USER MOD reduce.3.24.130724 H: found=0, std=0, add=877, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 871 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 45 HIS : no HD1:sc= -2.72! C(o=-12!,f=-13!) USER MOD Set 1.2: A 49 ASN : amide:sc= -8.79! C(o=-12!,f=-18!) USER MOD Set 2.1: A 25 SER OG : rot 18:sc= 0.733 USER MOD Set 2.2: A 94 HIS : no HE2:sc= 0.322 K(o=1.1,f=-3.6!) USER MOD Set 3.1: A 18 ASN : amide:sc= -4.84! C(o=-4.5!,f=-8!) USER MOD Set 3.2: A 90 THR OG1 : rot 170:sc= 0.348 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=-0.00983 USER MOD Single : A 5 SER OG : rot -49:sc= 1.23 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 HIS : no HD1:sc= -0.451 X(o=-0.45,f=-0.16) USER MOD Single : A 16 MET CE :methyl 176:sc= 0 (180deg=-0.00474) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 19:sc= -5.73! USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 160:sc= -0.4 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 SER OG : rot 180:sc=-0.00208 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 150:sc= 1.1 (180deg=-0.312) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 MET CE :methyl -115:sc= 0 (180deg=-0.215) USER MOD Single : A 58 GLN : amide:sc= 0.152 X(o=0.15,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 134:sc= -1.02 USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 TYR OH : rot 30:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -0.0155 X(o=-0.015,f=0) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 MET CE :methyl -175:sc= -0.547 (180deg=-0.58) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -0.1 X(o=-0.1,f=-0.56) USER MOD Single : A 106 SER OG : rot -2:sc= 0.557 USER MOD Single : A 107 GLN : amide:sc=-0.00974 X(o=-0.0097,f=-0.16) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 53:sc= 0.00299 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -23.742 -21.703 -18.467 1.00 0.00 N ATOM 2 CA GLY A 1 -23.992 -21.114 -17.163 1.00 0.00 C ATOM 3 C GLY A 1 -25.452 -21.304 -16.746 1.00 0.00 C ATOM 4 O GLY A 1 -25.739 -22.009 -15.780 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.745 -21.561 -18.727 1.00 0.00 H new ATOM 0 H2 GLY A 1 -23.949 -22.722 -18.433 1.00 0.00 H new ATOM 0 H3 GLY A 1 -24.353 -21.249 -19.176 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -23.336 -21.571 -16.422 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.753 -20.051 -17.188 1.00 0.00 H new ATOM 8 N SER A 2 -26.336 -20.662 -17.496 1.00 0.00 N ATOM 9 CA SER A 2 -27.759 -20.751 -17.217 1.00 0.00 C ATOM 10 C SER A 2 -28.093 -19.967 -15.946 1.00 0.00 C ATOM 11 O SER A 2 -28.890 -19.030 -15.982 1.00 0.00 O ATOM 12 CB SER A 2 -28.202 -22.208 -17.073 1.00 0.00 C ATOM 13 OG SER A 2 -29.616 -22.350 -17.187 1.00 0.00 O ATOM 0 H SER A 2 -26.094 -20.078 -18.297 1.00 0.00 H new ATOM 0 HA SER A 2 -28.300 -20.316 -18.058 1.00 0.00 H new ATOM 0 HB2 SER A 2 -27.714 -22.813 -17.838 1.00 0.00 H new ATOM 0 HB3 SER A 2 -27.876 -22.592 -16.107 1.00 0.00 H new ATOM 0 HG SER A 2 -29.859 -23.295 -17.091 1.00 0.00 H new ATOM 19 N SER A 3 -27.467 -20.378 -14.853 1.00 0.00 N ATOM 20 CA SER A 3 -27.688 -19.726 -13.574 1.00 0.00 C ATOM 21 C SER A 3 -26.523 -18.785 -13.258 1.00 0.00 C ATOM 22 O SER A 3 -25.429 -18.944 -13.796 1.00 0.00 O ATOM 23 CB SER A 3 -27.859 -20.754 -12.454 1.00 0.00 C ATOM 24 OG SER A 3 -28.127 -20.136 -11.198 1.00 0.00 O ATOM 0 H SER A 3 -26.807 -21.155 -14.827 1.00 0.00 H new ATOM 0 HA SER A 3 -28.608 -19.145 -13.641 1.00 0.00 H new ATOM 0 HB2 SER A 3 -28.675 -21.432 -12.706 1.00 0.00 H new ATOM 0 HB3 SER A 3 -26.955 -21.358 -12.375 1.00 0.00 H new ATOM 0 HG SER A 3 -28.231 -20.826 -10.510 1.00 0.00 H new ATOM 30 N GLY A 4 -26.798 -17.826 -12.386 1.00 0.00 N ATOM 31 CA GLY A 4 -25.787 -16.860 -11.992 1.00 0.00 C ATOM 32 C GLY A 4 -26.128 -15.464 -12.518 1.00 0.00 C ATOM 33 O GLY A 4 -27.285 -15.177 -12.820 1.00 0.00 O ATOM 0 H GLY A 4 -27.707 -17.697 -11.941 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -25.708 -16.834 -10.905 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -24.814 -17.169 -12.375 1.00 0.00 H new ATOM 37 N SER A 5 -25.100 -14.634 -12.609 1.00 0.00 N ATOM 38 CA SER A 5 -25.276 -13.275 -13.093 1.00 0.00 C ATOM 39 C SER A 5 -26.339 -12.557 -12.260 1.00 0.00 C ATOM 40 O SER A 5 -27.031 -13.182 -11.458 1.00 0.00 O ATOM 41 CB SER A 5 -25.663 -13.263 -14.573 1.00 0.00 C ATOM 42 OG SER A 5 -27.062 -13.461 -14.760 1.00 0.00 O ATOM 0 H SER A 5 -24.142 -14.876 -12.356 1.00 0.00 H new ATOM 0 HA SER A 5 -24.327 -12.749 -12.990 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.369 -12.312 -15.017 1.00 0.00 H new ATOM 0 HB3 SER A 5 -25.113 -14.044 -15.098 1.00 0.00 H new ATOM 0 HG SER A 5 -27.355 -14.239 -14.241 1.00 0.00 H new ATOM 48 N SER A 6 -26.436 -11.254 -12.478 1.00 0.00 N ATOM 49 CA SER A 6 -27.404 -10.444 -11.757 1.00 0.00 C ATOM 50 C SER A 6 -27.057 -10.418 -10.267 1.00 0.00 C ATOM 51 O SER A 6 -26.884 -11.466 -9.648 1.00 0.00 O ATOM 52 CB SER A 6 -28.825 -10.972 -11.962 1.00 0.00 C ATOM 53 OG SER A 6 -29.791 -10.185 -11.271 1.00 0.00 O ATOM 0 H SER A 6 -25.860 -10.739 -13.144 1.00 0.00 H new ATOM 0 HA SER A 6 -27.362 -9.429 -12.151 1.00 0.00 H new ATOM 0 HB2 SER A 6 -29.059 -10.981 -13.027 1.00 0.00 H new ATOM 0 HB3 SER A 6 -28.882 -12.004 -11.615 1.00 0.00 H new ATOM 0 HG SER A 6 -30.686 -10.553 -11.428 1.00 0.00 H new ATOM 59 N GLY A 7 -26.966 -9.208 -9.735 1.00 0.00 N ATOM 60 CA GLY A 7 -26.644 -9.031 -8.329 1.00 0.00 C ATOM 61 C GLY A 7 -25.312 -9.700 -7.984 1.00 0.00 C ATOM 62 O GLY A 7 -25.202 -10.924 -8.016 1.00 0.00 O ATOM 0 H GLY A 7 -27.110 -8.341 -10.252 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -26.593 -7.968 -8.095 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -27.438 -9.455 -7.714 1.00 0.00 H new ATOM 66 N MET A 8 -24.333 -8.866 -7.662 1.00 0.00 N ATOM 67 CA MET A 8 -23.013 -9.362 -7.311 1.00 0.00 C ATOM 68 C MET A 8 -22.707 -9.108 -5.833 1.00 0.00 C ATOM 69 O MET A 8 -22.952 -8.016 -5.324 1.00 0.00 O ATOM 70 CB MET A 8 -21.961 -8.668 -8.177 1.00 0.00 C ATOM 71 CG MET A 8 -21.868 -9.321 -9.557 1.00 0.00 C ATOM 72 SD MET A 8 -20.359 -8.823 -10.369 1.00 0.00 S ATOM 73 CE MET A 8 -20.495 -9.763 -11.880 1.00 0.00 C ATOM 0 H MET A 8 -24.428 -7.851 -7.637 1.00 0.00 H new ATOM 0 HA MET A 8 -22.990 -10.437 -7.488 1.00 0.00 H new ATOM 0 HB2 MET A 8 -22.213 -7.613 -8.286 1.00 0.00 H new ATOM 0 HB3 MET A 8 -20.990 -8.714 -7.683 1.00 0.00 H new ATOM 0 HG2 MET A 8 -21.896 -10.406 -9.457 1.00 0.00 H new ATOM 0 HG3 MET A 8 -22.728 -9.034 -10.162 1.00 0.00 H new ATOM 0 HE1 MET A 8 -19.627 -9.568 -12.509 1.00 0.00 H new ATOM 0 HE2 MET A 8 -20.541 -10.826 -11.644 1.00 0.00 H new ATOM 0 HE3 MET A 8 -21.401 -9.470 -12.411 1.00 0.00 H new ATOM 83 N SER A 9 -22.177 -10.136 -5.187 1.00 0.00 N ATOM 84 CA SER A 9 -21.835 -10.038 -3.778 1.00 0.00 C ATOM 85 C SER A 9 -20.670 -10.976 -3.456 1.00 0.00 C ATOM 86 O SER A 9 -20.826 -12.196 -3.480 1.00 0.00 O ATOM 87 CB SER A 9 -23.040 -10.366 -2.895 1.00 0.00 C ATOM 88 OG SER A 9 -23.677 -9.191 -2.402 1.00 0.00 O ATOM 0 H SER A 9 -21.976 -11.041 -5.613 1.00 0.00 H new ATOM 0 HA SER A 9 -21.535 -9.011 -3.569 1.00 0.00 H new ATOM 0 HB2 SER A 9 -23.758 -10.955 -3.466 1.00 0.00 H new ATOM 0 HB3 SER A 9 -22.717 -10.982 -2.056 1.00 0.00 H new ATOM 0 HG SER A 9 -24.442 -9.443 -1.844 1.00 0.00 H new ATOM 94 N SER A 10 -19.529 -10.371 -3.162 1.00 0.00 N ATOM 95 CA SER A 10 -18.338 -11.137 -2.836 1.00 0.00 C ATOM 96 C SER A 10 -17.226 -10.199 -2.362 1.00 0.00 C ATOM 97 O SER A 10 -16.819 -9.294 -3.090 1.00 0.00 O ATOM 98 CB SER A 10 -17.864 -11.957 -4.038 1.00 0.00 C ATOM 99 OG SER A 10 -17.788 -13.348 -3.738 1.00 0.00 O ATOM 0 H SER A 10 -19.404 -9.359 -3.143 1.00 0.00 H new ATOM 0 HA SER A 10 -18.587 -11.830 -2.033 1.00 0.00 H new ATOM 0 HB2 SER A 10 -18.546 -11.803 -4.874 1.00 0.00 H new ATOM 0 HB3 SER A 10 -16.884 -11.601 -4.357 1.00 0.00 H new ATOM 0 HG SER A 10 -17.484 -13.837 -4.531 1.00 0.00 H new ATOM 105 N HIS A 11 -16.766 -10.446 -1.144 1.00 0.00 N ATOM 106 CA HIS A 11 -15.709 -9.635 -0.564 1.00 0.00 C ATOM 107 C HIS A 11 -14.347 -10.168 -1.014 1.00 0.00 C ATOM 108 O HIS A 11 -14.271 -11.189 -1.696 1.00 0.00 O ATOM 109 CB HIS A 11 -15.847 -9.570 0.958 1.00 0.00 C ATOM 110 CG HIS A 11 -16.013 -10.918 1.618 1.00 0.00 C ATOM 111 ND1 HIS A 11 -17.111 -11.243 2.395 1.00 0.00 N ATOM 112 CD2 HIS A 11 -15.209 -12.020 1.608 1.00 0.00 C ATOM 113 CE1 HIS A 11 -16.964 -12.486 2.828 1.00 0.00 C ATOM 114 NE2 HIS A 11 -15.784 -12.966 2.340 1.00 0.00 N ATOM 0 H HIS A 11 -17.106 -11.197 -0.543 