USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1028 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 22 MET CE :methyl 144:sc= -6.67! (180deg=-5.4!) USER MOD Set 1.2: A 74 ASN :FLIP amide:sc= -1.64 F(o=-14!,f=-8.8) USER MOD Set 1.3: A 77 TYR OH : rot 30:sc= -0.511 USER MOD Set 2.1: A 33 TYR OH : rot -104:sc= 0.00196 USER MOD Set 2.2: A 64 LYS NZ :NH3+ 143:sc= 1.15 (180deg=0.25) 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 10 LYS NZ :NH3+ 162:sc= -0.0269 (180deg=-0.216) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.36 USER MOD Single : A 25 LYS NZ :NH3+ -136:sc= -0.791 (180deg=-2.43!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 CYS SG : rot 180:sc= -0.963 USER MOD Single : A 39 HIS : no HD1:sc= -0.119 X(o=-0.12,f=0.019) USER MOD Single : A 40 CYS SG : rot -136:sc= -3.61! USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= -1.51 K(o=-1.5,f=-3.2!) USER MOD Single : A 47 TYR OH : rot -175:sc= -2.44 USER MOD Single : A 48 THR OG1 : rot 75:sc= 0.494 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 91:sc= -0.11 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= -2.77! C(o=-2.8!,f=-2.7!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 MET CE :methyl -150:sc= -4.43! (180deg=-7.97!) USER MOD Single : A 68 THR OG1 : rot 150:sc= 0 USER MOD Single : A 70 ASN : amide:sc= 0.287 K(o=0.29,f=-2.5!) USER MOD Single : A 73 THR OG1 : rot -167:sc= 0.468 USER MOD Single : A 76 GLN : amide:sc= -1.27 X(o=-1.3,f=-0.92) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -53:sc= 1.27 USER MOD Single : A 86 TYR OH : rot -150:sc= 0.0773 USER MOD Single : A 90 SER OG : rot -160:sc= -1.58 USER MOD Single : A 93 LYS NZ :NH3+ 161:sc= -1.84 (180deg=-2.23) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc=-0.00867 X(o=-0.0087,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= -0.0807 K(o=-0.081,f=-2.5!) USER MOD Single : A 108 HIS : no HE2:sc= 1.03 K(o=1,f=-4!) USER MOD Single : A 110 SER OG : rot -8:sc= -0.0866 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 HIS : no HE2:sc= -11.7! C(o=-12!,f=-12!) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot -23:sc= 0.537 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.246 -7.695 -18.721 1.00 0.00 N ATOM 2 CA GLY A 1 7.770 -6.352 -18.447 1.00 0.00 C ATOM 3 C GLY A 1 8.297 -5.336 -19.441 1.00 0.00 C ATOM 4 O GLY A 1 9.265 -4.629 -19.163 1.00 0.00 O ATOM 0 H1 GLY A 1 7.858 -8.352 -18.014 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.937 -7.986 -19.670 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.285 -7.711 -18.675 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.680 -6.345 -18.468 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.071 -6.061 -17.441 1.00 0.00 H new ATOM 8 N SER A 2 7.659 -5.264 -20.605 1.00 0.00 N ATOM 9 CA SER A 2 8.072 -4.331 -21.647 1.00 0.00 C ATOM 10 C SER A 2 7.045 -3.215 -21.816 1.00 0.00 C ATOM 11 O SER A 2 6.724 -2.816 -22.935 1.00 0.00 O ATOM 12 CB SER A 2 8.265 -5.067 -22.974 1.00 0.00 C ATOM 13 OG SER A 2 9.373 -5.948 -22.911 1.00 0.00 O ATOM 0 H SER A 2 6.854 -5.841 -20.850 1.00 0.00 H new ATOM 0 HA SER A 2 9.020 -3.886 -21.346 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.363 -5.629 -23.217 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.416 -4.344 -23.776 1.00 0.00 H new ATOM 0 HG SER A 2 9.475 -6.408 -23.770 1.00 0.00 H new ATOM 19 N SER A 3 6.533 -2.716 -20.695 1.00 0.00 N ATOM 20 CA SER A 3 5.539 -1.650 -20.718 1.00 0.00 C ATOM 21 C SER A 3 6.206 -0.283 -20.596 1.00 0.00 C ATOM 22 O SER A 3 7.068 -0.074 -19.745 1.00 0.00 O ATOM 23 CB SER A 3 4.530 -1.840 -19.584 1.00 0.00 C ATOM 24 OG SER A 3 3.322 -1.150 -19.854 1.00 0.00 O ATOM 0 H SER A 3 6.790 -3.033 -19.760 1.00 0.00 H new ATOM 0 HA SER A 3 5.015 -1.696 -21.673 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.324 -2.902 -19.451 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.957 -1.479 -18.649 1.00 0.00 H new ATOM 0 HG SER A 3 2.694 -1.289 -19.115 1.00 0.00 H new ATOM 30 N GLY A 4 5.799 0.646 -21.457 1.00 0.00 N ATOM 31 CA GLY A 4 6.367 1.981 -21.430 1.00 0.00 C ATOM 32 C GLY A 4 5.441 2.992 -20.783 1.00 0.00 C ATOM 33 O GLY A 4 4.280 3.120 -21.173 1.00 0.00 O ATOM 0 H GLY A 4 5.087 0.497 -22.172 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.312 1.959 -20.888 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.591 2.298 -22.449 1.00 0.00 H new ATOM 37 N SER A 5 5.955 3.712 -19.791 1.00 0.00 N ATOM 38 CA SER A 5 5.164 4.713 -19.085 1.00 0.00 C ATOM 39 C SER A 5 6.052 5.575 -18.192 1.00 0.00 C ATOM 40 O SER A 5 7.172 5.192 -17.856 1.00 0.00 O ATOM 41 CB SER A 5 4.079 4.037 -18.244 1.00 0.00 C ATOM 42 OG SER A 5 2.979 4.906 -18.037 1.00 0.00 O ATOM 0 H SER A 5 6.915 3.621 -19.458 1.00 0.00 H new ATOM 0 HA SER A 5 4.690 5.356 -19.827 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.740 3.129 -18.743 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.495 3.736 -17.282 1.00 0.00 H new ATOM 0 HG SER A 5 2.299 4.450 -17.499 1.00 0.00 H new ATOM 48 N SER A 6 5.542 6.742 -17.811 1.00 0.00 N ATOM 49 CA SER A 6 6.289 7.662 -16.961 1.00 0.00 C ATOM 50 C SER A 6 6.329 7.158 -15.521 1.00 0.00 C ATOM 51 O SER A 6 5.294 7.015 -14.872 1.00 0.00 O ATOM 52 CB SER A 6 5.662 9.056 -17.007 1.00 0.00 C ATOM 53 OG SER A 6 6.416 9.981 -16.243 1.00 0.00 O ATOM 0 H SER A 6 4.615 7.073 -18.077 1.00 0.00 H new ATOM 0 HA SER A 6 7.310 7.718 -17.338 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.602 9.397 -18.041 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.642 9.012 -16.626 1.00 0.00 H new ATOM 0 HG SER A 6 5.995 10.865 -16.290 1.00 0.00 H new ATOM 59 N GLY A 7 7.535 6.891 -15.028 1.00 0.00 N ATOM 60 CA GLY A 7 7.690 6.406 -13.669 1.00 0.00 C ATOM 61 C GLY A 7 7.492 4.907 -13.562 1.00 0.00 C ATOM 62 O GLY A 7 6.675 4.315 -14.268 1.00 0.00 O ATOM 0 H GLY A 7 8.407 7.002 -15.546 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.684 6.665 -13.305 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.973 6.911 -13.022 1.00 0.00 H new ATOM 66 N PRO A 8 8.253 4.268 -12.662 1.00 0.00 N ATOM 67 CA PRO A 8 8.176 2.820 -12.444 1.00 0.00 C ATOM 68 C PRO A 8 6.868 2.403 -11.780 1.00 0.00 C ATOM 69 O PRO A 8 6.180 1.500 -12.256 1.00 0.00 O ATOM 70 CB PRO A 8 9.361 2.537 -11.517 1.00 0.00 C ATOM 71 CG PRO A 8 9.602 3.824 -10.807 1.00 0.00 C ATOM 72 CD PRO A 8 9.248 4.910 -11.786 1.00 0.00 C ATOM 0 HA PRO A 8 8.209 2.264 -13.381 1.00 0.00 H new ATOM 0 HB2 PRO A 8 9.132 1.735 -10.816 1.00 0.00 H new ATOM 0 HB3 PRO A 8 10.240 2.226 -12.082 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.990 3.894 -9.908 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.642 3.907 -10.492 1.00 0.00 H new ATOM 0 HD2 PRO A 8 8.836 5.785 -11.284 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.120 5.246 -12.347 1.00 0.00 H new ATOM 80 N VAL A 9 6.531 3.066 -10.679 1.00 0.00 N ATOM 81 CA VAL A 9 5.305 2.764 -9.950 1.00 0.00 C ATOM 82 C VAL A 9 4.086 2.862 -10.861 1.00 0.00 C ATOM 83 O VAL A 9 3.803 3.919 -11.426 1.00 0.00 O ATOM 84 CB VAL A 9 5.115 3.714 -8.753 1.00 0.00 C ATOM 85 CG1 VAL A 9 3.804 3.420 -8.040 1.00 0.00 C ATOM 86 CG2 VAL A 9 6.290 3.602 -7.793 1.00 0.00 C ATOM 0 H VAL A 9 7.090 3.816 -10.272 1.00 0.00 H new ATOM 0 HA VAL A 9 5.399 1.742 -9.582 1.00 0.00 H new ATOM 0 HB VAL A 9 5.076 4.737 -9.126 1.00 0.00 H new ATOM 0 HG11 VAL A 9 3.687 4.101 -7.197 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.974 3.556 -8.734 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.810 2.392 -7.678 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.139 4.280 -6.953 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.363 2.579 -7.425 1.00 0.00 H new ATOM 0 HG23 VAL A 9 7.211 3.867 -8.313 1.00 0.00 H new ATOM 96 N LYS A 10 3.366 1.754 -10.998 1.00 0.00 N ATOM 97 CA LYS A 10 2.176 1.714 -11.839 1.00 0.00 C ATOM 98 C LYS A 10 0.997 2.391 -11.146 1.00 0.00 C ATOM 99 O LYS A 10 0.761 2.183 -9.956 1.00 0.00 O ATOM 100 CB LYS A 10 1.817 0.266 -12.182 1.00 0.00 C ATOM 101 CG LYS A 10 0.551 0.134 -13.011 1.00 0.00 C ATOM 102 CD LYS A 10 0.583 -1.110 -13.883 1.00 0.00 C ATOM 103 CE LYS A 10 -0.401 -1.007 -15.038 1.00 0.00 C ATOM 104 NZ LYS A 10 0.046 -0.022 -16.061 1.00 0.00 N ATOM 0 H LYS A 10 3.586 0.871 -10.537 1.00 0.00 H new ATOM 0 HA LYS A 10 2.394 2.256 -12.760 1.00 0.00 H new ATOM 0 HB2 LYS A 10 2.646 -0.186 -12.726 1.00 0.00 H new ATOM 0 HB3 LYS A 10 1.697 -0.299 -11.257 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -0.315 0.094 -12.350 1.00 0.00 H new ATOM 0 HG3 LYS A 10 0.433 1.017 -13.639 1.00 0.00 H new ATOM 0 HD2 LYS A 10 1.590 -1.256 -14.274 1.00 0.00 H new ATOM 0 HD3 LYS A 10 0.346 -1.985 -13.279 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -0.519 -1.986 -15.503 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -1.380 -0.716 -14.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -0.463 -0.191 -16.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -0.154 0.942 -15.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 1.068 -0.128 -16.221 1.00 0.00 H new ATOM 118 N VAL A 11 0.259 3.200 -11.899 1.00 0.00 N ATOM 119 CA VAL A 11 -0.896 3.906 -11.357 1.00 0.00 C ATOM 120 C VAL A 11 -2.173 3.092 -11.542 1.00 0.00 C ATOM 121 O VAL A 11 -2.388 2.485 -12.591 1.00 0.00 O ATOM 122 CB VAL A 11 -1.077 5.282 -12.024 1.00 0.00 C ATOM 123 CG1 VAL A 11 0.273 5.876 -12.397 1.00 0.00 C ATOM 124 CG2 VAL A 11 -1.974 5.168 -13.247 1.00 0.00 C ATOM 0 H VAL A 11 0.440 3.383 -12.886 1.00 0.00 H new ATOM 0 HA VAL A 11 -0.709 4.049 -10.293 1.00 0.00 H new ATOM 0 HB VAL A 11 -1.558 5.951 -11.311 1.00 0.00 H new ATOM 0 HG11 VAL A 11 0.125 6.848 -12.867 1.00 0.00 H new ATOM 0 HG12 VAL A 11 0.879 5.996 -11.499 1.00 0.00 H new ATOM 0 HG13 VAL A 11 0.784 5.210 -13.093 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.091 6.150 -13.705 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.524 4.483 -13.966 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.951 4.789 -12.947 1.00 0.00 H new ATOM 134 N VAL A 12 -3.017 3.085 -10.516 1.00 0.00 N ATOM 135 CA VAL A 12 -4.274 2.348 -10.565 1.00 0.00 C ATOM 136 C VAL A 12 -5.460 3.263 -10.279 1.00 0.00 C ATOM 137 O VAL A 12 -5.423 4.073 -9.354 1.00 0.00 O ATOM 138 CB VAL A 12 -4.282 1.185 -9.556 1.00 0.00 C ATOM 139 CG1 VAL A 12 -5.623 0.466 -9.579 1.00 0.00 C ATOM 140 CG2 VAL A 12 -3.145 0.218 -9.848 1.00 0.00 C ATOM 0 H VAL A 12 -2.853 3.582 -9.640 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.365 1.945 -11.574 1.00 0.00 H new ATOM 0 HB VAL A 12 -4.133 1.594 -8.557 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.609 -0.353 -8.859 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -6.416 1.166 -9.317 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.806 0.068 -10.577 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.166 -0.597 -9.125 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -3.260 -0.186 -10.854 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -2.193 0.743 -9.775 1.00 0.00 H new ATOM 150 N VAL A 13 -6.512 3.127 -11.081 1.00 0.00 N ATOM 151 CA VAL A 13 -7.710 3.940 -10.913 1.00 0.00 C ATOM 152 C VAL A 13 -8.878 3.100 -10.408 1.00 0.00 C ATOM 153 O VAL A 13 -8.812 1.872 -10.393 1.00 0.00 O ATOM 154 CB VAL A 13 -8.116 4.620 -12.235 1.00 0.00 C ATOM 155 CG1 VAL A 13 -7.129 5.721 -12.593 1.00 0.00 C ATOM 156 CG2 VAL A 13 -8.213 3.594 -13.354 1.00 0.00 C ATOM 0 H VAL A 13 -6.558 2.462 -11.853 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.472 4.707 -10.176 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.098 5.074 -12.104 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -7.431 6.190 -13.529 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.115 6.469 -11.800 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.133 5.294 -12.706 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -8.501 4.092 -14.280 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -7.246 3.109 -13.488 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -8.962 2.845 -13.097 1.00 0.00 H new ATOM 166 N GLY A 14 -9.947 3.773 -9.993 1.00 0.00 N ATOM 167 CA GLY A 14 -11.116 3.072 -9.492 1.00 0.00 C ATOM 168 C GLY A 14 -11.649 2.054 -10.480 1.00 0.00 C ATOM 169 O GLY A 14 -12.167 1.008 -10.087 1.00 0.00 O ATOM 0 H GLY A 14 -10.025 4.790 -9.995 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -10.862 2.570 -8.559 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.899 3.795 -9.262 1.00 0.00 H new ATOM 173 N LYS A 15 -11.523 2.358 -11.767 1.00 0.00 N ATOM 174 CA LYS A 15 -11.997 1.462 -12.815 1.00 0.00 C ATOM 175 C LYS A 15 -11.059 0.270 -12.976 1.00 0.00 C ATOM 176 O LYS A 15 -11.445 -0.770 -13.510 1.00 0.00 O ATOM 177 CB LYS A 15 -12.115 2.214 -14.143 1.00 0.00 C ATOM 178 CG LYS A 15 -10.871 2.119 -15.009 1.00 0.00 C ATOM 179 CD LYS A 15 -10.972 3.017 -16.231 1.00 0.00 C ATOM 180 CE LYS A 15 -9.632 3.150 -16.937 1.00 0.00 C ATOM 181 NZ LYS A 15 -9.795 3.367 -18.401 1.00 0.00 N ATOM 0 H LYS A 15 -11.096 3.219 -12.110 1.00 0.00 H new ATOM 0 HA LYS A 15 -12.981 1.092 -12.525 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -12.966 1.820 -14.699 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -12.326 3.264 -13.939 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -9.996 2.399 -14.422 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -10.725 1.086 -15.326 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -11.710 2.611 -16.923 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -11.326 4.003 -15.931 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -9.076 3.983 -16.506 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -9.041 2.250 -16.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -8.859 3.453 -18.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -10.303 2.561 -18.