.687 -0.997 1.00 0.00 C ATOM 1808 NZ LYS A 112 15.000 -1.127 -1.374 1.00 0.00 N ATOM 0 H LYS A 112 10.895 -0.535 1.869 1.00 0.00 H new ATOM 0 HA LYS A 112 10.639 -2.695 -0.223 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.132 -2.096 2.298 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.444 -3.707 2.271 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.419 -4.182 1.144 1.00 0.00 H new ATOM 0 HG3 LYS A 112 12.460 -3.696 -0.240 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.648 -1.370 1.143 1.00 0.00 H new ATOM 0 HD3 LYS A 112 14.872 -2.504 0.607 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.384 -2.501 -1.662 1.00 0.00 H new ATOM 0 HE3 LYS A 112 12.891 -0.929 -1.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.961 -0.767 -2.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 15.245 -0.350 -0.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 15.722 -1.872 -1.309 1.00 0.00 H new ATOM 1822 N ILE A 113 8.640 -3.812 0.713 1.00 0.00 N ATOM 1823 CA ILE A 113 7.345 -4.351 1.220 1.00 0.00 C ATOM 1824 C ILE A 113 7.551 -5.739 1.837 1.00 0.00 C ATOM 1825 O ILE A 113 8.425 -6.483 1.436 1.00 0.00 O ATOM 1826 CB ILE A 113 6.444 -4.439 -0.011 1.00 0.00 C ATOM 1827 CG1 ILE A 113 5.593 -3.172 -0.111 1.00 0.00 C ATOM 1828 CG2 ILE A 113 5.527 -5.659 0.112 1.00 0.00 C ATOM 1829 CD1 ILE A 113 5.645 -2.632 -1.541 1.00 0.00 C ATOM 0 H ILE A 113 8.969 -4.221 -0.161 1.00 0.00 H new ATOM 0 HA ILE A 113 6.913 -3.721 1.998 1.00 0.00 H new ATOM 0 HB ILE A 113 7.060 -4.536 -0.905 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.562 -3.391 0.169 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.960 -2.419 0.587 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.885 -5.721 -0.766 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.132 -6.563 0.184 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.911 -5.562 1.006 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.038 -1.729 -1.611 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.676 -2.397 -1.804 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.257 -3.384 -2.228 1.00 0.00 H new ATOM 1841 N VAL A 114 6.752 -6.090 2.807 1.00 0.00 N ATOM 1842 CA VAL A 114 6.899 -7.429 3.448 1.00 0.00 C ATOM 1843 C VAL A 114 5.524 -8.066 3.655 1.00 0.00 C ATOM 1844 O VAL A 114 4.715 -7.578 4.415 1.00 0.00 O ATOM 1845 CB VAL A 114 7.563 -7.153 4.796 1.00 0.00 C ATOM 1846 CG1 VAL A 114 8.294 -8.409 5.272 1.00 0.00 C ATOM 1847 CG2 VAL A 114 8.563 -6.005 4.644 1.00 0.00 C ATOM 0 H VAL A 114 6.004 -5.508 3.184 1.00 0.00 H new ATOM 0 HA VAL A 114 7.484 -8.117 2.837 1.00 0.00 H new ATOM 0 HB VAL A 114 6.803 -6.878 5.527 1.00 0.00 H new ATOM 0 HG11 VAL A 114 8.768 -8.212 6.234 1.00 0.00 H new ATOM 0 HG12 VAL A 114 7.581 -9.226 5.379 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.055 -8.685 4.543 1.00 0.00 H new ATOM 0 HG21 VAL A 114 9.038 -5.807 5.605 1.00 0.00 H new ATOM 0 HG22 VAL A 114 9.324 -6.279 3.913 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.041 -5.110 4.306 1.00 0.00 H new ATOM 1857 N SER A 115 5.252 -9.154 2.989 1.00 0.00 N ATOM 1858 CA SER A 115 3.926 -9.814 3.157 1.00 0.00 C ATOM 1859 C SER A 115 3.902 -11.156 2.421 1.00 0.00 C ATOM 1860 O SER A 115 4.855 -11.536 1.769 1.00 0.00 O ATOM 1861 CB SER A 115 2.923 -8.844 2.534 1.00 0.00 C ATOM 1862 OG SER A 115 3.503 -8.245 1.383 1.00 0.00 O ATOM 0 H SER A 115 5.888 -9.614 