1.00 0.00 H new ATOM 0 HA HIS A 11 -15.795 -8.609 -0.922 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -14.965 -9.080 1.372 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -16.705 -8.946 1.208 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -14.264 -12.108 1.092 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -17.657 -13.025 3.457 1.00 0.00 H new ATOM 0 HE2 HIS A 11 -15.406 -13.898 2.510 1.00 0.00 H new ATOM 122 N VAL A 12 -13.306 -9.454 -0.613 1.00 0.00 N ATOM 123 CA VAL A 12 -11.951 -9.842 -0.966 1.00 0.00 C ATOM 124 C VAL A 12 -11.733 -11.310 -0.593 1.00 0.00 C ATOM 125 O VAL A 12 -12.125 -11.745 0.488 1.00 0.00 O ATOM 126 CB VAL A 12 -10.946 -8.901 -0.299 1.00 0.00 C ATOM 127 CG1 VAL A 12 -9.512 -9.392 -0.509 1.00 0.00 C ATOM 128 CG2 VAL A 12 -11.115 -7.468 -0.810 1.00 0.00 C ATOM 0 H VAL A 12 -13.373 -8.608 -0.047 1.00 0.00 H new ATOM 0 HA VAL A 12 -11.796 -9.752 -2.041 1.00 0.00 H new ATOM 0 HB VAL A 12 -11.147 -8.901 0.772 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -8.818 -8.705 -0.025 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -9.401 -10.386 -0.076 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.295 -9.435 -1.576 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.389 -6.819 -0.320 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -10.954 -7.445 -1.888 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -12.123 -7.118 -0.586 1.00 0.00 H new ATOM 138 N PRO A 13 -11.091 -12.053 -1.535 1.00 0.00 N ATOM 139 CA PRO A 13 -10.816 -13.463 -1.316 1.00 0.00 C ATOM 140 C PRO A 13 -9.660 -13.650 -0.332 1.00 0.00 C ATOM 141 O PRO A 13 -9.147 -12.678 0.221 1.00 0.00 O ATOM 142 CB PRO A 13 -10.517 -14.024 -2.697 1.00 0.00 C ATOM 143 CG PRO A 13 -10.179 -12.826 -3.570 1.00 0.00 C ATOM 144 CD PRO A 13 -10.613 -11.572 -2.828 1.00 0.00 C ATOM 0 HA PRO A 13 -11.654 -13.989 -0.859 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -9.685 -14.728 -2.661 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.376 -14.566 -3.093 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.110 -12.795 -3.779 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.689 -12.897 -4.530 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -9.783 -10.875 -2.709 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.398 -11.044 -3.369 1.00 0.00 H new ATOM 152 N ALA A 14 -9.284 -14.906 -0.142 1.00 0.00 N ATOM 153 CA ALA A 14 -8.198 -15.233 0.767 1.00 0.00 C ATOM 154 C ALA A 14 -6.932 -15.521 -0.042 1.00 0.00 C ATOM 155 O ALA A 14 -5.911 -15.918 0.518 1.00 0.00 O ATOM 156 CB ALA A 14 -8.608 -16.413 1.649 1.00 0.00 C ATOM 0 H ALA A 14 -9.712 -15.710 -0.602 1.00 0.00 H new ATOM 0 HA ALA A 14 -7.983 -14.393 1.427 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -7.793 -16.658 2.331 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -9.495 -16.146 2.224 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -8.829 -17.277 1.022 1.00 0.00 H new ATOM 162 N ASP A 15 -7.040 -15.311 -1.345 1.00 0.00 N ATOM 163 CA ASP A 15 -5.916 -15.543 -2.236 1.00 0.00 C ATOM 164 C ASP A 15 -5.357 -14.199 -2.707 1.00 0.00 C ATOM 165 O ASP A 15 -4.201 -14.114 -3.121 1.00 0.00 O ATOM 166 CB ASP A 15 -6.348 -16.334 -3.473 1.00 0.00 C ATOM 167 CG ASP A 15 -5.353 -17.399 -3.940 1.00 0.00 C ATOM 168 OD1 ASP A 15 -5.457 -18.535 -3.429 1.00 0.00 O ATOM 169 OD2 ASP A 15 -4.512 -17.053 -4.797 1.00 0.00 O ATOM 0 H ASP A 15 -7.889 -14.983 -1.806 1.00 0.00 H new ATOM 0 HA ASP A 15 -5.164 -16.111 -1.688 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -7.302 -16.817 -3.262 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -6.519 -15.635 -4.291 1.00 0.00 H new ATOM 174 N MET A 16 -6.202 -13.182 -2.626 1.00 0.00 N ATOM 175 CA MET A 16 -5.806 -11.846 -3.038 1.00 0.00 C ATOM 176 C MET A 16 -5.670 -10.917 -1.830 1.00 0.00 C ATOM 177 O MET A 16 -6.149 -11.234 -0.742 1.00 0.00 O ATOM 178 CB MET A 16 -6.850 -11.279 -4.003 1.00 0.00 C ATOM 179 CG MET A 16 -6.905 -12.097 -5.294 1.00 0.00 C ATOM 180 SD MET A 16 -7.369 -11.048 -6.662 1.00 0.00 S ATOM 181 CE MET A 16 -5.775 -10.367 -7.086 1.00 0.00 C ATOM 0 H MET A 16 -7.159 -13.256 -2.281 1.00 0.00 H new ATOM 0 HA MET A 16 -4.837 -11.911 -3.533 1.00 0.00 H new ATOM 0 HB2 MET A 16 -7.830 -11.280 -3.526 1.00 0.00 H new ATOM 0 HB3 MET A 16 -6.610 -10.242 -4.236 1.00 0.00 H new ATOM 0 HG2 MET A 16 -5.934 -12.552 -5.487 1.00 0.00 H new ATOM 0 HG3 MET A 16 -7.623 -12.910 -5.189 1.00 0.00 H new ATOM 0 HE1 MET A 16 -5.871 -9.740 -7.972 1.00 0.00 H new ATOM 0 HE2 MET A 16 -5.403 -9.767 -6.256 1.00 0.00 H new ATOM 0 HE3 MET A 16 -5.075 -11.178 -7.289 1.00 0.00 H new ATOM 191 N ILE A 17 -5.013 -9.790 -2.062 1.00 0.00 N ATOM 192 CA ILE A 17 -4.807 -8.814 -1.006 1.00 0.00 C ATOM 193 C ILE A 17 -5.404 -7.472 -1.434 1.00 0.00 C ATOM 194 O ILE A 17 -4.957 -6.873 -2.411 1.00 0.00 O ATOM 195 CB ILE A 17 -3.326 -8.735 -0.630 1.00 0.00 C ATOM 196 CG1 ILE A 17 -2.809 -10.094 -0.152 1.00 0.00 C ATOM 197 CG2 ILE A 17 -3.079 -7.633 0.402 1.00 0.00 C ATOM 198 CD1 ILE A 17 -1.343 -10.291 -0.544 1.00 0.00 C ATOM 0 H ILE A 17 -4.617 -9.531 -2.966 1.00 0.00 H new ATOM 0 HA ILE A 17 -5.327 -9.120 -0.098 1.00 0.00 H new ATOM 0 HB ILE A 17 -2.761 -8.471 -1.524 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -2.913 -10.166 0.931 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -3.415 -10.890 -0.584 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.018 -7.599 0.651 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -3.386 -6.672 -0.011 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -3.657 -7.842 1.302 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -1.000 -11.264 -0.193 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -1.247 -10.242 -1.629 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -0.737 -9.507 -0.090 1.00 0.00 H new ATOM 210 N ASN A 18 -6.406 -7.040 -0.682 1.00 0.00 N ATOM 211 CA ASN A 18 -7.069 -5.780 -0.972 1.00 0.00 C ATOM 212 C ASN A 18 -6.178 -4.623 -0.517 1.00 0.00 C ATOM 213 O ASN A 18 -5.734 -4.589 0.629 1.00 0.00 O ATOM 214 CB ASN A 18 -8.400 -5.673 -0.224 1.00 0.00 C ATOM 215 CG ASN A 18 -9.462 -4.992 -1.089 1.00 0.00 C ATOM 216 OD1 ASN A 18 -9.494 -5.128 -2.301 1.00 0.00 O ATOM 217 ND2 ASN A 18 -10.327 -4.252 -0.401 1.00 0.00 N ATOM 0 H ASN A 18 -6.775 -7.540 0.127 1.00 0.00 H new ATOM 0 HA ASN A 18 -7.253 -5.736 -2.045 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -8.742 -6.668 0.062 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -8.259 -5.108 0.697 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -11.074 -3.756 -0.887 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -10.244 -4.181 0.613 1.00 0.00 H new ATOM 224 N LEU A 19 -5.942 -3.702 -1.440 1.00 0.00 N ATOM 225 CA LEU A 19 -5.111 -2.546 -1.149 1.00 0.00 C ATOM 226 C LEU A 19 -5.908 -1.269 -1.421 1.00 0.00 C ATOM 227 O LEU A 19 -6.593 -1.165 -2.437 1.00 0.00 O ATOM 228 CB LEU A 19 -3.793 -2.625 -1.922 1.00 0.00 C ATOM 229 CG LEU A 19 -2.757 -3.614 -1.383 1.00 0.00 C ATOM 230 CD1 LEU A 19 -1.368 -3.314 -1.948 1.00 0.00 C ATOM 231 CD2 LEU A 19 -2.762 -3.634 0.147 1.00 0.00 C ATOM 0 H LEU A 19 -6.312 -3.733 -2.390 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.835 -2.531 -0.095 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -4.016 -2.891 -2.955 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.344 -1.632 -1.938 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.032 -4.614 -1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -0.650 -4.031 -1.549 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.393 -3.392 -3.035 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.069 -2.305 -1.663 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.017 -4.345 0.504 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.525 -2.639 0.525 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.748 -3.932 0.504 1.00 0.00 H new ATOM 243 N ARG A 20 -5.792 -0.328 -0.495 1.00 0.00 N ATOM 244 CA ARG A 20 -6.494 0.938 -0.623 1.00 0.00 C ATOM 245 C ARG A 20 -5.552 2.014 -1.167 1.00 0.00 C ATOM 246 O ARG A 20 -4.547 2.342 -0.537 1.00 0.00 O ATOM 247 CB ARG A 20 -7.054 1.395 0.726 1.00 0.00 C ATOM 248 CG ARG A 20 -8.135 2.462 0.537 1.00 0.00 C ATOM 249 CD ARG A 20 -9.194 2.370 1.637 1.00 0.00 C ATOM 250 NE ARG A 20 -10.469 1.875 1.073 1.00 0.00 N ATOM 251 CZ ARG A 20 -11.626 1.840 1.748 1.00 0.00 C ATOM 252 NH1 ARG A 20 -11.676 2.271 3.015 1.00 0.00 N ATOM 253 NH2 ARG A 20 -12.734 1.374 1.155 1.00 0.00 N ATOM 0 H ARG A 20 -5.223 -0.417 0.347 1.00 0.00 H new ATOM 0 HA ARG A 20 -7.322 0.790 -1.317 