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -10.337 4.240 -18.564 1.00 0.00 H new ATOM 195 N THR A 16 -9.824 0.427 -12.510 1.00 0.00 N ATOM 196 CA THR A 16 -8.831 -0.636 -12.602 1.00 0.00 C ATOM 197 C THR A 16 -8.304 -1.017 -11.224 1.00 0.00 C ATOM 198 O THR A 16 -7.272 -1.677 -11.103 1.00 0.00 O ATOM 199 CB THR A 16 -7.646 -0.223 -13.496 1.00 0.00 C ATOM 200 OG1 THR A 16 -6.885 0.807 -12.855 1.00 0.00 O ATOM 201 CG2 THR A 16 -8.135 0.270 -14.849 1.00 0.00 C ATOM 0 H THR A 16 -9.487 1.281 -12.065 1.00 0.00 H new ATOM 0 HA THR A 16 -9.330 -1.496 -13.048 1.00 0.00 H new ATOM 0 HB THR A 16 -7.015 -1.098 -13.652 1.00 0.00 H new ATOM 0 HG1 THR A 16 -6.133 1.063 -13.429 1.00 0.00 H new ATOM 0 HG21 THR A 16 -7.281 0.556 -15.463 1.00 0.00 H new ATOM 0 HG22 THR A 16 -8.690 -0.525 -15.347 1.00 0.00 H new ATOM 0 HG23 THR A 16 -8.786 1.133 -14.708 1.00 0.00 H new ATOM 209 N PHE A 17 -9.020 -0.599 -10.185 1.00 0.00 N ATOM 210 CA PHE A 17 -8.624 -0.896 -8.814 1.00 0.00 C ATOM 211 C PHE A 17 -8.925 -2.351 -8.464 1.00 0.00 C ATOM 212 O PHE A 17 -8.023 -3.119 -8.127 1.00 0.00 O ATOM 213 CB PHE A 17 -9.347 0.034 -7.838 1.00 0.00 C ATOM 214 CG PHE A 17 -8.824 -0.047 -6.433 1.00 0.00 C ATOM 215 CD1 PHE A 17 -8.905 -1.231 -5.717 1.00 0.00 C ATOM 216 CD2 PHE A 17 -8.252 1.060 -5.827 1.00 0.00 C ATOM 217 CE1 PHE A 17 -8.424 -1.310 -4.423 1.00 0.00 C ATOM 218 CE2 PHE A 17 -7.769 0.987 -4.534 1.00 0.00 C ATOM 219 CZ PHE A 17 -7.857 -0.199 -3.831 1.00 0.00 C ATOM 0 H PHE A 17 -9.878 -0.053 -10.267 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.549 -0.734 -8.730 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.256 1.061 -8.192 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -10.409 -0.210 -7.836 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -9.349 -2.102 -6.175 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -8.183 1.990 -6.371 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.492 -2.239 -3.876 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.323 1.856 -4.074 1.00 0.00 H new ATOM 0 HZ PHE A 17 -7.483 -0.257 -2.820 1.00 0.00 H new ATOM 229 N ASP A 18 -10.198 -2.722 -8.547 1.00 0.00 N ATOM 230 CA ASP A 18 -10.619 -4.084 -8.240 1.00 0.00 C ATOM 231 C ASP A 18 -10.029 -5.073 -9.241 1.00 0.00 C ATOM 232 O ASP A 18 -10.177 -6.286 -9.090 1.00 0.00 O ATOM 233 CB ASP A 18 -12.145 -4.182 -8.247 1.00 0.00 C ATOM 234 CG ASP A 18 -12.756 -3.796 -6.914 1.00 0.00 C ATOM 235 OD1 ASP A 18 -12.342 -4.368 -5.884 1.00 0.00 O ATOM 236 OD2 ASP A 18 -13.648 -2.922 -6.901 1.00 0.00 O ATOM 0 H ASP A 18 -10.956 -2.099 -8.824 1.00 0.00 H new ATOM 0 HA ASP A 18 -10.251 -4.337 -7.246 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -12.544 -3.534 -9.028 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -12.440 -5.201 -8.497 1.00 0.00 H new ATOM 241 N ALA A 19 -9.360 -4.547 -10.262 1.00 0.00 N ATOM 242 CA ALA A 19 -8.747 -5.384 -11.286 1.00 0.00 C ATOM 243 C ALA A 19 -7.260 -5.584 -11.013 1.00 0.00 C ATOM 244 O ALA A 19 -6.746 -6.698 -11.118 1.00 0.00 O ATOM 245 CB ALA A 19 -8.956 -4.770 -12.663 1.00 0.00 C ATOM 0 H ALA A 19 -9.229 -3.545 -10.402 1.00 0.00 H new ATOM 0 HA ALA A 19 -9.229 -6.361 -11.259 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -8.493 -5.405 -13.419 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -10.024 -4.685 -12.865 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.501 -3.780 -12.693 1.00 0.00 H new ATOM 251 N ILE A 20 -6.576 -4.500 -10.665 1.00 0.00 N ATOM 252 CA ILE A 20 -5.148 -4.558 -10.377 1.00 0.00 C ATOM 253 C ILE A 20 -4.895 -4.725 -8.883 1.00 0.00 C ATOM 254 O ILE A 20 -4.446 -5.779 -8.432 1.00 0.00 O ATOM 255 CB ILE A 20 -4.422 -3.293 -10.872 1.00 0.00 C ATOM 256 CG1 ILE A 20 -4.420 -3.245 -12.401 1.00 0.00 C ATOM 257 CG2 ILE A 20 -3.000 -3.253 -10.332 1.00 0.00 C ATOM 258 CD1 ILE A 20 -4.198 -1.858 -12.962 1.00 0.00 C ATOM 0 H ILE A 20 -6.987 -3.571 -10.576 1.00 0.00 H new ATOM 0 HA ILE A 20 -4.754 -5.424 -10.908 1.00 0.00 H new ATOM 0 HB ILE A 20 -4.955 -2.417 -10.501 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -3.641 -3.909 -12.776 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -5.371 -3.629 -12.770 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -2.500 -2.353 -10.691 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -3.025 -3.245 -9.242 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -2.455 -4.132 -10.676 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -4.209 -1.900 -14.051 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -4.991 -1.195 -12.617 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -3.234 -1.478 -12.623 1.00 0.00 H new ATOM 270 N VAL A 21 -5.187 -3.677 -8.118 1.00 0.00 N ATOM 271 CA VAL A 21 -4.994 -3.708 -6.673 1.00 0.00 C ATOM 272 C VAL A 21 -5.637 -4.946 -6.059 1.00 0.00 C ATOM 273 O VAL A 21 -5.226 -5.409 -4.995 1.00 0.00 O ATOM 274 CB VAL A 21 -5.580 -2.452 -6.002 1.00 0.00 C ATOM 275 CG1 VAL A 21 -5.371 -2.504 -4.496 1.00 0.00 C ATOM 276 CG2 VAL A 21 -4.959 -1.194 -6.591 1.00 0.00 C ATOM 0 H VAL A 21 -5.558 -2.797 -8.475 1.00 0.00 H new ATOM 0 HA VAL A 21 -3.919 -3.736 -6.498 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.652 -2.425 -6.195 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.792 -1.608 -4.039 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -5.867 -3.386 -4.090 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -4.304 -2.556 -4.278 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.385 -0.316 -6.105 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -3.881 -1.211 -6.430 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -5.166 -1.153 -7.660 1.00 0.00 H new ATOM 286 N MET A 22 -6.649 -5.479 -6.737 1.00 0.00 N ATOM 287 CA MET A 22 -7.348 -6.665 -6.258 1.00 0.00 C ATOM 288 C MET A 22 -7.128 -7.844 -7.201 1.00 0.00 C ATOM 289 O MET A 22 -8.035 -8.643 -7.433 1.00 0.00 O ATOM 290 CB MET A 22 -8.845 -6.380 -6.120 1.00 0.00 C ATOM 291 CG MET A 22 -9.170 -5.340 -5.061 1.00 0.00 C ATOM 292 SD MET A 22 -9.328 -6.052 -3.412 1.00 0.00 S ATOM 293 CE MET A 22 -8.404 -4.865 -2.440 1.00 0.00 C ATOM 0 H MET A 22 -7.002 -5.108 -7.619 1.00 0.00 H new ATOM 0 HA MET A 22 -6.943 -6.924 -5.280 1.00 0.00 H new ATOM 0 HB2 MET A 22 -9.232 -6.041 -7.081 1.00 0.00 H new ATOM 0 HB3 MET A 22 -9.362 -7.308 -5.877 1.00 0.00 H new ATOM 0 HG2 MET A 22 -8.388 -4.581 -5.051 1.00 0.00 H new ATOM 0 HG3 MET A 22 -10.100 -4.836 -5.325 1.00 0.00 H new ATOM 0 HE1 MET A 22 -8.878 -4.745 -1.466 1.00 0.00 H new ATOM 0 HE2 MET A 22 -7.383 -5.221 -2.305 1.00 0.00 H new ATOM 0 HE3 MET A 22 -8.388 -3.905 -2.957 1.00 0.00 H new ATOM 303 N ASP A 23 -5.919 -7.945 -7.742 1.00 0.00 N ATOM 304 CA ASP A 23 -5.579 -9.027 -8.659 1.00 0.00 C ATOM 305 C ASP A 23 -5.253 -10.306 -7.895 1.00 0.00 C ATOM 306 O ASP A 23 -4.239 -10.403 -7.202 1.00 0.00 O ATOM 307 CB ASP A 23 -4.393 -8.626 -9.537 1.00 0.00 C ATOM 308 CG ASP A 23 -4.408 -9.322 -10.884 1.00 0.00 C ATOM 309 OD1 ASP A 23 -5.512 -9.574 -11.410 1.00 0.00 O ATOM 310 OD2 ASP A 23 -3.315 -9.616 -11.412 1.00 0.00 O ATOM 0 H ASP A 23 -5.158 -7.291 -7.561 1.00 0.00 H new ATOM 0 HA ASP A 23 -6.444 -9.216 -9.294 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -4.406 -7.547 -9.689 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -3.464 -8.864 -9.019 1.00 0.00 H new ATOM 315 N PRO A 24 -6.132 -11.311 -8.020 1.00 0.00 N ATOM 316 CA PRO A 24 -5.959 -12.602 -7.348 1.00 0.00 C ATOM 317 C PRO A 24 -4.803 -13.409 -7.930 1.00 0.00 C ATOM 318 O PRO A 24 -4.585 -14.561 -7.554 1.00 0.00 O ATOM 319 CB PRO A 24 -7.290 -13.315 -7.600 1.00 0.00 C ATOM 320 CG PRO A 24 -7.819 -12.698 -8.849 1.00 0.00 C ATOM 321 CD PRO A 24 -7.362 -11.265 -8.828 1.00 0.00 C ATOM 0 HA PRO A 24 -5.718 -12.482 -6.292 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -7.148 -14.389 -7.718 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -7.978 -13.175 -6.767 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -7.441 -13.215 -9.731 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -8.907 -12.760 -8.885 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -7.169 -10.890 -9.833 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -8.111 -10.611 -8.382 1.00 0.00 H new ATOM 329 N LYS A 25 -4.066 -12.797 -8.850 1.00 0.00 N ATOM 330 CA LYS A 25 -2.931 -13.458 -9.484 1.00 0.00 C ATOM 331 C LYS A 25 -1.633 -13.133 -8.751 1.00 0.00 C ATOM 332 O LYS A 25 -0.772 -13.996 -8.580 1.00 0.00 O ATOM 333 CB LYS A 25 -2.821 -13.032 -10.950 1.00 0.00 C ATOM 334 CG LYS A 25 -4.136 -13.108 -11.706 1.00 0.00 C ATOM 335 CD LYS A 25 -3.914 -13.359 -13.188 1.00 0.00 C ATOM 336 CE LYS A 25 -3.602 -14.822 -13.465 1.00 0.00 C ATOM 337 NZ LYS A 25 -2.140 -15.098 -13.402 1.00 0.00 N ATOM 0 H LYS A 25 -4.234 -11.844 -9.174 1.00 0.00 H new ATOM 0 HA LYS A 25 -3.096 -14.534 -9.435 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -2.444 -12.010 -10.995 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -2.087 -13.665 -11.449 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -4.751 -13.906 -11.289 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -4.688 -12.178 -11.572 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -4.803 -13.064 -13.745 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -3.093 -12.737 -13.544 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.121 -15.448 -12.739 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -3.981 -15.094 -14.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -1.866 -15.703 -14.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.615 -14.201 -13.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -1.916 -15.583 -12.509 1.00 0.00 H new ATOM 351 N LYS A 26 -1.500 -11.884 -8.318 1.00 0.00 N ATOM 352 CA LYS A 26 -0.309 -11.445 -7.601 1.00 0.00 C ATOM 353 C LYS A 26 -0.654 -10.358 -6.587 1.00 0.00 C ATOM 354 O LYS A 26 -1.700 -9.716 -6.684 1.00 0.00 O ATOM 355 CB LYS A 26 0.741 -10.925 -8.584 1.00 0.00 C ATOM 356 CG LYS A 26 0.158 -10.096 -9.716 1.00 0.00 C ATOM 357 CD LYS A 26 1.138 -9.039 -10.196 1.00 0.00 C ATOM 358 CE LYS A 26 2.025 -9.567 -11.313 1.00 0.00 C ATOM 359 NZ LYS A 26 1.332 -9.540 -12.631 1.00 0.00 N ATOM 0 H LYS A 26 -2.203 -11.157 -8.451 1.00 0.00 H new ATOM 0 HA LYS A 26 0.098 -12.302 -7.065 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.468 -10.322 -8.040 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.282 -11.772 -9.006 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.109 -10.750 -10.546 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.761 -9.616 -9.380 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.589 -8.166 -10.548 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.758 -8.711 -9.362 1.00 0.00 H new ATOM 0 HE2 LYS A 26 2.934 -8.968 -11.368 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.329 -10.588 -11.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 1.969 -9.908 -13.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.478 -10.131 -12.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 1.064 -8.562 -12.862 1.00 0.00 H new ATOM 373 N ASP A 27 0.232 -10.157 -5.618 1.00 0.00 N ATOM 374 CA ASP A 27 0.022 -9.146 -4.588 1.00 0.00 C ATOM 375 C ASP A 27 0.352 -7.754 -5.118 1.00 0.00 C ATOM 376 O ASP A 27 1.460 -7.507 -5.595 1.00 0.00 O ATOM 377 CB ASP A 27 0.878 -9.454 -3.359 1.00 0.00 C ATOM 378 CG ASP A 27 1.137 -10.938 -3.191 1.00 0.00 C ATOM 379 OD1 ASP A 27 1.696 -11.553 -4.123 1.00 0.00 O ATOM 380 OD2 ASP A 27 0.781 -11.485 -2.126 1.00 0.00 O ATOM 0 H ASP A 27 1.102 -10.681 -5.524 1.00 0.00 H new ATOM 0 HA ASP A 27 -1.030 -9.166 -4.302 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.830 -8.929 -3.442 1.00 0.00 H new ATOM 0 HB3 ASP A 27 0.380 -9.072 -2.468 1.00 0.00 H new ATOM 385 N VAL A 28 -0.617 -6.848 -5.032 1.00 0.00 N ATOM 386 CA VAL A 28 -0.429 -5.481 -5.503 1.00 0.00 C ATOM 387 C VAL A 28 -0.465 -4.491 -4.344 1.00 0.00 C ATOM 388 O VAL A 28 -1.470 -4.376 -3.642 1.00 0.00 O ATOM 389 CB VAL A 28 -1.506 -5.089 -6.532 1.00 0.00 C ATOM 390 CG1 VAL A 28 -1.401 -3.612 -6.879 1.00 0.00 C ATOM 391 CG2 VAL A 28 -1.387 -5.948 -7.781 1.00 0.00 C ATOM 0 H VAL A 28 -1.540 -7.036 -4.641 1.00 0.00 H new ATOM 0 HA VAL A 28 0.550 -5.442 -5.980 1.00 0.00 H new ATOM 0 HB VAL A 28 -2.487 -5.265 -6.090 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.170 -3.354 -7.607 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -1.540 -3.016 -5.977 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.417 -3.407 -7.302 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -2.156 -5.657 -8.497 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.403 -5.806 -8.228 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.517 -6.997 -7.515 1.00 0.00 H new ATOM 401 N LEU A 29 0.638 -3.777 -4.149 1.00 0.00 N ATOM 402 CA LEU A 29 0.734 -2.795 -3.074 1.00 0.00 C ATOM 403 C LEU A 29 0.162 -1.451 -3.513 1.00 0.00 C ATOM 404 O LEU A 29 0.787 -0.721 -4.283 1.00 0.00 O ATOM 405 CB LEU A 29 2.192 -2.625 -2.641 1.00 0.00 C ATOM 406 CG LEU A 29 2.438 -1.666 -1.476 1.00 0.00 C ATOM 407 CD1 LEU A 29 2.131 -2.345 -0.151 1.00 0.00 C ATOM 408 CD2 LEU A 29 3.872 -1.158 -1.498 1.00 0.00 C ATOM 0 H LEU A 29 1.478 -3.859 -4.721 1.00 0.00 H new ATOM 0 HA LEU A 29 0.150 -3.159 -2.228 1.00 0.00 H new ATOM 0 HB2 LEU A 29 2.586 -3.604 -2.369 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.767 -2.277 -3.499 1.00 0.00 H new ATOM 0 HG LEU A 29 1.769 -0.812 -1.586 1.00 0.00 H new ATOM 0 HD11 LEU A 29 2.312 -1.647 0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 29 1.087 -2.658 -0.136 1.00 0.00 H new ATOM 0 HD13 LEU A 29 2.773 -3.217 -0.032 1.00 0.00 H new ATOM 0 HD21 LEU A 29 4.030 -0.477 -0.662 1.00 0.00 H new ATOM 0 HD22 LEU A 29 4.558 -2.001 -1.413 1.00 0.00 H new ATOM 0 HD23 LEU A 29 4.057 -0.632 -2.435 1.00 0.00 H new ATOM 420 N ILE A 30 -1.028 -1.130 -3.016 1.00 0.00 N ATOM 421 CA ILE A 30 -1.682 0.128 -3.354 1.00 0.00 C ATOM 422 C ILE A 30 -1.382 1.200 -2.312 1.00 0.00 C ATOM 423 O ILE A 30 -1.548 0.978 -1.113 1.00 0.00 O ATOM 424 CB ILE A 30 -3.208 -0.045 -3.471 1.00 0.00 C ATOM 425 CG1 ILE A 30 -3.814 1.109 -4.272 1.00 0.00 C ATOM 426 CG2 ILE A 30 -3.840 -0.128 -2.090 1.00 0.00 C ATOM 427 CD1 ILE A 30 -3.212 1.270 -5.650 1.00 0.00 C ATOM 0 H ILE A 30 -1.558 -1.723 -2.378 1.00 0.00 H new ATOM 0 HA ILE A 30 -1.285 0.441 -4.319 1.00 0.00 H new ATOM 0 HB ILE A 30 -3.413 -0.976 -3.999 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -4.888 0.948 -4.370 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -3.680 2.037 -3.715 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -4.918 -0.250 -2.190 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.427 -0.981 -1.551 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -3.628 0.787 -1.537 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -3.690 2.107 -6.160 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -2.143 1.462 -5.560 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.369 0.357 -6.225 1.00 0.00 H new ATOM 439 N GLU A 31 -0.942 2.364 -2.779 1.00 0.00 N ATOM 440 CA GLU A 31 -0.620 3.472 -1.888 1.00 0.00 C ATOM 441 C GLU A 31 -1.495 4.685 -2.189 1.00 0.00 C ATOM 442 O GLU A 31 -1.329 5.345 -3.216 1.00 0.00 O ATOM 443 CB GLU A 31 0.857 3.850 -2.019 1.00 0.00 C ATOM 444 CG GLU A 31 1.231 5.117 -1.269 1.00 0.00 C ATOM 445 CD GLU A 31 2.387 5.857 -1.913 1.00 0.00 C ATOM 446 OE1 GLU A 31 2.136 6.669 -2.828 1.00 0.00 O ATOM 447 OE2 GLU A 31 3.543 5.624 -1.502 1.00 0.00 O ATOM 0 H GLU A 31 -0.800 2.564 -3.769 1.00 0.00 H new ATOM 0 HA GLU A 31 -0.815 3.149 -0.865 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.468 3.026 -1.650 1.00 0.00 H new ATOM 0 HB3 GLU A 31 1.098 3.978 -3.074 1.00 0.00 H new ATOM 0 HG2 GLU A 31 0.364 5.776 -1.222 1.00 0.00 H new ATOM 0 HG3 GLU A 31 1.494 4.863 -0.242 1.00 0.00 H new ATOM 454 N PHE A 32 -2.427 4.974 -1.287 1.00 0.00 N ATOM 455 CA PHE A 32 -3.330 6.106 -1.457 1.00 0.00 C ATOM 456 C PHE A 32 -2.613 7.422 -1.167 1.00 0.00 C ATOM 457 O PHE A 32 -2.316 7.739 -0.015 1.00 0.00 O ATOM 458 CB PHE A 32 -4.544 5.961 -0.536 1.00 0.00 C ATOM 459 CG PHE A 32 -5.143 4.583 -0.547 1.00 0.00 C ATOM 460 CD1 PHE A 32 -5.287 3.886 -1.736 1.00 0.00 C ATOM 461 CD2 PHE A 32 -5.563 3.986 0.630 1.00 0.00 C ATOM 462 CE1 PHE A 32 -5.838 2.618 -1.750 1.00 0.00 C ATOM 463 CE2 PHE A 32 -6.114 2.719 0.623 1.00 0.00 C ATOM 464 CZ PHE A 32 -6.253 2.035 -0.569 1.00 0.00 C ATOM 0 H PHE A 32 -2.577 4.440 -0.431 1.00 0.00 H new ATOM 0 HA PHE A 32 -3.668 6.116 -2.493 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -4.249 6.212 0.483 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -5.305 6.682 -0.835 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -4.965 4.338 -2.662 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -5.459 4.517 1.565 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -5.944 2.084 -2.683 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.436 2.264 1.548 1.00 0.00 H new ATOM 0 HZ PHE A 32 -6.686 1.046 -0.577 1.00 0.00 H new ATOM 474 N TYR A 33 -2.338 8.182 -2.221 1.00 0.00 N ATOM 475 CA TYR A 