USER MOD reduce.3.24.130724 H: found=0, std=0, add=929, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 927 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 93 HIS : no HE2:sc= -4.4 K(o=-4.4,f=-3.2!) USER MOD Set 1.2: A 113 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 64 TYR OH : rot 163:sc= -0.148 USER MOD Set 2.2: A 72 GLN : amide:sc= -0.22 K(o=-0.37,f=-4.1!) USER MOD Set 3.1: A 32 SER OG : rot -95:sc= 0.946 USER MOD Set 3.2: A 33 SER OG : rot 180:sc= 0 USER MOD Set 3.3: A 48 THR OG1 : rot -145:sc= 1.03 USER MOD Single : A 1 GLY N :NH3+ -113:sc= 0.0723 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0918 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 HIS : no HD1:sc= -0.0937 X(o=-0.094,f=-0.14) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -160:sc= -1.47 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -2.93 K(o=-2.9,f=-5.5!) USER MOD Single : A 53 GLN : amide:sc=-0.00309 X(o=-0.0031,f=-0.0031) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= -5.67! C(o=-5.7!,f=-4.3!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -116:sc= 0.917 (180deg=0.00546) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -164:sc=-0.00822 (180deg=-0.118) USER MOD Single : A 80 GLN : amide:sc= -0.501 X(o=-0.5,f=-0.5) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.184 X(o=-0.18,f=-0.17) USER MOD Single : A 91 SER OG : rot -57:sc= 0.092 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0.0368 USER MOD Single : A 97 THR OG1 : rot -52:sc= 0.266 USER MOD Single : A 99 LYS NZ :NH3+ 159:sc= -0.0554 (180deg=-0.367) USER MOD Single : A 102 ASN : amide:sc= -1.29 K(o=-1.3,f=-11!) USER MOD Single : A 103 ASN : amide:sc= -1.27 K(o=-1.3,f=-0.4) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -159:sc= 0.169 USER MOD Single : A 119 HIS : no HD1:sc= -0.425 X(o=-0.43,f=-0.58) USER MOD Single : A 120 THR OG1 : rot 33:sc= 0.0339 USER MOD Single : A 121 SER OG : rot 180:sc= -0.0417 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 26.923 31.938 -6.481 1.00 0.00 N ATOM 2 CA GLY A 1 26.057 30.799 -6.727 1.00 0.00 C ATOM 3 C GLY A 1 24.588 31.148 -6.585 1.00 0.00 C ATOM 4 O GLY A 1 24.238 32.146 -5.957 1.00 0.00 O ATOM 0 H1 GLY A 1 27.403 32.206 -7.364 1.00 0.00 H new ATOM 0 H2 GLY A 1 26.354 32.739 -6.139 1.00 0.00 H new ATOM 0 H3 GLY A 1 27.632 31.686 -5.763 1.00 0.00 H new ATOM 0 HA2 GLY A 1 26.241 30.416 -7.731 1.00 0.00 H new ATOM 0 HA3 GLY A 1 26.307 29.999 -6.030 1.00 0.00 H new ATOM 8 N SER A 2 23.727 30.323 -7.173 1.00 0.00 N ATOM 9 CA SER A 2 22.288 30.552 -7.115 1.00 0.00 C ATOM 10 C SER A 2 21.527 29.393 -7.751 1.00 0.00 C ATOM 11 O SER A 2 22.028 28.733 -8.662 1.00 0.00 O ATOM 12 CB SER A 2 21.930 31.861 -7.820 1.00 0.00 C ATOM 13 OG SER A 2 20.528 32.071 -7.826 1.00 0.00 O ATOM 0 H SER A 2 24.001 29.490 -7.695 1.00 0.00 H new ATOM 0 HA SER A 2 21.998 30.622 -6.067 1.00 0.00 H new ATOM 0 HB2 SER A 2 22.423 32.694 -7.319 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.302 31.839 -8.844 1.00 0.00 H new ATOM 0 HG SER A 2 20.326 32.915 -8.281 1.00 0.00 H new ATOM 19 N SER A 3 20.314 29.152 -7.265 1.00 0.00 N ATOM 20 CA SER A 3 19.484 28.070 -7.783 1.00 0.00 C ATOM 21 C SER A 3 18.019 28.491 -7.843 1.00 0.00 C ATOM 22 O SER A 3 17.658 29.586 -7.414 1.00 0.00 O ATOM 23 CB SER A 3 19.633 26.822 -6.910 1.00 0.00 C ATOM 24 OG SER A 3 20.997 26.480 -6.738 1.00 0.00 O ATOM 0 H SER A 3 19.884 29.691 -6.513 1.00 0.00 H new ATOM 0 HA SER A 3 19.819 27.839 -8.794 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.173 26.998 -5.937 1.00 0.00 H new ATOM 0 HB3 SER A 3 19.101 25.988 -7.368 1.00 0.00 H new ATOM 0 HG SER A 3 21.065 25.680 -6.175 1.00 0.00 H new ATOM 30 N GLY A 4 17.179 27.611 -8.379 1.00 0.00 N ATOM 31 CA GLY A 4 15.762 27.908 -8.486 1.00 0.00 C ATOM 32 C GLY A 4 14.961 26.733 -9.011 1.00 0.00 C ATOM 33 O GLY A 4 14.632 26.677 -10.196 1.00 0.00 O ATOM 0 H GLY A 4 17.454 26.698 -8.741 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.379 28.196 -7.507 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.622 28.763 -9.147 1.00 0.00 H new ATOM 37 N SER A 5 14.648 25.791 -8.128 1.00 0.00 N ATOM 38 CA SER A 5 13.885 24.608 -8.510 1.00 0.00 C ATOM 39 C SER A 5 12.648 24.452 -7.631 1.00 0.00 C ATOM 40 O SER A 5 12.724 24.565 -6.408 1.00 0.00 O ATOM 41 CB SER A 5 14.759 23.356 -8.408 1.00 0.00 C ATOM 42 OG SER A 5 13.985 22.180 -8.561 1.00 0.00 O ATOM 0 H SER A 5 14.911 25.823 -7.143 1.00 0.00 H new ATOM 0 HA SER A 5 13.561 24.733 -9.543 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.534 23.387 -9.173 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.265 23.339 -7.442 1.00 0.00 H new ATOM 0 HG SER A 5 14.567 21.394 -8.494 1.00 0.00 H new ATOM 48 N SER A 6 11.509 24.190 -8.265 1.00 0.00 N ATOM 49 CA SER A 6 10.254 24.022 -7.542 1.00 0.00 C ATOM 50 C SER A 6 9.192 23.391 -8.437 1.00 0.00 C ATOM 51 O SER A 6 9.292 23.434 -9.663 1.00 0.00 O ATOM 52 CB SER A 6 9.759 25.371 -7.016 1.00 0.00 C ATOM 53 OG SER A 6 8.478 25.248 -6.423 1.00 0.00 O ATOM 0 H SER A 6 11.430 24.090 -9.277 1.00 0.00 H new ATOM 0 HA SER A 6 10.435 23.356 -6.698 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.466 25.761 -6.284 1.00 0.00 H new ATOM 0 HB3 SER A 6 9.717 26.091 -7.834 1.00 0.00 H new ATOM 0 HG SER A 6 8.185 26.123 -6.093 1.00 0.00 H new ATOM 59 N GLY A 7 8.173 22.805 -7.814 1.00 0.00 N ATOM 60 CA GLY A 7 7.107 22.173 -8.569 1.00 0.00 C ATOM 61 C GLY A 7 5.731 22.554 -8.059 1.00 0.00 C ATOM 62 O GLY A 7 5.088 21.802 -7.326 1.00 0.00 O ATOM 0 H GLY A 7 8.067 22.757 -6.801 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.193 22.454 -9.619 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.223 21.090 -8.519 1.00 0.00 H new ATOM 66 N PRO A 8 5.262 23.749 -8.447 1.00 0.00 N ATOM 67 CA PRO A 8 3.949 24.255 -8.034 1.00 0.00 C ATOM 68 C PRO A 8 2.802 23.485 -8.679 1.00 0.00 C ATOM 69 O PRO A 8 1.633 23.734 -8.385 1.00 0.00 O ATOM 70 CB PRO A 8 3.960 25.706 -8.522 1.00 0.00 C ATOM 71 CG PRO A 8 4.923 25.717 -9.658 1.00 0.00 C ATOM 72 CD PRO A 8 5.975 24.697 -9.319 1.00 0.00 C ATOM 0 HA PRO A 8 3.791 24.152 -6.960 1.00 0.00 H new ATOM 0 HB2 PRO A 8 2.967 26.024 -8.842 1.00 0.00 H new ATOM 0 HB3 PRO A 8 4.273 26.387 -7.731 1.00 0.00 H new ATOM 0 HG2 PRO A 8 4.425 25.467 -10.595 1.00 0.00 H new ATOM 0 HG3 PRO A 8 5.365 26.705 -9.786 1.00 0.00 H new ATOM 0 HD2 PRO A 8 6.363 24.208 -10.212 1.00 0.00 H new ATOM 0 HD3 PRO A 8 6.825 25.151 -8.809 1.00 0.00 H new ATOM 80 N ALA A 9 3.144 22.548 -9.557 1.00 0.00 N ATOM 81 CA ALA A 9 2.142 21.740 -10.241 1.00 0.00 C ATOM 82 C ALA A 9 1.506 20.733 -9.289 1.00 0.00 C ATOM 83 O ALA A 9 2.006 19.620 -9.119 1.00 0.00 O ATOM 84 CB ALA A 9 2.763 21.024 -11.431 1.00 0.00 C ATOM 0 H ALA A 9 4.107 22.330 -9.811 1.00 0.00 H new ATOM 0 HA ALA A 9 1.358 22.406 -10.601 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.003 20.424 -11.932 1.00 0.00 H new ATOM 0 HB2 ALA A 9 3.164 21.759 -12.129 1.00 0.00 H new ATOM 0 HB3 ALA A 9 3.568 20.375 -11.086 1.00 0.00 H new ATOM 90 N THR A 10 0.400 21.130 -8.667 1.00 0.00 N ATOM 91 CA THR A 10 -0.304 20.263 -7.730 1.00 0.00 C ATOM 92 C THR A 10 -1.701 19.925 -8.237 1.00 0.00 C ATOM 93 O THR A 10 -2.663 19.907 -7.468 1.00 0.00 O ATOM 94 CB THR A 10 -0.418 20.915 -6.339 1.00 0.00 C ATOM 95 OG1 THR A 10 -0.897 22.258 -6.465 1.00 0.00 O ATOM 96 CG2 THR A 10 0.928 20.915 -5.629 1.00 0.00 C ATOM 0 H THR A 10 -0.028 22.047 -8.795 1.00 0.00 H new ATOM 0 HA THR A 10 0.280 19.347 -7.647 1.00 0.00 H new ATOM 0 HB THR A 10 -1.123 20.333 -5.746 1.00 0.00 H new ATOM 0 HG1 THR A 10 -0.968 22.665 -5.576 1.00 0.00 H new ATOM 0 HG21 THR A 10 0.822 21.380 -4.649 1.00 0.00 H new ATOM 0 HG22 THR A 10 1.276 19.889 -5.508 1.00 0.00 H new ATOM 0 HG23 THR A 10 1.652 21.476 -6.221 1.00 0.00 H new ATOM 104 N ASP A 11 -1.806 19.656 -9.533 1.00 0.00 N ATOM 105 CA ASP A 11 -3.087 19.316 -10.142 1.00 0.00 C ATOM 106 C ASP A 11 -3.208 17.809 -10.347 1.00 0.00 C ATOM 107 O ASP A 11 -2.837 17.283 -11.396 1.00 0.00 O ATOM 108 CB ASP A 11 -3.247 20.039 -11.480 1.00 0.00 C ATOM 109 CG ASP A 11 -2.194 19.629 -12.490 1.00 0.00 C ATOM 110 OD1 ASP A 11 -0.992 19.800 -12.197 1.00 0.00 O ATOM 111 OD2 ASP A 11 -2.571 19.136 -13.574 1.00 0.00 O ATOM 0 H ASP A 11 -1.020 19.667 -10.183 1.00 0.00 H new ATOM 0 HA ASP A 11 -3.880 19.638 -9.466 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -4.237 19.830 -11.886 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -3.190 21.115 -11.317 1.00 0.00 H new ATOM 116 N TRP A 12 -3.728 17.120 -9.337 1.00 0.00 N ATOM 117 CA TRP A 12 -3.897 15.673 -9.406 1.00 0.00 C ATOM 118 C TRP A 12 -5.297 15.267 -8.958 1.00 0.00 C ATOM 119 O TRP A 12 -5.524 14.980 -7.782 1.00 0.00 O ATOM 120 CB TRP A 12 -2.848 14.975 -8.539 1.00 0.00 C ATOM 121 CG TRP A 12 -1.472 15.004 -9.133 1.00 0.00 C ATOM 122 CD1 TRP A 12 -0.518 15.962 -8.944 1.00 0.00 C ATOM 123 CD2 TRP A 12 -0.898 14.032 -10.014 1.00 0.00 C ATOM 124 NE1 TRP A 12 0.615 15.644 -9.654 1.00 0.00 N ATOM 125 CE2 TRP A 12 0.407 14.465 -10.318 1.00 0.00 C ATOM 126 CE3 TRP A 12 -1.359 12.837 -10.574 1.00 0.00 C ATOM 127 CZ2 TRP A 12 1.253 13.745 -11.157 1.00 0.00 C ATOM 128 CZ3 TRP A 12 -0.519 12.124 -11.407 1.00 0.00 C ATOM 129 CH2 TRP A 12 0.776 12.579 -11.692 1.00 0.00 C ATOM 0 H TRP A 12 -4.040 17.540 -8.461 1.00 0.00 H new ATOM 0 HA TRP A 12 -3.764 15.365 -10.443 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -2.823 15.450 -7.558 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -3.147 13.938 -8.383 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -0.636 16.841 -8.327 1.00 0.00 H new ATOM 0 HE1 TRP A 12 1.472 16.197 -9.682 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -2.354 12.478 -10.359 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 2.251 14.094 -11.378 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -0.866 11.200 -11.846 1.00 0.00 H new ATOM 0 HH2 TRP A 12 1.409 11.998 -12.346 1.00 0.00 H new ATOM 140 N LEU A 13 -6.232 15.243 -9.902 1.00 0.00 N ATOM 141 CA LEU A 13 -7.610 14.871 -9.604 1.00 0.00 C ATOM 142 C LEU A 13 -7.823 13.373 -9.793 1.00 0.00 C ATOM 143 O LEU A 13 -8.592 12.747 -9.063 1.00 0.00 O ATOM 144 CB LEU A 13 -8.575 15.652 -10.499 1.00 0.00 C ATOM 145 CG LEU A 13 -8.288 15.601 -12.000 1.00 0.00 C ATOM 146 CD1 LEU A 13 -9.578 15.739 -12.794 1.00 0.00 C ATOM 147 CD2 LEU A 13 -7.299 16.689 -12.391 1.00 0.00 C ATOM 0 H LEU A 13 -6.060 15.477 -10.880 1.00 0.00 H new ATOM 0 HA LEU A 13 -7.810 15.119 -8.561 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.583 15.274 -10.329 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.568 16.695 -10.183 1.00 0.00 H new ATOM 0 HG LEU A 13 -7.843 14.634 -12.234 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -9.355 15.701 -13.860 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -10.254 14.924 -12.535 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.051 16.692 -12.556 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -7.106 16.638 -13.463 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -7.716 17.665 -12.144 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -6.365 16.545 -11.847 1.00 0.00 H new ATOM 159 N SER A 14 -7.134 12.802 -10.777 1.00 0.00 N ATOM 160 CA SER A 14 -7.249 11.377 -11.063 1.00 0.00 C ATOM 161 C SER A 14 -6.739 10.544 -9.891 1.00 0.00 C ATOM 162 O SER A 14 -5.544 10.275 -9.780 1.00 0.00 O ATOM 163 CB SER A 14 -6.467 11.025 -12.331 1.00 0.00 C ATOM 164 OG SER A 14 -7.262 11.213 -13.489 1.00 0.00 O ATOM 0 H SER A 14 -6.491 13.305 -11.389 1.00 0.00 H new ATOM 0 HA SER A 14 -8.303 11.147 -11.218 1.00 0.00 H new ATOM 0 HB2 SER A 14 -5.573 11.646 -12.395 1.00 0.00 H new ATOM 0 HB3 SER A 14 -6.133 9.989 -12.280 1.00 0.00 H new ATOM 0 HG SER A 14 -6.739 10.983 -14.285 1.00 0.00 H new ATOM 170 N ALA A 15 -7.656 10.140 -9.018 1.00 0.00 N ATOM 171 CA ALA A 15 -7.301 9.337 -7.854 1.00 0.00 C ATOM 172 C ALA A 15 -7.796 7.902 -8.006 1.00 0.00 C ATOM 173 O ALA A 15 -8.931 7.587 -7.651 1.00 0.00 O ATOM 174 CB ALA A 15 -7.869 9.961 -6.589 1.00 0.00 C ATOM 0 H ALA A 15 -8.650 10.356 -9.095 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.214 9.313 -7.778 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.596 9.351 -5.728 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -7.464 10.965 -6.465 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.955 10.015 -6.666 1.00 0.00 H new ATOM 180 N GLU A 16 -6.936 7.038 -8.537 1.00 0.00 N ATOM 181 CA GLU A 16 -7.287 5.637 -8.737 1.00 0.00 C ATOM 182 C GLU A 16 -6.260 4.719 -8.080 1.00 0.00 C ATOM 183 O GLU A 16 -5.061 4.999 -8.094 1.00 0.00 O ATOM 184 CB GLU A 16 -7.388 5.321 -10.231 1.00 0.00 C ATOM 185 CG GLU A 16 -7.604 3.847 -10.529 1.00 0.00 C ATOM 186 CD GLU A 16 -9.070 3.458 -10.512 1.00 0.00 C ATOM 187 OE1 GLU A 16 -9.881 4.177 -11.131 1.00 0.00 O ATOM 188 OE2 GLU A 16 -9.405 2.435 -9.879 1.00 0.00 O ATOM 0 H GLU A 16 -5.992 7.284 -8.836 1.00 0.00 H new ATOM 0 HA GLU A 16 -8.256 5.462 -8.270 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.210 5.894 -10.660 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.476 5.653 -10.726 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -7.181 3.612 -11.505 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -7.064 3.249 -9.795 1.00 0.00 H new ATOM 195 N THR A 17 -6.739 3.621 -7.504 1.00 0.00 N ATOM 196 CA THR A 17 -5.865 2.662 -6.840 1.00 0.00 C ATOM 197 C THR A 17 -5.739 1.379 -7.653 1.00 0.00 C ATOM 198 O THR A 17 -6.691 0.606 -7.763 1.00 0.00 O ATOM 199 CB