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.470 0.541 1.259 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -6.248 1.794 1.342 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -7.679 3.452 0.548 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -8.606 2.338 -0.438 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -8.852 1.701 2.427 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -9.344 3.349 2.091 1.00 0.00 H new ATOM 0 HE ARG A 20 -10.467 1.539 0.110 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -10.833 2.626 3.467 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -12.557 2.244 3.528 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -12.696 1.046 0.190 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -13.615 1.347 1.669 1.00 0.00 H new ATOM 267 N LEU A 21 -5.910 2.534 -2.332 1.00 0.00 N ATOM 268 CA LEU A 21 -5.109 3.566 -2.968 1.00 0.00 C ATOM 269 C LEU A 21 -5.705 4.938 -2.647 1.00 0.00 C ATOM 270 O LEU A 21 -6.754 5.303 -3.176 1.00 0.00 O ATOM 271 CB LEU A 21 -4.972 3.291 -4.467 1.00 0.00 C ATOM 272 CG LEU A 21 -4.026 2.154 -4.856 1.00 0.00 C ATOM 273 CD1 LEU A 21 -2.566 2.557 -4.638 1.00 0.00 C ATOM 274 CD2 LEU A 21 -4.382 0.865 -4.112 1.00 0.00 C ATOM 0 H LEU A 21 -6.744 2.260 -2.852 1.00 0.00 H new ATOM 0 HA LEU A 21 -4.094 3.558 -2.572 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.961 3.067 -4.867 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.630 4.204 -4.954 1.00 0.00 H new ATOM 0 HG LEU A 21 -4.150 1.956 -5.921 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.914 1.731 -4.922 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.334 3.429 -5.249 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -2.408 2.799 -3.587 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.694 0.073 -4.407 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.304 1.032 -3.038 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.402 0.571 -4.361 1.00 0.00 H new ATOM 286 N ILE A 22 -5.010 5.662 -1.781 1.00 0.00 N ATOM 287 CA ILE A 22 -5.458 6.986 -1.383 1.00 0.00 C ATOM 288 C ILE A 22 -4.688 8.041 -2.180 1.00 0.00 C ATOM 289 O ILE A 22 -3.485 7.905 -2.395 1.00 0.00 O ATOM 290 CB ILE A 22 -5.344 7.157 0.133 1.00 0.00 C ATOM 291 CG1 ILE A 22 -6.124 6.065 0.868 1.00 0.00 C ATOM 292 CG2 ILE A 22 -5.779 8.560 0.561 1.00 0.00 C ATOM 293 CD1 ILE A 22 -5.307 5.493 2.029 1.00 0.00 C ATOM 0 H ILE A 22 -4.140 5.357 -1.344 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.515 7.117 -1.617 1.00 0.00 H new ATOM 0 HB ILE A 22 -4.296 7.047 0.411 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -7.061 6.474 1.245 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -6.382 5.267 0.172 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -5.688 8.655 1.643 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -5.143 9.301 0.077 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -6.816 8.725 0.268 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -5.885 4.719 2.534 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -4.382 5.063 1.646 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -5.072 6.289 2.735 1.00 0.00 H new ATOM 305 N LEU A 23 -5.414 9.068 -2.597 1.00 0.00 N ATOM 306 CA LEU A 23 -4.815 10.145 -3.365 1.00 0.00 C ATOM 307 C LEU A 23 -4.091 11.102 -2.416 1.00 0.00 C ATOM 308 O LEU A 23 -2.876 11.010 -2.244 1.00 0.00 O ATOM 309 CB LEU A 23 -5.867 10.828 -4.242 1.00 0.00 C ATOM 310 CG LEU A 23 -5.581 10.842 -5.745 1.00 0.00 C ATOM 311 CD1 LEU A 23 -5.465 9.419 -6.295 1.00 0.00 C ATOM 312 CD2 LEU A 23 -6.632 11.663 -6.495 1.00 0.00 C ATOM 0 H LEU A 23 -6.412 9.177 -2.417 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.067 9.751 -4.053 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.824 10.333 -4.079 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -5.980 11.858 -3.904 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.618 11.328 -5.905 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.262 9.458 -7.365 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.651 8.899 -5.790 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.399 8.885 -6.123 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.406 11.657 -7.561 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.618 11.229 -6.331 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.622 12.689 -6.128 1.00 0.00 H new ATOM 324 N VAL A 24 -4.867 11.998 -1.824 1.00 0.00 N ATOM 325 CA VAL A 24 -4.315 12.970 -0.896 1.00 0.00 C ATOM 326 C VAL A 24 -5.004 12.822 0.462 1.00 0.00 C ATOM 327 O VAL A 24 -5.839 13.645 0.831 1.00 0.00 O ATOM 328 CB VAL A 24 -4.440 14.379 -1.479 1.00 0.00 C ATOM 329 CG1 VAL A 24 -3.558 14.540 -2.719 1.00 0.00 C ATOM 330 CG2 VAL A 24 -5.899 14.713 -1.798 1.00 0.00 C ATOM 0 H VAL A 24 -5.874 12.071 -1.969 1.00 0.00 H new ATOM 0 HA VAL A 24 -3.251 12.789 -0.742 1.00 0.00 H new ATOM 0 HB VAL A 24 -4.091 15.085 -0.725 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -3.666 15.550 -3.113 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -2.516 14.365 -2.450 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -3.863 13.820 -3.478 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -5.960 15.720 -2.211 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -6.285 13.999 -2.525 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -6.493 14.659 -0.885 1.00 0.00 H new ATOM 340 N SER A 25 -4.628 11.765 1.168 1.00 0.00 N ATOM 341 CA SER A 25 -5.199 11.498 2.477 1.00 0.00 C ATOM 342 C SER A 25 -6.714 11.707 2.439 1.00 0.00 C ATOM 343 O SER A 25 -7.310 12.140 3.424 1.00 0.00 O ATOM 344 CB SER A 25 -4.567 12.391 3.546 1.00 0.00 C ATOM 345 OG SER A 25 -3.650 11.673 4.367 1.00 0.00 O ATOM 0 H SER A 25 -3.935 11.084 0.858 1.00 0.00 H new ATOM 0 HA SER A 25 -4.988 10.461 2.737 1.00 0.00 H new ATOM 0 HB2 SER A 25 -4.050 13.221 3.065 1.00 0.00 H new ATOM 0 HB3 SER A 25 -5.351 12.821 4.169 1.00 0.00 H new ATOM 0 HG SER A 25 -3.393 10.840 3.919 1.00 0.00 H new ATOM 351 N GLY A 26 -7.295 11.390 1.291 1.00 0.00 N ATOM 352 CA GLY A 26 -8.729 11.537 1.111 1.00 0.00 C ATOM 353 C GLY A 26 -9.288 10.424 0.223 1.00 0.00 C ATOM 354 O GLY A 26 -9.061 9.244 0.484 1.00 0.00 O ATOM 0 H GLY A 26 -6.798 11.032 0.476 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.225 11.516 2.082 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.945 12.507 0.663 1.00 0.00 H new ATOM 358 N LYS A 27 -10.008 10.840 -0.809 1.00 0.00 N ATOM 359 CA LYS A 27 -10.601 9.893 -1.738 1.00 0.00 C ATOM 360 C LYS A 27 -9.607 8.761 -2.009 1.00 0.00 C ATOM 361 O LYS A 27 -8.421 9.009 -2.220 1.00 0.00 O ATOM 362 CB LYS A 27 -11.077 10.610 -3.003 1.00 0.00 C ATOM 363 CG LYS A 27 -12.260 11.531 -2.698 1.00 0.00 C ATOM 364 CD LYS A 27 -12.391 12.624 -3.762 1.00 0.00 C ATOM 365 CE LYS A 27 -11.538 13.842 -3.405 1.00 0.00 C ATOM 366 NZ LYS A 27 -12.319 15.088 -3.570 1.00 0.00 N ATOM 0 H LYS A 27 -10.194 11.820 -1.022 1.00 0.00 H new ATOM 0 HA LYS A 27 -11.491 9.439 -1.303 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -10.258 11.192 -3.426 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -11.367 9.876 -3.754 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -13.179 10.947 -2.656 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -12.127 11.987 -1.717 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.083 12.232 -4.731 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.435 12.922 -3.856 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.188 13.759 -2.376 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.654 13.873 -4.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -11.725 15.905 -3.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -12.632 15.173 -4.