USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 896 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 62 THR OG1 : rot 180:sc= -0.705 USER MOD Set 1.2: A 104 ASN : amide:sc= -4.58! C(o=-5.3!,f=-13!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 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 USER MOD Single : A 8 CYS SG : rot 180:sc= -0.246 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.233 K(o=-0.23,f=-2.6!) USER MOD Single : A 16 GLN : amide:sc= -0.0188 X(o=-0.019,f=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.0286 K(o=-0.029,f=-1.4) USER MOD Single : A 20 GLN : amide:sc= -0.27 X(o=-0.27,f=-0.58) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 CYS SG : rot 180:sc= -1.47 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= -2.54! X(o=-2.5!,f=-2.6) USER MOD Single : A 34 SER OG : rot -56:sc= 0.61 USER MOD Single : A 36 GLN : amide:sc= -2.27 K(o=-2.3,f=-0.42) USER MOD Single : A 54 GLN : amide:sc= -2.73 X(o=-2.7,f=-2.9!) USER MOD Single : A 56 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 170:sc= -0.123 (180deg=-0.346) USER MOD Single : A 76 TYR OH : rot 180:sc= -0.0633 USER MOD Single : A 78 ASN : amide:sc= -0.685 X(o=-0.69,f=-0.98!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -28:sc= 0.425 USER MOD Single : A 88 HIS : no HD1:sc= -1.37 K(o=-1.2,f=-4.8!) USER MOD Single : A 90 TYR OH : rot 180:sc= -0.0307 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 142:sc= 1.18 USER MOD Single : A 99 SER OG : rot -172:sc= -0.821 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 HIS : no HD1:sc= -0.508 K(o=-0.51,f=-1.3!) USER MOD Single : A 116 GLN : amide:sc= -0.186 X(o=-0.19,f=0.012) USER MOD Single : A 118 SER OG : rot 180:sc= 0.0275 USER MOD Single : A 121 SER OG : rot 180:sc= -0.0136 USER MOD Single : A 122 SER OG : rot 180:sc= -0.0131 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.714 4.006 3.236 1.00 0.00 N ATOM 2 CA GLY A 1 -10.783 4.557 4.203 1.00 0.00 C ATOM 3 C GLY A 1 -11.264 4.389 5.631 1.00 0.00 C ATOM 4 O GLY A 1 -12.436 4.617 5.930 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.340 4.146 2.276 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.839 2.989 3.415 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.631 4.488 3.324 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.815 4.070 4.089 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.633 5.617 3.996 1.00 0.00 H new ATOM 8 N SER A 2 -10.357 3.986 6.516 1.00 0.00 N ATOM 9 CA SER A 2 -10.696 3.782 7.919 1.00 0.00 C ATOM 10 C SER A 2 -9.504 4.097 8.817 1.00 0.00 C ATOM 11 O SER A 2 -8.522 3.356 8.847 1.00 0.00 O ATOM 12 CB SER A 2 -11.157 2.342 8.150 1.00 0.00 C ATOM 13 OG SER A 2 -11.757 2.196 9.426 1.00 0.00 O ATOM 0 H SER A 2 -9.382 3.794 6.286 1.00 0.00 H new ATOM 0 HA SER A 2 -11.510 4.461 8.173 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.869 2.056 7.375 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.306 1.667 8.066 1.00 0.00 H new ATOM 0 HG SER A 2 -12.044 1.267 9.548 1.00 0.00 H new ATOM 19 N SER A 3 -9.598 5.203 9.549 1.00 0.00 N ATOM 20 CA SER A 3 -8.527 5.619 10.446 1.00 0.00 C ATOM 21 C SER A 3 -8.937 5.437 11.904 1.00 0.00 C ATOM 22 O SER A 3 -8.186 4.888 12.708 1.00 0.00 O ATOM 23 CB SER A 3 -8.156 7.081 10.187 1.00 0.00 C ATOM 24 OG SER A 3 -6.997 7.450 10.915 1.00 0.00 O ATOM 0 H SER A 3 -10.405 5.827 9.538 1.00 0.00 H new ATOM 0 HA SER A 3 -7.658 4.990 10.251 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.983 7.232 9.121 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.988 7.726 10.470 1.00 0.00 H new ATOM 0 HG SER A 3 -6.780 8.388 10.731 1.00 0.00 H new ATOM 30 N GLY A 4 -10.137 5.904 12.237 1.00 0.00 N ATOM 31 CA GLY A 4 -10.628 5.783 13.598 1.00 0.00 C ATOM 32 C GLY A 4 -12.140 5.858 13.677 1.00 0.00 C ATOM 33 O GLY A 4 -12.795 6.320 12.743 1.00 0.00 O ATOM 0 H GLY A 4 -10.777 6.363 11.589 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.292 4.836 14.020 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.195 6.575 14.209 1.00 0.00 H new ATOM 37 N SER A 5 -12.695 5.400 14.795 1.00 0.00 N ATOM 38 CA SER A 5 -14.140 5.411 14.990 1.00 0.00 C ATOM 39 C SER A 5 -14.607 6.767 15.511 1.00 0.00 C ATOM 40 O SER A 5 -15.614 7.308 15.053 1.00 0.00 O ATOM 41 CB SER A 5 -14.553 4.308 15.966 1.00 0.00 C ATOM 42 OG SER A 5 -14.586 3.045 15.324 1.00 0.00 O ATOM 0 H SER A 5 -12.166 5.017 15.579 1.00 0.00 H new ATOM 0 HA SER A 5 -14.613 5.228 14.025 1.00 0.00 H new ATOM 0 HB2 SER A 5 -13.854 4.277 16.801 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.535 4.534 16.381 1.00 0.00 H new ATOM 0 HG SER A 5 -14.851 2.357 15.969 1.00 0.00 H new ATOM 48 N SER A 6 -13.868 7.311 16.473 1.00 0.00 N ATOM 49 CA SER A 6 -14.208 8.602 17.060 1.00 0.00 C ATOM 50 C SER A 6 -13.200 9.669 16.645 1.00 0.00 C ATOM 51 O SER A 6 -11.997 9.417 16.595 1.00 0.00 O ATOM 52 CB SER A 6 -14.255 8.495 18.585 1.00 0.00 C ATOM 53 OG SER A 6 -12.981 8.743 19.154 1.00 0.00 O ATOM 0 H SER A 6 -13.030 6.878 16.862 1.00 0.00 H new ATOM 0 HA SER A 6 -15.192 8.893 16.692 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.978 9.208 18.980 1.00 0.00 H new ATOM 0 HB3 SER A 6 -14.598 7.501 18.872 1.00 0.00 H new ATOM 0 HG SER A 6 -13.039 8.670 20.130 1.00 0.00 H new ATOM 59 N GLY A 7 -13.701 10.864 16.347 1.00 0.00 N ATOM 60 CA GLY A 7 -12.832 11.953 15.939 1.00 0.00 C ATOM 61 C GLY A 7 -13.408 13.313 16.280 1.00 0.00 C ATOM 62 O GLY A 7 -14.487 13.674 15.807 1.00 0.00 O ATOM 0 H GLY A 7 -14.693 11.098 16.381 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.862 11.841 16.423 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.660 11.894 14.864 1.00 0.00 H new ATOM 66 N CYS A 8 -12.690 14.068 17.104 1.00 0.00 N ATOM 67 CA CYS A 8 -13.138 15.396 17.509 1.00 0.00 C ATOM 68 C CYS A 8 -12.385 16.480 16.746 1.00 0.00 C ATOM 69 O CYS A 8 -12.971 17.478 16.328 1.00 0.00 O ATOM 70 CB CYS A 8 -12.942 15.585 19.014 1.00 0.00 C ATOM 71 SG CYS A 8 -11.238 15.352 19.572 1.00 0.00 S ATOM 0 H CYS A 8 -11.796 13.784 17.505 1.00 0.00 H new ATOM 0 HA CYS A 8 -14.199 15.482 17.274 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -13.269 16.588 19.289 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -13.586 14.883 19.544 1.00 0.00 H new ATOM 0 HG CYS A 8 -11.173 15.535 20.857 1.00 0.00 H new ATOM 77 N GLU A 9 -11.083 16.278 16.570 1.00 0.00 N ATOM 78 CA GLU A 9 -10.250 17.240 15.859 1.00 0.00 C ATOM 79 C GLU A 9 -10.943 17.728 14.590 1.00 0.00 C ATOM 80 O GLU A 9 -11.673 16.978 13.942 1.00 0.00 O ATOM 81 CB GLU A 9 -8.898 16.616 15.507 1.00 0.00 C ATOM 82 CG GLU A 9 -7.762 17.624 15.438 1.00 0.00 C ATOM 83 CD GLU A 9 -7.748 18.398 14.135 1.00 0.00 C ATOM 84 OE1 GLU A 9 -7.654 17.758 13.066 1.00 0.00 O ATOM 85 OE2 GLU A 9 -7.830 19.643 14.183 1.00 0.00 O ATOM 0 H GLU A 9 -10.583 15.457 16.910 1.00 0.00 H new ATOM 0 HA GLU A 9 -10.088 18.095 16.515 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -8.654 15.856 16.249 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -8.981 16.108 14.546 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -7.850 18.322 16.270 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -6.812 17.104 15.557 1.00 0.00 H new ATOM 92 N GLY A 10 -10.710 18.989 14.242 1.00 0.00 N ATOM 93 CA GLY A 10 -11.319 19.556 13.053 1.00 0.00 C ATOM 94 C GLY A 10 -10.871 20.980 12.794 1.00 0.00 C ATOM 95 O GLY A 10 -10.161 21.573 13.606 1.00 0.00 O ATOM 0 H GLY A 10 -10.110 19.629 14.762 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -11.069 18.938 12.191 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -12.404 19.533 13.158 1.00 0.00 H new ATOM 99 N GLY A 11 -11.284 21.532 11.657 1.00 0.00 N ATOM 100 CA GLY A 11 -10.909 22.891 11.313 1.00 0.00 C ATOM 101 C GLY A 11 -10.828 23.109 9.815 1.00 0.00 C ATOM 102 O GLY A 11 -11.186 22.228 9.032 1.00 0.00 O ATOM 0 H GLY A 11 -11.872 21.062 10.968 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -11.635 23.584 11.739 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.944 23.123 11.763 1.00 0.00 H new ATOM 106 N VAL A 12 -10.359 24.286 9.414 1.00 0.00 N ATOM 107 CA VAL A 12 -10.234 24.617 7.999 1.00 0.00 C ATOM 108 C VAL A 12 -9.408 25.883 7.802 1.00 0.00 C ATOM 109 O VAL A 12 -9.445 26.795 8.629 1.00 0.00 O ATOM 110 CB VAL A 12 -11.614 24.810 7.343 1.00 0.00 C ATOM 111 CG1 VAL A 12 -12.350 25.977 7.982 1.00 0.00 C ATOM 112 CG2 VAL A 12 -11.466 25.018 5.844 1.00 0.00 C ATOM 0 H VAL A 12 -10.059 25.026 10.048 1.00 0.00 H new ATOM 0 HA VAL A 12 -9.728 23.778 7.521 1.00 0.00 H new ATOM 0 HB VAL A 12 -12.204 23.908 7.505 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -13.323 26.098 7.506 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -12.488 25.782 9.045 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -11.767 26.889 7.854 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -12.451 25.153 5.396 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -10.859 25.904 5.658 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -10.983 24.147 5.402 1.00 0.00 H new ATOM 122 N ASP A 13 -8.664 25.933 6.703 1.00 0.00 N ATOM 123 CA ASP A 13 -7.830 27.089 6.396 1.00 0.00 C ATOM 124 C ASP A 13 -8.667 28.225 5.817 1.00 0.00 C ATOM 125 O ASP A 13 -9.800 28.015 5.382 1.00 0.00 O ATOM 126 CB ASP A 13 -6.725 26.700 5.412 1.00 0.00 C ATOM 127 CG ASP A 13 -7.262 25.967 4.198 1.00 0.00 C ATOM 128 OD1 ASP A 13 -8.093 26.551 3.472 1.00 0.00 O ATOM 129 OD2 ASP A 13 -6.853 24.808 3.976 1.00 0.00 O ATOM 0 H ASP A 13 -8.621 25.186 6.010 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.375 27.434 7.324 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -6.199 27.598 5.087 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -5.995 26.069 5.920 1.00 0.00 H new ATOM 134 N MET A 14 -8.103 29.428 5.815 1.00 0.00 N ATOM 135 CA MET A 14 -8.798 30.597 5.290 1.00 0.00 C ATOM 136 C MET A 14 -9.007 30.474 3.784 1.00 0.00 C ATOM 137 O MET A 14 -8.452 29.582 3.143 1.00 0.00 O ATOM 138 CB MET A 14 -8.010 31.870 5.604 1.00 0.00 C ATOM 139 CG MET A 14 -6.557 31.811 5.160 1.00 0.00 C ATOM 140 SD MET A 14 -5.761 33.429 5.171 1.00 0.00 S ATOM 141 CE MET A 14 -5.256 33.545 6.886 1.00 0.00 C ATOM 0 H MET A 14 -7.166 29.619 6.171 1.00 0.00 H new ATOM 0 HA MET A 14 -9.774 30.654 5.772 1.00 0.00 H new ATOM 0 HB2 MET A 14 -8.495 32.717 5.119 1.00 0.00 H new ATOM 0 HB3 MET A 14 -8.046 32.054 6.678 1.00 0.00 H new ATOM 0 HG2 MET A 14 -6.008 31.136 5.816 1.00 0.00 H new ATOM 0 HG3 MET A 14 -6.505 31.392 4.155 1.00 0.00 H new ATOM 0 HE1 MET A 14 -4.747 34.495 7.052 1.00 0.00 H new ATOM 0 HE2 MET A 14 -6.134 33.487 7.529 1.00 0.00 H new ATOM 0 HE3 MET A 14 -4.579 32.724 7.122 1.00 0.00 H new ATOM 151 N GLN A 15 -9.811 31.374 3.227 1.00 0.00 N ATOM 152 CA GLN A 15 -10.093 31.364 1.796 1.00 0.00 C ATOM 153 C GLN A 15 -9.769 32.716 1.168 1.00 0.00 C ATOM 154 O GLN A 15 -9.713 33.733 1.858 1.00 0.00 O ATOM 155 CB GLN A 15 -11.560 31.012 1.547 1.00 0.00 C ATOM 156 CG GLN A 15 -11.878 29.541 1.766 1.00 0.00 C ATOM 157 CD GLN A 15 -11.446 28.671 0.603 1.00 0.00 C ATOM 158 OE1 GLN A 15 -10.261 28.595 0.276 1.00 0.00 O ATOM 159 NE2 GLN A 15 -12.407 28.007 -0.030 1.00 0.00 N ATOM 0 H GLN A 15 -10.278 32.119 3.744 1.00 0.00 H new ATOM 0 HA GLN A 15 -9.461 30.607 1.332 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -12.186 31.613 2.207 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -11.822 31.284 0.524 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -11.384 29.198 2.675 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -12.950 29.425 1.923 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -13.376 28.099 0.274 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -12.176 27.405 -0.820 1.00 0.00 H new ATOM 168 N GLN A 16 -9.555 32.717 -0.144 1.00 0.00 N ATOM 169 CA GLN A 16 -9.235 33.944 -0.864 1.00 0.00 C ATOM 170 C GLN A 16 -9.367 33.741 -2.370 1.00 0.00 C ATOM 171 O GLN A 16 -9.106 32.654 -2.885 1.00 0.00 O ATOM 172 CB GLN A 16 -7.818 34.406 -0.522 1.00 0.00 C ATOM 173 CG GLN A 16 -7.439 35.731 -1.163 1.00 0.00 C ATOM 174 CD GLN A 16 -6.233 36.374 -0.506 1.00 0.00 C ATOM 175 OE1 GLN A 16 -5.174 36.507 -1.121 1.00 0.00 O ATOM 176 NE2 GLN A 16 -6.388 36.777 0.749 1.00 0.00 N ATOM 0 H GLN A 16 -9.597 31.883 -0.729 1.00 0.00 H new ATOM 0 HA GLN A 16 -9.944 34.712 -0.556 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -7.725 34.496 0.560 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -7.109 33.642 -0.840 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -7.230 35.572 -2.221 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -8.287 36.414 -1.105 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -7.284 36.647 1.220 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -5.612 37.217 1.243 1.00 0.00 H new ATOM 185 N SER A 17 -9.774 34.794 -3.071 1.00 0.00 N ATOM 186 CA SER A 17 -9.944 34.731 -4.518 1.00 0.00 C ATOM 187 C SER A 17 -8.594 34.627 -5.220 1.00 0.00 C ATOM 188 O SER A 17 -7.775 35.543 -5.150 1.00 0.00 O ATOM 189 CB SER A 17 -10.699 35.964 -5.018 1.00 0.00 C ATOM 190 OG SER A 17 -12.075 35.889 -4.687 1.00 0.00 O ATOM 0 H SER A 17 -9.992 35.702 -2.660 1.00 0.00 H new ATOM 0 HA SER A 17 -10.525 33.839 -4.752 1.00 0.00 H new ATOM 0 HB2 SER A 17 -10.265 36.863 -4.580 1.00 0.00 H new ATOM 0 HB3 SER A 17 -10.586 36.050 -6.099 1.00 0.00 H new ATOM 0 HG SER A 17 -12.535 36.690 -5.016 1.00 0.00 H new ATOM 196 N GLN A 18 -8.369 33.505 -5.895 1.00 0.00 N ATOM 197 CA GLN A 18 -7.118 33.280 -6.609 1.00 0.00 C ATOM 198 C GLN A 18 -7.373 32.620 -7.960 1.00 0.00 C ATOM 199 O GLN A 18 -8.431 32.033 -8.186 1.00 0.00 O ATOM 200 CB GLN A 18 -6.177 32.411 -5.773 1.00 0.00 C ATOM 201 CG GLN A 18 -5.528 33.155 -4.617 1.00 0.00 C ATOM 202 CD GLN A 18 -5.072 32.228 -3.508 1.00 0.00 C