33 -1.653 9.462 -2.082 1.00 0.00 C ATOM 476 C TYR A 33 -2.620 10.623 -2.290 1.00 0.00 C ATOM 477 O TYR A 33 -3.572 10.522 -3.062 1.00 0.00 O ATOM 478 CB TYR A 33 -0.500 9.559 -3.082 1.00 0.00 C ATOM 479 CG TYR A 33 -0.953 9.634 -4.523 1.00 0.00 C ATOM 480 CD1 TYR A 33 -1.407 10.829 -5.067 1.00 0.00 C ATOM 481 CD2 TYR A 33 -0.928 8.510 -5.339 1.00 0.00 C ATOM 482 CE1 TYR A 33 -1.822 10.902 -6.383 1.00 0.00 C ATOM 483 CE2 TYR A 33 -1.341 8.574 -6.656 1.00 0.00 C ATOM 484 CZ TYR A 33 -1.787 9.773 -7.173 1.00 0.00 C ATOM 485 OH TYR A 33 -2.200 9.841 -8.484 1.00 0.00 O ATOM 0 H TYR A 33 -2.579 7.934 -3.181 1.00 0.00 H new ATOM 0 HA TYR A 33 -1.253 9.523 -1.070 1.00 0.00 H new ATOM 0 HB2 TYR A 33 0.097 10.441 -2.851 1.00 0.00 H new ATOM 0 HB3 TYR A 33 0.150 8.693 -2.959 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -1.436 11.716 -4.451 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -0.580 7.570 -4.937 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -2.172 11.839 -6.791 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -1.315 7.691 -7.277 1.00 0.00 H new ATOM 0 HH TYR A 33 -3.089 9.438 -8.568 1.00 0.00 H new ATOM 495 N ALA A 34 -2.367 11.727 -1.594 1.00 0.00 N ATOM 496 CA ALA A 34 -3.213 12.909 -1.703 1.00 0.00 C ATOM 497 C ALA A 34 -2.495 14.031 -2.446 1.00 0.00 C ATOM 498 O ALA A 34 -1.405 14.461 -2.068 1.00 0.00 O ATOM 499 CB ALA A 34 -3.643 13.380 -0.322 1.00 0.00 C ATOM 0 H ALA A 34 -1.583 11.827 -0.949 1.00 0.00 H new ATOM 0 HA ALA A 34 -4.100 12.638 -2.275 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.274 14.263 -0.419 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -4.202 12.587 0.175 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.761 13.627 0.269 1.00 0.00 H new ATOM 505 N PRO A 35 -3.118 14.517 -3.530 1.00 0.00 N ATOM 506 CA PRO A 35 -2.557 15.595 -4.349 1.00 0.00 C ATOM 507 C PRO A 35 -2.561 16.936 -3.624 1.00 0.00 C ATOM 508 O PRO A 35 -2.132 17.951 -4.174 1.00 0.00 O ATOM 509 CB PRO A 35 -3.488 15.640 -5.563 1.00 0.00 C ATOM 510 CG PRO A 35 -4.780 15.085 -5.071 1.00 0.00 C ATOM 511 CD PRO A 35 -4.420 14.052 -4.039 1.00 0.00 C ATOM 0 HA PRO A 35 -1.513 15.413 -4.603 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -3.609 16.659 -5.931 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -3.092 15.048 -6.388 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -5.402 15.869 -4.638 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -5.350 14.640 -5.887 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -5.166 13.999 -3.246 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -4.348 13.056 -4.476 1.00 0.00 H new ATOM 519 N TRP A 36 -3.047 16.934 -2.388 1.00 0.00 N ATOM 520 CA TRP A 36 -3.106 18.151 -1.588 1.00 0.00 C ATOM 521 C TRP A 36 -2.385 17.964 -0.258 1.00 0.00 C ATOM 522 O TRP A 36 -2.564 18.752 0.672 1.00 0.00 O ATOM 523 CB TRP A 36 -4.561 18.554 -1.342 1.00 0.00 C ATOM 524 CG TRP A 36 -5.463 17.387 -1.077 1.00 0.00 C ATOM 525 CD1 TRP A 36 -6.285 16.766 -1.974 1.00 0.00 C ATOM 526 CD2 TRP A 36 -5.636 16.703 0.169 1.00 0.00 C ATOM 527 NE1 TRP A 36 -6.958 15.737 -1.361 1.00 0.00 N ATOM 528 CE2 TRP A 36 -6.578 15.677 -0.047 1.00 0.00 C ATOM 529 CE3 TRP A 36 -5.087 16.855 1.444 1.00 0.00 C ATOM 530 CZ2 TRP A 36 -6.980 14.811 0.966 1.00 0.00 C ATOM 531 CZ3 TRP A 36 -5.487 15.995 2.449 1.00 0.00 C ATOM 532 CH2 TRP A 36 -6.425 14.983 2.206 1.00 0.00 C ATOM 0 H TRP A 36 -3.406 16.103 -1.918 1.00 0.00 H new ATOM 0 HA TRP A 36 -2.605 18.945 -2.142 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -4.603 19.237 -0.493 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -4.931 19.101 -2.209 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -6.390 17.043 -3.012 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -7.632 15.118 -1.812 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -4.362 17.631 1.641 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -7.704 14.031 0.781 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -5.069 16.105 3.439 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -6.716 14.326 3.012 1.00 0.00 H new ATOM 543 N CYS A 37 -1.570 16.919 -0.174 1.00 0.00 N ATOM 544 CA CYS A 37 -0.822 16.628 1.045 1.00 0.00 C ATOM 545 C CYS A 37 0.676 16.797 0.816 1.00 0.00 C ATOM 546 O CYS A 37 1.227 16.291 -0.161 1.00 0.00 O ATOM 547 CB CYS A 37 -1.120 15.207 1.524 1.00 0.00 C ATOM 548 SG CYS A 37 -0.321 14.773 3.087 1.00 0.00 S ATOM 0 H CYS A 37 -1.410 16.259 -0.935 1.00 0.00 H new ATOM 0 HA CYS A 37 -1.136 17.335 1.813 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -2.198 15.091 1.635 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.801 14.502 0.757 1.00 0.00 H new ATOM 0 HG CYS A 37 -0.634 13.554 3.411 1.00 0.00 H new ATOM 554 N GLY A 38 1.331 17.515 1.724 1.00 0.00 N ATOM 555 CA GLY A 38 2.760 17.740 1.602 1.00 0.00 C ATOM 556 C GLY A 38 3.568 16.480 1.840 1.00 0.00 C ATOM 557 O GLY A 38 4.697 16.358 1.364 1.00 0.00 O ATOM 0 H GLY A 38 0.898 17.945 2.541 1.00 0.00 H new ATOM 0 HA2 GLY A 38 2.980 18.126 0.607 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.066 18.505 2.316 1.00 0.00 H new ATOM 561 N HIS A 39 2.990 15.540 2.581 1.00 0.00 N ATOM 562 CA HIS A 39 3.664 14.282 2.883 1.00 0.00 C ATOM 563 C HIS A 39 3.856 13.451 1.618 1.00 0.00 C ATOM 564 O HIS A 39 4.958 12.978 1.336 1.00 0.00 O ATOM 565 CB HIS A 39 2.865 13.485 3.914 1.00 0.00 C ATOM 566 CG HIS A 39 2.815 14.132 5.264 1.00 0.00 C ATOM 567 ND1 HIS A 39 3.888 14.149 6.130 1.00 0.00 N ATOM 568 CD2 HIS A 39 1.814 14.789 5.895 1.00 0.00 C ATOM 569 CE1 HIS A 39 3.549 14.787 7.236 1.00 0.00 C ATOM 570 NE2 HIS A 39 2.295 15.186 7.119 1.00 0.00 N ATOM 0 H HIS A 39 2.057 15.625 2.983 1.00 0.00 H new ATOM 0 HA HIS A 39 4.645 14.515 3.296 1.00 0.00 H new ATOM 0 HB2 HIS A 39 1.848 13.350 3.547 1.00 0.00 H new ATOM 0 HB3 HIS A 39 3.303 12.492 4.012 1.00 0.00 H new ATOM 0 HD2 HIS A 39 0.822 14.968 5.508 1.00 0.00 H new ATOM 0 HE1 HIS A 39 4.188 14.954 8.090 1.00 0.00 H new ATOM 0 HE2 HIS A 39 1.770 15.704 7.823 1.00 0.00 H new ATOM 579 N CYS A 40 2.779 13.277 0.861 1.00 0.00 N ATOM 580 CA CYS A 40 2.828 12.502 -0.373 1.00 0.00 C ATOM 581 C CYS A 40 3.963 12.983 -1.272 1.00 0.00 C ATOM 582 O CYS A 40 4.557 12.201 -2.014 1.00 0.00 O ATOM 583 CB CYS A 40 1.495 12.601 -1.116 1.00 0.00 C ATOM 584 SG CYS A 40 1.360 14.041 -2.202 1.00 0.00 S ATOM 0 H CYS A 40 1.860 13.662 1.080 1.00 0.00 H new ATOM 0 HA CYS A 40 3.012 11.460 -0.112 1.00 0.00 H new ATOM 0 HB2 CYS A 40 1.354 11.698 -1.709 1.00 0.00 H new ATOM 0 HB3 CYS A 40 0.686 12.633 -0.386 1.00 0.00 H new ATOM 0 HG CYS A 40 0.190 14.588 -2.054 1.00 0.00 H new ATOM 590 N LYS A 41 4.258 14.277 -1.203 1.00 0.00 N ATOM 591 CA LYS A 41 5.320 14.865 -2.010 1.00 0.00 C ATOM 592 C LYS A 41 6.673 14.258 -1.653 1.00 0.00 C ATOM 593 O LYS A 41 7.455 13.903 -2.534 1.00 0.00 O ATOM 594 CB LYS A 41 5.361 16.381 -1.810 1.00 0.00 C ATOM 595 CG LYS A 41 3.995 17.000 -1.566 1.00 0.00 C ATOM 596 CD LYS A 41 2.996 16.583 -2.633 1.00 0.00 C ATOM 597 CE LYS A 41 2.992 17.555 -3.803 1.00 0.00 C ATOM 598 NZ LYS A 41 1.775 17.402 -4.647 1.00 0.00 N ATOM 0 H LYS A 41 3.775 14.939 -0.595 1.00 0.00 H new ATOM 0 HA LYS A 41 5.109 14.649 -3.057 1.00 0.00 H new ATOM 0 HB2 LYS A 41 6.010 16.610 -0.965 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.808 16.843 -2.690 1.00 0.00 H new ATOM 0 HG2 LYS A 41 3.628 16.699 -0.585 1.00 0.00 H new ATOM 0 HG3 LYS A 41 4.084 18.086 -1.554 1.00 0.00 H new ATOM 0 HD2 LYS A 41 3.240 15.583 -2.990 1.00 0.00 H new ATOM 0 HD3 LYS A 41 1.998 16.531 -2.198 1.00 0.00 H new ATOM 0 HE2 LYS A 41 3.047 18.576 -3.427 1.00 0.00 H new ATOM 0 HE3 LYS A 41 3.880 17.392 -4.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 1.810 18.082 -5.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 1.735 16.435 -5.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 0.928 17.582 -4.071 1.00 0.00 H new ATOM 612 N GLN A 42 6.941 14.141 -0.357 1.00 0.00 N ATOM 613 CA GLN A 42 8.200 13.576 0.115 1.00 0.00 C ATOM 614 C GLN A 42 8.260 12.077 -0.158 1.00 0.00 C ATOM 615 O GLN A 42 9.341 11.506 -0.310 1.00 0.00 O ATOM 616 CB GLN A 42 8.373 13.841 1.612 1.00 0.00 C ATOM 617 CG GLN A 42 7.787 15.168 2.066 1.00 0.00 C ATOM 618 CD GLN A 42 8.291 16.340 1.247 1.00 0.00 C ATOM 619 OE1 GLN A 42 7.521 17.001 0.549 1.00 0.00 O ATOM 620 NE2 GLN A 42 9.590 16.604 1.328 1.00 0.00 N ATOM 0 H GLN A 42 6.304 14.430 0.385 1.00 0.00 H new ATOM 0 HA GLN A 42 9.012 14.059 -0.429 1.00 0.00 H new ATOM 0 HB2 GLN A 42 7.901 13.034 2.172 1.00 0.00 H new ATOM 0 HB3 GLN A 42 9.435 13.820 1.856 1.00 0.00 H new ATOM 0 HG2 GLN A 42 6.700 15.123 1.998 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.034 15.330 3.115 1.00 0.00 H new ATOM 0 HE21 GLN A 42 10.191 16.030 1.919 1.00 0.00 H new ATOM 0 HE22 GLN A 42 9.986 17.381 0.799 1.00 0.00 H new ATOM 629 N LEU A 43 7.093 11.445 -0.219 1.00 0.00 N ATOM 630 CA LEU A 43 7.013 10.010 -0.474 1.00 0.00 C ATOM 631 C LEU A 43 6.963 9.725 -1.972 1.00 0.00 C ATOM 632 O LEU A 43 7.288 8.624 -2.414 1.00 0.00 O ATOM 633 CB LEU A 43 5.779 9.419 0.211 1.00 0.00 C ATOM 634 CG LEU A 43 5.641 7.898 0.148 1.00 0.00 C ATOM 635 CD1 LEU A 43 6.691 7.230 1.023 1.00 0.00 C ATOM 636 CD2 LEU A 43 4.243 7.471 0.570 1.00 0.00 C ATOM 0 H LEU A 43 6.190 11.903 -0.096 1.00 0.00 H new ATOM 0 HA LEU A 43 7.908 9.542 -0.064 1.00 0.00 H new ATOM 0 HB2 LEU A 43 5.791 9.720 1.259 1.00 0.00 H new ATOM 0 HB3 LEU A 43 4.891 9.863 -0.238 1.00 0.00 H new ATOM 0 HG LEU A 43 5.801 7.581 -0.882 1.00 0.00 H new ATOM 0 HD11 LEU A 43 6.577 6.147 0.966 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.686 7.509 0.675 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.563 7.554 2.056 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.163 6.385 0.519 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.055 7.801 1.592 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.508 7.921 -0.098 1.00 0.00 H new ATOM 648 N GLU A 44 6.556 10.726 -2.746 1.00 0.00 N ATOM 649 CA GLU A 44 6.465 10.583 -4.194 1.00 0.00 C ATOM 650 C GLU A 44 7.710 9.901 -4.752 1.00 0.00 C ATOM 651 O GLU A 44 7.638 8.864 -5.412 1.00 0.00 O ATOM 652 CB GLU A 44 6.280 11.951 -4.854 1.00 0.00 C ATOM 653 CG GLU A 44 4.825 12.319 -5.094 1.00 0.00 C ATOM 654 CD GLU A 44 4.022 11.172 -5.676 1.00 0.00 C ATOM 655 OE1 GLU A 44 4.210 10.861 -6.871 1.00 0.00 O ATOM 656 OE2 GLU A 44 3.204 10.586 -4.936 1.00 0.00 O ATOM 0 H GLU A 44 6.284 11.644 -2.395 1.00 0.00 H new ATOM 0 HA GLU A 44 5.599 9.960 -4.418 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.740 12.714 -4.225 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.810 11.960 -5.806 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.373 12.633 -4.153 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.777 13.172 -5.771 1.00 0.00 H new ATOM 663 N PRO A 45 8.882 10.496 -4.483 1.00 0.00 N ATOM 664 CA PRO A 45 10.166 9.965 -4.949 1.00 0.00 C ATOM 665 C PRO A 45 10.549 8.671 -4.239 1.00 0.00 C ATOM 666 O PRO A 45 11.112 7.761 -4.848 1.00 0.00 O ATOM 667 CB PRO A 45 11.157 11.078 -4.602 1.00 0.00 C ATOM 668 CG PRO A 45 10.526 11.809 -3.468 1.00 0.00 C ATOM 669 CD PRO A 45 9.042 11.735 -3.703 1.00 0.00 C ATOM 0 HA PRO A 45 10.142 9.712 -6.009 1.00 0.00 H new ATOM 0 HB2 PRO A 45 12.127 10.670 -4.319 1.00 0.00 H new ATOM 0 HB3 PRO A 45 11.325 11.738 -5.453 1.00 0.00 H new ATOM 0 HG2 PRO A 45 10.793 11.355 -2.514 1.00 0.00 H new ATOM 0 HG3 PRO A 45 10.865 12.844 -3.434 1.00 0.00 H new ATOM 0 HD2 PRO A 45 8.488 11.694 -2.765 1.00 0.00 H new ATOM 0 HD3 PRO A 45 8.678 12.604 -4.250 1.00 0.00 H new ATOM 677 N ILE A 46 10.240 8.595 -2.949 1.00 0.00 N ATOM 678 CA ILE A 46 10.551 7.411 -2.157 1.00 0.00 C ATOM 679 C ILE A 46 9.849 6.177 -2.715 1.00 0.00 C ATOM 680 O ILE A 46 10.470 5.131 -2.908 1.00 0.00 O ATOM 681 CB ILE A 46 10.145 7.597 -0.683 1.00 0.00 C ATOM 682 CG1 ILE A 46 10.983 8.700 -0.036 1.00 0.00 C ATOM 683 CG2 ILE A 46 10.302 6.289 0.078 1.00 0.00 C ATOM 684 CD1 ILE A 46 10.358 9.281 1.213 1.00 0.00 C ATOM 0 H ILE A 46 9.774 9.339 -2.430 1.00 0.00 H new ATOM 0 HA ILE A 46 11.630 7.268 -2.212 1.00 0.00 H new ATOM 0 HB ILE A 46 9.097 7.894 -0.644 1.00 0.00 H new ATOM 0 HG12 ILE A 46 11.966 8.300 0.212 1.00 0.00 H new ATOM 0 HG13 ILE A 46 11.138 9.500 -0.760 1.00 0.00 H new ATOM 0 HG21 ILE A 46 10.011 6.436 1.118 1.00 0.00 H new ATOM 0 HG22 ILE A 46 9.665 5.527 -0.372 1.00 0.00 H new ATOM 0 HG23 ILE A 46 11.342 5.965 0.034 1.00 0.00 H new ATOM 0 HD11 ILE A 46 11.007 10.057 1.618 1.00 0.00 H new ATOM 0 HD12 ILE A 46 9.387 9.712 0.968 1.00 0.00 H new ATOM 0 HD13 ILE A 46 10.228 8.493 1.955 1.00 0.00 H new ATOM 696 N TYR A 47 8.553 6.307 -2.973 1.00 0.00 N ATOM 697 CA TYR A 47 7.766 5.203 -3.508 1.00 0.00 C ATOM 698 C TYR A 47 8.233 4.831 -4.912 1.00 0.00 C ATOM 699 O TYR A 47 8.363 3.652 -5.245 1.00 0.00 O ATOM 700 CB TYR A 47 6.281 5.572 -3.534 1.00 0.00 C ATOM 701 CG TYR A 47 5.359 4.384 -3.374 1.00 0.00 C ATOM 702 CD1 TYR A 47 5.382 3.612 -2.219 1.00 0.00 C ATOM 703 CD2 TYR A 47 4.464 4.035 -4.378 1.00 0.00 C ATOM 704 CE1 TYR A 47 4.541 2.526 -2.070 1.00 0.00 C ATOM 705 CE2 TYR A 47 3.619 2.951 -4.237 1.00 0.00 C ATOM 706 CZ TYR A 47 3.662 2.200 -3.081 1.00 0.00 C ATOM 707 OH TYR A 47 2.822 1.119 -2.935 1.00 0.00 O ATOM 0 H TYR A 47 8.025 7.166 -2.820 1.00 0.00 H new ATOM 0 HA TYR A 47 7.908 4.341 -2.857 1.00 0.00 H new ATOM 0 HB2 TYR A 47 6.079 6.288 -2.737 1.00 0.00 H new ATOM 0 HB3 TYR A 47 6.056 6.072 -4.476 1.00 0.00 H new ATOM 0 HD1 TYR A 47 6.069 3.865 -1.425 1.00 0.00 H new ATOM 0 HD2 TYR A 47 4.428 4.621 -5.284 1.00 0.00 H new ATOM 0 HE1 TYR A 47 4.572 1.935 -1.166 1.00 0.00 H new ATOM 0 HE2 TYR A 47 2.929 2.693 -5.027 1.00 0.00 H new ATOM 0 HH TYR A 47 2.323 0.978 -3.766 1.00 0.00 H new ATOM 717 N THR A 48 8.485 5.845 -5.733 1.00 0.00 N ATOM 718 CA THR A 48 8.937 5.627 -7.101 1.00 0.00 C ATOM 719 C THR A 48 9.955 4.494 -7.170 1.00 0.00 C ATOM 720 O THR A 48 9.701 3.455 -7.778 1.00 0.00 O ATOM 721 CB THR A 48 9.565 6.902 -7.696 1.00 0.00 C ATOM 722 OG1 THR A 48 8.537 7.830 -8.060 1.00 0.00 O ATOM 723 CG2 THR A 48 10.412 6.571 -8.915 1.00 0.00 C ATOM 0 H THR A 48 8.384 6.826 -5.474 1.00 0.00 H new ATOM 0 HA THR A 48 8.057 5.358 -7.685 1.00 0.00 H new ATOM 0 HB THR A 48 10.208 7.351 -6.939 1.00 0.00 H new ATOM 0 HG1 THR A 48 8.173 8.248 -7.252 1.00 0.00 H new ATOM 0 HG21 THR A 48 10.845 7.487 -9.317 1.00 0.00 H new ATOM 0 HG22 THR A 48 11.211 5.888 -8.628 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.788 6.100 -9.675 1.00 0.00 H new ATOM 731 N SER A 49 11.107 4.701 -6.541 1.00 0.00 N ATOM 732 CA SER A 49 12.165 3.698 -6.534 1.00 0.00 C ATOM 733 C SER A 49 11.649 2.369 -5.991 1.00 0.00 C ATOM 734 O SER A 49 11.854 1.315 -6.597 1.00 0.00 O ATOM 735 CB SER A 49 13.349 4.180 -5.693 1.00 0.00 C ATOM 736 OG SER A 49 13.999 5.277 -6.310 1.00 0.00 O ATOM 0 H SER A 49 11.332 5.554 -6.029 1.00 0.00 H new ATOM 0 HA SER A 49 12.496 3.548 -7.562 1.00 0.00 H new ATOM 0 HB2 SER A 49 13.001 4.470 -4.702 1.00 0.00 H new ATOM 0 HB3 SER A 49 14.058 3.364 -5.556 1.00 0.00 H new ATOM 0 HG SER A 49 14.751 5.568 -5.752 1.00 0.00 H new ATOM 742 N LEU A 50 10.978 2.425 -4.846 1.00 0.00 N ATOM 743 CA LEU A 50 10.431 1.226 -4.220 1.00 0.00 C ATOM 744 C LEU A 50 9.790 0.313 -5.260 1.00 0.00 C ATOM 745 O LEU A 50 9.767 -0.907 -5.100 1.00 0.00 O ATOM 746 CB LEU A 50 9.401 1.608 -3.155 1.00 0.00 C ATOM 747 CG LEU A 50 8.878 0.463 -2.287 1.00 0.00 C ATOM 748 CD1 LEU A 50 9.911 0.072 -1.241 1.00 0.00 C ATOM 749 CD2 LEU A 50 7.566 0.854 -1.623 1.00 0.00 C ATOM 0 H LEU A 50 10.799 3.288 -4.332 1.00 0.00 H new ATOM 0 HA LEU A 50 11.251 0.686 -3.746 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.845 2.359 -2.502 1.00 0.00 H new ATOM 0 HB3 LEU A 50 8.552 2.078 -3.651 1.00 0.00 H new ATOM 0 HG LEU A 50 8.695 -0.400 -2.928 1.00 0.00 H new ATOM 0 HD11 LEU A 50 9.522 -0.744 -0.632 1.00 0.00 H new ATOM 0 HD12 LEU A 50 10.827 -0.250 -1.737 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.126 0.930 -0.603 1.00 0.00 H new ATOM 0 HD21 LEU A 50 7.208 0.027 -1.009 1.00 0.00 H new ATOM 0 HD22 LEU A 50 7.723 1.731 -0.995 1.00 0.00 H new ATOM 0 HD23 LEU A 50 6.825 1.084 -2.389 1.00 0.00 H new ATOM 761 N GLY A 51 9.271 0.913 -6.327 1.00 0.00 N ATOM 762 CA GLY A 51 8.638 0.138 -7.379 1.00 0.00 C ATOM 763 C GLY A 51 9.634 -0.377 -8.399 1.00 0.00 C ATOM 764 O GLY A 51 9.599 -1.549 -8.775 1.00 0.00 O ATOM 0 H GLY A 51 9.277 1.921 -6.482 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.108 -0.705 -6.936 1.00 0.00 H new ATOM 0 HA3 GLY A 51 7.893 0.755 -7.882 1.00 0.00 H new ATOM 768 N LYS A 52 10.523 0.500 -8.850 1.00 0.00 N ATOM 769 CA LYS A 52 11.534 0.129 -9.834 1.00 0.00 C ATOM 770 C LYS A 52 12.472 -0.936 -9.274 1.00 0.00 C ATOM 771 O LYS A 52 13.203 -1.587 -10.020 1.00 0.00 O ATOM 772 CB LYS A 52 12.338 1.360 -10.259 1.00 0.00 C ATOM 773 CG LYS A 52 13.511 1.666 -9.344 1.00 0.00 C ATOM 774 CD LYS A 52 14.197 2.964 -9.732 1.00 0.00 C ATOM 775 CE LYS A 52 15.516 3.140 -8.995 1.00 0.00 C ATOM 776 NZ LYS A 52 16.651 2.519 -9.733 1.00 0.00 N ATOM 0 H LYS A 52 10.565 1.474 -8.550 1.00 0.00 H new ATOM 0 HA LYS A 52 11.024 -0.282 -10.705 1.00 0.00 H new ATOM 0 HB2 LYS A 52 12.709 1.209 -11.273 1.00 0.00 H new ATOM 0 HB3 LYS A 52 11.675 2.225 -10.287 1.00 0.00 H new ATOM 0 HG2 LYS A 52 13.162 1.732 -8.313 1.00 0.00 H new ATOM 0 HG3 LYS A 52 14.229 0.847 -9.386 1.00 0.00 H new ATOM 0 HD2 LYS A 52 14.376 2.975 -10.807 1.00 0.00 H new ATOM 0 HD3 LYS A 52 13.540 3.805 -9.509 1.00 0.00 H new ATOM 0 HE2 LYS A 52 15.713 4.202 -8.852 1.00 0.00 H new ATOM 0 HE3 LYS A 52 15.440 2.694 -8.