USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 902 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 53 THR OG1 : rot 78:sc= 0.0693 USER MOD Set 1.2: A 107 LYS NZ :NH3+ -106:sc= -0.963 (180deg=-4.05!) USER MOD Set 2.1: A 27 ASN : amide:sc= -0.511 X(o=-2,f=-1.9) USER MOD Set 2.2: A 59 ASN : amide:sc= -1.53 X(o=-2,f=-1.9) 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= -0.0703 USER MOD Single : A 6 SER OG : rot 60:sc= 0.54 USER MOD Single : A 10 LYS NZ :NH3+ 171:sc= -9.64! (180deg=-9.78!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -6.11! C(o=-6.1!,f=-7.4!) USER MOD Single : A 25 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.0878) USER MOD Single : A 26 LYS NZ :NH3+ 163:sc= 0.219 (180deg=0.0885) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 CYS SG : rot -150:sc= -1.45 USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 40 CYS SG : rot 148:sc= -0.904 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= -0.113 K(o=-0.11,f=-2.2!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= -0.284 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc= -3.19 K(o=-3.2,f=-7.9!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 MET CE :methyl -160:sc= -0.0965 (180deg=-0.792) USER MOD Single : A 67 SER OG : rot -140:sc= 0 USER MOD Single : A 68 THR OG1 : rot -63:sc= -0.489 USER MOD Single : A 70 ASN : amide:sc= -1.46 X(o=-1.5,f=-1.7) USER MOD Single : A 76 LYS NZ :NH3+ -148:sc= -1.9! (180deg=-2.83!) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 102:sc= 0.778 USER MOD Single : A 84 LYS NZ :NH3+ -148:sc= 1.22 (180deg=1.04) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot -89:sc= 1.35 USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot -152:sc= 1.39 USER MOD Single : A 108 LYS NZ :NH3+ -121:sc= -1.29! (180deg=-3.4!) USER MOD Single : A 112 SER OG : rot 74:sc= 1.07 USER MOD Single : A 115 GLN : amide:sc= -0.282 X(o=-0.28,f=-0.33) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 12:sc= 0.94 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.717 -28.697 6.353 1.00 0.00 N ATOM 2 CA GLY A 1 -11.143 -28.694 6.084 1.00 0.00 C ATOM 3 C GLY A 1 -11.624 -27.371 5.523 1.00 0.00 C ATOM 4 O GLY A 1 -11.839 -27.242 4.318 1.00 0.00 O ATOM 0 H1 GLY A 1 -9.438 -29.623 6.735 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.197 -28.515 5.471 1.00 0.00 H new ATOM 0 H3 GLY A 1 -9.493 -27.955 7.046 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -11.378 -29.491 5.379 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.684 -28.913 7.005 1.00 0.00 H new ATOM 8 N SER A 2 -11.796 -26.385 6.398 1.00 0.00 N ATOM 9 CA SER A 2 -12.261 -25.067 5.983 1.00 0.00 C ATOM 10 C SER A 2 -11.278 -24.426 5.008 1.00 0.00 C ATOM 11 O SER A 2 -10.177 -24.934 4.796 1.00 0.00 O ATOM 12 CB SER A 2 -12.450 -24.162 7.203 1.00 0.00 C ATOM 13 OG SER A 2 -13.649 -24.476 7.889 1.00 0.00 O ATOM 0 H SER A 2 -11.620 -26.474 7.399 1.00 0.00 H new ATOM 0 HA SER A 2 -13.219 -25.189 5.478 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.601 -24.274 7.878 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.471 -23.119 6.887 1.00 0.00 H new ATOM 0 HG SER A 2 -13.746 -23.886 8.665 1.00 0.00 H new ATOM 19 N SER A 3 -11.684 -23.307 4.418 1.00 0.00 N ATOM 20 CA SER A 3 -10.842 -22.597 3.462 1.00 0.00 C ATOM 21 C SER A 3 -11.412 -21.215 3.157 1.00 0.00 C ATOM 22 O SER A 3 -12.601 -20.965 3.352 1.00 0.00 O ATOM 23 CB SER A 3 -10.710 -23.404 2.169 1.00 0.00 C ATOM 24 OG SER A 3 -9.479 -23.134 1.522 1.00 0.00 O ATOM 0 H SER A 3 -12.591 -22.872 4.585 1.00 0.00 H new ATOM 0 HA SER A 3 -9.855 -22.473 3.907 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.781 -24.469 2.392 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.536 -23.163 1.500 1.00 0.00 H new ATOM 0 HG SER A 3 -9.419 -23.663 0.700 1.00 0.00 H new ATOM 30 N GLY A 4 -10.554 -20.321 2.675 1.00 0.00 N ATOM 31 CA GLY A 4 -10.989 -18.975 2.350 1.00 0.00 C ATOM 32 C GLY A 4 -9.877 -18.134 1.756 1.00 0.00 C ATOM 33 O GLY A 4 -9.562 -17.059 2.268 1.00 0.00 O ATOM 0 H GLY A 4 -9.565 -20.505 2.504 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.819 -19.025 1.645 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.365 -18.490 3.251 1.00 0.00 H new ATOM 37 N SER A 5 -9.280 -18.623 0.674 1.00 0.00 N ATOM 38 CA SER A 5 -8.192 -17.911 0.014 1.00 0.00 C ATOM 39 C SER A 5 -8.519 -16.427 -0.124 1.00 0.00 C ATOM 40 O SER A 5 -7.684 -15.568 0.157 1.00 0.00 O ATOM 41 CB SER A 5 -7.922 -18.516 -1.366 1.00 0.00 C ATOM 42 OG SER A 5 -9.043 -18.361 -2.219 1.00 0.00 O ATOM 0 H SER A 5 -9.531 -19.509 0.236 1.00 0.00 H new ATOM 0 HA SER A 5 -7.298 -18.013 0.629 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.052 -18.036 -1.813 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.684 -19.575 -1.262 1.00 0.00 H new ATOM 0 HG SER A 5 -8.845 -18.754 -3.095 1.00 0.00 H new ATOM 48 N SER A 6 -9.740 -16.135 -0.560 1.00 0.00 N ATOM 49 CA SER A 6 -10.178 -14.756 -0.739 1.00 0.00 C ATOM 50 C SER A 6 -9.064 -13.907 -1.346 1.00 0.00 C ATOM 51 O SER A 6 -8.816 -12.784 -0.909 1.00 0.00 O ATOM 52 CB SER A 6 -10.618 -14.159 0.599 1.00 0.00 C ATOM 53 OG SER A 6 -9.500 -13.865 1.418 1.00 0.00 O ATOM 0 H SER A 6 -10.443 -16.835 -0.796 1.00 0.00 H new ATOM 0 HA SER A 6 -11.026 -14.757 -1.424 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.193 -13.250 0.424 1.00 0.00 H new ATOM 0 HB3 SER A 6 -11.276 -14.859 1.114 1.00 0.00 H new ATOM 0 HG SER A 6 -8.917 -13.226 0.958 1.00 0.00 H new ATOM 59 N GLY A 7 -8.396 -14.454 -2.357 1.00 0.00 N ATOM 60 CA GLY A 7 -7.317 -13.734 -3.008 1.00 0.00 C ATOM 61 C GLY A 7 -6.149 -13.474 -2.076 1.00 0.00 C ATOM 62 O GLY A 7 -6.240 -13.667 -0.864 1.00 0.00 O ATOM 0 H GLY A 7 -8.583 -15.382 -2.737 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.971 -14.305 -3.869 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -7.694 -12.784 -3.387 1.00 0.00 H new ATOM 66 N PRO A 8 -5.021 -13.025 -2.646 1.00 0.00 N ATOM 67 CA PRO A 8 -3.809 -12.729 -1.877 1.00 0.00 C ATOM 68 C PRO A 8 -3.969 -11.496 -0.994 1.00 0.00 C ATOM 69 O PRO A 8 -3.674 -11.533 0.201 1.00 0.00 O ATOM 70 CB PRO A 8 -2.755 -12.479 -2.958 1.00 0.00 C ATOM 71 CG PRO A 8 -3.532 -12.036 -4.150 1.00 0.00 C ATOM 72 CD PRO A 8 -4.842 -12.771 -4.086 1.00 0.00 C ATOM 0 HA PRO A 8 -3.554 -13.538 -1.192 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -2.041 -11.717 -2.646 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.184 -13.383 -3.171 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.688 -10.957 -4.135 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -2.999 -12.268 -5.072 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -5.658 -12.174 -4.493 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -4.810 -13.699 -4.657 1.00 0.00 H new ATOM 80 N VAL A 9 -4.440 -10.405 -1.589 1.00 0.00 N ATOM 81 CA VAL A 9 -4.641 -9.160 -0.856 1.00 0.00 C ATOM 82 C VAL A 9 -6.112 -8.761 -0.845 1.00 0.00 C ATOM 83 O VAL A 9 -6.770 -8.741 -1.886 1.00 0.00 O ATOM 84 CB VAL A 9 -3.813 -8.012 -1.462 1.00 0.00 C ATOM 85 CG1 VAL A 9 -3.748 -8.141 -2.976 1.00 0.00 C ATOM 86 CG2 VAL A 9 -4.394 -6.665 -1.057 1.00 0.00 C ATOM 0 H VAL A 9 -4.690 -10.358 -2.577 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.308 -9.337 0.167 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.797 -8.075 -1.073 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.159 -7.321 -3.386 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -3.282 -9.090 -3.241 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.757 -8.105 -3.388 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -3.797 -5.865 -1.494 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.420 -6.589 -1.416 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.382 -6.575 0.029 1.00 0.00 H new ATOM 96 N LYS A 10 -6.625 -8.442 0.338 1.00 0.00 N ATOM 97 CA LYS A 10 -8.018 -8.041 0.487 1.00 0.00 C ATOM 98 C LYS A 10 -8.276 -6.704 -0.202 1.00 0.00 C ATOM 99 O LYS A 10 -7.431 -5.809 -0.177 1.00 0.00 O ATOM 100 CB LYS A 10 -8.387 -7.942 1.969 1.00 0.00 C ATOM 101 CG LYS A 10 -9.767 -8.491 2.290 1.00 0.00 C ATOM 102 CD LYS A 10 -10.858 -7.488 1.954 1.00 0.00 C ATOM 103 CE LYS A 10 -11.153 -6.571 3.132 1.00 0.00 C ATOM 104 NZ LYS A 10 -9.909 -5.983 3.702 1.00 0.00 N ATOM 0 H LYS A 10 -6.095 -8.454 1.209 1.00 0.00 H new ATOM 0 HA LYS A 10 -8.641 -8.800 0.014 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -7.645 -8.482 2.557 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -8.340 -6.898 2.278 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -9.933 -9.411 1.730 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -9.821 -8.747 3.348 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -10.553 -6.891 1.094 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -11.766 -8.019 1.668 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -11.819 -5.770 2.811 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -11.678 -7.131 3.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -10.158 -5.251 4.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -9.354 -6.729 4.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -9.345 -5.557 2.939 1.00 0.00 H new ATOM 118 N VAL A 11 -9.448 -6.575 -0.815 1.00 0.00 N ATOM 119 CA VAL A 11 -9.817 -5.347 -1.509 1.00 0.00 C ATOM 120 C VAL A 11 -10.782 -4.513 -0.673 1.00 0.00 C ATOM 121 O VAL A 11 -11.870 -4.970 -0.320 1.00 0.00 O ATOM 122 CB VAL A 11 -10.465 -5.646 -2.874 1.00 0.00 C ATOM 123 CG1 VAL A 11 -10.869 -4.354 -3.567 1.00 0.00 C ATOM 124 CG2 VAL A 11 -9.518 -6.455 -3.746 1.00 0.00 C ATOM 0 H VAL A 11 -10.159 -7.306 -0.845 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.897 -4.784 -1.668 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.365 -6.238 -2.708 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.325 -4.585 -4.530 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.585 -3.816 -2.946 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -9.987 -3.733 -3.723 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -9.991 -6.658 -4.707 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -8.599 -5.891 -3.906 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.283 -7.397 -3.251 1.00 0.00 H new ATOM 134 N LEU A 12 -10.376 -3.288 -0.359 1.00 0.00 N ATOM 135 CA LEU A 12 -11.205 -2.388 0.436 1.00 0.00 C ATOM 136 C LEU A 12 -11.965 -1.415 -0.459 1.00 0.00 C ATOM 137 O LEU A 12 -11.461 -0.986 -1.497 1.00 0.00 O ATOM 138 CB LEU A 12 -10.340 -1.613 1.432 1.00 0.00 C ATOM 139 CG LEU A 12 -9.501 -2.457 2.392 1.00 0.00 C ATOM 140 CD1 LEU A 12 -8.472 -1.593 3.103 1.00 0.00 C ATOM 141 CD2 LEU A 12 -10.395 -3.164 3.400 1.00 0.00 C ATOM 0 H LEU A 12 -9.478 -2.895 -0.642 1.00 0.00 H new ATOM 0 HA LEU A 12 -11.929 -2.990 0.984 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.669 -0.963 0.871 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -10.991 -0.967 2.022 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.971 -3.213 1.813 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -7.885 -2.211 3.782 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -7.812 -1.134 2.367 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -8.981 -0.814 3.670 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.781 -3.760 4.075 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -10.952 -2.424 3.974 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -11.093 -3.815 2.874 1.00 0.00 H new ATOM 153 N VAL A 13 -13.182 -1.068 -0.049 1.00 0.00 N ATOM 154 CA VAL A 13 -14.011 -0.143 -0.812 1.00 0.00 C ATOM 155 C VAL A 13 -14.508 1.000 0.065 1.00 0.00 C ATOM 156 O VAL A 13 -14.448 0.927 1.292 1.00 0.00 O ATOM 157 CB VAL A 13 -15.222 -0.860 -1.437 1.00 0.00 C ATOM 158 CG1 VAL A 13 -14.768 -1.838 -2.511 1.00 0.00 C ATOM 159 CG2 VAL A 13 -16.032 -1.572 -0.364 1.00 0.00 C ATOM 0 H VAL A 13 -13.615 -1.414 0.807 1.00 0.00 H new ATOM 0 HA VAL A 13 -13.386 0.260 -1.609 1.00 0.00 H new ATOM 0 HB VAL A 13 -15.862 -0.113 -1.907 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -15.637 -2.335 -2.941 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -14.235 -1.298 -3.293 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -14.106 -2.583 -2.069 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -16.884 -2.073 -0.824 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -15.404 -2.309 0.137 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -16.389 -0.845 0.365 1.00 0.00 H new ATOM 169 N GLY A 14 -15.001 2.058 -0.573 1.00 0.00 N ATOM 170 CA GLY A 14 -15.502 3.202 0.165 1.00 0.00 C ATOM 171 C GLY A 14 -16.804 2.904 0.883 1.00 0.00 C ATOM 172 O GLY A 14 -17.411 3.794 1.479 1.00 0.00 O ATOM 0 H GLY A 14 -15.062 2.142 -1.588 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -14.754 3.518 0.892 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -15.651 4.036 -0.521 1.00 0.00 H new ATOM 176 N LYS A 15 -17.235 1.648 0.827 1.00 0.00 N ATOM 177 CA LYS A 15 -18.472 1.234 1.476 1.00 0.00 C ATOM 178 C LYS A 15 -18.181 0.432 2.741 1.00 0.00 C ATOM 179 O LYS A 15 -18.877 0.568 3.746 1.00 0.00 O ATOM 180 CB LYS A 15 -19.322 0.399 0.515 1.00 0.00 C ATOM 181 CG LYS A 15 -20.732 0.140 1.018 1.00 0.00 C ATOM 182 CD LYS A 15 -21.313 -1.129 0.417 1.00 0.00 C ATOM 183 CE LYS A 15 -20.832 -2.368 1.158 1.00 0.00 C ATOM 184 NZ LYS A 15 -21.463 -3.609 0.630 1.00 0.00 N ATOM 0 H LYS A 15 -16.745 0.899 0.338 1.00 0.00 H new ATOM 0 HA LYS A 15 -19.024 2.131 1.754 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -19.376 0.910 -0.446 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -18.826 -0.556 0.341 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -20.722 0.058 2.105 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -21.370 0.988 0.768 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -22.402 -1.083 0.451 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -21.029 -1.199 -0.633 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -19.748 -2.446 1.070 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -21.060 -2.268 2.