ATOM 203 OE1 GLN A 18 -5.158 31.005 -3.631 1.00 0.00 O ATOM 204 NE2 GLN A 18 -4.584 32.805 -2.416 1.00 0.00 N ATOM 0 H GLN A 18 -9.037 32.737 -5.963 1.00 0.00 H new ATOM 0 HA GLN A 18 -6.649 34.249 -6.781 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -6.734 31.561 -5.380 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -5.397 32.009 -6.419 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -4.673 33.719 -4.988 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -6.236 33.878 -4.212 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -4.531 33.822 -2.357 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -4.262 32.231 -1.637 1.00 0.00 H new ATOM 213 N VAL A 19 -6.396 32.720 -8.856 1.00 0.00 N ATOM 214 CA VAL A 19 -6.515 32.132 -10.185 1.00 0.00 C ATOM 215 C VAL A 19 -5.409 31.113 -10.435 1.00 0.00 C ATOM 216 O VAL A 19 -5.637 30.075 -11.056 1.00 0.00 O ATOM 217 CB VAL A 19 -6.462 33.211 -11.283 1.00 0.00 C ATOM 218 CG1 VAL A 19 -5.167 34.003 -11.192 1.00 0.00 C ATOM 219 CG2 VAL A 19 -6.614 32.578 -12.658 1.00 0.00 C ATOM 0 H VAL A 19 -5.514 33.203 -8.686 1.00 0.00 H new ATOM 0 HA VAL A 19 -7.482 31.631 -10.225 1.00 0.00 H new ATOM 0 HB VAL A 19 -7.292 33.901 -11.131 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -5.148 34.760 -11.976 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -5.104 34.487 -10.218 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -4.319 33.330 -11.317 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -6.574 33.354 -13.422 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -5.805 31.866 -12.822 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -7.571 32.060 -12.716 1.00 0.00 H new ATOM 229 N GLN A 20 -4.210 31.417 -9.948 1.00 0.00 N ATOM 230 CA GLN A 20 -3.068 30.527 -10.119 1.00 0.00 C ATOM 231 C GLN A 20 -2.031 30.755 -9.025 1.00 0.00 C ATOM 232 O GLN A 20 -1.854 31.877 -8.546 1.00 0.00 O ATOM 233 CB GLN A 20 -2.431 30.739 -11.494 1.00 0.00 C ATOM 234 CG GLN A 20 -3.031 29.866 -12.584 1.00 0.00 C ATOM 235 CD GLN A 20 -2.798 28.387 -12.342 1.00 0.00 C ATOM 236 OE1 GLN A 20 -3.620 27.710 -11.724 1.00 0.00 O ATOM 237 NE2 GLN A 20 -1.672 27.878 -12.828 1.00 0.00 N ATOM 0 H GLN A 20 -4.005 32.273 -9.432 1.00 0.00 H new ATOM 0 HA GLN A 20 -3.426 29.500 -10.046 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -2.539 31.786 -11.778 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -1.362 30.536 -11.425 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -4.103 30.055 -12.647 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -2.601 30.145 -13.546 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -1.019 28.476 -13.334 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -1.460 26.889 -12.695 1.00 0.00 H new ATOM 246 N LEU A 21 -1.347 29.686 -8.632 1.00 0.00 N ATOM 247 CA LEU A 21 -0.327 29.769 -7.593 1.00 0.00 C ATOM 248 C LEU A 21 0.435 28.453 -7.471 1.00 0.00 C ATOM 249 O LEU A 21 -0.149 27.376 -7.581 1.00 0.00 O ATOM 250 CB LEU A 21 -0.967 30.128 -6.250 1.00 0.00 C ATOM 251 CG LEU A 21 -1.721 29.001 -5.544 1.00 0.00 C ATOM 252 CD1 LEU A 21 -1.662 29.184 -4.035 1.00 0.00 C ATOM 253 CD2 LEU A 21 -3.165 28.945 -6.020 1.00 0.00 C ATOM 0 H LEU A 21 -1.481 28.751 -9.018 1.00 0.00 H new ATOM 0 HA LEU A 21 0.379 30.551 -7.873 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -0.185 30.489 -5.582 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -1.657 30.956 -6.409 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.240 28.055 -5.794 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.204 28.373 -3.549 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -0.622 29.173 -3.708 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -2.117 30.137 -3.766 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.686 28.137 -5.507 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.658 29.892 -5.800 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -3.187 28.766 -7.095 1.00 0.00 H new ATOM 265 N GLN A 22 1.740 28.550 -7.241 1.00 0.00 N ATOM 266 CA GLN A 22 2.581 27.367 -7.103 1.00 0.00 C ATOM 267 C GLN A 22 2.393 26.723 -5.733 1.00 0.00 C ATOM 268 O GLN A 22 2.412 27.405 -4.708 1.00 0.00 O ATOM 269 CB GLN A 22 4.051 27.733 -7.309 1.00 0.00 C ATOM 270 CG GLN A 22 4.527 28.869 -6.418 1.00 0.00 C ATOM 271 CD GLN A 22 6.034 28.899 -6.264 1.00 0.00 C ATOM 272 OE1 GLN A 22 6.770 28.930 -7.251 1.00 0.00 O ATOM 273 NE2 GLN A 22 6.503 28.889 -5.022 1.00 0.00 N ATOM 0 H GLN A 22 2.238 29.435 -7.146 1.00 0.00 H new ATOM 0 HA GLN A 22 2.282 26.649 -7.867 1.00 0.00 H new ATOM 0 HB2 GLN A 22 4.666 26.853 -7.120 1.00 0.00 H new ATOM 0 HB3 GLN A 22 4.205 28.012 -8.352 1.00 0.00 H new ATOM 0 HG2 GLN A 22 4.189 29.818 -6.835 1.00 0.00 H new ATOM 0 HG3 GLN A 22 4.067 28.771 -5.435 1.00 0.00 H new ATOM 0 HE21 GLN A 22 5.857 28.863 -4.233 1.00 0.00 H new ATOM 0 HE22 GLN A 22 7.509 28.907 -4.857 1.00 0.00 H new ATOM 282 N CYS A 23 2.210 25.407 -5.724 1.00 0.00 N ATOM 283 CA CYS A 23 2.017 24.671 -4.480 1.00 0.00 C ATOM 284 C CYS A 23 3.053 23.561 -4.338 1.00 0.00 C ATOM 285 O CYS A 23 3.338 22.820 -5.280 1.00 0.00 O ATOM 286 CB CYS A 23 0.608 24.079 -4.427 1.00 0.00 C ATOM 287 SG CYS A 23 -0.080 23.958 -2.759 1.00 0.00 S ATOM 0 H CYS A 23 2.191 24.828 -6.564 1.00 0.00 H new ATOM 0 HA CYS A 23 2.142 25.368 -3.651 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -0.055 24.691 -5.038 1.00 0.00 H new ATOM 0 HB3 CYS A 23 0.626 23.085 -4.874 1.00 0.00 H new ATOM 0 HG CYS A 23 -1.274 23.448 -2.818 1.00 0.00 H new ATOM 293 N PRO A 24 3.634 23.443 -3.135 1.00 0.00 N ATOM 294 CA PRO A 24 4.649 22.427 -2.842 1.00 0.00 C ATOM 295 C PRO A 24 4.066 21.018 -2.808 1.00 0.00 C ATOM 296 O PRO A 24 2.955 20.783 -3.284 1.00 0.00 O ATOM 297 CB PRO A 24 5.162 22.827 -1.457 1.00 0.00 C ATOM 298 CG PRO A 24 4.035 23.579 -0.838 1.00 0.00 C ATOM 299 CD PRO A 24 3.343 24.292 -1.968 1.00 0.00 C ATOM 0 HA PRO A 24 5.426 22.395 -3.606 1.00 0.00 H new ATOM 0 HB2 PRO A 24 5.426 21.951 -0.865 1.00 0.00 H new ATOM 0 HB3 PRO A 24 6.057 23.444 -1.530 1.00 0.00 H new ATOM 0 HG2 PRO A 24 3.350 22.904 -0.325 1.00 0.00 H new ATOM 0 HG3 PRO A 24 4.400 24.288 -0.095 1.00 0.00 H new ATOM 0 HD2 PRO A 24 2.271 24.379 -1.792 1.00 0.00 H new ATOM 0 HD3 PRO A 24 3.728 25.303 -2.101 1.00 0.00 H new ATOM 307 N LEU A 25 4.822 20.084 -2.242 1.00 0.00 N ATOM 308 CA LEU A 25 4.380 18.697 -2.145 1.00 0.00 C ATOM 309 C LEU A 25 2.870 18.619 -1.942 1.00 0.00 C ATOM 310 O LEU A 25 2.265 19.514 -1.349 1.00 0.00 O ATOM 311 CB LEU A 25 5.098 17.991 -0.993 1.00 0.00 C ATOM 312 CG LEU A 25 5.309 18.820 0.274 1.00 0.00 C ATOM 313 CD1 LEU A 25 4.095 18.722 1.185 1.00 0.00 C ATOM 314 CD2 LEU A 25 6.564 18.367 1.005 1.00 0.00 C ATOM 0 H LEU A 25 5.744 20.262 -1.843 1.00 0.00 H new ATOM 0 HA LEU A 25 4.628 18.197 -3.081 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.530 17.099 -0.729 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.072 17.655 -1.350 1.00 0.00 H new ATOM 0 HG LEU A 25 5.437 19.863 -0.015 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.264 19.318 2.082 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.216 19.096 0.661 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.934 17.681 1.467 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.698 18.968 1.904 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.465 17.317 1.282 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.429 18.491 0.354 1.00 0.00 H new ATOM 326 N THR A 26 2.266 17.543 -2.436 1.00 0.00 N ATOM 327 CA THR A 26 0.827 17.348 -2.308 1.00 0.00 C ATOM 328 C THR A 26 0.511 16.033 -1.605 1.00 0.00 C ATOM 329 O THR A 26 1.220 15.037 -1.751 1.00 0.00 O ATOM 330 CB THR A 26 0.134 17.361 -3.683 1.00 0.00 C ATOM 331 OG1 THR A 26 1.011 16.822 -4.679 1.00 0.00 O ATOM 332 CG2 THR A 26 -0.273 18.774 -4.070 1.00 0.00 C ATOM 0 H THR A 26 2.751 16.793 -2.929 1.00 0.00 H new ATOM 0 HA THR A 26 0.448 18.177 -1.710 1.00 0.00 H new ATOM 0 HB THR A 26 -0.764 16.746 -3.619 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.562 16.832 -5.550 1.00 0.00 H new ATOM 0 HG21 THR A 26 -0.760 18.758 -5.045 1.00 0.00 H new ATOM 0 HG22 THR A 26 -0.963 19.171 -3.325 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.613 19.408 -4.118 1.00 0.00 H new ATOM 340 N PRO A 27 -0.578 16.026 -0.822 1.00 0.00 N ATOM 341 CA PRO A 27 -1.013 14.838 -0.082 1.00 0.00 C ATOM 342 C PRO A 27 -1.547 13.745 -1.001 1.00 0.00 C ATOM 343 O PRO A 27 -2.120 14.013 -2.057 1.00 0.00 O ATOM 344 CB PRO A 27 -2.130 15.372 0.819 1.00 0.00 C ATOM 345 CG PRO A 27 -2.650 16.573 0.107 1.00 0.00 C ATOM 346 CD PRO A 27 -1.469 17.177 -0.601 1.00 0.00 C ATOM 0 HA PRO A 27 -0.191 14.374 0.463 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -2.913 14.627 0.963 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -1.751 15.631 1.808 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -3.432 16.299 -0.602 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -3.090 17.283 0.808 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.761 17.646 -1.541 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -0.989 17.947 0.003 1.00 0.00 H new ATOM 354 N PRO A 28 -1.355 12.482 -0.593 1.00 0.00 N ATOM 355 CA PRO A 28 -1.811 11.322 -1.365 1.00 0.00 C ATOM 356 C PRO A 28 -3.330 11.193 -1.375 1.00 0.00 C ATOM 357 O PRO A 28 -3.958 11.061 -0.324 1.00 0.00 O ATOM 358 CB PRO A 28 -1.178 10.137 -0.633 1.00 0.00 C ATOM 359 CG PRO A 28 -0.976 10.618 0.763 1.00 0.00 C ATOM 360 CD PRO A 28 -0.680 12.088 0.655 1.00 0.00 C ATOM 0 HA PRO A 28 -1.525 11.393 -2.415 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -1.828 9.262 -0.660 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -0.233 9.847 -1.092 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.865 10.442 1.369 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -0.153 10.088 1.243 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -1.066 12.640 1.512 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.392 12.280 0.610 1.00 0.00 H new ATOM 368 N ARG A 29 -3.915 11.231 -2.568 1.00 0.00 N ATOM 369 CA ARG A 29 -5.362 11.118 -2.713 1.00 0.00 C ATOM 370 C ARG A 29 -5.738 9.819 -3.420 1.00 0.00 C ATOM 371 O ARG A 29 -4.928 9.236 -4.140 1.00 0.00 O ATOM 372 CB ARG A 29 -5.912 12.314 -3.493 1.00 0.00 C ATOM 373 CG ARG A 29 -7.376 12.605 -3.209 1.00 0.00 C ATOM 374 CD ARG A 29 -7.782 13.975 -3.727 1.00 0.00 C ATOM 375 NE ARG A 29 -9.021 14.447 -3.114 1.00 0.00 N ATOM 376 CZ ARG A 29 -9.073 15.046 -1.929 1.00 0.00 C ATOM 377 NH1 ARG A 29 -7.962 15.245 -1.234 1.00 0.00 N ATOM 378 NH2 ARG A 29 -10.238 15.447 -1.438 1.00 0.00 N ATOM 0 H ARG A 29 -3.410 11.339 -3.448 1.00 0.00 H new ATOM 0 HA ARG A 29 -5.803 11.109 -1.716 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.321 13.197 -3.251 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -5.787 12.129 -4.560 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -7.997 11.840 -3.675 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -7.557 12.552 -2.135 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -6.983 14.689 -3.527 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -7.907 13.931 -4.809 1.00 0.00 H new ATOM 0 HE ARG A 29 -9.894 14.309 -3.623 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -7.064 14.938 -1.609 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -8.005 15.705 -0.325 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -11.095 15.296 -1.970 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -10.277 15.907 -0.528 1.00 0.00 H new ATOM 392 N GLY A 30 -6.972 9.372 -3.209 1.00 0.00 N ATOM 393 CA GLY A 30 -7.433 8.145 -3.832 1.00 0.00 C ATOM 394 C GLY A 30 -6.378 7.057 -3.820 1.00 0.00 C ATOM 395 O GLY A 30 -6.202 6.342 -4.808 1.00 0.00 O ATOM 0 H GLY A 30 -7.661 9.838 -2.618 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -8.323 7.790 -3.313 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -7.726 8.352 -4.861 1.00 0.00 H new ATOM 399 N LEU A 31 -5.673 6.931 -2.702 1.00 0.00 N ATOM 400 CA LEU A 31 -4.628 5.922 -2.566 1.00 0.00 C ATOM 401 C LEU A 31 -5.228 4.552 -2.267 1.00 0.00 C ATOM 402 O LEU A 31 -5.791 4.331 -1.195 1.00 0.00 O ATOM 403 CB LEU A 31 -3.652 6.317 -1.455 1.00 0.00 C ATOM 404 CG LEU A 31 -2.395 5.455 -1.329 1.00 0.00 C ATOM 405 CD1 LEU A 31 -2.741 4.085 -0.768 1.00 0.00 C ATOM 406 CD2 LEU A 31 -1.702 5.322 -2.678 1.00 0.00 C ATOM 0 H LEU A 31 -5.806 7.515 -1.876 1.00 0.00 H new ATOM 0 HA LEU A 31 -4.089 5.863 -3.512 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -3.345 7.350 -1.619 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.184 6.289 -0.504 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.710 5.945 -0.638 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -1.834 3.486 -0.686 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.192 4.199 0.218 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.446 3.587 -1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.810 4.706 -2.569 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.381 4.855 -3.391 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.418 6.310 -3.040 1.00 0.00 H new ATOM 418 N GLN A 32 -5.103 3.636 -3.222 1.00 0.00 N ATOM 419 CA GLN A 32 -5.633 2.287 -3.060 1.00 0.00 C ATOM 420 C GLN A 32 -4.760 1.269 -3.787 1.00 0.00 C ATOM 421 O GLN A 32 -4.027 1.613 -4.714 1.00 0.00 O ATOM 422 CB GLN A 32 -7.068 2.213 -3.586 1.00 0.00 C ATOM 423 CG GLN A 32 -7.176 2.411 -5.089 1.00 0.00 C ATOM 424 CD GLN A 32 -7.223 3.874 -5.483 1.00 0.00 C ATOM 425 OE1 GLN A 32 -8.166 4.591 -5.145 1.00 0.00 O ATOM 426 NE2 GLN A 32 -6.203 4.327 -6.203 1.00 0.00 N ATOM 0 H GLN A 32 -4.640 3.803 -4.115 1.00 0.00 H new ATOM 0 HA GLN A 32 -5.631 2.048 -1.997 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -7.493 1.244 -3.324 