2.338 1.00 0.00 H new ATOM 0 HA SER A 115 3.699 -10.024 4.202 1.00 0.00 H new ATOM 0 HB2 SER A 115 2.009 -9.372 2.262 1.00 0.00 H new ATOM 0 HB3 SER A 115 2.645 -8.077 3.256 1.00 0.00 H new ATOM 0 HG SER A 115 3.258 -7.297 1.349 1.00 0.00 H new ATOM 1868 N SER A 116 2.817 -11.875 2.518 1.00 0.00 N ATOM 1869 CA SER A 116 2.726 -13.191 1.822 1.00 0.00 C ATOM 1870 C SER A 116 1.259 -13.549 1.572 1.00 0.00 C ATOM 1871 O SER A 116 0.545 -13.945 2.472 1.00 0.00 O ATOM 1872 CB SER A 116 3.368 -14.193 2.781 1.00 0.00 C ATOM 1873 OG SER A 116 2.960 -15.508 2.427 1.00 0.00 O ATOM 0 H SER A 116 1.989 -11.608 3.050 1.00 0.00 H new ATOM 0 HA SER A 116 3.223 -13.184 0.852 1.00 0.00 H new ATOM 0 HB2 SER A 116 4.454 -14.112 2.736 1.00 0.00 H new ATOM 0 HB3 SER A 116 3.074 -13.972 3.807 1.00 0.00 H new ATOM 0 HG SER A 116 3.371 -16.154 3.039 1.00 0.00 H new ATOM 1879 N THR A 117 0.803 -13.407 0.358 1.00 0.00 N ATOM 1880 CA THR A 117 -0.620 -13.734 0.054 1.00 0.00 C ATOM 1881 C THR A 117 -0.716 -15.091 -0.648 1.00 0.00 C ATOM 1882 O THR A 117 0.159 -15.476 -1.398 1.00 0.00 O ATOM 1883 CB THR A 117 -1.091 -12.612 -0.873 1.00 0.00 C ATOM 1884 OG1 THR A 117 -0.688 -12.901 -2.204 1.00 0.00 O ATOM 1885 CG2 THR A 117 -0.474 -11.287 -0.426 1.00 0.00 C ATOM 0 H THR A 117 1.353 -13.079 -0.436 1.00 0.00 H new ATOM 0 HA THR A 117 -1.230 -13.803 0.954 1.00 0.00 H new ATOM 0 HB THR A 117 -2.177 -12.536 -0.831 1.00 0.00 H new ATOM 0 HG1 THR A 117 -0.990 -12.184 -2.800 1.00 0.00 H new ATOM 0 HG21 THR A 117 -0.810 -10.488 -1.087 1.00 0.00 H new ATOM 0 HG22 THR A 117 -0.784 -11.067 0.596 1.00 0.00 H new ATOM 0 HG23 THR A 117 0.613 -11.359 -0.468 1.00 0.00 H new ATOM 1893 N GLN A 118 -1.774 -15.819 -0.411 1.00 0.00 N ATOM 1894 CA GLN A 118 -1.927 -17.150 -1.065 1.00 0.00 C ATOM 1895 C GLN A 118 -3.366 -17.329 -1.559 1.00 0.00 C ATOM 1896 O GLN A 118 -4.307 -17.268 -0.793 1.00 0.00 O ATOM 1897 CB GLN A 118 -1.604 -18.169 0.028 1.00 0.00 C ATOM 1898 CG GLN A 118 -1.987 -19.571 -0.451 1.00 0.00 C ATOM 1899 CD GLN A 118 -1.703 -20.585 0.657 1.00 0.00 C ATOM 1900 OE1 GLN A 118 -2.001 -20.342 1.810 1.00 0.00 O ATOM 1901 NE2 GLN A 118 -1.137 -21.722 0.356 1.00 0.00 N ATOM 0 H GLN A 118 -2.539 -15.549 0.207 1.00 0.00 H new ATOM 0 HA GLN A 118 -1.275 -17.264 -1.931 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -0.542 -18.134 0.270 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -2.148 -17.924 0.940 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -3.043 -19.598 -0.722 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -1.422 -19.828 -1.347 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -0.887 -21.927 -0.611 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -0.945 -22.406 1.088 1.00 0.00 H new ATOM 1910 N ILE A 119 -3.543 -17.547 -2.833 1.00 0.00 N ATOM 1911 CA ILE A 119 -4.922 -17.726 -3.374 1.00 0.00 C ATOM 1912 C ILE A 119 -5.178 -19.198 -3.708 1.00 0.00 C ATOM 1913 O ILE A 119 -6.061 -19.525 -4.477 1.00 0.00 O ATOM 1914 CB ILE A 119 -4.961 -16.873 -4.641 1.00 0.00 C ATOM 1915 CG1 ILE A 119 -4.671 -15.414 -4.282 1.00 0.00 C ATOM 1916 CG2 ILE A 119 -6.347 -16.973 -5.282 1.00 0.00 C ATOM 1917 CD1 ILE A 119 -3.210 -15.090 -4.599 1.00 0.00 C ATOM 0 H ILE A 119 -2.794 -17.609 -3.523 1.00 0.00 H new ATOM 0 HA ILE A 119 -5.688 -17.430 -2.657 1.00 0.00 H new ATOM 0 HB ILE A 119 -4.209 -17.232 -5.343 