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -21.110 -4.431 1.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -22.496 -3.546 0.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -21.225 -3.718 -0.376 1.00 0.00 H new ATOM 198 N ASN A 16 -17.148 -0.401 2.683 1.00 0.00 N ATOM 199 CA ASN A 16 -16.765 -1.224 3.824 1.00 0.00 C ATOM 200 C ASN A 16 -15.287 -1.039 4.157 1.00 0.00 C ATOM 201 O ASN A 16 -14.702 -1.830 4.897 1.00 0.00 O ATOM 202 CB ASN A 16 -17.053 -2.699 3.537 1.00 0.00 C ATOM 203 CG ASN A 16 -16.002 -3.331 2.646 1.00 0.00 C ATOM 204 OD1 ASN A 16 -16.219 -3.521 1.449 1.00 0.00 O ATOM 205 ND2 ASN A 16 -14.853 -3.659 3.227 1.00 0.00 N ATOM 0 H ASN A 16 -16.561 -0.524 1.858 1.00 0.00 H new ATOM 0 HA ASN A 16 -17.356 -0.906 4.683 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -17.104 -3.246 4.478 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -18.030 -2.790 3.062 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -14.107 -4.086 2.678 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -14.716 -3.483 4.222 1.00 0.00 H new ATOM 212 N PHE A 17 -14.689 0.012 3.605 1.00 0.00 N ATOM 213 CA PHE A 17 -13.280 0.302 3.842 1.00 0.00 C ATOM 214 C PHE A 17 -12.954 0.233 5.331 1.00 0.00 C ATOM 215 O PHE A 17 -12.184 -0.621 5.769 1.00 0.00 O ATOM 216 CB PHE A 17 -12.922 1.685 3.293 1.00 0.00 C ATOM 217 CG PHE A 17 -11.814 2.361 4.048 1.00 0.00 C ATOM 218 CD1 PHE A 17 -10.523 1.858 4.007 1.00 0.00 C ATOM 219 CD2 PHE A 17 -12.062 3.499 4.797 1.00 0.00 C ATOM 220 CE1 PHE A 17 -9.502 2.478 4.701 1.00 0.00 C ATOM 221 CE2 PHE A 17 -11.045 4.124 5.494 1.00 0.00 C ATOM 222 CZ PHE A 17 -9.762 3.613 5.445 1.00 0.00 C ATOM 0 H PHE A 17 -15.159 0.677 2.990 1.00 0.00 H new ATOM 0 HA PHE A 17 -12.687 -0.451 3.323 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -12.631 1.588 2.247 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -13.809 2.319 3.320 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.313 0.972 3.426 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -13.063 3.903 4.837 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.501 2.076 4.662 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -11.253 5.010 6.076 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.964 4.100 5.987 1.00 0.00 H new ATOM 232 N GLU A 18 -13.544 1.141 6.102 1.00 0.00 N ATOM 233 CA GLU A 18 -13.315 1.184 7.542 1.00 0.00 C ATOM 234 C GLU A 18 -13.757 -0.119 8.202 1.00 0.00 C ATOM 235 O GLU A 18 -13.230 -0.509 9.245 1.00 0.00 O ATOM 236 CB GLU A 18 -14.063 2.364 8.165 1.00 0.00 C ATOM 237 CG GLU A 18 -13.837 3.680 7.439 1.00 0.00 C ATOM 238 CD GLU A 18 -14.859 3.927 6.347 1.00 0.00 C ATOM 239 OE1 GLU A 18 -15.584 2.976 5.987 1.00 0.00 O ATOM 240 OE2 GLU A 18 -14.933 5.071 5.851 1.00 0.00 O ATOM 0 H GLU A 18 -14.183 1.856 5.754 1.00 0.00 H new ATOM 0 HA GLU A 18 -12.246 1.312 7.710 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -15.130 2.143 8.174 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -13.751 2.474 9.204 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -13.874 4.498 8.158 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -12.838 3.683 7.004 1.00 0.00 H new ATOM 247 N ASP A 19 -14.728 -0.786 7.589 1.00 0.00 N ATOM 248 CA ASP A 19 -15.241 -2.045 8.116 1.00 0.00 C ATOM 249 C ASP A 19 -14.103 -3.022 8.395 1.00 0.00 C ATOM 250 O ASP A 19 -14.029 -3.614 9.472 1.00 0.00 O ATOM 251 CB ASP A 19 -16.235 -2.667 7.134 1.00 0.00 C ATOM 252 CG ASP A 19 -17.296 -3.496 7.830 1.00 0.00 C ATOM 253 OD1 ASP A 19 -17.053 -4.700 8.060 1.00 0.00 O ATOM 254 OD2 ASP A 19 -18.369 -2.942 8.145 1.00 0.00 O ATOM 0 H ASP A 19 -15.176 -0.476 6.727 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.753 -1.835 9.055 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.716 -1.876 6.559 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -15.696 -3.294 6.424 1.00 0.00 H new ATOM 259 N VAL A 20 -13.219 -3.188 7.416 1.00 0.00 N ATOM 260 CA VAL A 20 -12.085 -4.093 7.556 1.00 0.00 C ATOM 261 C VAL A 20 -10.834 -3.342 7.999 1.00 0.00 C ATOM 262 O VAL A 20 -10.076 -3.822 8.842 1.00 0.00 O ATOM 263 CB VAL A 20 -11.788 -4.829 6.236 1.00 0.00 C ATOM 264 CG1 VAL A 20 -10.930 -6.058 6.491 1.00 0.00 C ATOM 265 CG2 VAL A 20 -13.084 -5.208 5.535 1.00 0.00 C ATOM 0 H VAL A 20 -13.267 -2.707 6.518 1.00 0.00 H new ATOM 0 HA VAL A 20 -12.356 -4.824 8.318 1.00 0.00 H new ATOM 0 HB VAL A 20 -11.231 -4.157 5.582 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.731 -6.565 5.547 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -9.987 -5.755 6.947 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -11.456 -6.736 7.163 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -12.856 -5.727 4.604 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -13.669 -5.862 6.181 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -13.657 -4.307 5.317 1.00 0.00 H new ATOM 275 N ALA A 21 -10.625 -2.162 7.426 1.00 0.00 N ATOM 276 CA ALA A 21 -9.467 -1.343 7.764 1.00 0.00 C ATOM 277 C ALA A 21 -9.326 -1.189 9.274 1.00 0.00 C ATOM 278 O ALA A 21 -8.346 -1.644 9.866 1.00 0.00 O ATOM 279 CB ALA A 21 -9.574 0.022 7.100 1.00 0.00 C ATOM 0 H ALA A 21 -11.242 -1.751 6.725 1.00 0.00 H new ATOM 0 HA ALA A 21 -8.575 -1.847 7.392 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.703 0.623 7.361 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -9.618 -0.102 6.018 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -10.478 0.524 7.445 1.00 0.00 H new ATOM 285 N PHE A 22 -10.309 -0.544 9.894 1.00 0.00 N ATOM 286 CA PHE A 22 -10.293 -0.329 11.336 1.00 0.00 C ATOM 287 C PHE A 22 -10.862 -1.537 12.073 1.00 0.00 C ATOM 288 O PHE A 22 -12.072 -1.639 12.278 1.00 0.00 O ATOM 289 CB PHE A 22 -11.093 0.925 11.694 1.00 0.00 C ATOM 290 CG PHE A 22 -10.453 2.200 11.223 1.00 0.00 C ATOM 291 CD1 PHE A 22 -9.101 2.427 11.423 1.00 0.00 C ATOM 292 CD2 PHE A 22 -11.204 3.170 10.579 1.00 0.00 C ATOM 293 CE1 PHE A 22 -8.510 3.599 10.991 1.00 0.00 C ATOM 294 CE2 PHE A 22 -10.618 4.344 10.144 1.00 0.00 C ATOM 295 CZ PHE A 22 -9.269 4.559 10.349 1.00 0.00 C ATOM 0 H PHE A 22 -11.127 -0.161 9.420 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.257 -0.192 11.646 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -12.090 0.846 11.260 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -11.219 0.969 12.776 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -8.502 1.680 11.922 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -12.259 3.007 10.415 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -7.455 3.765 11.155 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -11.215 5.093 9.644 1.00 0.00 H new ATOM 0 HZ PHE A 22 -8.809 5.475 10.009 1.00 0.00 H new ATOM 305 N ASP A 23 -9.982 -2.450 12.468 1.00 0.00 N ATOM 306 CA ASP A 23 -10.396 -3.652 13.182 1.00 0.00 C ATOM 307 C ASP A 23 -9.557 -3.852 14.441 1.00 0.00 C ATOM 308 O ASP A 23 -8.336 -3.705 14.413 1.00 0.00 O ATOM 309 CB ASP A 23 -10.277 -4.878 12.275 1.00 0.00 C ATOM 310 CG ASP A 23 -10.846 -6.129 12.913 1.00 0.00 C ATOM 311 OD1 ASP A 23 -11.962 -6.056 13.469 1.00 0.00 O ATOM 312 OD2 ASP A 23 -10.175 -7.181 12.859 1.00 0.00 O ATOM 0 H ASP A 23 -8.977 -2.381 12.306 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.438 -3.528 13.477 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -10.797 -4.684 11.337 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -9.228 -5.044 12.030 1.00 0.00 H new ATOM 317 N GLU A 24 -10.222 -4.187 15.542 1.00 0.00 N ATOM 318 CA GLU A 24 -9.537 -4.405 16.811 1.00 0.00 C ATOM 319 C GLU A 24 -8.884 -5.784 16.847 1.00 0.00 C ATOM 320 O GLU A 24 -9.447 -6.763 16.356 1.00 0.00 O ATOM 321 CB GLU A 24 -10.518 -4.263 17.976 1.00 0.00 C ATOM 322 CG GLU A 24 -11.498 -5.418 18.092 1.00 0.00 C ATOM 323 CD GLU A 24 -12.669 -5.287 17.139 1.00 0.00 C ATOM 324 OE1 GLU A 24 -13.118 -4.145 16.904 1.00 0.00 O ATOM 325 OE2 GLU A 24 -13.138 -6.326 16.628 1.00 0.00 O ATOM 0 H GLU A 24 -11.233 -4.313 15.581 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.757 -3.650 16.908 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -9.955 -4.181 18.906 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.076 -3.334 17.858 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.976 -6.354 17.894 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.871 -5.472 19.115 1.00 0.00 H new ATOM 332 N LYS A 25 -7.692 -5.853 17.430 1.00 0.00 N ATOM 333 CA LYS A 25 -6.961 -7.110 17.532 1.00 0.00 C ATOM 334 C LYS A 25 -6.588 -7.636 16.150 1.00 0.00 C ATOM 335 O LYS A 25 -6.512 -8.846 15.934 1.00 0.00 O ATOM 336 CB LYS A 25 -7.798 -8.152 18.277 1.00 0.00 C ATOM 337 CG LYS A 25 -8.243 -7.701 19.658 1.00 0.00 C ATOM 338 CD LYS A 25 -7.069 -7.609 20.619 1.00 0.00 C ATOM 339 CE LYS A 25 -7.341 -6.616 21.738 1.00 0.00 C ATOM 340 NZ LYS A 25 -7.258 -5.207 21.262 1.00 0.00 N ATOM 0 H LYS A 25 -7.211 -5.052 17.839 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.044 -6.923 18.090 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.679 -8.392 17.681 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.218 -9.070 18.373 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.732 -6.729 19.585 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.981 -8.400 20.050 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -6.868 -8.592 21.045 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.174 -7.308 20.074 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -8.331 -6.801 22.155 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.622 -6.770 22.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -7.212 -4.566 22.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.405 -5.087 20.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.099 -4.983 20.693 1.00 0.00 H new ATOM 354 N LYS A 26 -6.355 -6.720 15.216 1.00 0.00 N ATOM 355 CA LYS A 26 -5.988 -7.091 13.854 1.00 0.00 C ATOM 356 C LYS A 26 -5.194 -5.975 13.182 1.00 0.00 C ATOM 357 O LYS A 26 -5.685 -4.858 13.027 1.00 0.00 O ATOM 358 CB LYS A 26 -7.240 -7.406 13.034 1.00 0.00 C ATOM 359 CG LYS A 26 -6.979 -7.510 11.541 1.00 0.00 C ATOM 360 CD LYS A 26 -6.502 -8.899 11.154 1.00 0.00 C ATOM 361 CE LYS A 26 -7.643 -9.905 11.172 1.00 0.00 C ATOM 362 NZ LYS A 26 -7.158 -11.298 10.968 1.00 0.00 N ATOM 0 H LYS A 26 -6.414 -5.715 15.377 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.361 -7.981 13.903 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -7.668 -8.345 13.386 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -7.985 -6.630 13.211 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.891 -7.272 10.994 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.231 -6.773 11.249 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.058 -8.868 10.159 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.720 -9.221 11.842 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.170 -9.840 12.124 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.362 -9.653 10.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -7.894 -11.969 11.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -6.942 -11.447 9.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.298 -11.452 11.533 1.00 0.00 H new ATOM 376 N ASN A 27 -3.965 -6.286 12.785 1.00 0.00 N ATOM 377 CA ASN A 27 -3.103 -5.310 12.128 1.00 0.00 C ATOM 378 C ASN A 27 -3.297 -5.343 10.615 1.00 0.00 C ATOM 379 O ASN A 27 -2.687 -6.154 9.918 1.00 0.00 O ATOM 380 CB ASN A 27 -1.637 -5.579 12.472 1.00 0.00 C ATOM 381 CG ASN A 27 -1.404 -5.691 13.966 1.00 0.00 C ATOM 382 OD1 ASN A 27 -1.103 -4.702 14.634 1.00 0.00 O ATOM 383 ND2 ASN A 27 -1.544 -6.900 14.497 1.00 0.00 N ATOM 0 H ASN A 27 -3.543 -7.207 12.907 1.00 0.00 H new ATOM 0 HA ASN A 27 -3.378 -4.319 12.490 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.316 -6.501 11.987 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -1.019 -4.776 12.070 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.401 -7.037 15.498 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -1.795 -7.691 13.904 1.00 0.00 H new ATOM 390 N VAL A 28 -4.151 -4.456 10.113 1.00 0.00 N ATOM 391 CA VAL A 28 -4.424 -4.383 8.683 1.00 0.00 C ATOM 392 C VAL A 28 -3.571 -3.310 8.015 1.00 0.00 C ATOM 393 O VAL A 28 -3.526 -2.166 8.468 1.00 0.00 O ATOM 394 CB VAL A 28 -5.911 -4.084 8.411 1.00 0.00 C ATOM 395 CG1 VAL A 28 -6.182 -4.045 6.915 1.00 0.00 C ATOM 396 CG2 VAL A 28 -6.795 -5.116 9.094 1.00 0.00 C ATOM 0 H VAL A 28 -4.665 -3.778 10.676 1.00 0.00 H new ATOM 0 HA VAL A 28 -4.173 -5.357 8.262 1.00 0.00 H new ATOM 0 HB VAL A 28 -6.149 -3.104 8.825 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -7.237 -3.833 6.742 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -5.575 -3.265 6.455 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -5.929 -5.009 6.474 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -7.842 -4.890 8.891 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -6.558 -6.109 8.711 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.620 -5.090 10.170 1.00 0.00 H new ATOM 406 N PHE A 29 -2.896 -3.688 6.934 1.00 0.00 N ATOM 407 CA PHE A 29 -2.043 -2.759 6.203 1.00 0.00 C ATOM 408 C PHE A 29 -2.654 -2.410 4.849 1.00 0.00 C ATOM 409 O PHE A 29 -2.548 -3.176 3.891 1.00 0.00 O ATOM 410 CB PHE A 29 -0.649 -3.359 6.006 1.00 0.00 C ATOM 411 CG PHE A 29 0.331 -2.408 5.382 1.00 0.00 C ATOM 412 CD1 PHE A 29 0.097 -1.042 5.397 1.00 0.00 C ATOM 413 CD2 PHE A 29 1.485 -2.879 4.778 1.00 0.00 C ATOM 414 CE1 PHE A 29 0.997 -0.164 4.824 1.00 0.00 C ATOM 415 CE2 PHE A 29 2.389 -2.006 4.203 1.00 0.00 C ATOM 416 CZ PHE A 29 2.144 -0.647 4.225 1.00 0.00 C ATOM 0 H PHE A 29 -2.923 -4.631 6.545 1.00 0.00 H new ATOM 0 HA PHE A 29 -1.958 -1.845 6.791 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -0.263 -3.684 