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -7.670 2.971 -3.084 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -6.325 1.935 -5.576 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -8.073 1.911 -5.454 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -5.442 3.699 -6.461 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -6.180 5.303 -6.498 1.00 0.00 H new ATOM 435 N VAL A 33 -4.844 0.013 -3.359 1.00 0.00 N ATOM 436 CA VAL A 33 -4.062 -1.056 -3.968 1.00 0.00 C ATOM 437 C VAL A 33 -4.925 -1.911 -4.889 1.00 0.00 C ATOM 438 O VAL A 33 -6.145 -1.970 -4.736 1.00 0.00 O ATOM 439 CB VAL A 33 -3.418 -1.960 -2.900 1.00 0.00 C ATOM 440 CG1 VAL A 33 -2.168 -1.306 -2.331 1.00 0.00 C ATOM 441 CG2 VAL A 33 -4.416 -2.273 -1.796 1.00 0.00 C ATOM 0 H VAL A 33 -5.446 -0.289 -2.593 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.274 -0.579 -4.551 1.00 0.00 H new ATOM 0 HB VAL A 33 -3.126 -2.899 -3.371 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.726 -1.959 -1.578 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.449 -1.138 -3.132 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.432 -0.352 -1.874 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.944 -2.913 -1.050 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -4.741 -1.345 -1.325 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -5.279 -2.786 -2.220 1.00 0.00 H new ATOM 451 N SER A 34 -4.283 -2.574 -5.846 1.00 0.00 N ATOM 452 CA SER A 34 -4.992 -3.424 -6.795 1.00 0.00 C ATOM 453 C SER A 34 -4.198 -4.694 -7.085 1.00 0.00 C ATOM 454 O SER A 34 -2.982 -4.736 -6.896 1.00 0.00 O ATOM 455 CB SER A 34 -5.254 -2.665 -8.096 1.00 0.00 C ATOM 456 OG SER A 34 -4.117 -2.692 -8.941 1.00 0.00 O ATOM 0 H SER A 34 -3.273 -2.539 -5.984 1.00 0.00 H new ATOM 0 HA SER A 34 -5.946 -3.706 -6.349 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.106 -3.107 -8.613 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.519 -1.632 -7.871 1.00 0.00 H new ATOM 0 HG SER A 34 -3.345 -2.325 -8.462 1.00 0.00 H new ATOM 462 N ILE A 35 -4.895 -5.728 -7.545 1.00 0.00 N ATOM 463 CA ILE A 35 -4.255 -6.999 -7.862 1.00 0.00 C ATOM 464 C ILE A 35 -4.127 -7.188 -9.370 1.00 0.00 C ATOM 465 O ILE A 35 -5.126 -7.218 -10.088 1.00 0.00 O ATOM 466 CB ILE A 35 -5.039 -8.186 -7.272 1.00 0.00 C ATOM 467 CG1 ILE A 35 -5.224 -8.004 -5.764 1.00 0.00 C ATOM 468 CG2 ILE A 35 -4.321 -9.494 -7.569 1.00 0.00 C ATOM 469 CD1 ILE A 35 -6.181 -9.000 -5.148 1.00 0.00 C ATOM 0 H ILE A 35 -5.902 -5.711 -7.706 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.261 -6.973 -7.415 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.024 -8.220 -7.738 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -4.254 -8.093 -5.274 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.588 -6.995 -5.570 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.887 -10.324 -7.146 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.236 -9.626 -8.648 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.325 -9.471 -7.127 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.263 -8.811 -4.078 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.162 -8.896 -5.611 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.808 -10.011 -5.311 1.00 0.00 H new ATOM 481 N GLN A 36 -2.891 -7.317 -9.842 1.00 0.00 N ATOM 482 CA GLN A 36 -2.632 -7.504 -11.264 1.00 0.00 C ATOM 483 C GLN A 36 -3.711 -8.373 -11.904 1.00 0.00 C ATOM 484 O GLN A 36 -3.728 -9.590 -11.727 1.00 0.00 O ATOM 485 CB GLN A 36 -1.258 -8.141 -11.475 1.00 0.00 C ATOM 486 CG GLN A 36 -0.837 -8.212 -12.934 1.00 0.00 C ATOM 487 CD GLN A 36 -0.902 -6.866 -13.627 1.00 0.00 C ATOM 488 OE1 GLN A 36 0.111 -6.183 -13.779 1.00 0.00 O ATOM 489 NE2 GLN A 36 -2.098 -6.475 -14.051 1.00 0.00 N ATOM 0 H GLN A 36 -2.054 -7.295 -9.260 1.00 0.00 H new ATOM 0 HA GLN A 36 -2.648 -6.524 -11.742 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -0.514 -7.572 -10.918 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -1.266 -9.148 -11.059 1.00 0.00 H new ATOM 0 HG2 GLN A 36 0.180 -8.599 -12.996 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -1.480 -8.918 -13.460 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -2.912 -7.072 -13.904 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -2.203 -5.577 -14.523 1.00 0.00 H new ATOM 498 N GLY A 37 -4.611 -7.737 -12.648 1.00 0.00 N ATOM 499 CA GLY A 37 -5.681 -8.467 -13.302 1.00 0.00 C ATOM 500 C GLY A 37 -6.772 -8.886 -12.337 1.00 0.00 C ATOM 501 O GLY A 37 -6.499 -9.183 -11.174 1.00 0.00 O ATOM 0 H GLY A 37 -4.618 -6.730 -12.809 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.113 -7.846 -14.087 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -5.269 -9.352 -13.786 1.00 0.00 H new ATOM 505 N GLU A 38 -8.011 -8.908 -12.819 1.00 0.00 N ATOM 506 CA GLU A 38 -9.146 -9.291 -11.988 1.00 0.00 C ATOM 507 C GLU A 38 -8.976 -10.710 -11.454 1.00 0.00 C ATOM 508 O GLU A 38 -9.092 -11.683 -12.199 1.00 0.00 O ATOM 509 CB GLU A 38 -10.448 -9.187 -12.785 1.00 0.00 C ATOM 510 CG GLU A 38 -11.686 -9.540 -11.978 1.00 0.00 C ATOM 511 CD GLU A 38 -12.933 -9.637 -12.835 1.00 0.00 C ATOM 512 OE1 GLU A 38 -13.201 -10.732 -13.372 1.00 0.00 O ATOM 513 OE2 GLU A 38 -13.642 -8.617 -12.968 1.00 0.00 O ATOM 0 H GLU A 38 -8.254 -8.665 -13.780 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.191 -8.606 -11.141 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -10.551 -8.171 -13.166 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -10.388 -9.847 -13.650 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.525 -10.490 -11.469 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.838 -8.787 -11.205 1.00 0.00 H new ATOM 520 N ALA A 39 -8.699 -10.820 -10.159 1.00 0.00 N ATOM 521 CA ALA A 39 -8.514 -12.119 -9.525 1.00 0.00 C ATOM 522 C ALA A 39 -9.669 -12.440 -8.582 1.00 0.00 C ATOM 523 O ALA A 39 -9.826 -11.807 -7.538 1.00 0.00 O ATOM 524 CB ALA A 39 -7.191 -12.156 -8.773 1.00 0.00 C ATOM 0 H ALA A 39 -8.598 -10.025 -9.528 1.00 0.00 H new ATOM 0 HA ALA A 39 -8.497 -12.878 -10.307 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -7.066 -13.132 -8.304 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -6.371 -11.980 -9.470 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.187 -11.382 -8.006 1.00 0.00 H new ATOM 530 N VAL A 40 -10.476 -13.427 -8.958 1.00 0.00 N ATOM 531 CA VAL A 40 -11.618 -13.832 -8.146 1.00 0.00 C ATOM 532 C VAL A 40 -11.253 -14.991 -7.225 1.00 0.00 C ATOM 533 O VAL A 40 -11.648 -15.019 -6.060 1.00 0.00 O ATOM 534 CB VAL A 40 -12.813 -14.245 -9.024 1.00 0.00 C ATOM 535 CG1 VAL A 40 -13.487 -13.018 -9.621 1.00 0.00 C ATOM 536 CG2 VAL A 40 -12.364 -15.202 -10.119 1.00 0.00 C ATOM 0 H VAL A 40 -10.360 -13.961 -9.819 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.901 -12.968 -7.544 1.00 0.00 H new ATOM 0 HB VAL A 40 -13.540 -14.761 -8.397 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -14.329 -13.330 -10.238 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -13.845 -12.373 -8.819 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -12.770 -12.471 -10.234 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -13.221 -15.484 -10.730 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.617 -14.714 -10.745 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -11.932 -16.095 -9.667 1.00 0.00 H new ATOM 546 N ALA A 41 -10.497 -15.946 -7.756 1.00 0.00 N ATOM 547 CA ALA A 41 -10.077 -17.107 -6.981 1.00 0.00 C ATOM 548 C ALA A 41 -8.617 -17.452 -7.258 1.00 0.00 C ATOM 549 O ALA A 41 -8.272 -17.899 -8.352 1.00 0.00 O ATOM 550 CB ALA A 41 -10.971 -18.298 -7.288 1.00 0.00 C ATOM 0 H ALA A 41 -10.163 -15.939 -8.720 1.00 0.00 H new ATOM 0 HA ALA A 41 -10.171 -16.861 -5.923 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -10.646 -19.158 -6.702 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.002 -18.054 -7.033 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -10.907 -18.537 -8.350 1.00 0.00 H new ATOM 556 N VAL A 42 -7.765 -17.242 -6.260 1.00 0.00 N ATOM 557 CA VAL A 42 -6.342 -17.532 -6.396 1.00 0.00 C ATOM 558 C VAL A 42 -5.977 -18.836 -5.695 1.00 0.00 C ATOM 559 O VAL A 42 -6.670 -19.273 -4.776 1.00 0.00 O ATOM 560 CB VAL A 42 -5.480 -16.393 -5.821 1.00 0.00 C ATOM 561 CG1 VAL A 42 -4.139 -16.929 -5.342 1.00 0.00 C ATOM 562 CG2 VAL A 42 -5.286 -15.296 -6.857 1.00 0.00 C ATOM 0 H VAL A 42 -8.035 -16.872 -5.349 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.139 -17.628 -7.463 1.00 0.00 H new ATOM 0 HB VAL A 42 -6.000 -15.964 -4.965 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.543 -16.110 -4.939 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.302 -17.676 -4.565 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.610 -17.385 -6.179 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -4.675 -14.499 -6.433 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.788 -15.708 -7.734 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.257 -14.893 -7.147 1.00 0.00 H new ATOM 572 N ARG A 43 -4.885 -19.452 -6.134 1.00 0.00 N ATOM 573 CA ARG A 43 -4.428 -20.706 -5.549 1.00 0.00 C ATOM 574 C ARG A 43 -3.454 -20.449 -4.403 1.00 0.00 C ATOM 575 O ARG A 43 -2.735 -19.449 -4.380 1.00 0.00 O ATOM 576 CB ARG A 43 -3.760 -21.578 -6.614 1.00 0.00 C ATOM 577 CG ARG A 43 -4.747 -22.324 -7.497 1.00 0.00 C ATOM 578 CD ARG A 43 -5.122 -21.510 -8.725 1.00 0.00 C ATOM 579 NE ARG A 43 -6.080 -22.212 -9.575 1.00 0.00 N ATOM 580 CZ ARG A 43 -6.860 -21.602 -10.461 1.00 0.00 C ATOM 581 NH1 ARG A 43 -6.795 -20.287 -10.613 1.00 0.00 N ATOM 582 NH2 ARG A 43 -7.707 -22.310 -11.198 1.00 0.00 N ATOM 0 H ARG A 43 -4.300 -19.103 -6.893 1.00 0.00 H new ATOM 0 HA ARG A 43 -5.298 -21.230 -5.153 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -3.127 -20.950 -7.241 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -3.107 -22.300 -6.123 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -4.313 -23.274 -7.808 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -5.645 -22.556 -6.925 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -5.546 -20.556 -8.412 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -4.223 -21.286 -9.300 1.00 0.00 H new ATOM 0 HE ARG A 43 -6.154 -23.225 -9.484 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -6.145 -19.740 -10.049 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -7.395 -19.822 -11.294 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -7.759 -23.322 -11.084 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -8.306 -21.842 -11.878 1.00 0.00 H new ATOM 596 N PRO A 44 -3.428 -21.370 -3.429 1.00 0.00 N ATOM 597 CA PRO A 44 -2.546 -21.265 -2.262 1.00 0.00 C ATOM 598 C PRO A 44 -1.079 -21.465 -2.625 1.00 0.00 C ATOM 599 O PRO A 44 -0.656 -22.573 -2.953 1.00 0.00 O ATOM 600 CB PRO A 44 -3.030 -22.394 -1.349 1.00 0.00 C ATOM 601 CG PRO A 44 -3.653 -23.386 -2.270 1.00 0.00 C ATOM 602 CD PRO A 44 -4.257 -22.587 -3.391 1.00 0.00 C ATOM 0 HA PRO A 44 -2.593 -20.278 -1.803 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -2.203 -22.835 -0.793 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -3.749 -22.029 -0.615 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -2.910 -24.088 -2.648 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -4.414 -23.973 -1.755 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -4.219 -23.129 -4.336 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -5.304 -22.354 -3.199 1.00 0.00 H new ATOM 610 N GLY A 45 -0.306 -20.385 -2.563 1.00 0.00 N ATOM 611 CA GLY A 45 1.107 -20.464 -2.887 1.00 0.00 C ATOM 612 C GLY A 45 1.429 -19.840 -4.230 1.00 0.00 C ATOM 613 O GLY A 45 2.502 -20.071 -4.787 1.00 0.00 O ATOM 0 H GLY A 45 -0.633 -19.457 -2.294 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.684 -19.963 -2.109 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.418 -21.509 -2.891 1.00 0.00 H new ATOM 617 N GLU A 46 0.497 -19.050 -4.753 1.00 0.00 N ATOM 618 CA GLU A 46 0.687 -18.393 -6.041 1.00 0.00 C ATOM 619 C GLU A 46 1.234 -16.981 -5.857 1.00 0.00 C ATOM 620 O GLU A 46 0.583 -16.125 -5.256 1.00 0.00 O ATOM 621 CB GLU A 46 -0.633 -18.345 -6.814 1.00 0.00 C ATOM 622 CG GLU A 46 -0.901 -19.591 -7.640 1.00 0.00 C ATOM 623 CD GLU A 46 0.044 -19.725 -8.818 1.00 0.00 C ATOM 624 OE1 GLU A 46 -0.155 -19.008 -9.821 1.00 0.00 O ATOM 625 OE2 GLU A 46 0.982 -20.545 -8.737 1.00 0.00 O ATOM 0 H GLU A 46 -0.397 -18.849 -4.305 1.00 0.00 H new ATOM 0 HA GLU A 46 1.413 -18.973 -6.612 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -1.452 -18.204 -6.109 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.627 -17.477 -7.473 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.809 -20.471 -7.003 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.928 -19.567 -8.004 1.00 0.00 H new ATOM 632 N ASP A 47 2.433 -16.744 -6.376 1.00 0.00 N ATOM 633 CA ASP A 47 3.068 -15.436 -6.270 1.00 0.00 C ATOM 634 C ASP A 47 2.147 -14.340 -6.799 1.00 0.00 C ATOM 635 O ASP A 47 2.242 -13.943 -7.960 1.00 0.00 O ATOM 636 CB ASP A 47 4.390 -15.423 -7.039 1.00 0.00 C ATOM 637 CG ASP A 47 5.531 -16.019 -6.238 1.00 0.00 C ATOM 638 OD1 ASP A 47 5.419 -16.071 -4.995 1.00 0.00 O ATOM 639 OD2 ASP A 47 6.536 -16.433 -6.853 1.00 0.00 O ATOM 0 H ASP A 47 2.985 -17.441 -6.875 1.00 0.00 H new ATOM 0 HA ASP A 47 3.268 -15.241 -5.216 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.272 -15.980 -7.968 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.638 -14.397 -7.312 1.00 0.00 H new ATOM 644 N VAL A 48 1.256 -13.857 -5.939 1.00 0.00 N ATOM 645 CA VAL A 48 0.318 -12.808 -6.320 1.00 0.00 C ATOM 646 C VAL A 48 1.025 -11.465 -6.467 1.00 0.00 C ATOM 647 O VAL A 48 1.993 -11.180 -5.759 1.00 0.00 O ATOM 648 CB VAL A 48 -0.816 -12.668 -5.287 1.00 0.00 C ATOM 649 CG1 VAL A 48 -0.254 -12.300 -3.923 1.00 0.00 C ATOM 650 CG2 VAL A 48 -1.833 -11.635 -5.750 1.00 0.00 C ATOM 0 H VAL A 48 1.164 -14.175 -4.974 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.108 -13.098 -7.280 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.323 -13.629 -5.197 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.070 -12.206 -3.207 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.433 -13.078 -3.590 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.279 -11.352 -3.993 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.627 -11.549 -5.009 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.342 -10.669 -5.870 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.259 -11.946 -6.704 1.00 0.00 H new ATOM 660 N LEU A 49 0.537 -10.643 -7.389 1.00 0.00 N ATOM 661 CA LEU A 49 1.121 -9.328 -7.629 1.00 0.00 C ATOM 662 C LEU A 49 0.126 -8.221 -7.298 1.00 0.00 C ATOM 663 O LEU A 49 -1.054 -8.310 -7.639 1.00 0.00 O ATOM 664 CB LEU A 49 1.572 -9.207 -9.086 1.00 0.00 C ATOM 665 CG LEU A 49 2.810 -10.015 -9.475 1.00 0.00 C ATOM 666 CD1 LEU A 49 4.078 -9.247 -9.131 1.00 0.00 C ATOM 667 CD2 LEU A 49 2.802 -11.370 -8.783 1.00 0.00 C ATOM 0 H LEU A 49 -0.262 -10.864 -7.983 1.00 0.00 H new ATOM 0 HA LEU A 49 1.987 -9.218 -6.977 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.746 -9.514 -9.728 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.767 -8.156 -9.299 1.00 0.00 H new ATOM 0 HG LEU A 49 2.789 -10.179 -10.552 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.949 -9.837 -9.415 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.089 -8.301 -9.672 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.106 -9.052 -8.059 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.691 -11.931 -9.072 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.799 -11.227 -7.702 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.911 -11.924 -9.078 1.00 0.00 H new ATOM 679 N PHE A 50 0.609 -7.176 -6.634 1.00 0.00 N ATOM 680 CA PHE A 50 -0.238 -6.050 -6.259 1.00 0.00 C ATOM 681 C PHE A 50 0.218 -4.771 -6.955 1.00 0.00 C ATOM 682 O PHE A 50 1.325 -4.286 -6.724 1.00 0.00 O ATOM 683 CB PHE A 50 -0.218 -5.853 -4.742 1.00 0.00 C ATOM 684 CG PHE A 50 -1.255 -6.664 -4.018 1.00 0.00 C ATOM 685 CD1 PHE A 50 -2.522 -6.151 -3.794 1.00 0.00 C ATOM 686 CD2 PHE A 50 -0.962 -7.939 -3.562 1.00 0.00 C ATOM 687 CE1 PHE A 50 -3.479 -6.895 -3.129 1.00 0.00 C ATOM 688 CE2 PHE A 50 -1.915 -8.688 -2.897 1.00 0.00 C ATOM 689 CZ PHE A 50 -3.175 -8.164 -2.679 1.00 0.00 C ATOM 0 H PHE A 50 1.583 -7.086 -6.345 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.257 -6.272 -6.577 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.769 -6.118 -4.362 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -0.373 -4.797 -4.519 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.765 -5.158 -4.143 1.00 0.00 H new ATOM 0 HD2 PHE A 50 0.022 -8.352 -3.728 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.463 -6.484 -2.962 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -1.675 -9.682 -2.548 1.00 0.00 H new ATOM 0 HZ PHE A 50 -3.920 -8.746 -2.158 1.00 0.00 H new ATOM 699 N VAL A 51 -0.645 -4.230 -7.810 1.00 0.00 N ATOM 700 CA VAL A 51 -0.332 -3.007 -8.540 1.00 0.00 C ATOM 701 C VAL A 51 -0.829 -1.777 -7.789 1.00 0.00 C ATOM 702 O VAL A 51 -2.008 -1.677 -7.449 1.00 0.00 O ATOM 703 CB VAL A 51 -0.954 -3.021 -9.949 1.00 0.00 C ATOM 704 CG1 VAL A 51 -0.725 -1.689 -10.647 1.00 0.00 C ATOM 705 CG2 VAL A 51 -0.385 -4.168 -10.771 1.00 0.00 C ATOM 0 H VAL A 51 -1.566 -4.619 -8.014 1.00 0.00 H new ATOM 0 HA VAL A 51 0.753 -2.960 -8.630 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.029 -3.173 -9.851 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -1.171 -1.718 -11.641 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -1.185 -0.890 -10.066 1.00 0.00 H new ATOM 0 HG13 VAL A 51 0.346 -1.504 -10.735 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -0.835 -4.163 -11.764 1.00 0.00 H new ATOM 0 HG22 VAL A 51 0.695 -4.050 -10.862 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -0.606 -5.114 -10.277 1.00 0.00 H new ATOM 715 N VAL A 52 0.079 -0.840 -7.533 1.00 0.00 N ATOM 716 CA VAL A 52 -0.267 0.385 -6.823 1.00 0.00 C ATOM 717 C VAL A 52 -0.402 1.559 -7.787 1.00 0.00 C ATOM 718 O VAL A 52 0.427 1.741 -8.679 1.00 0.00 O ATOM 719 CB VAL A 52 0.787 0.732 -5.755 1.00 0.00 C ATOM 720 CG1 VAL A 52 2.129 1.034 -6.406 1.00 0.00 C ATOM 721 CG2 VAL A 52 0.321 1.906 -4.907 1.00 0.00 C ATOM 0 H VAL A 52 1.059 -0.906 -7.807 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.225 0.207 -6.334 1.00 0.00 H new ATOM 0 HB VAL A 52 0.913 -0.131 -5.102 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.861 1.277 -5.635 1.00 0.00 H new ATOM 0 HG12 VAL A 52 2.467 0.161 -6.965 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.022 1.880 -7.084 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.078 2.137 -4.158 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.164 2.776 -5.545 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.614 1.647 -4.410 1.00 0.00 H new ATOM 731 N ARG A 53 -1.452 2.352 -7.601 1.00 0.00 N ATOM 732 CA ARG A 53 -1.696 3.508 -8.455 1.00 0.00 C ATOM 733 C ARG A 53 -2.430 4.605 -7.688 1.00 0.00 C ATOM 734 O ARG A 53 -3.159 4.328 -6.736 1.00 0.00 O ATOM 735 CB ARG A 53 -2.510 3.099 -9.684 1.00 0.00 C ATOM 736 CG ARG A 53 -2.901 4.268 -10.573 1.00 0.00 C ATOM 737 CD ARG A 53 -3.174 3.816 -11.999 1.00 0.00 C ATOM 738 NE ARG A 53 -3.587 4.925 -12.855 1.00 0.00 N ATOM 739 CZ ARG A 53 -4.819 5.422 -12.872 1.00 0.00 C ATOM 740 NH1 ARG A 53 -5.754 4.910 -12.084 1.00 0.00 N ATOM 741 NH2 ARG A 53 -5.117 6.432 -13.679 1.00 0.00 N ATOM 0 H ARG A 53 -2.147 2.215 -6.867 1.00 0.00 H new ATOM 0 HA ARG A 53 -0.731 3.898 -8.780 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -1.932 2.385 -10.271 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -3.414 2.585 -9.356 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -3.789 4.754 -10.168 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -2.103 5.010 -10.572 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -2.277 3.355 -12.411 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -3.952 3.052 -11.995 1.00 0.00 H new ATOM 0 HE ARG A 53 -2.891 5.341 -13.474 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -5.528 4.133 -11.463 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -6.699 5.293 -12.099 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -4.400 6.828 -14.287 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -6.063 6.813 -13.691 1.00 0.00 H new ATOM 755 N GLN A 54 -2.230 5.850 -8.110 1.00 0.00 N ATOM 756 CA GLN A 54 -2.871 6.987 -7.461 1.00 0.00 C ATOM 757 C GLN A 54 -3.631 7.835 -8.476 1.00 0.00 C ATOM 758 O GLN A 54 -3.334 7.805 -9.670 1.00 0.00 O ATOM 759 CB GLN A 54 -1.829 7.845 -6.741 1.00 0.00 C ATOM 760 CG GLN A 54 -2.404 8.671 -5.602 1.00 0.00 C ATOM 761 CD GLN A 54 -1.335 9.191 -4.661 1.00 0.00 C ATOM 762 OE1 GLN A 54 -1.275 10.385 -4.369 1.00 0.00 O ATOM 763 NE2 GLN A 54 -0.483 8.293 -4.179 1.00 0.00 N ATOM 0 H GLN A 54 -1.630 6.096 -8.897 1.00 0.00 H new ATOM 0 HA GLN A 54 -3.582 6.602 -6.730 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -1.045 7.197 -6.349 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.359 8.513 -7.463 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -2.961 9.513 -6.014 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -3.113 8.064 -5.040 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -0.569 7.313 -4.448 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.257 8.584 -3.540 1.00 0.00 H new ATOM 772 N GLU A 55 -4.613 8.589 -7.993 1.00 0.00 N ATOM 773 CA GLU A 55 -5.416 9.444 -8.860 1.00 0.00 C ATOM 774 C GLU A 55 -4.706 10.768 -9.128 1.00 0.00 C ATOM 775 O GLU A 55 -4.678 11.250 -10.259 1.00 0.00 O ATOM 776 CB GLU A 55 -6.785 9.706 -8.228 1.00 0.00 C ATOM 777 CG GLU A 55 -6.754 10.737 -7.113 1.00 0.00 C ATOM 778 CD GLU A 55 -8.116 10.956 -6.483 1.00 0.00 C ATOM 779 OE1 GLU A 55 -8.853 9.964 -6.306 1.00 0.00 O ATOM 780 OE2 GLU A 55 -8.444 12.119 -6.167 1.00 0.00 O ATOM 0 H GLU A 55 -4.872 8.625 -7.007 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.554 8.927 -9.810 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -7.475 10.042 -9.002 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -7.179 8.769 -7.834 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.050 10.415 -6.345 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -6.384 11.683 -7.508 1.00 0.00 H new ATOM 787 N GLN A 56 -4.134 11.349 -8.078 1.00 0.00 N ATOM 788 CA GLN A 56 -3.425 12.617 -8.199 1.00 0.00 C ATOM 789 C GLN A 56 -1.974 12.475 -7.753 1.00 0.00 C ATOM 790 O GLN A 56 -1.327 13.456 -7.389 1.00 0.00 O ATOM 791 CB GLN A 56 -4.123 13.697 -7.370 1.00 0.00 C ATOM 792 CG GLN A 56 -5.332 14.308 -8.061 1.00 0.00 C ATOM 793 CD GLN A 56 -5.836 15.554 -7.360 1.00 0.00 C ATOM 794 OE1 GLN A 56 -6.611 15.473 -6.407 1.00 0.00 O ATOM 795 NE2 GLN A 56 -5.398 16.716 -7.829 1.00 0.00 N ATOM 0 H GLN A 56 -4.148 10.962 -7.134 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.435 12.911 -9.249 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -4.437 13.267 -6.419 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -3.408 14.487 -7.142 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -5.071 14.555 -9.090 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -6.133 13.570 -8.103 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -4.756 16.737 -8.621 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.703 17.588 -7.397 1.00 0.00 H new ATOM 804 N GLY A 57 -1.469 11.245 -7.782 1.00 0.00 N ATOM 805 CA GLY A 57 -0.097 10.997 -7.377 1.00 0.00 C ATOM 806 C GLY A 57 0.854 10.941 -8.556 1.00 0.00 C ATOM 807 O GLY A 57 0.960 9.915 -9.229 1.00 0.00 O ATOM 0 H GLY A 57 -1.985 10.417 -8.078 1.00 0.00 H new ATOM 0 HA2 GLY A 57 0.224 11.782 -6.692 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -0.048 10.056 -6.829 1.00 0.00 H new ATOM 811 N ASP A 58 1.547 12.046 -8.808 1.00 0.00 N ATOM 812 CA ASP A 58 2.495 12.119 -9.914 1.00 0.00 C ATOM 813 C ASP A 58 3.931 12.106 -9.401 1.00 0.00 C ATOM 814 O ASP A 58 4.834 11.595 -10.064 1.00 0.00 O ATOM 815 CB ASP A 58 2.247 13.380 -10.743 1.00 0.00 C ATOM 816 CG ASP A 58 3.325 13.609 -11.784 1.00 0.00 C ATOM 817 OD1 ASP A 58 3.877 12.612 -12.296 1.00 0.00 O ATOM 818 OD2 ASP A 58 3.615 14.784 -12.089 1.00 0.00 O ATOM 0 H ASP A 58 1.470 12.904 -8.261 1.00 0.00 H new ATOM 0 HA ASP A 58 2.347 11.243 -10.546 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.279 13.302 -11.238 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.197 14.244 -10.080 1.00 0.00 H new ATOM 823 N VAL A 59 4.136 12.673 -8.216 1.00 0.00 N ATOM 824 CA VAL A 59 5.463 12.727 -7.614 1.00 0.00 C ATOM 825 C VAL A 59 5.395 13.239 -6.179 1.00 0.00 C ATOM 826 O VAL A 59 4.876 14.325 -5.920 1.00 0.00 O ATOM 827 CB VAL A 59 6.411 13.629 -8.425 1.00 0.00 C ATOM 828 CG1 VAL A 59 5.904 15.063 -8.436 1.00 0.00 C ATOM 829 CG2 VAL A 59 7.823 13.559 -7.863 1.00 0.00 C ATOM 0 H VAL A 59 3.400 13.101 -7.654 1.00 0.00 H new ATOM 0 HA VAL A 59 5.853 11.709 -7.615 1.00 0.00 H new ATOM 0 HB VAL A 59 6.435 13.269 -9.454 1.00 0.00 H new ATOM 0 HG11 VAL A 59 6.587 15.686 -9.014 1.00 0.00 H new ATOM 0 HG12 VAL A 59 4.913 15.095 -8.888 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.849 15.437 -7.414 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.480 14.203 -8.448 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.819 13.893 -6.825 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.184 12.532 -7.912 1.00 0.00 H new ATOM 839 N LEU A 60 5.922 12.450 -5.250 1.00 0.00 N ATOM 840 CA LEU A 60 5.923 12.823 -3.839 1.00 0.00 C ATOM 841 C LEU A 60 6.698 11.806 -3.007 1.00 0.00 C ATOM 842 O LEU A 60 7.046 10.728 -3.490 1.00 0.00 O ATOM 843 CB LEU A 60 4.488 12.935 -3.321 1.00 0.00 C ATOM 844 CG LEU A 60 3.789 11.617 -2.989 1.00 0.00 C ATOM 845 CD1 LEU A 60 2.527 11.871 -2.179 1.00 0.00 C ATOM 846 CD2 LEU A 60 3.462 10.851 -4.262 1.00 0.00 C ATOM 0 H LEU A 60 6.354 11.548 -5.448 1.00 0.00 H new ATOM 0 HA LEU A 60 6.414 13.791 -3.745 1.00 0.00 H new ATOM 0 HB2 LEU A 60 4.494 13.556 -2.425 1.00 0.00 H new ATOM 0 HB3 LEU A 60 3.893 13.460 -4.068 1.00 0.00 H new ATOM 0 HG LEU A 60 4.466 11.011 -2.388 1.00 0.00 H new ATOM 0 HD11 LEU A 60 2.043 10.921 -1.952 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.787 12.377 -1.249 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.845 12.497 -2.754 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.965 9.915 -4.006 1.00 0.00 H new ATOM 0 HD22 LEU A 60 2.804 11.452 -4.889 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.383 10.636 -4.804 1.00 0.00 H new ATOM 858 N THR A 61 6.964 12.156 -1.752 1.00 0.00 N ATOM 859 CA THR A 61 7.696 11.274 -0.852 1.00 0.00 C ATOM 860 C THR A 61 6.789 10.734 0.247 1.00 0.00 C ATOM 861 O THR A 61 6.710 11.303 1.337 1.00 0.00 O ATOM 862 CB THR A 61 8.892 11.999 -0.206 1.00 0.00 C ATOM 863 OG1 THR A 61 9.522 11.144 0.754 1.00 0.00 O ATOM 864 CG2 THR A 61 8.443 13.286 0.471 1.00 0.00 C ATOM 0 H THR A 61 6.683 13.044 -1.336 1.00 0.00 H new ATOM 0 HA THR A 61 8.066 10.444 -1.454 1.00 0.00 H new ATOM 0 HB THR A 61 9.605 12.250 -0.992 1.00 0.00 H new ATOM 0 HG1 THR A 61 10.282 11.611 1.159 1.00 0.00 H new ATOM 0 HG21 THR A 61 9.304 13.781 0.920 1.00 0.00 H new ATOM 0 HG22 THR A 61 7.990 13.947 -0.268 1.00 0.00 H new ATOM 0 HG23 THR A 61 7.713 13.054 1.246 1.00 0.00 H new ATOM 872 N THR A 62 6.105 9.632 -0.044 1.00 0.00 N ATOM 873 CA THR A 62 5.203 9.015 0.920 1.00 0.00 C ATOM 874 C THR A 62 5.534 7.540 1.117 1.00 0.00 C ATOM 875 O THR A 62 5.499 6.754 0.171 1.00 0.00 O ATOM 876 CB THR A 62 3.733 9.145 0.477 1.00 0.00 C ATOM 877 OG1 THR A 62 3.266 10.478 0.715 1.00 0.00 O ATOM 878 CG2 THR A 62 2.853 8.153 1.223 1.00 0.00 C ATOM 0 H THR A 62 6.159 9.148 -0.940 1.00 0.00 H new ATOM 0 HA THR A 62 5.339 9.544 1.863 1.00 0.00 H new ATOM 0 HB THR A 62 3.677 8.926 -0.589 1.00 0.00 H new ATOM 0 HG1 THR A 62 2.331 10.553 0.430 1.00 0.00 H new ATOM 0 HG21 THR A 62 1.820 8.264 0.894 1.00 0.00 H new ATOM 0 HG22 THR A 62 3.193 7.138 1.017 1.00 0.00 H new ATOM 0 HG23 THR A 62 2.915 8.346 2.294 1.00 0.00 H new ATOM 886 N LYS A 63 5.854 7.171 2.353 1.00 0.00 N ATOM 887 CA LYS A 63 6.189 5.789 2.676 1.00 0.00 C ATOM 888 C LYS A 63 4.928 4.946 2.834 1.00 0.00 C ATOM 889 O LYS A 63 4.060 5.257 3.649 1.00 0.00 O ATOM 890 CB LYS A 63 7.019 5.731 3.960 1.00 0.00 C ATOM 891 CG LYS A 63 8.221 6.659 3.950 1.00 0.00 C ATOM 892 CD LYS A 63 9.448 5.975 3.370 1.00 0.00 C ATOM 893 CE LYS A 63 10.572 6.968 3.118 1.00 0.00 C ATOM 894 NZ LYS A 63 11.227 7.399 4.384 1.00 0.00 N ATOM 0 H LYS A 63 5.888 7.810 3.147 1.00 0.00 H new ATOM 0 HA LYS A 63 6.776 5.382 1.853 1.00 0.00 H new ATOM 0 HB2 LYS A 63 6.381 5.985 4.807 1.00 0.00 H new ATOM 0 HB3 LYS A 63 7.362 4.708 4.115 1.00 0.00 H new ATOM 0 HG2 LYS A 63 7.989 7.550 3.366 1.00 0.00 H new ATOM 0 HG3 LYS A 63 8.434 6.991 4.966 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.792 5.200 4.055 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.182 5.480 2.436 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.315 6.516 2.461 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.176 7.841 2.