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.150 15.063 -2.945 1.00 0.00 H new ATOM 380 N THR A 28 -10.129 7.543 -1.994 1.00 0.00 N ATOM 381 CA THR A 28 -9.302 6.373 -2.236 1.00 0.00 C ATOM 382 C THR A 28 -10.098 5.305 -2.989 1.00 0.00 C ATOM 383 O THR A 28 -11.325 5.370 -3.055 1.00 0.00 O ATOM 384 CB THR A 28 -8.761 5.890 -0.889 1.00 0.00 C ATOM 385 OG1 THR A 28 -8.007 4.726 -1.215 1.00 0.00 O ATOM 386 CG2 THR A 28 -9.865 5.372 0.035 1.00 0.00 C ATOM 0 H THR A 28 -11.113 7.341 -1.818 1.00 0.00 H new ATOM 0 HA THR A 28 -8.453 6.614 -2.876 1.00 0.00 H new ATOM 0 HB THR A 28 -8.231 6.706 -0.398 1.00 0.00 H new ATOM 0 HG1 THR A 28 -7.797 4.730 -2.172 1.00 0.00 H new ATOM 0 HG21 THR A 28 -9.426 5.042 0.977 1.00 0.00 H new ATOM 0 HG22 THR A 28 -10.582 6.170 0.229 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.375 4.534 -0.441 1.00 0.00 H new ATOM 394 N LYS A 29 -9.367 4.345 -3.538 1.00 0.00 N ATOM 395 CA LYS A 29 -9.989 3.265 -4.284 1.00 0.00 C ATOM 396 C LYS A 29 -9.357 1.935 -3.869 1.00 0.00 C ATOM 397 O LYS A 29 -8.135 1.794 -3.879 1.00 0.00 O ATOM 398 CB LYS A 29 -9.915 3.539 -5.787 1.00 0.00 C ATOM 399 CG LYS A 29 -11.297 3.429 -6.434 1.00 0.00 C ATOM 400 CD LYS A 29 -11.192 3.453 -7.960 1.00 0.00 C ATOM 401 CE LYS A 29 -12.513 3.032 -8.607 1.00 0.00 C ATOM 402 NZ LYS A 29 -12.578 3.505 -10.008 1.00 0.00 N ATOM 0 H LYS A 29 -8.350 4.293 -3.481 1.00 0.00 H new ATOM 0 HA LYS A 29 -11.051 3.201 -4.048 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -9.508 4.535 -5.959 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -9.233 2.830 -6.256 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -11.780 2.506 -6.114 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -11.927 4.252 -6.096 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -10.922 4.455 -8.294 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -10.395 2.784 -8.284 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -12.609 1.947 -8.579 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -13.349 3.441 -8.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -13.481 3.211 -10.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -12.508 4.542 -10.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -11.791 3.095 -10.550 1.00 0.00 H new ATOM 416 N GLU A 30 -10.218 0.992 -3.514 1.00 0.00 N ATOM 417 CA GLU A 30 -9.759 -0.322 -3.097 1.00 0.00 C ATOM 418 C GLU A 30 -9.429 -1.182 -4.319 1.00 0.00 C ATOM 419 O GLU A 30 -10.220 -1.263 -5.257 1.00 0.00 O ATOM 420 CB GLU A 30 -10.797 -1.009 -2.208 1.00 0.00 C ATOM 421 CG GLU A 30 -12.123 -1.187 -2.950 1.00 0.00 C ATOM 422 CD GLU A 30 -13.082 -2.074 -2.153 1.00 0.00 C ATOM 423 OE1 GLU A 30 -12.902 -3.309 -2.222 1.00 0.00 O ATOM 424 OE2 GLU A 30 -13.974 -1.496 -1.494 1.00 0.00 O ATOM 0 H GLU A 30 -11.231 1.112 -3.507 1.00 0.00 H new ATOM 0 HA GLU A 30 -8.850 -0.197 -2.508 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -10.421 -1.981 -1.889 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -10.957 -0.418 -1.306 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -12.581 -0.213 -3.122 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -11.940 -1.631 -3.929 1.00 0.00 H new ATOM 431 N PHE A 31 -8.259 -1.802 -4.268 1.00 0.00 N ATOM 432 CA PHE A 31 -7.815 -2.653 -5.359 1.00 0.00 C ATOM 433 C PHE A 31 -7.507 -4.067 -4.861 1.00 0.00 C ATOM 434 O PHE A 31 -7.669 -4.361 -3.678 1.00 0.00 O ATOM 435 CB PHE A 31 -6.533 -2.031 -5.917 1.00 0.00 C ATOM 436 CG PHE A 31 -6.771 -1.013 -7.034 1.00 0.00 C ATOM 437 CD1 PHE A 31 -7.364 -1.402 -8.194 1.00 0.00 C ATOM 438 CD2 PHE A 31 -6.390 0.282 -6.866 1.00 0.00 C ATOM 439 CE1 PHE A 31 -7.585 -0.457 -9.231 1.00 0.00 C ATOM 440 CE2 PHE A 31 -6.611 1.227 -7.903 1.00 0.00 C ATOM 441 CZ PHE A 31 -7.204 0.838 -9.063 1.00 0.00 C ATOM 0 H PHE A 31 -7.605 -1.732 -3.488 1.00 0.00 H new ATOM 0 HA PHE A 31 -8.596 -2.726 -6.116 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -5.994 -1.544 -5.104 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -5.890 -2.826 -6.295 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -7.667 -2.430 -8.327 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -5.920 0.591 -5.944 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -8.055 -0.766 -10.153 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -6.308 2.255 -7.770 1.00 0.00 H new ATOM 0 HZ PHE A 31 -7.373 1.557 -9.851 1.00 0.00 H new ATOM 451 N LEU A 32 -7.068 -4.904 -5.790 1.00 0.00 N ATOM 452 CA LEU A 32 -6.736 -6.279 -5.460 1.00 0.00 C ATOM 453 C LEU A 32 -5.357 -6.617 -6.030 1.00 0.00 C ATOM 454 O LEU A 32 -5.045 -6.257 -7.165 1.00 0.00 O ATOM 455 CB LEU A 32 -7.843 -7.225 -5.929 1.00 0.00 C ATOM 456 CG LEU A 32 -9.066 -7.331 -5.015 1.00 0.00 C ATOM 457 CD1 LEU A 32 -10.363 -7.275 -5.826 1.00 0.00 C ATOM 458 CD2 LEU A 32 -8.991 -8.584 -4.141 1.00 0.00 C ATOM 0 H LEU A 32 -6.935 -4.656 -6.770 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.675 -6.407 -4.379 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -8.177 -6.901 -6.914 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.416 -8.221 -6.049 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.067 -6.471 -4.345 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -11.217 -7.352 -5.153 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.413 -6.331 -6.368 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -10.384 -8.102 -6.536 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.872 -8.635 -3.501 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -8.952 -9.469 -4.776 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -8.095 -8.543 -3.522 1.00 0.00 H new ATOM 470 N PHE A 33 -4.568 -7.305 -5.218 1.00 0.00 N ATOM 471 CA PHE A 33 -3.230 -7.695 -5.627 1.00 0.00 C ATOM 472 C PHE A 33 -2.872 -9.080 -5.084 1.00 0.00 C ATOM 473 O PHE A 33 -3.566 -9.609 -4.217 1.00 0.00 O ATOM 474 CB PHE A 33 -2.264 -6.665 -5.039 1.00 0.00 C ATOM 475 CG PHE A 33 -2.474 -5.243 -5.565 1.00 0.00 C ATOM 476 CD1 PHE A 33 -2.468 -5.006 -6.904 1.00 0.00 C ATOM 477 CD2 PHE A 33 -2.667 -4.217 -4.694 1.00 0.00 C ATOM 478 CE1 PHE A 33 -2.663 -3.687 -7.392 1.00 0.00 C ATOM 479 CE2 PHE A 33 -2.862 -2.898 -5.182 1.00 0.00 C ATOM 480 CZ PHE A 33 -2.856 -2.661 -6.521 1.00 0.00 C ATOM 0 H PHE A 33 -4.830 -7.602 -4.278 1.00 0.00 H new ATOM 0 HA PHE A 33 -3.171 -7.734 -6.715 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -2.371 -6.660 -3.954 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -1.242 -6.975 -5.257 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -2.315 -5.821 -7.596 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -2.672 -4.405 -3.631 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -2.658 -3.499 -8.455 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.015 -2.083 -4.490 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.005 -1.658 -6.893 1.00 0.00 H new ATOM 490 N SER A 34 -1.789 -9.627 -5.616 1.00 0.00 N ATOM 491 CA SER A 34 -1.331 -10.941 -5.195 1.00 0.00 C ATOM 492 C SER A 34 -0.062 -10.806 -4.351 1.00 0.00 C ATOM 493 O SER A 34 0.593 -9.765 -4.369 1.00 0.00 O ATOM 494 CB SER A 34 -1.073 -11.846 -6.401 1.00 0.00 C ATOM 495 OG SER A 34 0.176 -12.526 -6.301 1.00 0.00 O ATOM 0 H SER A 34 -1.215 -9.185 -6.334 1.00 0.00 H new ATOM 0 HA SER A 34 -2.114 -11.400 -4.592 1.00 0.00 H new ATOM 0 HB2 SER A 34 -1.878 -12.576 -6.485 1.00 0.00 H new ATOM 0 HB3 SER A 34 -1.089 -11.249 -7.313 1.00 0.00 H new ATOM 0 HG SER A 34 0.170 -13.309 -6.890 1.00 0.00 H new ATOM 501 N PRO A 35 0.257 -11.904 -3.613 1.00 0.00 N ATOM 502 CA PRO A 35 1.436 -11.918 -2.764 1.00 0.00 C ATOM 503 C PRO A 35 2.710 -12.067 -3.599 1.00 0.00 C ATOM 504 O PRO A 35 3.817 -11.982 -3.068 1.00 0.00 O ATOM 505 CB PRO A 35 1.216 -13.076 -1.805 1.00 0.00 C ATOM 506 CG PRO A 35 0.150 -13.951 -2.445 1.00 0.00 C ATOM 507 CD PRO A 35 -0.495 -13.154 -3.567 1.00 0.00 C ATOM 0 HA PRO A 35 1.572 -10.985 -2.217 1.00 0.00 H new ATOM 0 HB2 PRO A 35 2.139 -13.635 -1.650 1.00 0.00 H new ATOM 0 HB3 PRO A 35 0.892 -12.718 -0.828 1.00 0.00 H new ATOM 0 HG2 PRO A 35 0.592 -14.868 -2.834 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -0.597 -14.244 -1.707 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -0.436 -13.687 -4.516 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -1.551 -12.974 -3.368 1.00 0.00 H new ATOM 515 N ASN A 36 2.511 -12.286 -4.890 1.00 0.00 N ATOM 516 CA ASN A 36 3.630 -12.447 -5.803 1.00 0.00 C ATOM 517 C ASN A 36 3.843 -11.145 -6.577 1.00 0.00 C ATOM 518 O ASN A 36 4.902 -10.935 -7.167 1.00 0.00 O ATOM 519 CB ASN A 36 3.359 -13.561 -6.816 1.00 0.00 C ATOM 520 CG ASN A 36 4.127 -14.833 -6.452 1.00 0.00 C ATOM 521 OD1 ASN A 36 5.265 -15.035 -6.841 1.00 0.00 O ATOM 522 ND2 ASN A 36 3.443 -15.677 -5.685 1.00 0.00 N ATOM 0 H ASN A 36 1.591 -12.356 -5.326 1.00 0.00 H new ATOM 0 HA ASN A 36 4.511 -12.702 -5.214 1.00 0.00 H new ATOM 0 HB2 ASN A 36 2.291 -13.774 -6.850 1.00 0.00 H new ATOM 0 HB3 ASN A 36 3.650 -13.229 -7.813 1.00 0.00 H new ATOM 0 HD21 ASN A 36 3.869 -16.555 -5.387 1.00 0.00 H new ATOM 0 HD22 ASN A 36 2.493 -15.446 -5.394 1.00 0.00 H new ATOM 529 N ASP A 37 2.820 -10.304 -6.550 1.00 0.00 N ATOM 530 CA ASP A 37 2.882 -9.028 -7.243 1.00 0.00 C ATOM 531 C ASP A 37 3.752 -8.059 -6.440 1.00 0.00 C ATOM 532 O ASP A 37 3.684 -8.028 -5.212 1.00 0.00 O ATOM 533 CB ASP A 37 1.490 -8.409 -7.381 1.00 0.00 C ATOM 534 CG ASP A 37 0.589 -9.068 -8.428 1.00 0.00 C ATOM 535 OD1 ASP A 37 