THR A 17 -6.379 2.316 -5.430 1.00 0.00 C ATOM 200 OG1 THR A 17 -6.649 3.517 -4.698 1.00 0.00 O ATOM 201 CG2 THR A 17 -5.362 1.474 -4.675 1.00 0.00 C ATOM 0 H THR A 17 -7.728 3.374 -7.484 1.00 0.00 H new ATOM 0 HA THR A 17 -4.885 3.132 -6.755 1.00 0.00 H new ATOM 0 HB THR A 17 -7.299 1.740 -5.534 1.00 0.00 H new ATOM 0 HG1 THR A 17 -6.977 3.288 -3.803 1.00 0.00 H new ATOM 0 HG21 THR A 17 -5.747 1.242 -3.682 1.00 0.00 H new ATOM 0 HG22 THR A 17 -5.181 0.547 -5.220 1.00 0.00 H new ATOM 0 HG23 THR A 17 -4.428 2.028 -4.582 1.00 0.00 H new ATOM 209 N PHE A 18 -4.558 1.156 -8.219 1.00 0.00 N ATOM 210 CA PHE A 18 -4.308 -0.035 -9.022 1.00 0.00 C ATOM 211 C PHE A 18 -3.569 -1.094 -8.209 1.00 0.00 C ATOM 212 O PHE A 18 -2.634 -1.726 -8.699 1.00 0.00 O ATOM 213 CB PHE A 18 -3.496 0.326 -10.268 1.00 0.00 C ATOM 214 CG PHE A 18 -3.180 -0.856 -11.140 1.00 0.00 C ATOM 215 CD1 PHE A 18 -4.196 -1.598 -11.719 1.00 0.00 C ATOM 216 CD2 PHE A 18 -1.866 -1.224 -11.382 1.00 0.00 C ATOM 217 CE1 PHE A 18 -3.908 -2.686 -12.521 1.00 0.00 C ATOM 218 CE2 PHE A 18 -1.571 -2.311 -12.183 1.00 0.00 C ATOM 219 CZ PHE A 18 -2.594 -3.042 -12.755 1.00 0.00 C ATOM 0 H PHE A 18 -3.759 1.784 -8.137 1.00 0.00 H new ATOM 0 HA PHE A 18 -5.270 -0.444 -9.329 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.049 1.061 -10.852 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -2.564 0.800 -9.960 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.225 -1.323 -11.542 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -1.062 -0.654 -10.939 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.710 -3.258 -12.965 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.543 -2.588 -12.361 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.367 -3.890 -13.384 1.00 0.00 H new ATOM 229 N GLU A 19 -3.996 -1.280 -6.964 1.00 0.00 N ATOM 230 CA GLU A 19 -3.375 -2.261 -6.083 1.00 0.00 C ATOM 231 C GLU A 19 -4.354 -3.379 -5.737 1.00 0.00 C ATOM 232 O GLU A 19 -4.326 -3.924 -4.633 1.00 0.00 O ATOM 233 CB GLU A 19 -2.880 -1.587 -4.801 1.00 0.00 C ATOM 234 CG GLU A 19 -1.662 -2.260 -4.190 1.00 0.00 C ATOM 235 CD GLU A 19 -1.549 -2.017 -2.698 1.00 0.00 C ATOM 236 OE1 GLU A 19 -2.601 -1.907 -2.034 1.00 0.00 O ATOM 237 OE2 GLU A 19 -0.409 -1.937 -2.194 1.00 0.00 O ATOM 0 H GLU A 19 -4.769 -0.764 -6.543 1.00 0.00 H new ATOM 0 HA GLU A 19 -2.525 -2.696 -6.608 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.639 -0.546 -5.018 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -3.687 -1.582 -4.069 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -1.712 -3.333 -4.377 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -0.762 -1.892 -4.683 1.00 0.00 H new ATOM 244 N SER A 20 -5.219 -3.716 -6.688 1.00 0.00 N ATOM 245 CA SER A 20 -6.210 -4.766 -6.484 1.00 0.00 C ATOM 246 C SER A 20 -5.603 -6.142 -6.739 1.00 0.00 C ATOM 247 O SER A 20 -6.055 -7.144 -6.184 1.00 0.00 O ATOM 248 CB SER A 20 -7.412 -4.547 -7.404 1.00 0.00 C ATOM 249 OG SER A 20 -7.024 -4.574 -8.766 1.00 0.00 O ATOM 0 H SER A 20 -5.254 -3.277 -7.608 1.00 0.00 H new ATOM 0 HA SER A 20 -6.543 -4.722 -5.447 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.160 -5.319 -7.220 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.879 -3.589 -7.175 1.00 0.00 H new ATOM 0 HG SER A 20 -7.811 -4.433 -9.333 1.00 0.00 H new ATOM 255 N ASP A 21 -4.578 -6.183 -7.582 1.00 0.00 N ATOM 256 CA ASP A 21 -3.908 -7.436 -7.911 1.00 0.00 C ATOM 257 C ASP A 21 -2.392 -7.266 -7.877 1.00 0.00 C ATOM 258 O ASP A 21 -1.776 -6.886 -8.874 1.00 0.00 O ATOM 259 CB ASP A 21 -4.347 -7.927 -9.291 1.00 0.00 C ATOM 260 CG ASP A 21 -5.831 -8.230 -9.352 1.00 0.00 C ATOM 261 OD1 ASP A 21 -6.341 -8.888 -8.421 1.00 0.00 O ATOM 262 OD2 ASP A 21 -6.483 -7.809 -10.330 1.00 0.00 O ATOM 0 H ASP A 21 -4.192 -5.363 -8.050 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.190 -8.178 -7.164 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.102 -7.171 -10.037 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.785 -8.824 -9.550 1.00 0.00 H new ATOM 267 N LEU A 22 -1.796 -7.550 -6.724 1.00 0.00 N ATOM 268 CA LEU A 22 -0.352 -7.428 -6.559 1.00 0.00 C ATOM 269 C LEU A 22 0.170 -8.453 -5.557 1.00 0.00 C ATOM 270 O LEU A 22 -0.590 -8.992 -4.752 1.00 0.00 O ATOM 271 CB LEU A 22 0.011 -6.016 -6.096 1.00 0.00 C ATOM 272 CG LEU A 22 0.082 -4.949 -7.189 1.00 0.00 C ATOM 273 CD1 LEU A 22 0.406 -3.590 -6.588 1.00 0.00 C ATOM 274 CD2 LEU A 22 1.116 -5.329 -8.239 1.00 0.00 C ATOM 0 H LEU A 22 -2.290 -7.866 -5.890 1.00 0.00 H new ATOM 0 HA LEU A 22 0.116 -7.619 -7.525 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -0.722 -5.699 -5.354 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.977 -6.057 -5.593 1.00 0.00 H new ATOM 0 HG LEU A 22 -0.893 -4.887 -7.673 1.00 0.00 H new ATOM 0 HD11 LEU A 22 0.452 -2.843 -7.381 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -0.370 -3.314 -5.874 1.00 0.00 H new ATOM 0 HD13 LEU A 22 1.368 -3.638 -6.078 1.00 0.00 H new ATOM 0 HD21 LEU A 22 1.153 -4.558 -9.009 1.00 0.00 H new ATOM 0 HD22 LEU A 22 2.095 -5.420 -7.769 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.841 -6.282 -8.692 1.00 0.00 H new ATOM 286 N ASP A 23 1.471 -8.717 -5.613 1.00 0.00 N ATOM 287 CA ASP A 23 2.096 -9.675 -4.708 1.00 0.00 C ATOM 288 C ASP A 23 2.832 -8.959 -3.580 1.00 0.00 C ATOM 289 O ASP A 23 4.045 -8.767 -3.643 1.00 0.00 O ATOM 290 CB ASP A 23 3.066 -10.575 -5.476 1.00 0.00 C ATOM 291 CG ASP A 23 2.351 -11.639 -6.286 1.00 0.00 C ATOM 292 OD1 ASP A 23 1.566 -12.408 -5.693 1.00 0.00 O ATOM 293 OD2 ASP A 23 2.577 -11.702 -7.513 1.00 0.00 O ATOM 0 H ASP A 23 2.113 -8.281 -6.275 1.00 0.00 H new ATOM 0 HA ASP A 23 1.310 -10.290 -4.270 1.00 0.00 H new ATOM 0 HB2 ASP A 23 3.675 -9.963 -6.142 1.00 0.00 H new ATOM 0 HB3 ASP A 23 3.747 -11.054 -4.772 1.00 0.00 H new ATOM 298 N GLU A 24 2.087 -8.565 -2.552 1.00 0.00 N ATOM 299 CA GLU A 24 2.670 -7.867 -1.411 1.00 0.00 C ATOM 300 C GLU A 24 3.052 -8.851 -0.309 1.00 0.00 C ATOM 301 O GLU A 24 4.019 -8.637 0.423 1.00 0.00 O ATOM 302 CB GLU A 24 1.688 -6.828 -0.865 1.00 0.00 C ATOM 303 CG GLU A 24 1.966 -6.426 0.574 1.00 0.00 C ATOM 304 CD GLU A 24 1.239 -7.302 1.575 1.00 0.00 C ATOM 305 OE1 GLU A 24 0.429 -8.149 1.143 1.00 0.00 O ATOM 306 OE2 GLU A 24 1.480 -7.141 2.790 1.00 0.00 O ATOM 0 H GLU A 24 1.081 -8.717 -2.485 1.00 0.00 H new ATOM 0 HA GLU A 24 3.573 -7.360 -1.750 1.00 0.00 H new ATOM 0 HB2 GLU A 24 1.724 -5.939 -1.495 1.00 0.00 H new ATOM 0 HB3 GLU A 24 0.676 -7.226 -0.933 1.00 0.00 H new ATOM 0 HG2 GLU A 24 3.038 -6.479 0.762 1.00 0.00 H new ATOM 0 HG3 GLU A 24 1.668 -5.388 0.721 1.00 0.00 H new ATOM 313 N THR A 25 2.285 -9.931 -0.196 1.00 0.00 N ATOM 314 CA THR A 25 2.541 -10.947 0.817 1.00 0.00 C ATOM 315 C THR A 25 4.031 -11.245 0.933 1.00 0.00 C ATOM 316 O THR A 25 4.500 -11.720 1.968 1.00 0.00 O ATOM 317 CB THR A 25 1.791 -12.255 0.502 1.00 0.00 C ATOM 318 OG1 THR A 25 1.935 -13.177 1.589 1.00 0.00 O ATOM 319 CG2 THR A 25 2.318 -12.886 -0.778 1.00 0.00 C ATOM 0 H THR A 25 1.481 -10.124 -0.794 1.00 0.00 H new ATOM 0 HA THR A 25 2.179 -10.547 1.764 1.00 0.00 H new ATOM 0 HB THR A 25 0.736 -12.019 0.364 1.00 0.00 H new ATOM 0 HG1 THR A 25 1.454 -14.005 1.381 1.00 0.00 H new ATOM 0 HG21 THR A 25 1.773 -13.808 -0.980 1.00 0.00 H new ATOM 0 HG22 THR A 25 2.180 -12.194 -1.609 1.00 0.00 H new ATOM 0 HG23 THR A 25 3.379 -13.109 -0.664 1.00 0.00 H new ATOM 327 N ARG A 26 4.772 -10.962 -0.134 1.00 0.00 N ATOM 328 CA ARG A 26 6.210 -11.200 -0.151 1.00 0.00 C ATOM 329 C ARG A 26 6.979 -9.883 -0.113 1.00 0.00 C ATOM 330 O ARG A 26 6.598 -8.910 -0.765 1.00 0.00 O ATOM 331 CB ARG A 26 6.602 -11.997 -1.396 1.00 0.00 C ATOM 332 CG ARG A 26 6.187 -11.333 -2.699 1.00 0.00 C ATOM 333 CD ARG A 26 6.786 -12.045 -3.902 1.00 0.00 C ATOM 334 NE ARG A 26 6.076 -11.725 -5.137 1.00 0.00 N ATOM 335 CZ ARG A 26 6.070 -12.512 -6.207 1.00 0.00 C ATOM 336 NH1 ARG A 26 6.733 -13.661 -6.193 1.00 0.00 N ATOM 337 NH2 ARG A 26 5.400 -12.152 -7.294 1.00 0.00 N ATOM 0 H ARG A 26 4.400 -10.568 -0.998 1.00 0.00 H new ATOM 0 HA ARG A 26 6.468 -11.777 0.737 1.00 0.00 H new ATOM 0 HB2 ARG A 26 7.682 -12.141 -1.399 1.00 0.00 H new ATOM 0 HB3 ARG A 26 6.148 -12.987 -1.342 1.00 0.00 H new ATOM 0 HG2 ARG A 26 5.100 -11.333 -2.779 1.00 0.00 H new ATOM 0 HG3 ARG A 26 6.506 -10.291 -2.695 1.00 0.00 H new ATOM 0 HD2 ARG A 26 7.835 -11.765 -4.004 1.00 0.00 H new ATOM 0 HD3 ARG A 26 6.758 -13.122 -3.737 1.00 0.00 H new ATOM 0 HE ARG A 26 5.556 -10.849 -5.181 1.00 0.00 H new ATOM 0 HH11 ARG A 26 7.249 -13.942 -5.359 1.00 0.00 H new ATOM 0 HH12 ARG A 26 6.727 -14.263 -7.016 1.00 0.00 H new ATOM 0 HH21 ARG A 26 4.888 -11.270 -7.309 1.00 0.00 H new ATOM 0 HH22 ARG A 26 5.396 -12.758 -8.115 1.00 0.00 H new ATOM 351 N VAL A 27 8.064 -9.858 0.654 1.00 0.00 N ATOM 352 CA VAL A 27 8.888 -8.662 0.776 1.00 0.00 C ATOM 353 C VAL A 27 9.614 -8.359 -0.529 1.00 0.00 C ATOM 354 O VAL A 27 9.986 -9.258 -1.284 1.00 0.00 O ATOM 355 CB VAL A 27 9.924 -8.806 1.906 1.00 0.00 C ATOM 356 CG1 VAL A 27 9.242 -9.190 3.211 1.00 0.00 C ATOM 357 CG2 VAL A 27 10.984 -9.830 1.528 1.00 0.00 C ATOM 0 H VAL A 27 8.393 -10.654 1.201 1.00 0.00 H new ATOM 0 HA VAL A 27 8.215 -7.838 1.014 1.00 0.00 H new ATOM 0 HB VAL A 27 10.415 -7.844 2.050 1.00 0.00 H new ATOM 0 HG11 VAL A 27 9.990 -9.287 3.998 1.00 0.00 H new ATOM 0 HG12 VAL A 27 8.523 -8.418 3.487 1.00 0.00 H new ATOM 0 HG13 VAL A 27 8.723 -10.140 3.084 1.00 0.00 H new ATOM 0 HG21 VAL A 27 11.708 -9.920 2.338 1.00 0.00 H new ATOM 0 HG22 VAL A 27 10.511 -10.797 1.356 1.00 0.00 H new ATOM 0 HG23 VAL A 27 11.493 -9.508 0.620 1.00 0.00 H new ATOM 367 N PRO A 28 9.824 -7.063 -0.803 1.00 0.00 N ATOM 368 CA PRO A 28 10.509 -6.611 -2.018 1.00 0.00 C ATOM 369 C PRO A 28 11.995 -6.949 -2.005 1.00 0.00 C ATOM 370 O PRO A 28 12.798 -6.232 -1.408 1.00 0.00 O ATOM 371 CB PRO A 28 10.305 -5.094 -1.997 1.00 0.00 C ATOM 372 CG PRO A 28 10.111 -4.758 -0.559 1.00 0.00 C ATOM 373 CD PRO A 28 9.408 -5.938 0.052 1.00 0.00 C ATOM 0 HA PRO A 28 10.116 -7.095 -2.912 1.00 0.00 H new ATOM 0 HB2 PRO A 28 11.167 -4.573 -2.412 1.00 0.00 H new ATOM 0 HB3 PRO A 28 9.439 -4.803 -2.592 1.00 0.00 H new ATOM 0 HG2 PRO A 28 11.067 -4.577 -0.068 1.00 0.00 H new ATOM 0 HG3 PRO A 28 9.518 -3.850 -0.447 1.00 0.00 H new ATOM 0 HD2 PRO A 28 9.706 -6.090 1.089 1.00 0.00 H new ATOM 0 HD3 PRO A 28 8.326 -5.808 0.047 1.00 0.00 H new ATOM 381 N GLU A 29 12.355 -8.045 -2.666 1.00 0.00 N ATOM 382 CA GLU A 29 13.746 -8.476 -2.729 1.00 0.00 C ATOM 383 C GLU A 29 14.658 -7.317 -3.119 1.00 0.00 C ATOM 384 O GLU A 29 14.194 -6.275 -3.582 1.00 0.00 O ATOM 385 CB GLU A 29 13.903 -9.622 -3.731 1.00 0.00 C ATOM 386 CG GLU A 29 13.305 -10.935 -3.253 1.00 0.00 C ATOM 387 CD GLU A 29 14.247 -11.712 -2.355 1.00 0.00 C ATOM 388 OE1 GLU A 29 14.564 -11.214 -1.254 1.00 0.00 O ATOM 389 OE2 GLU A 29 14.666 -12.819 -2.752 1.00 0.00 O ATOM 0 H GLU A 29 11.703 -8.650 -3.165 1.00 0.00 H new ATOM 0 HA GLU A 29 14.036 -8.826 -1.738 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.431 -9.338 -4.671 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.963 -9.769 -3.938 1.00 0.00 H new ATOM 0 HG2 GLU A 29 12.379 -10.733 -2.714 1.00 0.00 H new ATOM 0 HG3 GLU A 29 13.045 -11.547 -4.117 1.00 0.00 H new ATOM 396 N VAL A 30 15.960 -7.506 -2.926 1.00 0.00 N ATOM 397 CA VAL A 30 16.939 -6.477 -3.257 1.00 0.00 C ATOM 398 C VAL A 30 16.566 -5.759 -4.549 1.00 0.00 C ATOM 399 O VAL A 30 16.163 -6.374 -5.537 1.00 0.00 O ATOM 400 CB VAL A 30 18.352 -7.073 -3.404 1.00 0.00 C ATOM 401 CG1 VAL A 30 18.339 -8.247 -4.370 1.00 0.00 C ATOM 402 CG2 VAL A 30 19.335 -6.006 -3.862 1.00 0.00 C ATOM 0 H VAL A 30 16.361 -8.362 -2.542 1.00 0.00 H new ATOM 0 HA VAL A 30 16.938 -5.763 -2.434 1.00 0.00 H new ATOM 0 HB VAL A 30 18.676 -7.439 -2.430 1.00 0.00 H new ATOM 0 HG11 VAL A 30 19.346 -8.655 -4.461 1.00 0.00 H new ATOM 0 HG12 VAL A 30 17.667 -9.019 -3.995 1.00 0.00 H new ATOM 0 HG13 VAL A 30 17.995 -7.910 -5.348 1.00 0.00 H new ATOM 0 HG21 VAL A 30 20.328 -6.444 -3.961 1.00 0.00 H new ATOM 0 HG22 VAL A 30 19.017 -5.608 -4.825 1.00 0.00 H new ATOM 0 HG23 VAL A 30 19.365 -5.200 -3.128 1.00 0.00 H new ATOM 412 N PRO A 31 16.702 -4.424 -4.545 1.00 0.00 N ATOM 413 CA PRO A 31 16.386 -3.593 -5.710 1.00 0.00 C ATOM 414 C PRO A 31 17.379 -3.789 -6.850 1.00 0.00 C ATOM 415 O PRO A 31 18.464 -4.336 -6.653 1.00 0.00 O ATOM 416 CB PRO A 31 16.475 -2.166 -5.162 1.00 0.00 C ATOM 417 CG PRO A 31 17.404 -2.264 -4.001 1.00 0.00 C ATOM 418 CD PRO A 31 17.177 -3.625 -3.403 1.00 0.00 C ATOM 0 HA PRO A 31 15.414 -3.841 -6.136 1.00 0.00 H new ATOM 0 HB2 PRO A 31 16.854 -1.475 -5.915 1.00 0.00 H new ATOM 0 HB3 PRO A 31 15.496 -1.798 -4.856 1.00 0.00 H new ATOM 0 HG2 PRO A 31 18.440 -2.145 -4.319 1.00 0.00 H new ATOM 0 HG3 PRO A 31 17.202 -1.479 -3.272 1.00 0.00 H new ATOM 0 HD2 PRO A 31 18.093 -4.035 -2.979 1.00 0.00 H new ATOM 0 HD3 PRO A 31 16.440 -3.594 -2.600 1.00 0.00 H new ATOM 426 N SER A 32 17.001 -3.339 -8.042 1.00 0.00 N ATOM 427 CA SER A 32 17.858 -3.469 -9.215 1.00 0.00 C ATOM 428 C SER A 32 19.295 -3.078 -8.884 1.00 0.00 C ATOM 429 O SER A 32 20.238 -3.795 -9.217 1.00 0.00 O ATOM 430 CB SER A 32 17.331 -2.598 -10.357 1.00 0.00 C ATOM 431 OG SER A 32 17.898 -1.301 -10.313 1.00 0.00 O ATOM 0 H SER A 32 16.107 -2.881 -8.221 1.00 0.00 H new ATOM 0 HA SER A 32 17.847 -4.513 -9.529 1.00 0.00 H new ATOM 0 HB2 SER A 32 17.563 -3.067 -11.313 1.00 0.00 H new ATOM 0 HB3 SER A 32 16.245 -2.526 -10.292 1.00 0.00 H new