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 11.987 8.075 4.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 10.524 7.853 5.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.628 6.570 4.867 1.00 0.00 H new ATOM 908 N TYR A 64 4.835 3.877 2.051 1.00 0.00 N ATOM 909 CA TYR A 64 3.679 2.989 2.104 1.00 0.00 C ATOM 910 C TYR A 64 3.982 1.749 2.940 1.00 0.00 C ATOM 911 O TYR A 64 5.089 1.212 2.893 1.00 0.00 O ATOM 912 CB TYR A 64 3.262 2.576 0.691 1.00 0.00 C ATOM 913 CG TYR A 64 3.109 3.741 -0.260 1.00 0.00 C ATOM 914 CD1 TYR A 64 1.928 4.471 -0.311 1.00 0.00 C ATOM 915 CD2 TYR A 64 4.145 4.112 -1.109 1.00 0.00 C ATOM 916 CE1 TYR A 64 1.783 5.536 -1.179 1.00 0.00 C ATOM 917 CE2 TYR A 64 4.009 5.176 -1.979 1.00 0.00 C ATOM 918 CZ TYR A 64 2.826 5.885 -2.011 1.00 0.00 C ATOM 919 OH TYR A 64 2.687 6.945 -2.877 1.00 0.00 O ATOM 0 H TYR A 64 5.546 3.604 1.372 1.00 0.00 H new ATOM 0 HA TYR A 64 2.858 3.530 2.575 1.00 0.00 H new ATOM 0 HB2 TYR A 64 4.004 1.885 0.290 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.318 2.034 0.744 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.109 4.201 0.339 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.072 3.559 -1.088 1.00 0.00 H new ATOM 0 HE1 TYR A 64 0.858 6.092 -1.206 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.825 5.452 -2.631 1.00 0.00 H new ATOM 0 HH TYR A 64 3.514 7.058 -3.391 1.00 0.00 H new ATOM 929 N GLN A 65 2.991 1.301 3.702 1.00 0.00 N ATOM 930 CA GLN A 65 3.150 0.125 4.549 1.00 0.00 C ATOM 931 C GLN A 65 2.281 -1.025 4.053 1.00 0.00 C ATOM 932 O GLN A 65 1.062 -1.016 4.227 1.00 0.00 O ATOM 933 CB GLN A 65 2.793 0.461 5.998 1.00 0.00 C ATOM 934 CG GLN A 65 2.857 -0.735 6.934 1.00 0.00 C ATOM 935 CD GLN A 65 2.198 -0.465 8.272 1.00 0.00 C ATOM 936 OE1 GLN A 65 1.190 -1.083 8.616 1.00 0.00 O ATOM 937 NE2 GLN A 65 2.766 0.461 9.036 1.00 0.00 N ATOM 0 H GLN A 65 2.069 1.734 3.751 1.00 0.00 H new ATOM 0 HA GLN A 65 4.194 -0.186 4.502 1.00 0.00 H new ATOM 0 HB2 GLN A 65 3.472 1.233 6.361 1.00 0.00 H new ATOM 0 HB3 GLN A 65 1.788 0.881 6.028 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.372 -1.589 6.460 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.899 -1.010 7.096 1.00 0.00 H new ATOM 0 HE21 GLN A 65 3.601 0.949 8.711 1.00 0.00 H new ATOM 0 HE22 GLN A 65 2.367 0.685 9.948 1.00 0.00 H new ATOM 946 N VAL A 66 2.915 -2.015 3.432 1.00 0.00 N ATOM 947 CA VAL A 66 2.200 -3.174 2.911 1.00 0.00 C ATOM 948 C VAL A 66 2.066 -4.261 3.971 1.00 0.00 C ATOM 949 O VAL A 66 3.058 -4.858 4.391 1.00 0.00 O ATOM 950 CB VAL A 66 2.908 -3.761 1.675 1.00 0.00 C ATOM 951 CG1 VAL A 66 2.119 -4.936 1.116 1.00 0.00 C ATOM 952 CG2 VAL A 66 3.106 -2.689 0.615 1.00 0.00 C ATOM 0 H VAL A 66 3.923 -2.037 3.278 1.00 0.00 H new ATOM 0 HA VAL A 66 1.207 -2.829 2.622 1.00 0.00 H new ATOM 0 HB VAL A 66 3.890 -4.124 1.979 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.634 -5.338 0.243 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.034 -5.712 1.877 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.123 -4.601 0.827 1.00 0.00 H new ATOM 0 HG21 VAL A 66 3.607 -3.122 -0.251 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.137 -2.293 0.312 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.716 -1.883 1.022 1.00 0.00 H new ATOM 962 N ASP A 67 0.835 -4.512 4.401 1.00 0.00 N ATOM 963 CA ASP A 67 0.570 -5.529 5.412 1.00 0.00 C ATOM 964 C ASP A 67 -0.259 -6.670 4.832 1.00 0.00 C ATOM 965 O ASP A 67 -1.441 -6.502 4.531 1.00 0.00 O ATOM 966 CB ASP A 67 -0.155 -4.912 6.609 1.00 0.00 C ATOM 967 CG ASP A 67 -0.809 -5.957 7.491 1.00 0.00 C ATOM 968 OD1 ASP A 67 -1.941 -6.378 7.173 1.00 0.00 O ATOM 969 OD2 ASP A 67 -0.190 -6.354 8.501 1.00 0.00 O ATOM 0 H ASP A 67 0.004 -4.025 4.065 1.00 0.00 H new ATOM 0 HA ASP A 67 1.526 -5.932 5.745 1.00 0.00 H new ATOM 0 HB2 ASP A 67 0.554 -4.333 7.201 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -0.914 -4.216 6.251 1.00 0.00 H new ATOM 974 N LEU A 68 0.369 -7.830 4.675 1.00 0.00 N ATOM 975 CA LEU A 68 -0.310 -9.000 4.129 1.00 0.00 C ATOM 976 C LEU A 68 -1.185 -9.666 5.188 1.00 0.00 C ATOM 977 O LEU A 68 -2.252 -10.195 4.882 1.00 0.00 O ATOM 978 CB LEU A 68 0.712 -10.004 3.592 1.00 0.00 C ATOM 979 CG LEU A 68 1.399 -9.624 2.280 1.00 0.00 C ATOM 980 CD1 LEU A 68 0.424 -9.727 1.118 1.00 0.00 C ATOM 981 CD2 LEU A 68 1.980 -8.220 2.369 1.00 0.00 C ATOM 0 H LEU A 68 1.347 -7.986 4.918 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.949 -8.669 3.311 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.480 -10.152 4.351 1.00 0.00 H new ATOM 0 HB3 LEU A 68 0.212 -10.962 3.453 1.00 0.00 H new ATOM 0 HG LEU A 68 2.217 -10.323 2.104 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.931 -9.453 0.193 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.056 -10.750 1.041 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.415 -9.052 1.286 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.465 -7.967 1.426 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.180 -7.507 2.569 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.712 -8.179 3.176 1.00 0.00 H new ATOM 993 N GLY A 69 -0.725 -9.632 6.435 1.00 0.00 N ATOM 994 CA GLY A 69 -1.478 -10.233 7.520 1.00 0.00 C ATOM 995 C GLY A 69 -0.962 -11.609 7.891 1.00 0.00 C ATOM 996 O GLY A 69 -0.809 -11.924 9.071 1.00 0.00 O ATOM 0 H GLY A 69 0.156 -9.199 6.713 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.432 -9.583 8.394 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -2.527 -10.307 7.233 1.00 0.00 H new ATOM 1000 N ASP A 70 -0.695 -12.431 6.882 1.00 0.00 N ATOM 1001 CA ASP A 70 -0.195 -13.782 7.109 1.00 0.00 C ATOM 1002 C ASP A 70 1.108 -13.752 7.902 1.00 0.00 C ATOM 1003 O ASP A 70 1.141 -14.123 9.075 1.00 0.00 O ATOM 1004 CB ASP A 70 0.022 -14.498 5.775 1.00 0.00 C ATOM 1005 CG ASP A 70 1.045 -15.612 5.876 1.00 0.00 C ATOM 1006 OD1 ASP A 70 1.189 -16.187 6.975 1.00 0.00 O ATOM 1007 OD2 ASP A 70 1.703 -15.908 4.856 1.00 0.00 O ATOM 0 H ASP A 70 -0.816 -12.186 5.899 1.00 0.00 H new ATOM 0 HA ASP A 70 -0.940 -14.327 7.689 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.926 -14.909 5.428 1.00 0.00 H new ATOM 0 HB3 ASP A 70 0.348 -13.775 5.027 1.00 0.00 H new ATOM 1012 N GLY A 71 2.181 -13.310 7.253 1.00 0.00 N ATOM 1013 CA GLY A 71 3.472 -13.242 7.912 1.00 0.00 C ATOM 1014 C GLY A 71 4.500 -12.483 7.097 1.00 0.00 C ATOM 1015 O GLY A 71 5.703 -12.704 7.241 1.00 0.00 O ATOM 0 H GLY A 71 2.179 -12.998 6.282 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.356 -12.761 8.883 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.835 -14.253 8.098 1.00 0.00 H new ATOM 1019 N PHE A 72 4.027 -11.587 6.238 1.00 0.00 N ATOM 1020 CA PHE A 72 4.914 -10.794 5.394 1.00 0.00 C ATOM 1021 C PHE A 72 4.744 -9.304 5.675 1.00 0.00 C ATOM 1022 O PHE A 72 3.679 -8.734 5.438 1.00 0.00 O ATOM 1023 CB PHE A 72 4.639 -11.081 3.917 1.00 0.00 C ATOM 1024 CG PHE A 72 5.793 -10.746 3.016 1.00 0.00 C ATOM 1025 CD1 PHE A 72 7.049 -11.284 3.247 1.00 0.00 C ATOM 1026 CD2 PHE A 72 5.622 -9.893 1.937 1.00 0.00 C ATOM 1027 CE1 PHE A 72 8.112 -10.976 2.420 1.00 0.00 C ATOM 1028 CE2 PHE A 72 6.682 -9.582 1.106 1.00 0.00 C ATOM 1029 CZ PHE A 72 7.928 -10.125 1.347 1.00 0.00 C ATOM 0 H PHE A 72 3.034 -11.391 6.108 1.00 0.00 H new ATOM 0 HA PHE A 72 5.942 -11.074 5.626 1.00 0.00 H new ATOM 0 HB2 PHE A 72 4.392 -12.136 3.800 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.765 -10.512 3.601 1.00 0.00 H new ATOM 0 HD1 PHE A 72 7.199 -11.951 4.083 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.649 -9.466 1.743 1.00 0.00 H new ATOM 0 HE1 PHE A 72 9.086 -11.400 2.612 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.535 -8.915 0.269 1.00 0.00 H new ATOM 0 HZ PHE A 72 8.757 -9.885 0.698 1.00 0.00 H new ATOM 1039 N LYS A 73 5.801 -8.679 6.181 1.00 0.00 N ATOM 1040 CA LYS A 73 5.772 -7.255 6.495 1.00 0.00 C ATOM 1041 C LYS A 73 6.894 -6.516 5.774 1.00 0.00 C ATOM 1042 O LYS A 73 8.068 -6.670 6.110 1.00 0.00 O ATOM 1043 CB LYS A 73 5.894 -7.042 8.005 1.00 0.00 C ATOM 1044 CG LYS A 73 4.728 -7.610 8.796 1.00 0.00 C ATOM 1045 CD LYS A 73 4.913 -9.092 9.076 1.00 0.00 C ATOM 1046 CE LYS A 73 5.921 -9.327 10.190 1.00 0.00 C ATOM 1047 NZ LYS A 73 5.303 -9.178 11.537 1.00 0.00 N ATOM 0 H LYS A 73 6.690 -9.137 6.383 1.00 0.00 H new ATOM 0 HA LYS A 73 4.818 -6.853 6.154 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.818 -7.502 8.355 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.973 -5.974 8.207 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.629 -7.070 9.738 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.802 -7.456 8.242 1.00 0.00 H new ATOM 0 HD2 LYS A 73 3.955 -9.534 9.351 1.00 0.00 H new ATOM 0 HD3 LYS A 73 5.247 -9.596 8.169 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.343 -10.327 10.093 1.00 0.00 H new ATOM 0 HE3 LYS A 73 6.746 -8.621 10.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.022 -9.346 12.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 4.922 -8.216 11.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 4.533 -9.868 11.644 1.00 0.00 H new ATOM 1061 N ALA A 74 6.526 -5.712 4.782 1.00 0.00 N ATOM 1062 CA ALA A 74 7.502 -4.947 4.016 1.00 0.00 C ATOM 1063 C ALA A 74 7.094 -3.481 3.917 1.00 0.00 C ATOM 1064 O ALA A 74 5.939 -3.130 4.159 1.00 0.00 O ATOM 1065 CB ALA A 74 7.670 -5.545 2.627 1.00 0.00 C ATOM 0 H ALA A 74 5.559 -5.574 4.490 1.00 0.00 H new ATOM 0 HA ALA A 74 8.457 -4.997 4.539 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.402 -4.963 2.067 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.015 -6.575 2.714 1.00 0.00 H new ATOM 0 HB3 ALA A 74 6.714 -5.525 2.104 1.00 0.00 H new ATOM 1071 N MET A 75 8.049 -2.628 3.560 1.00 0.00 N ATOM 1072 CA MET A 75 7.788 -1.200 3.429 1.00 0.00 C ATOM 1073 C MET A 75 8.367 -0.659 2.125 1.00 0.00 C ATOM 1074 O MET A 75 9.584 -0.590 1.957 1.00 0.00 O ATOM 1075 CB MET A 75 8.380 -0.440 4.618 1.00 0.00 C ATOM 1076 CG MET A 75 8.201 1.067 4.526 1.00 0.00 C ATOM 1077 SD MET A 75 9.504 1.974 5.380 1.00 0.00 S ATOM 1078 CE MET A 75 10.493 2.531 3.994 1.00 0.00 C ATOM 0 H MET A 75 9.010 -2.901 3.356 1.00 0.00 H new ATOM 0 HA MET A 75 6.708 -1.053 3.415 1.00 0.00 H new ATOM 0 HB2 MET A 75 7.914 -0.798 5.536 1.00 0.00 H new ATOM 0 HB3 MET A 75 9.443 -0.668 4.691 1.00 0.00 H new ATOM 0 HG2 MET A 75 8.184 1.364 3.477 1.00 0.00 H new ATOM 0 HG3 MET A 75 7.235 1.341 4.950 1.00 0.00 H new ATOM 0 HE1 MET A 75 11.234 3.251 4.342 1.00 0.00 H new ATOM 0 HE2 MET A 75 11.000 1.678 3.543 1.00 0.00 H new ATOM 0 HE3 MET A 75 9.848 3.003 3.253 1.00 0.00 H new ATOM 1088 N TYR A 76 7.487 -0.277 1.206 1.00 0.00 N ATOM 1089 CA TYR A 76 7.911 0.256 -0.083 1.00 0.00 C ATOM 1090 C TYR A 76 7.679 1.762 -0.154 1.00 0.00 C ATOM 1091 O TYR A 76 6.869 2.313 0.591 1.00 0.00 O ATOM 1092 CB TYR A 76 7.159 -0.441 -1.218 1.00 0.00 C ATOM 1093 CG TYR A 76 7.094 -1.944 -1.068 1.00 0.00 C ATOM 1094 CD1 TYR A 76 6.194 -2.536 -0.190 1.00 0.00 C ATOM 1095 CD2 TYR A 76 7.932 -2.773 -1.803 1.00 0.00 C ATOM 1096 CE1 TYR A 76 6.130 -3.908 -0.049 1.00 0.00 C ATOM 1097 CE2 TYR A 76 7.875 -4.147 -1.670 1.00 0.00 C ATOM 1098 CZ TYR A 76 6.973 -4.710 -0.791 1.00 0.00 C ATOM 1099 OH TYR A 76 6.914 -6.078 -0.655 1.00 0.00 O ATOM 0 H TYR A 76 6.476 -0.327 1.330 1.00 0.00 H new ATOM 0 HA TYR A 76 8.979 0.066 -0.192 1.00 0.00 H new ATOM 0 HB2 TYR A 76 6.145 -0.045 -1.267 1.00 0.00 H new ATOM 0 HB3 TYR A 76 7.642 -0.199 -2.165 1.00 0.00 H new ATOM 0 HD1 TYR A 76 5.533 -1.912 0.393 1.00 0.00 H new ATOM 0 HD2 TYR A 76 8.641 -2.336 -2.491 1.00 0.00 H new ATOM 0 HE1 TYR A 76 5.424 -4.351 0.638 1.00 0.00 H new ATOM 0 HE2 TYR A 76 8.533 -4.777 -2.251 1.00 0.00 H new ATOM 0 HH TYR A 76 7.573 -6.495 -1.249 1.00 0.00 H new ATOM 1109 N VAL A 77 8.398 2.423 -1.056 1.00 0.00 N ATOM 1110 CA VAL A 77 8.271 3.865 -1.227 1.00 0.00 C ATOM 1111 C VAL A 77 8.363 4.254 -2.698 1.00 0.00 C ATOM 1112 O VAL A 77 9.240 3.785 -3.421 1.00 0.00 O ATOM 1113 CB VAL A 77 9.356 4.622 -0.438 1.00 0.00 C ATOM 1114 CG1 VAL A 77 10.738 4.089 -0.786 1.00 0.00 C ATOM 1115 CG2 VAL A 77 9.268 6.116 -0.711 1.00 0.00 C ATOM 0 H VAL A 77 9.074 1.982 -1.679 1.00 0.00 H new ATOM 0 HA VAL A 77 7.291 4.144 -0.841 1.00 0.00 H new ATOM 0 HB VAL A 77 9.187 4.460 0.627 1.00 0.00 H new ATOM 0 HG11 VAL A 77 11.492 