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -5.331 -14.752 -4.843 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -4.871 -15.242 -3.224 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -6.375 -16.364 -6.186 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.556 -18.012 -5.538 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -7.099 -16.614 -4.580 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -3.004 -14.051 -4.343 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -2.558 -15.743 -4.018 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.025 -15.245 -5.662 1.00 0.00 H new ATOM 1929 N ASP A 120 -4.415 -20.089 -3.136 1.00 0.00 N ATOM 1930 CA ASP A 120 -4.620 -21.538 -3.421 1.00 0.00 C ATOM 1931 C ASP A 120 -4.681 -21.778 -4.933 1.00 0.00 C ATOM 1932 O ASP A 120 -5.619 -22.359 -5.442 1.00 0.00 O ATOM 1933 CB ASP A 120 -5.958 -21.885 -2.768 1.00 0.00 C ATOM 1934 CG ASP A 120 -5.716 -22.790 -1.558 1.00 0.00 C ATOM 1935 OD1 ASP A 120 -4.722 -22.586 -0.879 1.00 0.00 O ATOM 1936 OD2 ASP A 120 -6.529 -23.671 -1.331 1.00 0.00 O ATOM 0 H ASP A 120 -3.659 -19.877 -2.484 1.00 0.00 H new ATOM 0 HA ASP A 120 -3.807 -22.153 -3.036 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -6.470 -20.974 -2.458 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -6.606 -22.386 -3.487 1.00 0.00 H new ATOM 1941 N ASP A 121 -3.689 -21.334 -5.656 1.00 0.00 N ATOM 1942 CA ASP A 121 -3.689 -21.539 -7.133 1.00 0.00 C ATOM 1943 C ASP A 121 -2.516 -22.436 -7.540 1.00 0.00 C ATOM 1944 O ASP A 121 -2.583 -23.160 -8.513 1.00 0.00 O ATOM 1945 CB ASP A 121 -3.524 -20.140 -7.728 1.00 0.00 C ATOM 1946 CG ASP A 121 -4.894 -19.585 -8.120 1.00 0.00 C ATOM 1947 OD1 ASP A 121 -5.857 -19.906 -7.443 1.00 0.00 O ATOM 1948 OD2 ASP A 121 -4.958 -18.849 -9.091 1.00 0.00 O ATOM 0 H ASP A 121 -2.878 -20.838 -5.287 1.00 0.00 H new ATOM 0 HA ASP A 121 -4.600 -22.025 -7.483 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -3.046 -19.480 -7.004 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -2.873 -20.180 -8.601 1.00 0.00 H new ATOM 1953 N GLY A 122 -1.443 -22.390 -6.799 1.00 0.00 N ATOM 1954 CA GLY A 122 -0.264 -23.238 -7.137 1.00 0.00 C ATOM 1955 C GLY A 122 0.745 -23.182 -5.989 1.00 0.00 C ATOM 1956 O GLY A 122 1.069 -24.186 -5.385 1.00 0.00 O ATOM 0 H GLY A 122 -1.331 -21.802 -5.973 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -0.579 -24.267 -7.309 1.00 0.00 H new ATOM 0 HA3 GLY A 122 0.198 -22.887 -8.060 1.00 0.00 H new ATOM 1960 N GLU A 123 1.241 -22.015 -5.681 1.00 0.00 N ATOM 1961 CA GLU A 123 2.226 -21.893 -4.569 1.00 0.00 C ATOM 1962 C GLU A 123 1.947 -20.625 -3.757 1.00 0.00 C ATOM 1963 O GLU A 123 1.312 -19.703 -4.227 1.00 0.00 O ATOM 1964 CB GLU A 123 3.590 -21.805 -5.254 1.00 0.00 C ATOM 1965 CG GLU A 123 4.369 -23.097 -5.002 1.00 0.00 C ATOM 1966 CD GLU A 123 5.868 -22.827 -5.151 1.00 0.00 C ATOM 1967 OE1 GLU A 123 6.213 -21.757 -5.625 1.00 0.00 O ATOM 1968 OE2 GLU A 123 6.645 -23.696 -4.790 1.00 0.00 O ATOM 0 H GLU A 123 1.007 -21.141 -6.151 1.00 0.00 H new ATOM 0 HA GLU A 123 2.175 -22.732 -3.876 1.00 0.00 H new ATOM 0 HB2 GLU A 123 3.462 -21.647 -6.325 1.00 0.00 H new ATOM 0 HB3 GLU A 123 4.147 -20.950 -4.870 1.00 0.00 H new ATOM 0 HG2 GLU A 123 4.154 -23.474 -4.002 1.00 0.00 H new ATOM 0 HG3 GLU A 123 4.055 -23.867 -5.707 1.00 0.00 H new ATOM 1975 N GLU A 124 2.417 -20.570 -2.541 1.00 0.00 N ATOM 1976 CA GLU A 124 