ATOM 0 HG SER A 32 17.293 -0.695 -9.837 1.00 0.00 H new ATOM 437 N SER A 33 19.453 -1.934 -8.225 1.00 0.00 N ATOM 438 CA SER A 33 20.775 -1.444 -7.851 1.00 0.00 C ATOM 439 C SER A 33 20.666 -0.177 -7.008 1.00 0.00 C ATOM 440 O SER A 33 19.566 0.274 -6.684 1.00 0.00 O ATOM 441 CB SER A 33 21.612 -1.168 -9.101 1.00 0.00 C ATOM 442 OG SER A 33 21.117 -0.045 -9.809 1.00 0.00 O ATOM 0 H SER A 33 18.683 -1.330 -7.939 1.00 0.00 H new ATOM 0 HA SER A 33 21.266 -2.214 -7.256 1.00 0.00 H new ATOM 0 HB2 SER A 33 22.650 -0.994 -8.816 1.00 0.00 H new ATOM 0 HB3 SER A 33 21.602 -2.044 -9.750 1.00 0.00 H new ATOM 0 HG SER A 33 21.670 0.111 -10.603 1.00 0.00 H new ATOM 448 N LEU A 34 21.813 0.393 -6.657 1.00 0.00 N ATOM 449 CA LEU A 34 21.849 1.609 -5.851 1.00 0.00 C ATOM 450 C LEU A 34 23.093 2.433 -6.165 1.00 0.00 C ATOM 451 O LEU A 34 24.215 2.019 -5.873 1.00 0.00 O ATOM 452 CB LEU A 34 21.816 1.259 -4.362 1.00 0.00 C ATOM 453 CG LEU A 34 22.465 2.274 -3.421 1.00 0.00 C ATOM 454 CD1 LEU A 34 21.546 3.466 -3.205 1.00 0.00 C ATOM 455 CD2 LEU A 34 22.815 1.620 -2.092 1.00 0.00 C ATOM 0 H LEU A 34 22.731 0.033 -6.918 1.00 0.00 H new ATOM 0 HA LEU A 34 20.970 2.205 -6.097 1.00 0.00 H new ATOM 0 HB2 LEU A 34 20.776 1.129 -4.063 1.00 0.00 H new ATOM 0 HB3 LEU A 34 22.310 0.297 -4.224 1.00 0.00 H new ATOM 0 HG LEU A 34 23.386 2.631 -3.882 1.00 0.00 H new ATOM 0 HD11 LEU A 34 22.025 4.178 -2.533 1.00 0.00 H new ATOM 0 HD12 LEU A 34 21.346 3.949 -4.161 1.00 0.00 H new ATOM 0 HD13 LEU A 34 20.608 3.127 -2.766 1.00 0.00 H new ATOM 0 HD21 LEU A 34 23.276 2.357 -1.434 1.00 0.00 H new ATOM 0 HD22 LEU A 34 21.908 1.235 -1.626 1.00 0.00 H new ATOM 0 HD23 LEU A 34 23.512 0.799 -2.263 1.00 0.00 H new ATOM 467 N HIS A 35 22.886 3.605 -6.759 1.00 0.00 N ATOM 468 CA HIS A 35 23.992 4.490 -7.109 1.00 0.00 C ATOM 469 C HIS A 35 24.172 5.578 -6.055 1.00 0.00 C ATOM 470 O HIS A 35 23.202 6.045 -5.458 1.00 0.00 O ATOM 471 CB HIS A 35 23.749 5.125 -8.478 1.00 0.00 C ATOM 472 CG HIS A 35 24.748 6.184 -8.833 1.00 0.00 C ATOM 473 ND1 HIS A 35 24.505 7.532 -8.671 1.00 0.00 N ATOM 474 CD2 HIS A 35 25.998 6.087 -9.341 1.00 0.00 C ATOM 475 CE1 HIS A 35 25.562 8.218 -9.067 1.00 0.00 C ATOM 476 NE2 HIS A 35 26.483 7.365 -9.477 1.00 0.00 N ATOM 0 H HIS A 35 21.964 3.963 -7.008 1.00 0.00 H new ATOM 0 HA HIS A 35 24.904 3.894 -7.149 1.00 0.00 H new ATOM 0 HB2 HIS A 35 23.771 4.346 -9.240 1.00 0.00 H new ATOM 0 HB3 HIS A 35 22.749 5.559 -8.496 1.00 0.00 H new ATOM 0 HD2 HIS A 35 26.518 5.175 -9.593 1.00 0.00 H new ATOM 0 HE1 HIS A 35 25.657 9.294 -9.057 1.00 0.00 H new ATOM 0 HE2 HIS A 35 27.404 7.614 -9.836 1.00 0.00 H new ATOM 485 N VAL A 36 25.420 5.976 -5.830 1.00 0.00 N ATOM 486 CA VAL A 36 25.727 7.009 -4.848 1.00 0.00 C ATOM 487 C VAL A 36 26.761 7.991 -5.389 1.00 0.00 C ATOM 488 O VAL A 36 27.753 7.591 -5.997 1.00 0.00 O ATOM 489 CB VAL A 36 26.254 6.397 -3.536 1.00 0.00 C ATOM 490 CG1 VAL A 36 25.108 5.825 -2.716 1.00 0.00 C ATOM 491 CG2 VAL A 36 27.297 5.329 -3.828 1.00 0.00 C ATOM 0 H VAL A 36 26.235 5.599 -6.314 1.00 0.00 H new ATOM 0 HA VAL A 36 24.797 7.540 -4.645 1.00 0.00 H new ATOM 0 HB VAL A 36 26.729 7.186 -2.952 1.00 0.00 H new ATOM 0 HG11 VAL A 36 25.499 5.397 -1.793 1.00 0.00 H new ATOM 0 HG12 VAL A 36 24.400 6.619 -2.477 1.00 0.00 H new ATOM 0 HG13 VAL A 36 24.602 5.049 -3.290 1.00 0.00 H new ATOM 0 HG21 VAL A 36 27.658 4.907 -2.890 1.00 0.00 H new ATOM 0 HG22 VAL A 36 26.850 4.540 -4.432 1.00 0.00 H new ATOM 0 HG23 VAL A 36 28.131 5.774 -4.371 1.00 0.00 H new ATOM 501 N ARG A 37 26.521 9.278 -5.162 1.00 0.00 N ATOM 502 CA ARG A 37 27.430 10.319 -5.627 1.00 0.00 C ATOM 503 C ARG A 37 28.011 11.098 -4.451 1.00 0.00 C ATOM 504 O ARG A 37 27.316 11.854 -3.771 1.00 0.00 O ATOM 505 CB ARG A 37 26.704 11.273 -6.576 1.00 0.00 C ATOM 506 CG ARG A 37 27.609 11.887 -7.632 1.00 0.00 C ATOM 507 CD ARG A 37 28.255 13.171 -7.134 1.00 0.00 C ATOM 508 NE ARG A 37 28.906 13.910 -8.212 1.00 0.00 N ATOM 509 CZ ARG A 37 30.100 13.595 -8.702 1.00 0.00 C ATOM 510 NH1 ARG A 37 30.769 12.560 -8.212 1.00 0.00 N ATOM 511 NH2 ARG A 37 30.627 14.316 -9.683 1.00 0.00 N ATOM 0 H ARG A 37 25.705 9.625 -4.659 1.00 0.00 H new ATOM 0 HA ARG A 37 28.249 9.839 -6.163 1.00 0.00 H new ATOM 0 HB2 ARG A 37 25.896 10.735 -7.071 1.00 0.00 H new ATOM 0 HB3 ARG A 37 26.245 12.072 -5.994 1.00 0.00 H new ATOM 0 HG2 ARG A 37 28.384 11.172 -7.909 1.00 0.00 H new ATOM 0 HG3 ARG A 37 27.031 12.095 -8.532 1.00 0.00 H new ATOM 0 HD2 ARG A 37 27.497 13.801 -6.669 1.00 0.00 H new ATOM 0 HD3 ARG A 37 28.988 12.933 -6.364 1.00 0.00 H new ATOM 0 HE ARG A 37 28.417 14.712 -8.611 1.00 0.00 H new ATOM 0 HH11 ARG A 37 30.367 12.004 -7.457 1.00 0.00 H new ATOM 0 HH12 ARG A 37 31.686 12.320 -8.590 1.00 0.00 H new ATOM 0 HH21 ARG A 37 30.115 15.113 -10.062 1.00 0.00 H new ATOM 0 HH22 ARG A 37 31.544 14.073 -10.059 1.00 0.00 H new ATOM 525 N PRO A 38 29.316 10.911 -4.203 1.00 0.00 N ATOM 526 CA PRO A 38 30.019 11.588 -3.109 1.00 0.00 C ATOM 527 C PRO A 38 30.181 13.083 -3.362 1.00 0.00 C ATOM 528 O PRO A 38 30.771 13.493 -4.362 1.00 0.00 O ATOM 529 CB PRO A 38 31.386 10.898 -3.086 1.00 0.00 C ATOM 530 CG PRO A 38 31.576 10.387 -4.472 1.00 0.00 C ATOM 531 CD PRO A 38 30.205 10.024 -4.972 1.00 0.00 C ATOM 0 HA PRO A 38 29.474 11.517 -2.168 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.177 11.595 -2.809 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.408 10.087 -2.359 1.00 0.00 H new ATOM 0 HG2 PRO A 38 32.035 11.144 -5.107 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.237 9.520 -4.481 1.00 0.00 H new ATOM 0 HD2 PRO A 38 30.111 10.192 -6.045 1.00 0.00 H new ATOM 0 HD3 PRO A 38 29.977 8.973 -4.793 1.00 0.00 H new ATOM 539 N LEU A 39 29.656 13.892 -2.449 1.00 0.00 N ATOM 540 CA LEU A 39 29.743 15.343 -2.573 1.00 0.00 C ATOM 541 C LEU A 39 30.602 15.934 -1.459 1.00 0.00 C ATOM 542 O LEU A 39 30.738 15.345 -0.387 1.00 0.00 O ATOM 543 CB LEU A 39 28.345 15.963 -2.536 1.00 0.00 C ATOM 544 CG LEU A 39 27.646 16.122 -3.887 1.00 0.00 C ATOM 545 CD1 LEU A 39 26.825 14.884 -4.213 1.00 0.00 C ATOM 546 CD2 LEU A 39 26.766 17.364 -3.889 1.00 0.00 C ATOM 0 H LEU A 39 29.166 13.568 -1.615 1.00 0.00 H new ATOM 0 HA LEU A 39 30.211 15.573 -3.530 1.00 0.00 H new ATOM 0 HB2 LEU A 39 27.714 15.350 -1.893 1.00 0.00 H new ATOM 0 HB3 LEU A 39 28.417 16.945 -2.069 1.00 0.00 H new ATOM 0 HG LEU A 39 28.408 16.240 -4.657 1.00 0.00 H new ATOM 0 HD11 LEU A 39 26.335 15.016 -5.178 1.00 0.00 H new ATOM 0 HD12 LEU A 39 27.480 14.014 -4.255 1.00 0.00 H new ATOM 0 HD13 LEU A 39 26.071 14.734 -3.441 1.00 0.00 H new ATOM 0 HD21 LEU A 39 26.276 17.461 -4.858 1.00 0.00 H new ATOM 0 HD22 LEU A 39 26.011 17.276 -3.108 1.00 0.00 H new ATOM 0 HD23 LEU A 39 27.380 18.245 -3.702 1.00 0.00 H new ATOM 558 N VAL A 40 31.180 17.102 -1.721 1.00 0.00 N ATOM 559 CA VAL A 40 32.023 17.775 -0.740 1.00 0.00 C ATOM 560 C VAL A 40 31.620 17.399 0.681 1.00 0.00 C ATOM 561 O VAL A 40 32.355 16.703 1.384 1.00 0.00 O ATOM 562 CB VAL A 40 31.952 19.306 -0.895 1.00 0.00 C ATOM 563 CG1 VAL A 40 32.764 19.990 0.194 1.00 0.00 C ATOM 564 CG2 VAL A 40 32.436 19.725 -2.275 1.00 0.00 C ATOM 0 H VAL A 40 31.080 17.602 -2.604 1.00 0.00 H new ATOM 0 HA VAL A 40 33.046 17.446 -0.923 1.00 0.00 H new ATOM 0 HB VAL A 40 30.913 19.617 -0.790 1.00 0.00 H new ATOM 0 HG11 VAL A 40 32.703 21.071 0.069 1.00 0.00 H new ATOM 0 HG12 VAL A 40 32.367 19.715 1.171 1.00 0.00 H new ATOM 0 HG13 VAL A 40 33.805 19.675 0.123 1.00 0.00 H new ATOM 0 HG21 VAL A 40 32.379 20.810 -2.367 1.00 0.00 H new ATOM 0 HG22 VAL A 40 33.468 19.403 -2.412 1.00 0.00 H new ATOM 0 HG23 VAL A 40 31.808 19.263 -3.037 1.00 0.00 H new ATOM 574 N THR A 41 30.447 17.863 1.100 1.00 0.00 N ATOM 575 CA THR A 41 29.945 17.576 2.438 1.00 0.00 C ATOM 576 C THR A 41 28.627 16.814 2.379 1.00 0.00 C ATOM 577 O THR A 41 28.041 16.487 3.412 1.00 0.00 O ATOM 578 CB THR A 41 29.743 18.869 3.251 1.00 0.00 C ATOM 579 OG1 THR A 41 28.911 19.780 2.523 1.00 0.00 O ATOM 580 CG2 THR A 41 31.078 19.529 3.559 1.00 0.00 C ATOM 0 H THR A 41 29.827 18.440 0.532 1.00 0.00 H new ATOM 0 HA THR A 41 30.695 16.959 2.932 1.00 0.00 H new ATOM 0 HB THR A 41 29.259 18.608 4.192 1.00 0.00 H new ATOM 0 HG1 THR A 41 28.786 20.599 3.047 1.00 0.00 H new ATOM 0 HG21 THR A 41 30.910 20.440 4.134 1.00 0.00 H new ATOM 0 HG22 THR A 41 31.698 18.844 4.138 1.00 0.00 H new ATOM 0 HG23 THR A 41 31.585 19.777 2.627 1.00 0.00 H new ATOM 588 N SER A 42 28.164 16.533 1.165 1.00 0.00 N ATOM 589 CA SER A 42 26.912 15.811 0.972 1.00 0.00 C ATOM 590 C SER A 42 27.145 14.516 0.201 1.00 0.00 C ATOM 591 O SER A 42 28.279 14.178 -0.138 1.00 0.00 O ATOM 592 CB SER A 42 25.903 16.688 0.227 1.00 0.00 C ATOM 593 OG SER A 42 26.527 17.399 -0.828 1.00 0.00 O ATOM 0 H SER A 42 28.637 16.795 0.300 1.00 0.00 H new ATOM 0 HA SER A 42 26.510 15.561 1.954 1.00 0.00 H new ATOM 0 HB2 SER A 42 25.102 16.067 -0.173 1.00 0.00 H new ATOM 0 HB3 SER A 42 25.444 17.391 0.922 1.00 0.00 H new ATOM 0 HG SER A 42 25.971 18.166 -1.079 1.00 0.00 H new ATOM 599 N ILE A 43 26.063 13.795 -0.072 1.00 0.00 N ATOM 600 CA ILE A 43 26.148 12.537 -0.804 1.00 0.00 C ATOM 601 C ILE A 43 24.800 12.162 -1.411 1.00 0.00 C ATOM 602 O ILE A 43 23.892 11.720 -0.706 1.00 0.00 O ATOM 603 CB ILE A 43 26.628 11.389 0.103 1.00 0.00 C ATOM 604 CG1 ILE A 43 28.006 11.712 0.684 1.00 0.00 C ATOM 605 CG2 ILE A 43 26.667 10.082 -0.673 1.00 0.00 C ATOM 606 CD1 ILE A 43 28.599 10.581 1.497 1.00 0.00 C ATOM 0 H ILE A 43 25.117 14.060 0.203 1.00 0.00 H new ATOM 0 HA ILE A 43 26.875 12.685 -1.603 1.00 0.00 H new ATOM 0 HB ILE A 43 25.924 11.278 0.928 1.00 0.00 H new ATOM 0 HG12 ILE A 43 28.686 11.959 -0.131 1.00 0.00 H new ATOM 0 HG13 ILE A 43 27.928 12.599 1.313 1.00 0.00 H new ATOM 0 HG21 ILE A 43 27.008 9.280 -0.018 1.00 0.00 H new ATOM 0 HG22 ILE A 43 25.669 9.848 -1.043 1.00 0.00 H new ATOM 0 HG23 ILE A 43 27.352 10.179 -1.515 1.00 0.00 H new ATOM 0 HD11 ILE A 43 29.576 10.880 1.878 1.00 0.00 H new ATOM 0 HD12 ILE A 43 27.939 10.349 2.333 1.00 0.00 H new ATOM 0 HD13 ILE A 43 28.710 9.699 0.866 1.00 0.00 H new ATOM 618 N VAL A 44 24.678 12.338 -2.722 1.00 0.00 N ATOM 619 CA VAL A 44 23.442 12.015 -3.425 1.00 0.00 C ATOM 620 C VAL A 44 23.242 10.506 -3.520 1.00 0.00 C ATOM 621 O VAL A 44 24.006 9.809 -4.187 1.00 0.00 O ATOM 622 CB VAL A 44 23.430 12.613 -4.844 1.00 0.00 C ATOM 623 CG1 VAL A 44 22.192 12.162 -5.604 1.00 0.00 C ATOM 624 CG2 VAL A 44 23.504 14.131 -4.782 1.00 0.00 C ATOM 0 H VAL A 44 25.420 12.703 -3.319 1.00 0.00 H new ATOM 0 HA VAL A 44 22.627 12.452 -2.848 1.00 0.00 H new ATOM 0 HB VAL A 44 24.307 12.250 -5.380 1.00 0.00 H new ATOM 0 HG11 VAL A 44 22.201 12.595 -6.604 1.00 0.00 H new ATOM 0 HG12 VAL A 44 22.187 11.075 -5.679 1.00 0.00 H new ATOM 0 HG13 VAL A 44 21.299 12.493 -5.074 1.00 0.00 H new ATOM 0 HG21 VAL A 44 23.495 14.537 -5.793 1.00 0.00 H new ATOM 0 HG22 VAL A 44 22.647 14.515 -4.229 1.00 0.00 H new ATOM 0 HG23 VAL A 44 24.424 14.430 -4.279 1.00 0.00 H new ATOM 634 N VAL A 45 22.209 10.008 -2.848 1.00 0.00 N ATOM 635 CA VAL A 45 21.907 8.582 -2.858 1.00 0.00 C ATOM 636 C VAL A 45 20.669 8.288 -3.697 1.00 0.00 C ATOM 637 O VAL A 45 19.540 8.481 -3.246 1.00 0.00 O ATOM 638 CB VAL A 45 21.685 8.046 -1.431 1.00 0.00 C ATOM 639 CG1 VAL A 45 21.291 6.577 -1.467 1.00 0.00 C ATOM 640 CG2 VAL A 45 22.932 8.251 -0.585 1.00 0.00 C ATOM 0 H VAL A 45 21.567 10.571 -2.290 1.00 0.00 H new ATOM 0 HA VAL A 45 22.768 8.079 -3.298 1.00 0.00 H new ATOM 0 HB VAL A 45 20.868 8.605 -0.975 1.00 0.00 H new ATOM 0 HG11 VAL A 45 21.139 6.216 -0.450 1.00 0.00 H new ATOM 0 HG12 VAL A 45 20.368 6.462 -2.035 1.00 0.00 H new ATOM 0 HG13 VAL A 45 22.084 5.999 -1.942 1.00 0.00 H new ATOM 0 HG21 VAL A 45 22.757 7.867 0.420 1.00 0.00 H new ATOM 0 HG22 VAL A 45 23.769 7.719 -1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 45 23.164 9.315 -0.531 1.00 0.00 H new ATOM 650 N SER A 46 20.889 7.820 -4.922 1.00 0.00 N ATOM 651 CA SER A 46 19.791 7.502 -5.827 1.00 0.00 C ATOM 652 C SER A 46 19.623 5.992 -5.969 1.00 0.00 C ATOM 653 O SER A 46 20.583 5.274 -6.251 1.00 0.00 O ATOM 654 CB SER A 46 20.036 8.130 -7.200 1.00 0.00 C ATOM 655 OG SER A 46 19.271 7.482 -8.202 1.00 0.00 O ATOM 0 H SER A 46 21.817 7.653 -5.310 1.00 0.00 H new ATOM 0 HA SER A 46 18.874 7.914 -5.405 1.00 0.00 H new ATOM 0 HB2 SER A 46 19.779 9.189 -7.170 1.00 0.00 H new ATOM 0 HB3 SER A 46 21.095 8.066 -7.449 1.00 0.00 H new ATOM 0 HG SER A 46 19.445 7.903 -9.070 1.00 0.00 H new ATOM 661 N TRP A 47 18.399 5.518 -5.771 1.00 0.00 N ATOM 662 CA TRP A 47 18.104 4.093 -5.876 1.00 0.00 C ATOM 663 C TRP A 47 16.957 3.845 -6.850 1.00 0.00 C ATOM 664 O TRP A 47 16.383 4.784 -7.401 1.00 0.00 O ATOM 665 CB TRP A 47 17.756 3.520 -4.502 1.00 0.00 C ATOM 666 CG TRP A 47 16.527 4.129 -3.899 1.00 0.00 C ATOM 667 CD1 TRP A 47 15.240 3.693 -4.045 1.00 0.00 C ATOM 668 CD2 TRP A 47 16.467 5.284 -3.055 1.00 0.00 C ATOM 669 NE1 TRP A 47 14.385 4.509 -3.344 1.00 0.00 N ATOM 670 CE2 TRP A 47 15.113 5.492 -2.727 1.00 0.00 C ATOM 671 CE3 TRP A 47 17.426 6.163 -2.544 1.00 0.00 C ATOM 672 CZ2 TRP A 47 14.698 6.541 -1.912 1.00 0.00 C ATOM 673 CZ3 TRP A 47 17.012 7.204 -1.736 1.00 0.00 C ATOM 674 CH2 TRP A 47 15.658 7.386 -1.426 1.00 0.00 C ATOM 0 H TRP A 47 17.594 6.099 -5.537 1.00 0.00 H new ATOM 0 HA TRP A 47 18.994 3.590 -6.256 1.00 0.00 H new ATOM 0 HB2 TRP A 47 17.613 2.443 -4.591 1.00 0.00 H new ATOM 0 HB3 TRP A 47 18.598 3.675 -3.828 1.00 0.00 H new ATOM 0 HD1 TRP A 47 14.939 