4.635 -0.219 1.00 0.00 H new ATOM 0 HG12 VAL A 77 10.793 3.030 -0.536 1.00 0.00 H new ATOM 0 HG13 VAL A 77 10.920 4.220 -1.853 1.00 0.00 H new ATOM 0 HG21 VAL A 77 10.042 6.635 -0.146 1.00 0.00 H new ATOM 0 HG22 VAL A 77 9.411 6.300 -1.776 1.00 0.00 H new ATOM 0 HG23 VAL A 77 8.288 6.484 -0.408 1.00 0.00 H new ATOM 1125 N ASN A 78 7.450 5.117 -3.134 1.00 0.00 N ATOM 1126 CA ASN A 78 7.428 5.570 -4.520 1.00 0.00 C ATOM 1127 C ASN A 78 7.382 4.385 -5.480 1.00 0.00 C ATOM 1128 O ASN A 78 8.179 4.298 -6.415 1.00 0.00 O ATOM 1129 CB ASN A 78 8.656 6.433 -4.816 1.00 0.00 C ATOM 1130 CG ASN A 78 8.412 7.903 -4.533 1.00 0.00 C ATOM 1131 OD1 ASN A 78 7.272 8.367 -4.543 1.00 0.00 O ATOM 1132 ND2 ASN A 78 9.486 8.642 -4.279 1.00 0.00 N ATOM 0 H ASN A 78 6.717 5.516 -2.548 1.00 0.00 H new ATOM 0 HA ASN A 78 6.528 6.168 -4.666 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.495 6.084 -4.214 1.00 0.00 H new ATOM 0 HB3 ASN A 78 8.940 6.309 -5.861 1.00 0.00 H new ATOM 0 HD21 ASN A 78 9.385 9.638 -4.081 1.00 0.00 H new ATOM 0 HD22 ASN A 78 10.412 8.214 -4.282 1.00 0.00 H new ATOM 1139 N LEU A 79 6.444 3.474 -5.242 1.00 0.00 N ATOM 1140 CA LEU A 79 6.293 2.293 -6.085 1.00 0.00 C ATOM 1141 C LEU A 79 6.276 2.677 -7.561 1.00 0.00 C ATOM 1142 O LEU A 79 6.974 2.076 -8.378 1.00 0.00 O ATOM 1143 CB LEU A 79 5.008 1.547 -5.725 1.00 0.00 C ATOM 1144 CG LEU A 79 5.115 0.537 -4.581 1.00 0.00 C ATOM 1145 CD1 LEU A 79 6.379 -0.296 -4.722 1.00 0.00 C ATOM 1146 CD2 LEU A 79 5.091 1.250 -3.237 1.00 0.00 C ATOM 0 H LEU A 79 5.777 3.531 -4.472 1.00 0.00 H new ATOM 0 HA LEU A 79 7.147 1.639 -5.909 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.246 2.282 -5.464 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.655 1.023 -6.613 1.00 0.00 H new ATOM 0 HG LEU A 79 4.256 -0.132 -4.630 1.00 0.00 H new ATOM 0 HD11 LEU A 79 6.439 -1.009 -3.900 1.00 0.00 H new ATOM 0 HD12 LEU A 79 6.356 -0.835 -5.669 1.00 0.00 H new ATOM 0 HD13 LEU A 79 7.250 0.358 -4.699 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.168 0.516 -2.435 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.931 1.942 -3.177 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.157 1.803 -3.135 1.00 0.00 H new ATOM 1158 N THR A 80 5.474 3.683 -7.897 1.00 0.00 N ATOM 1159 CA THR A 80 5.367 4.147 -9.274 1.00 0.00 C ATOM 1160 C THR A 80 6.737 4.491 -9.847 1.00 0.00 C ATOM 1161 O THR A 80 6.966 4.370 -11.051 1.00 0.00 O ATOM 1162 CB THR A 80 4.454 5.384 -9.380 1.00 0.00 C ATOM 1163 OG1 THR A 80 5.049 6.492 -8.695 1.00 0.00 O ATOM 1164 CG2 THR A 80 3.082 5.095 -8.791 1.00 0.00 C ATOM 0 H THR A 80 4.889 4.192 -7.234 1.00 0.00 H new ATOM 0 HA THR A 80 4.930 3.331 -9.849 1.00 0.00 H new ATOM 0 HB THR A 80 4.335 5.631 -10.435 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.464 7.275 -8.768 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.455 5.982 -8.877 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.620 4.270 -9.333 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.187 4.825 -7.740 1.00 0.00 H new ATOM 1172 N LEU A 81 7.646 4.919 -8.978 1.00 0.00 N ATOM 1173 CA LEU A 81 8.996 5.279 -9.398 1.00 0.00 C ATOM 1174 C LEU A 81 9.867 4.037 -9.556 1.00 0.00 C ATOM 1175 O LEU A 81 10.603 3.901 -10.534 1.00 0.00 O ATOM 1176 CB LEU A 81 9.629 6.234 -8.384 1.00 0.00 C ATOM 1177 CG LEU A 81 10.831 7.038 -8.880 1.00 0.00 C ATOM 1178 CD1 LEU A 81 10.927 8.365 -8.142 1.00 0.00 C ATOM 1179 CD2 LEU A 81 12.114 6.238 -8.710 1.00 0.00 C ATOM 0 H LEU A 81 7.473 5.025 -7.978 1.00 0.00 H new ATOM 0 HA LEU A 81 8.928 5.778 -10.365 1.00 0.00 H new ATOM 0 HB2 LEU A 81 8.864 6.933 -8.046 1.00 0.00 H new ATOM 0 HB3 LEU A 81 9.938 5.655 -7.514 1.00 0.00 H new ATOM 0 HG LEU A 81 10.693 7.245 -9.941 1.00 0.00 H new ATOM 0 HD11 LEU A 81 11.788 8.924 -8.508 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.019 8.944 -8.314 1.00 0.00 H new ATOM 0 HD13 LEU A 81 11.042 8.180 -7.074 1.00 0.00 H new ATOM 0 HD21 LEU A 81 12.959 6.826 -9.068 1.00 0.00 H new ATOM 0 HD22 LEU A 81 12.258 6.001 -7.656 1.00 0.00 H new ATOM 0 HD23 LEU A 81 12.045 5.314 -9.284 1.00 0.00 H new ATOM 1191 N THR A 82 9.777 3.130 -8.588 1.00 0.00 N ATOM 1192 CA THR A 82 10.556 1.899 -8.620 1.00 0.00 C ATOM 1193 C THR A 82 10.026 0.941 -9.681 1.00 0.00 C ATOM 1194 O THR A 82 10.733 0.037 -10.123 1.00 0.00 O ATOM 1195 CB THR A 82 10.542 1.190 -7.252 1.00 0.00 C ATOM 1196 OG1 THR A 82 9.242 0.649 -6.994 1.00 0.00 O ATOM 1197 CG2 THR A 82 10.926 2.153 -6.140 1.00 0.00 C ATOM 0 H THR A 82 9.172 3.225 -7.772 1.00 0.00 H new ATOM 0 HA THR A 82 11.580 2.179 -8.866 1.00 0.00 H new ATOM 0 HB THR A 82 11.272 0.381 -7.279 1.00 0.00 H new ATOM 0 HG1 THR A 82 8.567 1.180 -7.466 1.00 0.00 H new ATOM 0 HG21 THR A 82 10.909 1.630 -5.184 1.00 0.00 H new ATOM 0 HG22 THR A 82 11.928 2.540 -6.324 1.00 0.00 H new ATOM 0 HG23 THR A 82 10.216 2.980 -6.114 1.00 0.00 H new ATOM 1205 N GLY A 83 8.777 1.146 -10.087 1.00 0.00 N ATOM 1206 CA GLY A 83 8.174 0.293 -11.094 1.00 0.00 C ATOM 1207 C GLY A 83 8.253 -1.177 -10.731 1.00 0.00 C ATOM 1208 O GLY A 83 8.212 -2.041 -11.606 1.00 0.00 O ATOM 0 H GLY A 83 8.172 1.888 -9.736 1.00 0.00 H new ATOM 0 HA2 GLY A 83 7.130 0.576 -11.227 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.673 0.456 -12.050 1.00 0.00 H new ATOM 1212 N GLU A 84 8.368 -1.460 -9.438 1.00 0.00 N ATOM 1213 CA GLU A 84 8.456 -2.836 -8.963 1.00 0.00 C ATOM 1214 C GLU A 84 7.197 -3.227 -8.194 1.00 0.00 C ATOM 1215 O GLU A 84 6.873 -2.657 -7.152 1.00 0.00 O ATOM 1216 CB GLU A 84 9.687 -3.014 -8.071 1.00 0.00 C ATOM 1217 CG GLU A 84 11.000 -2.992 -8.835 1.00 0.00 C ATOM 1218 CD GLU A 84 12.108 -3.732 -8.111 1.00 0.00 C ATOM 1219 OE1 GLU A 84 12.247 -3.541 -6.885 1.00 0.00 O ATOM 1220 OE2 GLU A 84 12.837 -4.502 -8.772 1.00 0.00 O ATOM 0 H GLU A 84 8.402 -0.756 -8.701 1.00 0.00 H new ATOM 0 HA GLU A 84 8.548 -3.488 -9.832 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.699 -2.223 -7.321 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.604 -3.960 -7.536 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.852 -3.439 -9.818 1.00 0.00 H new ATOM 0 HG3 GLU A 84 11.304 -1.958 -8.997 1.00 0.00 H new ATOM 1227 N PRO A 85 6.469 -4.223 -8.720 1.00 0.00 N ATOM 1228 CA PRO A 85 5.234 -4.714 -8.101 1.00 0.00 C ATOM 1229 C PRO A 85 5.496 -5.462 -6.799 1.00 0.00 C ATOM 1230 O PRO A 85 6.589 -5.986 -6.582 1.00 0.00 O ATOM 1231 CB PRO A 85 4.660 -5.662 -9.157 1.00 0.00 C ATOM 1232 CG PRO A 85 5.842 -6.111 -9.945 1.00 0.00 C ATOM 1233 CD PRO A 85 6.795 -4.948 -9.960 1.00 0.00 C ATOM 0 HA PRO A 85 4.562 -3.899 -7.830 1.00 0.00 H new ATOM 0 HB2 PRO A 85 4.148 -6.506 -8.695 1.00 0.00 H new ATOM 0 HB3 PRO A 85 3.931 -5.155 -9.790 1.00 0.00 H new ATOM 0 HG2 PRO A 85 6.303 -6.988 -9.491 1.00 0.00 H new ATOM 0 HG3 PRO A 85 5.552 -6.391 -10.958 1.00 0.00 H new ATOM 0 HD2 PRO A 85 7.833 -5.280 -9.970 1.00 0.00 H new ATOM 0 HD3 PRO A 85 6.651 -4.322 -10.841 1.00 0.00 H new ATOM 1241 N ILE A 86 4.487 -5.509 -5.935 1.00 0.00 N ATOM 1242 CA ILE A 86 4.609 -6.195 -4.655 1.00 0.00 C ATOM 1243 C ILE A 86 4.306 -7.682 -4.797 1.00 0.00 C ATOM 1244 O ILE A 86 3.146 -8.095 -4.769 1.00 0.00 O ATOM 1245 CB ILE A 86 3.666 -5.588 -3.599 1.00 0.00 C ATOM 1246 CG1 ILE A 86 3.998 -4.112 -3.375 1.00 0.00 C ATOM 1247 CG2 ILE A 86 3.765 -6.363 -2.293 1.00 0.00 C ATOM 1248 CD1 ILE A 86 2.804 -3.280 -2.961 1.00 0.00 C ATOM 0 H ILE A 86 3.576 -5.080 -6.099 1.00 0.00 H new ATOM 0 HA ILE A 86 5.640 -6.067 -4.325 1.00 0.00 H new ATOM 0 HB ILE A 86 2.642 -5.659 -3.965 1.00 0.00 H new ATOM 0 HG12 ILE A 86 4.769 -4.034 -2.608 1.00 0.00 H new ATOM 0 HG13 ILE A 86 4.418 -3.699 -4.292 1.00 0.00 H new ATOM 0 HG21 ILE A 86 3.093 -5.922 -1.557 1.00 0.00 H new ATOM 0 HG22 ILE A 86 3.484 -7.402 -2.464 1.00 0.00 H new ATOM 0 HG23 ILE A 86 4.789 -6.320 -1.921 1.00 0.00 H new ATOM 0 HD11 ILE A 86 3.113 -2.244 -2.820 1.00 0.00 H new ATOM 0 HD12 ILE A 86 2.040 -3.328 -3.737 1.00 0.00 H new ATOM 0 HD13 ILE A 86 2.397 -3.668 -2.027 1.00 0.00 H new ATOM 1260 N ARG A 87 5.355 -8.483 -4.948 1.00 0.00 N ATOM 1261 CA ARG A 87 5.201 -9.926 -5.094 1.00 0.00 C ATOM 1262 C ARG A 87 5.081 -10.600 -3.730 1.00 0.00 C ATOM 1263 O ARG A 87 5.823 -10.281 -2.800 1.00 0.00 O ATOM 1264 CB ARG A 87 6.387 -10.512 -5.862 1.00 0.00 C ATOM 1265 CG ARG A 87 6.132 -11.910 -6.402 1.00 0.00 C ATOM 1266 CD ARG A 87 6.971 -12.191 -7.639 1.00 0.00 C ATOM 1267 NE ARG A 87 8.272 -12.762 -7.300 1.00 0.00 N ATOM 1268 CZ ARG A 87 9.232 -12.981 -8.191 1.00 0.00 C ATOM 1269 NH1 ARG A 87 9.039 -12.678 -9.467 1.00 0.00 N ATOM 1270 NH2 ARG A 87 10.389 -13.504 -7.805 1.00 0.00 N ATOM 0 H ARG A 87 6.321 -8.158 -4.973 1.00 0.00 H new ATOM 0 HA ARG A 87 4.286 -10.114 -5.655 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.634 -9.850 -6.692 1.00 0.00 H new ATOM 0 HB3 ARG A 87 7.257 -10.538 -5.206 1.00 0.00 H new ATOM 0 HG2 ARG A 87 6.360 -12.646 -5.631 1.00 0.00 H new ATOM 0 HG3 ARG A 87 5.075 -12.020 -6.645 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.433 -12.877 -8.293 1.00 0.00 H new ATOM 0 HD3 ARG A 87 7.115 -11.266 -8.197 1.00 0.00 H new ATOM 0 HE ARG A 87 8.453 -13.006 -6.326 1.00 0.00 H new ATOM 0 HH11 ARG A 87 8.151 -12.275 -9.767 1.00 0.00 H new ATOM 0 HH12 ARG A 87 9.778 -12.847 -10.149 1.00 0.00 H new ATOM 0 HH21 ARG A 87 10.541 -13.738 -6.824 1.00 0.00 H new ATOM 0 HH22 ARG A 87 11.126 -13.672 -8.489 1.00 0.00 H new ATOM 1284 N HIS A 88 4.142 -11.534 -3.619 1.00 0.00 N ATOM 1285 CA HIS A 88 3.925 -12.254 -2.369 1.00 0.00 C ATOM 1286 C HIS A 88 3.072 -13.498 -2.599 1.00 0.00 C ATOM 1287 O HIS A 88 2.247 -13.536 -3.513 1.00 0.00 O ATOM 1288 CB HIS A 88 3.251 -11.343 -1.341 1.00 0.00 C ATOM 1289 CG HIS A 88 2.667 -12.083 -0.178 1.00 0.00 C ATOM 1290 ND1 HIS A 88 3.348 -12.287 1.004 1.00 0.00 N ATOM 1291 CD2 HIS A 88 1.456 -12.667 -0.018 1.00 0.00 C ATOM 1292 CE1 HIS A 88 2.582 -12.966 1.839 1.00 0.00 C ATOM 1293 NE2 HIS A 88 1.429 -13.208 1.244 1.00 0.00 N ATOM 0 H HIS A 88 3.520 -11.810 -4.379 1.00 0.00 H new ATOM 0 HA HIS A 88 4.896 -12.566 -1.986 1.00 0.00 H new ATOM 0 HB2 HIS A 88 3.981 -10.622 -0.973 1.00 0.00 H new ATOM 0 HB3 HIS A 88 2.462 -10.775 -1.833 1.00 0.00 H new ATOM 0 HD2 HIS A 88 0.660 -12.701 -0.747 1.00 0.00 H new ATOM 0 HE1 HIS A 88 2.853 -13.271 2.839 1.00 0.00 H new ATOM 0 HE2 HIS A 88 0.645 -13.715 1.655 1.00 0.00 H new ATOM 1302 N ARG A 89 3.277 -14.513 -1.766 1.00 0.00 N ATOM 1303 CA ARG A 89 2.528 -15.759 -1.881 1.00 0.00 C ATOM 1304 C ARG A 89 2.073 -16.248 -0.509 1.00 0.00 C ATOM 1305 O ARG A 89 2.725 -15.987 0.502 1.00 0.00 O ATOM 1306 CB ARG A 89 3.383 -16.832 -2.559 1.00 0.00 C ATOM 1307 CG ARG A 89 4.742 -17.028 -1.908 1.00 0.00 C ATOM 1308 CD ARG A 89 5.235 -18.458 -2.069 1.00 0.00 C ATOM 1309 NE ARG A 89 4.775 -19.321 -0.984 1.00 0.00 N ATOM 1310 CZ ARG A 89 5.244 -19.256 0.256 1.00 0.00 C ATOM 1311 NH1 ARG A 89 6.183 -18.373 0.568 1.00 0.00 N ATOM 1312 NH2 ARG A 89 4.775 -20.076 1.188 1.00 0.00 N ATOM 0 H ARG A 89 3.955 -14.497 -1.004 1.00 0.00 H new ATOM 0 HA ARG A 89 1.645 -15.568 -2.491 1.00 0.00 H new ATOM 0 HB2 ARG A 89 2.842 -17.778 -2.544 1.00 0.00 H new ATOM 0 HB3 ARG A 89 3.526 -16.563 -3.606 1.00 0.00 H new ATOM 0 HG2 ARG A 89 5.462 -16.341 -2.353 1.00 0.00 H new ATOM 0 HG3 ARG A 89 4.678 -16.781 -0.848 1.00 0.00 H new ATOM 0 HD2 ARG A 89 4.886 -18.857 -3.022 1.00 0.00 H new ATOM 0 HD3 ARG A 89 6.325 -18.464 -2.100 1.00 0.00 H new ATOM 0 HE ARG A 89 4.054 -20.012 -1.191 1.00 0.00 H new ATOM 0 HH11 ARG A 89 6.547 -17.742 -0.146 1.00 0.00 H new ATOM 0 HH12 ARG A 89 6.542 -18.325 1.522 1.00 0.00 H new ATOM 0 HH21 ARG A 89 4.053 -20.757 0.952 1.00 0.00 H new ATOM 0 HH22 ARG A 89 5.136 -20.025 2.141 1.00 0.00 H new ATOM 1326 N TYR A 90 0.950 -16.956 -0.483 1.00 0.00 N ATOM 1327 CA TYR A 90 0.405 -17.479 0.765 1.00 0.00 C ATOM 1328 C TYR A 90 0.758 -18.953 0.938 1.00 0.00 C ATOM 1329 O TYR A 90 1.233 -19.602 0.006 1.00 0.00 O ATOM 1330 CB TYR A 90 -1.114 -17.299 0.798 1.00 0.00 C ATOM 1331 CG TYR A 90 -1.549 -15.861 0.968 1.00 0.00 C ATOM 1332 CD1 TYR A 90 -1.248 -15.156 2.126 1.00 0.00 C ATOM 1333 CD2 TYR A 90 -2.262 -15.208 -0.031 1.00 0.00 C ATOM 1334 CE1 TYR A 90 -1.645 -13.842 2.286 1.00 0.00 C ATOM 1335 CE2 TYR A 90 -2.661 -13.894 0.120 1.00 0.00 C ATOM 1336 CZ TYR A 90 -2.351 -13.216 1.280 1.00 0.00 C ATOM 1337 OH TYR A 90 -2.747 -11.907 1.435 1.00 0.00 O ATOM 0 H TYR A 90 0.399 -17.181 -1.311 1.00 0.00 H new ATOM 0 HA TYR A 90 0.848 -16.919 1.588 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -1.538 -17.691 -0.126 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.524 -17.893 1.615 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.694 -15.643 2.915 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -2.508 -15.737 -0.940 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.404 -13.308 3.193 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -3.213 -13.400 -0.666 1.00 0.00 H new ATOM 0 HH TYR A 90 -3.233 -11.615 0.636 1.00 0.00 H new ATOM 1347 N GLU A 91 0.520 -19.475 2.137 1.00 0.00 N ATOM 1348 CA GLU A 91 0.813 -20.873 2.433 1.00 0.00 C ATOM 1349 C GLU A 91 -0.467 -21.704 2.453 1.00 0.00 C ATOM 1350 O GLU A 91 -0.567 -22.724 1.772 1.00 0.00 O ATOM 1351 CB GLU A 91 1.532 -20.993 3.778 1.00 0.00 C ATOM 1352 CG GLU A 91 2.824 -20.196 3.850 1.00 0.00 C ATOM 1353 CD GLU A 91 3.302 -19.988 5.274 1.00 0.00 C ATOM 1354 OE1 GLU A 91 3.498 -20.993 5.988 1.00 0.00 O ATOM 1355 OE2 GLU A 91 3.481 -18.818 5.674 1.00 0.00 O ATOM 0 H GLU A 91 0.125 -18.952 2.919 1.00 0.00 H new ATOM 0 HA GLU A 91 1.463 -21.256 1.646 1.00 0.00 H new ATOM 0 HB2 GLU A 91 0.863 -20.656 4.570 1.00 0.00 H new ATOM 0 HB3 GLU A 91 1.751 -22.043 3.971 1.00 0.00 H new ATOM 0 HG2 GLU A 91 3.598 -20.713 3.283 1.00 0.00 H new ATOM 0 HG3 GLU A 91 2.675 -19.226 3.375 1.00 0.00 H new ATOM 1362 N SER A 92 -1.442 -21.260 3.239 1.00 0.00 N ATOM 1363 CA SER A 92 -2.714 -21.964 3.351 1.00 0.00 C ATOM 1364 C SER A 92 -3.849 -21.133 2.760 1.00 0.00 C ATOM 1365 O SER A 92 -3.757 -19.912 2.632 1.00 0.00 O ATOM 1366 CB SER A 92 -3.014 -22.289 4.816 1.00 0.00 C ATOM 1367 OG SER A 92 -2.337 -23.464 5.227 1.00 0.00 O ATOM 0 H SER A 92 -1.376 -20.416 3.808 1.00 0.00 H new ATOM 0 HA SER A 92 -2.637 -22.894 2.788 1.00 0.00 H new ATOM 0 HB2 SER A 92 -2.712 -21.452 5.446 1.00 0.00 H new ATOM 0 HB3 SER A 92 -4.088 -22.418 4.950 1.00 0.00 H new ATOM 0 HG SER A 92 -2.544 -23.649 6.167 1.00 0.00 H new ATOM 1373 N PRO A 93 -4.947 -21.810 2.392 1.00 0.00 N ATOM 1374 CA PRO A 93 -6.122 -21.156 1.809 1.00 0.00 C ATOM 1375 C PRO A 93 -6.872 -20.300 2.824 1.00 0.00 C ATOM 1376 O PRO A 93 -6.648 -20.409 4.028 1.00 0.00 O ATOM 1377 CB PRO A 93 -6.992 -22.330 1.353 1.00 0.00 C ATOM 1378 CG PRO A 93 -6.589 -23.464 2.232 1.00 0.00 C ATOM 1379 CD PRO A 93 -5.126 -23.267 2.516 1.00 0.00 C ATOM 0 HA PRO A 93 -5.851 -20.472 1.005 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -8.052 -22.102 1.462 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -6.822 -22.564 0.302 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -7.169 -23.468 3.155 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -6.766 -24.421 1.741 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -4.859 -23.621 3.512 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -4.502 -23.810 1.806 1.00 0.00 H new ATOM 1387 N GLY A 94 -7.763 -19.447 2.328 1.00 0.00 N ATOM 1388 CA GLY A 94 -8.533 -18.584 3.205 1.00 0.00 C ATOM 1389 C GLY A 94 -8.371 -17.117 2.864 1.00 0.00 C ATOM 1390 O GLY A 94 -7.284 -16.676 2.488 1.00 0.00 O ATOM 0 H GLY A 94 -7.965 -19.338 1.334 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -9.587 -18.854 3.141 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -8.223 -18.750 4.237 1.00 0.00 H new ATOM 1394 N ILE A 95 -9.454 -16.358 2.993 1.00 0.00 N ATOM 1395 CA ILE A 95 -9.426 -14.931 2.694 1.00 0.00 C ATOM 1396 C ILE A 95 -8.405 -14.207 3.564 1.00 0.00 C ATOM 1397 O ILE A 95 -8.377 -14.382 4.783 1.00 0.00 O ATOM 1398 CB ILE A 95 -10.810 -14.286 2.900 1.00 0.00 C ATOM 1399 CG1 ILE A 95 -11.756 -14.682 1.765 1.00 0.00 C ATOM 1400 CG2 ILE A 95 -10.681 -12.773 2.986 1.00 0.00 C ATOM 1401 CD1 ILE A 95 -12.380 -16.047 1.947 1.00 0.00 C ATOM 0 H ILE A 95 -10.361 -16.707 3.302 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.141 -14.833 1.647 1.00 0.00 H new ATOM 0 HB ILE A 95 -11.228 -14.650 3.839 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.548 -13.937 1.686 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.208 -14.665 0.823 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.667 -12.331 3.132 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -10.038 -12.510 3.826 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.246 -12.392 2.062 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -13.038 -16.261 1.105 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.595 -16.802 1.995 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.957 -16.063 2.872 1.00 0.00 H new ATOM 1413 N TYR A 96 -7.569 -13.391 2.932 1.00 0.00 N ATOM 1414 CA TYR A 96 -6.546 -12.640 3.648 1.00 0.00 C ATOM 1415 C TYR A 96 -6.874 -11.150 3.663 1.00 0.00 C ATOM 1416 O TYR A 96 -7.543 -10.641 2.763 1.00 0.00 O ATOM 1417 CB TYR A 96 -5.175 -12.865 3.007 1.00 0.00 C ATOM 1418 CG TYR A 96 -4.601 -14.239 3.272 1.00 0.00 C ATOM 1419 CD1 TYR A 96 -3.886 -14.502 4.434 1.00 0.00 C ATOM 1420 CD2 TYR A 96 -4.774 -15.274 2.361 1.00 0.00 C ATOM 1421 CE1 TYR A 96 -3.359 -15.755 4.681 1.00 0.00 C ATOM 1422 CE2 TYR A 96 -4.252 -16.530 2.600 1.00 0.00 C ATOM 1423 CZ TYR A 96 -3.545 -16.766 3.761 1.00 0.00 C ATOM 1424 OH TYR A 96 -3.023 -18.015 4.002 1.00 0.00 O ATOM 0 H TYR A 96 -7.580 -13.233 1.924 1.00 0.00 H new ATOM 0 HA TYR A 96 -6.522 -12.999 4.677 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -5.258 -12.716 1.930 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -4.481 -12.112 3.380 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -3.740 -13.713 5.157 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -5.326 -15.093 1.451 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -2.805 -15.942 5.589 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -4.396 -17.323 1.882 1.00 0.00 H new ATOM 0 HH TYR A 96 -3.654 -18.698 3.694 1.00 0.00 H new ATOM 1434 N ARG A 97 -6.396 -10.456 4.691 1.00 0.00 N ATOM 1435 CA ARG A 97 -6.638 -9.024 4.824 1.00 0.00 C ATOM 1436 C ARG A 97 -5.384 -8.226 4.479 1.00 0.00 C ATOM 1437 O ARG A 97 -4.401 -8.244 5.220 1.00 0.00 O ATOM 1438 CB ARG A 97 -7.091 -8.692 6.247 1.00 0.00 C ATOM 1439 CG ARG A 97 -7.947 -7.440 6.338 1.00 0.00 C ATOM 1440 CD ARG A 97 -7.094 -6.196 6.533 1.00 0.00 C ATOM 1441 NE ARG A 97 -6.212 -6.313 7.691 1.00 0.00 N ATOM 1442 CZ ARG A 97 -6.590 -6.040 8.934 1.00 0.00 C ATOM 1443 NH1 ARG A 97 -7.829 -5.635 9.180 1.00 0.00 N ATOM 1444 NH2 ARG A 97 -5.729 -6.171 9.935 1.00 0.00 N ATOM 0 H ARG A 97 -5.839 -10.862 5.443 1.00 0.00 H new ATOM 0 HA ARG A 97 -7.427 -8.748 4.125 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -7.653 -9.536 6.646 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -6.212 -8.567 6.879 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -8.541 -7.337 5.430 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -8.647 -7.536 7.168 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -6.496 -6.022 5.638 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -7.742 -5.328 6.657 1.00 0.00 H new ATOM 0 HE ARG A 97 -5.252 -6.622 7.536 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -8.494 -5.533 8.413 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -8.117 -5.426 10.136 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -4.775 -6.482 9.750 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -6.021 -5.961 10.890 1.00 0.00 H new ATOM 1458 N VAL A 98 -5.426 -7.528 3.349 1.00 0.00 N ATOM 1459 CA VAL A 98 -4.294 -6.723 2.905 1.00 0.00 C ATOM 1460 C VAL A 98 -4.630 -5.237 2.938 1.00 0.00 C ATOM 1461 O VAL A 98 -5.594 -4.793 2.313 1.00 0.00 O ATOM 1462 CB VAL A 98 -3.856 -7.108 1.479 1.00 0.00 C ATOM 1463 CG1 VAL A 98 -2.740 -6.193 0.998 1.00 0.00 C ATOM 1464 CG2 VAL A 98 -3.421 -8.565 1.431 1.00 0.00 C ATOM 0 H VAL A 98 -6.232 -7.504 2.724 1.00 0.00 H new ATOM 0 HA VAL A 98 -3.474 -6.922 3.595 1.00 0.00 H new ATOM 0 HB VAL A 98 -4.708 -6.985 0.810 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -2.444 -6.480 -0.011 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -3.092 -5.161 0.993 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.884 -6.281 1.667 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -3.115 -8.820 0.416 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -2.584 -8.717 2.112 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -4.253 -9.203 1.730 1.00 0.00 H new ATOM 1474 N SER A 99 -3.829 -4.470 3.671 1.00 0.00 N ATOM 1475 CA SER A 99 -4.043 -3.033 3.788 1.00 0.00 C ATOM 1476 C SER A 99 -2.758 -2.266 3.489 1.00 0.00 C ATOM 1477 O SER A 99 -1.664 -2.830 3.514 1.00 0.00 O ATOM 1478 CB SER A 99 -4.543 -2.683 5.191 1.00 0.00 C ATOM 1479 OG SER A 99 -5.958 -2.728 5.253 1.00 0.00 O ATOM 0 H SER A 99 -3.026 -4.820 4.193 1.00 0.00 H new ATOM 0 HA SER A 99 -4.798 -2.743 3.057 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.122 -3.380 5.915 1.00 0.00 H new ATOM 0 HB3 SER A 99 -4.195 -1.688 5.467 1.00 0.00 H new ATOM 0 HG SER A 99 -6.259 -2.380 6.118 1.00 0.00 H new ATOM 1485 N VAL A 100 -2.900 -0.975 3.205 1.00 0.00 N ATOM 1486 CA VAL A 100 -1.752 -0.129 2.901 1.00 0.00 C ATOM 1487 C VAL A 100 -1.842 1.204 3.636 1.00 0.00 C ATOM 1488 O VAL A 100 -2.785 1.971 3.439 1.00 0.00 O ATOM 1489 CB VAL A 100 -1.636 0.138 1.388 1.00 0.00 C ATOM 1490 CG1 VAL A 100 -2.921 0.752 0.854 1.00 0.00 C ATOM 1491 CG2 VAL A 100 -0.444 1.038 1.096 1.00 0.00 C ATOM 0 H VAL A 100 -3.798 -0.493 3.179 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.865 -0.667 3.236 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.478 -0.813 0.880 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -2.820 0.934 -0.216 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -3.751 0.068 1.029 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.114 1.695 1.365 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.377 1.216 0.023 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.570 1.988 1.615 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.470 0.555 1.441 1.00 0.00 H new ATOM 1501 N ARG A 101 -0.855 1.474 4.483 1.00 0.00 N ATOM 1502 CA ARG A 101 -0.823 2.715 5.249 1.00 0.00 C ATOM 1503 C ARG A 101 0.212 3.679 4.677 1.00 0.00 C ATOM 1504 O ARG A 101 1.283 3.266 4.235 1.00 0.00 O ATOM 1505 CB ARG A 101 -0.508 2.424 6.717 1.00 0.00 C ATOM 1506 CG ARG A 101 -0.965 3.520 7.666 1.00 0.00 C ATOM 1507 CD ARG A 101 -0.381 3.333 9.057 1.00 0.00 C ATOM 1508 NE ARG A 101 -1.133 4.067 10.071 1.00 0.00 N ATOM 1509 CZ ARG A 101 -0.670 4.320 11.290 1.00 0.00 C ATOM 1510 NH1 ARG A 101 0.536 3.899 11.645 1.00 0.00 N ATOM 1511 NH2 ARG A 101 -1.415 4.995 12.157 1.00 0.00 N ATOM 0 H ARG A 101 -0.067 0.851 4.657 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.806 3.181 5.181 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -0.983 1.486 7.003 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.567 2.283 6.828 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.666 4.491 7.272 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -2.053 3.521 7.725 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -0.375 2.272 9.308 1.00 0.00 H new ATOM 0 HD3 ARG A 101 0.656 3.668 9.062 1.00 0.00 H new ATOM 0 HE ARG A 101 -2.065 4.404 9.830 1.00 0.00 H new ATOM 0 HH11 ARG A 101 1.111 3.380 10.981 1.00 0.00 H new ATOM 0 HH12 ARG A 101 0.889 4.095 12.582 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -2.344 5.320 11.887 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -1.059 5.189 13.093 1.00 0.00 H new ATOM 1525 N ALA A 102 -0.117 4.967 4.689 1.00 0.00 N ATOM 1526 CA ALA A 102 0.784 5.991 4.173 1.00 0.00 C ATOM 1527 C ALA A 102 0.584 7.315 4.902 1.00 0.00 C ATOM 1528 O ALA A 102 -0.541 7.797 5.035 1.00 0.00 O ATOM 1529 CB ALA A 102 0.575 6.172 2.677 1.00 0.00 C ATOM 0 H ALA A 102 -1.001 5.326 5.050 1.00 0.00 H new ATOM 0 HA ALA A 102 1.808 5.661 4.348 1.00 0.00 H new ATOM 0 HB1 ALA A 102 1.254 6.939 2.305 1.00 0.00 H new ATOM 0 HB2 ALA A 102 0.776 5.231 2.165 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.455 6.476 2.488 1.00 0.00 H new ATOM 1535 N GLU A 103 1.682 7.898 5.372 1.00 0.00 N ATOM 1536 CA GLU A 103 1.626 9.167 6.089 1.00 0.00 C ATOM 1537 C GLU A 103 2.924 9.949 5.913 1.00 0.00 C ATOM 1538 O GLU A 103 3.949 9.611 6.503 1.00 0.00 O ATOM 1539 CB GLU A 103 1.360 8.926 7.576 1.00 0.00 C ATOM 1540 CG GLU A 103 1.139 10.203 8.369 1.00 0.00 C ATOM 1541 CD GLU A 103 1.189 9.976 9.868 1.00 0.00 C ATOM 1542 OE1 GLU A 103 2.081 9.231 10.326 1.00 0.00 O ATOM 1543 OE2 GLU A 103 0.337 10.543 10.582 1.00 0.00 O ATOM 0 H GLU A 103 2.621 7.512 5.269 1.00 0.00 H new ATOM 0 HA GLU A 103 0.809 9.755 5.672 1.00 0.00 H new ATOM 0 HB2 GLU A 103 0.483 8.287 7.681 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.203 8.384 8.004 1.00 0.00 H new ATOM 0 HG2 GLU A 103 1.897 10.935 8.091 1.00 0.00 H new ATOM 0 HG3 GLU A 103 0.172 10.629 8.102 1.00 0.00 H new ATOM 1550 N ASN A 104 2.871 10.997 5.097 1.00 0.00 N ATOM 1551 CA ASN A 104 4.042 11.827 4.842 1.00 0.00 C ATOM 1552 C ASN A 104 3.822 13.249 5.350 1.00 0.00 C ATOM 1553 O ASN A 104 2.704 13.631 5.696 1.00 0.00 O ATOM 1554 CB ASN A 104 4.359 11.852 3.345 1.00 0.00 C ATOM 1555 CG ASN A 104 3.449 12.790 2.576 1.00 0.00 C ATOM 1556 OD1 ASN A 104 3.863 13.873 2.162 1.00 0.00 O ATOM 1557 ND2 ASN A 104 2.202 12.377 2.382 1.00 0.00 N ATOM 0 H ASN A 104 2.030 11.291 4.601 1.00 0.00 H new ATOM 0 HA ASN A 104 4.887 11.395 5.379 1.00 0.00 H new ATOM 0 HB2 ASN A 104 5.396 12.157 3.201 1.00 0.00 H new ATOM 0 HB3 ASN A 104 4.264 10.845 2.940 1.00 0.00 H new ATOM 0 HD21 ASN A 104 1.543 12.965 1.872 1.00 0.00 H new ATOM 0 HD22 ASN A 104 1.903 11.471 2.743 1.00 0.00 H new ATOM 1564 N THR A 105 4.897 14.030 5.391 1.00 0.00 N ATOM 1565 CA THR A 105 4.823 15.409 5.856 1.00 0.00 C ATOM 1566 C THR A 105 3.638 16.137 5.232 1.00 0.00 C ATOM 1567 O THR A 105 2.963 16.925 5.893 1.00 0.00 O ATOM 1568 CB THR A 105 6.115 16.182 5.532 1.00 0.00 C ATOM 1569 OG1 THR A 105 5.972 17.556 5.910 1.00 0.00 O ATOM 1570 CG2 THR A 105 6.442 16.091 4.049 1.00 0.00 C ATOM 0 H THR A 105 5.830 13.730 5.107 1.00 0.00 H new ATOM 0 HA THR A 105 4.694 15.371 6.938 1.00 0.00 H new ATOM 0 HB THR A 105 6.932 15.733 6.097 1.00 0.00 H new ATOM 0 HG1 THR A 105 6.798 18.040 5.702 1.00 0.00 H new ATOM 0 HG21 THR A 105 7.358 16.644 3.844 1.00 0.00 H new ATOM 0 HG22 THR A 105 6.579 15.046 3.770 1.00 0.00 H new ATOM 0 HG23 THR A 105 5.623 16.517 3.469 1.00 0.00 H new ATOM 1578 N ALA A 106 3.390 15.867 3.954 1.00 0.00 N ATOM 1579 CA ALA A 106 2.284 16.495 3.242 1.00 0.00 C ATOM 1580 C ALA A 106 0.942 16.079 3.834 1.00 0.00 C ATOM 1581 O ALA A 106 0.262 16.878 4.477 1.00 0.00 O ATOM 1582 CB ALA A 106 2.342 16.143 1.762 1.00 0.00 C ATOM 0 H ALA A 106 3.940 15.218 3.391 1.00 0.00 H new ATOM 0 HA ALA A 106 2.380 17.575 3.352 1.00 0.00 H new ATOM 0 HB1 ALA A 106 1.510 16.618 1.242 1.00 0.00 H new ATOM 0 HB2 ALA A 106 3.283 16.496 1.341 1.00 0.00 H new ATOM 0 HB3 ALA A 106 2.274 15.062 1.642 1.00 0.00 H new ATOM 1588 N GLY A 107 0.566 14.823 3.613 1.00 0.00 N ATOM 1589 CA GLY A 107 -0.694 14.323 4.131 1.00 0.00 C ATOM 1590 C GLY A 107 -0.623 12.858 4.513 1.00 0.00 C ATOM 1591 O GLY A 107 0.425 12.369 4.935 1.00 0.00 O ATOM 0 H