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 17.532 2.661 -9.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 16.475 1.500 -9.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 16.740 2.962 -10.670 1.00 0.00 H new ATOM 790 N LYS A 53 12.445 -1.109 -7.957 1.00 0.00 N ATOM 791 CA LYS A 53 13.291 -2.096 -7.297 1.00 0.00 C ATOM 792 C LYS A 53 12.530 -3.399 -7.069 1.00 0.00 C ATOM 793 O LYS A 53 13.092 -4.487 -7.194 1.00 0.00 O ATOM 794 CB LYS A 53 13.801 -1.551 -5.962 1.00 0.00 C ATOM 795 CG LYS A 53 12.693 -1.221 -4.977 1.00 0.00 C ATOM 796 CD LYS A 53 13.157 -1.386 -3.539 1.00 0.00 C ATOM 797 CE LYS A 53 14.367 -0.514 -3.241 1.00 0.00 C ATOM 798 NZ LYS A 53 15.239 -1.115 -2.194 1.00 0.00 N ATOM 0 H LYS A 53 11.846 -0.578 -7.325 1.00 0.00 H new ATOM 0 HA LYS A 53 14.142 -2.301 -7.947 1.00 0.00 H new ATOM 0 HB2 LYS A 53 14.470 -2.284 -5.511 1.00 0.00 H new ATOM 0 HB3 LYS A 53 14.391 -0.653 -6.147 1.00 0.00 H new ATOM 0 HG2 LYS A 53 12.357 -0.197 -5.136 1.00 0.00 H new ATOM 0 HG3 LYS A 53 11.837 -1.870 -5.161 1.00 0.00 H new ATOM 0 HD2 LYS A 53 12.344 -1.126 -2.861 1.00 0.00 H new ATOM 0 HD3 LYS A 53 13.405 -2.431 -3.353 1.00 0.00 H new ATOM 0 HE2 LYS A 53 14.944 -0.369 -4.154 1.00 0.00 H new ATOM 0 HE3 LYS A 53 14.033 0.471 -2.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 16.052 -0.491 -2.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 14.696 -1.231 -1.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 15.578 -2.044 -2.516 1.00 0.00 H new ATOM 812 N TYR A 54 11.249 -3.280 -6.737 1.00 0.00 N ATOM 813 CA TYR A 54 10.412 -4.448 -6.491 1.00 0.00 C ATOM 814 C TYR A 54 9.661 -4.855 -7.754 1.00 0.00 C ATOM 815 O TYR A 54 8.886 -5.812 -7.749 1.00 0.00 O ATOM 816 CB TYR A 54 9.418 -4.161 -5.364 1.00 0.00 C ATOM 817 CG TYR A 54 9.986 -4.394 -3.982 1.00 0.00 C ATOM 818 CD1 TYR A 54 9.946 -5.653 -3.396 1.00 0.00 C ATOM 819 CD2 TYR A 54 10.562 -3.354 -3.261 1.00 0.00 C ATOM 820 CE1 TYR A 54 10.463 -5.871 -2.134 1.00 0.00 C ATOM 821 CE2 TYR A 54 11.082 -3.563 -1.999 1.00 0.00 C ATOM 822 CZ TYR A 54 11.031 -4.823 -1.439 1.00 0.00 C ATOM 823 OH TYR A 54 11.547 -5.035 -0.182 1.00 0.00 O ATOM 0 H TYR A 54 10.768 -2.387 -6.632 1.00 0.00 H new ATOM 0 HA TYR A 54 11.061 -5.272 -6.194 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.084 -3.126 -5.441 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.539 -4.791 -5.497 1.00 0.00 H new ATOM 0 HD1 TYR A 54 9.503 -6.476 -3.937 1.00 0.00 H new ATOM 0 HD2 TYR A 54 10.603 -2.366 -3.695 1.00 0.00 H new ATOM 0 HE1 TYR A 54 10.423 -6.856 -1.694 1.00 0.00 H new ATOM 0 HE2 TYR A 54 11.527 -2.744 -1.453 1.00 0.00 H new ATOM 0 HH TYR A 54 12.496 -5.270 -0.253 1.00 0.00 H new ATOM 833 N LYS A 55 9.896 -4.123 -8.837 1.00 0.00 N ATOM 834 CA LYS A 55 9.245 -4.406 -10.110 1.00 0.00 C ATOM 835 C LYS A 55 9.716 -5.742 -10.676 1.00 0.00 C ATOM 836 O LYS A 55 8.931 -6.496 -11.249 1.00 0.00 O ATOM 837 CB LYS A 55 9.531 -3.287 -11.114 1.00 0.00 C ATOM 838 CG LYS A 55 8.464 -2.205 -11.137 1.00 0.00 C ATOM 839 CD LYS A 55 7.387 -2.507 -12.166 1.00 0.00 C ATOM 840 CE LYS A 55 6.660 -1.243 -12.599 1.00 0.00 C ATOM 841 NZ LYS A 55 5.328 -1.544 -13.191 1.00 0.00 N ATOM 0 H LYS A 55 10.534 -3.327 -8.858 1.00 0.00 H new ATOM 0 HA LYS A 55 8.171 -4.463 -9.935 1.00 0.00 H new ATOM 0 HB2 LYS A 55 10.493 -2.833 -10.875 1.00 0.00 H new ATOM 0 HB3 LYS A 55 9.621 -3.719 -12.111 1.00 0.00 H new ATOM 0 HG2 LYS A 55 8.011 -2.118 -10.149 1.00 0.00 H new ATOM 0 HG3 LYS A 55 8.924 -1.243 -11.362 1.00 0.00 H new ATOM 0 HD2 LYS A 55 7.837 -2.985 -13.036 1.00 0.00 H new ATOM 0 HD3 LYS A 55 6.671 -3.215 -11.748 1.00 0.00 H new ATOM 0 HE2 LYS A 55 6.535 -0.584 -11.740 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.268 -0.706 -13.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 4.865 -0.657 -13.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 5.449 -2.152 -14.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 4.738 -2.034 -12.488 1.00 0.00 H new ATOM 855 N GLY A 56 11.004 -6.029 -10.511 1.00 0.00 N ATOM 856 CA GLY A 56 11.556 -7.275 -11.009 1.00 0.00 C ATOM 857 C GLY A 56 11.336 -8.431 -10.054 1.00 0.00 C ATOM 858 O GLY A 56 12.107 -9.390 -10.043 1.00 0.00 O ATOM 0 H GLY A 56 11.675 -5.421 -10.041 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.101 -7.511 -11.971 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.625 -7.151 -11.184 1.00 0.00 H new ATOM 862 N GLN A 57 10.282 -8.339 -9.249 1.00 0.00 N ATOM 863 CA GLN A 57 9.965 -9.384 -8.283 1.00 0.00 C ATOM 864 C GLN A 57 9.129 -10.485 -8.928 1.00 0.00 C ATOM 865 O GLN A 57 8.871 -10.459 -10.132 1.00 0.00 O ATOM 866 CB GLN A 57 9.217 -8.793 -7.087 1.00 0.00 C ATOM 867 CG GLN A 57 10.051 -7.823 -6.267 1.00 0.00 C ATOM 868 CD GLN A 57 10.802 -8.506 -5.141 1.00 0.00 C ATOM 869 OE1 GLN A 57 12.032 -8.555 -5.139 1.00 0.00 O ATOM 870 NE2 GLN A 57 10.063 -9.038 -4.174 1.00 0.00 N ATOM 0 H GLN A 57 9.634 -7.552 -9.247 1.00 0.00 H new ATOM 0 HA GLN A 57 10.902 -9.820 -7.936 1.00 0.00 H new ATOM 0 HB2 GLN A 57 8.325 -8.279 -7.445 1.00 0.00 H new ATOM 0 HB3 GLN A 57 8.880 -9.605 -6.442 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.763 -7.320 -6.921 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.401 -7.053 -5.851 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.046 -8.974 -4.216 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.513 -9.510 -3.390 1.00 0.00 H new ATOM 879 N LYS A 58 8.708 -11.452 -8.120 1.00 0.00 N ATOM 880 CA LYS A 58 7.900 -12.562 -8.610 1.00 0.00 C ATOM 881 C LYS A 58 6.448 -12.416 -8.165 1.00 0.00 C ATOM 882 O LYS A 58 6.115 -12.670 -7.007 1.00 0.00 O ATOM 883 CB LYS A 58 8.467 -13.892 -8.109 1.00 0.00 C ATOM 884 CG LYS A 58 7.924 -15.102 -8.850 1.00 0.00 C ATOM 885 CD LYS A 58 8.718 -15.383 -10.115 1.00 0.00 C ATOM 886 CE LYS A 58 8.157 -16.578 -10.871 1.00 0.00 C ATOM 887 NZ LYS A 58 8.734 -16.689 -12.239 1.00 0.00 N ATOM 0 H LYS A 58 8.913 -11.489 -7.122 1.00 0.00 H new ATOM 0 HA LYS A 58 7.931 -12.548 -9.699 1.00 0.00 H new ATOM 0 HB2 LYS A 58 9.553 -13.874 -8.206 1.00 0.00 H new ATOM 0 HB3 LYS A 58 8.243 -13.996 -7.047 1.00 0.00 H new ATOM 0 HG2 LYS A 58 7.957 -15.974 -8.197 1.00 0.00 H new ATOM 0 HG3 LYS A 58 6.878 -14.934 -9.106 1.00 0.00 H new ATOM 0 HD2 LYS A 58 8.702 -14.504 -10.759 1.00 0.00 H new ATOM 0 HD3 LYS A 58 9.760 -15.571 -9.858 1.00 0.00 H new ATOM 0 HE2 LYS A 58 8.366 -17.491 -10.314 1.00 0.00 H new ATOM 0 HE3 LYS A 58 7.073 -16.488 -10.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 8.327 -17.515 -12.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 8.513 -15.829 -12.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 9.766 -16.801 -12.173 1.00 0.00 H new ATOM 901 N ASP A 59 5.589 -12.008 -9.092 1.00 0.00 N ATOM 902 CA ASP A 59 4.172 -11.831 -8.796 1.00 0.00 C ATOM 903 C ASP A 59 3.962 -10.690 -7.805 1.00 0.00 C ATOM 904 O ASP A 59 3.211 -10.824 -6.838 1.00 0.00 O ATOM 905 CB ASP A 59 3.581 -13.125 -8.236 1.00 0.00 C ATOM 906 CG ASP A 59 4.329 -14.356 -8.709 1.00 0.00 C ATOM 907 OD1 ASP A 59 4.656 -14.426 -9.912 1.00 0.00 O ATOM 908 OD2 ASP A 59 4.589 -15.249 -7.875 1.00 0.00 O ATOM 0 H ASP A 59 5.849 -11.794 -10.055 1.00 0.00 H new ATOM 0 HA ASP A 59 3.661 -11.580 -9.725 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.600 -13.088 -7.147 1.00 0.00 H new ATOM 0 HB3 ASP A 59 2.535 -13.202 -8.534 1.00 0.00 H new ATOM 913 N LEU A 60 4.631 -9.569 -8.051 1.00 0.00 N ATOM 914 CA LEU A 60 4.519 -8.405 -7.180 1.00 0.00 C ATOM 915 C LEU A 60 4.652 -7.112 -7.978 1.00 0.00 C ATOM 916 O LEU A 60 5.605 -6.934 -8.737 1.00 0.00 O ATOM 917 CB LEU A 60 5.589 -8.455 -6.088 1.00 0.00 C ATOM 918 CG LEU A 60 5.521 -7.354 -5.030 1.00 0.00 C ATOM 919 CD1 LEU A 60 4.602 -7.765 -3.890 1.00 0.00 C ATOM 920 CD2 LEU A 60 6.912 -7.031 -4.505 1.00 0.00 C ATOM 0 H LEU A 60 5.257 -9.442 -8.846 1.00 0.00 H new ATOM 0 HA LEU A 60 3.533 -8.424 -6.716 1.00 0.00 H new ATOM 0 HB2 LEU A 60 5.521 -9.419 -5.585 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.568 -8.413 -6.565 1.00 0.00 H new ATOM 0 HG LEU A 60 5.112 -6.456 -5.494 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.566 -6.969 -3.146 1.00 0.00 H new ATOM 0 HD12 LEU A 60 3.599 -7.945 -4.278 1.00 0.00 H new ATOM 0 HD13 LEU A 60 4.981 -8.676 -3.428 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.844 -6.245 -3.753 1.00 0.00 H new ATOM 0 HD22 LEU A 60 7.349 -7.924 -4.058 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.542 -6.692 -5.328 1.00 0.00 H new ATOM 932 N VAL A 61 3.691 -6.211 -7.801 1.00 0.00 N ATOM 933 CA VAL A 61 3.702 -4.933 -8.502 1.00 0.00 C ATOM 934 C VAL A 61 3.258 -3.799 -7.585 1.00 0.00 C ATOM 935 O VAL A 61 2.114 -3.767 -7.129 1.00 0.00 O ATOM 936 CB VAL A 61 2.788 -4.965 -9.741 1.00 0.00 C ATOM 937 CG1 VAL A 61 2.914 -3.671 -10.531 1.00 0.00 C ATOM 938 CG2 VAL A 61 3.115 -6.166 -10.614 1.00 0.00 C ATOM 0 H VAL A 61 2.895 -6.343 -7.178 1.00 0.00 H new ATOM 0 HA VAL A 61 4.729 -4.756 -8.822 1.00 0.00 H new ATOM 0 HB VAL A 61 1.755 -5.059 -9.406 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.261 -3.712 -11.403 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.625 -2.830 -9.900 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.946 -3.543 -10.857 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.459 -6.172 -11.485 1.00 0.00 H new ATOM 0 HG22 VAL A 61 4.153 -6.106 -10.942 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.968 -7.082 -10.042 1.00 0.00 H new ATOM 948 N ILE A 62 4.169 -2.869 -7.319 1.00 0.00 N ATOM 949 CA ILE A 62 3.871 -1.732 -6.457 1.00 0.00 C ATOM 950 C ILE A 62 3.223 -0.600 -7.247 1.00 0.00 C ATOM 951 O ILE A 62 3.884 0.086 -8.025 1.00 0.00 O ATOM 952 CB ILE A 62 5.141 -1.200 -5.767 1.00 0.00 C ATOM 953 CG1 ILE A 62 5.685 -2.237 -4.783 1.00 0.00 C ATOM 954 CG2 ILE A 62 4.846 0.111 -5.055 1.00 0.00 C ATOM 955 CD1 ILE A 62 6.963 -1.807 -4.097 1.00 0.00 C ATOM 0 H ILE A 62 5.120 -2.881 -7.688 1.00 0.00 H new ATOM 0 HA ILE A 62 3.176 -2.086 -5.696 1.00 0.00 H new ATOM 0 HB ILE A 62 5.900 -1.015 -6.527 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.927 -2.441 -4.027 1.00 0.00 H new ATOM 0 HG13 ILE A 62 5.864 -3.172 -5.315 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.753 0.475 -4.572 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.500 0.848 -5.779 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.074 -0.049 -4.303 1.00 0.00 H new ATOM 0 HD11 ILE A 62 7.291 -2.591 -3.414 1.00 0.00 H new ATOM 0 HD12 ILE A 62 7.736 -1.631 -4.845 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.784 -0.889 -3.537 1.00 0.00 H new ATOM 967 N ALA A 63 1.924 -0.409 -7.038 1.00 0.00 N ATOM 968 CA ALA A 63 1.186 0.643 -7.727 1.00 0.00 C ATOM 969 C ALA A 63 0.559 1.615 -6.733 1.00 0.00 C ATOM 970 O ALA A 63 0.479 1.331 -5.538 1.00 0.00 O ATOM 971 CB ALA A 63 0.117 0.037 -8.623 1.00 0.00 C ATOM 0 H ALA A 63 1.361 -0.969 -6.397 1.00 0.00 H new ATOM 0 HA ALA A 63 1.889 1.201 -8.346 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -0.426 0.834 -9.131 1.00 0.00 H new ATOM 0 HB2 ALA A 63 0.587 -0.611 -9.363 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -0.577 -0.547 -8.018 1.00 0.00 H new ATOM 977 N LYS A 64 0.115 2.762 -7.235 1.00 0.00 N ATOM 978 CA LYS A 64 -0.507 3.777 -6.392 1.00 0.00 C ATOM 979 C LYS A 64 -1.885 4.156 -6.924 1.00 0.00 C ATOM 980 O LYS A 64 -2.255 3.783 -8.036 1.00 0.00 O ATOM 981 CB LYS A 64 0.382 5.020 -6.315 1.00 0.00 C ATOM 982 CG LYS A 64 0.618 5.683 -7.661 1.00 0.00 C ATOM 983 CD LYS A 64 1.479 6.928 -7.526 1.00 0.00 C ATOM 984 CE LYS A 64 1.678 7.616 -8.867 1.00 0.00 C ATOM 985 NZ LYS A 64 0.426 8.261 -9.352 1.00 0.00 N ATOM 0 H LYS A 64 0.174 3.012 -8.222 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.625 3.360 -5.392 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.075 5.742 -5.639 1.00 0.00 H new ATOM 0 HB3 LYS A 64 1.343 4.743 -5.882 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.101 4.977 -8.336 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -0.339 5.948 -8.110 1.00 0.00 H new ATOM 0 HD2 LYS A 64 1.012 7.621 -6.826 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.448 6.658 -7.107 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.462 8.368 -8.776 1.00 0.00 H new ATOM 0 HE3 LYS A 64 2.019 6.887 -9.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 0.659 9.155 -9.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -0.055 7.626 -10.