2.834 -4.626 1.00 0.00 H new ATOM 0 HE1 TRP A 47 13.372 4.400 -3.292 1.00 0.00 H new ATOM 0 HE3 TRP A 47 18.472 6.031 -2.777 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 13.655 6.683 -1.672 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 17.745 7.889 -1.336 1.00 0.00 H new ATOM 0 HH2 TRP A 47 15.366 8.209 -0.791 1.00 0.00 H new ATOM 685 N THR A 48 16.627 2.574 -7.057 1.00 0.00 N ATOM 686 CA THR A 48 15.549 2.203 -7.965 1.00 0.00 C ATOM 687 C THR A 48 14.757 1.019 -7.422 1.00 0.00 C ATOM 688 O THR A 48 15.267 0.196 -6.662 1.00 0.00 O ATOM 689 CB THR A 48 16.089 1.847 -9.363 1.00 0.00 C ATOM 690 OG1 THR A 48 17.106 0.845 -9.255 1.00 0.00 O ATOM 691 CG2 THR A 48 16.654 3.078 -10.054 1.00 0.00 C ATOM 0 H THR A 48 17.091 1.784 -6.608 1.00 0.00 H new ATOM 0 HA THR A 48 14.893 3.069 -8.047 1.00 0.00 H new ATOM 0 HB THR A 48 15.263 1.462 -9.960 1.00 0.00 H new ATOM 0 HG1 THR A 48 17.792 1.000 -9.937 1.00 0.00 H new ATOM 0 HG21 THR A 48 17.029 2.802 -11.039 1.00 0.00 H new ATOM 0 HG22 THR A 48 15.870 3.827 -10.161 1.00 0.00 H new ATOM 0 HG23 THR A 48 17.469 3.488 -9.457 1.00 0.00 H new ATOM 699 N PRO A 49 13.479 0.928 -7.820 1.00 0.00 N ATOM 700 CA PRO A 49 12.590 -0.153 -7.386 1.00 0.00 C ATOM 701 C PRO A 49 12.976 -1.499 -7.990 1.00 0.00 C ATOM 702 O PRO A 49 13.676 -1.576 -8.999 1.00 0.00 O ATOM 703 CB PRO A 49 11.217 0.289 -7.900 1.00 0.00 C ATOM 704 CG PRO A 49 11.514 1.177 -9.058 1.00 0.00 C ATOM 705 CD PRO A 49 12.805 1.874 -8.725 1.00 0.00 C ATOM 0 HA PRO A 49 12.629 -0.304 -6.307 1.00 0.00 H new ATOM 0 HB2 PRO A 49 10.613 -0.567 -8.202 1.00 0.00 H new ATOM 0 HB3 PRO A 49 10.657 0.818 -7.129 1.00 0.00 H new ATOM 0 HG2 PRO A 49 11.608 0.600 -9.978 1.00 0.00 H new ATOM 0 HG3 PRO A 49 10.711 1.897 -9.214 1.00 0.00 H new ATOM 0 HD2 PRO A 49 13.399 2.068 -9.618 1.00 0.00 H new ATOM 0 HD3 PRO A 49 12.630 2.836 -8.243 1.00 0.00 H new ATOM 713 N PRO A 50 12.509 -2.587 -7.359 1.00 0.00 N ATOM 714 CA PRO A 50 12.793 -3.951 -7.818 1.00 0.00 C ATOM 715 C PRO A 50 12.081 -4.282 -9.125 1.00 0.00 C ATOM 716 O PRO A 50 10.890 -4.014 -9.278 1.00 0.00 O ATOM 717 CB PRO A 50 12.259 -4.825 -6.681 1.00 0.00 C ATOM 718 CG PRO A 50 11.208 -3.997 -6.027 1.00 0.00 C ATOM 719 CD PRO A 50 11.668 -2.571 -6.151 1.00 0.00 C ATOM 0 HA PRO A 50 13.852 -4.100 -8.027 1.00 0.00 H new ATOM 0 HB2 PRO A 50 11.847 -5.760 -7.061 1.00 0.00 H new ATOM 0 HB3 PRO A 50 13.050 -5.087 -5.979 1.00 0.00 H new ATOM 0 HG2 PRO A 50 10.242 -4.139 -6.511 1.00 0.00 H new ATOM 0 HG3 PRO A 50 11.085 -4.278 -4.981 1.00 0.00 H new ATOM 0 HD2 PRO A 50 10.827 -1.885 -6.256 1.00 0.00 H new ATOM 0 HD3 PRO A 50 12.231 -2.253 -5.274 1.00 0.00 H new ATOM 727 N GLU A 51 12.819 -4.867 -10.063 1.00 0.00 N ATOM 728 CA GLU A 51 12.256 -5.235 -11.357 1.00 0.00 C ATOM 729 C GLU A 51 10.834 -5.767 -11.201 1.00 0.00 C ATOM 730 O GLU A 51 9.959 -5.476 -12.015 1.00 0.00 O ATOM 731 CB GLU A 51 13.133 -6.287 -12.039 1.00 0.00 C ATOM 732 CG GLU A 51 14.568 -5.836 -12.255 1.00 0.00 C ATOM 733 CD GLU A 51 15.553 -6.988 -12.224 1.00 0.00 C ATOM 734 OE1 GLU A 51 15.798 -7.588 -13.292 1.00 0.00 O ATOM 735 OE2 GLU A 51 16.079 -7.291 -11.133 1.00 0.00 O ATOM 0 H GLU A 51 13.807 -5.096 -9.951 1.00 0.00 H new ATOM 0 HA GLU A 51 12.225 -4.340 -11.978 1.00 0.00 H new ATOM 0 HB2 GLU A 51 13.133 -7.194 -11.435 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.693 -6.545 -13.002 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.643 -5.324 -13.214 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.837 -5.112 -11.486 1.00 0.00 H new ATOM 742 N ASN A 52 10.613 -6.548 -10.149 1.00 0.00 N ATOM 743 CA ASN A 52 9.298 -7.122 -9.886 1.00 0.00 C ATOM 744 C ASN A 52 8.369 -6.087 -9.258 1.00 0.00 C ATOM 745 O ASN A 52 7.912 -6.255 -8.128 1.00 0.00 O ATOM 746 CB ASN A 52 9.424 -8.337 -8.965 1.00 0.00 C ATOM 747 CG ASN A 52 8.154 -9.166 -8.925 1.00 0.00 C ATOM 748 OD1 ASN A 52 7.151 -8.755 -8.342 1.00 0.00 O ATOM 749 ND2 ASN A 52 8.194 -10.339 -9.545 1.00 0.00 N ATOM 0 H ASN A 52 11.327 -6.798 -9.465 1.00 0.00 H new ATOM 0 HA ASN A 52 8.870 -7.439 -10.837 1.00 0.00 H new ATOM 0 HB2 ASN A 52 10.252 -8.961 -9.302 1.00 0.00 H new ATOM 0 HB3 ASN A 52 9.668 -8.002 -7.957 1.00 0.00 H new ATOM 0 HD21 ASN A 52 7.371 -10.941 -9.551 1.00 0.00 H new ATOM 0 HD22 ASN A 52 9.048 -10.638 -10.015 1.00 0.00 H new ATOM 756 N GLN A 53 8.095 -5.019 -9.999 1.00 0.00 N ATOM 757 CA GLN A 53 7.221 -3.957 -9.514 1.00 0.00 C ATOM 758 C GLN A 53 5.965 -4.537 -8.871 1.00 0.00 C ATOM 759 O GLN A 53 5.384 -3.936 -7.969 1.00 0.00 O ATOM 760 CB GLN A 53 6.835 -3.021 -10.661 1.00 0.00 C ATOM 761 CG GLN A 53 6.643 -1.577 -10.228 1.00 0.00 C ATOM 762 CD GLN A 53 5.267 -1.321 -9.644 1.00 0.00 C ATOM 763 OE1 GLN A 53 4.257 -1.405 -10.344 1.00 0.00 O ATOM 764 NE2 GLN A 53 5.220 -1.005 -8.355 1.00 0.00 N ATOM 0 H GLN A 53 8.465 -4.866 -10.937 1.00 0.00 H new ATOM 0 HA GLN A 53 7.765 -3.390 -8.759 1.00 0.00 H new ATOM 0 HB2 GLN A 53 7.608 -3.062 -11.428 1.00 0.00 H new ATOM 0 HB3 GLN A 53 5.913 -3.380 -11.118 1.00 0.00 H new ATOM 0 HG2 GLN A 53 7.401 -1.320 -9.488 1.00 0.00 H new ATOM 0 HG3 GLN A 53 6.798 -0.921 -11.085 1.00 0.00 H new ATOM 0 HE21 GLN A 53 6.082 -0.947 -7.812 1.00 0.00 H new ATOM 0 HE22 GLN A 53 4.322 -0.821 -7.907 1.00 0.00 H new ATOM 773 N ASN A 54 5.553 -5.709 -9.343 1.00 0.00 N ATOM 774 CA ASN A 54 4.365 -6.371 -8.814 1.00 0.00 C ATOM 775 C ASN A 54 4.371 -6.362 -7.289 1.00 0.00 C ATOM 776 O ASN A 54 3.324 -6.225 -6.655 1.00 0.00 O ATOM 777 CB ASN A 54 4.286 -7.810 -9.327 1.00 0.00 C ATOM 778 CG ASN A 54 3.698 -7.895 -10.722 1.00 0.00 C ATOM 779 OD1 ASN A 54 2.482 -7.995 -10.891 1.00 0.00 O ATOM 780 ND2 ASN A 54 4.560 -7.856 -11.731 1.00 0.00 N ATOM 0 H ASN A 54 6.023 -6.220 -10.090 1.00 0.00 H new ATOM 0 HA ASN A 54 3.489 -5.821 -9.159 1.00 0.00 H new ATOM 0 HB2 ASN A 54 5.284 -8.247 -9.329 1.00 0.00 H new ATOM 0 HB3 ASN A 54 3.679 -8.404 -8.643 1.00 0.00 H new ATOM 0 HD21 ASN A 54 4.223 -7.910 -12.692 1.00 0.00 H new ATOM 0 HD22 ASN A 54 5.559 -7.772 -11.545 1.00 0.00 H new ATOM 787 N ILE A 55 5.556 -6.509 -6.706 1.00 0.00 N ATOM 788 CA ILE A 55 5.698 -6.517 -5.256 1.00 0.00 C ATOM 789 C ILE A 55 5.544 -5.112 -4.681 1.00 0.00 C ATOM 790 O ILE A 55 6.287 -4.199 -5.039 1.00 0.00 O ATOM 791 CB ILE A 55 7.062 -7.088 -4.827 1.00 0.00 C ATOM 792 CG1 ILE A 55 7.191 -8.547 -5.271 1.00 0.00 C ATOM 793 CG2 ILE A 55 7.235 -6.970 -3.320 1.00 0.00 C ATOM 794 CD1 ILE A 55 8.623 -8.996 -5.462 1.00 0.00 C ATOM 0 H ILE A 55 6.432 -6.624 -7.216 1.00 0.00 H new ATOM 0 HA ILE A 55 4.907 -7.156 -4.865 1.00 0.00 H new ATOM 0 HB ILE A 55 7.850 -6.510 -5.310 1.00 0.00 H new ATOM 0 HG12 ILE A 55 6.714 -9.188 -4.529 1.00 0.00 H new ATOM 0 HG13 ILE A 55 6.648 -8.683 -6.206 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.204 -7.378 -3.032 1.00 0.00 H new ATOM 0 HG22 ILE A 55 7.182 -5.921 -3.029 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.443 -7.527 -2.818 1.00 0.00 H new ATOM 0 HD11 ILE A 55 8.638 -10.040 -5.777 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.099 -8.380 -6.225 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.165 -8.892 -4.522 1.00 0.00 H new ATOM 806 N VAL A 56 4.575 -4.948 -3.786 1.00 0.00 N ATOM 807 CA VAL A 56 4.325 -3.656 -3.159 1.00 0.00 C ATOM 808 C VAL A 56 5.552 -3.169 -2.395 1.00 0.00 C ATOM 809 O VAL A 56 6.307 -3.966 -1.839 1.00 0.00 O ATOM 810 CB VAL A 56 3.127 -3.723 -2.193 1.00 0.00 C ATOM 811 CG1 VAL A 56 3.033 -2.449 -1.368 1.00 0.00 C ATOM 812 CG2 VAL A 56 1.837 -3.966 -2.962 1.00 0.00 C ATOM 0 H VAL A 56 3.950 -5.694 -3.479 1.00 0.00 H new ATOM 0 HA VAL A 56 4.097 -2.954 -3.961 1.00 0.00 H new ATOM 0 HB VAL A 56 3.280 -4.558 -1.510 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.181 -2.515 -0.692 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.947 -2.323 -0.788 1.00 0.00 H new ATOM 0 HG13 VAL A 56 2.904 -1.594 -2.032 1.00 0.00 H new ATOM 0 HG21 VAL A 56 1.001 -4.011 -2.265 1.00 0.00 H new ATOM 0 HG22 VAL A 56 1.676 -3.153 -3.670 1.00 0.00 H new ATOM 0 HG23 VAL A 56 1.908 -4.909 -3.504 1.00 0.00 H new ATOM 822 N VAL A 57 5.745 -1.854 -2.373 1.00 0.00 N ATOM 823 CA VAL A 57 6.879 -1.259 -1.676 1.00 0.00 C ATOM 824 C VAL A 57 6.452 -0.034 -0.877 1.00 0.00 C ATOM 825 O VAL A 57 6.082 0.993 -1.446 1.00 0.00 O ATOM 826 CB VAL A 57 7.993 -0.854 -2.661 1.00 0.00 C ATOM 827 CG1 VAL A 57 9.146 -0.195 -1.920 1.00 0.00 C ATOM 828 CG2 VAL A 57 8.475 -2.065 -3.446 1.00 0.00 C ATOM 0 H VAL A 57 5.130 -1.180 -2.830 1.00 0.00 H new ATOM 0 HA VAL A 57 7.265 -2.017 -0.994 1.00 0.00 H new ATOM 0 HB VAL A 57 7.586 -0.131 -3.367 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.923 0.084 -2.631 1.00 0.00 H new ATOM 0 HG12 VAL A 57 8.786 0.697 -1.407 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.556 -0.893 -1.190 1.00 0.00 H new ATOM 0 HG21 VAL A 57 9.261 -1.761 -4.137 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.866 -2.813 -2.757 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.643 -2.489 -4.008 1.00 0.00 H new ATOM 838 N ARG A 58 6.507 -0.148 0.446 1.00 0.00 N ATOM 839 CA ARG A 58 6.126 0.951 1.325 1.00 0.00 C ATOM 840 C ARG A 58 7.232 1.999 1.396 1.00 0.00 C ATOM 841 O ARG A 58 6.966 3.200 1.364 1.00 0.00 O ATOM 842 CB ARG A 58 5.814 0.426 2.728 1.00 0.00 C ATOM 843 CG ARG A 58 4.435 -0.201 2.852 1.00 0.00 C ATOM 844 CD ARG A 58 3.337 0.848 2.765 1.00 0.00 C ATOM 845 NE ARG A 58 2.006 0.256 2.855 1.00 0.00 N ATOM 846 CZ ARG A 58 1.416 -0.056 4.004 1.00 0.00 C ATOM 847 NH1 ARG A 58 2.037 0.169 5.154 1.00 0.00 N ATOM 848 NH2 ARG A 58 0.202 -0.592 4.004 1.00 0.00 N ATOM 0 H ARG A 58 6.812 -0.991 0.933 1.00 0.00 H new ATOM 0 HA ARG A 58 5.232 1.419 0.913 1.00 0.00 H new ATOM 0 HB2 ARG A 58 6.566 -0.313 3.006 1.00 0.00 H new ATOM 0 HB3 ARG A 58 5.896 1.247 3.440 1.00 0.00 H new ATOM 0 HG2 ARG A 58 4.298 -0.940 2.062 1.00 0.00 H new ATOM 0 HG3 ARG A 58 4.359 -0.731 3.801 1.00 0.00 H new ATOM 0 HD2 ARG A 58 3.465 1.575 3.567 1.00 0.00 H new ATOM 0 HD3 ARG A 58 3.429 1.392 1.825 1.00 0.00 H new ATOM 0 HE ARG A 58 1.501 0.072 1.988 1.00 0.00 H new ATOM 0 HH11 ARG A 58 2.969 0.582 5.158 1.00 0.00 H new ATOM 0 HH12 ARG A 58 1.582 -0.071 6.035 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -0.279 -0.765 3.121 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -0.250 -0.831 4.887 1.00 0.00 H new ATOM 862 N GLY A 59 8.474 1.536 1.494 1.00 0.00 N ATOM 863 CA GLY A 59 9.602 2.446 1.569 1.00 0.00 C ATOM 864 C GLY A 59 10.927 1.719 1.692 1.00 0.00 C ATOM 865 O GLY A 59 10.973 0.489 1.664 1.00 0.00 O ATOM 0 H GLY A 59 8.719 0.546 1.523 1.00 0.00 H new ATOM 0 HA2 GLY A 59 9.617 3.075 0.679 1.00 0.00 H new ATOM 0 HA3 GLY A 59 9.474 3.109 2.425 1.00 0.00 H new ATOM 869 N TYR A 60 12.006 2.481 1.828 1.00 0.00 N ATOM 870 CA TYR A 60 13.339 1.902 1.953 1.00 0.00 C ATOM 871 C TYR A 60 14.060 2.453 3.179 1.00 0.00 C ATOM 872 O TYR A 60 13.570 3.366 3.843 1.00 0.00 O ATOM 873 CB TYR A 60 14.160 2.185 0.694 1.00 0.00 C ATOM 874 CG TYR A 60 13.351 2.130 -0.582 1.00 0.00 C ATOM 875 CD1 TYR A 60 12.598 3.221 -0.999 1.00 0.00 C ATOM 876 CD2 TYR A 60 13.340 0.987 -1.372 1.00 0.00 C ATOM 877 CE1 TYR A 60 11.857 3.174 -2.163 1.00 0.00 C ATOM 878 CE2 TYR A 60 12.602 0.932 -2.539 1.00 0.00 C ATOM 879 CZ TYR A 60 11.862 2.028 -2.930 1.00 0.00 C ATOM 880 OH TYR A 60 11.126 1.978 -4.092 1.00 0.00 O ATOM 0 H TYR A 60 11.984 3.500 1.855 1.00 0.00 H new ATOM 0 HA TYR A 60 13.230 0.824 2.073 1.00 0.00 H new ATOM 0 HB2 TYR A 60 14.617 3.171 0.782 1.00 0.00 H new ATOM 0 HB3 TYR A 60 14.973 1.462 0.630 1.00 0.00 H new ATOM 0 HD1 TYR A 60 12.592 4.121 -0.402 1.00 0.00 H new ATOM 0 HD2 TYR A 60 13.918 0.127 -1.069 1.00 0.00 H new ATOM 0 HE1 TYR A 60 11.276 4.031 -2.471 1.00 0.00 H new ATOM 0 HE2 TYR A 60 12.605 0.036 -3.141 1.00 0.00 H new ATOM 0 HH TYR A 60 11.239 1.101 -4.514 1.00 0.00 H new ATOM 890 N ALA A 61 15.229 1.892 3.471 1.00 0.00 N ATOM 891 CA ALA A 61 16.021 2.328 4.615 1.00 0.00 C ATOM 892 C ALA A 61 17.478 2.547 4.222 1.00 0.00 C ATOM 893 O ALA A 61 18.194 1.597 3.906 1.00 0.00 O ATOM 894 CB ALA A 61 15.923 1.312 5.743 1.00 0.00 C ATOM 0 H ALA A 61 15.649 1.135 2.931 1.00 0.00 H new ATOM 0 HA ALA A 61 15.619 3.280 4.963 1.00 0.00 H new ATOM 0 HB1 ALA A 61 16.519 1.651 6.590 1.00 0.00 H new ATOM 0 HB2 ALA A 61 14.882 1.208 6.050 1.00 0.00 H new ATOM 0 HB3 ALA A 61 16.297 0.348 5.398 1.00 0.00 H new ATOM 900 N ILE A 62 17.909 3.804 4.245 1.00 0.00 N ATOM 901 CA ILE A 62 19.281 4.146 3.891 1.00 0.00 C ATOM 902 C ILE A 62 20.154 4.274 5.136 1.00 0.00 C ATOM 903 O ILE A 62 19.857 5.057 6.037 1.00 0.00 O ATOM 904 CB ILE A 62 19.346 5.463 3.095 1.00 0.00 C ATOM 905 CG1 ILE A 62 18.503 5.357 1.823 1.00 0.00 C ATOM 906 CG2 ILE A 62 20.789 5.805 2.754 1.00 0.00 C ATOM 907 CD1 ILE A 62 18.023 6.693 1.302 1.00 0.00 C ATOM 0 H ILE A 62 17.328 4.601 4.505 1.00 0.00 H new ATOM 0 HA ILE A 62 19.657 3.335 3.267 1.00 0.00 H new ATOM 0 HB ILE A 62 18.939 6.264 3.712 1.00 0.00 H new ATOM 0 HG12 ILE A 62 19.090 4.864 1.048 1.00 0.00 H new ATOM 0 HG13 ILE A 62 17.639 4.722 2.021 1.00 0.00 H new ATOM 0 HG21 ILE A 62 20.819 6.738 2.192 1.00 0.00 H new ATOM 0 HG22 ILE A 62 21.363 5.917 3.674 1.00 0.00 H new ATOM 0 HG23 ILE A 62 21.220 5.005 2.152 1.00 0.00 H new ATOM 0 HD11 ILE A 62 17.432 6.540 0.399 1.00 0.00 H new ATOM 0 HD12 ILE A 62 17.409 7.180 2.060 1.00 0.00 H new ATOM 0 HD13 ILE A 62 18.882 7.323 1.071 1.00 0.00 H new ATOM 919 N GLY A 63 21.234 3.499 5.177 1.00 0.00 N ATOM 920 CA GLY A 63 