0.997 -10.136 -8.935 1.00 0.00 O ATOM 536 OD2 ASP A 37 -0.486 -8.491 -8.697 1.00 0.00 O ATOM 0 H ASP A 37 1.943 -10.481 -6.059 1.00 0.00 H new ATOM 0 HA ASP A 37 3.300 -9.202 -8.235 1.00 0.00 H new ATOM 0 HB2 ASP A 37 0.991 -8.456 -6.413 1.00 0.00 H new ATOM 0 HB3 ASP A 37 1.601 -7.354 -7.632 1.00 0.00 H new ATOM 541 N SER A 38 4.551 -7.291 -7.167 1.00 0.00 N ATOM 542 CA SER A 38 5.434 -6.324 -6.538 1.00 0.00 C ATOM 543 C SER A 38 4.790 -4.936 -6.557 1.00 0.00 C ATOM 544 O SER A 38 3.787 -4.724 -7.237 1.00 0.00 O ATOM 545 CB SER A 38 6.796 -6.286 -7.235 1.00 0.00 C ATOM 546 OG SER A 38 6.711 -5.729 -8.543 1.00 0.00 O ATOM 0 H SER A 38 4.605 -7.319 -8.185 1.00 0.00 H new ATOM 0 HA SER A 38 5.593 -6.630 -5.504 1.00 0.00 H new ATOM 0 HB2 SER A 38 7.493 -5.700 -6.636 1.00 0.00 H new ATOM 0 HB3 SER A 38 7.200 -7.297 -7.297 1.00 0.00 H new ATOM 0 HG SER A 38 7.601 -5.721 -8.954 1.00 0.00 H new ATOM 552 N ALA A 39 5.392 -4.028 -5.804 1.00 0.00 N ATOM 553 CA ALA A 39 4.889 -2.667 -5.726 1.00 0.00 C ATOM 554 C ALA A 39 4.630 -2.143 -7.140 1.00 0.00 C ATOM 555 O ALA A 39 3.624 -1.478 -7.385 1.00 0.00 O ATOM 556 CB ALA A 39 5.885 -1.798 -4.955 1.00 0.00 C ATOM 0 H ALA A 39 6.224 -4.208 -5.242 1.00 0.00 H new ATOM 0 HA ALA A 39 3.943 -2.637 -5.185 1.00 0.00 H new ATOM 0 HB1 ALA A 39 5.508 -0.777 -4.896 1.00 0.00 H new ATOM 0 HB2 ALA A 39 6.012 -2.196 -3.948 1.00 0.00 H new ATOM 0 HB3 ALA A 39 6.845 -1.801 -5.470 1.00 0.00 H new ATOM 562 N SER A 40 5.554 -2.461 -8.034 1.00 0.00 N ATOM 563 CA SER A 40 5.438 -2.030 -9.417 1.00 0.00 C ATOM 564 C SER A 40 4.091 -2.472 -9.991 1.00 0.00 C ATOM 565 O SER A 40 3.340 -1.654 -10.521 1.00 0.00 O ATOM 566 CB SER A 40 6.584 -2.585 -10.265 1.00 0.00 C ATOM 567 OG SER A 40 6.297 -2.521 -11.659 1.00 0.00 O ATOM 0 H SER A 40 6.387 -3.012 -7.828 1.00 0.00 H new ATOM 0 HA SER A 40 5.497 -0.942 -9.442 1.00 0.00 H new ATOM 0 HB2 SER A 40 7.494 -2.023 -10.056 1.00 0.00 H new ATOM 0 HB3 SER A 40 6.776 -3.620 -9.982 1.00 0.00 H new ATOM 0 HG SER A 40 7.054 -2.883 -12.166 1.00 0.00 H new ATOM 573 N ASP A 41 3.825 -3.764 -9.866 1.00 0.00 N ATOM 574 CA ASP A 41 2.581 -4.324 -10.366 1.00 0.00 C ATOM 575 C ASP A 41 1.403 -3.544 -9.778 1.00 0.00 C ATOM 576 O ASP A 41 0.433 -3.258 -10.478 1.00 0.00 O ATOM 577 CB ASP A 41 2.431 -5.789 -9.953 1.00 0.00 C ATOM 578 CG ASP A 41 2.036 -6.742 -11.083 1.00 0.00 C ATOM 579 OD1 ASP A 41 1.131 -6.361 -11.856 1.00 0.00 O ATOM 580 OD2 ASP A 41 2.648 -7.830 -11.148 1.00 0.00 O ATOM 0 H ASP A 41 4.450 -4.439 -9.426 1.00 0.00 H new ATOM 0 HA ASP A 41 2.594 -4.256 -11.454 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.374 -6.128 -9.525 1.00 0.00 H new ATOM 0 HB3 ASP A 41 1.681 -5.854 -9.165 1.00 0.00 H new ATOM 585 N ILE A 42 1.527 -3.223 -8.499 1.00 0.00 N ATOM 586 CA ILE A 42 0.485 -2.482 -7.809 1.00 0.00 C ATOM 587 C ILE A 42 0.356 -1.091 -8.432 1.00 0.00 C ATOM 588 O ILE A 42 -0.603 -0.815 -9.151 1.00 0.00 O ATOM 589 CB ILE A 42 0.751 -2.459 -6.303 1.00 0.00 C ATOM 590 CG1 ILE A 42 0.715 -3.872 -5.717 1.00 0.00 C ATOM 591 CG2 ILE A 42 -0.220 -1.517 -5.588 1.00 0.00 C ATOM 592 CD1 ILE A 42 1.141 -3.868 -4.248 1.00 0.00 C ATOM 0 H ILE A 42 2.333 -3.462 -7.922 1.00 0.00 H new ATOM 0 HA ILE A 42 -0.478 -2.977 -7.931 1.00 0.00 H new ATOM 0 HB ILE A 42 1.756 -2.069 -6.141 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -0.291 -4.281 -5.806 1.00 0.00 H new ATOM 0 HG13 ILE A 42 1.376 -4.524 -6.289 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -0.009 -1.520 -4.519 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -0.101 -0.506 -5.979 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -1.243 -1.853 -5.756 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.106 -4.885 -3.856 1.00 0.00 H new ATOM 0 HD12 ILE A 42 2.157 -3.481 -4.165 1.00 0.00 H new ATOM 0 HD13 ILE A 42 0.464 -3.235 -3.675 1.00 0.00 H new ATOM 604 N ALA A 43 1.337 -0.251 -8.134 1.00 0.00 N ATOM 605 CA ALA A 43 1.345 1.105 -8.656 1.00 0.00 C ATOM 606 C ALA A 43 0.882 1.088 -10.115 1.00 0.00 C ATOM 607 O ALA A 43 -0.158 1.654 -10.446 1.00 0.00 O ATOM 608 CB ALA A 43 2.743 1.706 -8.495 1.00 0.00 C ATOM 0 H ALA A 43 2.131 -0.483 -7.538 1.00 0.00 H new ATOM 0 HA ALA A 43 0.653 1.735 -8.098 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.749 2.723 -8.887 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.013 1.722 -7.439 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.464 1.101 -9.045 1.00 0.00 H new ATOM 614 N LYS A 44 1.678 0.433 -10.947 1.00 0.00 N ATOM 615 CA LYS A 44 1.363 0.335 -12.362 1.00 0.00 C ATOM 616 C LYS A 44 -0.120 -0.001 -12.528 1.00 0.00 C ATOM 617 O LYS A 44 -0.870 0.765 -13.131 1.00 0.00 O ATOM 618 CB LYS A 44 2.300 -0.659 -13.052 1.00 0.00 C ATOM 619 CG LYS A 44 2.309 -0.443 -14.567 1.00 0.00 C ATOM 620 CD LYS A 44 3.387 0.564 -14.971 1.00 0.00 C ATOM 621 CE LYS A 44 2.923 1.421 -16.150 1.00 0.00 C ATOM 622 NZ LYS A 44 2.956 2.857 -15.792 1.00 0.00 N ATOM 0 H LYS A 44 2.540 -0.035 -10.668 1.00 0.00 H new ATOM 0 HA LYS A 44 1.531 1.292 -12.857 1.00 0.00 H new ATOM 0 HB2 LYS A 44 3.310 -0.545 -12.659 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.984 -1.678 -12.828 1.00 0.00 H new ATOM 0 HG2 LYS A 44 2.486 -1.393 -15.072 1.00 0.00 H new ATOM 0 HG3 LYS A 44 1.332 -0.086 -14.893 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.627 1.205 -14.123 1.00 0.00 H new ATOM 0 HD3 LYS A 44 4.302 0.035 -15.239 1.00 0.00 H new ATOM 0 HE2 LYS A 44 3.564 1.240 -17.013 1.00 0.00 H new ATOM 0 HE3 LYS A 44 1.912 1.135 -16.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 3.144 3.423 -16.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 2.039 3.135 -15.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 3.708 3.023 -15.093 1.00 0.00 H new ATOM 636 N HIS A 45 -0.499 -1.148 -11.982 1.00 0.00 N ATOM 637 CA HIS A 45 -1.879 -1.595 -12.062 1.00 0.00 C ATOM 638 C HIS A 45 -2.817 -0.402 -11.864 1.00 0.00 C ATOM 639 O HIS A 45 -3.626 -0.092 -12.737 1.00 0.00 O ATOM 640 CB HIS A 45 -2.142 -2.728 -11.068 1.00 0.00 C ATOM 641 CG HIS A 45 -3.605 -3.044 -10.870 1.00 0.00 C ATOM 642 ND1 HIS A 45 -4.256 -4.048 -11.565 1.00 0.00 N ATOM 643 CD2 HIS A 45 -4.535 -2.479 -10.048 1.00 0.00 C ATOM 644 CE1 HIS A 45 -5.521 -4.077 -11.172 1.00 0.00 C ATOM 645 NE2 HIS A 45 -5.692 -3.103 -10.232 1.00 0.00 N ATOM 0 H HIS A 45 0.126 -1.781 -11.483 1.00 0.00 H new ATOM 0 HA HIS A 45 -2.075 -2.007 -13.052 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -1.630 -3.626 -11.413 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -1.705 -2.462 -10.106 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -4.360 -1.662 -9.363 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -6.283 -4.753 -11.532 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -6.565 -2.889 -9.750 1.00 0.00 H new ATOM 653 N VAL A 46 -2.678 0.233 -10.710 1.00 0.00 N ATOM 654 CA VAL A 46 -3.503 1.384 -10.385 1.00 0.00 C ATOM 655 C VAL A 46 -3.547 2.330 -11.588 1.00 0.00 C ATOM 656 O VAL A 46 -4.616 2.587 -12.140 1.00 0.00 O ATOM 657 CB VAL A 46 -2.983 2.059 -9.114 1.00 0.00 C ATOM 658 CG1 VAL A 46 -3.727 3.368 -8.844 1.00 0.00 C ATOM 659 CG2 VAL A 46 -3.082 1.115 -7.913 1.00 0.00 C ATOM 0 H VAL A 46 -2.006 -0.028 -9.988 1.00 0.00 H new ATOM 0 HA VAL A 46 -4.527 1.073 -10.177 1.00 0.00 H new ATOM 0 HB VAL A 46 -1.931 2.298 -9.268 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -3.338 3.827 -7.935 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -3.584 4.048 -9.684 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -4.790 3.163 -8.720 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -2.706 1.619 -7.022 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -4.123 0.832 -7.758 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -2.487 0.221 -8.103 1.00 0.00 H new ATOM 669 N TYR A 47 -2.374 2.820 -11.958 1.00 0.00 N ATOM 670 CA TYR A 47 -2.265 3.732 -13.084 1.00 0.00 C ATOM 671 C TYR A 47 -2.944 3.151 -14.326 1.00 0.00 C ATOM 672 O TYR A 47 -3.770 3.813 -14.953 1.00 0.00 O ATOM 673 CB TYR A 47 -0.768 3.884 -13.361 1.00 0.00 C ATOM 674 CG TYR A 47 -0.447 4.701 -14.614 1.00 0.00 C ATOM 675 CD1 TYR A 47 -0.750 6.046 -14.657 1.00 0.00 C ATOM 676 CD2 TYR A 47 0.146 4.092 -15.701 1.00 0.00 C ATOM 677 CE1 TYR A 47 -0.447 6.815 -15.837 1.00 0.00 C ATOM 678 CE2 TYR A 47 0.449 4.860 -16.881 1.00 0.00 C ATOM 679 CZ TYR A 47 0.137 6.184 -16.890 1.00 0.00 C ATOM 680 OH TYR A 47 0.423 6.910 -18.004 1.00 0.00 O ATOM 0 H TYR A 47 -1.490 2.603 -11.498 1.00 0.00 H new ATOM 0 HA TYR A 47 -2.746 4.683 -12.856 