6.972 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -0.730 -4.247 5.380 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -0.799 -0.659 5.862 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.681 -3.941 4.756 1.00 0.00 H new ATOM 0 HE1 PHE A 29 0.804 0.898 4.844 1.00 0.00 H new ATOM 0 HE2 PHE A 29 3.286 -2.386 3.737 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.848 0.037 3.775 1.00 0.00 H new ATOM 426 N VAL A 30 -3.296 -1.248 4.778 1.00 0.00 N ATOM 427 CA VAL A 30 -3.925 -0.796 3.543 1.00 0.00 C ATOM 428 C VAL A 30 -2.906 -0.144 2.614 1.00 0.00 C ATOM 429 O VAL A 30 -1.821 0.246 3.044 1.00 0.00 O ATOM 430 CB VAL A 30 -5.060 0.206 3.825 1.00 0.00 C ATOM 431 CG1 VAL A 30 -5.820 0.525 2.546 1.00 0.00 C ATOM 432 CG2 VAL A 30 -5.999 -0.340 4.890 1.00 0.00 C ATOM 0 H VAL A 30 -3.394 -0.603 5.562 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.342 -1.679 3.059 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.621 1.131 4.199 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -6.618 1.234 2.764 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.137 0.960 1.816 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.250 -0.391 2.140 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.795 0.381 5.077 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.433 -1.279 4.546 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.443 -0.513 5.811 1.00 0.00 H new ATOM 442 N GLU A 31 -3.264 -0.029 1.339 1.00 0.00 N ATOM 443 CA GLU A 31 -2.380 0.576 0.350 1.00 0.00 C ATOM 444 C GLU A 31 -3.173 1.416 -0.647 1.00 0.00 C ATOM 445 O GLU A 31 -3.846 0.882 -1.529 1.00 0.00 O ATOM 446 CB GLU A 31 -1.592 -0.506 -0.392 1.00 0.00 C ATOM 447 CG GLU A 31 -1.029 -0.043 -1.725 1.00 0.00 C ATOM 448 CD GLU A 31 -0.584 -1.197 -2.603 1.00 0.00 C ATOM 449 OE1 GLU A 31 -1.458 -1.848 -3.214 1.00 0.00 O ATOM 450 OE2 GLU A 31 0.636 -1.450 -2.678 1.00 0.00 O ATOM 0 H GLU A 31 -4.159 -0.347 0.967 1.00 0.00 H new ATOM 0 HA GLU A 31 -1.682 1.228 0.875 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.772 -0.845 0.241 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -2.241 -1.365 -0.560 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.785 0.539 -2.252 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.183 0.621 -1.547 1.00 0.00 H new ATOM 457 N PHE A 32 -3.089 2.734 -0.500 1.00 0.00 N ATOM 458 CA PHE A 32 -3.799 3.649 -1.385 1.00 0.00 C ATOM 459 C PHE A 32 -3.017 3.874 -2.676 1.00 0.00 C ATOM 460 O PHE A 32 -2.094 4.688 -2.722 1.00 0.00 O ATOM 461 CB PHE A 32 -4.042 4.987 -0.683 1.00 0.00 C ATOM 462 CG PHE A 32 -4.865 4.867 0.568 1.00 0.00 C ATOM 463 CD1 PHE A 32 -6.248 4.930 0.512 1.00 0.00 C ATOM 464 CD2 PHE A 32 -4.255 4.691 1.800 1.00 0.00 C ATOM 465 CE1 PHE A 32 -7.008 4.820 1.661 1.00 0.00 C ATOM 466 CE2 PHE A 32 -5.011 4.580 2.952 1.00 0.00 C ATOM 467 CZ PHE A 32 -6.388 4.645 2.882 1.00 0.00 C ATOM 0 H PHE A 32 -2.536 3.192 0.224 1.00 0.00 H new ATOM 0 HA PHE A 32 -4.759 3.199 -1.636 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -3.081 5.437 -0.434 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.543 5.665 -1.374 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.738 5.067 -0.441 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -3.178 4.640 1.861 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -8.085 4.871 1.604 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -4.524 4.442 3.906 1.00 0.00 H new ATOM 0 HZ PHE A 32 -6.980 4.559 3.781 1.00 0.00 H new ATOM 477 N TYR A 33 -3.392 3.146 -3.722 1.00 0.00 N ATOM 478 CA TYR A 33 -2.725 3.263 -5.013 1.00 0.00 C ATOM 479 C TYR A 33 -3.586 4.042 -6.003 1.00 0.00 C ATOM 480 O TYR A 33 -4.746 4.346 -5.728 1.00 0.00 O ATOM 481 CB TYR A 33 -2.410 1.876 -5.575 1.00 0.00 C ATOM 482 CG TYR A 33 -3.639 1.093 -5.979 1.00 0.00 C ATOM 483 CD1 TYR A 33 -4.286 1.349 -7.182 1.00 0.00 C ATOM 484 CD2 TYR A 33 -4.153 0.097 -5.158 1.00 0.00 C ATOM 485 CE1 TYR A 33 -5.409 0.636 -7.554 1.00 0.00 C ATOM 486 CE2 TYR A 33 -5.275 -0.622 -5.523 1.00 0.00 C ATOM 487 CZ TYR A 33 -5.900 -0.348 -6.721 1.00 0.00 C ATOM 488 OH TYR A 33 -7.018 -1.061 -7.089 1.00 0.00 O ATOM 0 H TYR A 33 -4.154 2.469 -3.701 1.00 0.00 H new ATOM 0 HA TYR A 33 -1.793 3.808 -4.864 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -1.757 1.984 -6.441 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -1.857 1.307 -4.828 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -3.904 2.118 -7.837 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -3.667 -0.119 -4.218 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -5.900 0.848 -8.492 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -5.660 -1.394 -4.874 1.00 0.00 H new ATOM 0 HH TYR A 33 -7.232 -1.716 -6.393 1.00 0.00 H new ATOM 498 N ALA A 34 -3.008 4.362 -7.156 1.00 0.00 N ATOM 499 CA ALA A 34 -3.721 5.102 -8.189 1.00 0.00 C ATOM 500 C ALA A 34 -3.628 4.394 -9.536 1.00 0.00 C ATOM 501 O ALA A 34 -2.567 3.921 -9.943 1.00 0.00 O ATOM 502 CB ALA A 34 -3.175 6.518 -8.296 1.00 0.00 C ATOM 0 H ALA A 34 -2.047 4.120 -7.398 1.00 0.00 H new ATOM 0 HA ALA A 34 -4.772 5.150 -7.906 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -3.717 7.059 -9.072 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.300 7.029 -7.342 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.116 6.481 -8.552 1.00 0.00 H new ATOM 508 N PRO A 35 -4.764 4.319 -10.246 1.00 0.00 N ATOM 509 CA PRO A 35 -4.835 3.670 -11.558 1.00 0.00 C ATOM 510 C PRO A 35 -4.099 4.458 -12.636 1.00 0.00 C ATOM 511 O PRO A 35 -3.975 4.005 -13.774 1.00 0.00 O ATOM 512 CB PRO A 35 -6.337 3.633 -11.854 1.00 0.00 C ATOM 513 CG PRO A 35 -6.907 4.760 -11.064 1.00 0.00 C ATOM 514 CD PRO A 35 -6.065 4.862 -9.822 1.00 0.00 C ATOM 0 HA PRO A 35 -4.363 2.688 -11.553 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -6.534 3.757 -12.919 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -6.776 2.680 -11.558 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -6.878 5.689 -11.633 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -7.951 4.572 -10.813 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -5.978 5.893 -9.479 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -6.491 4.288 -8.999 1.00 0.00 H new ATOM 522 N TRP A 36 -3.613 5.639 -12.270 1.00 0.00 N ATOM 523 CA TRP A 36 -2.888 6.490 -13.207 1.00 0.00 C ATOM 524 C TRP A 36 -1.478 6.775 -12.704 1.00 0.00 C ATOM 525 O TRP A 36 -0.624 7.246 -13.456 1.00 0.00 O ATOM 526 CB TRP A 36 -3.642 7.803 -13.422 1.00 0.00 C ATOM 527 CG TRP A 36 -4.452 8.225 -12.234 1.00 0.00 C ATOM 528 CD1 TRP A 36 -5.772 7.958 -12.005 1.00 0.00 C ATOM 529 CD2 TRP A 36 -3.995 8.990 -11.113 1.00 0.00 C ATOM 530 NE1 TRP A 36 -6.163 8.511 -10.809 1.00 0.00 N ATOM 531 CE2 TRP A 36 -5.091 9.149 -10.243 1.00 0.00 C ATOM 532 CE3 TRP A 36 -2.767 9.555 -10.759 1.00 0.00 C ATOM 533 CZ2 TRP A 36 -4.994 9.850 -9.043 1.00 0.00 C ATOM 534 CZ3 TRP A 36 -2.672 10.250 -9.569 1.00 0.00 C ATOM 535 CH2 TRP A 36 -3.779 10.392 -8.722 1.00 0.00 C ATOM 0 H TRP A 36 -3.708 6.029 -11.332 1.00 0.00 H new ATOM 0 HA TRP A 36 -2.814 5.962 -14.158 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -2.926 8.589 -13.662 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -4.302 7.698 -14.283 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -6.414 7.395 -12.666 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -7.099 8.455 -10.408 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -1.907 9.450 -11.404 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -5.847 9.962 -8.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -1.728 10.692 -9.287 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -3.671 10.940 -7.798 1.00 0.00 H new ATOM 546 N CYS A 37 -1.239 6.487 -11.429 1.00 0.00 N ATOM 547 CA CYS A 37 0.069 6.713 -10.826 1.00 0.00 C ATOM 548 C CYS A 37 1.067 5.651 -11.277 1.00 0.00 C ATOM 549 O CYS A 37 1.120 4.557 -10.717 1.00 0.00 O ATOM 550 CB CYS A 37 -0.042 6.711 -9.301 1.00 0.00 C ATOM 551 SG CYS A 37 1.529 6.976 -8.445 1.00 0.00 S ATOM 0 H CYS A 37 -1.934 6.096 -10.793 1.00 0.00 H new ATOM 0 HA CYS A 37 0.430 7.687 -11.155 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -0.744 7.488 -8.998 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.462 5.758 -8.979 1.00 0.00 H new ATOM 0 HG CYS A 37 1.506 6.365 -7.298 1.00 0.00 H new ATOM 557 N GLY A 38 1.856 5.982 -12.294 1.00 0.00 N ATOM 558 CA GLY A 38 2.841 5.046 -12.804 1.00 0.00 C ATOM 559 C GLY A 38 3.484 4.224 -11.705 1.00 0.00 C ATOM 560 O GLY A 38 3.617 3.006 -11.827 1.00 0.00 O ATOM 0 H GLY A 38 1.831 6.882 -12.774 1.00 0.00 H new ATOM 0 HA2 GLY A 38 2.365 4.378 -13.522 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.614 5.594 -13.343 1.00 0.00 H new ATOM 564 N HIS A 39 3.886 4.891 -10.628 1.00 0.00 N ATOM 565 CA HIS A 39 4.520 4.215 -9.502 1.00 0.00 C ATOM 566 C HIS A 39 3.693 3.013 -9.054 1.00 0.00 C ATOM 567 O HIS A 39 4.222 1.916 -8.871 1.00 0.00 O ATOM 568 CB HIS A 39 4.705 5.185 -8.335 1.00 0.00 C ATOM 569 CG HIS A 39 5.812 6.171 -8.545 1.00 0.00 C ATOM 570 ND1 HIS A 39 7.144 5.853 -8.383 1.00 0.00 N ATOM 571 CD2 HIS A 39 5.780 7.474 -8.909 1.00 0.00 C ATOM 572 CE1 HIS A 39 7.883 6.918 -8.636 1.00 0.00 C ATOM 573 NE2 HIS A 39 7.079 7.916 -8.958 1.00 0.00 N ATOM 0 H HIS A 39 3.784 5.899 -10.511 1.00 0.00 H new ATOM 0 HA HIS A 39 5.498 3.860 -9.828 1.00 0.00 H new ATOM 0 HB2 HIS A 39 3.773 5.727 -8.172 1.00 0.00 H new ATOM 0 HB3 HIS A 39 4.905 4.615 -7.428 1.00 0.00 H new ATOM 0 HD2 HIS A 39 4.897 8.058 -9.122 1.00 0.00 H new ATOM 0 HE1 HIS A 39 8.961 6.965 -8.588 1.00 0.00 H new ATOM 0 HE2 HIS A 39 7.375 8.861 -9.203 1.00 0.00 H new ATOM 582 N CYS A 40 2.394 3.228 -8.879 1.00 0.00 N ATOM 583 CA CYS A 40 1.494 2.163 -8.450 1.00 0.00 C ATOM 584 C CYS A 40 1.678 0.917 -9.310 1.00 0.00 C ATOM 585 O CYS A 40 1.822 -0.192 -8.794 1.00 0.00 O ATOM 586 CB CYS A 40 0.041 2.635 -8.521 1.00 0.00 C ATOM 587 SG CYS A 40 -1.148 1.318 -8.867 1.00 0.00 S ATOM 0 H CYS A 40 1.940 4.129 -9.027 1.00 0.00 H new ATOM 0 HA CYS A 40 1.736 1.910 -7.418 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -0.222 3.108 -7.575 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -0.044 3.399 -9.294 1.00 0.00 H new ATOM 0 HG CYS A 40 -2.274 1.583 -8.274 1.00 0.00 H new ATOM 593 N LYS A 41 1.671 1.105 -10.625 1.00 0.00 N ATOM 594 CA LYS A 41 1.837 -0.003 -11.559 1.00 0.00 C ATOM 595 C LYS A 41 2.964 -0.927 -11.110 1.00 0.00 C ATOM 596 O LYS A 41 2.947 -2.125 -11.395 1.00 0.00 O ATOM 597 CB LYS A 41 2.127 0.527 -12.965 1.00 0.00 C ATOM 598 CG LYS A 41 0.948 1.244 -13.600 1.00 0.00 C ATOM 599 CD LYS A 41 1.362 1.997 -14.853 1.00 0.00 C ATOM 600 CE LYS A 41 0.205 2.798 -15.430 1.00 0.00 C ATOM 601 NZ LYS A 41 -0.597 1.996 -16.395 1.00 0.00 N ATOM 0 H LYS A 41 1.552 2.016 -11.069 1.00 0.00 H new ATOM 0 HA LYS A 41 0.908 -0.573 -11.577 1.00 0.00 H new ATOM 0 HB2 LYS A 41 2.975 1.210 -12.919 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.423 -0.305 -13.604 1.00 0.00 H new ATOM 0 HG2 LYS A 41 0.172 0.520 -13.849 1.00 0.00 H new ATOM 0 HG3 LYS A 41 0.515 1.941 -12.882 1.00 0.00 H new ATOM 0 HD2 LYS A 41 2.189 2.667 -14.619 1.00 0.00 H new ATOM 0 HD3 LYS A 41 1.725 1.291 -15.600 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -0.439 3.142 -14.620 1.00 0.00 H new ATOM 0 HE3 LYS A 41 0.591 3.687 -15.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -1.376 2.577 -16.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 0.011 1.689 -17.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -0.987 1.161 -15.913 1.00 0.00 H new ATOM 615 N GLN A 42 3.942 -0.364 -10.407 1.00 0.00 N ATOM 616 CA GLN A 42 5.076 -1.140 -9.919 1.00 0.00 C ATOM 617 C GLN A 42 4.765 -1.765 -8.563 1.00 0.00 C ATOM 618 O GLN A 42 5.308 -2.813 -8.212 1.00 0.00 O ATOM 619 CB GLN A 42 6.318 -0.254 -9.812 1.00 0.00 C ATOM 620 CG GLN A 42 6.864 0.193 -11.159 1.00 0.00 C ATOM 621 CD GLN A 42 8.345 0.516 -11.110 1.00 0.00 C ATOM 622 OE1 GLN A 42 9.021 0.236 -10.120 1.00 0.00 O ATOM 623 NE2 GLN A 42 8.857 1.107 -12.183 1.00 0.00 N ATOM 0 H GLN A 42 3.972 0.626 -10.163 1.00 0.00 H new ATOM 0 HA GLN A 42 5.270 -1.941 -10.632 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.076 0.627 -9.217 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.096 -0.797 -9.276 1.00 0.00 H new ATOM 0 HG2 GLN A 42 6.691 -0.592 -11.895 1.00 0.00 H new ATOM 0 HG3 GLN A 42 6.315 1.072 -11.496 1.00 0.00 H new ATOM 0 HE21 GLN A 42 8.259 1.321 -12.981 1.00 0.00 H new ATOM 0 HE22 GLN A 42 9.848 1.347 -12.209 1.00 0.00 H new ATOM 632 N LEU A 43 3.888 -1.116 -7.805 1.00 0.00 N ATOM 633 CA LEU A 43 3.505 -1.608 -6.486 1.00 0.00 C ATOM 634 C LEU A 43 2.421 -2.675 -6.598 1.00 0.00 C ATOM 635 O LEU A 43 2.186 -3.436 -5.659 1.00 0.00 O ATOM 636 CB LEU A 43 3.011 -0.453 -5.613 1.00 0.00 C ATOM 637 CG LEU A 43 3.103 -0.668 -4.102 1.00 0.00 C ATOM 638 CD1 LEU A 43 4.556 -0.735 -3.659 1.00 0.00 C ATOM 639 CD2 LEU A 43 2.369 0.440 -3.360 1.00 0.00 C ATOM 0 H LEU A 43 3.429 -0.248 -8.081 1.00 0.00 H new ATOM 0 HA LEU A 43 4.384 -2.056 -6.022 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.582 0.439 -5.868 1.00 0.00 H new ATOM 0 HB3 LEU A 43 1.971 -0.250 -5.868 1.00 0.00 H new ATOM 0 HG LEU A 43 2.627 -1.618 -3.861 1.00 0.00 H new ATOM 0 HD11 LEU A 43 4.601 -0.888 -2.581 1.00 0.00 H new ATOM 0 HD12 LEU A 43 5.053 -1.563 -4.164 1.00 0.00 H new ATOM 0 HD13 LEU A 43 5.058 0.199 -3.914 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.445 0.271 -2.286 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.816 1.402 -3.608 1.00 0.00 H new ATOM 0 HD23 LEU A 43 1.319 0.441 -3.654 1.00 0.00 H new ATOM 651 N ALA A 44 1.765 -2.727 -7.752 1.00 0.00 N ATOM 652 CA ALA A 44 0.709 -3.704 -7.988 1.00 0.00 C ATOM 653 C ALA A 44 1.183 -5.115 -7.658 1.00 0.00 C ATOM 654 O ALA A 44 0.565 -5.836 -6.874 1.00 0.00 O ATOM 655 CB ALA A 44 0.234 -3.629 -9.432 1.00 0.00 