GLY A 107 1.112 14.143 3.084 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -0.983 14.909 5.003 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -1.473 14.462 3.381 1.00 0.00 H new ATOM 1595 N HIS A 108 -1.742 12.156 4.368 1.00 0.00 N ATOM 1596 CA HIS A 108 -1.804 10.737 4.702 1.00 0.00 C ATOM 1597 C HIS A 108 -2.916 10.043 3.922 1.00 0.00 C ATOM 1598 O HIS A 108 -3.782 10.697 3.342 1.00 0.00 O ATOM 1599 CB HIS A 108 -2.027 10.555 6.204 1.00 0.00 C ATOM 1600 CG HIS A 108 -3.472 10.550 6.598 1.00 0.00 C ATOM 1601 ND1 HIS A 108 -4.402 11.416 6.060 1.00 0.00 N ATOM 1602 CD2 HIS A 108 -4.147 9.778 7.481 1.00 0.00 C ATOM 1603 CE1 HIS A 108 -5.585 11.177 6.597 1.00 0.00 C ATOM 1604 NE2 HIS A 108 -5.457 10.187 7.462 1.00 0.00 N ATOM 0 H HIS A 108 -2.618 12.546 4.021 1.00 0.00 H new ATOM 0 HA HIS A 108 -0.853 10.282 4.426 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -1.569 9.618 6.520 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -1.516 11.356 6.739 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -3.732 8.987 8.088 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -6.501 11.702 6.368 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -6.210 9.791 8.025 1.00 0.00 H new ATOM 1613 N ASP A 109 -2.884 8.715 3.912 1.00 0.00 N ATOM 1614 CA ASP A 109 -3.889 7.931 3.203 1.00 0.00 C ATOM 1615 C ASP A 109 -3.779 6.453 3.562 1.00 0.00 C ATOM 1616 O ASP A 109 -2.724 5.986 3.992 1.00 0.00 O ATOM 1617 CB ASP A 109 -3.738 8.115 1.692 1.00 0.00 C ATOM 1618 CG ASP A 109 -5.055 7.968 0.956 1.00 0.00 C ATOM 1619 OD1 ASP A 109 -5.742 6.947 1.168 1.00 0.00 O ATOM 1620 OD2 ASP A 109 -5.399 8.874 0.168 1.00 0.00 O ATOM 0 H ASP A 109 -2.173 8.159 4.387 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.873 8.287 3.508 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.320 9.101 1.489 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.027 7.383 1.309 1.00 0.00 H new ATOM 1625 N GLU A 110 -4.875 5.722 3.384 1.00 0.00 N ATOM 1626 CA GLU A 110 -4.901 4.297 3.692 1.00 0.00 C ATOM 1627 C GLU A 110 -5.966 3.581 2.866 1.00 0.00 C ATOM 1628 O GLU A 110 -6.989 4.166 2.512 1.00 0.00 O ATOM 1629 CB GLU A 110 -5.164 4.079 5.183 1.00 0.00 C ATOM 1630 CG GLU A 110 -5.096 2.622 5.607 1.00 0.00 C ATOM 1631 CD GLU A 110 -5.500 2.415 7.054 1.00 0.00 C ATOM 1632 OE1 GLU A 110 -4.861 3.018 7.941 1.00 0.00 O ATOM 1633 OE2 GLU A 110 -6.457 1.651 7.299 1.00 0.00 O ATOM 0 H GLU A 110 -5.756 6.093 3.028 1.00 0.00 H new ATOM 0 HA GLU A 110 -3.927 3.879 3.438 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.436 4.650 5.759 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -6.149 4.475 5.431 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.747 2.030 4.964 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.081 2.252 5.461 1.00 0.00 H new ATOM 1640 N ALA A 111 -5.716 2.311 2.563 1.00 0.00 N ATOM 1641 CA ALA A 111 -6.654 1.515 1.781 1.00 0.00 C ATOM 1642 C ALA A 111 -6.749 0.092 2.321 1.00 0.00 C ATOM 1643 O ALA A 111 -5.881 -0.358 3.069 1.00 0.00 O ATOM 1644 CB ALA A 111 -6.239 1.499 0.317 1.00 0.00 C ATOM 0 H ALA A 111 -4.873 1.812 2.847 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.639 1.974 1.863 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.948 0.901 -0.256 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -6.229 2.518 -0.069 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -5.243 1.066 0.226 1.00 0.00 H new ATOM 1650 N VAL A 112 -7.809 -0.612 1.938 1.00 0.00 N ATOM 1651 CA VAL A 112 -8.018 -1.984 2.383 1.00 0.00 C ATOM 1652 C VAL A 112 -8.433 -2.882 1.223 1.00 0.00 C ATOM 1653 O VAL A 112 -9.202 -2.474 0.352 1.00 0.00 O ATOM 1654 CB VAL A 112 -9.091 -2.060 3.485 1.00 0.00 C ATOM 1655 CG1 VAL A 112 -9.247 -3.489 3.983 1.00 0.00 C ATOM 1656 CG2 VAL A 112 -8.744 -1.122 4.632 1.00 0.00 C ATOM 0 H VAL A 112 -8.537 -0.254 1.320 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.068 -2.333 2.787 1.00 0.00 H new ATOM 0 HB VAL A 112 -10.044 -1.743 3.061 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -10.010 -3.522 4.761 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -9.545 -4.132 3.155 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -8.298 -3.838 4.390 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -9.513 -1.189 5.402 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -7.781 -1.406 5.056 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.689 -0.098 4.261 1.00 0.00 H new ATOM 1666 N LEU A 113 -7.919 -4.107 1.217 1.00 0.00 N ATOM 1667 CA LEU A 113 -8.236 -5.065 0.163 1.00 0.00 C ATOM 1668 C LEU A 113 -8.253 -6.489 0.709 1.00 0.00 C ATOM 1669 O LEU A 113 -7.403 -6.866 1.516 1.00 0.00 O ATOM 1670 CB LEU A 113 -7.221 -4.955 -0.976 1.00 0.00 C ATOM 1671 CG LEU A 113 -7.738 -5.303 -2.372 1.00 0.00 C ATOM 1672 CD1 LEU A 113 -6.798 -4.765 -3.439 1.00 0.00 C ATOM 1673 CD2 LEU A 113 -7.908 -6.808 -2.518 1.00 0.00 C ATOM 0 H LEU A 113 -7.281 -4.461 1.930 1.00 0.00 H new ATOM 0 HA LEU A 113 -9.229 -4.831 -0.220 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.837 -3.935 -0.996 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.378 -5.608 -0.749 1.00 0.00 H new ATOM 0 HG LEU A 113 -8.712 -4.833 -2.505 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -7.182 -5.022 -4.426 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -6.727 -3.681 -3.349 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -5.809 -5.205 -3.309 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -8.277 -7.037 -3.518 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.947 -7.299 -2.364 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.622 -7.167 -1.777 1.00 0.00 H new ATOM 1685 N PHE A 114 -9.224 -7.277 0.261 1.00 0.00 N ATOM 1686 CA PHE A 114 -9.351 -8.661 0.703 1.00 0.00 C ATOM 1687 C PHE A 114 -9.091 -9.626 -0.450 1.00 0.00 C ATOM 1688 O PHE A 114 -9.730 -9.545 -1.499 1.00 0.00 O ATOM 1689 CB PHE A 114 -10.745 -8.907 1.285 1.00 0.00 C ATOM 1690 CG PHE A 114 -11.002 -8.160 2.562 1.00 0.00 C ATOM 1691 CD1 PHE A 114 -11.332 -6.815 2.538 1.00 0.00 C ATOM 1692 CD2 PHE A 114 -10.913 -8.803 3.786 1.00 0.00 C ATOM 1693 CE1 PHE A 114 -11.570 -6.124 3.712 1.00 0.00 C ATOM 1694 CE2 PHE A 114 -11.150 -8.118 4.963 1.00 0.00 C ATOM 1695 CZ PHE A 114 -11.478 -6.776 4.925 1.00 0.00 C ATOM 0 H PHE A 114 -9.935 -6.981 -0.408 1.00 0.00 H new ATOM 0 HA PHE A 114 -8.605 -8.839 1.478 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -11.494 -8.618 0.548 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -10.871 -9.974 1.466 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -11.404 -6.300 1.591 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -10.656 -9.851 3.821 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -11.827 -5.076 3.680 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -11.079 -8.631 5.911 1.00 0.00 H new ATOM 0 HZ PHE A 114 -11.662 -6.238 5.843 1.00 0.00 H new ATOM 1705 N VAL A 115 -8.146 -10.540 -0.247 1.00 0.00 N ATOM 1706 CA VAL A 115 -7.801 -11.522 -1.268 1.00 0.00 C ATOM 1707 C VAL A 115 -8.448 -12.870 -0.975 1.00 0.00 C ATOM 1708 O VAL A 115 -8.279 -13.428 0.109 1.00 0.00 O ATOM 1709 CB VAL A 115 -6.275 -11.709 -1.373 1.00 0.00 C ATOM 1710 CG1 VAL A 115 -5.944 -12.939 -2.203 1.00 0.00 C ATOM 1711 CG2 VAL A 115 -5.626 -10.466 -1.963 1.00 0.00 C ATOM 0 H VAL A 115 -7.606 -10.620 0.615 1.00 0.00 H new ATOM 0 HA VAL A 115 -8.179 -11.140 -2.216 1.00 0.00 H new ATOM 0 HB VAL A 115 -5.874 -11.859 -0.370 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.862 -13.055 -2.266 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -6.377 -13.822 -1.733 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -6.356 -12.823 -3.206 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -4.548 -10.615 -2.030 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -6.030 -10.283 -2.959 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.834 -9.608 -1.323 1.00 0.00 H new ATOM 1721 N GLN A 116 -9.190 -13.388 -1.948 1.00 0.00 N ATOM 1722 CA GLN A 116 -9.863 -14.672 -1.794 1.00 0.00 C ATOM 1723 C GLN A 116 -9.041 -15.796 -2.416 1.00 0.00 C ATOM 1724 O GLN A 116 -8.855 -15.844 -3.632 1.00 0.00 O ATOM 1725 CB GLN A 116 -11.251 -14.625 -2.436 1.00 0.00 C ATOM 1726 CG GLN A 116 -11.859 -15.997 -2.673 1.00 0.00 C ATOM 1727 CD GLN A 116 -13.368 -15.951 -2.817 1.00 0.00 C ATOM 1728 OE1 GLN A 116 -13.898 -15.976 -3.928 1.00 0.00 O ATOM 1729 NE2 GLN A 116 -14.068 -15.882 -1.691 1.00 0.00 N ATOM 0 H GLN A 116 -9.340 -12.938 -2.851 1.00 0.00 H new ATOM 0 HA GLN A 116 -9.970 -14.871 -0.728 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -11.918 -14.047 -1.797 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -11.184 -14.097 -3.387 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -11.425 -16.432 -3.574 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -11.597 -16.654 -1.844 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -13.587 -15.864 -0.792 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -15.087 -15.847 -1.725 1.00 0.00 H new ATOM 1738 N VAL A 117 -8.551 -16.700 -1.574 1.00 0.00 N ATOM 1739 CA VAL A 117 -7.749 -17.825 -2.040 1.00 0.00 C ATOM 1740 C VAL A 117 -8.479 -19.146 -1.829 1.00 0.00 C ATOM 1741 O VAL A 117 -8.924 -19.451 -0.722 1.00 0.00 O ATOM 1742 CB VAL A 117 -6.389 -17.881 -1.320 1.00 0.00 C ATOM 1743 CG1 VAL A 117 -6.554 -17.564 0.158 1.00 0.00 C ATOM 1744 CG2 VAL A 117 -5.741 -19.245 -1.512 1.00 0.00 C ATOM 0 H VAL A 117 -8.696 -16.675 -0.565 1.00 0.00 H new ATOM 0 HA VAL A 117 -7.581 -17.673 -3.106 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.734 -17.128 -1.758 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.583 -17.608 0.650 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.973 -16.564 0.271 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.225 -18.292 0.614 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -4.781 -19.267 -0.997 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.391 -20.018 -1.102 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -5.587 -19.428 -2.575 1.00 0.00 H new ATOM 1754 N SER A 118 -8.599 -19.928 -2.897 1.00 0.00 N ATOM 1755 CA SER A 118 -9.279 -21.216 -2.829 1.00 0.00 C ATOM 1756 C SER A 118 -8.384 -22.269 -2.182 1.00 0.00 C ATOM 1757 O SER A 118 -7.251 -21.984 -1.795 1.00 0.00 O ATOM 1758 CB SER A 118 -9.692 -21.673 -4.230 1.00 0.00 C ATOM 1759 OG SER A 118 -10.702 -22.664 -4.165 1.00 0.00 O ATOM 0 H SER A 118 -8.234 -19.692 -3.820 1.00 0.00 H new ATOM 0 HA SER A 118 -10.172 -21.096 -2.215 1.00 0.00 H new ATOM 0 HB2 SER A 118 -10.052 -20.819 -4.803 1.00 0.00 H new ATOM 0 HB3 SER A 118 -8.824 -22.068 -4.758 1.00 0.00 H new ATOM 0 HG SER A 118 -10.950 -22.938 -5.073 1.00 0.00 H new ATOM 1765 N GLY A 119 -8.903 -23.488 -2.067 1.00 0.00 N ATOM 1766 CA GLY A 119 -8.139 -24.565 -1.465 1.00 0.00 C ATOM 1767 C GLY A 119 -7.514 -25.480 -2.500 1.00 0.00 C ATOM 1768 O GLY A 119 -7.473 -25.170 -3.691 1.00 0.00 O ATOM 0 H GLY A 119 -9.838 -23.749 -2.380 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -7.355 -24.143 -0.836 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -8.790 -25.149 -0.814 1.00 0.00 H new ATOM 1772 N PRO A 120 -7.010 -26.637 -2.045 1.00 0.00 N ATOM 1773 CA PRO A 120 -6.374 -27.623 -2.924 1.00 0.00 C ATOM 1774 C PRO A 120 -7.375 -28.309 -3.847 1.00 0.00 C ATOM 1775 O PRO A 120 -7.014 -29.197 -4.619 1.00 0.00 O ATOM 1776 CB PRO A 120 -5.771 -28.633 -1.944 1.00 0.00 C ATOM 1777 CG PRO A 120 -6.604 -28.514 -0.716 1.00 0.00 C ATOM 1778 CD PRO A 120 -7.024 -27.072 -0.638 1.00 0.00 C ATOM 0 HA PRO A 120 -5.643 -27.164 -3.590 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -5.804 -29.645 -2.348 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -4.725 -28.407 -1.736 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -7.472 -29.171 -0.768 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -6.038 -28.804 0.169 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -8.014 -26.965 -0.194 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -6.336 -26.485 -0.029 1.00 0.00 H new ATOM 1786 N SER A 121 -8.634 -27.890 -3.762 1.00 0.00 N ATOM 1787 CA SER A 121 -9.688 -28.467 -4.589 1.00 0.00 C ATOM 1788 C SER A 121 -9.196 -28.698 -6.014 1.00 0.00 C ATOM 1789 O SER A 121 -9.513 -29.713 -6.635 1.00 0.00 O ATOM 1790 CB SER A 121 -10.913 -27.550 -4.603 1.00 0.00 C ATOM 1791 OG SER A 121 -10.663 -26.376 -5.356 1.00 0.00 O ATOM 0 H SER A 121 -8.949 -27.154 -3.130 1.00 0.00 H new ATOM 0 HA SER A 121 -9.967 -29.429 -4.159 1.00 0.00 H new ATOM 0 HB2 SER A 121 -11.765 -28.082 -5.026 1.00 0.00 H new ATOM 0 HB3 SER A 121 -11.181 -27.280 -3.581 1.00 0.00 H new ATOM 0 HG SER A 121 -11.461 -25.808 -5.351 1.00 0.00 H new ATOM 1797 N SER A 122 -8.418 -27.750 -6.526 1.00 0.00 N ATOM 1798 CA SER A 122 -7.884 -27.847 -7.880 1.00 0.00 C ATOM 1799 C SER A 122 -6.715 -28.826 -7.933 1.00 0.00 C ATOM 1800 O SER A 122 -5.557 -28.422 -8.031 1.00 0.00 O ATOM 1801 CB SER A 122 -7.435 -26.471 -8.374 1.00 0.00 C ATOM 1802 OG SER A 122 -6.806 -26.564 -9.640 1.00 0.00 O ATOM 0 H SER A 122 -8.143 -26.906 -6.024 1.00 0.00 H new ATOM 0 HA SER A 122 -8.676 -28.217 -8.531 1.00 0.00 H new ATOM 0 HB2 SER A 122 -8.296 -25.806 -8.440 1.00 0.00 H new ATOM 0 HB3 SER A 122 -6.746 -26.030 -7.654 1.00 0.00 H new ATOM 0 HG SER A 122 -6.530 -25.671 -9.934 1.00 0.00 H new ATOM 1808 N GLY A 123 -7.028 -30.116 -7.868 1.00 0.00 N ATOM 1809 CA GLY A 123 -5.993 -31.134 -7.911 1.00 0.00 C ATOM 1810 C GLY A 123 -6.555 -32.522 -8.145 1.00 0.00 C ATOM 1811 O GLY A 123 -6.121 -33.488 -7.518 1.00 0.00 O ATOM 0 H GLY A 123 -7.979 -30.475 -7.786 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -5.284 -30.894 -8.704 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -5.438 -31.123 -6.973 1.00 0.00 H new TER 1815 GLY A 123