2.174 -19.360 -1.704 1.00 0.00 C ATOM 1977 C GLU A 124 3.167 -18.254 -2.073 1.00 0.00 C ATOM 1978 O GLU A 124 4.364 -18.462 -2.096 1.00 0.00 O ATOM 1979 CB GLU A 124 2.397 -19.821 -0.263 1.00 0.00 C ATOM 1980 CG GLU A 124 2.607 -18.600 0.635 1.00 0.00 C ATOM 1981 CD GLU A 124 2.367 -18.990 2.095 1.00 0.00 C ATOM 1982 OE1 GLU A 124 1.215 -19.149 2.463 1.00 0.00 O ATOM 1983 OE2 GLU A 124 3.340 -19.122 2.819 1.00 0.00 O ATOM 0 H GLU A 124 2.958 -21.309 -2.091 1.00 0.00 H new ATOM 0 HA GLU A 124 1.174 -18.952 -1.850 1.00 0.00 H new ATOM 0 HB2 GLU A 124 1.539 -20.397 0.083 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.265 -20.479 -0.210 1.00 0.00 H new ATOM 0 HG2 GLU A 124 3.620 -18.216 0.512 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.925 -17.801 0.345 1.00 0.00 H new ATOM 1990 N THR A 125 2.679 -17.079 -2.361 1.00 0.00 N ATOM 1991 CA THR A 125 3.594 -15.961 -2.729 1.00 0.00 C ATOM 1992 C THR A 125 4.104 -15.257 -1.469 1.00 0.00 C ATOM 1993 O THR A 125 3.374 -14.552 -0.801 1.00 0.00 O ATOM 1994 CB THR A 125 2.740 -15.009 -3.567 1.00 0.00 C ATOM 1995 OG1 THR A 125 2.020 -15.753 -4.539 1.00 0.00 O ATOM 1996 CG2 THR A 125 3.645 -13.993 -4.267 1.00 0.00 C ATOM 0 H THR A 125 1.686 -16.844 -2.358 1.00 0.00 H new ATOM 0 HA THR A 125 4.471 -16.309 -3.275 1.00 0.00 H new ATOM 0 HB THR A 125 2.039 -14.483 -2.919 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.471 -15.144 -5.076 1.00 0.00 H new ATOM 0 HG21 THR A 125 3.036 -13.314 -4.864 1.00 0.00 H new ATOM 0 HG22 THR A 125 4.198 -13.423 -3.520 1.00 0.00 H new ATOM 0 HG23 THR A 125 4.347 -14.517 -4.916 1.00 0.00 H new ATOM 2004 N ASN A 126 5.353 -15.443 -1.139 1.00 0.00 N ATOM 2005 CA ASN A 126 5.911 -14.784 0.075 1.00 0.00 C ATOM 2006 C ASN A 126 6.768 -13.581 -0.326 1.00 0.00 C ATOM 2007 O ASN A 126 7.887 -13.726 -0.776 1.00 0.00 O ATOM 2008 CB ASN A 126 6.771 -15.854 0.748 1.00 0.00 C ATOM 2009 CG ASN A 126 7.339 -15.304 2.058 1.00 0.00 C ATOM 2010 OD1 ASN A 126 8.378 -14.675 2.066 1.00 0.00 O ATOM 2011 ND2 ASN A 126 6.698 -15.519 3.175 1.00 0.00 N ATOM 0 H ASN A 126 6.011 -16.024 -1.659 1.00 0.00 H new ATOM 0 HA ASN A 126 5.131 -14.412 0.739 1.00 0.00 H new ATOM 0 HB2 ASN A 126 6.174 -16.745 0.944 1.00 0.00 H new ATOM 0 HB3 ASN A 126 7.583 -16.153 0.085 1.00 0.00 H new ATOM 0 HD21 ASN A 126 7.070 -15.159 4.054 1.00 0.00 H new ATOM 0 HD22 ASN A 126 5.825 -16.047 3.169 1.00 0.00 H new ATOM 2018 N TYR A 127 6.252 -12.393 -0.171 1.00 0.00 N ATOM 2019 CA TYR A 127 7.038 -11.184 -0.548 1.00 0.00 C ATOM 2020 C TYR A 127 8.140 -10.925 0.483 1.00 0.00 C ATOM 2021 O TYR A 127 8.153 -9.909 1.149 1.00 0.00 O ATOM 2022 CB TYR A 127 6.026 -10.037 -0.551 1.00 0.00 C ATOM 2023 CG TYR A 127 4.945 -10.320 -1.565 1.00 0.00 C ATOM 2024 CD1 TYR A 127 5.285 -10.781 -2.842 1.00 0.00 C ATOM 2025 CD2 TYR A 127 3.600 -10.121 -1.228 1.00 0.00 C ATOM 2026 CE1 TYR A 127 4.281 -11.043 -3.782 1.00 0.00 C ATOM 2027 CE2 TYR A 127 2.597 -10.383 -2.168 1.00 0.00 C ATOM 2028 CZ TYR A 127 2.937 -10.844 -3.445 1.00 0.00 C ATOM 2029 OH TYR A 127 1.947 -11.104 -4.371 1.00 0.00 O ATOM 0 H TYR A 127 5.320 -12.207 0.200 1.00 0.00 H new ATOM 0 HA TYR A 127 7.529 -11.297 -1.515 1.00 0.00 H new ATOM 0 HB2 TYR A 127 5.588 -9.922 0.440 1.00 0.00 H new ATOM 0 HB3 TYR A 127 6.526 -9.098 -0.789 1.00 0.00 H new ATOM 0 HD1 TYR A 127 6.322 -10.935 -3.102 1.00 0.00 H new ATOM 0 HD2 TYR A 127 3.337 -9.765 -0.243 1.00 0.00 H new ATOM 0 HE1 TYR A 127 4.544 -11.399 -4.767 1.00 0.00 H new ATOM 0 HE2 TYR A 127 1.560 -10.229 -1.908 1.00 0.00 H new ATOM 0 HH TYR A 127 1.071 -10.915 -3.975 1.00 0.00 H new ATOM 2039 N ASP A 128 9.064 -11.835 0.620 1.00 0.00 N ATOM 2040 CA ASP A 128 10.165 -11.637 1.606 1.00 0.00 C ATOM 2041 C ASP A 128 10.796 -10.257 1.419 1.00 0.00 C ATOM 2042 O ASP A 128 11.103 -9.569 2.372 1.00 0.00 O ATOM 2043 CB ASP A 128 11.180 -12.738 1.296 1.00 0.00 C ATOM 2044 CG ASP A 128 12.167 -12.867 2.458 1.00 0.00 C ATOM 2045 OD1 ASP A 128 11.801 -12.501 3.563 1.00 0.00 O ATOM 2046 OD2 ASP A 128 13.271 -13.328 2.223 1.00 0.00 O ATOM 0 H ASP A 128 9.105 -12.707 0.092 1.00 0.00 H new ATOM 0 HA ASP A 128 9.812 -11.689 2.636 1.00 0.00 H new ATOM 0 HB2 ASP A 128 10.666 -13.686 1.135 1.00 0.00 H new ATOM 0 HB3 ASP A 128 11.715 -12.505 0.375 1.00 0.00 H new ATOM 2051 N TYR A 129 10.990 -9.846 0.196 1.00 0.00 N ATOM 2052 CA TYR A 129 11.598 -8.508 -0.055 1.00 0.00 C ATOM 2053 C TYR A 129 11.108 -7.948 -1.392 1.00 0.00 C ATOM 2054 O TYR A 129 11.561 -8.347 -2.446 1.00 0.00 O ATOM 2055 CB TYR A 129 13.105 -8.757 -0.101 1.00 0.00 C ATOM 2056 CG TYR A 129 13.783 -7.582 -0.763 1.00 0.00 C ATOM 2057 CD1 TYR A 129 14.075 -6.433 -0.019 1.00 0.00 C ATOM 2058 CD2 TYR A 129 14.116 -7.640 -2.122 1.00 0.00 C ATOM 2059 CE1 TYR A 129 14.699 -5.341 -0.633 1.00 0.00 C ATOM 2060 CE2 TYR A 129 14.742 -6.548 -2.736 1.00 0.00 C ATOM 2061 CZ TYR A 129 15.033 -5.399 -1.992 1.00 0.00 C ATOM 2062 OH TYR A 129 15.648 -4.323 -2.598 1.00 0.00 O ATOM 0 H TYR A 129 10.754 -10.379 -0.641 1.00 0.00 H new ATOM 0 HA TYR A 129 11.328 -7.783 0.713 1.00 0.00 H new ATOM 0 HB2 TYR A 129 13.494 -8.895 0.908 1.00 0.00 H new ATOM 0 HB3 TYR A 129 13.318 -9.673 -0.653 1.00 0.00 H new ATOM 0 HD1 TYR A 129 13.819 -6.389 1.029 1.00 0.00 H new ATOM 0 HD2 TYR A 129 13.890 -8.526 -2.696 1.00 0.00 H new ATOM 0 HE1 TYR A 129 14.923 -4.454 -0.059 1.00 0.00 H new ATOM 0 HE2 TYR A 129 15.000 -6.593 -3.784 1.00 0.00 H new ATOM 0 HH TYR A 129 15.811 -4.529 -3.542 1.00 0.00 H new ATOM 2072 N THR A 130 10.187 -7.026 -1.357 1.00 0.00 N ATOM 2073 CA THR A 130 9.672 -6.440 -2.628 1.00 0.00 C ATOM 2074 C THR A 130 10.078 -4.967 -2.727 1.00 0.00 C ATOM 2075 O THR A 130 9.488 -4.106 -2.105 1.00 0.00 O ATOM 2076 CB THR A 130 8.151 -6.577 -2.539 1.00 0.00 C ATOM 2077 OG1 THR A 130 7.795 -7.949 -2.635 1.00 0.00 O ATOM 2078 CG2 THR A 130 7.498 -5.798 -3.682 1.00 0.00 C ATOM 0 H THR A 130 9.768 -6.653 -0.505 1.00 0.00 H new ATOM 0 HA THR A 130 10.072 -6.940 -3.510 1.00 0.00 H new ATOM 0 HB THR A 130 7.805 -6.177 -1.586 1.00 0.00 H new ATOM 0 HG1 THR A 130 6.824 -8.029 -2.737 1.00 0.00 H new ATOM 0 HG21 THR A 130 6.414 -5.897 -3.617 1.00 0.00 H new ATOM 0 HG22 THR A 130 7.772 -4.746 -3.608 1.00 0.00 H new ATOM 0 HG23 THR A 130 7.842 -6.196 -4.637 1.00 0.00 H new ATOM 2086 N LYS A 131 11.085 -4.672 -3.503 1.00 0.00 N ATOM 2087 CA LYS A 131 11.533 -3.256 -3.640 1.00 0.00 C ATOM 2088 C LYS A 131 10.540 -2.459 -4.491 1.00 0.00 C ATOM 2089 O LYS A 131 10.579 -2.497 -5.704 1.00 0.00 O ATOM 2090 CB LYS A 131 12.891 -3.339 -4.341 1.00 0.00 C ATOM 2091 CG LYS A 131 13.350 -1.934 -4.735 1.00 0.00 C ATOM 2092 CD LYS A 131 14.674 -2.023 -5.496 1.00 0.00 C ATOM 2093 CE LYS A 131 14.916 -0.717 -6.256 1.00 0.00 C ATOM 2094 NZ LYS A 131 15.518 0.205 -5.255 1.00 0.00 N ATOM 0 H LYS A 131 