C ATOM 0 H ALA A 44 1.946 -2.104 -8.539 1.00 0.00 H new ATOM 0 HA ALA A 44 -0.126 -3.466 -7.329 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -0.554 -4.364 -9.594 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -0.153 -2.631 -9.636 1.00 0.00 H new ATOM 0 HB3 ALA A 44 1.069 -3.839 -10.101 1.00 0.00 H new ATOM 661 N PRO A 45 2.307 -5.521 -8.269 1.00 0.00 N ATOM 662 CA PRO A 45 2.888 -6.850 -8.055 1.00 0.00 C ATOM 663 C PRO A 45 3.475 -7.007 -6.657 1.00 0.00 C ATOM 664 O PRO A 45 3.206 -7.991 -5.967 1.00 0.00 O ATOM 665 CB PRO A 45 3.994 -6.927 -9.111 1.00 0.00 C ATOM 666 CG PRO A 45 4.362 -5.508 -9.379 1.00 0.00 C ATOM 667 CD PRO A 45 3.095 -4.714 -9.215 1.00 0.00 C ATOM 0 HA PRO A 45 2.142 -7.640 -8.140 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.850 -7.496 -8.747 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.643 -7.423 -10.016 1.00 0.00 H new ATOM 0 HG2 PRO A 45 5.130 -5.166 -8.685 1.00 0.00 H new ATOM 0 HG3 PRO A 45 4.767 -5.393 -10.384 1.00 0.00 H new ATOM 0 HD2 PRO A 45 3.294 -3.716 -8.824 1.00 0.00 H new ATOM 0 HD3 PRO A 45 2.575 -4.586 -10.164 1.00 0.00 H new ATOM 675 N ILE A 46 4.278 -6.032 -6.244 1.00 0.00 N ATOM 676 CA ILE A 46 4.902 -6.063 -4.927 1.00 0.00 C ATOM 677 C ILE A 46 3.853 -6.163 -3.824 1.00 0.00 C ATOM 678 O ILE A 46 4.040 -6.877 -2.839 1.00 0.00 O ATOM 679 CB ILE A 46 5.767 -4.812 -4.684 1.00 0.00 C ATOM 680 CG1 ILE A 46 6.831 -4.681 -5.776 1.00 0.00 C ATOM 681 CG2 ILE A 46 6.416 -4.875 -3.309 1.00 0.00 C ATOM 682 CD1 ILE A 46 7.199 -3.249 -6.093 1.00 0.00 C ATOM 0 H ILE A 46 4.512 -5.211 -6.802 1.00 0.00 H new ATOM 0 HA ILE A 46 5.540 -6.947 -4.901 1.00 0.00 H new ATOM 0 HB ILE A 46 5.125 -3.932 -4.721 1.00 0.00 H new ATOM 0 HG12 ILE A 46 7.727 -5.217 -5.465 1.00 0.00 H new ATOM 0 HG13 ILE A 46 6.470 -5.164 -6.684 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.024 -3.984 -3.152 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.642 -4.925 -2.543 1.00 0.00 H new ATOM 0 HG23 ILE A 46 7.048 -5.761 -3.245 1.00 0.00 H new ATOM 0 HD11 ILE A 46 7.958 -3.233 -6.875 1.00 0.00 H new ATOM 0 HD12 ILE A 46 6.314 -2.713 -6.435 1.00 0.00 H new ATOM 0 HD13 ILE A 46 7.591 -2.767 -5.197 1.00 0.00 H new ATOM 694 N TRP A 47 2.750 -5.445 -3.998 1.00 0.00 N ATOM 695 CA TRP A 47 1.670 -5.455 -3.018 1.00 0.00 C ATOM 696 C TRP A 47 0.917 -6.781 -3.050 1.00 0.00 C ATOM 697 O TRP A 47 0.462 -7.272 -2.017 1.00 0.00 O ATOM 698 CB TRP A 47 0.703 -4.300 -3.283 1.00 0.00 C ATOM 699 CG TRP A 47 -0.195 -3.999 -2.121 1.00 0.00 C ATOM 700 CD1 TRP A 47 -1.555 -4.123 -2.082 1.00 0.00 C ATOM 701 CD2 TRP A 47 0.203 -3.521 -0.831 1.00 0.00 C ATOM 702 NE1 TRP A 47 -2.025 -3.751 -0.846 1.00 0.00 N ATOM 703 CE2 TRP A 47 -0.967 -3.379 -0.060 1.00 0.00 C ATOM 704 CE3 TRP A 47 1.434 -3.202 -0.252 1.00 0.00 C ATOM 705 CZ2 TRP A 47 -0.940 -2.930 1.258 1.00 0.00 C ATOM 706 CZ3 TRP A 47 1.460 -2.756 1.055 1.00 0.00 C ATOM 707 CH2 TRP A 47 0.279 -2.625 1.799 1.00 0.00 C ATOM 0 H TRP A 47 2.580 -4.849 -4.808 1.00 0.00 H new ATOM 0 HA TRP A 47 2.110 -5.332 -2.028 1.00 0.00 H new ATOM 0 HB2 TRP A 47 1.275 -3.406 -3.532 1.00 0.00 H new ATOM 0 HB3 TRP A 47 0.092 -4.540 -4.153 1.00 0.00 H new ATOM 0 HD1 TRP A 47 -2.170 -4.463 -2.902 1.00 0.00 H new ATOM 0 HE1 TRP A 47 -3.004 -3.752 -0.560 1.00 0.00 H new ATOM 0 HE3 TRP A 47 2.349 -3.302 -0.817 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 -1.849 -2.826 1.832 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 2.406 -2.504 1.511 1.00 0.00 H new ATOM 0 HH2 TRP A 47 0.333 -2.276 2.820 1.00 0.00 H new ATOM 718 N ASP A 48 0.791 -7.356 -4.241 1.00 0.00 N ATOM 719 CA ASP A 48 0.095 -8.626 -4.407 1.00 0.00 C ATOM 720 C ASP A 48 0.950 -9.785 -3.902 1.00 0.00 C ATOM 721 O ASP A 48 0.430 -10.814 -3.473 1.00 0.00 O ATOM 722 CB ASP A 48 -0.266 -8.846 -5.877 1.00 0.00 C ATOM 723 CG ASP A 48 -0.443 -10.313 -6.217 1.00 0.00 C ATOM 724 OD1 ASP A 48 -1.339 -10.954 -5.630 1.00 0.00 O ATOM 725 OD2 ASP A 48 0.317 -10.821 -7.069 1.00 0.00 O ATOM 0 H ASP A 48 1.162 -6.962 -5.106 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.821 -8.589 -3.817 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.187 -8.309 -6.106 1.00 0.00 H new ATOM 0 HB3 ASP A 48 0.516 -8.422 -6.507 1.00 0.00 H new ATOM 730 N LYS A 49 2.266 -9.610 -3.958 1.00 0.00 N ATOM 731 CA LYS A 49 3.195 -10.639 -3.506 1.00 0.00 C ATOM 732 C LYS A 49 3.291 -10.656 -1.984 1.00 0.00 C ATOM 733 O LYS A 49 3.586 -11.689 -1.382 1.00 0.00 O ATOM 734 CB LYS A 49 4.581 -10.406 -4.112 1.00 0.00 C ATOM 735 CG LYS A 49 4.675 -10.786 -5.580 1.00 0.00 C ATOM 736 CD LYS A 49 5.699 -9.934 -6.312 1.00 0.00 C ATOM 737 CE LYS A 49 7.114 -10.443 -6.081 1.00 0.00 C ATOM 738 NZ LYS A 49 8.134 -9.522 -6.654 1.00 0.00 N ATOM 0 H LYS A 49 2.713 -8.765 -4.312 1.00 0.00 H new ATOM 0 HA LYS A 49 2.817 -11.605 -3.839 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.845 -9.354 -4.000 1.00 0.00 H new ATOM 0 HB3 LYS A 49 5.316 -10.981 -3.549 1.00 0.00 H new ATOM 0 HG2 LYS A 49 4.946 -11.838 -5.668 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.699 -10.668 -6.051 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.480 -9.937 -7.380 1.00 0.00 H new ATOM 0 HD3 LYS A 49 5.623 -8.901 -5.974 1.00 0.00 H new ATOM 0 HE2 LYS A 49 7.289 -10.558 -5.011 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.223 -11.430 -6.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 9.085 -9.903 -6.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.983 -9.432 -7.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 8.047 -8.587 -6.208 1.00 0.00 H new ATOM 752 N LEU A 50 3.037 -9.507 -1.367 1.00 0.00 N ATOM 753 CA LEU A 50 3.093 -9.390 0.086 1.00 0.00 C ATOM 754 C LEU A 50 1.772 -9.818 0.718 1.00 0.00 C ATOM 755 O LEU A 50 1.752 -10.444 1.777 1.00 0.00 O ATOM 756 CB LEU A 50 3.422 -7.952 0.490 1.00 0.00 C ATOM 757 CG LEU A 50 2.888 -7.497 1.848 1.00 0.00 C ATOM 758 CD1 LEU A 50 3.666 -8.158 2.976 1.00 0.00 C ATOM 759 CD2 LEU A 50 2.956 -5.982 1.968 1.00 0.00 C ATOM 0 H LEU A 50 2.790 -8.643 -1.850 1.00 0.00 H new ATOM 0 HA LEU A 50 3.880 -10.052 0.449 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.506 -7.835 0.491 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.030 -7.282 -0.275 1.00 0.00 H new ATOM 0 HG LEU A 50 1.844 -7.801 1.927 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.272 -7.822 3.935 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.566 -9.241 2.901 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.719 -7.885 2.901 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.572 -5.676 2.941 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.991 -5.655 1.868 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.354 -5.527 1.181 1.00 0.00 H new ATOM 771 N GLY A 51 0.669 -9.478 0.058 1.00 0.00 N ATOM 772 CA GLY A 51 -0.641 -9.837 0.569 1.00 0.00 C ATOM 773 C GLY A 51 -0.813 -11.335 0.723 1.00 0.00 C ATOM 774 O GLY A 51 -1.374 -11.803 1.713 1.00 0.00 O ATOM 0 H GLY A 51 0.659 -8.961 -0.821 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -0.795 -9.356 1.535 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -1.408 -9.454 -0.104 1.00 0.00 H new ATOM 778 N GLU A 52 -0.331 -12.089 -0.261 1.00 0.00 N ATOM 779 CA GLU A 52 -0.437 -13.543 -0.230 1.00 0.00 C ATOM 780 C GLU A 52 0.345 -14.121 0.946 1.00 0.00 C ATOM 781 O GLU A 52 0.003 -15.179 1.475 1.00 0.00 O ATOM 782 CB GLU A 52 0.076 -14.141 -1.542 1.00 0.00 C ATOM 783 CG GLU A 52 1.583 -14.037 -1.710 1.00 0.00 C ATOM 784 CD GLU A 52 2.105 -14.902 -2.841 1.00 0.00 C ATOM 785 OE1 GLU A 52 1.801 -16.113 -2.851 1.00 0.00 O ATOM 786 OE2 GLU A 52 2.818 -14.367 -3.716 1.00 0.00 O ATOM 0 H GLU A 52 0.136 -11.717 -1.088 1.00 0.00 H new ATOM 0 HA GLU A 52 -1.488 -13.803 -0.107 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -0.215 -15.190 -1.592 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -0.410 -13.635 -2.377 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.853 -12.998 -1.898 1.00 0.00 H new ATOM 0 HG3 GLU A 52 2.070 -14.329 -0.780 1.00 0.00 H new ATOM 793 N THR A 53 1.399 -13.419 1.351 1.00 0.00 N ATOM 794 CA THR A 53 2.231 -13.862 2.462 1.00 0.00 C ATOM 795 C THR A 53 1.467 -13.801 3.779 1.00 0.00 C ATOM 796 O THR A 53 1.604 -14.682 4.629 1.00 0.00 O ATOM 797 CB THR A 53 3.508 -13.008 2.582 1.00 0.00 C ATOM 798 OG1 THR A 53 4.321 -13.176 1.416 1.00 0.00 O ATOM 799 CG2 THR A 53 4.303 -13.396 3.820 1.00 0.00 C ATOM 0 H THR A 53 1.696 -12.541 0.926 1.00 0.00 H new ATOM 0 HA THR A 53 2.511 -14.895 2.255 1.00 0.00 H new ATOM 0 HB THR A 53 3.213 -11.963 2.671 1.00 0.00 H new ATOM 0 HG1 THR A 53 3.952 -12.643 0.681 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.200 -12.780 3.884 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.692 -13.240 4.709 1.00 0.00 H new ATOM 0 HG23 THR A 53 4.588 -14.446 3.755 1.00 0.00 H new ATOM 807 N TYR A 54 0.661 -12.758 3.943 1.00 0.00 N ATOM 808 CA TYR A 54 -0.124 -12.582 5.159 1.00 0.00 C ATOM 809 C TYR A 54 -1.617 -12.677 4.861 1.00 0.00 C ATOM 810 O TYR A 54 -2.435 -12.025 5.511 1.00 0.00 O ATOM 811 CB TYR A 54 0.194 -11.233 5.805 1.00 0.00 C ATOM 812 CG TYR A 54 1.668 -11.016 6.061 1.00 0.00 C ATOM 813 CD1 TYR A 54 2.515 -10.592 5.045 1.00 0.00 C ATOM 814 CD2 TYR A 54 2.214 -11.235 7.320 1.00 0.00 C ATOM 815 CE1 TYR A 54 3.863 -10.394 5.274 1.00 0.00 C ATOM 816 CE2 TYR A 54 3.561 -11.038 7.559 1.00 0.00 C ATOM 817 CZ TYR A 54 4.381 -10.618 6.533 1.00 0.00 C ATOM 818 OH TYR A 54 5.723 -10.420 6.765 1.00 0.00 O ATOM 0 H TYR A 54 0.534 -12.021 3.249 1.00 0.00 H new ATOM 0 HA TYR A 54 0.141 -13.380 5.852 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.175 -10.435 5.161 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.345 -11.156 6.749 1.00 0.00 H new ATOM 0 HD1 TYR A 54 2.113 -10.414 4.059 1.00 0.00 H new ATOM 0 HD2 TYR A 54 1.575 -11.565 8.126 1.00 0.00 H new ATOM 0 HE1 TYR A 54 4.508 -10.066 4.472 1.00 0.00 H new ATOM 0 HE2 TYR A 54 3.969 -11.212 8.544 1.00 0.00 H new ATOM 0 HH TYR A 54 5.926 -10.621 7.703 1.00 0.00 H new ATOM 828 N LYS A 55 -1.966 -13.494 3.873 1.00 0.00 N ATOM 829 CA LYS A 55 -3.361 -13.678 3.488 1.00 0.00 C ATOM 830 C LYS A 55 -4.082 -14.590 4.475 1.00 0.00 C ATOM 831 O LYS A 55 -5.287 -14.457 4.692 1.00 0.00 O ATOM 832 CB LYS A 55 -3.448 -14.265 2.078 1.00 0.00 C ATOM 833 CG LYS A 55 -3.091 -15.739 2.009 1.00 0.00 C ATOM 834 CD LYS A 55 -2.995 -16.224 0.572 1.00 0.00 C ATOM 835 CE LYS A 55 -2.017 -17.381 0.438 1.00 0.00 C ATOM 836 NZ LYS A 55 -2.577 -18.646 0.989 1.00 0.00 N ATOM 0 H LYS A 55 -1.302 -14.040 3.324 1.00 0.00 H new ATOM 0 HA LYS A 55 -3.847 -12.703 3.500 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -4.460 -14.127 1.698 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.782 -13.707 1.420 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -2.140 -15.908 2.515 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -3.843 -16.322 2.541 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -3.980 -16.537 0.226 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -2.678 -15.402 -0.070 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -1.764 -17.523 -0.613 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -1.091 -17.136 0.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -1.881 -19.411 0.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -2.795 -18.519 1.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -3.447 -18.893 0.475 1.00 0.00 H new ATOM 850 N ASP A 56 -3.338 -15.515 5.072 1.00 0.00 N ATOM 851 CA ASP A 56 -3.906 -16.447 6.038 1.00 0.00 C ATOM 852 C ASP A 56 -3.287 -16.245 7.418 1.00 0.00 C ATOM 853 O ASP A 56 -3.274 -17.158 8.244 1.00 0.00 O ATOM 854 CB ASP A 56 -3.691 -17.889 5.575 1.00 0.00 C ATOM 855 CG ASP A 56 -4.375 -18.895 6.479 1.00 0.00 C ATOM 856 OD1 ASP A 56 -5.623 -18.941 6.478 1.00 0.00 O ATOM 857 OD2 ASP A 56 -3.663 -19.637 7.189 1.00 0.00 O ATOM 0 H ASP A 56 -2.340 -15.639 4.903 1.00 0.00 H new ATOM 0 HA ASP A 56 -4.976 -16.252 6.108 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -4.069 -18.002 4.559 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -2.622 -18.102 5.543 1.00 0.00 H new ATOM 862 N HIS A 57 -2.773 -15.043 7.659 1.00 0.00 N ATOM 863 CA HIS A 57 -2.151 -14.721 8.939 1.00 0.00 C ATOM 864 C HIS A 57 -3.183 -14.735 10.063 1.00 0.00 C ATOM 865 O HIS A 57 -4.342 -15.088 9.849 1.00 0.00 O ATOM 866 CB HIS A 57 -1.473 -13.352 8.870 1.00 0.00 C ATOM 867 CG HIS A 57 -0.183 -13.284 9.628 1.00 0.00 C ATOM 868 ND1 HIS A 57 -0.101 -12.859 10.937 1.00 0.00 N ATOM 869 CD2 HIS A 57 1.081 -13.592 9.254 1.00 0.00 C ATOM 870 CE1 HIS A 57 1.158 -12.906 11.335 1.00 0.00 C ATOM 871 NE2 HIS A 57 1.895 -13.349 10.332 1.00 0.00 N ATOM 0 H HIS A 57 -2.775 -14.277 6.986 1.00 0.00 H new ATOM 0 HA HIS A 57 -1.398 -15.481 9.151 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -1.285 -13.101 7.826 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -2.155 -12.598 9.262 1.00 0.00 H new ATOM 0 HD2 HIS A 57 1.391 -13.960 8.287 1.00 0.00 H new ATOM 0 HE1 HIS A 57 1.522 -12.629 12.313 1.00 0.00 H new ATOM 0 HE2 HIS A 57 2.905 -13.488 10.355 1.00 0.00 H new ATOM 880 N GLU A 58 -2.752 -14.349 11.260 1.00 0.00 N ATOM 881 CA GLU A 58 -3.638 -14.319 12.417 1.00 0.00 C ATOM 882 C GLU A 58 -4.084 -12.893 12.725 1.00 0.00 C ATOM 883 O GLU A 58 -5.271 -12.629 12.913 1.00 0.00 O ATOM 884 CB GLU A 58 -2.940 -14.922 13.638 1.00 0.00 C ATOM 885 CG GLU A 58 -1.848 -14.036 14.214 1.00 0.00 C ATOM 886 CD GLU A 58 -0.969 -14.766 15.210 1.00 0.00 C ATOM 887 OE1 GLU A 58 -1.398 -14.930 16.371 1.00 0.00 O ATOM 888 OE2 GLU A 58 0.148 -15.174 14.829 1.00 0.00 O ATOM 0 H GLU A 58 -1.795 -14.053 11.453 1.00 0.00 H new ATOM 0 HA GLU A 58 -4.520 -14.914 12.181 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -3.683 -15.118 14.411 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.508 -15.883 13.361 