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.201 8.452 -8.545 1.00 0.00 H new ATOM 999 N MET A 65 -2.639 4.902 -6.122 1.00 0.00 N ATOM 1000 CA MET A 65 -3.975 5.334 -6.515 1.00 0.00 C ATOM 1001 C MET A 65 -4.408 6.558 -5.714 1.00 0.00 C ATOM 1002 O MET A 65 -4.019 6.724 -4.558 1.00 0.00 O ATOM 1003 CB MET A 65 -4.981 4.198 -6.316 1.00 0.00 C ATOM 1004 CG MET A 65 -6.379 4.531 -6.812 1.00 0.00 C ATOM 1005 SD MET A 65 -7.404 5.294 -5.539 1.00 0.00 S ATOM 1006 CE MET A 65 -8.763 4.131 -5.458 1.00 0.00 C ATOM 0 H MET A 65 -2.348 5.219 -5.197 1.00 0.00 H new ATOM 0 HA MET A 65 -3.947 5.604 -7.571 1.00 0.00 H new ATOM 0 HB2 MET A 65 -4.622 3.310 -6.836 1.00 0.00 H new ATOM 0 HB3 MET A 65 -5.030 3.949 -5.256 1.00 0.00 H new ATOM 0 HG2 MET A 65 -6.307 5.204 -7.666 1.00 0.00 H new ATOM 0 HG3 MET A 65 -6.862 3.620 -7.164 1.00 0.00 H new ATOM 0 HE1 MET A 65 -9.674 4.656 -5.171 1.00 0.00 H new ATOM 0 HE2 MET A 65 -8.904 3.667 -6.434 1.00 0.00 H new ATOM 0 HE3 MET A 65 -8.540 3.361 -4.719 1.00 0.00 H new ATOM 1016 N ASP A 66 -5.213 7.412 -6.336 1.00 0.00 N ATOM 1017 CA ASP A 66 -5.698 8.621 -5.681 1.00 0.00 C ATOM 1018 C ASP A 66 -7.083 8.395 -5.082 1.00 0.00 C ATOM 1019 O ASP A 66 -8.091 8.450 -5.786 1.00 0.00 O ATOM 1020 CB ASP A 66 -5.742 9.783 -6.674 1.00 0.00 C ATOM 1021 CG ASP A 66 -6.034 9.324 -8.090 1.00 0.00 C ATOM 1022 OD1 ASP A 66 -5.272 8.481 -8.609 1.00 0.00 O ATOM 1023 OD2 ASP A 66 -7.023 9.807 -8.678 1.00 0.00 O ATOM 0 H ASP A 66 -5.544 7.289 -7.293 1.00 0.00 H new ATOM 0 HA ASP A 66 -5.008 8.869 -4.874 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.505 10.496 -6.361 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -4.788 10.309 -6.655 1.00 0.00 H new ATOM 1028 N ALA A 67 -7.124 8.141 -3.778 1.00 0.00 N ATOM 1029 CA ALA A 67 -8.385 7.908 -3.085 1.00 0.00 C ATOM 1030 C ALA A 67 -9.206 9.189 -2.993 1.00 0.00 C ATOM 1031 O ALA A 67 -10.417 9.149 -2.774 1.00 0.00 O ATOM 1032 CB ALA A 67 -8.126 7.344 -1.695 1.00 0.00 C ATOM 0 H ALA A 67 -6.299 8.091 -3.181 1.00 0.00 H new ATOM 0 HA ALA A 67 -8.958 7.181 -3.660 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -9.076 7.175 -1.188 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.587 6.401 -1.780 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -7.529 8.052 -1.120 1.00 0.00 H new ATOM 1038 N THR A 68 -8.539 10.327 -3.161 1.00 0.00 N ATOM 1039 CA THR A 68 -9.207 11.621 -3.096 1.00 0.00 C ATOM 1040 C THR A 68 -10.016 11.887 -4.360 1.00 0.00 C ATOM 1041 O THR A 68 -10.722 12.890 -4.457 1.00 0.00 O ATOM 1042 CB THR A 68 -8.196 12.766 -2.897 1.00 0.00 C ATOM 1043 OG1 THR A 68 -7.515 13.038 -4.127 1.00 0.00 O ATOM 1044 CG2 THR A 68 -7.183 12.411 -1.818 1.00 0.00 C ATOM 0 H THR A 68 -7.537 10.378 -3.343 1.00 0.00 H new ATOM 0 HA THR A 68 -9.879 11.586 -2.239 1.00 0.00 H new ATOM 0 HB THR A 68 -8.743 13.654 -2.582 1.00 0.00 H new ATOM 0 HG1 THR A 68 -7.267 13.985 -4.161 1.00 0.00 H new ATOM 0 HG21 THR A 68 -6.479 13.234 -1.695 1.00 0.00 H new ATOM 0 HG22 THR A 68 -7.702 12.233 -0.876 1.00 0.00 H new ATOM 0 HG23 THR A 68 -6.641 11.511 -2.109 1.00 0.00 H new ATOM 1052 N ALA A 69 -9.909 10.982 -5.327 1.00 0.00 N ATOM 1053 CA ALA A 69 -10.633 11.118 -6.585 1.00 0.00 C ATOM 1054 C ALA A 69 -11.367 9.828 -6.938 1.00 0.00 C ATOM 1055 O ALA A 69 -12.449 9.859 -7.523 1.00 0.00 O ATOM 1056 CB ALA A 69 -9.679 11.507 -7.704 1.00 0.00 C ATOM 0 H ALA A 69 -9.328 10.146 -5.263 1.00 0.00 H new ATOM 0 HA ALA A 69 -11.375 11.907 -6.465 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -10.234 11.605 -8.637 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -9.204 12.458 -7.463 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.915 10.737 -7.815 1.00 0.00 H new ATOM 1062 N ASN A 70 -10.771 8.696 -6.579 1.00 0.00 N ATOM 1063 CA ASN A 70 -11.368 7.396 -6.860 1.00 0.00 C ATOM 1064 C ASN A 70 -12.041 6.826 -5.615 1.00 0.00 C ATOM 1065 O ASN A 70 -11.395 6.621 -4.586 1.00 0.00 O ATOM 1066 CB ASN A 70 -10.303 6.421 -7.368 1.00 0.00 C ATOM 1067 CG ASN A 70 -9.706 6.857 -8.693 1.00 0.00 C ATOM 1068 OD1 ASN A 70 -10.322 6.696 -9.747 1.00 0.00 O ATOM 1069 ND2 ASN A 70 -8.501 7.412 -8.644 1.00 0.00 N ATOM 0 H ASN A 70 -9.875 8.653 -6.093 1.00 0.00 H new ATOM 0 HA ASN A 70 -12.125 7.532 -7.632 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -9.509 6.335 -6.626 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -10.744 5.431 -7.480 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -8.048 7.725 -9.503 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -8.028 7.525 -7.748 1.00 0.00 H new ATOM 1076 N ASP A 71 -13.341 6.572 -5.715 1.00 0.00 N ATOM 1077 CA ASP A 71 -14.102 6.024 -4.598 1.00 0.00 C ATOM 1078 C ASP A 71 -13.760 4.554 -4.377 1.00 0.00 C ATOM 1079 O ASP A 71 -13.861 3.739 -5.294 1.00 0.00 O ATOM 1080 CB ASP A 71 -15.602 6.180 -4.851 1.00 0.00 C ATOM 1081 CG ASP A 71 -16.088 7.594 -4.601 1.00 0.00 C ATOM 1082 OD1 ASP A 71 -15.630 8.213 -3.618 1.00 0.00 O ATOM 1083 OD2 ASP A 71 -16.926 8.081 -5.388 1.00 0.00 O ATOM 0 H ASP A 71 -13.890 6.737 -6.559 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.834 6.579 -3.699 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -15.825 5.899 -5.880 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -16.149 5.492 -4.207 1.00 0.00 H new ATOM 1088 N ILE A 72 -13.355 4.224 -3.155 1.00 0.00 N ATOM 1089 CA ILE A 72 -12.999 2.852 -2.814 1.00 0.00 C ATOM 1090 C ILE A 72 -14.242 2.013 -2.539 1.00 0.00 C ATOM 1091 O ILE A 72 -15.001 2.293 -1.610 1.00 0.00 O ATOM 1092 CB ILE A 72 -12.075 2.800 -1.583 1.00 0.00 C ATOM 1093 CG1 ILE A 72 -10.838 3.671 -1.810 1.00 0.00 C ATOM 1094 CG2 ILE A 72 -11.671 1.364 -1.285 1.00 0.00 C ATOM 1095 CD1 ILE A 72 -10.075 3.978 -0.540 1.00 0.00 C ATOM 0 H ILE A 72 -13.265 4.887 -2.385 1.00 0.00 H new ATOM 0 HA ILE A 72 -12.470 2.441 -3.673 1.00 0.00 H new ATOM 0 HB ILE A 72 -12.618 3.190 -0.722 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -10.173 3.168 -2.512 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -11.143 4.608 -2.276 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -11.018 1.343 -0.412 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -12.562 0.769 -1.085 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -11.143 0.949 -2.143 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -9.211 4.599 -0.776 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -10.725 4.509 0.155 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -9.739 3.047 -0.083 1.00 0.00 H new ATOM 1107 N THR A 73 -14.445 0.981 -3.352 1.00 0.00 N ATOM 1108 CA THR A 73 -15.595 0.100 -3.196 1.00 0.00 C ATOM 1109 C THR A 73 -15.365 -0.913 -2.079 1.00 0.00 C ATOM 1110 O THR A 73 -16.314 -1.409 -1.474 1.00 0.00 O ATOM 1111 CB THR A 73 -15.906 -0.655 -4.502 1.00 0.00 C ATOM 1112 OG1 THR A 73 -14.779 -1.450 -4.888 1.00 0.00 O ATOM 1113 CG2 THR A 73 -16.254 0.317 -5.619 1.00 0.00 C ATOM 0 H THR A 73 -13.827 0.735 -4.126 1.00 0.00 H new ATOM 0 HA THR A 73 -16.445 0.733 -2.940 1.00 0.00 H new ATOM 0 HB THR A 73 -16.764 -1.303 -4.326 1.00 0.00 H new ATOM 0 HG1 THR A 73 -14.901 -1.765 -5.808 1.00 0.00 H new ATOM 0 HG21 THR A 73 -16.470 -0.239 -6.531 1.00 0.00 H new ATOM 0 HG22 THR A 73 -17.130 0.900 -5.334 1.00 0.00 H new ATOM 0 HG23 THR A 73 -15.412 0.987 -5.793 1.00 0.00 H new ATOM 1121 N ASN A 74 -14.099 -1.214 -1.812 1.00 0.00 N ATOM 1122 CA ASN A 74 -13.745 -2.169 -0.768 1.00 0.00 C ATOM 1123 C ASN A 74 -14.391 -1.786 0.561 1.00 0.00 C ATOM 1124 O ASN A 74 -15.175 -0.839 0.631 1.00 0.00 O ATOM 1125 CB ASN A 74 -12.225 -2.239 -0.607 1.00 0.00 C ATOM 1126 CG ASN A 74 -11.538 -2.793 -1.840 1.00 0.00 C ATOM 1127 OD1 ASN A 74 -10.218 -2.657 -1.893 1.00 0.00 O flip ATOM 1128 ND2 ASN A 74 -12.187 -3.336 -2.734 1.00 0.00 N flip ATOM 0 H ASN A 74 -13.301 -0.811 -2.303 1.00 0.00 H new ATOM 0 HA ASN A 74 -14.118 -3.149 -1.064 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -11.838 -1.242 -0.396 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -11.982 -2.864 0.253 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -13.200 -3.418 -2.651 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -11.712 -3.704 -3.558 1.00 0.00 H new ATOM 1135 N ASP A 75 -14.055 -2.527 1.611 1.00 0.00 N ATOM 1136 CA ASP A 75 -14.600 -2.265 2.937 1.00 0.00 C ATOM 1137 C ASP A 75 -13.490 -2.218 3.982 1.00 0.00 C ATOM 1138 O ASP A 75 -13.532 -1.411 4.910 1.00 0.00 O ATOM 1139 CB ASP A 75 -15.625 -3.337 3.312 1.00 0.00 C ATOM 1140 CG ASP A 75 -16.861 -3.287 2.435 1.00 0.00 C ATOM 1141 OD1 ASP A 75 -16.710 -3.142 1.204 1.00 0.00 O ATOM 1142 OD2 ASP A 75 -17.979 -3.395 2.980 1.00 0.00 O ATOM 0 H ASP A 75 -13.408 -3.314 1.569 1.00 0.00 H new ATOM 0 HA ASP A 75 -15.094 -1.293 2.914 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -15.164 -4.321 3.230 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -15.917 -3.208 4.354 1.00 0.00 H new ATOM 1147 N GLN A 76 -12.499 -3.090 3.824 1.00 0.00 N ATOM 1148 CA GLN A 76 -11.378 -3.149 4.755 1.00 0.00 C ATOM 1149 C GLN A 76 -10.360 -2.054 4.452 1.00 0.00 C ATOM 1150 O GLN A 76 -9.546 -1.696 5.304 1.00 0.00 O ATOM 1151 CB GLN A 76 -10.705 -4.520 4.689 1.00 0.00 C ATOM 1152 CG GLN A 76 -11.675 -5.682 4.832 1.00 0.00 C ATOM 1153 CD GLN A 76 -12.231 -6.145 3.500 1.00 0.00 C ATOM 1154 OE1 GLN A 76 -13.444 -6.275 3.333 1.00 0.00 O ATOM 1155 NE2 GLN A 76 -11.346 -6.397 2.544 1.00 0.00 N ATOM 0 H GLN A 76 -12.450 -3.765 3.061 1.00 0.00 H new ATOM 0 HA GLN A 76 -11.766 -2.991 5.761 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -10.179 -4.612 3.739 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -9.954 -4.585 5.477 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -11.169 -6.515 5.319 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -12.498 -5.385 5.482 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -10.350 -6.276 2.726 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -11.662 -6.712 1.627 1.00 0.00 H new ATOM 1164 N TYR A 77 -10.412 -1.527 3.234 1.00 0.00 N ATOM 1165 CA TYR A 77 -9.492 -0.475 2.817 1.00 0.00 C ATOM 1166 C TYR A 77 -10.061 0.904 3.137 1.00 0.00 C ATOM 1167 O TYR A 77 -10.849 1.457 2.369 1.00 0.00 O ATOM 1168 CB TYR A 77 -9.203 -0.585 1.319 1.00 0.00 C ATOM 1169 CG TYR A 77 -8.455 -1.842 0.938 1.00 0.00 C ATOM 1170 CD1 TYR A 77 -9.042 -3.093 1.077 1.00 0.00 C ATOM 1171 CD2 TYR A 77 -7.160 -1.779 0.437 1.00 0.00 C ATOM 1172 CE1 TYR A 77 -8.362 -4.245 0.730 1.00 0.00 C ATOM 1173 CE2 TYR A 77 -6.473 -2.925 0.086 1.00 0.00 C ATOM 1174 CZ TYR A 77 -7.078 -4.155 0.235 1.00 0.00 C ATOM 1175 OH TYR A 77 -6.397 -5.300 -0.112 1.00 0.00 O ATOM 0 H TYR A 77 -11.081 -1.811 2.518 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.561 -0.601 3.370 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -10.145 -0.553 0.772 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.623 0.283 1.005 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -10.048 -3.167 1.463 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.683 -0.817 0.320 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -8.833 -5.210 0.846 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -5.468 -2.858 -0.303 1.00 0.00 H new ATOM 0 HH TYR A 77 -7.035 -5.983 -0.407 1.00 0.00 H new ATOM 1185 N LYS A 78 -9.655 1.455 4.276 1.00 0.00 N ATOM 1186 CA LYS A 78 -10.121 2.770 4.699 1.00 0.00 C ATOM 1187 C LYS A 78 -8.987 3.790 4.654 1.00 0.00 C ATOM 1188 O LYS A 78 -7.855 3.491 5.035 1.00 0.00 O ATOM 1189 CB LYS A 78 -10.701 2.698 6.113 1.00 0.00 C ATOM 1190 CG LYS A 78 -12.191 2.406 6.146 1.00 0.00 C ATOM 1191 CD LYS A 78 -12.790 2.715 7.508 1.00 0.00 C ATOM 1192 CE LYS A 78 -13.198 4.176 7.619 1.00 0.00 C ATOM 1193 NZ LYS A 78 -13.629 4.528 9.000 1.00 0.00 N ATOM 0 H LYS A 78 -9.004 1.011 4.923 1.00 0.00 H new ATOM 0 HA LYS A 78 -10.902 3.090 4.009 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -10.175 1.925 6.673 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -10.513 3.643 6.622 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -12.696 2.998 5.383 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.363 1.358 5.901 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -13.659 2.080 7.677 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -12.066 2.478 8.287 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -12.361 4.810 7.327 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -14.011 4.380 6.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -13.899 5.532 9.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -14.444 3.941 9.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.845 4.358 9.662 1.00 0.00 H new ATOM 1207 N VAL A 79 -9.299 4.995 4.187 1.00 0.00 N ATOM 1208 CA VAL A 79 -8.307 6.059 4.095 1.00 0.00 C ATOM 1209 C VAL A 79 -8.551 7.130 5.152 1.00 0.00 C ATOM 1210 O VAL A 79 -9.424 7.983 4.995 1.00 0.00 O ATOM 1211 CB VAL A 79 -8.316 6.716 2.702 1.00 0.00 C ATOM 1212 CG1 VAL A 79 -7.227 7.773 2.603 1.00 0.00 C ATOM 1213 CG2 VAL A 79 -8.149 5.664 1.616 1.00 0.00 C ATOM 0 H VAL A 79 -10.231 5.258 3.867 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.333 5.600 4.265 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.279 7.206 2.557 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.249 8.226 1.612 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.396 8.542 3.357 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -6.254 7.310 2.769 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -8.158 6.146 0.638 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.201 5.144 1.756 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -8.968 4.947 1.675 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.772 7.081 6.228 1.00 0.00 N ATOM 1224 CA GLU A 80 -7.904 8.048 7.312 1.00 0.00 C ATOM 1225 C GLU A 80 -6.890 9.178 7.159 1.00 0.00 C ATOM 1226 O GLU A 80 -7.196 10.341 7.421 1.00 0.00 O ATOM 1227 CB GLU A 80 -7.717 7.360 8.665 1.00 0.00 C ATOM 1228 CG GLU A 80 -8.743 6.274 8.944 1.00 0.00 C ATOM 1229 CD GLU A 80 -8.993 6.074 10.426 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -8.152 5.430 11.087 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -10.029 6.561 10.924 1.00 0.00 O ATOM 0 H GLU A 80 -7.043 6.382 6.372 1.00 0.00 H new ATOM 0 HA GLU A 80 -8.906 8.473 7.265 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.719 6.924 8.706 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -7.770 8.110 9.455 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -9.681 6.531 8.453 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -8.401 5.336 8.507 1.00 0.00 H new ATOM 1238 N GLY A 81 -5.681 8.827 6.733 1.00 0.00 N ATOM 1239 CA GLY A 81 -4.640 9.822 6.553 1.00 0.00 C ATOM 1240 C GLY A 81 -3.590 9.388 5.549 1.00 0.00 C ATOM 1241 O GLY A 81 -3.162 8.234 5.548 1.00 0.00 O ATOM 0 H GLY A 81 -5.404 7.871 6.509 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.090 10.758 6.222 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.161 10.020 7.512 1.00 0.00 H new ATOM 1245 N PHE A 82 -3.175 10.314 4.691 1.00 0.00 N ATOM 1246 CA PHE A 82 -2.171 10.021 3.676 1.00 0.00 C ATOM 1247 C PHE A 82 -0.788 10.477 4.130 1.00 0.00 C ATOM 1248 O PHE A 82 -0.643 11.414 4.916 1.00 0.00 O ATOM 1249 CB PHE A 82 -2.537 10.701 2.355 1.00 0.00 C ATOM 1250 CG PHE A 82 -4.011 10.704 2.070 1.00 0.00 C ATOM 1251 CD1 PHE A 82 -4.848 11.618 2.689 1.00 0.00 C ATOM 1252 CD2 PHE A 82 -4.561 9.791 1.184 1.00 0.00 C ATOM 1253 CE1 PHE A 82 -6.206 11.624 2.429 1.00 0.00 C ATOM 1254 CE2 PHE A 82 -5.917 9.792 0.920 1.00 0.00 C ATOM 1255 CZ PHE A 82 -6.741 10.708 1.544 1.00 0.00 C ATOM 0 H PHE A 82 -3.519 11.274 4.679 1.00 0.00 H new ATOM 0 HA PHE A 82 -2.147 8.942 3.527 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.177 11.730 2.373 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -2.019 10.196 1.540 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -4.435 12.335 3.383 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -3.922 9.071 0.695 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.847 12.343 2.917 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.333 9.077 0.226 1.00 0.00 H new ATOM 0 HZ PHE A 82 -7.802 10.708 1.340 1.00 0.00 H new ATOM 1265 N PRO A 83 0.254 9.800 3.625 1.00 0.00 N ATOM 1266 CA PRO A 83 0.093 