22.134 3.542 6.314 1.00 0.00 C ATOM 921 C GLY A 63 23.548 3.923 5.920 1.00 0.00 C ATOM 922 O GLY A 63 24.134 3.318 5.022 1.00 0.00 O ATOM 0 H GLY A 63 21.501 2.843 4.443 1.00 0.00 H new ATOM 0 HA2 GLY A 63 21.758 4.259 7.044 1.00 0.00 H new ATOM 0 HA3 GLY A 63 22.146 2.567 6.801 1.00 0.00 H new ATOM 926 N TYR A 64 24.096 4.929 6.592 1.00 0.00 N ATOM 927 CA TYR A 64 25.448 5.392 6.305 1.00 0.00 C ATOM 928 C TYR A 64 26.335 5.289 7.542 1.00 0.00 C ATOM 929 O TYR A 64 25.843 5.207 8.667 1.00 0.00 O ATOM 930 CB TYR A 64 25.419 6.838 5.804 1.00 0.00 C ATOM 931 CG TYR A 64 24.553 7.751 6.642 1.00 0.00 C ATOM 932 CD1 TYR A 64 23.168 7.660 6.599 1.00 0.00 C ATOM 933 CD2 TYR A 64 25.121 8.706 7.477 1.00 0.00 C ATOM 934 CE1 TYR A 64 22.373 8.493 7.362 1.00 0.00 C ATOM 935 CE2 TYR A 64 24.334 9.542 8.245 1.00 0.00 C ATOM 936 CZ TYR A 64 22.960 9.432 8.184 1.00 0.00 C ATOM 937 OH TYR A 64 22.173 10.264 8.946 1.00 0.00 O ATOM 0 H TYR A 64 23.625 5.439 7.339 1.00 0.00 H new ATOM 0 HA TYR A 64 25.865 4.752 5.527 1.00 0.00 H new ATOM 0 HB2 TYR A 64 26.436 7.229 5.789 1.00 0.00 H new ATOM 0 HB3 TYR A 64 25.057 6.850 4.776 1.00 0.00 H new ATOM 0 HD1 TYR A 64 22.704 6.925 5.958 1.00 0.00 H new ATOM 0 HD2 TYR A 64 26.196 8.796 7.526 1.00 0.00 H new ATOM 0 HE1 TYR A 64 21.297 8.409 7.315 1.00 0.00 H new ATOM 0 HE2 TYR A 64 24.792 10.278 8.890 1.00 0.00 H new ATOM 0 HH TYR A 64 22.715 10.669 9.655 1.00 0.00 H new ATOM 947 N GLY A 65 27.647 5.294 7.325 1.00 0.00 N ATOM 948 CA GLY A 65 28.582 5.201 8.431 1.00 0.00 C ATOM 949 C GLY A 65 29.980 4.831 7.978 1.00 0.00 C ATOM 950 O GLY A 65 30.183 3.786 7.357 1.00 0.00 O ATOM 0 H GLY A 65 28.079 5.361 6.403 1.00 0.00 H new ATOM 0 HA2 GLY A 65 28.614 6.155 8.957 1.00 0.00 H new ATOM 0 HA3 GLY A 65 28.225 4.457 9.143 1.00 0.00 H new ATOM 954 N ILE A 66 30.947 5.689 8.286 1.00 0.00 N ATOM 955 CA ILE A 66 32.333 5.446 7.906 1.00 0.00 C ATOM 956 C ILE A 66 32.759 4.025 8.258 1.00 0.00 C ATOM 957 O ILE A 66 32.689 3.614 9.415 1.00 0.00 O ATOM 958 CB ILE A 66 33.287 6.441 8.592 1.00 0.00 C ATOM 959 CG1 ILE A 66 32.906 7.878 8.232 1.00 0.00 C ATOM 960 CG2 ILE A 66 34.727 6.154 8.193 1.00 0.00 C ATOM 961 CD1 ILE A 66 33.548 8.916 9.125 1.00 0.00 C ATOM 0 H ILE A 66 30.796 6.558 8.798 1.00 0.00 H new ATOM 0 HA ILE A 66 32.393 5.583 6.826 1.00 0.00 H new ATOM 0 HB ILE A 66 33.198 6.321 9.672 1.00 0.00 H new ATOM 0 HG12 ILE A 66 33.192 8.073 7.198 1.00 0.00 H new ATOM 0 HG13 ILE A 66 31.822 7.983 8.288 1.00 0.00 H new ATOM 0 HG21 ILE A 66 35.390 6.865 8.686 1.00 0.00 H new ATOM 0 HG22 ILE A 66 34.993 5.141 8.495 1.00 0.00 H new ATOM 0 HG23 ILE A 66 34.831 6.250 7.112 1.00 0.00 H new ATOM 0 HD11 ILE A 66 33.233 9.911 8.811 1.00 0.00 H new ATOM 0 HD12 ILE A 66 33.242 8.747 10.157 1.00 0.00 H new ATOM 0 HD13 ILE A 66 34.633 8.839 9.051 1.00 0.00 H new ATOM 973 N GLY A 67 33.203 3.279 7.251 1.00 0.00 N ATOM 974 CA GLY A 67 33.636 1.912 7.475 1.00 0.00 C ATOM 975 C GLY A 67 32.472 0.946 7.584 1.00 0.00 C ATOM 976 O GLY A 67 32.490 -0.128 6.983 1.00 0.00 O ATOM 0 H GLY A 67 33.271 3.597 6.284 1.00 0.00 H new ATOM 0 HA2 GLY A 67 34.287 1.602 6.657 1.00 0.00 H new ATOM 0 HA3 GLY A 67 34.229 1.867 8.389 1.00 0.00 H new ATOM 980 N SER A 68 31.459 1.327 8.356 1.00 0.00 N ATOM 981 CA SER A 68 30.285 0.484 8.547 1.00 0.00 C ATOM 982 C SER A 68 29.008 1.319 8.525 1.00 0.00 C ATOM 983 O SER A 68 28.891 2.339 9.204 1.00 0.00 O ATOM 984 CB SER A 68 30.387 -0.277 9.870 1.00 0.00 C ATOM 985 OG SER A 68 31.593 -1.018 9.940 1.00 0.00 O ATOM 0 H SER A 68 31.428 2.214 8.859 1.00 0.00 H new ATOM 0 HA SER A 68 30.245 -0.232 7.726 1.00 0.00 H new ATOM 0 HB2 SER A 68 30.339 0.426 10.702 1.00 0.00 H new ATOM 0 HB3 SER A 68 29.536 -0.951 9.972 1.00 0.00 H new ATOM 0 HG SER A 68 31.635 -1.494 10.795 1.00 0.00 H new ATOM 991 N PRO A 69 28.026 0.876 7.725 1.00 0.00 N ATOM 992 CA PRO A 69 26.740 1.566 7.594 1.00 0.00 C ATOM 993 C PRO A 69 25.893 1.457 8.857 1.00 0.00 C ATOM 994 O PRO A 69 24.778 1.977 8.916 1.00 0.00 O ATOM 995 CB PRO A 69 26.062 0.837 6.431 1.00 0.00 C ATOM 996 CG PRO A 69 26.678 -0.520 6.425 1.00 0.00 C ATOM 997 CD PRO A 69 28.097 -0.332 6.886 1.00 0.00 C ATOM 0 HA PRO A 69 26.867 2.636 7.428 1.00 0.00 H new ATOM 0 HB2 PRO A 69 24.983 0.781 6.574 1.00 0.00 H new ATOM 0 HB3 PRO A 69 26.233 1.354 5.486 1.00 0.00 H new ATOM 0 HG2 PRO A 69 26.139 -1.196 7.088 1.00 0.00 H new ATOM 0 HG3 PRO A 69 26.646 -0.959 5.428 1.00 0.00 H new ATOM 0 HD2 PRO A 69 28.453 -1.193 7.451 1.00 0.00 H new ATOM 0 HD3 PRO A 69 28.778 -0.198 6.046 1.00 0.00 H new ATOM 1005 N HIS A 70 26.428 0.778 9.867 1.00 0.00 N ATOM 1006 CA HIS A 70 25.721 0.602 11.130 1.00 0.00 C ATOM 1007 C HIS A 70 25.878 1.834 12.017 1.00 0.00 C ATOM 1008 O HIS A 70 26.214 1.723 13.196 1.00 0.00 O ATOM 1009 CB HIS A 70 26.241 -0.636 11.862 1.00 0.00 C ATOM 1010 CG HIS A 70 27.632 -0.478 12.393 1.00 0.00 C ATOM 1011 ND1 HIS A 70 28.219 -1.388 13.247 1.00 0.00 N ATOM 1012 CD2 HIS A 70 28.555 0.490 12.185 1.00 0.00 C ATOM 1013 CE1 HIS A 70 29.442 -0.984 13.543 1.00 0.00 C ATOM 1014 NE2 HIS A 70 29.670 0.153 12.911 1.00 0.00 N ATOM 0 H HIS A 70 27.349 0.341 9.835 1.00 0.00 H new ATOM 0 HA HIS A 70 24.662 0.467 10.909 1.00 0.00 H new ATOM 0 HB2 HIS A 70 25.570 -0.868 12.689 1.00 0.00 H new ATOM 0 HB3 HIS A 70 26.215 -1.488 11.182 1.00 0.00 H new ATOM 0 HD2 HIS A 70 28.436 1.365 11.563 1.00 0.00 H new ATOM 0 HE1 HIS A 70 30.137 -1.497 14.192 1.00 0.00 H new ATOM 0 HE2 HIS A 70 30.534 0.693 12.955 1.00 0.00 H new ATOM 1023 N ALA A 71 25.632 3.006 11.441 1.00 0.00 N ATOM 1024 CA ALA A 71 25.745 4.258 12.179 1.00 0.00 C ATOM 1025 C ALA A 71 24.392 4.954 12.288 1.00 0.00 C ATOM 1026 O ALA A 71 23.935 5.271 13.386 1.00 0.00 O ATOM 1027 CB ALA A 71 26.760 5.174 11.513 1.00 0.00 C ATOM 0 H ALA A 71 25.353 3.115 10.466 1.00 0.00 H new ATOM 0 HA ALA A 71 26.088 4.027 13.187 1.00 0.00 H new ATOM 0 HB1 ALA A 71 26.834 6.105 12.075 1.00 0.00 H new ATOM 0 HB2 ALA A 71 27.734 4.684 11.493 1.00 0.00 H new ATOM 0 HB3 ALA A 71 26.441 5.390 10.493 1.00 0.00 H new ATOM 1033 N GLN A 72 23.760 5.190 11.144 1.00 0.00 N ATOM 1034 CA GLN A 72 22.460 5.851 11.112 1.00 0.00 C ATOM 1035 C GLN A 72 21.539 5.192 10.090 1.00 0.00 C ATOM 1036 O GLN A 72 21.982 4.398 9.259 1.00 0.00 O ATOM 1037 CB GLN A 72 22.627 7.335 10.783 1.00 0.00 C ATOM 1038 CG GLN A 72 23.085 8.173 11.966 1.00 0.00 C ATOM 1039 CD GLN A 72 23.379 9.610 11.585 1.00 0.00 C ATOM 1040 OE1 GLN A 72 22.467 10.422 11.430 1.00 0.00 O ATOM 1041 NE2 GLN A 72 24.658 9.933 11.432 1.00 0.00 N ATOM 0 H GLN A 72 24.126 4.934 10.227 1.00 0.00 H new ATOM 0 HA GLN A 72 22.007 5.753 12.098 1.00 0.00 H new ATOM 0 HB2 GLN A 72 23.349 7.440 9.973 1.00 0.00 H new ATOM 0 HB3 GLN A 72 21.678 7.726 10.417 1.00 0.00 H new ATOM 0 HG2 GLN A 72 22.315 8.156 12.738 1.00 0.00 H new ATOM 0 HG3 GLN A 72 23.980 7.726 12.398 1.00 0.00 H new ATOM 0 HE21 GLN A 72 25.382 9.228 11.570 1.00 0.00 H new ATOM 0 HE22 GLN A 72 24.916 10.886 11.176 1.00 0.00 H new ATOM 1050 N THR A 73 20.254 5.526 10.156 1.00 0.00 N ATOM 1051 CA THR A 73 19.271 4.966 9.239 1.00 0.00 C ATOM 1052 C THR A 73 18.237 6.012 8.836 1.00 0.00 C ATOM 1053 O THR A 73 17.745 6.767 9.675 1.00 0.00 O ATOM 1054 CB THR A 73 18.546 3.757 9.860 1.00 0.00 C ATOM 1055 OG1 THR A 73 19.499 2.863 10.445 1.00 0.00 O ATOM 1056 CG2 THR A 73 17.728 3.019 8.812 1.00 0.00 C ATOM 0 H THR A 73 19.870 6.182 10.836 1.00 0.00 H new ATOM 0 HA THR A 73 19.816 4.637 8.354 1.00 0.00 H new ATOM 0 HB THR A 73 17.870 4.124 10.632 1.00 0.00 H new ATOM 0 HG1 THR A 73 19.031 2.098 10.839 1.00 0.00 H new ATOM 0 HG21 THR A 73 17.226 2.169 9.275 1.00 0.00 H new ATOM 0 HG22 THR A 73 16.984 3.694 8.389 1.00 0.00 H new ATOM 0 HG23 THR A 73 18.387 2.663 8.020 1.00 0.00 H new ATOM 1064 N ILE A 74 17.911 6.049 7.548 1.00 0.00 N ATOM 1065 CA ILE A 74 16.933 7.002 7.036 1.00 0.00 C ATOM 1066 C ILE A 74 15.825 6.291 6.266 1.00 0.00 C ATOM 1067 O ILE A 74 16.067 5.693 5.218 1.00 0.00 O ATOM 1068 CB ILE A 74 17.593 8.046 6.116 1.00 0.00 C ATOM 1069 CG1 ILE A 74 18.643 8.847 6.889 1.00 0.00 C ATOM 1070 CG2 ILE A 74 16.541 8.972 5.526 1.00 0.00 C ATOM 1071 CD1 ILE A 74 19.540 9.682 6.002 1.00 0.00 C ATOM 0 H ILE A 74 18.309 5.431 6.841 1.00 0.00 H new ATOM 0 HA ILE A 74 16.504 7.510 7.900 1.00 0.00 H new ATOM 0 HB ILE A 74 18.090 7.525 5.298 1.00 0.00 H new ATOM 0 HG12 ILE A 74 18.138 9.501 7.600 1.00 0.00 H new ATOM 0 HG13 ILE A 74 19.258 8.159 7.469 1.00 0.00 H new ATOM 0 HG21 ILE A 74 17.023 9.704 4.878 1.00 0.00 H new ATOM 0 HG22 ILE A 74 15.827 8.388 4.945 1.00 0.00 H new ATOM 0 HG23 ILE A 74 16.018 9.488 6.331 1.00 0.00 H new ATOM 0 HD11 ILE A 74 20.259 10.222 6.617 1.00 0.00 H new ATOM 0 HD12 ILE A 74 20.072 9.032 5.308 1.00 0.00 H new ATOM 0 HD13 ILE A 74 18.935 10.394 5.441 1.00 0.00 H new ATOM 1083 N LYS A 75 14.607 6.363 6.793 1.00 0.00 N ATOM 1084 CA LYS A 75 13.459 5.730 6.155 1.00 0.00 C ATOM 1085 C LYS A 75 12.622 6.756 5.399 1.00 0.00 C ATOM 1086 O LYS A 75 12.061 7.676 5.995 1.00 0.00 O ATOM 1087 CB LYS A 75 12.594 5.023 7.201 1.00 0.00 C ATOM 1088 CG LYS A 75 13.319 3.910 7.938 1.00 0.00 C ATOM 1089 CD LYS A 75 13.154 2.574 7.233 1.00 0.00 C ATOM 1090 CE LYS A 75 13.397 1.409 8.180 1.00 0.00 C ATOM 1091 NZ LYS A 75 12.846 0.134 7.644 1.00 0.00 N ATOM 0 H LYS A 75 14.390 6.854 7.660 1.00 0.00 H new ATOM 0 HA LYS A 75 13.832 4.994 5.442 1.00 0.00 H new ATOM 0 HB2 LYS A 75 12.241 5.757 7.925 1.00 0.00 H new ATOM 0 HB3 LYS A 75 11.712 4.609 6.712 1.00 0.00 H new ATOM 0 HG2 LYS A 75 14.379 4.153 8.015 1.00 0.00 H new ATOM 0 HG3 LYS A 75 12.935 3.835 8.955 1.00 0.00 H new ATOM 0 HD2 LYS A 75 12.149 2.503 6.817 1.00 0.00 H new ATOM 0 HD3 LYS A 75 13.850 2.515 6.396 1.00 0.00 H new ATOM 0 HE2 LYS A 75 14.468 1.298 8.352 1.00 0.00 H new ATOM 0 HE3 LYS A 75 12.940 1.625 9.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 12.087 -0.206 8.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 12.464 0.295 6.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 13.602 -0.579 7.598 1.00 0.00 H new ATOM 1105 N VAL A 76 12.542 6.593 4.082 1.00 0.00 N ATOM 1106 CA VAL A 76 11.771 7.504 3.244 1.00 0.00 C ATOM 1107 C VAL A 76 10.647 6.769 2.522 1.00 0.00 C ATOM 1108 O VAL A 76 10.610 5.539 2.500 1.00 0.00 O ATOM 1109 CB VAL A 76 12.666 8.201 2.202 1.00 0.00 C ATOM 1110 CG1 VAL A 76 13.673 9.113 2.887 1.00 0.00 C ATOM 1111 CG2 VAL A 76 13.372 7.171 1.333 1.00 0.00 C ATOM 0 H VAL A 76 13.002 5.838 3.572 1.00 0.00 H new ATOM 0 HA VAL A 76 11.342 8.257 3.906 1.00 0.00 H new ATOM 0 HB VAL A 76 12.035 8.815 1.559 1.00 0.00 H new ATOM 0 HG11 VAL A 76 14.296 9.597 2.135 1.00 0.00 H new ATOM 0 HG12 VAL A 76 13.144 9.872 3.462 1.00 0.00 H new ATOM 0 HG13 VAL A 76 14.302 8.524 3.555 1.00 0.00 H new ATOM 0 HG21 VAL A 76 14.000 7.681 0.602 1.00 0.00 H new ATOM 0 HG22 VAL A 76 13.992 6.530 1.960 1.00 0.00 H new ATOM 0 HG23 VAL A 76 12.631 6.564 0.814 1.00 0.00 H new ATOM 1121 N ASP A 77 9.733 7.531 1.932 1.00 0.00 N ATOM 1122 CA ASP A 77 8.607 6.953 1.208 1.00 0.00 C ATOM 1123 C ASP A 77 9.041 6.470 -0.173 1.00 0.00 C ATOM 1124 O ASP A 77 10.123 6.812 -0.650 1.00 0.00 O ATOM 1125 CB ASP A 77 7.480 7.977 1.073 1.00 0.00 C ATOM 1126 CG ASP A 77 7.212 8.718 2.368 1.00 0.00 C ATOM 1127 OD1 ASP A 77 7.036 8.049 3.408 1.00 0.00 O ATOM 1128 OD2 ASP A 77 7.179 9.966 2.342 1.00 0.00 O ATOM 0 H ASP A 77 9.750 8.551 1.941 1.00 0.00 H new ATOM 0 HA ASP A 77 8.242 6.097 1.775 1.00 0.00 H new ATOM 0 HB2 ASP A 77 7.737 8.695 0.294 1.00 0.00 H new ATOM 0 HB3 ASP A 77 6.570 7.471 0.753 1.00 0.00 H new ATOM 1133 N TYR A 78 8.190 5.674 -0.810 1.00 0.00 N ATOM 1134 CA TYR A 78 8.486 5.141 -2.134 1.00 0.00 C ATOM 1135 C TYR A 78 8.739 6.268 -3.131 1.00 0.00 C ATOM 1136 O TYR A 78 9.699 6.229 -3.900 1.00 0.00 O ATOM 1137 CB TYR A 78 7.333 4.262 -2.623 1.00 0.00 C ATOM 1138 CG TYR A 78 5.979 4.926 -2.517 1.00 0.00 C ATOM 1139 CD1 TYR A 78 5.241 4.861 -1.342 1.00 0.00 C ATOM 1140 CD2 TYR A 78 5.437 5.620 -3.593 1.00 0.00 C ATOM 1141 CE1 TYR A 78 4.003 5.465 -1.241 1.00 0.00 C ATOM 1142 CE2 TYR A 78 4.201 6.229 -3.500 1.00 0.00 C ATOM 1143 CZ TYR A 78 3.487 6.148 -2.323 1.00 0.00 C ATOM 1144 OH TYR A 78 2.255 6.753 -2.226 1.00 0.00 O ATOM 0 H TYR A 78 7.289 5.383 -0.430 1.00 0.00 H new ATOM 0 HA TYR A 78 9.389 4.536 -2.060 1.00 0.00 H new ATOM 0 HB2 TYR A 78 7.513 3.986 -3.662 1.00 0.00 H new ATOM 0 HB3 TYR A 78 7.321 3.338 -2.045 1.00 0.00 H new ATOM 0 HD1 TYR A 78 5.642 4.329 -0.492 1.00 0.00 H new ATOM 0 HD2 TYR A 78 5.992 5.684 -4.517 1.00 0.00 H new ATOM 0 HE1 TYR A 78 3.442 5.403 -0.320 1.00 0.00 H new ATOM 0 HE2 TYR A 78 3.796 6.766 -4.345 1.00 0.00 H new ATOM 0 HH TYR A 78 2.038 7.192 -3.075 1.00 0.00 H new ATOM 1154 N LYS A 79 7.871 7.273 -3.110 1.00 0.00 N ATOM 1155 CA LYS A 79 7.998 8.414 -4.009 1.00 0.00 C ATOM 1156 C LYS A 79 9.444 8.895 -4.075 1.00 0.00 C ATOM 1157 O LYS A 79 9.981 9.126 -5.158 1.00 0.00 O ATOM 1158 CB LYS A 79 7.091 9.557 -3.548 1.00 0.00 C ATOM 1159 CG LYS A 79 5.626 9.168 -3.449 1.00 0.00 C ATOM 1160 CD LYS A 79 4.861 10.103 -2.527 1.00 0.00 C ATOM 1161 CE LYS A 79 3.383 10.149 -2.881 1.00 0.00 C ATOM 1162 NZ LYS A 79 3.136 10.915 -4.134 1.00 0.00 N ATOM 0 H LYS A 79 7.071 7.321 -2.479 1.00 0.00 H new ATOM 0 HA LYS A 79 7.692 8.095 -5.006 1.00 0.00 H new ATOM 0 HB2 LYS A 79 7.431 9.910 -2.574 1.00 0.00 H new ATOM 0 HB3 LYS A 79 7.191 10.391 -4.242 1.00 0.00 H new ATOM 0 HG2 LYS A 79 5.176 9.186 -4.442 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.544 8.145 -3.081 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.979 9.774 -1.494 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.283 11.106 -2.592 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.005 9.133 -2.996 1.00 0.00 H new ATOM 0 HE3 LYS A 79 2.827 10.605 -2.