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.230 -13.653 13.402 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.304 -13.174 14.701 1.00 0.00 H new ATOM 895 N ASN A 59 -3.122 -11.977 12.775 1.00 0.00 N ATOM 896 CA ASN A 59 -3.414 -10.577 13.061 1.00 0.00 C ATOM 897 C ASN A 59 -3.050 -9.691 11.873 1.00 0.00 C ATOM 898 O ASN A 59 -3.640 -8.629 11.674 1.00 0.00 O ATOM 899 CB ASN A 59 -2.652 -10.119 14.305 1.00 0.00 C ATOM 900 CG ASN A 59 -1.153 -10.068 14.079 1.00 0.00 C ATOM 901 OD1 ASN A 59 -0.629 -9.096 13.534 1.00 0.00 O ATOM 902 ND2 ASN A 59 -0.456 -11.118 14.497 1.00 0.00 N ATOM 0 H ASN A 59 -2.134 -12.179 12.621 1.00 0.00 H new ATOM 0 HA ASN A 59 -4.484 -10.486 13.245 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.006 -9.132 14.601 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.869 -10.796 15.131 1.00 0.00 H new ATOM 0 HD21 ASN A 59 0.556 -11.141 14.372 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.933 -11.901 14.944 1.00 0.00 H new ATOM 909 N ILE A 60 -2.075 -10.137 11.087 1.00 0.00 N ATOM 910 CA ILE A 60 -1.634 -9.386 9.918 1.00 0.00 C ATOM 911 C ILE A 60 -2.550 -9.637 8.725 1.00 0.00 C ATOM 912 O ILE A 60 -2.668 -10.765 8.245 1.00 0.00 O ATOM 913 CB ILE A 60 -0.189 -9.751 9.527 1.00 0.00 C ATOM 914 CG1 ILE A 60 0.734 -9.640 10.742 1.00 0.00 C ATOM 915 CG2 ILE A 60 0.298 -8.852 8.401 1.00 0.00 C ATOM 916 CD1 ILE A 60 2.186 -9.925 10.426 1.00 0.00 C ATOM 0 H ILE A 60 -1.576 -11.014 11.239 1.00 0.00 H new ATOM 0 HA ILE A 60 -1.674 -8.331 10.188 1.00 0.00 H new ATOM 0 HB ILE A 60 -0.173 -10.782 9.175 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.652 -8.637 11.160 1.00 0.00 H new ATOM 0 HG13 ILE A 60 0.395 -10.335 11.511 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.320 -9.122 8.136 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.347 -8.976 7.531 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.270 -7.812 8.728 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.782 -9.828 11.334 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.281 -10.938 10.036 1.00 0.00 H new ATOM 0 HD13 ILE A 60 2.542 -9.214 9.680 1.00 0.00 H new ATOM 928 N VAL A 61 -3.196 -8.577 8.249 1.00 0.00 N ATOM 929 CA VAL A 61 -4.100 -8.681 7.110 1.00 0.00 C ATOM 930 C VAL A 61 -3.830 -7.579 6.092 1.00 0.00 C ATOM 931 O VAL A 61 -4.117 -6.408 6.340 1.00 0.00 O ATOM 932 CB VAL A 61 -5.573 -8.606 7.553 1.00 0.00 C ATOM 933 CG1 VAL A 61 -6.447 -8.094 6.419 1.00 0.00 C ATOM 934 CG2 VAL A 61 -6.054 -9.966 8.036 1.00 0.00 C ATOM 0 H VAL A 61 -3.110 -7.637 8.635 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.917 -9.651 6.648 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.649 -7.904 8.383 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -7.484 -8.048 6.751 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.116 -7.098 6.125 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.369 -8.768 5.566 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -7.097 -9.894 8.345 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -5.964 -10.692 7.228 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -5.446 -10.288 8.882 1.00 0.00 H new ATOM 944 N ILE A 62 -3.277 -7.962 4.946 1.00 0.00 N ATOM 945 CA ILE A 62 -2.970 -7.006 3.889 1.00 0.00 C ATOM 946 C ILE A 62 -4.219 -6.653 3.088 1.00 0.00 C ATOM 947 O ILE A 62 -5.067 -7.507 2.832 1.00 0.00 O ATOM 948 CB ILE A 62 -1.896 -7.553 2.931 1.00 0.00 C ATOM 949 CG1 ILE A 62 -0.626 -7.912 3.705 1.00 0.00 C ATOM 950 CG2 ILE A 62 -1.589 -6.534 1.843 1.00 0.00 C ATOM 951 CD1 ILE A 62 0.051 -6.719 4.342 1.00 0.00 C ATOM 0 H ILE A 62 -3.032 -8.927 4.726 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.588 -6.108 4.375 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.279 -8.457 2.458 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -0.876 -8.635 4.481 1.00 0.00 H new ATOM 0 HG13 ILE A 62 0.076 -8.400 3.029 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -0.828 -6.935 1.173 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -2.496 -6.322 1.276 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.223 -5.614 2.299 1.00 0.00 H new ATOM 0 HD11 ILE A 62 0.944 -7.048 4.874 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.332 -6.004 3.569 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -0.634 -6.243 5.044 1.00 0.00 H new ATOM 963 N ALA A 63 -4.323 -5.388 2.693 1.00 0.00 N ATOM 964 CA ALA A 63 -5.465 -4.923 1.916 1.00 0.00 C ATOM 965 C ALA A 63 -5.074 -3.764 1.005 1.00 0.00 C ATOM 966 O ALA A 63 -4.164 -2.996 1.316 1.00 0.00 O ATOM 967 CB ALA A 63 -6.599 -4.508 2.843 1.00 0.00 C ATOM 0 H ALA A 63 -3.631 -4.668 2.898 1.00 0.00 H new ATOM 0 HA ALA A 63 -5.805 -5.746 1.288 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.446 -4.163 2.250 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.904 -5.361 3.449 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.260 -3.703 3.495 1.00 0.00 H new ATOM 973 N LYS A 64 -5.767 -3.645 -0.122 1.00 0.00 N ATOM 974 CA LYS A 64 -5.493 -2.580 -1.080 1.00 0.00 C ATOM 975 C LYS A 64 -6.763 -1.800 -1.405 1.00 0.00 C ATOM 976 O LYS A 64 -7.840 -2.380 -1.545 1.00 0.00 O ATOM 977 CB LYS A 64 -4.897 -3.161 -2.364 1.00 0.00 C ATOM 978 CG LYS A 64 -5.900 -3.930 -3.207 1.00 0.00 C ATOM 979 CD LYS A 64 -5.333 -4.273 -4.574 1.00 0.00 C ATOM 980 CE LYS A 64 -6.363 -4.976 -5.444 1.00 0.00 C ATOM 981 NZ LYS A 64 -5.733 -5.656 -6.610 1.00 0.00 N ATOM 0 H LYS A 64 -6.523 -4.273 -0.395 1.00 0.00 H new ATOM 0 HA LYS A 64 -4.773 -1.897 -0.629 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -4.480 -2.350 -2.961 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -4.071 -3.823 -2.104 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -6.184 -4.846 -2.690 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -6.807 -3.337 -3.327 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -4.998 -3.362 -5.069 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -4.458 -4.912 -4.456 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -6.905 -5.709 -4.846 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -7.095 -4.250 -5.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -6.468 -6.123 -7.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.237 -4.954 -7.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -5.053 -6.367 -6.272 1.00 0.00 H new ATOM 995 N MET A 65 -6.630 -0.483 -1.524 1.00 0.00 N ATOM 996 CA MET A 65 -7.767 0.375 -1.835 1.00 0.00 C ATOM 997 C MET A 65 -7.382 1.438 -2.859 1.00 0.00 C ATOM 998 O MET A 65 -6.264 1.952 -2.844 1.00 0.00 O ATOM 999 CB MET A 65 -8.292 1.043 -0.562 1.00 0.00 C ATOM 1000 CG MET A 65 -9.696 1.608 -0.707 1.00 0.00 C ATOM 1001 SD MET A 65 -10.425 2.071 0.875 1.00 0.00 S ATOM 1002 CE MET A 65 -10.875 3.775 0.555 1.00 0.00 C ATOM 0 H MET A 65 -5.746 0.013 -1.410 1.00 0.00 H new ATOM 0 HA MET A 65 -8.554 -0.247 -2.262 1.00 0.00 H new ATOM 0 HB2 MET A 65 -8.284 0.316 0.250 1.00 0.00 H new ATOM 0 HB3 MET A 65 -7.613 1.847 -0.277 1.00 0.00 H new ATOM 0 HG2 MET A 65 -9.666 2.481 -1.358 1.00 0.00 H new ATOM 0 HG3 MET A 65 -10.332 0.869 -1.193 1.00 0.00 H new ATOM 0 HE1 MET A 65 -11.002 4.302 1.501 1.00 0.00 H new ATOM 0 HE2 MET A 65 -10.088 4.256 -0.025 1.00 0.00 H new ATOM 0 HE3 MET A 65 -11.809 3.805 -0.006 1.00 0.00 H new ATOM 1012 N ASP A 66 -8.315 1.761 -3.748 1.00 0.00 N ATOM 1013 CA ASP A 66 -8.074 2.763 -4.780 1.00 0.00 C ATOM 1014 C ASP A 66 -8.602 4.127 -4.347 1.00 0.00 C ATOM 1015 O ASP A 66 -9.792 4.414 -4.481 1.00 0.00 O ATOM 1016 CB ASP A 66 -8.731 2.341 -6.094 1.00 0.00 C ATOM 1017 CG ASP A 66 -8.266 3.179 -7.269 1.00 0.00 C ATOM 1018 OD1 ASP A 66 -7.437 4.089 -7.058 1.00 0.00 O ATOM 1019 OD2 ASP A 66 -8.729 2.923 -8.400 1.00 0.00 O ATOM 0 H ASP A 66 -9.245 1.343 -3.775 1.00 0.00 H new ATOM 0 HA ASP A 66 -6.997 2.842 -4.931 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -8.507 1.292 -6.288 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -9.814 2.423 -5.998 1.00 0.00 H new ATOM 1024 N SER A 67 -7.710 4.964 -3.826 1.00 0.00 N ATOM 1025 CA SER A 67 -8.088 6.296 -3.369 1.00 0.00 C ATOM 1026 C SER A 67 -8.783 7.075 -4.481 1.00 0.00 C ATOM 1027 O SER A 67 -9.684 7.875 -4.225 1.00 0.00 O ATOM 1028 CB SER A 67 -6.854 7.062 -2.888 1.00 0.00 C ATOM 1029 OG SER A 67 -7.193 7.991 -1.874 1.00 0.00 O ATOM 0 H SER A 67 -6.721 4.743 -3.710 1.00 0.00 H new ATOM 0 HA SER A 67 -8.784 6.184 -2.538 1.00 0.00 H new ATOM 0 HB2 SER A 67 -6.112 6.360 -2.509 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.397 7.586 -3.728 1.00 0.00 H new ATOM 0 HG SER A 67 -6.690 8.821 -2.009 1.00 0.00 H new ATOM 1035 N THR A 68 -8.358 6.836 -5.718 1.00 0.00 N ATOM 1036 CA THR A 68 -8.938 7.515 -6.869 1.00 0.00 C ATOM 1037 C THR A 68 -10.331 6.980 -7.179 1.00 0.00 C ATOM 1038 O THR A 68 -11.146 7.665 -7.798 1.00 0.00 O ATOM 1039 CB THR A 68 -8.051 7.359 -8.119 1.00 0.00 C ATOM 1040 OG1 THR A 68 -8.370 6.138 -8.797 1.00 0.00 O ATOM 1041 CG2 THR A 68 -6.577 7.364 -7.741 1.00 0.00 C ATOM 0 H THR A 68 -7.614 6.177 -5.948 1.00 0.00 H new ATOM 0 HA THR A 68 -9.007 8.572 -6.611 1.00 0.00 H new ATOM 0 HB THR A 68 -8.243 8.203 -8.781 1.00 0.00 H new ATOM 0 HG1 THR A 68 -8.163 5.377 -8.215 1.00 0.00 H new ATOM 0 HG21 THR A 68 -5.971 7.253 -8.640 1.00 0.00 H new ATOM 0 HG22 THR A 68 -6.330 8.306 -7.251 1.00 0.00 H new ATOM 0 HG23 THR A 68 -6.373 6.537 -7.061 1.00 0.00 H new ATOM 1049 N ALA A 69 -10.599 5.753 -6.745 1.00 0.00 N ATOM 1050 CA ALA A 69 -11.896 5.128 -6.974 1.00 0.00 C ATOM 1051 C ALA A 69 -12.721 5.091 -5.692 1.00 0.00 C ATOM 1052 O ALA A 69 -13.917 4.802 -5.721 1.00 0.00 O ATOM 1053 CB ALA A 69 -11.713 3.722 -7.527 1.00 0.00 C ATOM 0 H ALA A 69 -9.935 5.172 -6.233 1.00 0.00 H new ATOM 0 HA ALA A 69 -12.437 5.727 -7.706 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -12.689 3.267 -7.693 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -11.169 3.770 -8.471 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -11.149 3.121 -6.814 1.00 0.00 H new ATOM 1059 N ASN A 70 -12.075 5.385 -4.569 1.00 0.00 N ATOM 1060 CA ASN A 70 -12.750 5.385 -3.276 1.00 0.00 C ATOM 1061 C ASN A 70 -12.075 6.353 -2.309 1.00 0.00 C ATOM 1062 O ASN A 70 -11.000 6.070 -1.782 1.00 0.00 O ATOM 1063 CB ASN A 70 -12.757 3.975 -2.682 1.00 0.00 C ATOM 1064 CG ASN A 70 -13.220 2.929 -3.678 1.00 0.00 C ATOM 1065 OD1 ASN A 70 -14.418 2.751 -3.895 1.00 0.00 O ATOM 1066 ND2 ASN A 70 -12.269 2.232 -4.289 1.00 0.00 N ATOM 0 H ASN A 70 -11.085 5.626 -4.528 1.00 0.00 H new ATOM 0 HA ASN A 70 -13.778 5.713 -3.431 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -11.754 3.725 -2.336 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -13.409 3.955 -1.809 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -12.520 1.515 -4.970 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -11.288 2.414 -4.078 1.00 0.00 H new ATOM 1073 N GLU A 71 -12.716 7.495 -2.081 1.00 0.00 N ATOM 1074 CA GLU A 71 -12.177 8.505 -1.178 1.00 0.00 C ATOM 1075 C GLU A 71 -12.847 8.425 0.190 1.00 0.00 C ATOM 1076 O GLU A 71 -14.068 8.308 0.290 1.00 0.00 O ATOM 1077 CB GLU A 71 -12.367 9.904 -1.769 1.00 0.00 C ATOM 1078 CG GLU A 71 -11.297 10.895 -1.344 1.00 0.00 C ATOM 1079 CD GLU A 71 -11.047 11.968 -2.386 1.00 0.00 C ATOM 1080 OE1 GLU A 71 -12.033 12.524 -2.914 1.00 0.00 O ATOM 1081 OE2 GLU A 71 -9.865 12.250 -2.674 1.00 0.00 O ATOM 0 H GLU A 71 -13.608 7.744 -2.509 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.111 8.312 -1.054 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -12.372 9.832 -2.857 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -13.343 10.286 -1.470 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.595 11.366 -0.407 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.368 10.359 -1.150 1.00 0.00 H new ATOM 1088 N VAL A 72 -12.038 8.487 1.244 1.00 0.00 N ATOM 1089 CA VAL A 72 -12.552 8.422 2.607 1.00 0.00 C ATOM 1090 C VAL A 72 -11.925 9.501 3.482 1.00 0.00 C ATOM 1091 O VAL A 72 -10.729 9.773 3.387 1.00 0.00 O ATOM 1092 CB VAL A 72 -12.286 7.043 3.241 1.00 0.00 C ATOM 1093 CG1 VAL A 72 -13.241 6.003 2.676 1.00 0.00 C ATOM 1094 CG2 VAL A 72 -10.840 6.626 3.022 1.00 0.00 C ATOM 0 H VAL A 72 -11.024 8.582 1.180 1.00 0.00 H new ATOM 0 HA VAL A 72 -13.628 8.586 2.549 1.00 0.00 H new ATOM 0 HB VAL A 72 -12.460 7.116 4.315 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -13.038 5.035 3.135 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -14.268 6.298 2.890 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -13.102 5.929 1.597 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -10.670 5.650 3.476 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -10.636 6.569 1.953 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -10.176 7.360 3.480 1.00 0.00 H new ATOM 1104 N GLU A 73 -12.741 10.112 4.335 1.00 0.00 N ATOM 1105 CA GLU A 73 -12.266 11.162 5.228 1.00 0.00 C ATOM 1106 C GLU A 73 -11.440 10.574 6.369 1.00 0.00 C ATOM 1107 O GLU A 73 -10.605 11.257 6.961 1.00 0.00 O ATOM 1108 CB GLU A 73 -13.446 11.954 5.794 1.00 0.00 C ATOM 1109 CG GLU A 73 -14.253 11.189 6.829 1.00 0.00 C ATOM 1110 CD GLU A 73 -15.706 11.618 6.871 1.00 0.00 C ATOM 1111 OE1 GLU A 73 -15.962 12.839 6.942 1.00 0.00 O ATOM 1112 OE2 GLU A 73 -16.588 10.735 6.832 1.00 0.00 O ATOM 0 H GLU A 73 -13.734 9.898 4.426 1.00 0.00 H new ATOM 0 HA GLU A 73 -11.630 11.834 4.651 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -13.073 12.874 6.244 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -14.104 12.244 4.975 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -14.199 10.123 6.610 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -13.807 11.335 7.813 1.00 0.00 H new ATOM 1119 N ALA A 74 -11.682 9.302 6.672 1.00 0.00 N ATOM 1120 CA ALA A 74 -10.960 8.621 7.740 1.00 0.00 C ATOM 1121 C ALA A 74 -9.483 8.469 7.394 1.00 0.00 C ATOM 1122 O ALA A 74 -8.688 8.010 8.214 1.00 0.00 O ATOM 1123 CB ALA A 