8.683 2.690 1.00 0.00 C ATOM 1267 C PRO A 83 -0.510 7.451 3.356 1.00 0.00 C ATOM 1268 O PRO A 83 -0.425 7.286 4.573 1.00 0.00 O ATOM 1269 CB PRO A 83 1.525 8.395 2.232 1.00 0.00 C ATOM 1270 CG PRO A 83 2.385 8.886 3.345 1.00 0.00 C ATOM 1271 CD PRO A 83 1.669 10.072 3.929 1.00 0.00 C ATOM 0 HA PRO A 83 -0.589 8.929 1.876 1.00 0.00 H new ATOM 0 HB2 PRO A 83 1.677 7.330 2.054 1.00 0.00 H new ATOM 0 HB3 PRO A 83 1.753 8.910 1.299 1.00 0.00 H new ATOM 0 HG2 PRO A 83 2.532 8.110 4.096 1.00 0.00 H new ATOM 0 HG3 PRO A 83 3.373 9.167 2.980 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.840 10.156 5.002 1.00 0.00 H new ATOM 0 HD3 PRO A 83 2.005 11.006 3.478 1.00 0.00 H new ATOM 1279 N THR A 84 -1.121 6.588 2.550 1.00 0.00 N ATOM 1280 CA THR A 84 -1.739 5.371 3.061 1.00 0.00 C ATOM 1281 C THR A 84 -1.385 4.168 2.195 1.00 0.00 C ATOM 1282 O THR A 84 -1.996 3.943 1.150 1.00 0.00 O ATOM 1283 CB THR A 84 -3.272 5.506 3.130 1.00 0.00 C ATOM 1284 OG1 THR A 84 -3.631 6.859 3.435 1.00 0.00 O ATOM 1285 CG2 THR A 84 -3.851 4.573 4.183 1.00 0.00 C ATOM 0 H THR A 84 -1.201 6.710 1.540 1.00 0.00 H new ATOM 0 HA THR A 84 -1.349 5.218 4.067 1.00 0.00 H new ATOM 0 HB THR A 84 -3.683 5.231 2.159 1.00 0.00 H new ATOM 0 HG1 THR A 84 -3.160 7.148 4.244 1.00 0.00 H new ATOM 0 HG21 THR A 84 -4.935 4.686 4.213 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.601 3.542 3.933 1.00 0.00 H new ATOM 0 HG23 THR A 84 -3.433 4.821 5.159 1.00 0.00 H new ATOM 1293 N ILE A 85 -0.396 3.398 2.635 1.00 0.00 N ATOM 1294 CA ILE A 85 0.037 2.217 1.900 1.00 0.00 C ATOM 1295 C ILE A 85 -0.761 0.986 2.317 1.00 0.00 C ATOM 1296 O ILE A 85 -1.108 0.826 3.487 1.00 0.00 O ATOM 1297 CB ILE A 85 1.537 1.939 2.114 1.00 0.00 C ATOM 1298 CG1 ILE A 85 2.368 3.154 1.698 1.00 0.00 C ATOM 1299 CG2 ILE A 85 1.964 0.706 1.332 1.00 0.00 C ATOM 1300 CD1 ILE A 85 3.684 3.268 2.435 1.00 0.00 C ATOM 0 H ILE A 85 0.121 3.571 3.497 1.00 0.00 H new ATOM 0 HA ILE A 85 -0.140 2.421 0.844 1.00 0.00 H new ATOM 0 HB ILE A 85 1.709 1.751 3.174 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.564 3.100 0.627 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.785 4.059 1.870 1.00 0.00 H new ATOM 0 HG21 ILE A 85 3.026 0.523 1.493 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.391 -0.157 1.672 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.781 0.867 0.270 1.00 0.00 H new ATOM 0 HD11 ILE A 85 4.219 4.152 2.089 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.495 3.354 3.505 1.00 0.00 H new ATOM 0 HD13 ILE A 85 4.287 2.380 2.243 1.00 0.00 H new ATOM 1312 N TYR A 86 -1.046 0.118 1.352 1.00 0.00 N ATOM 1313 CA TYR A 86 -1.804 -1.098 1.619 1.00 0.00 C ATOM 1314 C TYR A 86 -1.301 -2.253 0.758 1.00 0.00 C ATOM 1315 O TYR A 86 -1.053 -2.090 -0.437 1.00 0.00 O ATOM 1316 CB TYR A 86 -3.293 -0.864 1.358 1.00 0.00 C ATOM 1317 CG TYR A 86 -4.055 -0.394 2.577 1.00 0.00 C ATOM 1318 CD1 TYR A 86 -4.444 -1.290 3.565 1.00 0.00 C ATOM 1319 CD2 TYR A 86 -4.386 0.945 2.740 1.00 0.00 C ATOM 1320 CE1 TYR A 86 -5.141 -0.866 4.680 1.00 0.00 C ATOM 1321 CE2 TYR A 86 -5.081 1.379 3.852 1.00 0.00 C ATOM 1322 CZ TYR A 86 -5.456 0.469 4.819 1.00 0.00 C ATOM 1323 OH TYR A 86 -6.150 0.897 5.928 1.00 0.00 O ATOM 0 H TYR A 86 -0.764 0.234 0.379 1.00 0.00 H new ATOM 0 HA TYR A 86 -1.663 -1.361 2.667 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -3.402 -0.125 0.564 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -3.740 -1.790 0.995 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -4.197 -2.336 3.460 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -4.095 1.659 1.984 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -5.437 -1.576 5.438 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -5.329 2.424 3.964 1.00 0.00 H new ATOM 0 HH TYR A 86 -6.693 1.678 5.693 1.00 0.00 H new ATOM 1333 N PHE A 87 -1.153 -3.421 1.374 1.00 0.00 N ATOM 1334 CA PHE A 87 -0.680 -4.605 0.666 1.00 0.00 C ATOM 1335 C PHE A 87 -1.809 -5.612 0.474 1.00 0.00 C ATOM 1336 O PHE A 87 -2.351 -6.145 1.442 1.00 0.00 O ATOM 1337 CB PHE A 87 0.475 -5.255 1.431 1.00 0.00 C ATOM 1338 CG PHE A 87 1.204 -6.303 0.640 1.00 0.00 C ATOM 1339 CD1 PHE A 87 0.718 -7.598 0.568 1.00 0.00 C ATOM 1340 CD2 PHE A 87 2.375 -5.992 -0.032 1.00 0.00 C ATOM 1341 CE1 PHE A 87 1.386 -8.565 -0.160 1.00 0.00 C ATOM 1342 CE2 PHE A 87 3.047 -6.955 -0.762 1.00 0.00 C ATOM 1343 CZ PHE A 87 2.553 -8.243 -0.825 1.00 0.00 C ATOM 0 H PHE A 87 -1.354 -3.573 2.362 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.326 -4.293 -0.316 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.182 -4.482 1.732 1.00 0.00 H new ATOM 0 HB3 PHE A 87 0.087 -5.705 2.345 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -0.194 -7.855 1.087 1.00 0.00 H new ATOM 0 HD2 PHE A 87 2.767 -4.987 0.015 1.00 0.00 H new ATOM 0 HE1 PHE A 87 0.996 -9.571 -0.209 1.00 0.00 H new ATOM 0 HE2 PHE A 87 3.958 -6.700 -1.283 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.078 -8.997 -1.393 1.00 0.00 H new ATOM 1353 N ALA A 88 -2.159 -5.868 -0.782 1.00 0.00 N ATOM 1354 CA ALA A 88 -3.223 -6.812 -1.102 1.00 0.00 C ATOM 1355 C ALA A 88 -2.651 -8.129 -1.616 1.00 0.00 C ATOM 1356 O ALA A 88 -2.356 -8.285 -2.801 1.00 0.00 O ATOM 1357 CB ALA A 88 -4.172 -6.211 -2.127 1.00 0.00 C ATOM 0 H ALA A 88 -1.721 -5.435 -1.595 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.779 -7.019 -0.187 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -4.961 -6.927 -2.356 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.614 -5.300 -1.723 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.622 -5.974 -3.037 1.00 0.00 H new ATOM 1363 N PRO A 89 -2.490 -9.101 -0.706 1.00 0.00 N ATOM 1364 CA PRO A 89 -1.952 -10.422 -1.045 1.00 0.00 C ATOM 1365 C PRO A 89 -2.920 -11.242 -1.892 1.00 0.00 C ATOM 1366 O PRO A 89 -4.040 -11.528 -1.471 1.00 0.00 O ATOM 1367 CB PRO A 89 -1.746 -11.082 0.321 1.00 0.00 C ATOM 1368 CG PRO A 89 -2.718 -10.401 1.221 1.00 0.00 C ATOM 1369 CD PRO A 89 -2.821 -8.985 0.724 1.00 0.00 C ATOM 0 HA PRO A 89 -1.042 -10.351 -1.641 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -1.934 -12.155 0.275 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -0.723 -10.952 0.673 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -3.689 -10.896 1.193 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -2.376 -10.428 2.256 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -3.821 -8.578 0.873 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -2.127 -8.325 1.245 1.00 0.00 H new ATOM 1377 N SER A 90 -2.479 -11.617 -3.089 1.00 0.00 N ATOM 1378 CA SER A 90 -3.308 -12.401 -3.997 1.00 0.00 C ATOM 1379 C SER A 90 -3.820 -13.664 -3.312 1.00 0.00 C ATOM 1380 O SER A 90 -3.064 -14.606 -3.077 1.00 0.00 O ATOM 1381 CB SER A 90 -2.515 -12.773 -5.252 1.00 0.00 C ATOM 1382 OG SER A 90 -2.976 -13.995 -5.802 1.00 0.00 O ATOM 0 H SER A 90 -1.553 -11.391 -3.452 1.00 0.00 H new ATOM 0 HA SER A 90 -4.165 -11.792 -4.284 1.00 0.00 H new ATOM 0 HB2 SER A 90 -2.607 -11.979 -5.993 1.00 0.00 H new ATOM 0 HB3 SER A 90 -1.457 -12.858 -5.006 1.00 0.00 H new ATOM 0 HG SER A 90 -2.285 -14.373 -6.385 1.00 0.00 H new ATOM 1388 N GLY A 91 -5.111 -13.676 -2.993 1.00 0.00 N ATOM 1389 CA GLY A 91 -5.703 -14.827 -2.338 1.00 0.00 C ATOM 1390 C GLY A 91 -6.312 -14.480 -0.994 1.00 0.00 C ATOM 1391 O GLY A 91 -7.418 -14.915 -0.675 1.00 0.00 O ATOM 0 H GLY A 91 -5.757 -12.909 -3.177 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -6.472 -15.252 -2.983 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -4.941 -15.595 -2.201 1.00 0.00 H new ATOM 1395 N ASP A 92 -5.588 -13.695 -0.203 1.00 0.00 N ATOM 1396 CA ASP A 92 -6.063 -13.290 1.114 1.00 0.00 C ATOM 1397 C ASP A 92 -6.327 -11.788 1.159 1.00 0.00 C ATOM 1398 O ASP A 92 -6.367 -11.185 2.231 1.00 0.00 O ATOM 1399 CB ASP A 92 -5.042 -13.672 2.188 1.00 0.00 C ATOM 1400 CG ASP A 92 -4.578 -15.109 2.059 1.00 0.00 C ATOM 1401 OD1 ASP A 92 -3.861 -15.416 1.083 1.00 0.00 O ATOM 1402 OD2 ASP A 92 -4.931 -15.927 2.934 1.00 0.00 O ATOM 0 H ASP A 92 -4.670 -13.327 -0.452 1.00 0.00 H new ATOM 0 HA ASP A 92 -7.000 -13.812 1.311 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -4.181 -13.007 2.119 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -5.482 -13.522 3.174 1.00 0.00 H new ATOM 1407 N LYS A 93 -6.506 -11.189 -0.014 1.00 0.00 N ATOM 1408 CA LYS A 93 -6.766 -9.758 -0.111 1.00 0.00 C ATOM 1409 C LYS A 93 -7.796 -9.321 0.926 1.00 0.00 C ATOM 1410 O LYS A 93 -7.765 -8.188 1.408 1.00 0.00 O ATOM 1411 CB LYS A 93 -7.259 -9.402 -1.515 1.00 0.00 C ATOM 1412 CG LYS A 93 -6.419 -10.008 -2.626 1.00 0.00 C ATOM 1413 CD LYS A 93 -6.541 -9.213 -3.915 1.00 0.00 C ATOM 1414 CE LYS A 93 -5.537 -9.682 -4.957 1.00 0.00 C ATOM 1415 NZ LYS A 93 -4.136 -9.382 -4.552 1.00 0.00 N ATOM 0 H LYS A 93 -6.476 -11.673 -0.911 1.00 0.00 H new ATOM 0 HA LYS A 93 -5.832 -9.231 0.084 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -8.290 -9.739 -1.625 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -7.264 -8.318 -1.625 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.375 -10.042 -2.316 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.733 -11.037 -2.801 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -7.552 -9.313 -4.311 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -6.384 -8.155 -3.707 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -5.648 -10.755 -5.111 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -5.751 -9.199 -5.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -3.482 -9.978 -5.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.928 -8.380 -4.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.019 -9.578 -3.537 1.00 0.00 H new ATOM 1429 N LYS A 94 -8.706 -10.226 1.268 1.00 0.00 N ATOM 1430 CA LYS A 94 -9.743 -9.936 2.250 1.00 0.00 C ATOM 1431 C LYS A 94 -9.168 -9.178 3.442 1.00 0.00 C ATOM 1432 O LYS A 94 -9.806 -8.275 3.982 1.00 0.00 O ATOM 1433 CB LYS A 94 -10.400 -11.233 2.727 1.00 0.00 C ATOM 1434 CG LYS A 94 -11.816 -11.044 3.244 1.00 0.00 C ATOM 1435 CD LYS A 94 -12.817 -10.944 2.104 1.00 0.00 C ATOM 1436 CE LYS A 94 -14.238 -10.792 2.623 1.00 0.00 C ATOM 1437 NZ LYS A 94 -15.192 -10.443 1.534 1.00 0.00 N ATOM 0 H LYS A 94 -8.746 -11.168 0.879 1.00 0.00 H new ATOM 0 HA LYS A 94 -10.495 -9.309 1.771 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.415 -11.947 1.903 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -9.789 -11.671 3.517 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -12.083 -11.879 3.891 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -11.865 -10.141 3.853 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -12.566 -10.092 1.472 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -12.750 -11.835 1.480 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -14.553 -11.722 3.097 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -14.264 -10.018 3.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -16.150 -10.348 1.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -14.907 -9.543 1.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -15.187 -11.194 0.814 1.00 0.00 H new ATOM 1451 N ASN A 95 -7.957 -9.549 3.845 1.00 0.00 N ATOM 1452 CA ASN A 95 -7.295 -8.903 4.973 1.00 0.00 C ATOM 1453 C ASN A 95 -6.145 -8.021 4.496 1.00 0.00 C ATOM 1454 O ASN A 95 -5.022 -8.482 4.288 1.00 0.00 O ATOM 1455 CB ASN A 95 -6.774 -9.953 5.955 1.00 0.00 C ATOM 1456 CG ASN A 95 -7.860 -10.909 6.411 1.00 0.00 C ATOM 1457 OD1 ASN A 95 -7.729 -12.125 6.277 1.00 0.00 O ATOM 1458 ND2 ASN A 95 -8.941 -10.360 6.954 1.00 0.00 N ATOM 0 H ASN A 95 -7.414 -10.293 3.407 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.026 -8.273 5.480 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -5.970 -10.519 5.485 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -6.346 -9.453 6.824 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -9.705 -10.952 7.280 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -9.007 -9.346 7.045 1.00 0.00 H new ATOM 1465 N PRO A 96 -6.429 -6.723 4.318 1.00 0.00 N ATOM 1466 CA PRO A 96 -5.432 -5.749 3.865 1.00 0.00 C ATOM 1467 C PRO A 96 -4.369 -5.472 4.923 1.00 0.00 C ATOM 1468 O PRO A 96 -4.645 -5.527 6.122 1.00 0.00 O ATOM 1469 CB PRO A 96 -6.261 -4.490 3.598 1.00 0.00 C ATOM 1470 CG PRO A 96 -7.457 -4.631 4.476 1.00 0.00 C ATOM 1471 CD PRO A 96 -7.746 -6.105 4.547 1.00 0.00 C ATOM 0 HA PRO A 96 -4.881 -6.106 2.995 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -5.699 -3.587 3.837 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -6.546 -4.419 2.548 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -7.263 -4.223 5.468 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -8.308 -4.086 4.067 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -8.159 -6.387 5.515 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -8.470 -6.409 3.791 1.00 0.00 H new ATOM 1479 N ILE A 97 -3.155 -5.176 4.472 1.00 0.00 N ATOM 1480 CA ILE A 97 -2.052 -4.889 5.380 1.00 0.00 C ATOM 1481 C ILE A 97 -1.469 -3.505 5.118 1.00 0.00 C ATOM 1482 O ILE A 97 -0.671 -3.319 4.198 1.00 0.00 O ATOM 1483 CB ILE A 97 -0.932 -5.939 5.254 1.00 0.00 C ATOM 1484 CG1 ILE A 97 -1.528 -7.346 5.177 1.00 0.00 C ATOM 1485 CG2 ILE A 97 0.031 -5.829 6.427 1.00 0.00 C ATOM 1486 CD1 ILE A 97 -0.646 -8.336 4.448 1.00 0.00 C ATOM 0 H ILE A 97 -2.910 -5.129 3.483 1.00 0.00 H new ATOM 0 HA ILE A 97 -2.458 -4.923 6.391 1.00 0.00 H new ATOM 0 HB ILE A 97 -0.378 -5.749 4.335 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -1.711 -7.710 6.188 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -2.495 -7.296 4.676 1.00 0.00 H new ATOM 0 HG21 ILE A 97 0.817 -6.577 6.324 1.00 0.00 H new ATOM 0 HG22 ILE A 97 0.477 -4.834 6.440 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.510 -5.997 7.359 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -1.131 -9.312 4.432 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.483 -7.994 3.426 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.313 -8.416 4.961 1.00 0.00 H new ATOM 1498 N LYS A 98 -1.870 -2.536 5.933 1.00 0.00 N ATOM 1499 CA LYS A 98 -1.386 -1.167 5.792 1.00 0.00 C ATOM 1500 C LYS A 98 -0.059 -0.982 6.522 1.00 0.00 C ATOM 1501 O LYS A 98 0.240 -1.698 7.478 1.00 0.00 O ATOM 1502 CB LYS A 98 -2.421 -0.180 6.334 1.00 0.00 C ATOM 1503 CG LYS A 98 -1.825 1.147 6.772 1.00 0.00 C ATOM 1504 CD LYS A 98 -2.872 2.248 6.795 1.00 0.00 C ATOM 1505 CE LYS A 98 -3.544 2.350 8.155 1.00 0.00 C ATOM 1506 NZ LYS A 98 -4.251 3.649 8.329 1.00 0.00 N ATOM 0 H LYS A 98 -2.530 -2.673 6.699 1.00 0.00 H new ATOM 0 HA LYS A 98 -1.228 -0.971 4.732 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -3.172 0.004 5.566 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -2.936 -0.635 7.180 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -1.386 1.040 7.764 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -1.018 1.426 6.095 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -2.405 3.201 6.547 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -3.624 2.053 6.030 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -4.254 1.532 8.271 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -2.796 2.236 8.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -4.696 3.679 9.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -3.569 4.430 8.