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 2.127 11.157 -4.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 3.701 11.788 -4.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 3.408 10.336 -4.954 1.00 0.00 H new ATOM 1176 N GLN A 80 10.069 9.042 -2.911 1.00 0.00 N ATOM 1177 CA GLN A 80 11.453 9.494 -2.839 1.00 0.00 C ATOM 1178 C GLN A 80 12.354 8.632 -3.717 1.00 0.00 C ATOM 1179 O GLN A 80 12.568 7.453 -3.435 1.00 0.00 O ATOM 1180 CB GLN A 80 11.948 9.461 -1.392 1.00 0.00 C ATOM 1181 CG GLN A 80 11.493 10.653 -0.566 1.00 0.00 C ATOM 1182 CD GLN A 80 11.632 11.966 -1.311 1.00 0.00 C ATOM 1183 OE1 GLN A 80 12.737 12.377 -1.666 1.00 0.00 O ATOM 1184 NE2 GLN A 80 10.509 12.633 -1.551 1.00 0.00 N ATOM 0 H GLN A 80 9.639 8.855 -2.005 1.00 0.00 H new ATOM 0 HA GLN A 80 11.493 10.520 -3.206 1.00 0.00 H new ATOM 0 HB2 GLN A 80 11.596 8.545 -0.917 1.00 0.00 H new ATOM 0 HB3 GLN A 80 13.037 9.423 -1.390 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.452 10.513 -0.276 1.00 0.00 H new ATOM 0 HG3 GLN A 80 12.077 10.698 0.353 1.00 0.00 H new ATOM 0 HE21 GLN A 80 9.615 12.255 -1.239 1.00 0.00 H new ATOM 0 HE22 GLN A 80 10.541 13.523 -2.048 1.00 0.00 H new ATOM 1193 N ARG A 81 12.878 9.228 -4.783 1.00 0.00 N ATOM 1194 CA ARG A 81 13.755 8.513 -5.704 1.00 0.00 C ATOM 1195 C ARG A 81 15.177 8.441 -5.155 1.00 0.00 C ATOM 1196 O ARG A 81 15.853 7.420 -5.285 1.00 0.00 O ATOM 1197 CB ARG A 81 13.759 9.197 -7.072 1.00 0.00 C ATOM 1198 CG ARG A 81 14.019 8.245 -8.228 1.00 0.00 C ATOM 1199 CD ARG A 81 15.431 7.684 -8.182 1.00 0.00 C ATOM 1200 NE ARG A 81 15.818 7.069 -9.448 1.00 0.00 N ATOM 1201 CZ ARG A 81 16.274 7.756 -10.490 1.00 0.00 C ATOM 1202 NH1 ARG A 81 16.401 9.074 -10.415 1.00 0.00 N ATOM 1203 NH2 ARG A 81 16.605 7.124 -11.609 1.00 0.00 N ATOM 0 H ARG A 81 12.711 10.203 -5.031 1.00 0.00 H new ATOM 0 HA ARG A 81 13.375 7.497 -5.814 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.798 9.688 -7.226 1.00 0.00 H new ATOM 0 HB3 ARG A 81 14.520 9.977 -7.077 1.00 0.00 H new ATOM 0 HG2 ARG A 81 13.300 7.426 -8.195 1.00 0.00 H new ATOM 0 HG3 ARG A 81 13.865 8.767 -9.172 1.00 0.00 H new ATOM 0 HD2 ARG A 81 16.131 8.484 -7.939 1.00 0.00 H new ATOM 0 HD3 ARG A 81 15.501 6.945 -7.384 1.00 0.00 H new ATOM 0 HE ARG A 81 15.734 6.056 -9.538 1.00 0.00 H new ATOM 0 HH11 ARG A 81 16.148 9.563 -9.556 1.00 0.00 H new ATOM 0 HH12 ARG A 81 16.751 9.599 -11.216 1.00 0.00 H new ATOM 0 HH21 ARG A 81 16.509 6.110 -11.670 1.00 0.00 H new ATOM 0 HH22 ARG A 81 16.955 7.652 -12.408 1.00 0.00 H new ATOM 1217 N TYR A 82 15.624 9.531 -4.541 1.00 0.00 N ATOM 1218 CA TYR A 82 16.967 9.593 -3.975 1.00 0.00 C ATOM 1219 C TYR A 82 16.973 10.388 -2.673 1.00 0.00 C ATOM 1220 O TYR A 82 15.955 10.951 -2.272 1.00 0.00 O ATOM 1221 CB TYR A 82 17.936 10.224 -4.976 1.00 0.00 C ATOM 1222 CG TYR A 82 17.625 11.670 -5.291 1.00 0.00 C ATOM 1223 CD1 TYR A 82 16.762 12.006 -6.326 1.00 0.00 C ATOM 1224 CD2 TYR A 82 18.194 12.700 -4.552 1.00 0.00 C ATOM 1225 CE1 TYR A 82 16.476 13.325 -6.618 1.00 0.00 C ATOM 1226 CE2 TYR A 82 17.912 14.022 -4.835 1.00 0.00 C ATOM 1227 CZ TYR A 82 17.053 14.330 -5.870 1.00 0.00 C ATOM 1228 OH TYR A 82 16.769 15.646 -6.156 1.00 0.00 O ATOM 0 H TYR A 82 15.076 10.383 -4.422 1.00 0.00 H new ATOM 0 HA TYR A 82 17.291 8.575 -3.759 1.00 0.00 H new ATOM 0 HB2 TYR A 82 18.949 10.157 -4.580 1.00 0.00 H new ATOM 0 HB3 TYR A 82 17.917 9.647 -5.901 1.00 0.00 H new ATOM 0 HD1 TYR A 82 16.307 11.222 -6.913 1.00 0.00 H new ATOM 0 HD2 TYR A 82 18.868 12.463 -3.742 1.00 0.00 H new ATOM 0 HE1 TYR A 82 15.804 13.568 -7.428 1.00 0.00 H new ATOM 0 HE2 TYR A 82 18.361 14.810 -4.249 1.00 0.00 H new ATOM 0 HH TYR A 82 17.255 16.228 -5.535 1.00 0.00 H new ATOM 1238 N TYR A 83 18.128 10.429 -2.018 1.00 0.00 N ATOM 1239 CA TYR A 83 18.268 11.152 -0.761 1.00 0.00 C ATOM 1240 C TYR A 83 19.598 11.898 -0.707 1.00 0.00 C ATOM 1241 O TYR A 83 20.654 11.333 -0.994 1.00 0.00 O ATOM 1242 CB TYR A 83 18.163 10.188 0.422 1.00 0.00 C ATOM 1243 CG TYR A 83 17.901 10.875 1.743 1.00 0.00 C ATOM 1244 CD1 TYR A 83 18.949 11.346 2.524 1.00 0.00 C ATOM 1245 CD2 TYR A 83 16.604 11.054 2.209 1.00 0.00 C ATOM 1246 CE1 TYR A 83 18.714 11.974 3.732 1.00 0.00 C ATOM 1247 CE2 TYR A 83 16.360 11.682 3.415 1.00 0.00 C ATOM 1248 CZ TYR A 83 17.418 12.140 4.173 1.00 0.00 C ATOM 1249 OH TYR A 83 17.179 12.766 5.375 1.00 0.00 O ATOM 0 H TYR A 83 18.981 9.970 -2.337 1.00 0.00 H new ATOM 0 HA TYR A 83 17.460 11.881 -0.699 1.00 0.00 H new ATOM 0 HB2 TYR A 83 17.362 9.475 0.228 1.00 0.00 H new ATOM 0 HB3 TYR A 83 19.088 9.616 0.497 1.00 0.00 H new ATOM 0 HD1 TYR A 83 19.965 11.219 2.181 1.00 0.00 H new ATOM 0 HD2 TYR A 83 15.773 10.696 1.619 1.00 0.00 H new ATOM 0 HE1 TYR A 83 19.540 12.333 4.327 1.00 0.00 H new ATOM 0 HE2 TYR A 83 15.346 11.814 3.763 1.00 0.00 H new ATOM 0 HH TYR A 83 16.213 12.803 5.538 1.00 0.00 H new ATOM 1259 N THR A 84 19.539 13.173 -0.335 1.00 0.00 N ATOM 1260 CA THR A 84 20.737 13.999 -0.243 1.00 0.00 C ATOM 1261 C THR A 84 21.235 14.087 1.195 1.00 0.00 C ATOM 1262 O THR A 84 20.796 14.944 1.962 1.00 0.00 O ATOM 1263 CB THR A 84 20.481 15.422 -0.774 1.00 0.00 C ATOM 1264 OG1 THR A 84 20.067 15.367 -2.143 1.00 0.00 O ATOM 1265 CG2 THR A 84 21.732 16.278 -0.651 1.00 0.00 C ATOM 0 H THR A 84 18.674 13.656 -0.092 1.00 0.00 H new ATOM 0 HA THR A 84 21.498 13.521 -0.860 1.00 0.00 H new ATOM 0 HB THR A 84 19.691 15.873 -0.174 1.00 0.00 H new ATOM 0 HG1 THR A 84 19.905 16.276 -2.472 1.00 0.00 H new ATOM 0 HG21 THR A 84 21.527 17.278 -1.032 1.00 0.00 H new ATOM 0 HG22 THR A 84 22.027 16.342 0.396 1.00 0.00 H new ATOM 0 HG23 THR A 84 22.539 15.828 -1.229 1.00 0.00 H new ATOM 1273 N ILE A 85 22.154 13.196 1.554 1.00 0.00 N ATOM 1274 CA ILE A 85 22.712 13.176 2.900 1.00 0.00 C ATOM 1275 C ILE A 85 23.642 14.362 3.127 1.00 0.00 C ATOM 1276 O ILE A 85 24.691 14.472 2.493 1.00 0.00 O ATOM 1277 CB ILE A 85 23.487 11.872 3.168 1.00 0.00 C ATOM 1278 CG1 ILE A 85 22.613 10.658 2.844 1.00 0.00 C ATOM 1279 CG2 ILE A 85 23.956 11.822 4.614 1.00 0.00 C ATOM 1280 CD1 ILE A 85 23.343 9.339 2.965 1.00 0.00 C ATOM 0 H ILE A 85 22.527 12.479 0.932 1.00 0.00 H new ATOM 0 HA ILE A 85 21.872 13.239 3.591 1.00 0.00 H new ATOM 0 HB ILE A 85 24.364 11.849 2.521 1.00 0.00 H new ATOM 0 HG12 ILE A 85 21.753 10.651 3.513 1.00 0.00 H new ATOM 0 HG13 ILE A 85 22.227 10.759 1.830 1.00 0.00 H new ATOM 0 HG21 ILE A 85 24.502 10.895 4.788 1.00 0.00 H new ATOM 0 HG22 ILE A 85 24.610 12.671 4.814 1.00 0.00 H new ATOM 0 HG23 ILE A 85 23.093 11.865 5.278 1.00 0.00 H new ATOM 0 HD11 ILE A 85 22.663 8.523 2.721 1.00 0.00 H new ATOM 0 HD12 ILE A 85 24.187 9.326 2.276 1.00 0.00 H new ATOM 0 HD13 ILE A 85 23.706 9.216 3.985 1.00 0.00 H new ATOM 1292 N GLU A 86 23.251 15.248 4.039 1.00 0.00 N ATOM 1293 CA GLU A 86 24.051 16.426 4.351 1.00 0.00 C ATOM 1294 C GLU A 86 24.609 16.345 5.769 1.00 0.00 C ATOM 1295 O GLU A 86 24.257 15.449 6.535 1.00 0.00 O ATOM 1296 CB GLU A 86 23.212 17.696 4.192 1.00 0.00 C ATOM 1297 CG GLU A 86 22.707 17.919 2.777 1.00 0.00 C ATOM 1298 CD GLU A 86 22.074 19.284 2.591 1.00 0.00 C ATOM 1299 OE1 GLU A 86 22.706 20.288 2.982 1.00 0.00 O ATOM 1300 OE2 GLU A 86 20.947 19.349 2.057 1.00 0.00 O ATOM 0 H GLU A 86 22.386 15.172 4.574 1.00 0.00 H new ATOM 0 HA GLU A 86 24.887 16.462 3.652 1.00 0.00 H new ATOM 0 HB2 GLU A 86 22.359 17.645 4.869 1.00 0.00 H new ATOM 0 HB3 GLU A 86 23.809 18.556 4.495 1.00 0.00 H new ATOM 0 HG2 GLU A 86 23.536 17.809 2.078 1.00 0.00 H new ATOM 0 HG3 GLU A 86 21.977 17.148 2.530 1.00 0.00 H new ATOM 1307 N ASN A 87 25.481 17.289 6.110 1.00 0.00 N ATOM 1308 CA ASN A 87 26.089 17.324 7.435 1.00 0.00 C ATOM 1309 C ASN A 87 27.069 16.170 7.615 1.00 0.00 C ATOM 1310 O ASN A 87 27.031 15.459 8.620 1.00 0.00 O ATOM 1311 CB ASN A 87 25.008 17.263 8.517 1.00 0.00 C ATOM 1312 CG ASN A 87 23.872 18.234 8.254 1.00 0.00 C ATOM 1313 OD1 ASN A 87 24.055 19.450 8.308 1.00 0.00 O ATOM 1314 ND2 ASN A 87 22.691 17.698 7.968 1.00 0.00 N ATOM 0 H ASN A 87 25.782 18.039 5.488 1.00 0.00 H new ATOM 0 HA ASN A 87 26.637 18.261 7.531 1.00 0.00 H new ATOM 0 HB2 ASN A 87 24.611 16.250 8.573 1.00 0.00 H new ATOM 0 HB3 ASN A 87 25.455 17.484 9.486 1.00 0.00 H new ATOM 0 HD21 ASN A 87 21.889 18.300 7.782 1.00 0.00 H new ATOM 0 HD22 ASN A 87 22.586 16.684 7.934 1.00 0.00 H new ATOM 1321 N LEU A 88 27.948 15.989 6.635 1.00 0.00 N ATOM 1322 CA LEU A 88 28.940 14.921 6.685 1.00 0.00 C ATOM 1323 C LEU A 88 30.355 15.491 6.690 1.00 0.00 C ATOM 1324 O LEU A 88 30.553 16.688 6.479 1.00 0.00 O ATOM 1325 CB LEU A 88 28.763 13.977 5.494 1.00 0.00 C ATOM 1326 CG LEU A 88 27.359 13.404 5.295 1.00 0.00 C ATOM 1327 CD1 LEU A 88 27.200 12.859 3.884 1.00 0.00 C ATOM 1328 CD2 LEU A 88 27.075 12.319 6.324 1.00 0.00 C ATOM 0 H LEU A 88 27.994 16.568 5.797 1.00 0.00 H new ATOM 0 HA LEU A 88 28.790 14.363 7.609 1.00 0.00 H new ATOM 0 HB2 LEU A 88 29.048 14.511 4.587 1.00 0.00 H new ATOM 0 HB3 LEU A 88 29.460 13.147 5.607 1.00 0.00 H new ATOM 0 HG LEU A 88 26.636 14.207 5.435 1.00 0.00 H new ATOM 0 HD11 LEU A 88 26.195 12.455 3.761 1.00 0.00 H new ATOM 0 HD12 LEU A 88 27.360 13.662 3.164 1.00 0.00 H new ATOM 0 HD13 LEU A 88 27.931 12.069 3.715 1.00 0.00 H new ATOM 0 HD21 LEU A 88 26.072 11.923 6.167 1.00 0.00 H new ATOM 0 HD22 LEU A 88 27.804 11.515 6.216 1.00 0.00 H new ATOM 0 HD23 LEU A 88 27.146 12.741 7.327 1.00 0.00 H new ATOM 1340 N ASP A 89 31.335 14.627 6.929 1.00 0.00 N ATOM 1341 CA ASP A 89 32.732 15.045 6.958 1.00 0.00 C ATOM 1342 C ASP A 89 33.398 14.808 5.606 1.00 0.00 C ATOM 1343 O ASP A 89 33.472 13.683 5.112 1.00 0.00 O ATOM 1344 CB ASP A 89 33.489 14.290 8.052 1.00 0.00 C ATOM 1345 CG ASP A 89 33.160 14.801 9.441 1.00 0.00 C ATOM 1346 OD1 ASP A 89 32.770 15.982 9.563 1.00 0.00 O ATOM 1347 OD2 ASP A 89 33.292 14.021 10.407 1.00 0.00 O ATOM 0 H ASP A 89 31.188 13.633 7.105 1.00 0.00 H new ATOM 0 HA ASP A 89 32.762 16.113 7.176 1.00 0.00 H new ATOM 0 HB2 ASP A 89 33.247 13.229 7.991 1.00 0.00 H new ATOM 0 HB3 ASP A 89 34.561 14.383 7.878 1.00 0.00 H new ATOM 1352 N PRO A 90 33.892 15.893 4.992 1.00 0.00 N ATOM 1353 CA PRO A 90 34.560 15.829 3.688 1.00 0.00 C ATOM 1354 C PRO A 90 35.915 15.133 3.764 1.00 0.00 C ATOM 1355 O PRO A 90 36.568 15.137 4.808 1.00 0.00 O ATOM 1356 CB PRO A 90 34.735 17.301 3.307 1.00 0.00 C ATOM 1357 CG PRO A 90 34.754 18.029 4.607 1.00 0.00 C ATOM 1358 CD PRO A 90 33.839 17.265 5.523 1.00 0.00 C ATOM 0 HA PRO A 90 33.985 15.252 2.963 1.00 0.00 H new ATOM 0 HB2 PRO A 90 35.659 17.459 2.751 1.00 0.00 H new ATOM 0 HB3 PRO A 90 33.919 17.645 2.672 1.00 0.00 H new ATOM 0 HG2 PRO A 90 35.764 18.075 5.014 1.00 0.00 H new ATOM 0 HG3 PRO A 90 34.413 19.057 4.484 1.00 0.00 H new ATOM 0 HD2 PRO A 90 34.178 17.309 6.558 1.00 0.00 H new ATOM 0 HD3 PRO A 90 32.825 17.665 5.503 1.00 0.00 H new ATOM 1366 N SER A 91 36.332 14.537 2.652 1.00 0.00 N ATOM 1367 CA SER A 91 37.608 13.835 2.594 1.00 0.00 C ATOM 1368 C SER A 91 37.563 12.557 3.427 1.00 0.00 C ATOM 1369 O SER A 91 38.471 12.282 4.212 1.00 0.00 O ATOM 1370 CB SER A 91 38.737 14.741 3.091 1.00 0.00 C ATOM 1371 OG SER A 91 40.004 14.223 2.726 1.00 0.00 O ATOM 0 H SER A 91 35.805 14.526 1.779 1.00 0.00 H new ATOM 0 HA SER A 91 37.799 13.565 1.555 1.00 0.00 H new ATOM 0 HB2 SER A 91 38.616 15.741 2.674 1.00 0.00 H new ATOM 0 HB3 SER A 91 38.679 14.838 4.175 1.00 0.00 H new ATOM 0 HG SER A 91 40.104 13.318 3.088 1.00 0.00 H new ATOM 1377 N SER A 92 36.500 11.779 3.248 1.00 0.00 N ATOM 1378 CA SER A 92 36.333 10.532 3.985 1.00 0.00 C ATOM 1379 C SER A 92 35.395 9.584 3.244 1.00 0.00 C ATOM 1380 O SER A 92 34.451 10.018 2.583 1.00 0.00 O ATOM 1381 CB SER A 92 35.790 10.812 5.388 1.00 0.00 C ATOM 1382 OG SER A 92 35.911 9.671 6.219 1.00 0.00 O ATOM 0 H SER A 92 35.742 11.990 2.599 1.00 0.00 H new ATOM 0 HA SER A 92 37.310 10.056 4.070 1.00 0.00 H new ATOM 0 HB2 SER A 92 36.332 11.647 5.831 1.00 0.00 H new ATOM 0 HB3 SER A 92 34.743 11.109 5.324 1.00 0.00 H new ATOM 0 HG SER A 92 35.559 9.876 7.110 1.00 0.00 H new ATOM 1388 N HIS A 93 35.662 8.287 3.359 1.00 0.00 N ATOM 1389 CA HIS A 93 34.843 7.277 2.700 1.00 0.00 C ATOM 1390 C HIS A 93 33.563 7.017 3.489 1.00 0.00 C ATOM 1391 O HIS A 93 33.589 6.901 4.714 1.00 0.00 O ATOM 1392 CB HIS A 93 35.630 5.976 2.541 1.00 0.00 C ATOM 1393 CG HIS A 93 34.768 4.786 2.247 1.00 0.00 C ATOM 1394 ND1 HIS A 93 35.020 3.530 2.757 1.00 0.00 N ATOM 1395 CD2 HIS A 93 33.651 4.667 1.493 1.00 0.00 C ATOM 1396 CE1 HIS A 93 34.096 2.689 2.328 1.00 0.00 C ATOM 1397 NE2 HIS A 93 33.253 3.354 1.559 1.00 0.00 N ATOM 0 H HIS A 93 36.439 7.911 3.902 1.00 0.00 H new ATOM 0 HA HIS A 93 34.572 7.652 1.713 1.00 0.00 H new ATOM 0 HB2 HIS A 93 36.356 6.096 1.737 1.00 0.00 H new ATOM 0 HB3 HIS A 93 36.195 5.789 3.454 1.00 0.00 H new ATOM 0 HD1 HIS A 93 35.799 3.288 3.370 1.00 0.00 H new ATOM 0 HD2 HIS A 93 33.163 5.457 0.942 1.00 0.00 H new ATOM 0 HE1 HIS A 93 34.040 1.637 2.566 1.00 0.00 H new ATOM 1406 N TYR A 94 32.444 6.928 2.778 1.00 0.00 N ATOM 1407 CA TYR A 94 31.153 6.686 3.412 1.00 0.00 C ATOM 1408 C TYR A 94 30.415 5.541 2.725 1.00 0.00 C ATOM 1409 O TYR A 94 30.089 5.619 1.541 1.00 0.00 O ATOM 1410 CB TYR A 94 30.297 7.953 