74 -11.584 7.261 8.013 1.00 0.00 C ATOM 0 H ALA A 74 -12.372 8.723 6.193 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.033 9.230 8.641 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -11.036 6.763 8.812 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -12.624 7.391 8.313 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.540 6.653 7.110 1.00 0.00 H new ATOM 1129 N VAL A 75 -9.122 8.856 6.175 1.00 0.00 N ATOM 1130 CA VAL A 75 -7.740 8.762 5.720 1.00 0.00 C ATOM 1131 C VAL A 75 -7.439 9.811 4.657 1.00 0.00 C ATOM 1132 O VAL A 75 -8.118 9.887 3.633 1.00 0.00 O ATOM 1133 CB VAL A 75 -7.430 7.365 5.150 1.00 0.00 C ATOM 1134 CG1 VAL A 75 -6.161 7.400 4.311 1.00 0.00 C ATOM 1135 CG2 VAL A 75 -7.308 6.347 6.274 1.00 0.00 C ATOM 0 H VAL A 75 -9.768 9.238 5.484 1.00 0.00 H new ATOM 0 HA VAL A 75 -7.108 8.939 6.590 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.255 7.063 4.505 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.958 6.404 3.917 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.291 8.098 3.484 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.324 7.723 4.930 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.089 5.365 5.854 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.502 6.642 6.946 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -8.245 6.303 6.829 1.00 0.00 H new ATOM 1145 N LYS A 76 -6.415 10.621 4.905 1.00 0.00 N ATOM 1146 CA LYS A 76 -6.020 11.666 3.968 1.00 0.00 C ATOM 1147 C LYS A 76 -4.874 11.195 3.078 1.00 0.00 C ATOM 1148 O LYS A 76 -3.832 10.761 3.569 1.00 0.00 O ATOM 1149 CB LYS A 76 -5.605 12.929 4.727 1.00 0.00 C ATOM 1150 CG LYS A 76 -6.743 13.579 5.495 1.00 0.00 C ATOM 1151 CD LYS A 76 -7.743 14.238 4.560 1.00 0.00 C ATOM 1152 CE LYS A 76 -9.107 14.384 5.216 1.00 0.00 C ATOM 1153 NZ LYS A 76 -9.821 13.080 5.307 1.00 0.00 N ATOM 0 H LYS A 76 -5.843 10.573 5.748 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.877 11.895 3.335 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -4.805 12.678 5.423 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.197 13.650 4.019 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -7.250 12.828 6.100 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -6.341 14.324 6.182 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -7.374 15.220 4.264 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -7.837 13.645 3.650 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -8.987 14.803 6.215 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -9.711 15.090 4.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -10.846 13.239 5.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -9.507 12.458 4.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -9.609 12.631 6.221 1.00 0.00 H new ATOM 1167 N VAL A 77 -5.074 11.286 1.767 1.00 0.00 N ATOM 1168 CA VAL A 77 -4.056 10.872 0.809 1.00 0.00 C ATOM 1169 C VAL A 77 -3.888 11.908 -0.297 1.00 0.00 C ATOM 1170 O VAL A 77 -4.692 11.974 -1.227 1.00 0.00 O ATOM 1171 CB VAL A 77 -4.403 9.512 0.175 1.00 0.00 C ATOM 1172 CG1 VAL A 77 -3.207 8.954 -0.582 1.00 0.00 C ATOM 1173 CG2 VAL A 77 -4.875 8.533 1.239 1.00 0.00 C ATOM 0 H VAL A 77 -5.931 11.643 1.344 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.121 10.780 1.361 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.216 9.660 -0.536 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.472 7.993 -1.023 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.920 9.649 -1.371 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -2.372 8.820 0.105 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.116 7.577 0.773 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.085 8.388 1.976 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.763 8.931 1.731 1.00 0.00 H new ATOM 1183 N HIS A 78 -2.838 12.716 -0.189 1.00 0.00 N ATOM 1184 CA HIS A 78 -2.563 13.749 -1.181 1.00 0.00 C ATOM 1185 C HIS A 78 -1.388 13.351 -2.069 1.00 0.00 C ATOM 1186 O HIS A 78 -0.665 14.207 -2.578 1.00 0.00 O ATOM 1187 CB HIS A 78 -2.268 15.082 -0.492 1.00 0.00 C ATOM 1188 CG HIS A 78 -3.238 15.419 0.599 1.00 0.00 C ATOM 1189 ND1 HIS A 78 -4.602 15.269 0.467 1.00 0.00 N ATOM 1190 CD2 HIS A 78 -3.033 15.901 1.847 1.00 0.00 C ATOM 1191 CE1 HIS A 78 -5.195 15.645 1.586 1.00 0.00 C ATOM 1192 NE2 HIS A 78 -4.265 16.033 2.440 1.00 0.00 N ATOM 0 H HIS A 78 -2.164 12.675 0.575 1.00 0.00 H new ATOM 0 HA HIS A 78 -3.448 13.860 -1.808 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -1.261 15.051 -0.075 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -2.281 15.878 -1.237 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -2.079 16.138 2.293 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -6.259 15.637 1.771 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -4.434 16.375 3.386 1.00 0.00 H new ATOM 1201 N SER A 79 -1.204 12.047 -2.249 1.00 0.00 N ATOM 1202 CA SER A 79 -0.114 11.536 -3.072 1.00 0.00 C ATOM 1203 C SER A 79 -0.214 10.021 -3.225 1.00 0.00 C ATOM 1204 O SER A 79 -1.057 9.377 -2.602 1.00 0.00 O ATOM 1205 CB SER A 79 1.236 11.910 -2.457 1.00 0.00 C ATOM 1206 OG SER A 79 1.553 11.061 -1.367 1.00 0.00 O ATOM 0 H SER A 79 -1.795 11.326 -1.836 1.00 0.00 H new ATOM 0 HA SER A 79 -0.193 11.990 -4.060 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.016 11.840 -3.215 1.00 0.00 H new ATOM 0 HB3 SER A 79 1.211 12.946 -2.120 1.00 0.00 H new ATOM 0 HG SER A 79 2.421 11.320 -0.993 1.00 0.00 H new ATOM 1212 N PHE A 80 0.654 9.459 -4.060 1.00 0.00 N ATOM 1213 CA PHE A 80 0.665 8.020 -4.297 1.00 0.00 C ATOM 1214 C PHE A 80 1.980 7.584 -4.936 1.00 0.00 C ATOM 1215 O PHE A 80 2.636 8.344 -5.649 1.00 0.00 O ATOM 1216 CB PHE A 80 -0.508 7.622 -5.196 1.00 0.00 C ATOM 1217 CG PHE A 80 -1.779 8.358 -4.884 1.00 0.00 C ATOM 1218 CD1 PHE A 80 -2.038 9.593 -5.457 1.00 0.00 C ATOM 1219 CD2 PHE A 80 -2.715 7.816 -4.018 1.00 0.00 C ATOM 1220 CE1 PHE A 80 -3.207 10.273 -5.171 1.00 0.00 C ATOM 1221 CE2 PHE A 80 -3.886 8.491 -3.729 1.00 0.00 C ATOM 1222 CZ PHE A 80 -4.133 9.721 -4.307 1.00 0.00 C ATOM 0 H PHE A 80 1.359 9.978 -4.584 1.00 0.00 H new ATOM 0 HA PHE A 80 0.565 7.517 -3.335 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -0.237 7.806 -6.236 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -0.684 6.551 -5.097 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -1.319 10.029 -6.134 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -2.527 6.855 -3.563 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -3.396 11.235 -5.623 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -4.607 8.057 -3.052 1.00 0.00 H new ATOM 0 HZ PHE A 80 -5.048 10.250 -4.084 1.00 0.00 H new ATOM 1232 N PRO A 81 2.377 6.330 -4.673 1.00 0.00 N ATOM 1233 CA PRO A 81 1.606 5.416 -3.825 1.00 0.00 C ATOM 1234 C PRO A 81 1.623 5.833 -2.359 1.00 0.00 C ATOM 1235 O PRO A 81 2.609 6.389 -1.871 1.00 0.00 O ATOM 1236 CB PRO A 81 2.319 4.074 -4.009 1.00 0.00 C ATOM 1237 CG PRO A 81 3.713 4.435 -4.388 1.00 0.00 C ATOM 1238 CD PRO A 81 3.610 5.707 -5.184 1.00 0.00 C ATOM 0 HA PRO A 81 0.552 5.395 -4.102 1.00 0.00 H new ATOM 0 HB2 PRO A 81 2.298 3.485 -3.092 1.00 0.00 H new ATOM 0 HB3 PRO A 81 1.841 3.474 -4.784 1.00 0.00 H new ATOM 0 HG2 PRO A 81 4.333 4.578 -3.503 1.00 0.00 H new ATOM 0 HG3 PRO A 81 4.175 3.643 -4.977 1.00 0.00 H new ATOM 0 HD2 PRO A 81 4.478 6.348 -5.031 1.00 0.00 H new ATOM 0 HD3 PRO A 81 3.546 5.508 -6.254 1.00 0.00 H new ATOM 1246 N THR A 82 0.527 5.561 -1.657 1.00 0.00 N ATOM 1247 CA THR A 82 0.416 5.908 -0.246 1.00 0.00 C ATOM 1248 C THR A 82 0.048 4.690 0.592 1.00 0.00 C ATOM 1249 O THR A 82 -0.991 4.065 0.375 1.00 0.00 O ATOM 1250 CB THR A 82 -0.635 7.011 -0.020 1.00 0.00 C ATOM 1251 OG1 THR A 82 -0.193 8.238 -0.609 1.00 0.00 O ATOM 1252 CG2 THR A 82 -0.891 7.218 1.465 1.00 0.00 C ATOM 0 H THR A 82 -0.297 5.101 -2.044 1.00 0.00 H new ATOM 0 HA THR A 82 1.392 6.278 0.067 1.00 0.00 H new ATOM 0 HB THR A 82 -1.566 6.697 -0.493 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.657 8.378 -1.461 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.637 8.002 1.600 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.257 6.290 1.904 1.00 0.00 H new ATOM 0 HG23 THR A 82 0.037 7.511 1.957 1.00 0.00 H new ATOM 1260 N LEU A 83 0.904 4.357 1.552 1.00 0.00 N ATOM 1261 CA LEU A 83 0.667 3.213 2.425 1.00 0.00 C ATOM 1262 C LEU A 83 0.372 3.668 3.851 1.00 0.00 C ATOM 1263 O LEU A 83 0.985 4.609 4.354 1.00 0.00 O ATOM 1264 CB LEU A 83 1.880 2.281 2.417 1.00 0.00 C ATOM 1265 CG LEU A 83 2.348 1.800 1.042 1.00 0.00 C ATOM 1266 CD1 LEU A 83 3.585 0.927 1.174 1.00 0.00 C ATOM 1267 CD2 LEU A 83 1.232 1.045 0.334 1.00 0.00 C ATOM 0 H LEU A 83 1.768 4.863 1.745 1.00 0.00 H new ATOM 0 HA LEU A 83 -0.202 2.673 2.048 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.710 2.794 2.902 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.646 1.407 3.025 1.00 0.00 H new ATOM 0 HG LEU A 83 2.608 2.672 0.442 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.903 0.595 0.186 1.00 0.00 H new ATOM 0 HD12 LEU A 83 4.387 1.500 1.639 1.00 0.00 H new ATOM 0 HD13 LEU A 83 3.354 0.059 1.792 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.582 0.710 -0.642 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.941 0.181 0.931 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.372 1.703 0.205 1.00 0.00 H new ATOM 1279 N LYS A 84 -0.571 2.991 4.499 1.00 0.00 N ATOM 1280 CA LYS A 84 -0.947 3.322 5.868 1.00 0.00 C ATOM 1281 C LYS A 84 -1.202 2.058 6.683 1.00 0.00 C ATOM 1282 O LYS A 84 -2.021 1.220 6.306 1.00 0.00 O ATOM 1283 CB LYS A 84 -2.195 4.208 5.876 1.00 0.00 C ATOM 1284 CG LYS A 84 -2.048 5.473 5.048 1.00 0.00 C ATOM 1285 CD LYS A 84 -2.873 6.613 5.621 1.00 0.00 C ATOM 1286 CE LYS A 84 -2.828 7.840 4.723 1.00 0.00 C ATOM 1287 NZ LYS A 84 -3.107 9.092 5.479 1.00 0.00 N ATOM 0 H LYS A 84 -1.089 2.209 4.097 1.00 0.00 H new ATOM 0 HA LYS A 84 -0.120 3.866 6.324 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.041 3.633 5.499 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -2.429 4.482 6.905 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.998 5.765 5.011 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -2.360 5.276 4.022 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -3.906 6.289 5.745 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -2.499 6.872 6.612 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -1.847 7.910 4.254 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -3.558 7.730 3.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -3.590 9.772 4.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -3.714 8.877 6.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -2.212 9.503 5.812 1.00 0.00 H new ATOM 1301 N PHE A 85 -0.496 1.928 7.802 1.00 0.00 N ATOM 1302 CA PHE A 85 -0.647 0.767 8.670 1.00 0.00 C ATOM 1303 C PHE A 85 -1.673 1.037 9.766 1.00 0.00 C ATOM 1304 O PHE A 85 -1.619 2.064 10.443 1.00 0.00 O ATOM 1305 CB PHE A 85 0.698 0.393 9.296 1.00 0.00 C ATOM 1306 CG PHE A 85 0.592 -0.664 10.358 1.00 0.00 C ATOM 1307 CD1 PHE A 85 0.390 -0.314 11.683 1.00 0.00 C ATOM 1308 CD2 PHE A 85 0.696 -2.006 10.031 1.00 0.00 C ATOM 1309 CE1 PHE A 85 0.292 -1.284 12.663 1.00 0.00 C ATOM 1310 CE2 PHE A 85 0.598 -2.980 11.006 1.00 0.00 C ATOM 1311 CZ PHE A 85 0.397 -2.619 12.324 1.00 0.00 C ATOM 0 H PHE A 85 0.186 2.613 8.128 1.00 0.00 H new ATOM 0 HA PHE A 85 -1.001 -0.066 8.062 1.00 0.00 H new ATOM 0 HB2 PHE A 85 1.370 0.043 8.512 1.00 0.00 H new ATOM 0 HB3 PHE A 85 1.150 1.286 9.728 1.00 0.00 H new ATOM 0 HD1 PHE A 85 0.308 0.728 11.953 1.00 0.00 H new ATOM 0 HD2 PHE A 85 0.855 -2.294 9.002 1.00 0.00 H new ATOM 0 HE1 PHE A 85 0.134 -0.998 13.692 1.00 0.00 H new ATOM 0 HE2 PHE A 85 0.679 -4.023 10.738 1.00 0.00 H new ATOM 0 HZ PHE A 85 0.322 -3.379 13.088 1.00 0.00 H new ATOM 1321 N PHE A 86 -2.609 0.108 9.935 1.00 0.00 N ATOM 1322 CA PHE A 86 -3.649 0.245 10.948 1.00 0.00 C ATOM 1323 C PHE A 86 -3.409 -0.716 12.108 1.00 0.00 C ATOM 1324 O PHE A 86 -3.538 -1.933 11.976 1.00 0.00 O ATOM 1325 CB PHE A 86 -5.026 -0.013 10.333 1.00 0.00 C ATOM 1326 CG PHE A 86 -5.328 0.861 9.150 1.00 0.00 C ATOM 1327 CD1 PHE A 86 -4.563 1.986 8.890 1.00 0.00 C ATOM 1328 CD2 PHE A 86 -6.377 0.557 8.297 1.00 0.00 C ATOM 1329 CE1 PHE A 86 -4.837 2.793 7.801 1.00 0.00 C ATOM 1330 CE2 PHE A 86 -6.656 1.359 7.207 1.00 0.00 C ATOM 1331 CZ PHE A 86 -5.886 2.479 6.959 1.00 0.00 C ATOM 0 H PHE A 86 -2.668 -0.748 9.383 1.00 0.00 H new ATOM 0 HA PHE A 86 -3.615 1.265 11.332 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -5.089 -1.058 10.028 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -5.790 0.143 11.094 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -3.742 2.236 9.546 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -6.983 -0.317 8.486 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -4.232 3.667 7.609 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -7.476 1.110 6.549 1.00 0.00 H new ATOM 0 HZ PHE A 86 -6.104 3.108 6.108 1.00 0.00 H new ATOM 1341 N PRO A 87 -3.050 -0.158 13.274 1.00 0.00 N ATOM 1342 CA PRO A 87 -2.784 -0.946 14.481 1.00 0.00 C ATOM 1343 C PRO A 87 -4.051 -1.570 15.057 1.00 0.00 C ATOM 1344 O PRO A 87 -5.163 -1.190 14.691 1.00 0.00 O ATOM 1345 CB PRO A 87 -2.203 0.081 15.455 1.00 0.00 C ATOM 1346 CG PRO A 87 -2.752 1.389 14.999 1.00 0.00 C ATOM 1347 CD PRO A 87 -2.877 1.287 13.504 1.00 0.00 C ATOM 0 HA PRO A 87 -2.119 -1.786 14.281 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -2.498 -0.136 16.482 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -1.113 0.079 15.429 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -3.720 1.588 15.459 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -2.091 2.209 15.280 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -3.728 1.858 13.132 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -1.990 1.671 12.999 1.00 0.00 H