11.617 -5.350 -4.048 1.00 0.00 H new ATOM 0 HA LYS A 131 11.597 -2.751 -2.676 1.00 0.00 H new ATOM 0 HB2 LYS A 131 13.625 -3.801 -3.681 1.00 0.00 H new ATOM 0 HB3 LYS A 131 12.817 -3.970 -5.226 1.00 0.00 H new ATOM 0 HG2 LYS A 131 12.593 -1.454 -5.356 1.00 0.00 H new ATOM 0 HG3 LYS A 131 13.471 -1.317 -3.845 1.00 0.00 H new ATOM 0 HD2 LYS A 131 15.493 -2.209 -4.801 1.00 0.00 H new ATOM 0 HD3 LYS A 131 14.650 -2.862 -6.192 1.00 0.00 H new ATOM 0 HE2 LYS A 131 15.585 -0.871 -7.103 1.00 0.00 H new ATOM 0 HE3 LYS A 131 13.985 -0.314 -6.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 15.713 1.124 -5.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 14.856 0.338 -4.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 16.406 -0.202 -4.899 1.00 0.00 H new ATOM 2108 N LEU A 132 9.655 -1.734 -3.864 1.00 0.00 N ATOM 2109 CA LEU A 132 8.665 -0.931 -4.638 1.00 0.00 C ATOM 2110 C LEU A 132 9.158 0.512 -4.774 1.00 0.00 C ATOM 2111 O LEU A 132 9.144 1.275 -3.828 1.00 0.00 O ATOM 2112 CB LEU A 132 7.378 -0.984 -3.814 1.00 0.00 C ATOM 2113 CG LEU A 132 6.345 -0.031 -4.417 1.00 0.00 C ATOM 2114 CD1 LEU A 132 5.028 -0.777 -4.638 1.00 0.00 C ATOM 2115 CD2 LEU A 132 6.111 1.137 -3.458 1.00 0.00 C ATOM 0 H LEU A 132 9.574 -1.663 -2.850 1.00 0.00 H new ATOM 0 HA LEU A 132 8.515 -1.316 -5.647 1.00 0.00 H new ATOM 0 HB2 LEU A 132 6.985 -2.001 -3.799 1.00 0.00 H new ATOM 0 HB3 LEU A 132 7.584 -0.707 -2.780 1.00 0.00 H new ATOM 0 HG LEU A 132 6.713 0.347 -5.371 1.00 0.00 H new ATOM 0 HD11 LEU A 132 4.292 -0.097 -5.068 1.00 0.00 H new ATOM 0 HD12 LEU A 132 5.193 -1.612 -5.320 1.00 0.00 H new ATOM 0 HD13 LEU A 132 4.659 -1.155 -3.684 1.00 0.00 H new ATOM 0 HD21 LEU A 132 5.375 1.817 -3.886 1.00 0.00 H new ATOM 0 HD22 LEU A 132 5.743 0.757 -2.505 1.00 0.00 H new ATOM 0 HD23 LEU A 132 7.048 1.670 -3.298 1.00 0.00 H new ATOM 2127 N VAL A 133 9.601 0.892 -5.941 1.00 0.00 N ATOM 2128 CA VAL A 133 10.102 2.283 -6.131 1.00 0.00 C ATOM 2129 C VAL A 133 8.990 3.188 -6.668 1.00 0.00 C ATOM 2130 O VAL A 133 8.587 3.083 -7.810 1.00 0.00 O ATOM 2131 CB VAL A 133 11.231 2.160 -7.153 1.00 0.00 C ATOM 2132 CG1 VAL A 133 11.537 3.537 -7.746 1.00 0.00 C ATOM 2133 CG2 VAL A 133 12.483 1.612 -6.466 1.00 0.00 C ATOM 0 H VAL A 133 9.638 0.300 -6.771 1.00 0.00 H new ATOM 0 HA VAL A 133 10.441 2.726 -5.195 1.00 0.00 H new ATOM 0 HB VAL A 133 10.926 1.481 -7.950 1.00 0.00 H new ATOM 0 HG11 VAL A 133 12.343 3.448 -8.475 1.00 0.00 H new ATOM 0 HG12 VAL A 133 10.646 3.928 -8.236 1.00 0.00 H new ATOM 0 HG13 VAL A 133 11.841 4.217 -6.950 1.00 0.00 H new ATOM 0 HG21 VAL A 133 13.289 1.524 -7.195 1.00 0.00 H new ATOM 0 HG22 VAL A 133 12.787 2.290 -5.669 1.00 0.00 H new ATOM 0 HG23 VAL A 133 12.266 0.631 -6.044 1.00 0.00 H new ATOM 2143 N PHE A 134 8.498 4.081 -5.854 1.00 0.00 N ATOM 2144 CA PHE A 134 7.418 4.999 -6.316 1.00 0.00 C ATOM 2145 C PHE A 134 7.803 5.635 -7.653 1.00 0.00 C ATOM 2146 O PHE A 134 8.955 5.637 -8.041 1.00 0.00 O ATOM 2147 CB PHE A 134 7.333 6.082 -5.240 1.00 0.00 C ATOM 2148 CG PHE A 134 6.383 5.657 -4.147 1.00 0.00 C ATOM 2149 CD1 PHE A 134 5.128 5.127 -4.469 1.00 0.00 C ATOM 2150 CD2 PHE A 134 6.760 5.803 -2.807 1.00 0.00 C ATOM 2151 CE1 PHE A 134 4.250 4.741 -3.449 1.00 0.00 C ATOM 2152 CE2 PHE A 134 5.883 5.418 -1.788 1.00 0.00 C ATOM 2153 CZ PHE A 134 4.628 4.887 -2.108 1.00 0.00 C ATOM 0 H PHE A 134 8.797 4.215 -4.888 1.00 0.00 