3.376 1.00 0.00 C ATOM 1411 CG TYR A 94 30.540 8.882 4.544 1.00 0.00 C ATOM 1412 CD1 TYR A 94 31.539 9.847 4.495 1.00 0.00 C ATOM 1413 CD2 TYR A 94 29.770 8.794 5.698 1.00 0.00 C ATOM 1414 CE1 TYR A 94 31.764 10.696 5.560 1.00 0.00 C ATOM 1415 CE2 TYR A 94 29.988 9.641 6.768 1.00 0.00 C ATOM 1416 CZ TYR A 94 30.986 10.590 6.694 1.00 0.00 C ATOM 1417 OH TYR A 94 31.207 11.435 7.758 1.00 0.00 O ATOM 0 H TYR A 94 32.405 7.020 1.763 1.00 0.00 H new ATOM 0 HA TYR A 94 31.334 6.407 4.450 1.00 0.00 H new ATOM 0 HB2 TYR A 94 30.496 8.490 2.448 1.00 0.00 H new ATOM 0 HB3 TYR A 94 29.245 7.670 3.361 1.00 0.00 H new ATOM 0 HD1 TYR A 94 32.150 9.934 3.609 1.00 0.00 H new ATOM 0 HD2 TYR A 94 28.988 8.051 5.759 1.00 0.00 H new ATOM 0 HE1 TYR A 94 32.545 11.440 5.506 1.00 0.00 H new ATOM 0 HE2 TYR A 94 29.380 9.560 7.657 1.00 0.00 H new ATOM 0 HH TYR A 94 30.573 11.229 8.476 1.00 0.00 H new ATOM 1427 N VAL A 95 30.155 4.477 3.478 1.00 0.00 N ATOM 1428 CA VAL A 95 29.454 3.316 2.945 1.00 0.00 C ATOM 1429 C VAL A 95 27.944 3.477 3.076 1.00 0.00 C ATOM 1430 O VAL A 95 27.409 3.532 4.184 1.00 0.00 O ATOM 1431 CB VAL A 95 29.885 2.022 3.660 1.00 0.00 C ATOM 1432 CG1 VAL A 95 29.214 0.812 3.029 1.00 0.00 C ATOM 1433 CG2 VAL A 95 31.399 1.877 3.632 1.00 0.00 C ATOM 0 H VAL A 95 30.420 4.396 4.460 1.00 0.00 H new ATOM 0 HA VAL A 95 29.719 3.245 1.890 1.00 0.00 H new ATOM 0 HB VAL A 95 29.567 2.081 4.701 1.00 0.00 H new ATOM 0 HG11 VAL A 95 29.532 -0.092 3.548 1.00 0.00 H new ATOM 0 HG12 VAL A 95 28.132 0.914 3.107 1.00 0.00 H new ATOM 0 HG13 VAL A 95 29.497 0.745 1.979 1.00 0.00 H new ATOM 0 HG21 VAL A 95 31.686 0.957 4.142 1.00 0.00 H new ATOM 0 HG22 VAL A 95 31.742 1.841 2.598 1.00 0.00 H new ATOM 0 HG23 VAL A 95 31.855 2.729 4.136 1.00 0.00 H new ATOM 1443 N ILE A 96 27.261 3.551 1.938 1.00 0.00 N ATOM 1444 CA ILE A 96 25.811 3.704 1.926 1.00 0.00 C ATOM 1445 C ILE A 96 25.122 2.387 1.585 1.00 0.00 C ATOM 1446 O ILE A 96 25.583 1.637 0.723 1.00 0.00 O ATOM 1447 CB ILE A 96 25.367 4.779 0.917 1.00 0.00 C ATOM 1448 CG1 ILE A 96 25.903 6.151 1.332 1.00 0.00 C ATOM 1449 CG2 ILE A 96 23.850 4.808 0.807 1.00 0.00 C ATOM 1450 CD1 ILE A 96 27.389 6.314 1.102 1.00 0.00 C ATOM 0 H ILE A 96 27.688 3.507 1.013 1.00 0.00 H new ATOM 0 HA ILE A 96 25.518 4.015 2.929 1.00 0.00 H new ATOM 0 HB ILE A 96 25.778 4.530 -0.061 1.00 0.00 H new ATOM 0 HG12 ILE A 96 25.371 6.923 0.777 1.00 0.00 H new ATOM 0 HG13 ILE A 96 25.687 6.312 2.388 1.00 0.00 H new ATOM 0 HG21 ILE A 96 23.552 5.573 0.090 1.00 0.00 H new ATOM 0 HG22 ILE A 96 23.491 3.835 0.470 1.00 0.00 H new ATOM 0 HG23 ILE A 96 23.419 5.036 1.782 1.00 0.00 H new ATOM 0 HD11 ILE A 96 27.699 7.310 1.419 1.00 0.00 H new ATOM 0 HD12 ILE A 96 27.931 5.565 1.679 1.00 0.00 H new ATOM 0 HD13 ILE A 96 27.609 6.185 0.042 1.00 0.00 H new ATOM 1462 N THR A 97 24.014 2.111 2.266 1.00 0.00 N ATOM 1463 CA THR A 97 23.260 0.885 2.035 1.00 0.00 C ATOM 1464 C THR A 97 21.790 1.186 1.769 1.00 0.00 C ATOM 1465 O THR A 97 21.273 2.224 2.185 1.00 0.00 O ATOM 1466 CB THR A 97 23.368 -0.075 3.235 1.00 0.00 C ATOM 1467 OG1 THR A 97 23.091 0.628 4.451 1.00 0.00 O ATOM 1468 CG2 THR A 97 24.754 -0.697 3.307 1.00 0.00 C ATOM 0 H THR A 97 23.619 2.720 2.982 1.00 0.00 H new ATOM 0 HA THR A 97 23.694 0.407 1.157 1.00 0.00 H new ATOM 0 HB THR A 97 22.636 -0.872 3.102 1.00 0.00 H new ATOM 0 HG1 THR A 97 23.647 1.434 4.497 1.00 0.00 H new ATOM 0 HG21 THR A 97 24.806 -1.371 4.162 1.00 0.00 H new ATOM 0 HG22 THR A 97 24.950 -1.256 2.392 1.00 0.00 H new ATOM 0 HG23 THR A 97 25.500 0.089 3.419 1.00 0.00 H new ATOM 1476 N LEU A 98 21.119 0.272 1.077 1.00 0.00 N ATOM 1477 CA LEU A 98 19.706 0.439 0.756 1.00 0.00 C ATOM 1478 C LEU A 98 18.981 -0.903 0.774 1.00 0.00 C ATOM 1479 O LEU A 98 19.427 -1.870 0.157 1.00 0.00 O ATOM 1480 CB LEU A 98 19.548 1.099 -0.615 1.00 0.00 C ATOM 1481 CG LEU A 98 18.124 1.163 -1.169 1.00 0.00 C ATOM 1482 CD1 LEU A 98 17.433 2.441 -0.718 1.00 0.00 C ATOM 1483 CD2 LEU A 98 18.138 1.069 -2.688 1.00 0.00 C ATOM 0 H LEU A 98 21.531 -0.593 0.727 1.00 0.00 H new ATOM 0 HA LEU A 98 19.260 1.082 1.515 1.00 0.00 H new ATOM 0 HB2 LEU A 98 19.939 2.115 -0.554 1.00 0.00 H new ATOM 0 HB3 LEU A 98 20.170 0.560 -1.329 1.00 0.00 H new ATOM 0 HG LEU A 98 17.564 0.314 -0.778 1.00 0.00 H new ATOM 0 HD11 LEU A 98 16.421 2.469 -1.122 1.00 0.00 H new ATOM 0 HD12 LEU A 98 17.390 2.467 0.371 1.00 0.00 H new ATOM 0 HD13 LEU A 98 17.992 3.304 -1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 98 17.116 1.116 -3.065 1.00 0.00 H new ATOM 0 HD22 LEU A 98 18.715 1.898 -3.099 1.00 0.00 H new ATOM 0 HD23 LEU A 98 18.593 0.126 -2.990 1.00 0.00 H new ATOM 1495 N LYS A 99 17.859 -0.954 1.485 1.00 0.00 N ATOM 1496 CA LYS A 99 17.069 -2.175 1.581 1.00 0.00 C ATOM 1497 C LYS A 99 15.587 -1.882 1.373 1.00 0.00 C ATOM 1498 O LYS A 99 15.030 -0.977 1.994 1.00 0.00 O ATOM 1499 CB LYS A 99 17.282 -2.838 2.944 1.00 0.00 C ATOM 1500 CG LYS A 99 16.710 -2.042 4.104 1.00 0.00 C ATOM 1501 CD LYS A 99 16.838 -2.798 5.416 1.00 0.00 C ATOM 1502 CE LYS A 99 18.224 -2.634 6.021 1.00 0.00 C ATOM 1503 NZ LYS A 99 18.468 -1.238 6.477 1.00 0.00 N ATOM 0 H LYS A 99 17.477 -0.163 2.003 1.00 0.00 H new ATOM 0 HA LYS A 99 17.400 -2.855 0.796 1.00 0.00 H new ATOM 0 HB2 LYS A 99 16.825 -3.827 2.933 1.00 0.00 H new ATOM 0 HB3 LYS A 99 18.350 -2.983 3.105 1.00 0.00 H new ATOM 0 HG2 LYS A 99 17.229 -1.086 4.182 1.00 0.00 H new ATOM 0 HG3 LYS A 99 15.660 -1.820 3.912 1.00 0.00 H new ATOM 0 HD2 LYS A 99 16.088 -2.437 6.120 1.00 0.00 H new ATOM 0 HD3 LYS A 99 16.636 -3.856 5.249 1.00 0.00 H new ATOM 0 HE2 LYS A 99 18.335 -3.316 6.864 1.00 0.00 H new ATOM 0 HE3 LYS A 99 18.977 -2.912 5.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 19.235 -1.231 7.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 18.739 -0.649 5.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 17.601 -0.857 6.907 1.00 0.00 H new ATOM 1517 N ALA A 100 14.953 -2.655 0.496 1.00 0.00 N ATOM 1518 CA ALA A 100 13.535 -2.480 0.209 1.00 0.00 C ATOM 1519 C ALA A 100 12.674 -3.227 1.222 1.00 0.00 C ATOM 1520 O ALA A 100 12.789 -4.443 1.373 1.00 0.00 O ATOM 1521 CB ALA A 100 13.220 -2.951 -1.203 1.00 0.00 C ATOM 0 H ALA A 100 15.400 -3.408 -0.027 1.00 0.00 H new ATOM 0 HA ALA A 100 13.302 -1.418 0.286 1.00 0.00 H new ATOM 0 HB1 ALA A 100 12.157 -2.814 -1.404 1.00 0.00 H new ATOM 0 HB2 ALA A 100 13.802 -2.370 -1.919 1.00 0.00 H new ATOM 0 HB3 ALA A 100 13.475 -4.006 -1.300 1.00 0.00 H new ATOM 1527 N PHE A 101 11.812 -2.491 1.915 1.00 0.00 N ATOM 1528 CA PHE A 101 10.932 -3.083 2.916 1.00 0.00 C ATOM 1529 C PHE A 101 9.470 -2.776 2.605 1.00 0.00 C ATOM 1530 O PHE A 101 9.167 -1.896 1.800 1.00 0.00 O ATOM 1531 CB PHE A 101 11.288 -2.565 4.311 1.00 0.00 C ATOM 1532 CG PHE A 101 10.811 -1.164 4.570 1.00 0.00 C ATOM 1533 CD1 PHE A 101 9.474 -0.912 4.835 1.00 0.00 C ATOM 1534 CD2 PHE A 101 11.698 -0.100 4.547 1.00 0.00 C ATOM 1535 CE1 PHE A 101 9.031 0.375 5.075 1.00 0.00 C ATOM 1536 CE2 PHE A 101 11.261 1.189 4.786 1.00 0.00 C ATOM 1537 CZ PHE A 101 9.926 1.427 5.049 1.00 0.00 C ATOM 0 H PHE A 101 11.704 -1.483 1.802 1.00 0.00 H new ATOM 0 HA PHE A 101 11.071 -4.164 2.891 1.00 0.00 H new ATOM 0 HB2 PHE A 101 10.857 -3.231 5.058 1.00 0.00 H new ATOM 0 HB3 PHE A 101 12.370 -2.601 4.438 1.00 0.00 H new ATOM 0 HD1 PHE A 101 8.770 -1.731 4.854 1.00 0.00 H new ATOM 0 HD2 PHE A 101 12.743 -0.280 4.340 1.00 0.00 H new ATOM 0 HE1 PHE A 101 7.987 0.558 5.282 1.00 0.00 H new ATOM 0 HE2 PHE A 101 11.963 2.010 4.767 1.00 0.00 H new ATOM 0 HZ PHE A 101 9.582 2.434 5.234 1.00 0.00 H new ATOM 1547 N ASN A 102 8.568 -3.509 3.249 1.00 0.00 N ATOM 1548 CA ASN A 102 7.137 -3.316 3.042 1.00 0.00 C ATOM 1549 C ASN A 102 6.348 -3.714 4.285 1.00 0.00 C ATOM 1550 O ASN A 102 6.925 -4.080 5.308 1.00 0.00 O ATOM 1551 CB ASN A 102 6.661 -4.133 1.839 1.00 0.00 C ATOM 1552 CG ASN A 102 6.763 -5.627 2.078 1.00 0.00 C ATOM 1553 OD1 ASN A 102 7.528 -6.080 2.930 1.00 0.00 O ATOM 1554 ND2 ASN A 102 5.990 -6.401 1.325 1.00 0.00 N ATOM 0 H ASN A 102 8.802 -4.242 3.919 1.00 0.00 H new ATOM 0 HA ASN A 102 6.963 -2.258 2.847 1.00 0.00 H new ATOM 0 HB2 ASN A 102 5.627 -3.874 1.614 1.00 0.00 H new ATOM 0 HB3 ASN A 102 7.254 -3.866 0.964 1.00 0.00 H new ATOM 0 HD21 ASN A 102 6.015 -7.414 1.441 1.00 0.00 H new ATOM 0 HD22 ASN A 102 5.371 -5.982 0.631 1.00 0.00 H new ATOM 1561 N ASN A 103 5.025 -3.640 4.189 1.00 0.00 N ATOM 1562 CA ASN A 103 4.156 -3.992 5.306 1.00 0.00 C ATOM 1563 C ASN A 103 4.469 -5.395 5.817 1.00 0.00 C ATOM 1564 O ASN A 103 4.338 -5.678 7.008 1.00 0.00 O ATOM 1565 CB ASN A 103 2.688 -3.907 4.884 1.00 0.00 C ATOM 1566 CG ASN A 103 1.747 -3.848 6.072 1.00 0.00 C ATOM 1567 OD1 ASN A 103 1.573 -4.833 6.790 1.00 0.00 O ATOM 1568 ND2 ASN A 103 1.135 -2.689 6.284 1.00 0.00 N ATOM 0 H ASN A 103 4.531 -3.339 3.349 1.00 0.00 H new ATOM 0 HA ASN A 103 4.337 -3.281 6.113 1.00 0.00 H new ATOM 0 HB2 ASN A 103 2.542 -3.023 4.264 1.00 0.00 H new ATOM 0 HB3 ASN A 103 2.439 -4.772 4.269 1.00 0.00 H new ATOM 0 HD21 ASN A 103 0.490 -2.589 7.068 1.00 0.00 H new ATOM 0 HD22 ASN A 103 1.310 -1.899 5.663 1.00 0.00 H new ATOM 1575 N VAL A 104 4.885 -6.272 4.908 1.00 0.00 N ATOM 1576 CA VAL A 104 5.219 -7.645 5.266 1.00 0.00 C ATOM 1577 C VAL A 104 6.532 -7.708 6.037 1.00 0.00 C ATOM 1578 O VAL A 104 6.615 -8.331 7.095 1.00 0.00 O ATOM 1579 CB VAL A 104 5.326 -8.541 4.018 1.00 0.00 C ATOM 1580 CG1 VAL A 104 5.735 -9.953 4.407 1.00 0.00 C ATOM 1581 CG2 VAL A 104 4.009 -8.550 3.255 1.00 0.00 C ATOM 0 H VAL A 104 4.999 -6.055 3.918 1.00 0.00 H new ATOM 0 HA VAL A 104 4.411 -8.012 5.899 1.00 0.00 H new ATOM 0 HB VAL A 104 6.097 -8.133 3.364 1.00 0.00 H new ATOM 0 HG11 VAL A 104 5.805 -10.571 3.512 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.703 -9.927 4.907 1.00 0.00 H new ATOM 0 HG13 VAL A 104 4.990 -10.375 5.082 1.00 0.00 H new ATOM 0 HG21 VAL A 104 4.102 -9.188 2.376 1.00 0.00 H new ATOM 0 HG22 VAL A 104 3.218 -8.933 3.899 1.00 0.00 H new ATOM 0 HG23 VAL A 104 3.763 -7.535 2.942 1.00 0.00 H new ATOM 1591 N GLY A 105 7.559 -7.056 5.500 1.00 0.00 N ATOM 1592 CA GLY A 105 8.856 -7.050 6.151 1.00 0.00 C ATOM 1593 C GLY A 105 9.920 -6.360 5.319 1.00 0.00 C ATOM 1594 O GLY A 105 9.632 -5.838 4.243 1.00 0.00 O ATOM 0 H GLY A 105 7.516 -6.532 4.626 1.00 0.00 H new ATOM 0 HA2 GLY A 105 8.772 -6.550 7.116 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.164 -8.077 6.350 1.00 0.00 H new ATOM 1598 N GLU A 106 11.151 -6.357 5.820 1.00 0.00 N ATOM 1599 CA GLU A 106 12.260 -5.723 5.116 1.00 0.00 C ATOM 1600 C GLU A 106 12.896 -6.690 4.121 1.00 0.00 C ATOM 1601 O GLU A 106 12.644 -7.894 4.161 1.00 0.00 O ATOM 1602 CB GLU A 106 13.312 -5.233 6.112 1.00 0.00 C ATOM 1603 CG GLU A 106 12.725 -4.509 7.311 1.00 0.00 C ATOM 1604 CD GLU A 106 12.287 -5.458 8.409 1.00 0.00 C ATOM 1605 OE1 GLU A 106 12.906 -6.534 8.546 1.00 0.00 O ATOM 1606 OE2 GLU A 106 11.324 -5.125 9.132 1.00 0.00 O ATOM 0 H GLU A 106 11.406 -6.786 6.710 1.00 0.00 H new ATOM 0 HA GLU A 106 11.867 -4.869 4.565 1.00 0.00 H new ATOM 0 HB2 GLU A 106 13.893 -6.086 6.462 1.00 0.00 H new ATOM 0 HB3 GLU A 106 14.003 -4.565 5.598 1.00 0.00 H new ATOM 0 HG2 GLU A 106 13.465 -3.815 7.710 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.871 -3.914 6.989 1.00 0.00 H new ATOM 1613 N GLY A 107 13.722 -6.154 3.228 1.00 0.00 N ATOM 1614 CA GLY A 107 14.381 -6.982 2.236 1.00 0.00 C ATOM 1615 C GLY A 107 15.885 -7.028 2.425 1.00 0.00 C ATOM 1616 O GLY A 107 16.387 -6.769 3.519 1.00 0.00 O ATOM 0 H GLY A 107 13.946 -5.160 3.174 1.00 0.00 H new ATOM 0 HA2 GLY A 107 13.980 -7.994 2.288 1.00 0.00 H new ATOM 0 HA3 GLY A 107 14.155 -6.600 1.240 1.00 0.00 H new ATOM 1620 N ILE A 108 16.604 -7.361 1.358 1.00 0.00 N ATOM 1621 CA ILE A 108 18.058 -7.441 1.412 1.00 0.00 C ATOM 1622 C ILE A 108 18.695 -6.095 1.085 1.00 0.00 C ATOM 1623 O ILE A 108 18.449 -5.503 0.033 1.00 0.00 O ATOM 1624 CB ILE A 108 18.600 -8.504 0.438 1.00 0.00 C ATOM 1625 CG1 ILE A 108 17.628 -9.681 0.342 1.00 0.00 C ATOM 1626 CG2 ILE A 108 19.974 -8.979 0.885 1.00 0.00 C ATOM 1627 CD1 ILE A 108 17.539 -10.497 1.612 1.00 0.00 C ATOM 0 H ILE A 108 16.203 -7.580 0.446 1.00 0.00 H new ATOM 0 HA ILE A 108 18.321 -7.726 2.431 1.00 0.00 H new ATOM 0 HB ILE A 108 18.696 -8.055 -0.551 1.00 0.00 H new ATOM 0 HG12 ILE A 108 16.636 -9.303 0.092 1.00 0.00 H new ATOM 0 HG13 ILE A 108 17.937 -10.331 -0.477 1.00 0.00 H new ATOM 0 HG21 ILE A 108 20.344 -9.730 0.187 1.00 0.00 H new ATOM 0 HG22 ILE A 108 20.662 -8.134 0.907 1.00 0.00 H new ATOM 0 HG23 ILE A 108 19.902 -9.414 1.882 1.00 0.00 H new ATOM 0 HD11 ILE A 108 16.832 -11.314 1.471 1.00 0.00 H new ATOM 0 HD12 ILE A 108 18.521 -10.905 1.852 1.00 0.00 H new ATOM 0 HD13 ILE A 108 17.200 -9.861 2.430 1.00 0.00 H new ATOM 1639 N PRO A 109 19.536 -5.599 2.004 1.00 0.00 N ATOM 1640 CA PRO A 109 20.228 -4.318 1.835 1.00 0.00 C ATOM 1641 C PRO A 109 21.296 -4.376 0.748 1.00 0.00 C ATOM 1642 O PRO A 109 21.662 -5.454 0.279 1.00 0.00 O ATOM 1643 CB PRO A 109 20.871 -4.078 3.203 1.00 0.00 C ATOM 1644 CG PRO A 109 21.035 -5.438 3.788 1.00 0.00 C ATOM 1645 CD PRO A 109 19.876 -6.250 3.281 1.00 0.00 C ATOM 0 HA PRO A 109 19.547 -3.525 1.524 1.00 0.00 H new ATOM 0 HB2 PRO A 109 21.831 -3.570 3.106 1.00 0.00 H new ATOM 0 HB3 PRO A 109 20.240 -3.450 3.832 1.00 0.00 H new ATOM 0 HG2 PRO A 109 21.984 -5.881 3.485 1.00 0.00 H new ATOM 0 HG3 PRO A 109 21.036 -5.397 4.877 1.00 0.00 H new ATOM 0 HD2 PRO A 109 20.150 -7.295 3.139 