new ATOM 1355 N ALA A 88 -3.875 -2.529 15.960 1.00 0.00 N ATOM 1356 CA ALA A 88 -5.004 -3.203 16.588 1.00 0.00 C ATOM 1357 C ALA A 88 -5.622 -2.336 17.680 1.00 0.00 C ATOM 1358 O ALA A 88 -5.881 -2.807 18.787 1.00 0.00 O ATOM 1359 CB ALA A 88 -4.567 -4.543 17.159 1.00 0.00 C ATOM 0 H ALA A 88 -2.961 -2.856 16.273 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.763 -3.376 15.825 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.420 -5.036 17.625 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.179 -5.171 16.357 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.788 -4.384 17.905 1.00 0.00 H new ATOM 1365 N SER A 89 -5.856 -1.067 17.361 1.00 0.00 N ATOM 1366 CA SER A 89 -6.440 -0.134 18.317 1.00 0.00 C ATOM 1367 C SER A 89 -7.946 -0.010 18.105 1.00 0.00 C ATOM 1368 O SER A 89 -8.404 0.335 17.016 1.00 0.00 O ATOM 1369 CB SER A 89 -5.781 1.241 18.187 1.00 0.00 C ATOM 1370 OG SER A 89 -4.622 1.329 18.998 1.00 0.00 O ATOM 0 H SER A 89 -5.650 -0.662 16.448 1.00 0.00 H new ATOM 0 HA SER A 89 -6.262 -0.522 19.320 1.00 0.00 H new ATOM 0 HB2 SER A 89 -5.515 1.423 17.146 1.00 0.00 H new ATOM 0 HB3 SER A 89 -6.490 2.017 18.475 1.00 0.00 H new ATOM 0 HG SER A 89 -4.218 2.216 18.896 1.00 0.00 H new ATOM 1376 N ALA A 90 -8.710 -0.295 19.154 1.00 0.00 N ATOM 1377 CA ALA A 90 -10.164 -0.214 19.085 1.00 0.00 C ATOM 1378 C ALA A 90 -10.610 1.062 18.380 1.00 0.00 C ATOM 1379 O ALA A 90 -11.702 1.121 17.815 1.00 0.00 O ATOM 1380 CB ALA A 90 -10.763 -0.284 20.482 1.00 0.00 C ATOM 0 H ALA A 90 -8.346 -0.584 20.062 1.00 0.00 H new ATOM 0 HA ALA A 90 -10.523 -1.063 18.504 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.849 -0.222 20.416 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -10.481 -1.226 20.952 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.388 0.546 21.081 1.00 0.00 H new ATOM 1386 N ASP A 91 -9.758 2.081 18.416 1.00 0.00 N ATOM 1387 CA ASP A 91 -10.065 3.357 17.779 1.00 0.00 C ATOM 1388 C ASP A 91 -9.578 3.374 16.334 1.00 0.00 C ATOM 1389 O ASP A 91 -8.919 2.438 15.880 1.00 0.00 O ATOM 1390 CB ASP A 91 -9.426 4.507 18.560 1.00 0.00 C ATOM 1391 CG ASP A 91 -9.534 4.318 20.060 1.00 0.00 C ATOM 1392 OD1 ASP A 91 -10.653 4.452 20.596 1.00 0.00 O ATOM 1393 OD2 ASP A 91 -8.497 4.038 20.699 1.00 0.00 O ATOM 0 H ASP A 91 -8.850 2.048 18.879 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.147 3.485 17.780 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -8.375 4.592 18.282 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -9.906 5.444 18.279 1.00 0.00 H new ATOM 1398 N ARG A 92 -9.907 4.442 15.616 1.00 0.00 N ATOM 1399 CA ARG A 92 -9.505 4.580 14.222 1.00 0.00 C ATOM 1400 C ARG A 92 -8.124 5.221 14.115 1.00 0.00 C ATOM 1401 O ARG A 92 -7.992 6.372 13.699 1.00 0.00 O ATOM 1402 CB ARG A 92 -10.529 5.418 13.454 1.00 0.00 C ATOM 1403 CG ARG A 92 -11.848 4.701 13.217 1.00 0.00 C ATOM 1404 CD ARG A 92 -12.832 4.958 14.347 1.00 0.00 C ATOM 1405 NE ARG A 92 -13.652 6.142 14.100 1.00 0.00 N ATOM 1406 CZ ARG A 92 -14.401 6.723 15.030 1.00 0.00 C ATOM 1407 NH1 ARG A 92 -14.435 6.233 16.261 1.00 0.00 N ATOM 1408 NH2 ARG A 92 -15.119 7.797 14.729 1.00 0.00 N ATOM 0 H ARG A 92 -10.452 5.225 15.977 1.00 0.00 H new ATOM 0 HA ARG A 92 -9.459 3.583 13.783 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -10.720 6.339 14.006 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -10.103 5.705 12.492 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -12.280 5.034 12.274 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.670 3.630 13.125 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -13.478 4.089 14.470 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -12.286 5.084 15.282 1.00 0.00 H new ATOM 0 HE ARG A 92 -13.649 6.544 13.163 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -13.885 5.407 16.497 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -15.011 6.682 16.973 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -15.096 8.177 13.783 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -15.694 8.243 15.444 1.00 0.00 H new ATOM 1422 N THR A 93 -7.097 4.467 14.494 1.00 0.00 N ATOM 1423 CA THR A 93 -5.726 4.961 14.442 1.00 0.00 C ATOM 1424 C THR A 93 -5.049 4.567 13.135 1.00 0.00 C ATOM 1425 O THR A 93 -5.232 3.455 12.639 1.00 0.00 O ATOM 1426 CB THR A 93 -4.892 4.427 15.621 1.00 0.00 C ATOM 1427 OG1 THR A 93 -5.561 4.699 16.858 1.00 0.00 O ATOM 1428 CG2 THR A 93 -3.509 5.062 15.637 1.00 0.00 C ATOM 0 H THR A 93 -7.188 3.512 14.840 1.00 0.00 H new ATOM 0 HA THR A 93 -5.779 6.048 14.507 1.00 0.00 H new ATOM 0 HB THR A 93 -4.779 3.350 15.499 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.025 4.355 17.603 1.00 0.00 H new ATOM 0 HG21 THR A 93 -2.938 4.669 16.479 1.00 0.00 H new ATOM 0 HG22 THR A 93 -2.991 4.829 14.707 1.00 0.00 H new ATOM 0 HG23 THR A 93 -3.606 6.143 15.737 1.00 0.00 H new ATOM 1436 N VAL A 94 -4.263 5.486 12.580 1.00 0.00 N ATOM 1437 CA VAL A 94 -3.556 5.233 11.331 1.00 0.00 C ATOM 1438 C VAL A 94 -2.074 5.566 11.461 1.00 0.00 C ATOM 1439 O VAL A 94 -1.708 6.610 12.002 1.00 0.00 O ATOM 1440 CB VAL A 94 -4.155 6.051 10.171 1.00 0.00 C ATOM 1441 CG1 VAL A 94 -3.203 6.072 8.985 1.00 0.00 C ATOM 1442 CG2 VAL A 94 -5.511 5.491 9.769 1.00 0.00 C ATOM 0 H VAL A 94 -4.101 6.412 12.976 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.669 4.171 11.113 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.298 7.078 10.509 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.643 6.654 8.175 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -2.258 6.524 9.285 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.025 5.052 8.643 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -5.919 6.081 8.948 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -5.397 4.455 9.450 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -6.190 5.535 10.621 1.00 0.00 H new ATOM 1452 N ILE A 95 -1.227 4.672 10.962 1.00 0.00 N ATOM 1453 CA ILE A 95 0.216 4.873 11.021 1.00 0.00 C ATOM 1454 C ILE A 95 0.799 5.086 9.628 1.00 0.00 C ATOM 1455 O ILE A 95 0.515 4.327 8.702 1.00 0.00 O ATOM 1456 CB ILE A 95 0.923 3.676 11.684 1.00 0.00 C ATOM 1457 CG1 ILE A 95 0.584 3.616 13.174 1.00 0.00 C ATOM 1458 CG2 ILE A 95 2.428 3.772 11.481 1.00 0.00 C ATOM 1459 CD1 ILE A 95 1.342 2.543 13.924 1.00 0.00 C ATOM 0 H ILE A 95 -1.514 3.802 10.513 1.00 0.00 H new ATOM 0 HA ILE A 95 0.387 5.765 11.623 1.00 0.00 H new ATOM 0 HB ILE A 95 0.570 2.758 11.214 1.00 0.00 H new ATOM 0 HG12 ILE A 95 0.798 4.584 13.626 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -0.486 3.441 13.288 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.914 2.919 11.955 1.00 0.00 H new ATOM 0 HG22 ILE A 95 2.652 3.771 10.414 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.797 4.695 11.928 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.051 2.559 14.974 1.00 0.00 H new ATOM 0 HD12 ILE A 95 1.109 1.567 13.498 1.00 0.00 H new ATOM 0 HD13 ILE A 95 2.413 2.729 13.841 1.00 0.00 H new ATOM 1471 N ASP A 96 1.617 6.123 9.489 1.00 0.00 N ATOM 1472 CA ASP A 96 2.244 6.436 8.209 1.00 0.00 C ATOM 1473 C ASP A 96 3.401 5.484 7.924 1.00 0.00 C ATOM 1474 O ASP A 96 4.198 5.176 8.811 1.00 0.00 O ATOM 1475 CB ASP A 96 2.742 7.882 8.201 1.00 0.00 C ATOM 1476 CG ASP A 96 3.623 8.198 9.393 1.00 0.00 C ATOM 1477 OD1 ASP A 96 4.127 7.247 10.027 1.00 0.00 O ATOM 1478 OD2 ASP A 96 3.808 9.396 9.694 1.00 0.00 O ATOM 0 H ASP A 96 1.862 6.761 10.246 1.00 0.00 H new ATOM 0 HA ASP A 96 1.496 6.314 7.426 1.00 0.00 H new ATOM 0 HB2 ASP A 96 3.299 8.066 7.282 1.00 0.00 H new ATOM 0 HB3 ASP A 96 1.887 8.558 8.196 1.00 0.00 H new ATOM 1483 N TYR A 97 3.488 5.021 6.682 1.00 0.00 N ATOM 1484 CA TYR A 97 4.546 4.102 6.281 1.00 0.00 C ATOM 1485 C TYR A 97 5.544 4.790 5.355 1.00 0.00 C ATOM 1486 O TYR A 97 5.230 5.100 4.206 1.00 0.00 O ATOM 1487 CB TYR A 97 3.949 2.877 5.586 1.00 0.00 C ATOM 1488 CG TYR A 97 4.976 1.830 5.218 1.00 0.00 C ATOM 1489 CD1 TYR A 97 5.810 2.003 4.120 1.00 0.00 C ATOM 1490 CD2 TYR A 97 5.112 0.667 5.966 1.00 0.00 C ATOM 1491 CE1 TYR A 97 6.749 1.049 3.778 1.00 0.00 C ATOM 1492 CE2 TYR A 97 6.049 -0.291 5.633 1.00 0.00 C ATOM 1493 CZ TYR A 97 6.865 -0.096 4.538 1.00 0.00 C ATOM 1494 OH TYR A 97 7.799 -1.049 4.203 1.00 0.00 O ATOM 0 H TYR A 97 2.838 5.267 5.935 1.00 0.00 H new ATOM 0 HA TYR A 97 5.074 3.781 7.179 1.00 0.00 H new ATOM 0 HB2 TYR A 97 3.202 2.427 6.240 1.00 0.00 H new ATOM 0 HB3 TYR A 97 3.430 3.199 4.683 1.00 0.00 H new ATOM 0 HD1 TYR A 97 5.723 2.899 3.523 1.00 0.00 H new ATOM 0 HD2 TYR A 97 4.474 0.510 6.823 1.00 0.00 H new ATOM 0 HE1 TYR A 97 7.388 1.199 2.921 1.00 0.00 H new ATOM 0 HE2 TYR A 97 6.143 -1.188 6.227 1.00 0.00 H new ATOM 0 HH TYR A 97 7.405 -1.684 3.569 1.00 0.00 H new ATOM 1504 N ASN A 98 6.749 5.026 5.864 1.00 0.00 N ATOM 1505 CA ASN A 98 7.794 5.677 5.083 1.00 0.00 C ATOM 1506 C ASN A 98 9.096 4.884 5.147 1.00 0.00 C ATOM 1507 O ASN A 98 10.056 5.297 5.796 1.00 0.00 O ATOM 1508 CB ASN A 98 8.026 7.101 5.592 1.00 0.00 C ATOM 1509 CG ASN A 98 6.991 8.078 5.069 1.00 0.00 C ATOM 1510 OD1 ASN A 98 7.233 8.797 4.099 1.00 0.00 O ATOM 1511 ND2 ASN A 98 5.829 8.108 5.712 1.00 0.00 N ATOM 0 H ASN A 98 7.026 4.776 6.813 1.00 0.00 H new ATOM 0 HA ASN A 98 7.465 5.717 4.045 1.00 0.00 H new ATOM 0 HB2 ASN A 98 8.005 7.102 6.682 1.00 0.00 H new ATOM 0 HB3 ASN A 98 9.020 7.434 5.292 1.00 0.00 H new ATOM 0 HD21 ASN A 98 5.093 8.745 5.406 1.00 0.00 H new ATOM 0 HD22 ASN A 98 5.672 7.494 6.511 1.00 0.00 H new ATOM 1518 N GLY A 99 9.120 3.741 4.468 1.00 0.00 N ATOM 1519 CA GLY A 99 10.308 2.907 4.461 1.00 0.00 C ATOM 1520 C GLY A 99 10.791 2.600 3.058 1.00 0.00 C ATOM 1521 O GLY A 99 10.562 3.377 2.131 1.00 0.00 O ATOM 0 H GLY A 99 8.338 3.378 3.923 1.00 0.00 H new ATOM 0 HA2 GLY A 99 11.103 3.407 5.014 1.00 0.00 H new ATOM 0 HA3 GLY A 99 10.096 1.973 4.982 1.00 0.00 H new ATOM 1525 N GLU A 100 11.465 1.464 2.901 1.00 0.00 N ATOM 1526 CA GLU A 100 11.984 1.058 1.600 1.00 0.00 C ATOM 1527 C GLU A 100 10.845 0.741 0.635 1.00 0.00 C ATOM 1528 O GLU A 100 11.023 0.772 -0.583 1.00 0.00 O ATOM 1529 CB GLU A 100 12.896 -0.161 1.748 1.00 0.00 C ATOM 1530 CG GLU A 100 12.262 -1.306 2.520 1.00 0.00 C ATOM 1531 CD GLU A 100 13.181 -2.505 2.645 1.00 0.00 C ATOM 1532 OE1 GLU A 100 13.682 -2.979 1.604 1.00 0.00 O ATOM 1533 OE2 GLU A 100 13.400 -2.970 3.783 1.00 0.00 O ATOM 0 H GLU A 100 11.664 0.810 3.658 1.00 0.00 H new ATOM 0 HA GLU A 100 12.562 1.888 1.193 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.179 -0.515 0.757 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.814 0.142 2.252 1.00 0.00 H new ATOM 0 HG2 GLU A 100 11.986 -0.959 3.516 1.00 0.00 H new ATOM 0 HG3 GLU A 100 11.341 -1.609 2.022 1.00 0.00 H new ATOM 1540 N ARG A 101 9.676 0.435 1.188 1.00 0.00 N ATOM 1541 CA ARG A 101 8.509 0.110 0.377 1.00 0.00 C ATOM 1542 C ARG A 101 8.795 -1.081 -0.534 1.00 0.00 C ATOM 1543 O ARG A 101 8.579 -1.016 -1.745 1.00 0.00 O ATOM 1544 CB ARG A 101 8.092 1.319 -0.462 1.00 0.00 C ATOM 1545 CG ARG A 101 7.076 2.216 0.226 1.00 0.00 C ATOM 1546 CD ARG A 101 6.433 3.184 -0.754 1.00 0.00 C ATOM 1547 NE ARG A 101 7.171 4.441 -0.846 1.00 0.00 N ATOM 1548 CZ ARG A 101 8.241 4.611 -1.615 1.00 0.00 C ATOM 1549 NH1 ARG A 101 8.695 3.609 -2.355 1.00 0.00 N ATOM 1550 NH2 ARG A 101 8.859 5.785 -1.644 1.00 0.00 N ATOM 0 H ARG A 101 9.512 0.405 2.194 1.00 0.00 H new ATOM 0 HA ARG A 101 7.693 -0.156 1.049 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.978 1.906 -0.703 1.00 0.00 H new ATOM 0 HB3 ARG A 101 7.675 0.969 -1.406 1.00 0.00 H new ATOM 0 HG2 ARG A 101 6.305 1.603 0.692 1.00 0.00 H new ATOM 0 HG3 ARG A 101 7.564 2.775 1.024 1.00 0.00 H new ATOM 0 HD2 ARG A 101 6.381 2.721 -1.739 1.00 0.00 H new ATOM 0 HD3 ARG A 101 5.408 3.387 -0.443 1.00 0.00 H new ATOM 0 HE ARG A 101 6.847 5.232 -0.289 1.00 0.00 H new ATOM 0 HH11 ARG A 101 8.223 2.705 -2.335 1.00 0.00 H new ATOM 0 HH12 ARG A 101 9.517 3.742 -2.945 1.00 0.00 H new ATOM 0 HH21 ARG A 101 8.513 6.558 -1.076 1.00 0.00 H new ATOM 0 HH22 ARG A 101 9.680 5.914 -2.235 1.00 0.00 H new ATOM 1564 N THR A 102 9.281 -2.168 0.056 1.00 0.00 N ATOM 1565 CA THR A 102 9.598 -3.372 -0.701 1.00 0.00 C ATOM 1566 C THR A 102 8.989 -4.608 -0.050 1.00 0.00 C ATOM 1567 O THR A 102 8.904 -4.698 1.176 1.00 0.00 O ATOM 1568 CB THR A 102 11.120 -3.571 -0.830 1.00 0.00 C ATOM 1569 OG1 THR A 102 11.689 -3.842 0.456 1.00 0.00 O ATOM 1570 CG2 THR A 102 11.778 -2.338 -1.431 1.00 0.00 C ATOM 0 H THR A 102 9.464 -2.239 1.057 1.00 0.00 H new ATOM 0 HA THR A 102 9.171 -3.241 -1.695 1.00 0.00 H new ATOM 0 HB THR A 102 11.299 -4.418 -1.492 1.00 0.00 H new ATOM 0 HG1 THR A 102 12.618 -3.529 0.475 1.00 0.00 H new ATOM 0 HG21 THR A 102 12.853 -2.502 -1.512 1.00 0.00 H new ATOM 0 HG22 THR A 102 11.364 -2.151 -2.422 1.00 0.00 H new ATOM 0 HG23 THR A 102 11.590 -1.476 -0.790 1.00 0.00 H new ATOM 1578 N LEU A 103 8.566 -5.559 -0.875 1.00 0.00 N ATOM 1579 CA LEU A 103 7.965 -6.792 -0.379 1.00 0.00 C ATOM 1580 C LEU A 103 8.612 -7.223 0.933 1.00 0.00 C ATOM 1581 O LEU A 103 7.924 -7.484 1.920 1.00 0.00 O ATOM 1582 CB LEU A 103 8.102 -7.905 -1.419 1.00 0.00 C ATOM 1583 CG LEU A 103 7.549 -9.272 -1.016 1.00 0.00 C ATOM 1584 CD1 LEU A 103 6.058 -9.183 -0.732 1.00 0.00 C ATOM 1585 CD2 LEU A 103 7.826 -10.301 -2.103 1.00 0.00 C ATOM 0 H LEU A 103 8.628 -5.500 -1.891 1.00 0.00 H new ATOM 0 HA LEU A 103 6.907 -6.603 -0.196 1.00 0.00 H new ATOM 0 HB2 LEU A 103 7.598 -7.586 -2.331 1.00 0.00 H new ATOM 0 HB3 LEU A 103 9.158 -8.020 -1.662 1.00 0.00 H new ATOM 0 HG LEU A 103 8.053 -9.591 -0.104 1.00 0.00 H new ATOM 0 HD11 LEU A 103 5.683 -10.166 -0.447 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.884 -8.478 0.081 1.00 0.00 H new ATOM 0 HD13 LEU A 103 5.537 -8.841 -1.626 1.00 0.00 H new ATOM 0 HD21 LEU A 103 7.425 -11.268 -1.799 1.00 0.00 H new ATOM 0 HD22 LEU A 103 7.350 -9.987 -3.032 1.00 0.00 H new ATOM 0 HD23 LEU A 103 8.902 -10.386 -2.258 1.00 0.00 H new ATOM 1597 N ASP A 104 9.939 -7.294 0.937 1.00 0.00 N ATOM 1598 CA ASP A 104 10.680 -7.691 2.128 1.00 0.00 C ATOM 1599 C ASP A 104 10.633 -6.595 3.188 1.00 0.00 C ATOM 1600 O ASP A 104 10.564 -6.876 4.384 1.00 0.00 O ATOM 1601 CB ASP A 104 12.133 -8.008 1.769 1.00 0.00 C ATOM 1602 CG ASP A 104 12.322 -9.451 1.344 1.00 0.00 C ATOM 1603 OD1 ASP A 104 11.572 -10.318 1.839 1.00 0.00 O ATOM 1604 OD2 ASP A 104 13.220 -9.713 0.516 1.00 0.00 O ATOM 0 H ASP A 104 10.523 -7.082 0.128 1.00 0.00 H new ATOM 0 HA ASP A 104 10.211 -8.586 2.536 1.00 0.00 H new ATOM 0 HB2 ASP A 104 12.457 -7.349 0.963 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.771 -7.799 2.628 1.00 0.00 H new ATOM 1609 N GLY A 105 10.671 -5.343 2.740 1.00 0.00 N ATOM 1610 CA GLY A 105 10.633 -4.224 3.662 1.00 0.00 C ATOM 1611 C GLY A 105 9.344 -4.171 4.457 1.00 0.00 C ATOM 1612 O GLY A 105 9.350 -3.837 5.642 1.00 0.00 O ATOM 0 H GLY A 105 10.727 -5.085 1.755 1.00 0.00 H new ATOM 0 HA2 GLY A 105 11.477 -4.294 4.348 1.00 0.00 H new ATOM 0 HA3 GLY A 105 10.751 -3.294 3.105 1.00 0.00 H new ATOM 1616 N PHE A 106 8.234 -4.501 3.804 1.00 0.00 N ATOM 1617 CA PHE A 106 6.930 -4.487 4.457 1.00 0.00 C ATOM 1618 C PHE A 106 6.866 -5.534 5.565 1.00 0.00 C ATOM 1619 O PHE A 106 6.354 -5.272 6.654 1.00 0.00 O ATOM 1620 CB PHE A 106 5.821 -4.741 3.434 1.00 0.00 C ATOM 1621 CG PHE A 106 5.736 -3.686 2.368 1.00 0.00 C ATOM 1622 CD1 PHE A 106 5.675 -2.344 2.707 1.00 0.00 C ATOM 1623 CD2 PHE A 106 5.717 -4.037 1.028 1.00 0.00 C ATOM 1624 CE1 PHE A 106 5.595 -1.372 1.728 1.00 0.00 C ATOM 1625 CE2 PHE A 106 5.638 -3.069 0.045 1.00 0.00 C ATOM 1626 CZ PHE A 106 5.578 -1.735 0.395 1.00 0.00 C ATOM 0 H PHE A 106 8.212 -4.781 2.824 1.00 0.00 H new ATOM 0 HA PHE A 106 6.785 -3.503 4.903 1.00 0.00 H new ATOM 0 HB2 PHE A 106 5.987 -5.710 2.963 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.865 -4.799 3.954 1.00 0.00 H new ATOM 0 HD1 PHE A 106 5.690 -2.055 3.747 1.00 0.00 H new ATOM 0 HD2 PHE A 106 5.764 -5.079 0.748 1.00 0.00 H new ATOM 0 HE1 PHE A 106 5.546 -0.329 2.005 1.00 0.00 H new ATOM 0 HE2 PHE A 106 5.623 -3.356 -0.996 1.00 0.00 H new ATOM 0 HZ PHE A 106 5.518 -0.977 -0.372 1.00 0.00 H new ATOM 1636 N LYS A 107 7.388 -6.722 5.279 1.00 0.00 N ATOM 1637 CA LYS A 107 7.391 -7.810 6.249 1.00 0.00 C ATOM 1638 C LYS A 107 8.012 -7.362 7.568 1.00 0.00 C ATOM 1639 O LYS A 107 7.514 -7.691 8.645 1.00 0.00 O ATOM 1640 CB LYS A 107 8.159 -9.013 5.695 1.00 0.00 C ATOM 1641 CG LYS A 107 7.590 -9.551 4.394 1.00 0.00 C ATOM 1642 CD LYS A 107 7.828 -11.045 4.256 1.00 0.00 C ATOM 1643 CE LYS A 107 7.548 -11.526 2.841 1.00 0.00 C ATOM 1644 NZ LYS A 107 7.311 -12.996 2.792 1.00 0.00 N ATOM 0 H LYS A 107 7.815 -6.956 4.382 1.00 0.00 H new ATOM 0 HA LYS A 107 6.357 -8.100 6.434 1.00 0.00 H new ATOM 0 HB2 LYS A 107 9.199 -8.728 5.536 1.00 0.00 H new ATOM 0 HB3 LYS A 107 8.157 -9.809 6.440 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.520 -9.347 4.352 1.00 0.00 H new ATOM 0 HG3 LYS A 107 8.047 -9.030 3.553 1.00 0.00 H new ATOM 0 HD2 LYS A 107 8.859 -11.276 4.523 1.00 0.00 H new ATOM 0 HD3 LYS A 107 7.189 -11.582 4.957 1.00 0.00 H new ATOM 0 HE2 LYS A 107 6.676 -11.004 2.446 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.390 -11.272 2.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 8.141 -13.468 2.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 7.152 -13.354 3.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 6.474 -13.193 2.207 1.00 0.00 H new ATOM 1658 N LYS A 108 9.102 -6.607 7.478 1.00 0.00 N ATOM 1659 CA LYS A 108 9.789 -6.110 8.663 1.00 0.00 C ATOM 1660 C LYS A 108 8.881 -5.190 9.474 1.00 0.00 C ATOM 1661 O LYS A 108 8.657 -5.414 10.663 1.00 0.00 O ATOM 1662 CB LYS A 108 11.064 -5.362 8.263 1.00 0.00 C ATOM 1663 CG LYS A 108 11.919 -6.113 7.257 1.00 0.00 C ATOM 1664 CD LYS A 108 13.327 -5.547 7.189 1.00 0.00 C ATOM 1665 CE LYS A 108 14.072 -5.747 8.499 1.00 0.00 C ATOM 1666 NZ LYS A 108 13.875 -4.603 9.431 1.00 0.00 N ATOM 0 H LYS A 108 9.528 -6.326 6.595 1.00 0.00 H new ATOM 0 HA LYS A 108 10.056 -6.966 9.283 1.00 0.00 H new ATOM 0 HB2 LYS A 108 10.791 -4.394 7.844 1.00 0.00 H new ATOM 0 HB3 LYS A 108 11.656 -5.167 9.157 1.00 0.00 H new ATOM 0 HG2 LYS A 108 11.963 -7.167 7.530 1.00 0.00 H new ATOM 0 HG3 LYS A 108 11.456 -6.058 6.272 1.00 0.00 H new ATOM 0 HD2 LYS A 108 13.875 -6.030 6.380 1.00 0.00 H new ATOM 0 HD3 LYS A 108 13.282 -4.484 6.954 1.00 0.00 H new ATOM 0 HE2 LYS A 108 13.729 -6.666 8.975 1.00 0.00 H new ATOM 0 HE3 LYS A 108 15.136 -5.871 8.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 14.797 -4.183 9.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 13.273 -3.886 8.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 13.417 -4.940 10.302 1.00 0.00 H new ATOM 1680 N PHE A 109 8.361 -4.156 8.822 1.00 0.00 N ATOM 1681 CA PHE A 109 7.477 -3.202 9.482 1.00 0.00 C ATOM 1682 C PHE A 109 6.320 -3.921 10.172 1.00 0.00 C ATOM 1683 O PHE A 109 5.941 -3.578 11.292 1.00 0.00 O ATOM 1684 CB PHE A 109 6.933 -2.193 8.469 1.00 0.00 C ATOM 1685 CG PHE A 109 6.123 -1.093 9.095 1.00 0.00 C ATOM 1686 CD1 PHE A 109 6.738 0.054 9.569 1.00 0.00 C ATOM 1687 CD2 PHE A 109 4.747 -1.207 9.208 1.00 0.00 C ATOM 1688 CE1 PHE A 109 5.995 1.067 10.145 1.00 0.00 C ATOM 1689 CE2 PHE A 109 3.999 -0.197 9.784 1.00 0.00 C ATOM 1690 CZ PHE A 109 4.624 0.942 10.252 1.00 0.00 C ATOM 0 H PHE A 109 8.536 -3.957 7.837 1.00 0.00 H new ATOM 0 HA PHE A 109 8.056 -2.671 10.238 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.767 -1.753 7.922 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.316 -2.718 7.740 1.00 0.00 H new ATOM 0 HD1 PHE A 109 7.810 0.158 9.488 1.00 0.00 H new ATOM 0 HD2 PHE A 109 4.253 -2.095 8.842 1.00 0.00 H new ATOM 0 HE1 PHE A 109 6.487 1.956 10.511 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.927 -0.299 9.868 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.042 1.733 10.701 1.00 0.00 H new ATOM 1700 N LEU A 110 5.764 -4.919 9.495 1.00 0.00 N ATOM 1701 CA LEU A 110 4.650 -5.687 10.041 1.00 0.00 C ATOM 1702 C LEU A 110 5.108 -6.553 11.211 1.00 0.00 C ATOM 1703 O LEU A 110 4.668 -6.364 12.344 1.00 0.00 O ATOM 1704 CB LEU A 110 4.029 -6.565 8.954 1.00 0.00 C ATOM 1705 CG LEU A 110 3.415 -5.827 7.764 1.00 0.00 C ATOM 1706 CD1 LEU A 110 3.097 -6.799 6.639 1.00 0.00 C ATOM 1707 CD2 LEU A 110 2.163 -5.075 8.192 1.00 0.00 C ATOM 0 H LEU A 110 6.066 -5.216 8.567 1.00 0.00 H new ATOM 0 HA LEU A 110 3.900 -4.985 10.404 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.797 -7.242 8.579 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.256 -7.182 9.411 1.00 0.00 H new ATOM 0 HG LEU A 110 4.142 -5.103 7.395 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.661 -6.255 5.801 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.013 -7.292 6.314 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.389 -7.547 6.994 1.00 0.00 H new ATOM 0 HD21 LEU A 110 1.739 -4.555 7.333 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.432 -5.781 8.586 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.420 -4.350 8.964 1.00 0.00 H new ATOM 1719 N GLU A 111 5.994 -7.502 10.927 1.00 0.00 N ATOM 1720 CA GLU A 111 6.512 -8.395 11.956 1.00 0.00 C ATOM 1721 C GLU A 111 6.711 -7.651 13.273 1.00 0.00 C ATOM 1722 O GLU A 111 6.463 -8.194 14.349 1.00 0.00 O ATOM 1723 CB GLU A 111 7.835 -9.018 11.504 1.00 0.00 C ATOM 1724 CG GLU A 111 7.664 -10.161 10.518 1.00 0.00 C ATOM 1725 CD GLU A 111 8.798 -11.166 10.588 1.00 0.00 C ATOM 1726 OE1 GLU A 111 9.964 -10.735 10.706 1.00 0.00 O ATOM 1727 OE2 GLU A 111 8.520 -12.381 10.523 1.00 0.00 O ATOM 0 H GLU A 111 6.368 -7.672 9.993 1.00 0.00 H new ATOM 0 HA GLU A 111 5.781 -9.188 12.114 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.454 -8.245 11.048 1.00 0.00 H new ATOM 0 HB3 GLU A 111 8.373 -9.382 12.379 1.00 0.00 H new ATOM 0 HG2 GLU A 111 6.720 -10.669 10.717 1.00 0.00 H new ATOM 0 HG3 GLU A 111 7.603 -9.758 9.507 1.00 0.00 H new ATOM 1734 N SER A 112 7.162 -6.404 13.179 1.00 0.00 N ATOM 1735 CA SER A 112 7.399 -5.585 14.362 1.00 0.00 C ATOM 1736 C SER A 112 6.084 -5.218 15.041 1.00 0.00 C ATOM 1737 O SER A 112 5.968 -5.274 16.265 1.00 0.00 O ATOM 1738 CB SER A 112 8.163 -4.314 13.984 1.00 0.00 C ATOM 1739 OG SER A 112 9.345 -4.624 13.266 1.00 0.00 O ATOM 0 H SER A 112 7.371 -5.939 12.296 1.00 0.00 H new ATOM 0 HA SER A 112 7.999 -6.167 15.062 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.525 -3.669 13.380 1.00 0.00 H new ATOM 0 HB3 SER A 112 8.417 -3.757 14.886 1.00 0.00 H new ATOM 0 HG SER A 112 9.111 -4.902 12.356 1.00 0.00 H new ATOM 1745 N GLY A 113 5.094 -4.843 14.237 1.00 0.00 N ATOM 1746 CA GLY A 113 3.799 -4.472 14.777 1.00 0.00 C ATOM 1747 C GLY A 113 3.446 -3.025 14.496 1.00 0.00 C ATOM 1748 O GLY A 113 2.735 -2.390 15.274 1.00 0.00 O ATOM 0 H GLY A 113 5.166 -4.789 13.221 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.032 -5.119 14.351 1.00 0.00 H new ATOM 0 HA3 GLY A 113 3.796 -4.641 15.854 1.00 0.00 H new ATOM 1752 N GLY A 114 3.946 -2.501 13.381 1.00 0.00 N ATOM 1753 CA GLY A 114 3.671 -1.123 13.020 1.00 0.00 C ATOM 1754 C GLY A 114 4.353 -0.134 13.944 1.00 0.00 C ATOM 1755 O GLY A 114 3.741 0.840 14.381 1.00 0.00 O ATOM 0 H GLY A 114 4.537 -3.007 12.721 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.001 -0.946 11.996 1.00 0.00 H new ATOM 0 HA3 GLY A 114 2.595 -0.953 13.042 1.00 0.00 H new ATOM 1759 N GLN A 115 5.624 -0.386 14.243 1.00 0.00 N ATOM 1760 CA GLN A 115 6.388 0.489 15.123 1.00 0.00 C ATOM 1761 C GLN A 115 6.598 1.857 14.483 1.00 0.00 C ATOM 1762 O GLN A 115 7.130 1.961 13.377 1.00 0.00 O ATOM 1763 CB GLN A 115 7.740 -0.143 15.458 1.00 0.00 C ATOM 1764 CG GLN A 115 7.652 -1.261 16.484 1.00 0.00 C ATOM 1765 CD GLN A 115 8.976 -1.527 17.173 1.00 0.00 C ATOM 1766 OE1 GLN A 115 9.638 -0.604 17.649 1.00 0.00 O ATOM 1767 NE2 GLN A 115 9.370 -2.793 17.230 1.00 0.00 N ATOM 0 H GLN A 115 6.145 -1.188 13.889 1.00 0.00 H new ATOM 0 HA GLN A 115 5.819 0.622 16.043 1.00 0.00 H new ATOM 0 HB2 GLN A 115 8.185 -0.535 14.543 1.00 0.00 H new ATOM 0 HB3 GLN A 115 8.410 0.631 15.833 1.00 0.00 H new ATOM 0 HG2 GLN A 115 6.903 -1.004 17.233 1.00 0.00 H new ATOM 0 HG3 GLN A 115 7.312 -2.173 15.993 1.00 0.00 H new ATOM 0 HE21 GLN A 115 8.790 -3.526 16.822 1.00 0.00 H new ATOM 0 HE22 GLN A 115 10.253 -3.033 17.681 1.00 0.00 H new ATOM 1776 N SER A 116 6.177 2.905 15.184 1.00 0.00 N ATOM 1777 CA SER A 116 6.315 4.267 14.681 1.00 0.00 C ATOM 1778 C SER A 116 7.735 4.783 14.894 1.00 0.00 C ATOM 1779 O SER A 116 8.422 5.153 13.943 1.00 0.00 O ATOM 1780 CB SER A 116 5.315 5.193 15.375 1.00 0.00 C ATOM 1781 OG SER A 116 3.982 4.836 15.053 1.00 0.00 O ATOM 0 H SER A 116 5.738 2.837 16.102 1.00 0.00 H new ATOM 0 HA SER A 116 6.107 4.256 13.611 1.00 0.00 H new ATOM 0 HB2 SER A 116 5.457 5.144 16.455 1.00 0.00 H new ATOM 0 HB3 SER A 116 5.501 6.224 15.076 1.00 0.00 H new ATOM 0 HG SER A 116 3.362 5.442 15.510 1.00 0.00 H new ATOM 1787 N GLY A 117 8.169 4.804 16.151 1.00 0.00 N ATOM 1788 CA GLY A 117 9.504 5.276 16.467 1.00 0.00 C ATOM 1789 C GLY A 117 10.407 4.168 16.971 1.00 0.00 C ATOM 1790 O GLY A 117 10.124 2.982 16.800 1.00 0.00 O ATOM 0 H GLY A 117 7.619 4.502 16.956 1.00 0.00 H new ATOM 0 HA2 GLY A 117 9.947 5.725 15.578 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.440 6.060 17.222 1.00 0.00 H new ATOM 1794 N PRO A 118 11.523 4.552 17.607 1.00 0.00 N ATOM 1795 CA PRO A 118 12.494 3.597 18.150 1.00 0.00 C ATOM 1796 C PRO A 118 11.950 2.839 19.356 1.00 0.00 C ATOM 1797 O PRO A 118 11.197 3.390 20.159 1.00 0.00 O ATOM 1798 CB PRO A 118 13.672 4.483 18.561 1.00 0.00 C ATOM 1799 CG PRO A 118 13.069 5.822 18.813 1.00 0.00 C ATOM 1800 CD PRO A 118 11.924 5.949 17.847 1.00 0.00 C ATOM 0 HA PRO A 118 12.756 2.826 17.425 1.00 0.00 H new ATOM 0 HB2 PRO A 118 14.166 4.097 19.453 1.00 0.00 H new ATOM 0 HB3 PRO A 118 14.425 4.530 17.775 1.00 0.00 H new ATOM 0 HG2 PRO A 118 12.722 5.906 19.843 1.00 0.00 H new ATOM 0 HG3 PRO A 118 13.801 6.615 18.657 1.00 0.00 H new ATOM 0 HD2 PRO A 118 11.107 6.535 18.267 1.00 0.00 H new ATOM 0 HD3 PRO A 118 12.229 6.443 16.925 1.00 0.00 H new ATOM 1808 N SER A 119 12.336 1.573 19.478 1.00 0.00 N ATOM 1809 CA SER A 119 11.884 0.739 20.585 1.00 0.00 C ATOM 1810 C SER A 119 11.750 1.560 21.864 1.00 0.00 C ATOM 1811 O SER A 119 12.741 2.043 22.412 1.00 0.00 O ATOM 1812 CB SER A 119 12.858 -0.419 20.809 1.00 0.00 C ATOM 1813 OG SER A 119 14.074 0.039 21.374 1.00 0.00 O ATOM 0 H SER A 119 12.961 1.102 18.823 1.00 0.00 H new ATOM 0 HA SER A 119 10.904 0.336 20.328 1.00 0.00 H new ATOM 0 HB2 SER A 119 12.403 -1.159 21.468 1.00 0.00 H new ATOM 0 HB3 SER A 119 13.059 -0.918 19.861 1.00 0.00 H new ATOM 0 HG SER A 119 13.968 0.967 21.671 1.00 0.00 H new ATOM 1819 N SER A 120 10.516 1.714 22.335 1.00 0.00 N ATOM 1820 CA SER A 120 10.250 2.479 23.547 1.00 0.00 C ATOM 1821 C SER A 120 9.848 1.557 24.694 1.00 0.00 C ATOM 1822 O SER A 120 8.670 1.251 24.875 1.00 0.00 O ATOM 1823 CB SER A 120 9.147 3.508 23.293 1.00 0.00 C ATOM 1824 OG SER A 120 8.936 4.321 24.435 1.00 0.00 O ATOM 0 H SER A 120 9.685 1.319 21.895 1.00 0.00 H new ATOM 0 HA SER A 120 11.165 3.000 23.827 1.00 0.00 H new ATOM 0 HB2 SER A 120 9.418 4.133 22.442 1.00 0.00 H new ATOM 0 HB3 SER A 120 8.221 2.996 23.031 1.00 0.00 H new ATOM 0 HG SER A 120 8.228 4.972 24.247 1.00 0.00 H new ATOM 1830 N GLY A 121 10.837 1.118 25.467 1.00 0.00 N ATOM 1831 CA GLY A 121 10.567 0.236 26.587 1.00 0.00 C ATOM 1832 C GLY A 121 11.208 -1.127 26.419 1.00 0.00 C ATOM 1833 O GLY A 121 10.883 -1.863 25.487 1.00 0.00 O ATOM 0 H GLY A 121 11.820 1.358 25.337 1.00 0.00 H new ATOM 0 HA2 GLY A 121 10.934 0.696 27.504 1.00 0.00 H new ATOM 0 HA3 GLY A 121 9.489 0.116 26.699 1.00 0.00 H new TER 1837 GLY A 121