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -4.983 3.747 7.596 1.00 0.00 H new ATOM 1520 N PHE A 99 0.731 -0.016 6.067 1.00 0.00 N ATOM 1521 CA PHE A 99 2.026 0.264 6.678 1.00 0.00 C ATOM 1522 C PHE A 99 1.906 1.369 7.723 1.00 0.00 C ATOM 1523 O PHE A 99 1.582 2.511 7.399 1.00 0.00 O ATOM 1524 CB PHE A 99 3.042 0.667 5.607 1.00 0.00 C ATOM 1525 CG PHE A 99 4.378 1.062 6.168 1.00 0.00 C ATOM 1526 CD1 PHE A 99 5.322 0.100 6.488 1.00 0.00 C ATOM 1527 CD2 PHE A 99 4.690 2.396 6.375 1.00 0.00 C ATOM 1528 CE1 PHE A 99 6.553 0.461 7.004 1.00 0.00 C ATOM 1529 CE2 PHE A 99 5.919 2.763 6.890 1.00 0.00 C ATOM 1530 CZ PHE A 99 6.851 1.794 7.206 1.00 0.00 C ATOM 0 H PHE A 99 0.498 0.586 5.278 1.00 0.00 H new ATOM 0 HA PHE A 99 2.371 -0.644 7.173 1.00 0.00 H new ATOM 0 HB2 PHE A 99 3.178 -0.165 4.916 1.00 0.00 H new ATOM 0 HB3 PHE A 99 2.639 1.499 5.029 1.00 0.00 H new ATOM 0 HD1 PHE A 99 5.094 -0.944 6.333 1.00 0.00 H new ATOM 0 HD2 PHE A 99 3.964 3.158 6.131 1.00 0.00 H new ATOM 0 HE1 PHE A 99 7.281 -0.299 7.249 1.00 0.00 H new ATOM 0 HE2 PHE A 99 6.150 3.806 7.045 1.00 0.00 H new ATOM 0 HZ PHE A 99 7.811 2.078 7.610 1.00 0.00 H new ATOM 1540 N GLU A 100 2.170 1.019 8.978 1.00 0.00 N ATOM 1541 CA GLU A 100 2.090 1.981 10.072 1.00 0.00 C ATOM 1542 C GLU A 100 3.384 1.993 10.881 1.00 0.00 C ATOM 1543 O GLU A 100 3.374 2.244 12.085 1.00 0.00 O ATOM 1544 CB GLU A 100 0.908 1.652 10.985 1.00 0.00 C ATOM 1545 CG GLU A 100 -0.432 2.113 10.436 1.00 0.00 C ATOM 1546 CD GLU A 100 -0.430 3.578 10.046 1.00 0.00 C ATOM 1547 OE1 GLU A 100 0.037 3.896 8.933 1.00 0.00 O ATOM 1548 OE2 GLU A 100 -0.896 4.407 10.855 1.00 0.00 O ATOM 0 H GLU A 100 2.441 0.078 9.263 1.00 0.00 H new ATOM 0 HA GLU A 100 1.942 2.971 9.641 1.00 0.00 H new ATOM 0 HB2 GLU A 100 0.874 0.575 11.147 1.00 0.00 H new ATOM 0 HB3 GLU A 100 1.071 2.115 11.958 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -0.691 1.510 9.566 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -1.206 1.941 11.185 1.00 0.00 H new ATOM 1555 N GLY A 101 4.498 1.719 10.208 1.00 0.00 N ATOM 1556 CA GLY A 101 5.785 1.703 10.880 1.00 0.00 C ATOM 1557 C GLY A 101 6.369 3.091 11.048 1.00 0.00 C ATOM 1558 O GLY A 101 7.580 3.280 10.941 1.00 0.00 O ATOM 0 H GLY A 101 4.532 1.508 9.211 1.00 0.00 H new ATOM 0 HA2 GLY A 101 5.674 1.238 11.860 1.00 0.00 H new ATOM 0 HA3 GLY A 101 6.481 1.086 10.311 1.00 0.00 H new ATOM 1562 N GLY A 102 5.505 4.068 11.310 1.00 0.00 N ATOM 1563 CA GLY A 102 5.961 5.434 11.487 1.00 0.00 C ATOM 1564 C GLY A 102 6.869 5.892 10.363 1.00 0.00 C ATOM 1565 O GLY A 102 6.401 6.400 9.345 1.00 0.00 O ATOM 0 H GLY A 102 4.498 3.937 11.403 1.00 0.00 H new ATOM 0 HA2 GLY A 102 5.098 6.097 11.546 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.492 5.517 12.435 1.00 0.00 H new ATOM 1569 N ASN A 103 8.173 5.713 10.547 1.00 0.00 N ATOM 1570 CA ASN A 103 9.150 6.114 9.541 1.00 0.00 C ATOM 1571 C ASN A 103 8.804 5.518 8.180 1.00 0.00 C ATOM 1572 O ASN A 103 8.909 4.309 7.975 1.00 0.00 O ATOM 1573 CB ASN A 103 10.554 5.675 9.960 1.00 0.00 C ATOM 1574 CG ASN A 103 11.056 6.428 11.177 1.00 0.00 C ATOM 1575 OD1 ASN A 103 10.353 6.546 12.181 1.00 0.00 O ATOM 1576 ND2 ASN A 103 12.278 6.940 11.094 1.00 0.00 N ATOM 0 H ASN A 103 8.578 5.293 11.384 1.00 0.00 H new ATOM 0 HA ASN A 103 9.126 7.201 9.459 1.00 0.00 H new ATOM 0 HB2 ASN A 103 10.549 4.606 10.174 1.00 0.00 H new ATOM 0 HB3 ASN A 103 11.243 5.831 9.130 1.00 0.00 H new ATOM 0 HD21 ASN A 103 12.670 7.456 11.882 1.00 0.00 H new ATOM 0 HD22 ASN A 103 12.825 6.818 10.242 1.00 0.00 H new ATOM 1583 N ARG A 104 8.392 6.376 7.252 1.00 0.00 N ATOM 1584 CA ARG A 104 8.030 5.935 5.910 1.00 0.00 C ATOM 1585 C ARG A 104 9.155 6.225 4.921 1.00 0.00 C ATOM 1586 O ARG A 104 9.182 7.281 4.288 1.00 0.00 O ATOM 1587 CB ARG A 104 6.744 6.625 5.453 1.00 0.00 C ATOM 1588 CG ARG A 104 5.480 5.867 5.825 1.00 0.00 C ATOM 1589 CD ARG A 104 4.238 6.548 5.271 1.00 0.00 C ATOM 1590 NE ARG A 104 3.722 7.568 6.180 1.00 0.00 N ATOM 1591 CZ ARG A 104 3.035 7.291 7.282 1.00 0.00 C ATOM 1592 NH1 ARG A 104 2.783 6.032 7.612 1.00 0.00 N ATOM 1593 NH2 ARG A 104 2.599 8.275 8.059 1.00 0.00 N ATOM 0 H ARG A 104 8.301 7.380 7.405 1.00 0.00 H new ATOM 0 HA ARG A 104 7.865 4.858 5.941 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.702 7.622 5.891 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.775 6.753 4.371 1.00 0.00 H new ATOM 0 HG2 ARG A 104 5.539 4.848 5.442 1.00 0.00 H new ATOM 0 HG3 ARG A 104 5.404 5.795 6.910 1.00 0.00 H new ATOM 0 HD2 ARG A 104 4.473 7.005 4.310 1.00 0.00 H new ATOM 0 HD3 ARG A 104 3.466 5.801 5.089 1.00 0.00 H new ATOM 0 HE ARG A 104 3.899 8.547 5.956 1.00 0.00 H new ATOM 0 HH11 ARG A 104 3.117 5.273 7.019 1.00 0.00 H new ATOM 0 HH12 ARG A 104 2.255 5.823 8.459 1.00 0.00 H new ATOM 0 HH21 ARG A 104 2.792 9.245 7.810 1.00 0.00 H new ATOM 0 HH22 ARG A 104 2.071 8.061 8.905 1.00 0.00 H new ATOM 1607 N ASP A 105 10.081 5.281 4.793 1.00 0.00 N ATOM 1608 CA ASP A 105 11.208 5.435 3.880 1.00 0.00 C ATOM 1609 C ASP A 105 11.335 4.220 2.965 1.00 0.00 C ATOM 1610 O ASP A 105 10.624 3.228 3.130 1.00 0.00 O ATOM 1611 CB ASP A 105 12.504 5.635 4.666 1.00 0.00 C ATOM 1612 CG ASP A 105 12.291 6.422 5.944 1.00 0.00 C ATOM 1613 OD1 ASP A 105 11.827 7.579 5.858 1.00 0.00 O ATOM 1614 OD2 ASP A 105 12.586 5.881 7.030 1.00 0.00 O ATOM 0 H ASP A 105 10.074 4.402 5.310 1.00 0.00 H new ATOM 0 HA ASP A 105 11.027 6.315 3.263 1.00 0.00 H new ATOM 0 HB2 ASP A 105 12.932 4.662 4.909 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.229 6.155 4.039 1.00 0.00 H new ATOM 1619 N LEU A 106 12.245 4.306 2.001 1.00 0.00 N ATOM 1620 CA LEU A 106 12.466 3.214 1.058 1.00 0.00 C ATOM 1621 C LEU A 106 13.128 2.025 1.747 1.00 0.00 C ATOM 1622 O LEU A 106 13.031 0.892 1.279 1.00 0.00 O ATOM 1623 CB LEU A 106 13.332 3.689 -0.109 1.00 0.00 C ATOM 1624 CG LEU A 106 13.650 2.644 -1.178 1.00 0.00 C ATOM 1625 CD1 LEU A 106 12.448 2.425 -2.085 1.00 0.00 C ATOM 1626 CD2 LEU A 106 14.864 3.066 -1.993 1.00 0.00 C ATOM 0 H LEU A 106 12.842 5.120 1.851 1.00 0.00 H new ATOM 0 HA LEU A 106 11.496 2.895 0.676 1.00 0.00 H new ATOM 0 HB2 LEU A 106 12.830 4.529 -0.589 1.00 0.00 H new ATOM 0 HB3 LEU A 106 14.272 4.066 0.293 1.00 0.00 H new ATOM 0 HG LEU A 106 13.881 1.702 -0.680 1.00 0.00 H new ATOM 0 HD11 LEU A 106 12.693 1.678 -2.840 1.00 0.00 H new ATOM 0 HD12 LEU A 106 11.603 2.077 -1.491 1.00 0.00 H new ATOM 0 HD13 LEU A 106 12.186 3.363 -2.575 1.00 0.00 H new ATOM 0 HD21 LEU A 106 15.075 2.310 -2.749 1.00 0.00 H new ATOM 0 HD22 LEU A 106 14.661 4.020 -2.480 1.00 0.00 H new ATOM 0 HD23 LEU A 106 15.726 3.171 -1.334 1.00 0.00 H new ATOM 1638 N GLU A 107 13.799 2.293 2.863 1.00 0.00 N ATOM 1639 CA GLU A 107 14.476 1.245 3.617 1.00 0.00 C ATOM 1640 C GLU A 107 13.492 0.494 4.509 1.00 0.00 C ATOM 1641 O GLU A 107 13.584 -0.724 4.667 1.00 0.00 O ATOM 1642 CB GLU A 107 15.600 1.841 4.468 1.00 0.00 C ATOM 1643 CG GLU A 107 16.740 0.874 4.735 1.00 0.00 C ATOM 1644 CD GLU A 107 17.457 1.163 6.039 1.00 0.00 C ATOM 1645 OE1 GLU A 107 16.797 1.128 7.099 1.00 0.00 O ATOM 1646 OE2 GLU A 107 18.678 1.424 6.001 1.00 0.00 O ATOM 0 H GLU A 107 13.888 3.226 3.264 1.00 0.00 H new ATOM 0 HA GLU A 107 14.905 0.541 2.904 1.00 0.00 H new ATOM 0 HB2 GLU A 107 15.994 2.725 3.966 1.00 0.00 H new ATOM 0 HB3 GLU A 107 15.186 2.173 5.420 1.00 0.00 H new ATOM 0 HG2 GLU A 107 16.350 -0.144 4.757 1.00 0.00 H new ATOM 0 HG3 GLU A 107 17.454 0.924 3.913 1.00 0.00 H new ATOM 1653 N HIS A 108 12.550 1.230 5.092 1.00 0.00 N ATOM 1654 CA HIS A 108 11.548 0.635 5.968 1.00 0.00 C ATOM 1655 C HIS A 108 10.459 -0.060 5.156 1.00 0.00 C ATOM 1656 O HIS A 108 10.081 -1.195 5.448 1.00 0.00 O ATOM 1657 CB HIS A 108 10.926 1.704 6.867 1.00 0.00 C ATOM 1658 CG HIS A 108 11.836 2.170 7.961 1.00 0.00 C ATOM 1659 ND1 HIS A 108 12.333 3.455 8.032 1.00 0.00 N ATOM 1660 CD2 HIS A 108 12.338 1.515 9.034 1.00 0.00 C ATOM 1661 CE1 HIS A 108 13.102 3.569 9.099 1.00 0.00 C ATOM 1662 NE2 HIS A 108 13.122 2.406 9.725 1.00 0.00 N ATOM 0 H HIS A 108 12.460 2.239 4.973 1.00 0.00 H new ATOM 0 HA HIS A 108 12.043 -0.110 6.591 1.00 0.00 H new ATOM 0 HB2 HIS A 108 10.639 2.559 6.255 1.00 0.00 H new ATOM 0 HB3 HIS A 108 10.012 1.308 7.310 1.00 0.00 H new ATOM 0 HD1 HIS A 108 12.137 4.201 7.364 1.00 0.00 H new ATOM 0 HD2 HIS A 108 12.156 0.484 9.298 1.00 0.00 H new ATOM 0 HE1 HIS A 108 13.626 4.462 9.408 1.00 0.00 H new ATOM 1671 N LEU A 109 9.959 0.629 4.136 1.00 0.00 N ATOM 1672 CA LEU A 109 8.912 0.078 3.282 1.00 0.00 C ATOM 1673 C LEU A 109 9.304 -1.301 2.761 1.00 0.00 C ATOM 1674 O LEU A 109 8.472 -2.206 2.685 1.00 0.00 O ATOM 1675 CB LEU A 109 8.638 1.020 2.108 1.00 0.00 C ATOM 1676 CG LEU A 109 7.883 2.307 2.442 1.00 0.00 C ATOM 1677 CD1 LEU A 109 7.791 3.205 1.218 1.00 0.00 C ATOM 1678 CD2 LEU A 109 6.495 1.988 2.977 1.00 0.00 C ATOM 0 H LEU A 109 10.261 1.569 3.880 1.00 0.00 H new ATOM 0 HA LEU A 109 8.006 -0.024 3.879 1.00 0.00 H new ATOM 0 HB2 LEU A 109 9.592 1.289 1.654 1.00 0.00 H new ATOM 0 HB3 LEU A 109 8.070 0.474 1.355 1.00 0.00 H new ATOM 0 HG LEU A 109 8.436 2.839 3.217 1.00 0.00 H new ATOM 0 HD11 LEU A 109 7.250 4.116 1.475 1.00 0.00 H new ATOM 0 HD12 LEU A 109 8.795 3.462 0.879 1.00 0.00 H new ATOM 0 HD13 LEU A 109 7.262 2.682 0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 109 5.972 2.916 3.209 1.00 0.00 H new ATOM 0 HD22 LEU A 109 5.934 1.434 2.225 1.00 0.00 H new ATOM 0 HD23 LEU A 109 6.583 1.385 3.881 1.00 0.00 H new ATOM 1690 N SER A 110 10.575 -1.455 2.407 1.00 0.00 N ATOM 1691 CA SER A 110 11.077 -2.724 1.892 1.00 0.00 C ATOM 1692 C SER A 110 10.981 -3.817 2.953 1.00 0.00 C ATOM 1693 O SER A 110 10.562 -4.939 2.670 1.00 0.00 O ATOM 1694 CB SER A 110 12.527 -2.573 1.429 1.00 0.00 C ATOM 1695 OG SER A 110 13.315 -1.934 2.418 1.00 0.00 O ATOM 0 H SER A 110 11.277 -0.717 2.467 1.00 0.00 H new ATOM 0 HA SER A 110 10.460 -3.012 1.041 1.00 0.00 H new ATOM 0 HB2 SER A 110 12.945 -3.555 1.205 1.00 0.00 H new ATOM 0 HB3 SER A 110 12.559 -1.995 0.505 1.00 0.00 H new ATOM 0 HG SER A 110 12.736 -1.613 3.141 1.00 0.00 H new ATOM 1701 N LYS A 111 11.373 -3.480 4.177 1.00 0.00 N ATOM 1702 CA LYS A 111 11.332 -4.429 5.283 1.00 0.00 C ATOM 1703 C LYS A 111 9.895 -4.827 5.605 1.00 0.00 C ATOM 1704 O LYS A 111 9.654 -5.826 6.283 1.00 0.00 O ATOM 1705 CB LYS A 111 11.996 -3.828 6.524 1.00 0.00 C ATOM 1706 CG LYS A 111 13.508 -3.725 6.415 1.00 0.00 C ATOM 1707 CD LYS A 111 14.114 -3.094 7.657 1.00 0.00 C ATOM 1708 CE LYS A 111 14.335 -4.124 8.754 1.00 0.00 C ATOM 1709 NZ LYS A 111 15.432 -3.724 9.678 1.00 0.00 N ATOM 0 H LYS A 111 11.723 -2.555 4.428 1.00 0.00 H new ATOM 0 HA LYS A 111 11.880 -5.322 4.982 1.00 0.00 H new ATOM 0 HB2 LYS A 111 11.584 -2.834 6.701 1.00 0.00 H new ATOM 0 HB3 LYS A 111 11.743 -4.437 7.392 1.00 0.00 H new ATOM 0 HG2 LYS A 111 13.932 -4.718 6.267 1.00 0.00 H new ATOM 0 HG3 LYS A 111 13.771 -3.132 5.539 1.00 0.00 H new ATOM 0 HD2 LYS A 111 15.064 -2.624 7.401 1.00 0.00 H new ATOM 0 HD3 LYS A 111 13.457 -2.306 8.024 1.00 0.00 H new ATOM 0 HE2 LYS A 111 13.413 -4.255 9.320 1.00 0.00 H new ATOM 0 HE3 LYS A 111 14.572 -5.088 8.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 15.551 -4.452 10.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 16.318 -3.624 9.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 15.194 -2.816 10.127 1.00 0.00 H new ATOM 1723 N PHE A 112 8.944 -4.040 5.113 1.00 0.00 N ATOM 1724 CA PHE A 112 7.530 -4.311 5.348 1.00 0.00 C ATOM 1725 C PHE A 112 6.923 -5.082 4.180 1.00 0.00 C ATOM 1726 O PHE A 112 5.925 -5.787 4.340 1.00 0.00 O ATOM 1727 CB PHE A 112 6.767 -3.002 5.562 1.00 0.00 C ATOM 1728 CG PHE A 112 5.282 -3.138 5.385 1.00 0.00 C ATOM 1729 CD1 PHE A 112 4.725 -3.208 4.118 1.00 0.00 C ATOM 1730 CD2 PHE A 112 4.443 -3.198 6.486 1.00 0.00 C ATOM 1731 CE1 PHE A 112 3.358 -3.332 3.953 1.00 0.00 C ATOM 1732 CE2 PHE A 112 3.075 -3.323 6.327 1.00 0.00 C ATOM 1733 CZ PHE A 112 2.533 -3.391 5.059 1.00 0.00 C ATOM 0 H PHE A 112 9.126 -3.210 4.549 1.00 0.00 H new ATOM 0 HA PHE A 112 7.447 -4.923 6.246 1.00 0.00 H new ATOM 0 HB2 PHE A 112 6.973 -2.631 6.566 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.141 -2.254 4.863 1.00 0.00 H new ATOM 0 HD1 PHE A 112 5.366 -3.165 3.250 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.862 -3.147 7.480 1.00 0.00 H new ATOM 0 HE1 PHE A 112 2.936 -3.383 2.960 1.00 0.00 H new ATOM 0 HE2 PHE A 112 2.432 -3.367 7.193 1.00 0.00 H new ATOM 0 HZ PHE A 112 1.465 -3.490 4.932 1.00 0.00 H new ATOM 1743 N ILE A 113 7.530 -4.943 3.007 1.00 0.00 N ATOM 1744 CA ILE A 113 7.050 -5.626 1.813 1.00 0.00 C ATOM 1745 C ILE A 113 7.559 -7.063 1.760 1.00 0.00 C ATOM 1746 O ILE A 113 6.786 -8.012 1.894 1.00 0.00 O ATOM 1747 CB ILE A 113 7.485 -4.892 0.531 1.00 0.00 C ATOM 1748 CG1 ILE A 113 6.766 -3.546 0.419 1.00 0.00 C ATOM 1749 CG2 ILE A 113 7.204 -5.752 -0.693 1.00 0.00 C ATOM 1750 CD1 ILE A 113 7.316 -2.656 -0.673 1.00 0.00 C ATOM 0 H ILE A 113 8.356 -4.363 2.858 1.00 0.00 H new ATOM 0 HA ILE A 113 5.961 -5.630 1.868 1.00 0.00 H new ATOM 0 HB ILE A 113 8.558 -4.707 0.582 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.707 -3.724 0.233 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.839 -3.024 1.373 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.517 -5.220 -1.591 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.757 -6.688 -0.615 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.137 -5.965 -0.751 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.759 -1.719 -0.694 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.368 -2.448 -0.477 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.218 -3.158 -1.635 1.00 0.00 H new ATOM 1762 N ASP A 114 8.864 -7.216 1.565 1.00 0.00 N ATOM 1763 CA ASP A 114 9.478 -8.537 1.497 1.00 0.00 C ATOM 1764 C ASP A 114 8.757 -9.519 2.415 1.00 0.00 C ATOM 1765 O ASP A 114 8.382 -10.613 1.997 1.00 0.00 O ATOM 1766 CB ASP A 114 10.957 -8.456 1.877 1.00 0.00 C ATOM 1767 CG ASP A 114 11.820 -7.945 0.740 1.00 0.00 C ATOM 1768 OD1 ASP A 114 11.523 -8.279 -0.426 1.00 0.00 O ATOM 1769 OD2 ASP A 114 12.791 -7.210 1.017 1.00 0.00 O ATOM 0 H ASP A 114 9.518 -6.441 1.451 1.00 0.00 H new ATOM 0 HA ASP A 114 9.394 -8.897 0.472 1.00 0.00 H new ATOM 0 HB2 ASP A 114 11.072 -7.800 2.740 1.00 0.00 H new ATOM 0 HB3 ASP A 114 11.306 -9.443 2.179 1.00 0.00 H new ATOM 1774 N GLU A 115 8.567 -9.119 3.669 1.00 0.00 N ATOM 1775 CA GLU A 115 7.892 -9.965 4.646 1.00 0.00 C ATOM 1776 C GLU A 115 6.627 -10.579 4.053 1.00 0.00 C ATOM 1777 O GLU A 115 6.536 -11.795 3.881 1.00 0.00 O ATOM 1778 CB GLU A 115 7.542 -9.157 5.897 1.00 0.00 C ATOM 1779 CG GLU A 115 8.629 -9.177 6.959 1.00 0.00 C ATOM 1780 CD GLU A 115 8.249 -8.388 8.197 1.00 0.00 C ATOM 1781 OE1 GLU A 115 7.416 -7.466 8.080 1.00 0.00 O ATOM 1782 OE2 GLU A 115 8.786 -8.693 9.283 1.00 0.00 O ATOM 0 H GLU A 115 8.871 -8.215 4.031 1.00 0.00 H new ATOM 0 HA GLU A 115 8.571 -10.772 4.921 1.00 0.00 H new ATOM 0 HB2 GLU A 115 7.346 -8.124 5.609 1.00 0.00 H new ATOM 0 HB3 GLU A 115 6.620 -9.549 6.326 1.00 0.00 H new ATOM 0 HG2 GLU A 115 8.838 -10.209 7.240 1.00 0.00 H new ATOM 0 HG3 GLU A 115 9.549 -8.768 6.540 1.00 0.00 H new ATOM 1789 N HIS A 116 5.653 -9.729 3.743 1.00 0.00 N ATOM 1790 CA HIS A 116 4.393 -10.188 3.169 1.00 0.00 C ATOM 1791 C HIS A 116 4.625 -10.873 1.826 1.00 0.00 C ATOM 1792 O HIS A 116 4.044 -11.921 1.545 1.00 0.00 O ATOM 1793 CB HIS A 116 3.430 -9.013 2.996 1.00 0.00 C ATOM 1794 CG HIS A 116 3.015 -8.382 4.289 1.00 0.00 C ATOM 1795 ND1 