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -0.296 4.357 -12.500 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -0.325 2.893 -13.462 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -1.214 6.523 -13.806 1.00 0.00 H new ATOM 0 HD2 TYR A 47 0.383 3.039 -15.667 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -0.679 7.869 -15.884 1.00 0.00 H new ATOM 0 HE2 TYR A 47 0.913 4.396 -17.739 1.00 0.00 H new ATOM 0 HH TYR A 47 0.839 6.329 -18.675 1.00 0.00 H new ATOM 690 N ASP A 48 -2.571 1.920 -14.645 1.00 0.00 N ATOM 691 CA ASP A 48 -3.134 1.243 -15.801 1.00 0.00 C ATOM 692 C ASP A 48 -4.661 1.324 -15.740 1.00 0.00 C ATOM 693 O ASP A 48 -5.310 1.630 -16.739 1.00 0.00 O ATOM 694 CB ASP A 48 -2.740 -0.235 -15.819 1.00 0.00 C ATOM 695 CG ASP A 48 -1.649 -0.600 -16.829 1.00 0.00 C ATOM 696 OD1 ASP A 48 -0.553 -0.010 -16.719 1.00 0.00 O ATOM 697 OD2 ASP A 48 -1.937 -1.462 -17.688 1.00 0.00 O ATOM 0 H ASP A 48 -1.886 1.374 -14.123 1.00 0.00 H new ATOM 0 HA ASP A 48 -2.750 1.730 -16.697 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.401 -0.518 -14.822 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -3.628 -0.830 -16.034 1.00 0.00 H new ATOM 702 N ASN A 49 -5.190 1.044 -14.558 1.00 0.00 N ATOM 703 CA ASN A 49 -6.628 1.081 -14.355 1.00 0.00 C ATOM 704 C ASN A 49 -7.135 2.506 -14.588 1.00 0.00 C ATOM 705 O ASN A 49 -7.967 2.736 -15.465 1.00 0.00 O ATOM 706 CB ASN A 49 -6.992 0.679 -12.924 1.00 0.00 C ATOM 707 CG ASN A 49 -6.175 -0.532 -12.470 1.00 0.00 C ATOM 708 OD1 ASN A 49 -5.723 -0.620 -11.340 1.00 0.00 O ATOM 709 ND2 ASN A 49 -6.010 -1.458 -13.411 1.00 0.00 N ATOM 0 H ASN A 49 -4.649 0.791 -13.731 1.00 0.00 H new ATOM 0 HA ASN A 49 -7.086 0.382 -15.055 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -6.812 1.517 -12.250 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -8.055 0.447 -12.867 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -5.478 -2.304 -13.206 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -6.415 -1.322 -14.337 1.00 0.00 H new ATOM 716 N TRP A 50 -6.613 3.424 -13.789 1.00 0.00 N ATOM 717 CA TRP A 50 -7.002 4.820 -13.898 1.00 0.00 C ATOM 718 C TRP A 50 -6.785 5.260 -15.347 1.00 0.00 C ATOM 719 O TRP A 50 -5.658 5.252 -15.840 1.00 0.00 O ATOM 720 CB TRP A 50 -6.240 5.682 -12.891 1.00 0.00 C ATOM 721 CG TRP A 50 -7.014 5.965 -11.602 1.00 0.00 C ATOM 722 CD1 TRP A 50 -8.328 6.181 -11.459 1.00 0.00 C ATOM 723 CD2 TRP A 50 -6.463 6.056 -10.271 1.00 0.00 C ATOM 724 NE1 TRP A 50 -8.665 6.402 -10.139 1.00 0.00 N ATOM 725 CE2 TRP A 50 -7.494 6.324 -9.394 1.00 0.00 C ATOM 726 CE3 TRP A 50 -5.138 5.916 -9.822 1.00 0.00 C ATOM 727 CZ2 TRP A 50 -7.308 6.475 -8.014 1.00 0.00 C ATOM 728 CZ3 TRP A 50 -4.968 6.070 -8.441 1.00 0.00 C ATOM 729 CH2 TRP A 50 -5.996 6.340 -7.545 1.00 0.00 C ATOM 0 H TRP A 50 -5.924 3.229 -13.063 1.00 0.00 H new ATOM 0 HA TRP A 50 -8.056 4.947 -13.650 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -5.303 5.185 -12.638 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -5.981 6.630 -13.363 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -9.036 6.182 -12.275 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -9.600 6.588 -9.777 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -4.316 5.706 -10.490 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -8.132 6.684 -7.348 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -3.968 5.972 -8.044 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -5.783 6.445 -6.491 1.00 0.00 H new ATOM 740 N PRO A 51 -7.911 5.643 -16.007 1.00 0.00 N ATOM 741 CA PRO A 51 -7.854 6.085 -17.390 1.00 0.00 C ATOM 742 C PRO A 51 -7.273 7.497 -17.491 1.00 0.00 C ATOM 743 O PRO A 51 -7.979 8.439 -17.849 1.00 0.00 O ATOM 744 CB PRO A 51 -9.286 5.995 -17.891 1.00 0.00 C ATOM 745 CG PRO A 51 -10.161 5.953 -16.648 1.00 0.00 C ATOM 746 CD PRO A 51 -9.263 5.665 -15.456 1.00 0.00 C ATOM 0 HA PRO A 51 -7.193 5.470 -18.001 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -9.536 6.853 -18.516 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -9.431 5.103 -18.501 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -10.680 6.902 -16.514 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -10.926 5.182 -16.745 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -9.365 6.432 -14.689 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -9.516 4.713 -14.990 1.00 0.00 H new ATOM 754 N MET A 52 -5.992 7.599 -17.169 1.00 0.00 N ATOM 755 CA MET A 52 -5.308 8.880 -17.218 1.00 0.00 C ATOM 756 C MET A 52 -6.018 9.916 -16.344 1.00 0.00 C ATOM 757 O MET A 52 -6.789 10.733 -16.846 1.00 0.00 O ATOM 758 CB MET A 52 -5.261 9.378 -18.664 1.00 0.00 C ATOM 759 CG MET A 52 -4.474 10.687 -18.768 1.00 0.00 C ATOM 760 SD MET A 52 -5.569 12.023 -19.216 1.00 0.00 S ATOM 761 CE MET A 52 -5.718 11.728 -20.970 1.00 0.00 C ATOM 0 H MET A 52 -5.410 6.816 -16.873 1.00 0.00 H new ATOM 0 HA MET A 52 -4.296 8.745 -16.837 1.00 0.00 H new ATOM 0 HB2 MET A 52 -4.800 8.621 -19.298 1.00 0.00 H new ATOM 0 HB3 MET A 52 -6.275 9.529 -19.034 1.00 0.00 H new ATOM 0 HG2 MET A 52 -3.990 10.906 -17.817 1.00 0.00 H new ATOM 0 HG3 MET A 52 -3.684 10.588 -19.513 1.00 0.00 H new ATOM 0 HE1 MET A 52 -5.277 12.561 -21.518 1.00 0.00 H new ATOM 0 HE2 MET A 52 -5.196 10.807 -21.230 1.00 0.00 H new ATOM 0 HE3 MET A 52 -6.771 11.636 -21.235 1.00 0.00 H new ATOM 771 N ASP A 53 -5.734 9.847 -15.052 1.00 0.00 N ATOM 772 CA ASP A 53 -6.336 10.769 -14.103 1.00 0.00 C ATOM 773 C ASP A 53 -5.270 11.244 -13.114 1.00 0.00 C ATOM 774 O ASP A 53 -5.184 10.737 -11.997 1.00 0.00 O ATOM 775 CB ASP A 53 -7.450 10.088 -13.306 1.00 0.00 C ATOM 776 CG ASP A 53 -7.873 10.820 -12.031 1.00 0.00 C ATOM 777 OD1 ASP A 53 -8.521 11.880 -12.173 1.00 0.00 O ATOM 778 OD2 ASP A 53 -7.538 10.304 -10.943 1.00 0.00 O ATOM 0 H ASP A 53 -5.095 9.167 -14.640 1.00 0.00 H new ATOM 0 HA ASP A 53 -6.753 11.606 -14.663 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -8.322 9.978 -13.950 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -7.123 9.083 -13.039 1.00 0.00 H new ATOM 783 N TRP A 54 -4.484 12.213 -13.560 1.00 0.00 N ATOM 784 CA TRP A 54 -3.427 12.763 -12.728 1.00 0.00 C ATOM 785 C TRP A 54 -2.786 13.927 -13.486 1.00 0.00 C ATOM 786 O TRP A 54 -2.688 13.896 -14.712 1.00 0.00 O ATOM 787 CB TRP A 54 -2.421 11.680 -12.333 1.00 0.00 C ATOM 788 CG TRP A 54 -1.855 11.842 -10.921 1.00 0.00 C ATOM 789 CD1 TRP A 54 -1.109 12.847 -10.442 1.00 0.00 C ATOM 790 CD2 TRP A 54 -2.019 10.926 -9.819 1.00 0.00 C ATOM 791 NE1 TRP A 54 -0.783 12.646 -9.116 1.00 0.00 N ATOM 792 CE2 TRP A 54 -1.354 11.441 -8.725 1.00 0.00 C ATOM 793 CE3 TRP A 54 -2.708 9.702 -9.748 1.00 0.00 C ATOM 794 CZ2 TRP A 54 -1.312 10.799 -7.481 1.00 0.00 C ATOM 795 CZ3 TRP A 54 -2.656 9.073 -8.498 1.00 0.00 C ATOM 796 CH2 TRP A 54 -1.991 9.579 -7.387 1.00 0.00 C ATOM 0 H TRP A 54 -4.558 12.632 -14.487 1.00 0.00 H new ATOM 0 HA TRP A 54 -3.832 13.140 -11.789 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -2.903 10.705 -12.411 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -1.597 11.686 -13.047 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -0.802 13.706 -11.020 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -0.225 13.268 -8.531 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -3.235 9.281 -10.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -0.784 11.223 -6.640 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -3.168 8.129 -8.389 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -1.998 9.033 -6.455 1.00 0.00 H new ATOM 807 N GLU A 55 -2.367 14.927 -12.725 1.00 0.00 N ATOM 808 CA GLU A 55 -1.738 16.100 -13.309 1.00 0.00 C ATOM 809 C GLU A 55 -0.245 15.846 -13.531 1.00 0.00 C ATOM 810 O GLU A 55 0.592 16.642 -13.110 1.00 0.00 O ATOM 811 CB GLU A 55 -1.960 17.335 -12.434 1.00 0.00 C ATOM 812 CG GLU A 55 -2.263 18.566 -13.290 1.00 0.00 C ATOM 813 CD GLU A 55 -2.362 19.824 -12.425 1.00 0.00 C ATOM 814 OE1 GLU A 55 -1.338 20.158 -11.790 1.00 0.00 O ATOM 815 OE2 GLU A 55 -3.459 20.424 -12.418 1.00 0.00 O ATOM 0 H GLU A 55 -2.451 14.949 -11.709 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.202 16.293 -14.276 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.786 17.154 -11.746 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.074 17.519 -11.827 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -1.480 18.695 -14.038 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -3.198 18.417 -13.830 1.00 0.00 H new ATOM 822 N GLU A 56 0.042 14.735 -14.192 1.00 0.00 N ATOM 823 CA GLU A 56 1.418 14.366 -14.475 1.00 0.00 C ATOM 824 C GLU A 56 