1.00 0.00 H new ATOM 0 HD3 PRO A 109 19.037 -6.232 3.977 1.00 0.00 H new ATOM 1653 N LEU A 110 21.794 -3.209 0.351 1.00 0.00 N ATOM 1654 CA LEU A 110 22.821 -3.127 -0.682 1.00 0.00 C ATOM 1655 C LEU A 110 24.094 -2.491 -0.133 1.00 0.00 C ATOM 1656 O LEU A 110 24.056 -1.748 0.848 1.00 0.00 O ATOM 1657 CB LEU A 110 22.308 -2.322 -1.876 1.00 0.00 C ATOM 1658 CG LEU A 110 21.414 -3.076 -2.861 1.00 0.00 C ATOM 1659 CD1 LEU A 110 20.875 -2.132 -3.924 1.00 0.00 C ATOM 1660 CD2 LEU A 110 22.179 -4.225 -3.503 1.00 0.00 C ATOM 0 H LEU A 110 21.503 -2.307 0.729 1.00 0.00 H new ATOM 0 HA LEU A 110 23.055 -4.140 -1.010 1.00 0.00 H new ATOM 0 HB2 LEU A 110 21.754 -1.463 -1.498 1.00 0.00 H new ATOM 0 HB3 LEU A 110 23.167 -1.932 -2.422 1.00 0.00 H new ATOM 0 HG LEU A 110 20.569 -3.490 -2.311 1.00 0.00 H new ATOM 0 HD11 LEU A 110 20.241 -2.687 -4.616 1.00 0.00 H new ATOM 0 HD12 LEU A 110 20.291 -1.344 -3.449 1.00 0.00 H new ATOM 0 HD13 LEU A 110 21.706 -1.687 -4.471 1.00 0.00 H new ATOM 0 HD21 LEU A 110 21.528 -4.751 -4.201 1.00 0.00 H new ATOM 0 HD22 LEU A 110 23.043 -3.832 -4.039 1.00 0.00 H new ATOM 0 HD23 LEU A 110 22.515 -4.916 -2.730 1.00 0.00 H new ATOM 1672 N TYR A 111 25.220 -2.785 -0.775 1.00 0.00 N ATOM 1673 CA TYR A 111 26.505 -2.241 -0.351 1.00 0.00 C ATOM 1674 C TYR A 111 27.088 -1.324 -1.422 1.00 0.00 C ATOM 1675 O TYR A 111 27.248 -1.722 -2.575 1.00 0.00 O ATOM 1676 CB TYR A 111 27.486 -3.375 -0.046 1.00 0.00 C ATOM 1677 CG TYR A 111 27.418 -3.866 1.382 1.00 0.00 C ATOM 1678 CD1 TYR A 111 26.235 -4.371 1.909 1.00 0.00 C ATOM 1679 CD2 TYR A 111 28.537 -3.826 2.205 1.00 0.00 C ATOM 1680 CE1 TYR A 111 26.168 -4.820 3.213 1.00 0.00 C ATOM 1681 CE2 TYR A 111 28.480 -4.275 3.511 1.00 0.00 C ATOM 1682 CZ TYR A 111 27.293 -4.770 4.010 1.00 0.00 C ATOM 1683 OH TYR A 111 27.231 -5.218 5.310 1.00 0.00 O ATOM 0 H TYR A 111 25.269 -3.396 -1.590 1.00 0.00 H new ATOM 0 HA TYR A 111 26.343 -1.656 0.554 1.00 0.00 H new ATOM 0 HB2 TYR A 111 27.285 -4.209 -0.718 1.00 0.00 H new ATOM 0 HB3 TYR A 111 28.500 -3.034 -0.256 1.00 0.00 H new ATOM 0 HD1 TYR A 111 25.353 -4.413 1.288 1.00 0.00 H new ATOM 0 HD2 TYR A 111 29.467 -3.437 1.818 1.00 0.00 H new ATOM 0 HE1 TYR A 111 25.240 -5.208 3.607 1.00 0.00 H new ATOM 0 HE2 TYR A 111 29.359 -4.239 4.137 1.00 0.00 H new ATOM 0 HH TYR A 111 28.109 -5.115 5.734 1.00 0.00 H new ATOM 1693 N GLU A 112 27.402 -0.093 -1.030 1.00 0.00 N ATOM 1694 CA GLU A 112 27.967 0.882 -1.956 1.00 0.00 C ATOM 1695 C GLU A 112 29.110 1.654 -1.302 1.00 0.00 C ATOM 1696 O GLU A 112 29.391 1.482 -0.116 1.00 0.00 O ATOM 1697 CB GLU A 112 26.885 1.854 -2.430 1.00 0.00 C ATOM 1698 CG GLU A 112 26.115 1.363 -3.644 1.00 0.00 C ATOM 1699 CD GLU A 112 27.022 0.804 -4.723 1.00 0.00 C ATOM 1700 OE1 GLU A 112 27.843 1.574 -5.265 1.00 0.00 O ATOM 1701 OE2 GLU A 112 26.910 -0.402 -5.027 1.00 0.00 O ATOM 0 H GLU A 112 27.275 0.252 -0.079 1.00 0.00 H new ATOM 0 HA GLU A 112 28.362 0.342 -2.817 1.00 0.00 H new ATOM 0 HB2 GLU A 112 26.185 2.031 -1.614 1.00 0.00 H new ATOM 0 HB3 GLU A 112 27.348 2.812 -2.667 1.00 0.00 H new ATOM 0 HG2 GLU A 112 25.408 0.593 -3.334 1.00 0.00 H new ATOM 0 HG3 GLU A 112 25.531 2.186 -4.056 1.00 0.00 H new ATOM 1708 N SER A 113 29.765 2.505 -2.086 1.00 0.00 N ATOM 1709 CA SER A 113 30.880 3.300 -1.585 1.00 0.00 C ATOM 1710 C SER A 113 30.860 4.702 -2.187 1.00 0.00 C ATOM 1711 O SER A 113 30.530 4.882 -3.359 1.00 0.00 O ATOM 1712 CB SER A 113 32.209 2.614 -1.908 1.00 0.00 C ATOM 1713 OG SER A 113 32.320 1.375 -1.230 1.00 0.00 O ATOM 0 H SER A 113 29.543 2.661 -3.069 1.00 0.00 H new ATOM 0 HA SER A 113 30.777 3.385 -0.503 1.00 0.00 H new ATOM 0 HB2 SER A 113 32.287 2.452 -2.983 1.00 0.00 H new ATOM 0 HB3 SER A 113 33.036 3.264 -1.623 1.00 0.00 H new ATOM 0 HG SER A 113 33.177 0.955 -1.454 1.00 0.00 H new ATOM 1719 N ALA A 114 31.214 5.693 -1.375 1.00 0.00 N ATOM 1720 CA ALA A 114 31.239 7.079 -1.826 1.00 0.00 C ATOM 1721 C ALA A 114 32.247 7.898 -1.027 1.00 0.00 C ATOM 1722 O ALA A 114 32.061 8.137 0.167 1.00 0.00 O ATOM 1723 CB ALA A 114 29.852 7.694 -1.718 1.00 0.00 C ATOM 0 H ALA A 114 31.487 5.562 -0.401 1.00 0.00 H new ATOM 0 HA ALA A 114 31.549 7.090 -2.871 1.00 0.00 H new ATOM 0 HB1 ALA A 114 29.885 8.729 -2.058 1.00 0.00 H new ATOM 0 HB2 ALA A 114 29.155 7.131 -2.338 1.00 0.00 H new ATOM 0 HB3 ALA A 114 29.520 7.664 -0.680 1.00 0.00 H new ATOM 1729 N VAL A 115 33.315 8.326 -1.692 1.00 0.00 N ATOM 1730 CA VAL A 115 34.352 9.120 -1.044 1.00 0.00 C ATOM 1731 C VAL A 115 34.146 10.608 -1.299 1.00 0.00 C ATOM 1732 O VAL A 115 34.248 11.075 -2.435 1.00 0.00 O ATOM 1733 CB VAL A 115 35.756 8.715 -1.533 1.00 0.00 C ATOM 1734 CG1 VAL A 115 36.822 9.558 -0.850 1.00 0.00 C ATOM 1735 CG2 VAL A 115 35.998 7.234 -1.289 1.00 0.00 C ATOM 0 H VAL A 115 33.485 8.136 -2.680 1.00 0.00 H new ATOM 0 HA VAL A 115 34.278 8.925 0.026 1.00 0.00 H new ATOM 0 HB VAL A 115 35.815 8.897 -2.606 1.00 0.00 H new ATOM 0 HG11 VAL A 115 37.807 9.258 -1.207 1.00 0.00 H new ATOM 0 HG12 VAL A 115 36.657 10.610 -1.081 1.00 0.00 H new ATOM 0 HG13 VAL A 115 36.767 9.410 0.229 1.00 0.00 H new ATOM 0 HG21 VAL A 115 36.994 6.965 -1.640 1.00 0.00 H new ATOM 0 HG22 VAL A 115 35.920 7.024 -0.222 1.00 0.00 H new ATOM 0 HG23 VAL A 115 35.253 6.650 -1.829 1.00 0.00 H new ATOM 1745 N THR A 116 33.856 11.351 -0.236 1.00 0.00 N ATOM 1746 CA THR A 116 33.634 12.788 -0.345 1.00 0.00 C ATOM 1747 C THR A 116 34.842 13.485 -0.959 1.00 0.00 C ATOM 1748 O THR A 116 35.986 13.104 -0.707 1.00 0.00 O ATOM 1749 CB THR A 116 33.337 13.416 1.030 1.00 0.00 C ATOM 1750 OG1 THR A 116 34.289 12.955 1.995 1.00 0.00 O ATOM 1751 CG2 THR A 116 31.930 13.068 1.491 1.00 0.00 C ATOM 0 H THR A 116 33.769 10.982 0.711 1.00 0.00 H new ATOM 0 HA THR A 116 32.769 12.926 -0.994 1.00 0.00 H new ATOM 0 HB THR A 116 33.413 14.499 0.934 1.00 0.00 H new ATOM 0 HG1 THR A 116 33.923 13.071 2.897 1.00 0.00 H new ATOM 0 HG21 THR A 116 31.743 13.522 2.464 1.00 0.00 H new ATOM 0 HG22 THR A 116 31.206 13.446 0.769 1.00 0.00 H new ATOM 0 HG23 THR A 116 31.831 11.985 1.571 1.00 0.00 H new ATOM 1759 N ARG A 117 34.582 14.509 -1.765 1.00 0.00 N ATOM 1760 CA ARG A 117 35.649 15.260 -2.416 1.00 0.00 C ATOM 1761 C ARG A 117 36.410 16.111 -1.404 1.00 0.00 C ATOM 1762 O ARG A 117 35.900 16.456 -0.338 1.00 0.00 O ATOM 1763 CB ARG A 117 35.075 16.151 -3.519 1.00 0.00 C ATOM 1764 CG ARG A 117 34.873 15.429 -4.842 1.00 0.00 C ATOM 1765 CD ARG A 117 34.244 16.341 -5.883 1.00 0.00 C ATOM 1766 NE ARG A 117 35.136 17.433 -6.265 1.00 0.00 N ATOM 1767 CZ ARG A 117 35.044 18.088 -7.417 1.00 0.00 C ATOM 1768 NH1 ARG A 117 34.105 17.764 -8.295 1.00 0.00 N ATOM 1769 NH2 ARG A 117 35.892 19.071 -7.692 1.00 0.00 N ATOM 0 H ARG A 117 33.641 14.838 -1.983 1.00 0.00 H new ATOM 0 HA ARG A 117 36.343 14.546 -2.860 1.00 0.00 H new ATOM 0 HB2 ARG A 117 34.119 16.556 -3.186 1.00 0.00 H new ATOM 0 HB3 ARG A 117 35.743 16.998 -3.675 1.00 0.00 H new ATOM 0 HG2 ARG A 117 35.832 15.064 -5.209 1.00 0.00 H new ATOM 0 HG3 ARG A 117 34.237 14.557 -4.689 1.00 0.00 H new ATOM 0 HD2 ARG A 117 33.986 15.758 -6.767 1.00 0.00 H new ATOM 0 HD3 ARG A 117 33.315 16.753 -5.490 1.00 0.00 H new ATOM 0 HE ARG A 117 35.869 17.707 -5.612 1.00 0.00 H new ATOM 0 HH11 ARG A 117 33.451 17.010 -8.087 1.00 0.00 H new ATOM 0 HH12 ARG A 117 34.037 18.269 -9.179 1.00 0.00 H new ATOM 0 HH21 ARG A 117 36.615 19.324 -7.019 1.00 0.00 H new ATOM 0 HH22 ARG A 117 35.821 19.573 -8.577 1.00 0.00 H new ATOM 1783 N PRO A 118 37.660 16.459 -1.744 1.00 0.00 N ATOM 1784 CA PRO A 118 38.518 17.274 -0.879 1.00 0.00 C ATOM 1785 C PRO A 118 38.039 18.718 -0.782 1.00 0.00 C ATOM 1786 O PRO A 118 38.348 19.545 -1.640 1.00 0.00 O ATOM 1787 CB PRO A 118 39.883 17.209 -1.569 1.00 0.00 C ATOM 1788 CG PRO A 118 39.570 16.937 -3.000 1.00 0.00 C ATOM 1789 CD PRO A 118 38.332 16.083 -2.999 1.00 0.00 C ATOM 0 HA PRO A 118 38.526 16.908 0.148 1.00 0.00 H new ATOM 0 HB2 PRO A 118 40.430 18.145 -1.454 1.00 0.00 H new ATOM 0 HB3 PRO A 118 40.505 16.422 -1.143 1.00 0.00 H new ATOM 0 HG2 PRO A 118 39.403 17.865 -3.546 1.00 0.00 H new ATOM 0 HG3 PRO A 118 40.398 16.424 -3.490 1.00 0.00 H new ATOM 0 HD2 PRO A 118 37.704 16.284 -3.867 1.00 0.00 H new ATOM 0 HD3 PRO A 118 38.576 15.021 -3.022 1.00 0.00 H new ATOM 1797 N HIS A 119 37.281 19.016 0.269 1.00 0.00 N ATOM 1798 CA HIS A 119 36.759 20.362 0.479 1.00 0.00 C ATOM 1799 C HIS A 119 37.803 21.412 0.112 1.00 0.00 C ATOM 1800 O HIS A 119 38.922 21.398 0.627 1.00 0.00 O ATOM 1801 CB HIS A 119 36.326 20.543 1.934 1.00 0.00 C ATOM 1802 CG HIS A 119 35.274 21.593 2.120 1.00 0.00 C ATOM 1803 ND1 HIS A 119 35.418 22.889 1.673 1.00 0.00 N ATOM 1804 CD2 HIS A 119 34.056 21.532 2.707 1.00 0.00 C ATOM 1805 CE1 HIS A 119 34.335 23.581 1.979 1.00 0.00 C ATOM 1806 NE2 HIS A 119 33.493 22.780 2.606 1.00 0.00 N ATOM 0 H HIS A 119 37.015 18.344 0.988 1.00 0.00 H new ATOM 0 HA HIS A 119 35.892 20.494 -0.169 1.00 0.00 H new ATOM 0 HB2 HIS A 119 35.950 19.593 2.313 1.00 0.00 H new ATOM 0 HB3 HIS A 119 37.198 20.804 2.534 1.00 0.00 H new ATOM 0 HD2 HIS A 119 33.610 20.663 3.169 1.00 0.00 H new ATOM 0 HE1 HIS A 119 34.167 24.624 1.755 1.00 0.00 H new ATOM 0 HE2 HIS A 119 32.573 23.046 2.958 1.00 0.00 H new ATOM 1815 N THR A 120 37.431 22.323 -0.781 1.00 0.00 N ATOM 1816 CA THR A 120 38.335 23.380 -1.219 1.00 0.00 C ATOM 1817 C THR A 120 38.261 24.586 -0.289 1.00 0.00 C ATOM 1818 O THR A 120 37.174 25.042 0.067 1.00 0.00 O ATOM 1819 CB THR A 120 38.016 23.833 -2.656 1.00 0.00 C ATOM 1820 OG1 THR A 120 36.662 24.291 -2.736 1.00 0.00 O ATOM 1821 CG2 THR A 120 38.230 22.695 -3.642 1.00 0.00 C ATOM 0 H THR A 120 36.509 22.350 -1.216 1.00 0.00 H new ATOM 0 HA THR A 120 39.343 22.965 -1.193 1.00 0.00 H new ATOM 0 HB THR A 120 38.691 24.649 -2.914 1.00 0.00 H new ATOM 0 HG1 THR A 120 36.405 24.701 -1.884 1.00 0.00 H new ATOM 0 HG21 THR A 120 37.998 23.039 -4.650 1.00 0.00 H new ATOM 0 HG22 THR A 120 39.269 22.368 -3.600 1.00 0.00 H new ATOM 0 HG23 THR A 120 37.576 21.862 -3.384 1.00 0.00 H new ATOM 1829 N SER A 121 39.423 25.099 0.100 1.00 0.00 N ATOM 1830 CA SER A 121 39.490 26.252 0.990 1.00 0.00 C ATOM 1831 C SER A 121 39.573 27.550 0.194 1.00 0.00 C ATOM 1832 O SER A 121 38.821 28.492 0.440 1.00 0.00 O ATOM 1833 CB SER A 121 40.698 26.134 1.922 1.00 0.00 C ATOM 1834 OG SER A 121 41.899 25.987 1.184 1.00 0.00 O ATOM 0 H SER A 121 40.331 24.735 -0.187 1.00 0.00 H new ATOM 0 HA SER A 121 38.579 26.271 1.588 1.00 0.00 H new ATOM 0 HB2 SER A 121 40.762 27.020 2.554 1.00 0.00 H new ATOM 0 HB3 SER A 121 40.568 25.279 2.585 1.00 0.00 H new ATOM 0 HG SER A 121 42.656 25.915 1.802 1.00 0.00 H new ATOM 1840 N GLY A 122 40.494 27.592 -0.764 1.00 0.00 N ATOM 1841 CA GLY A 122 40.659 28.779 -1.583 1.00 0.00 C ATOM 1842 C GLY A 122 42.017 28.835 -2.255 1.00 0.00 C ATOM 1843 O GLY A 122 42.831 27.918 -2.137 1.00 0.00 O ATOM 0 H GLY A 122 41.129 26.825 -0.988 1.00 0.00 H new ATOM 0 HA2 GLY A 122 39.879 28.803 -2.344 1.00 0.00 H new ATOM 0 HA3 GLY A 122 40.527 29.666 -0.963 1.00 0.00 H new ATOM 1847 N PRO A 123 42.278 29.933 -2.980 1.00 0.00 N ATOM 1848 CA PRO A 123 43.546 30.131 -3.689 1.00 0.00 C ATOM 1849 C PRO A 123 44.712 30.365 -2.735 1.00 0.00 C ATOM 1850 O PRO A 123 44.520 30.506 -1.527 1.00 0.00 O ATOM 1851 CB PRO A 123 43.288 31.380 -4.535 1.00 0.00 C ATOM 1852 CG PRO A 123 42.217 32.116 -3.807 1.00 0.00 C ATOM 1853 CD PRO A 123 41.355 31.065 -3.165 1.00 0.00 C ATOM 0 HA PRO A 123 43.828 29.255 -4.273 1.00 0.00 H new ATOM 0 HB2 PRO A 123 44.189 31.986 -4.632 1.00 0.00 H new ATOM 0 HB3 PRO A 123 42.971 31.116 -5.544 1.00 0.00 H new ATOM 0 HG2 PRO A 123 42.642 32.783 -3.057 1.00 0.00 H new ATOM 0 HG3 PRO A 123 41.635 32.734 -4.490 1.00 0.00 H new ATOM 0 HD2 PRO A 123 40.944 31.408 -2.215 1.00 0.00 H new ATOM 0 HD3 PRO A 123 40.511 30.795 -3.799 1.00 0.00 H new ATOM 1861 N SER A 124 45.921 30.406 -3.284 1.00 0.00 N ATOM 1862 CA SER A 124 47.120 30.621 -2.481 1.00 0.00 C ATOM 1863 C SER A 124 47.500 32.098 -2.457 1.00 0.00 C ATOM 1864 O SER A 124 47.461 32.777 -3.482 1.00 0.00 O ATOM 1865 CB SER A 124 48.282 29.792 -3.030 1.00 0.00 C ATOM 1866 OG SER A 124 48.547 30.118 -4.384 1.00 0.00 O ATOM 0 H SER A 124 46.097 30.293 -4.282 1.00 0.00 H new ATOM 0 HA SER A 124 46.906 30.303 -1.461 1.00 0.00 H new ATOM 0 HB2 SER A 124 49.174 29.968 -2.429 1.00 0.00 H new ATOM 0 HB3 SER A 124 48.047 28.731 -2.948 1.00 0.00 H new ATOM 0 HG SER A 124 49.295 29.576 -4.711 1.00 0.00 H new ATOM 1872 N SER A 125 47.868 32.588 -1.277 1.00 0.00 N ATOM 1873 CA SER A 125 48.252 33.986 -1.117 1.00 0.00 C ATOM 1874 C SER A 125 49.539 34.106 -0.306 1.00 0.00 C ATOM 1875 O SER A 125 49.987 33.143 0.316 1.00 0.00 O ATOM 1876 CB SER A 125 47.131 34.770 -0.433 1.00 0.00 C ATOM 1877 OG SER A 125 47.005 34.397 0.929 1.00 0.00 O ATOM 0 H SER A 125 47.908 32.038 -0.419 1.00 0.00 H new ATOM 0 HA SER A 125 48.426 34.405 -2.108 1.00 0.00 H new ATOM 0 HB2 SER A 125 47.335 35.838 -0.503 1.00 0.00 H new ATOM 0 HB3 SER A 125 46.189 34.591 -0.951 1.00 0.00 H new ATOM 0 HG SER A 125 46.283 34.913 1.344 1.00 0.00 H new ATOM 1883 N GLY A 126 50.131 35.296 -0.319 1.00 0.00 N ATOM 1884 CA GLY A 126 51.361 35.522 0.417 1.00 0.00 C ATOM 1885 C GLY A 126 51.239 36.655 1.416 1.00 0.00 C ATOM 1886 O GLY A 126 51.614 37.791 1.125 1.00 0.00 O ATOM 0 H GLY A 126 49.780 36.108 -0.827 1.00 0.00 H new ATOM 0 HA2 GLY A 126 51.640 34.608 0.941 1.00 0.00 H new ATOM 0 HA3 GLY A 126 52.165 35.745 -0.285 1.00 0.00 H new TER 1890 GLY A 126