HIS A 116 3.365 -7.097 4.646 1.00 0.00 N ATOM 1796 CD2 HIS A 116 2.275 -8.867 5.313 1.00 0.00 C ATOM 1797 CE1 HIS A 116 2.858 -6.819 5.834 1.00 0.00 C ATOM 1798 NE2 HIS A 116 2.192 -7.877 6.260 1.00 0.00 N ATOM 0 H HIS A 116 5.712 -8.720 3.879 1.00 0.00 H new ATOM 0 HA HIS A 116 3.952 -10.912 3.854 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.901 -8.257 2.368 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.541 -9.358 2.468 1.00 0.00 H new ATOM 0 HD1 HIS A 116 3.927 -6.461 4.081 1.00 0.00 H new ATOM 0 HD2 HIS A 116 1.832 -9.850 5.374 1.00 0.00 H new ATOM 0 HE1 HIS A 116 2.969 -5.886 6.366 1.00 0.00 H new ATOM 1807 N ALA A 117 5.477 -10.274 1.000 1.00 0.00 N ATOM 1808 CA ALA A 117 5.786 -10.827 -0.312 1.00 0.00 C ATOM 1809 C ALA A 117 6.058 -12.325 -0.226 1.00 0.00 C ATOM 1810 O ALA A 117 6.274 -12.867 0.859 1.00 0.00 O ATOM 1811 CB ALA A 117 6.980 -10.106 -0.921 1.00 0.00 C ATOM 0 H ALA A 117 5.965 -9.405 1.217 1.00 0.00 H new ATOM 0 HA ALA A 117 4.919 -10.678 -0.955 1.00 0.00 H new ATOM 0 HB1 ALA A 117 7.200 -10.530 -1.901 1.00 0.00 H new ATOM 0 HB2 ALA A 117 6.750 -9.046 -1.027 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.847 -10.225 -0.272 1.00 0.00 H new ATOM 1817 N THR A 118 6.046 -12.991 -1.377 1.00 0.00 N ATOM 1818 CA THR A 118 6.289 -14.427 -1.431 1.00 0.00 C ATOM 1819 C THR A 118 7.363 -14.764 -2.459 1.00 0.00 C ATOM 1820 O THR A 118 7.292 -15.793 -3.132 1.00 0.00 O ATOM 1821 CB THR A 118 5.003 -15.202 -1.776 1.00 0.00 C ATOM 1822 OG1 THR A 118 3.982 -14.908 -0.816 1.00 0.00 O ATOM 1823 CG2 THR A 118 5.265 -16.701 -1.802 1.00 0.00 C ATOM 0 H THR A 118 5.871 -12.558 -2.284 1.00 0.00 H new ATOM 0 HA THR A 118 6.631 -14.727 -0.440 1.00 0.00 H new ATOM 0 HB THR A 118 4.671 -14.890 -2.766 1.00 0.00 H new ATOM 0 HG1 THR A 118 3.167 -15.403 -1.043 1.00 0.00 H new ATOM 0 HG21 THR A 118 4.343 -17.227 -2.048 1.00 0.00 H new ATOM 0 HG22 THR A 118 6.022 -16.925 -2.554 1.00 0.00 H new ATOM 0 HG23 THR A 118 5.618 -17.026 -0.823 1.00 0.00 H new ATOM 1831 N LYS A 119 8.359 -13.892 -2.575 1.00 0.00 N ATOM 1832 CA LYS A 119 9.450 -14.098 -3.520 1.00 0.00 C ATOM 1833 C LYS A 119 10.563 -14.931 -2.892 1.00 0.00 C ATOM 1834 O LYS A 119 11.691 -14.950 -3.386 1.00 0.00 O ATOM 1835 CB LYS A 119 10.008 -12.751 -3.986 1.00 0.00 C ATOM 1836 CG LYS A 119 10.706 -12.816 -5.334 1.00 0.00 C ATOM 1837 CD LYS A 119 11.811 -11.779 -5.441 1.00 0.00 C ATOM 1838 CE LYS A 119 12.421 -11.756 -6.834 1.00 0.00 C ATOM 1839 NZ LYS A 119 13.401 -12.860 -7.028 1.00 0.00 N ATOM 0 H LYS A 119 8.433 -13.036 -2.026 1.00 0.00 H new ATOM 0 HA LYS A 119 9.056 -14.639 -4.380 1.00 0.00 H new ATOM 0 HB2 LYS A 119 9.193 -12.029 -4.043 1.00 0.00 H new ATOM 0 HB3 LYS A 119 10.711 -12.380 -3.240 1.00 0.00 H new ATOM 0 HG2 LYS A 119 11.125 -13.812 -5.480 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.978 -12.657 -6.130 1.00 0.00 H new ATOM 0 HD2 LYS A 119 11.411 -10.794 -5.202 1.00 0.00 H new ATOM 0 HD3 LYS A 119 12.587 -11.995 -4.706 1.00 0.00 H new ATOM 0 HE2 LYS A 119 11.629 -11.838 -7.579 1.00 0.00 H new ATOM 0 HE3 LYS A 119 12.915 -10.798 -6.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 13.794 -12.810 -7.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 14.170 -12.768 -6.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 12.924 -13.775 -6.896 1.00 0.00 H new ATOM 1853 N ARG A 120 10.238 -15.620 -1.803 1.00 0.00 N ATOM 1854 CA ARG A 120 11.211 -16.455 -1.109 1.00 0.00 C ATOM 1855 C ARG A 120 10.885 -17.935 -1.293 1.00 0.00 C ATOM 1856 O ARG A 120 9.848 -18.288 -1.854 1.00 0.00 O ATOM 1857 CB ARG A 120 11.241 -16.110 0.381 1.00 0.00 C ATOM 1858 CG ARG A 120 10.283 -16.942 1.218 1.00 0.00 C ATOM 1859 CD ARG A 120 9.757 -16.155 2.408 1.00 0.00 C ATOM 1860 NE ARG A 120 8.707 -16.878 3.121 1.00 0.00 N ATOM 1861 CZ ARG A 120 8.938 -17.928 3.901 1.00 0.00 C ATOM 1862 NH1 ARG A 120 10.175 -18.375 4.068 1.00 0.00 N ATOM 1863 NH2 ARG A 120 7.930 -18.533 4.517 1.00 0.00 N ATOM 0 H ARG A 120 9.309 -15.616 -1.382 1.00 0.00 H new ATOM 0 HA ARG A 120 12.193 -16.260 -1.539 1.00 0.00 H new ATOM 0 HB2 ARG A 120 12.254 -16.250 0.757 1.00 0.00 H new ATOM 0 HB3 ARG A 120 10.997 -15.055 0.506 1.00 0.00 H new ATOM 0 HG2 ARG A 120 9.448 -17.270 0.599 1.00 0.00 H new ATOM 0 HG3 ARG A 120 10.791 -17.840 1.570 1.00 0.00 H new ATOM 0 HD2 ARG A 120 10.578 -15.940 3.092 1.00 0.00 H new ATOM 0 HD3 ARG A 120 9.368 -15.196 2.065 1.00 0.00 H new ATOM 0 HE ARG A 120 7.744 -16.559 3.014 1.00 0.00 H new ATOM 0 HH11 ARG A 120 10.952 -17.912 3.597 1.00 0.00 H new ATOM 0 HH12 ARG A 120 10.349 -19.182 4.668 1.00 0.00 H new ATOM 0 HH21 ARG A 120 6.977 -18.192 4.392 1.00 0.00 H new ATOM 0 HH22 ARG A 120 8.108 -19.339 5.116 1.00 0.00 H new ATOM 1877 N SER A 121 11.779 -18.796 -0.816 1.00 0.00 N ATOM 1878 CA SER A 121 11.589 -20.237 -0.931 1.00 0.00 C ATOM 1879 C SER A 121 10.116 -20.604 -0.787 1.00 0.00 C ATOM 1880 O SER A 121 9.380 -19.978 -0.024 1.00 0.00 O ATOM 1881 CB SER A 121 12.415 -20.968 0.130 1.00 0.00 C ATOM 1882 OG SER A 121 12.112 -20.490 1.429 1.00 0.00 O ATOM 0 H SER A 121 12.642 -18.520 -0.346 1.00 0.00 H new ATOM 0 HA SER A 121 11.927 -20.545 -1.920 1.00 0.00 H new ATOM 0 HB2 SER A 121 12.216 -22.038 0.077 1.00 0.00 H new ATOM 0 HB3 SER A 121 13.477 -20.831 -0.073 1.00 0.00 H new ATOM 0 HG SER A 121 12.651 -20.973 2.089 1.00 0.00 H new ATOM 1888 N ARG A 122 9.692 -21.624 -1.527 1.00 0.00 N ATOM 1889 CA ARG A 122 8.306 -22.074 -1.484 1.00 0.00 C ATOM 1890 C ARG A 122 8.232 -23.586 -1.288 1.00 0.00 C ATOM 1891 O ARG A 122 9.256 -24.267 -1.233 1.00 0.00 O ATOM 1892 CB ARG A 122 7.578 -21.679 -2.770 1.00 0.00 C ATOM 1893 CG ARG A 122 7.614 -20.187 -3.057 1.00 0.00 C ATOM 1894 CD ARG A 122 6.952 -19.859 -4.386 1.00 0.00 C ATOM 1895 NE ARG A 122 7.491 -18.638 -4.979 1.00 0.00 N ATOM 1896 CZ ARG A 122 8.684 -18.568 -5.559 1.00 0.00 C ATOM 1897 NH1 ARG A 122 9.458 -19.643 -5.623 1.00 0.00 N ATOM 1898 NH2 ARG A 122 9.104 -17.421 -6.077 1.00 0.00 N ATOM 0 H ARG A 122 10.288 -22.154 -2.163 1.00 0.00 H new ATOM 0 HA ARG A 122 7.819 -21.590 -0.637 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.025 -22.213 -3.609 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.539 -22.003 -2.703 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.109 -19.649 -2.255 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.648 -19.843 -3.070 1.00 0.00 H new ATOM 0 HD2 ARG A 122 7.093 -20.690 -5.076 1.00 0.00 H new ATOM 0 HD3 ARG A 122 5.878 -19.747 -4.238 1.00 0.00 H new ATOM 0 HE ARG A 122 6.920 -17.793 -4.946 1.00 0.00 H new ATOM 0 HH11 ARG A 122 9.138 -20.526 -5.226 1.00 0.00 H new ATOM 0 HH12 ARG A 122 10.374 -19.586 -6.069 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.511 -16.593 -6.030 1.00 0.00 H new ATOM 0 HH22 ARG A 122 10.020 -17.368 -6.522 1.00 0.00 H new ATOM 1912 N THR A 123 7.012 -24.105 -1.183 1.00 0.00 N ATOM 1913 CA THR A 123 6.804 -25.534 -0.992 1.00 0.00 C ATOM 1914 C THR A 123 6.651 -26.251 -2.328 1.00 0.00 C ATOM 1915 O THR A 123 5.840 -25.858 -3.167 1.00 0.00 O ATOM 1916 CB THR A 123 5.558 -25.810 -0.129 1.00 0.00 C ATOM 1917 OG1 THR A 123 5.433 -27.215 0.117 1.00 0.00 O ATOM 1918 CG2 THR A 123 4.300 -25.297 -0.815 1.00 0.00 C ATOM 0 H THR A 123 6.153 -23.556 -1.227 1.00 0.00 H new ATOM 0 HA THR A 123 7.686 -25.915 -0.477 1.00 0.00 H new ATOM 0 HB THR A 123 5.677 -25.285 0.819 1.00 0.00 H new ATOM 0 HG1 THR A 123 4.640 -27.381 0.668 1.00 0.00 H new ATOM 0 HG21 THR A 123 3.433 -25.503 -0.187 1.00 0.00 H new ATOM 0 HG22 THR A 123 4.385 -24.222 -0.975 1.00 0.00 H new ATOM 0 HG23 THR A 123 4.179 -25.798 -1.776 1.00 0.00 H new ATOM 1926 N LYS A 124 7.435 -27.307 -2.521 1.00 0.00 N ATOM 1927 CA LYS A 124 7.387 -28.081 -3.755 1.00 0.00 C ATOM 1928 C LYS A 124 7.806 -27.229 -4.949 1.00 0.00 C ATOM 1929 O LYS A 124 7.133 -27.216 -5.979 1.00 0.00 O ATOM 1930 CB LYS A 124 5.977 -28.634 -3.980 1.00 0.00 C ATOM 1931 CG LYS A 124 5.939 -29.853 -4.885 1.00 0.00 C ATOM 1932 CD LYS A 124 4.514 -30.314 -5.139 1.00 0.00 C ATOM 1933 CE LYS A 124 3.875 -29.544 -6.285 1.00 0.00 C ATOM 1934 NZ LYS A 124 4.247 -30.113 -7.610 1.00 0.00 N ATOM 0 H LYS A 124 8.112 -27.646 -1.837 1.00 0.00 H new ATOM 0 HA LYS A 124 8.086 -28.912 -3.660 1.00 0.00 H new ATOM 0 HB2 LYS A 124 5.540 -28.894 -3.016 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.354 -27.851 -4.412 1.00 0.00 H new ATOM 0 HG2 LYS A 124 6.421 -29.618 -5.834 1.00 0.00 H new ATOM 0 HG3 LYS A 124 6.509 -30.663 -4.430 1.00 0.00 H new ATOM 0 HD2 LYS A 124 4.511 -31.380 -5.369 1.00 0.00 H new ATOM 0 HD3 LYS A 124 3.921 -30.181 -4.234 1.00 0.00 H new ATOM 0 HE2 LYS A 124 2.791 -29.561 -6.174 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.184 -28.500 -6.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 3.792 -29.561 -8.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 5.280 -30.074 -7.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 3.929 -31.102 -7.665 1.00 0.00 H new ATOM 1948 N GLU A 125 8.922 -26.521 -4.803 1.00 0.00 N ATOM 1949 CA GLU A 125 9.430 -25.668 -5.870 1.00 0.00 C ATOM 1950 C GLU A 125 10.801 -26.143 -6.341 1.00 0.00 C ATOM 1951 O GLU A 125 11.539 -26.780 -5.590 1.00 0.00 O ATOM 1952 CB GLU A 125 9.516 -24.216 -5.395 1.00 0.00 C ATOM 1953 CG GLU A 125 9.689 -23.215 -6.525 1.00 0.00 C ATOM 1954 CD GLU A 125 8.419 -23.018 -7.330 1.00 0.00 C ATOM 1955 OE1 GLU A 125 7.586 -23.948 -7.361 1.00 0.00 O ATOM 1956 OE2 GLU A 125 8.259 -21.934 -7.928 1.00 0.00 O ATOM 0 H GLU A 125 9.491 -26.522 -3.956 1.00 0.00 H new ATOM 0 HA GLU A 125 8.737 -25.728 -6.709 1.00 0.00 H new ATOM 0 HB2 GLU A 125 8.611 -23.970 -4.839 1.00 0.00 H new ATOM 0 HB3 GLU A 125 10.352 -24.118 -4.703 1.00 0.00 H new ATOM 0 HG2 GLU A 125 10.005 -22.257 -6.112 1.00 0.00 H new ATOM 0 HG3 GLU A 125 10.485 -23.554 -7.187 1.00 0.00 H new ATOM 1963 N GLU A 126 11.133 -25.829 -7.589 1.00 0.00 N ATOM 1964 CA GLU A 126 12.415 -26.226 -8.160 1.00 0.00 C ATOM 1965 C GLU A 126 13.162 -25.016 -8.713 1.00 0.00 C ATOM 1966 O GLU A 126 12.606 -23.921 -8.814 1.00 0.00 O ATOM 1967 CB GLU A 126 12.207 -27.260 -9.269 1.00 0.00 C ATOM 1968 CG GLU A 126 11.788 -28.627 -8.755 1.00 0.00 C ATOM 1969 CD GLU A 126 10.285 -28.760 -8.607 1.00 0.00 C ATOM 1970 OE1 GLU A 126 9.621 -29.123 -9.600 1.00 0.00 O ATOM 1971 OE2 GLU A 126 9.773 -28.500 -7.498 1.00 0.00 O ATOM 0 H GLU A 126 10.533 -25.302 -8.223 1.00 0.00 H new ATOM 0 HA GLU A 126 13.015 -26.671 -7.366 1.00 0.00 H new ATOM 0 HB2 GLU A 126 11.448 -26.892 -9.959 1.00 0.00 H new ATOM 0 HB3 GLU A 126 13.132 -27.362 -9.837 1.00 0.00 H new ATOM 0 HG2 GLU A 126 12.151 -29.395 -9.438 1.00 0.00 H new ATOM 0 HG3 GLU A 126 12.262 -28.809 -7.790 1.00 0.00 H new ATOM 1978 N LEU A 127 14.426 -25.220 -9.069 1.00 0.00 N ATOM 1979 CA LEU A 127 15.251 -24.146 -9.612 1.00 0.00 C ATOM 1980 C LEU A 127 15.197 -24.135 -11.136 1.00 0.00 C ATOM 1981 O LEU A 127 16.219 -23.965 -11.802 1.00 0.00 O ATOM 1982 CB LEU A 127 16.698 -24.301 -9.142 1.00 0.00 C ATOM 1983 CG LEU A 127 17.053 -23.615 -7.822 1.00 0.00 C ATOM 1984 CD1 LEU A 127 16.834 -22.114 -7.925 1.00 0.00 C ATOM 1985 CD2 LEU A 127 16.233 -24.198 -6.680 1.00 0.00 C ATOM 0 H LEU A 127 14.902 -26.119 -8.991 1.00 0.00 H new ATOM 0 HA LEU A 127 14.857 -23.198 -9.247 1.00 0.00 H new ATOM 0 HB2 LEU A 127 16.915 -25.365 -9.045 1.00 0.00 H new ATOM 0 HB3 LEU A 127 17.355 -23.911 -9.919 1.00 0.00 H new ATOM 0 HG LEU A 127 18.108 -23.794 -7.614 1.00 0.00 H new ATOM 0 HD11 LEU A 127 17.092 -21.643 -6.977 1.00 0.00 H new ATOM 0 HD12 LEU A 127 17.465 -21.708 -8.715 1.00 0.00 H new ATOM 0 HD13 LEU A 127 15.788 -21.914 -8.157 1.00 0.00 H new ATOM 0 HD21 LEU A 127 16.499 -23.698 -5.749 1.00 0.00 H new ATOM 0 HD22 LEU A 127 15.172 -24.050 -6.881 1.00 0.00 H new ATOM 0 HD23 LEU A 127 16.440 -25.264 -6.591 1.00 0.00 H new ATOM 1997 N SER A 128 13.999 -24.315 -11.682 1.00 0.00 N ATOM 1998 CA SER A 128 13.813 -24.327 -13.128 1.00 0.00 C ATOM 1999 C SER A 128 14.929 -25.110 -13.814 1.00 0.00 C ATOM 2000 O SER A 128 15.467 -24.681 -14.833 1.00 0.00 O ATOM 2001 CB SER A 128 13.769 -22.897 -13.671 1.00 0.00 C ATOM 2002 OG SER A 128 15.060 -22.312 -13.668 1.00 0.00 O ATOM 0 H SER A 128 13.143 -24.454 -11.145 1.00 0.00 H new ATOM 0 HA SER A 128 12.864 -24.818 -13.342 1.00 0.00 H new ATOM 0 HB2 SER A 128 13.370 -22.902 -14.686 1.00 0.00 H new ATOM 0 HB3 SER A 128 13.092 -22.295 -13.065 1.00 0.00 H new ATOM 0 HG SER A 128 15.625 -22.769 -13.010 1.00 0.00 H new ATOM 2008 N GLY A 129 15.272 -26.261 -13.244 1.00 0.00 N ATOM 2009 CA GLY A 129 16.322 -27.086 -13.812 1.00 0.00 C ATOM 2010 C GLY A 129 17.624 -26.329 -13.986 1.00 0.00 C ATOM 2011 O GLY A 129 17.962 -25.876 -15.079 1.00 0.00 O ATOM 0 H GLY A 129 14.842 -26.637 -12.399 1.00 0.00 H new ATOM 0 HA2 GLY A 129 16.490 -27.949 -13.168 1.00 0.00 H new ATOM 0 HA3 GLY A 129 15.996 -27.469 -14.779 1.00 0.00 H new ATOM 2015 N PRO A 130 18.378 -26.182 -12.887 1.00 0.00 N ATOM 2016 CA PRO A 130 19.661 -25.474 -12.897 1.00 0.00 C ATOM 2017 C PRO A 130 20.741 -26.240 -13.654 1.00 0.00 C ATOM 2018 O PRO A 130 21.798 -25.694 -13.968 1.00 0.00 O ATOM 2019 CB PRO A 130 20.021 -25.371 -11.412 1.00 0.00 C ATOM 2020 CG PRO A 130 19.309 -26.510 -10.770 1.00 0.00 C ATOM 2021 CD PRO A 130 18.037 -26.697 -11.550 1.00 0.00 C ATOM 0 HA PRO A 130 19.590 -24.510 -13.401 1.00 0.00 H new ATOM 0 HB2 PRO A 130 21.098 -25.441 -11.260 1.00 0.00 H new ATOM 0 HB3 PRO A 130 19.701 -24.417 -10.992 1.00 0.00 H new ATOM 0 HG2 PRO A 130 19.918 -27.414 -10.794 1.00 0.00 H new ATOM 0 HG3 PRO A 130 19.096 -26.297 -9.722 1.00 0.00 H new ATOM 0 HD2 PRO A 130 17.739 -27.745 -11.587 1.00 0.00 H new ATOM 0 HD3 PRO A 130 17.209 -26.145 -11.106 1.00 0.00 H new ATOM 2029 N SER A 131 20.467 -27.508 -13.944 1.00 0.00 N ATOM 2030 CA SER A 131 21.416 -28.350 -14.662 1.00 0.00 C ATOM 2031 C SER A 131 21.706 -27.782 -16.048 1.00 0.00 C ATOM 2032 O SER A 131 22.862 -27.680 -16.460 1.00 0.00 O ATOM 2033 CB SER A 131 20.874 -29.775 -14.786 1.00 0.00 C ATOM 2034 OG SER A 131 20.624 -30.338 -13.510 1.00 0.00 O ATOM 0 H SER A 131 19.595 -27.975 -13.693 1.00 0.00 H new ATOM 0 HA SER A 131 22.347 -28.371 -14.095 1.00 0.00 H new ATOM 0 HB2 SER A 131 19.954 -29.768 -15.370 1.00 0.00 H new ATOM 0 HB3 SER A 131 21.590 -30.394 -15.326 1.00 0.00 H new ATOM 0 HG SER A 131 20.277 -31.248 -13.616 1.00 0.00 H new ATOM 2040 N SER A 132 20.648 -27.414 -16.763 1.00 0.00 N ATOM 2041 CA SER A 132 20.787 -26.859 -18.105 1.00 0.00 C ATOM 2042 C SER A 132 19.514 -26.132 -18.527 1.00 0.00 C ATOM 2043 O SER A 132 18.421 -26.448 -18.059 1.00 0.00 O ATOM 2044 CB SER A 132 21.110 -27.969 -19.107 1.00 0.00 C ATOM 2045 OG SER A 132 21.413 -27.432 -20.383 1.00 0.00 O ATOM 0 H SER A 132 19.685 -27.490 -16.436 1.00 0.00 H new ATOM 0 HA SER A 132 21.607 -26.141 -18.092 1.00 0.00 H new ATOM 0 HB2 SER A 132 21.955 -28.555 -18.746 1.00 0.00 H new ATOM 0 HB3 SER A 132 20.262 -28.649 -19.187 1.00 0.00 H new ATOM 0 HG SER A 132 21.617 -28.161 -21.005 1.00 0.00 H new ATOM 2051 N GLY A 133 19.666 -25.154 -19.415 1.00 0.00 N ATOM 2052 CA GLY A 133 18.521 -24.395 -19.885 1.00 0.00 C ATOM 2053 C GLY A 133 18.696 -22.902 -19.692 1.00 0.00 C ATOM 2054 O GLY A 133 19.820 -22.400 -19.668 1.00 0.00 O ATOM 0 H GLY A 133 20.561 -24.874 -19.817 1.00 0.00 H new ATOM 0 HA2 GLY A 133 18.359 -24.605 -20.942 1.00 0.00 H new ATOM 0 HA3 GLY A 133 17.628 -24.725 -19.354 1.00 0.00 H new TER 2058 GLY A 133