1.464 13.225 -15.493 1.00 0.00 C ATOM 825 O GLU A 56 1.962 12.141 -15.194 1.00 0.00 O ATOM 826 CB GLU A 56 2.159 13.986 -13.192 1.00 0.00 C ATOM 827 CG GLU A 56 3.651 13.779 -13.461 1.00 0.00 C ATOM 828 CD GLU A 56 4.472 14.960 -12.939 1.00 0.00 C ATOM 829 OE1 GLU A 56 4.528 15.976 -13.665 1.00 0.00 O ATOM 830 OE2 GLU A 56 5.024 14.820 -11.827 1.00 0.00 O ATOM 0 H GLU A 56 -0.656 14.078 -14.540 1.00 0.00 H new ATOM 0 HA GLU A 56 1.924 15.231 -14.905 1.00 0.00 H new ATOM 0 HB2 GLU A 56 2.026 14.769 -12.445 1.00 0.00 H new ATOM 0 HB3 GLU A 56 1.731 13.074 -12.777 1.00 0.00 H new ATOM 0 HG2 GLU A 56 3.986 12.859 -12.982 1.00 0.00 H new ATOM 0 HG3 GLU A 56 3.818 13.660 -14.532 1.00 0.00 H new ATOM 837 N GLU A 57 0.938 13.508 -16.676 1.00 0.00 N ATOM 838 CA GLU A 57 0.912 12.519 -17.740 1.00 0.00 C ATOM 839 C GLU A 57 2.186 12.612 -18.582 1.00 0.00 C ATOM 840 O GLU A 57 2.158 13.120 -19.702 1.00 0.00 O ATOM 841 CB GLU A 57 -0.335 12.683 -18.611 1.00 0.00 C ATOM 842 CG GLU A 57 -0.351 11.654 -19.744 1.00 0.00 C ATOM 843 CD GLU A 57 -1.139 12.177 -20.947 1.00 0.00 C ATOM 844 OE1 GLU A 57 -2.367 11.946 -20.966 1.00 0.00 O ATOM 845 OE2 GLU A 57 -0.494 12.795 -21.822 1.00 0.00 O ATOM 0 H GLU A 57 0.526 14.409 -16.921 1.00 0.00 H new ATOM 0 HA GLU A 57 0.871 11.528 -17.288 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -1.229 12.568 -17.998 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -0.362 13.690 -19.028 1.00 0.00 H new ATOM 0 HG2 GLU A 57 0.671 11.424 -20.046 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -0.796 10.724 -19.390 1.00 0.00 H new ATOM 852 N GLN A 58 3.273 12.113 -18.011 1.00 0.00 N ATOM 853 CA GLN A 58 4.554 12.134 -18.695 1.00 0.00 C ATOM 854 C GLN A 58 5.609 11.396 -17.868 1.00 0.00 C ATOM 855 O GLN A 58 6.755 11.836 -17.782 1.00 0.00 O ATOM 856 CB GLN A 58 4.995 13.569 -18.991 1.00 0.00 C ATOM 857 CG GLN A 58 5.879 13.625 -20.238 1.00 0.00 C ATOM 858 CD GLN A 58 6.982 14.674 -20.082 1.00 0.00 C ATOM 859 OE1 GLN A 58 6.961 15.730 -20.694 1.00 0.00 O ATOM 860 NE2 GLN A 58 7.942 14.327 -19.231 1.00 0.00 N ATOM 0 H GLN A 58 3.292 11.692 -17.082 1.00 0.00 H new ATOM 0 HA GLN A 58 4.442 11.619 -19.649 1.00 0.00 H new ATOM 0 HB2 GLN A 58 4.118 14.200 -19.134 1.00 0.00 H new ATOM 0 HB3 GLN A 58 5.540 13.969 -18.136 1.00 0.00 H new ATOM 0 HG2 GLN A 58 6.325 12.647 -20.416 1.00 0.00 H new ATOM 0 HG3 GLN A 58 5.269 13.860 -21.110 1.00 0.00 H new ATOM 0 HE21 GLN A 58 7.898 13.428 -18.752 1.00 0.00 H new ATOM 0 HE22 GLN A 58 8.723 14.960 -19.057 1.00 0.00 H new ATOM 869 N VAL A 59 5.185 10.286 -17.282 1.00 0.00 N ATOM 870 CA VAL A 59 6.079 9.483 -16.465 1.00 0.00 C ATOM 871 C VAL A 59 6.046 8.034 -16.954 1.00 0.00 C ATOM 872 O VAL A 59 5.090 7.617 -17.607 1.00 0.00 O ATOM 873 CB VAL A 59 5.707 9.625 -14.988 1.00 0.00 C ATOM 874 CG1 VAL A 59 5.609 11.098 -14.586 1.00 0.00 C ATOM 875 CG2 VAL A 59 4.406 8.883 -14.677 1.00 0.00 C ATOM 0 H VAL A 59 4.234 9.924 -17.357 1.00 0.00 H new ATOM 0 HA VAL A 59 7.106 9.835 -16.563 1.00 0.00 H new ATOM 0 HB VAL A 59 6.502 9.170 -14.397 1.00 0.00 H new ATOM 0 HG11 VAL A 59 5.343 11.170 -13.531 1.00 0.00 H new ATOM 0 HG12 VAL A 59 6.570 11.585 -14.752 1.00 0.00 H new ATOM 0 HG13 VAL A 59 4.844 11.589 -15.187 1.00 0.00 H new ATOM 0 HG21 VAL A 59 4.164 9.000 -13.621 1.00 0.00 H new ATOM 0 HG22 VAL A 59 3.598 9.295 -15.282 1.00 0.00 H new ATOM 0 HG23 VAL A 59 4.527 7.824 -14.907 1.00 0.00 H new ATOM 885 N SER A 60 7.101 7.306 -16.620 1.00 0.00 N ATOM 886 CA SER A 60 7.204 5.912 -17.017 1.00 0.00 C ATOM 887 C SER A 60 8.414 5.263 -16.340 1.00 0.00 C ATOM 888 O SER A 60 9.055 4.386 -16.916 1.00 0.00 O ATOM 889 CB SER A 60 7.312 5.778 -18.537 1.00 0.00 C ATOM 890 OG SER A 60 6.214 5.056 -19.088 1.00 0.00 O ATOM 0 H SER A 60 7.892 7.655 -16.079 1.00 0.00 H new ATOM 0 HA SER A 60 6.297 5.398 -16.698 1.00 0.00 H new ATOM 0 HB2 SER A 60 7.356 6.770 -18.986 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.243 5.272 -18.791 1.00 0.00 H new ATOM 0 HG SER A 60 6.319 4.993 -20.060 1.00 0.00 H new ATOM 896 N SER A 61 8.689 5.721 -15.128 1.00 0.00 N ATOM 897 CA SER A 61 9.811 5.196 -14.367 1.00 0.00 C ATOM 898 C SER A 61 9.422 5.051 -12.895 1.00 0.00 C ATOM 899 O SER A 61 8.705 5.891 -12.352 1.00 0.00 O ATOM 900 CB SER A 61 11.039 6.097 -14.505 1.00 0.00 C ATOM 901 OG SER A 61 11.855 6.070 -13.337 1.00 0.00 O ATOM 0 H SER A 61 8.155 6.449 -14.654 1.00 0.00 H new ATOM 0 HA SER A 61 10.067 4.215 -14.767 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.627 5.779 -15.366 1.00 0.00 H new ATOM 0 HB3 SER A 61 10.718 7.120 -14.699 1.00 0.00 H new ATOM 0 HG SER A 61 12.794 5.966 -13.597 1.00 0.00 H new ATOM 907 N PRO A 62 9.924 3.950 -12.273 1.00 0.00 N ATOM 908 CA PRO A 62 9.636 3.684 -10.874 1.00 0.00 C ATOM 909 C PRO A 62 10.444 4.609 -9.963 1.00 0.00 C ATOM 910 O PRO A 62 10.065 4.843 -8.816 1.00 0.00 O ATOM 911 CB PRO A 62 9.972 2.214 -10.676 1.00 0.00 C ATOM 912 CG PRO A 62 10.869 1.831 -11.842 1.00 0.00 C ATOM 913 CD PRO A 62 10.776 2.934 -12.884 1.00 0.00 C ATOM 0 HA PRO A 62 8.596 3.880 -10.614 1.00 0.00 H new ATOM 0 HB2 PRO A 62 10.479 2.054 -9.724 1.00 0.00 H new ATOM 0 HB3 PRO A 62 9.068 1.605 -10.662 1.00 0.00 H new ATOM 0 HG2 PRO A 62 11.899 1.708 -11.507 1.00 0.00 H new ATOM 0 HG3 PRO A 62 10.556 0.877 -12.267 1.00 0.00 H new ATOM 0 HD2 PRO A 62 11.760 3.335 -13.125 1.00 0.00 H new ATOM 0 HD3 PRO A 62 10.346 2.564 -13.815 1.00 0.00 H new ATOM 921 N ASN A 63 11.543 5.112 -10.507 1.00 0.00 N ATOM 922 CA ASN A 63 12.407 6.007 -9.757 1.00 0.00 C ATOM 923 C ASN A 63 11.590 7.200 -9.258 1.00 0.00 C ATOM 924 O ASN A 63 11.904 7.783 -8.221 1.00 0.00 O ATOM 925 CB ASN A 63 13.540 6.543 -10.635 1.00 0.00 C ATOM 926 CG ASN A 63 14.842 5.784 -10.375 1.00 0.00 C ATOM 927 OD1 ASN A 63 15.718 6.231 -9.654 1.00 0.00 O ATOM 928 ND2 ASN A 63 14.919 4.613 -11.002 1.00 0.00 N ATOM 0 H ASN A 63 11.854 4.916 -11.458 1.00 0.00 H new ATOM 0 HA ASN A 63 12.831 5.446 -8.924 1.00 0.00 H new ATOM 0 HB2 ASN A 63 13.265 6.451 -11.686 1.00 0.00 H new ATOM 0 HB3 ASN A 63 13.688 7.604 -10.436 1.00 0.00 H new ATOM 0 HD21 ASN A 63 15.749 4.030 -10.893 1.00 0.00 H new ATOM 0 HD22 ASN A 63 14.148 4.298 -11.591 1.00 0.00 H new ATOM 935 N ILE A 64 10.557 7.528 -10.020 1.00 0.00 N ATOM 936 CA ILE A 64 9.691 8.642 -9.669 1.00 0.00 C ATOM 937 C ILE A 64 8.313 8.106 -9.276 1.00 0.00 C ATOM 938 O ILE A 64 7.324 8.366 -9.960 1.00 0.00 O ATOM 939 CB ILE A 64 9.652 9.668 -10.803 1.00 0.00 C ATOM 940 CG1 ILE A 64 9.423 8.986 -12.153 1.00 0.00 C ATOM 941 CG2 ILE A 64 10.916 10.532 -10.804 1.00 0.00 C ATOM 942 CD1 ILE A 64 9.076 10.012 -13.234 1.00 0.00 C ATOM 0 H ILE A 64 10.300 7.042 -10.879 1.00 0.00 H new ATOM 0 HA ILE A 64 10.085 9.174 -8.803 1.00 0.00 H new ATOM 0 HB ILE A 64 8.806 10.334 -10.632 1.00 0.00 H new ATOM 0 HG12 ILE A 64 10.318 8.436 -12.443 1.00 0.00 H new ATOM 0 HG13 ILE A 64 8.616 8.258 -12.065 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.863 11.253 -11.620 1.00 0.00 H new ATOM 0 HG22 ILE A 64 10.995 11.063 -9.855 1.00 0.00 H new ATOM 0 HG23 ILE A 64 11.791 9.896 -10.938 1.00 0.00 H new ATOM 0 HD11 ILE A 64 8.918 9.501 -14.184 1.00 0.00 H new ATOM 0 HD12 ILE A 64 8.167 10.544 -12.953 1.00 0.00 H new ATOM 0 HD13 ILE A 64 9.895 10.723 -13.337 1.00 0.00 H new ATOM 954 N LEU A 65 8.291 7.369 -8.176 1.00 0.00 N ATOM 955 CA LEU A 65 7.051 6.795 -7.684 1.00 0.00 C ATOM 956 C LEU A 65 7.349 5.906 -6.475 1.00 0.00 C ATOM 957 O LEU A 65 8.193 5.014 -6.548 1.00 0.00 O ATOM 958 CB LEU A 65 6.311 6.071 -8.811 1.00 0.00 C ATOM 959 CG LEU A 65 5.691 4.720 -8.448 1.00 0.00 C ATOM 960 CD1 LEU A 65 4.450 4.904 -7.573 1.00 0.00 C ATOM 961 CD2 LEU A 65 5.391 3.899 -9.704 1.00 0.00 C ATOM 0 H LEU A 65 9.113 7.156 -7.611 1.00 0.00 H new ATOM 0 HA LEU A 65 6.377 7.581 -7.344 1.00 0.00 H new ATOM 0 HB2 LEU A 65 5.519 6.725 -9.177 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.007 5.919 -9.636 1.00 0.00 H new ATOM 0 HG LEU A 65 6.417 4.157 -7.862 1.00 0.00 H new ATOM 0 HD11 LEU A 65 4.029 3.929 -7.329 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.726 5.420 -6.653 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.709 5.495 -8.112 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.951 2.944 -9.418 1.00 0.00 H new ATOM 0 HD22 LEU A 65 4.692 4.445 -10.337 1.00 0.00 H new ATOM 0 HD23 LEU A 65 6.316 3.723 -10.253 1.00 0.00 H new ATOM 973 N ARG A 66 6.639 6.181 -5.390 1.00 0.00 N ATOM 974 CA ARG A 66 6.817 5.417 -4.166 1.00 0.00 C ATOM 975 C ARG A 66 5.468 5.188 -3.483 1.00 0.00 C ATOM 976 O ARG A 