H new ATOM 0 HA PHE A 134 6.472 4.477 -6.459 1.00 0.00 H new ATOM 0 HB2 PHE A 134 8.322 6.267 -4.821 1.00 0.00 H new ATOM 0 HB3 PHE A 134 6.994 7.019 -5.682 1.00 0.00 H new ATOM 0 HD1 PHE A 134 4.837 5.016 -5.503 1.00 0.00 H new ATOM 0 HD2 PHE A 134 7.728 6.213 -2.560 1.00 0.00 H new ATOM 0 HE1 PHE A 134 3.282 4.331 -3.696 1.00 0.00 H new ATOM 0 HE2 PHE A 134 6.174 5.530 -0.754 1.00 0.00 H new ATOM 0 HZ PHE A 134 3.951 4.590 -1.321 1.00 0.00 H new ATOM 2163 N ALA A 135 6.855 6.198 -8.347 1.00 0.00 N ATOM 2164 CA ALA A 135 7.176 6.858 -9.641 1.00 0.00 C ATOM 2165 C ALA A 135 7.824 8.213 -9.358 1.00 0.00 C ATOM 2166 O ALA A 135 8.580 8.734 -10.152 1.00 0.00 O ATOM 2167 CB ALA A 135 5.830 7.036 -10.344 1.00 0.00 C ATOM 0 H ALA A 135 5.873 6.230 -8.074 1.00 0.00 H new ATOM 0 HA ALA A 135 7.869 6.282 -10.254 1.00 0.00 H new ATOM 0 HB1 ALA A 135 5.985 7.518 -11.309 1.00 0.00 H new ATOM 0 HB2 ALA A 135 5.367 6.061 -10.496 1.00 0.00 H new ATOM 0 HB3 ALA A 135 5.178 7.656 -9.729 1.00 0.00 H new ATOM 2173 N LYS A 136 7.534 8.778 -8.216 1.00 0.00 N ATOM 2174 CA LYS A 136 8.129 10.092 -7.852 1.00 0.00 C ATOM 2175 C LYS A 136 8.246 10.198 -6.328 1.00 0.00 C ATOM 2176 O LYS A 136 7.658 9.416 -5.607 1.00 0.00 O ATOM 2177 CB LYS A 136 7.152 11.139 -8.393 1.00 0.00 C ATOM 2178 CG LYS A 136 7.749 11.798 -9.638 1.00 0.00 C ATOM 2179 CD LYS A 136 7.081 13.156 -9.864 1.00 0.00 C ATOM 2180 CE LYS A 136 6.573 13.244 -11.305 1.00 0.00 C ATOM 2181 NZ LYS A 136 5.093 13.361 -11.184 1.00 0.00 N ATOM 0 H LYS A 136 6.906 8.381 -7.517 1.00 0.00 H new ATOM 0 HA LYS A 136 9.129 10.227 -8.264 1.00 0.00 H new ATOM 0 HB2 LYS A 136 6.199 10.670 -8.638 1.00 0.00 H new ATOM 0 HB3 LYS A 136 6.950 11.892 -7.631 1.00 0.00 H new ATOM 0 HG2 LYS A 136 8.825 11.925 -9.515 1.00 0.00 H new ATOM 0 HG3 LYS A 136 7.601 11.158 -10.508 1.00 0.00 H new ATOM 0 HD2 LYS A 136 6.253 13.286 -9.167 1.00 0.00 H new ATOM 0 HD3 LYS A 136 7.791 13.959 -9.668 1.00 0.00 H new ATOM 0 HE2 LYS A 136 6.996 14.106 -11.821 1.00 0.00 H new ATOM 0 HE3 LYS A 136 6.854 12.360 -11.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 4.671 13.426 -12.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 4.717 12.524 -10.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 4.856 14.215 -10.640 1.00 0.00 H new ATOM 2195 N PRO A 137 9.005 11.163 -5.887 1.00 0.00 N ATOM 2196 CA PRO A 137 9.201 11.370 -4.429 1.00 0.00 C ATOM 2197 C PRO A 137 7.926 11.931 -3.797 1.00 0.00 C ATOM 2198 O PRO A 137 7.314 12.842 -4.319 1.00 0.00 O ATOM 2199 CB PRO A 137 10.338 12.385 -4.361 1.00 0.00 C ATOM 2200 CG PRO A 137 10.284 13.113 -5.667 1.00 0.00 C ATOM 2201 CD PRO A 137 9.743 12.145 -6.688 1.00 0.00 C ATOM 0 HA PRO A 137 9.428 10.450 -3.890 1.00 0.00 H new ATOM 0 HB2 PRO A 137 10.207 13.069 -3.522 1.00 0.00 H new ATOM 0 HB3 PRO A 137 11.300 11.892 -4.223 1.00 0.00 H new ATOM 0 HG2 PRO A 137 9.644 13.992 -5.592 1.00 0.00 H new ATOM 0 HG3 PRO A 137 11.275 13.463 -5.955 1.00 0.00 H new ATOM 0 HD2 PRO A 137 9.093 12.644 -7.406 1.00 0.00 H new ATOM 0 HD3 PRO A 137 10.545 11.675 -7.257 1.00 0.00 H new ATOM 2209 N ILE A 138 7.515 11.393 -2.680 1.00 0.00 N ATOM 2210 CA ILE A 138 6.276 11.904 -2.030 1.00 0.00 C ATOM 2211 C ILE A 138 6.618 12.975 -0.990 1.00 0.00 C ATOM 2212 O ILE A 138 7.090 12.678 0.090 1.00 0.00 O ATOM 2213 CB ILE A 138 5.648 10.685 -1.355 1.00 0.00 C ATOM 2214 CG1 ILE A 138 5.699 9.486 -2.307 1.00 0.00 C ATOM 2215 CG2 ILE A 138 4.192 10.995 -1.009 1.00 0.00 C ATOM 2216 CD1 ILE A 138 4.994 9.840 -3.617 1.00 0.00 C ATOM 0 H ILE A 138 7.981 10.627 -2.193 1.00 0.00 H new ATOM 0 HA ILE A 138 5.600 12.367 -2.748 1.00 0.00 H new ATOM 0 HB ILE A 138 6.201 10.448 -0.446 1.00 0.00 H new ATOM 0 HG12 ILE A 138 6.735 9.209 -2.503 1.00 0.00 H new ATOM 0 HG13 ILE A 138 5.219 8.622 -1.846 1.00 0.00 H new ATOM 0 HG21 ILE A 138 3.740 10.128 -0.527 1.00 0.00 H new ATOM 0 HG22 ILE A 138 4.153 11.848 -0.332 1.00 0.00 H new ATOM 0 HG23 ILE A 138 3.643 11.230 -1.921 1.00 0.00 H new ATOM 0 HD11 ILE A 138 5.032 8.986 -4.293 1.00 0.00 H new ATOM 0 HD12 ILE A 138 3.954 10.096 -3.413 1.00 0.00 H new ATOM 0 HD13 ILE A 138 5.493 10.691 -4.080 1.00 0.00 H new ATOM 2228 N TYR A 139 6.378 14.218 -1.307 1.00 0.00 N ATOM 2229 CA TYR A 139 6.682 15.309 -0.336 1.00 0.00 C ATOM 2230 C TYR A 139 5.388 16.010 0.087 1.00 0.00 C ATOM 2231 O TYR A 139 4.536 16.305 -0.730 1.00 0.00 O ATOM 2232 CB TYR A 139 7.593 16.275 -1.094 1.00 0.00 C ATOM 2233 CG TYR A 139 9.035 15.885 -0.878 1.00 0.00 C ATOM 2234 CD1 TYR A 139 9.565 15.855 0.418 1.00 0.00 C ATOM 2235 CD2 TYR A 139 9.844 15.554 -1.971 1.00 0.00 C ATOM 2236 CE1 TYR A 139 10.903 15.496 0.621 1.00 0.00 C ATOM 2237 CE2 TYR A 139 11.182 15.194 -1.770 1.00 0.00 C ATOM 2238 CZ TYR A 139 11.711 15.165 -0.474 1.00 0.00 C ATOM 2239 OH TYR A 139 13.030 14.811 -0.275 1.00 0.00 O ATOM 0 H TYR A 139 5.985 14.526 -2.196 1.00 0.00 H new ATOM 0 HA TYR A 139 7.155 14.935 0.572 1.00 0.00 H new ATOM 0 HB2 TYR A 139 7.356 16.256 -2.158 1.00 0.00 H new ATOM 0 HB3 TYR A 139 7.426 17.295 -0.749 1.00 0.00 H new ATOM 0 HD1 TYR A 139 8.941 16.109 1.262 1.00 0.00 H new ATOM 0 HD2 TYR A 139 9.436 15.576 -2.971 1.00 0.00 H new ATOM 0 HE1 TYR A 139 11.311 15.474 1.621 1.00 0.00 H new ATOM 0 HE2 TYR A 139 11.806 14.939 -2.614 1.00 0.00 H new ATOM 0 HH TYR A 139 13.079 13.869 -0.008 1.00 0.00 H new ATOM 2249 N ASN A 140 5.229 16.275 1.354 1.00 0.00 N ATOM 2250 CA ASN A 140 3.985 16.950 1.824 1.00 0.00 C ATOM 2251 C ASN A 140 3.933 18.393 1.309 1.00 0.00 C ATOM 2252 O ASN A 140 4.935 18.962 0.924 1.00 0.00 O ATOM 2253 CB ASN A 140 4.075 16.929 3.351 1.00 0.00 C ATOM 2254 CG ASN A 140 3.242 18.073 3.927 1.00 0.00 C ATOM 2255 OD1 ASN A 140 2.049 18.143 3.707 1.00 0.00 O ATOM 2256 ND2 ASN A 140 3.823 18.980 4.663 1.00 0.00 N ATOM 0 H ASN A 140 5.906 16.054 2.084 1.00 0.00 H new ATOM 0 HA ASN A 140 3.086 16.453 1.461 1.00 0.00 H new ATOM 0 HB2 ASN A 140 3.715 15.974 3.734 1.00 0.00 H new ATOM 0 HB3 ASN A 140 5.114 17.027 3.666 1.00 0.00 H new ATOM 0 HD21 ASN A 140 3.276 19.747 5.053 1.00 0.00 H new ATOM 0 HD22 ASN A 140 4.824 18.922 4.848 1.00 0.00 H new ATOM 2263 N ASP A 141 2.770 18.986 1.300 1.00 0.00 N ATOM 2264 CA ASP A 141 2.647 20.391 0.811 1.00 0.00 C ATOM 2265 C ASP A 141 2.215 21.312 1.957 1.00 0.00 C ATOM 2266 O ASP A 141 1.040 21.540 2.161 1.00 0.00 O ATOM 2267 CB ASP A 141 1.570 20.340 -0.273 1.00 0.00 C ATOM 2268 CG ASP A 141 2.113 20.951 -1.565 1.00 0.00 C ATOM 2269 OD1 ASP A 141 2.850 21.920 -1.475 1.00 0.00 O ATOM 2270 OD2 ASP A 141 1.785 20.440 -2.623 1.00 0.00 O ATOM 0 H ASP A 141 1.898 18.558 1.611 1.00 0.00 H new ATOM 0 HA ASP A 141 3.590 20.781 0.429 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.264 19.308 -0.447 1.00 0.00 H new ATOM 0 HB3 ASP A 141 0.684 20.884 0.054 1.00 0.00 H new