66 4.639 6.094 -3.418 1.00 0.00 O ATOM 977 CB ARG A 66 7.756 6.140 -3.198 1.00 0.00 C ATOM 978 CG ARG A 66 9.194 5.642 -3.353 1.00 0.00 C ATOM 979 CD ARG A 66 9.838 5.394 -1.987 1.00 0.00 C ATOM 980 NE ARG A 66 11.072 6.200 -1.856 1.00 0.00 N ATOM 981 CZ ARG A 66 11.818 6.257 -0.744 1.00 0.00 C ATOM 982 NH1 ARG A 66 11.459 5.555 0.340 1.00 0.00 N ATOM 983 NH2 ARG A 66 12.923 7.015 -0.716 1.00 0.00 N ATOM 0 H ARG A 66 5.940 6.922 -5.333 1.00 0.00 H new ATOM 0 HA ARG A 66 7.259 4.458 -4.434 1.00 0.00 H new ATOM 0 HB2 ARG A 66 7.718 7.214 -3.382 1.00 0.00 H new ATOM 0 HB3 ARG A 66 7.421 5.980 -2.173 1.00 0.00 H new ATOM 0 HG2 ARG A 66 9.203 4.721 -3.936 1.00 0.00 H new ATOM 0 HG3 ARG A 66 9.779 6.376 -3.907 1.00 0.00 H new ATOM 0 HD2 ARG A 66 9.138 5.654 -1.193 1.00 0.00 H new ATOM 0 HD3 ARG A 66 10.071 4.335 -1.872 1.00 0.00 H new ATOM 0 HE ARG A 66 11.374 6.747 -2.663 1.00 0.00 H new ATOM 0 HH11 ARG A 66 10.618 4.978 0.318 1.00 0.00 H new ATOM 0 HH12 ARG A 66 12.026 5.598 1.186 1.00 0.00 H new ATOM 0 HH21 ARG A 66 13.196 7.549 -1.541 1.00 0.00 H new ATOM 0 HH22 ARG A 66 13.491 7.058 0.130 1.00 0.00 H new ATOM 997 N LEU A 67 5.290 3.971 -2.990 1.00 0.00 N ATOM 998 CA LEU A 67 4.055 3.611 -2.313 1.00 0.00 C ATOM 999 C LEU A 67 4.268 3.686 -0.800 1.00 0.00 C ATOM 1000 O LEU A 67 5.148 3.018 -0.260 1.00 0.00 O ATOM 1001 CB LEU A 67 3.557 2.248 -2.798 1.00 0.00 C ATOM 1002 CG LEU A 67 3.183 1.244 -1.706 1.00 0.00 C ATOM 1003 CD1 LEU A 67 1.918 1.682 -0.967 1.00 0.00 C ATOM 1004 CD2 LEU A 67 3.051 -0.168 -2.282 1.00 0.00 C ATOM 0 H LEU A 67 5.980 3.222 -3.046 1.00 0.00 H new ATOM 0 HA LEU A 67 3.264 4.319 -2.559 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.685 2.407 -3.432 1.00 0.00 H new ATOM 0 HB3 LEU A 67 4.330 1.803 -3.424 1.00 0.00 H new ATOM 0 HG LEU A 67 3.990 1.220 -0.974 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.675 0.950 -0.196 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.085 2.655 -0.504 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.091 1.754 -1.673 1.00 0.00 H new ATOM 0 HD21 LEU A 67 2.785 -0.863 -1.485 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.274 -0.178 -3.047 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.000 -0.471 -2.725 1.00 0.00 H new ATOM 1016 N ILE A 68 3.446 4.504 -0.159 1.00 0.00 N ATOM 1017 CA ILE A 68 3.533 4.674 1.281 1.00 0.00 C ATOM 1018 C ILE A 68 2.530 3.740 1.962 1.00 0.00 C ATOM 1019 O ILE A 68 1.383 3.634 1.532 1.00 0.00 O ATOM 1020 CB ILE A 68 3.355 6.146 1.658 1.00 0.00 C ATOM 1021 CG1 ILE A 68 4.561 6.976 1.212 1.00 0.00 C ATOM 1022 CG2 ILE A 68 3.076 6.299 3.155 1.00 0.00 C ATOM 1023 CD1 ILE A 68 4.268 7.710 -0.097 1.00 0.00 C ATOM 0 H ILE A 68 2.717 5.056 -0.611 1.00 0.00 H new ATOM 0 HA ILE A 68 4.524 4.394 1.638 1.00 0.00 H new ATOM 0 HB ILE A 68 2.485 6.532 1.127 1.00 0.00 H new ATOM 0 HG12 ILE A 68 4.817 7.697 1.988 1.00 0.00 H new ATOM 0 HG13 ILE A 68 5.426 6.326 1.083 1.00 0.00 H new ATOM 0 HG21 ILE A 68 2.954 7.355 3.396 1.00 0.00 H new ATOM 0 HG22 ILE A 68 2.164 5.760 3.412 1.00 0.00 H new ATOM 0 HG23 ILE A 68 3.911 5.891 3.724 1.00 0.00 H new ATOM 0 HD11 ILE A 68 5.141 8.292 -0.391 1.00 0.00 H new ATOM 0 HD12 ILE A 68 4.036 6.985 -0.877 1.00 0.00 H new ATOM 0 HD13 ILE A 68 3.417 8.377 0.043 1.00 0.00 H new ATOM 1035 N TYR A 69 3.000 3.086 3.014 1.00 0.00 N ATOM 1036 CA TYR A 69 2.160 2.164 3.759 1.00 0.00 C ATOM 1037 C TYR A 69 2.339 2.354 5.267 1.00 0.00 C ATOM 1038 O TYR A 69 3.446 2.219 5.786 1.00 0.00 O ATOM 1039 CB TYR A 69 2.630 0.760 3.375 1.00 0.00 C ATOM 1040 CG TYR A 69 2.003 -0.357 4.211 1.00 0.00 C ATOM 1041 CD1 TYR A 69 0.730 -0.204 4.724 1.00 0.00 C ATOM 1042 CD2 TYR A 69 2.709 -1.518 4.453 1.00 0.00 C ATOM 1043 CE1 TYR A 69 0.140 -1.256 5.511 1.00 0.00 C ATOM 1044 CE2 TYR A 69 2.119 -2.569 5.241 1.00 0.00 C ATOM 1045 CZ TYR A 69 0.863 -2.386 5.730 1.00 0.00 C ATOM 1046 OH TYR A 69 0.305 -3.379 6.474 1.00 0.00 O ATOM 0 H TYR A 69 3.952 3.176 3.368 1.00 0.00 H new ATOM 0 HA TYR A 69 1.108 2.331 3.527 1.00 0.00 H new ATOM 0 HB2 TYR A 69 2.400 0.586 2.324 1.00 0.00 H new ATOM 0 HB3 TYR A 69 3.714 0.711 3.476 1.00 0.00 H new ATOM 0 HD1 TYR A 69 0.177 0.704 4.535 1.00 0.00 H new ATOM 0 HD2 TYR A 69 3.704 -1.638 4.051 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -0.855 -1.149 5.918 1.00 0.00 H new ATOM 0 HE2 TYR A 69 2.661 -3.482 5.439 1.00 0.00 H new ATOM 0 HH TYR A 69 -0.668 -3.365 6.361 1.00 0.00 H new ATOM 1056 N GLN A 70 1.233 2.665 5.927 1.00 0.00 N ATOM 1057 CA GLN A 70 1.254 2.875 7.365 1.00 0.00 C ATOM 1058 C GLN A 70 2.084 4.114 7.708 1.00 0.00 C ATOM 1059 O GLN A 70 2.390 4.356 8.874 1.00 0.00 O ATOM 1060 CB GLN A 70 1.787 1.639 8.092 1.00 0.00 C ATOM 1061 CG GLN A 70 0.644 0.704 8.494 1.00 0.00 C ATOM 1062 CD GLN A 70 0.725 0.349 9.980 1.00 0.00 C ATOM 1063 OE1 GLN A 70 1.630 -0.332 10.434 1.00 0.00 O ATOM 1064 NE2 GLN A 70 -0.270 0.845 10.710 1.00 0.00 N ATOM 0 H GLN A 70 0.317 2.777 5.493 1.00 0.00 H new ATOM 0 HA GLN A 70 0.231 3.042 7.703 1.00 0.00 H new ATOM 0 HB2 GLN A 70 2.487 1.107 7.448 1.00 0.00 H new ATOM 0 HB3 GLN A 70 2.340 1.945 8.980 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -0.313 1.181 8.282 1.00 0.00 H new ATOM 0 HG3 GLN A 70 0.686 -0.206 7.896 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -0.996 1.408 10.267 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -0.307 0.663 11.713 1.00 0.00 H new ATOM 1073 N GLY A 71 2.424 4.865 6.671 1.00 0.00 N ATOM 1074 CA GLY A 71 3.213 6.072 6.848 1.00 0.00 C ATOM 1075 C GLY A 71 4.589 5.929 6.194 1.00 0.00 C ATOM 1076 O GLY A 71 5.118 6.890 5.637 1.00 0.00 O ATOM 0 H GLY A 71 2.167 4.661 5.705 1.00 0.00 H new ATOM 0 HA2 GLY A 71 2.687 6.922 6.413 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.332 6.280 7.911 1.00 0.00 H new ATOM 1080 N ARG A 72 5.129 4.723 6.285 1.00 0.00 N ATOM 1081 CA ARG A 72 6.433 4.442 5.709 1.00 0.00 C ATOM 1082 C ARG A 72 6.309 4.206 4.203 1.00 0.00 C ATOM 1083 O ARG A 72 5.203 4.181 3.664 1.00 0.00 O ATOM 1084 CB ARG A 72 7.069 3.212 6.361 1.00 0.00 C ATOM 1085 CG ARG A 72 7.595 3.542 7.759 1.00 0.00 C ATOM 1086 CD ARG A 72 7.960 2.267 8.522 1.00 0.00 C ATOM 1087 NE ARG A 72 8.897 2.587 9.622 1.00 0.00 N ATOM 1088 CZ ARG A 72 9.144 1.775 10.659 1.00 0.00 C ATOM 1089 NH1 ARG A 72 8.524 0.590 10.744 1.00 0.00 N ATOM 1090 NH2 ARG A 72 10.010 2.148 11.611 1.00 0.00 N ATOM 0 H ARG A 72 4.687 3.929 6.749 1.00 0.00 H new ATOM 0 HA ARG A 72 7.070 5.307 5.893 1.00 0.00 H new ATOM 0 HB2 ARG A 72 6.334 2.409 6.425 1.00 0.00 H new ATOM 0 HB3 ARG A 72 7.886 2.847 5.738 1.00 0.00 H new ATOM 0 HG2 ARG A 72 8.471 4.186 7.679 1.00 0.00 H new ATOM 0 HG3 ARG A 72 6.840 4.099 8.314 1.00 0.00 H new ATOM 0 HD2 ARG A 72 7.059 1.803 8.924 1.00 0.00 H new ATOM 0 HD3 ARG A 72 8.415 1.545 7.844 1.00 0.00 H new ATOM 0 HE ARG A 72 9.385 3.482 9.589 1.00 0.00 H new ATOM 0 HH11 ARG A 72 7.864 0.306 10.020 1.00 0.00 H new ATOM 0 HH12 ARG A 72 8.712 -0.028 11.533 1.00 0.00 H new ATOM 0 HH21 ARG A 72 10.481 3.050 11.546 1.00 0.00 H new ATOM 0 HH22 ARG A 72 10.198 1.530 12.400 1.00 0.00 H new ATOM 1104 N PHE A 73 7.458 4.038 3.565 1.00 0.00 N ATOM 1105 CA PHE A 73 7.492 3.805 2.132 1.00 0.00 C ATOM 1106 C PHE A 73 7.973 2.387 1.818 1.00 0.00 C ATOM 1107 O PHE A 73 8.921 1.899 2.432 1.00 0.00 O ATOM 1108 CB PHE A 73 8.482 4.809 1.538 1.00 0.00 C ATOM 1109 CG PHE A 73 8.093 6.272 1.761 1.00 0.00 C ATOM 1110 CD1 PHE A 73 8.155 6.810 3.009 1.00 0.00 C ATOM 1111 CD2 PHE A 73 7.685 7.035 0.712 1.00 0.00 C ATOM 1112 CE1 PHE A 73 7.794 8.167 3.216 1.00 0.00 C ATOM 1113 CE2 PHE A 73 7.325 8.393 0.919 1.00 0.00 C ATOM 1114 CZ PHE A 73 7.387 8.930 2.167 1.00 0.00 C ATOM 0 H PHE A 73 8.373 4.059 4.015 1.00 0.00 H new ATOM 0 HA PHE A 73 6.493 3.922 1.713 1.00 0.00 H new ATOM 0 HB2 PHE A 73 9.466 4.635 1.974 1.00 0.00 H new ATOM 0 HB3 PHE A 73 8.571 4.626 0.467 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.479 6.204 3.842 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.635 6.608 -0.279 1.00 0.00 H new ATOM 0 HE1 PHE A 73 7.843 8.593 4.207 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.002 8.999 0.086 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.113 9.963 2.325 1.00 0.00 H new ATOM 1124 N LEU A 74 7.297 1.765 0.863 1.00 0.00 N ATOM 1125 CA LEU A 74 7.644 0.413 0.460 1.00 0.00 C ATOM 1126 C LEU A 74 8.537 0.468 -0.780 1.00 0.00 C ATOM 1127 O LEU A 74 8.430 1.390 -1.587 1.00 0.00 O ATOM 1128 CB LEU A 74 6.381 -0.431 0.272 1.00 0.00 C ATOM 1129 CG LEU A 74 5.459 -0.538 1.488 1.00 0.00 C ATOM 1130 CD1 LEU A 74 4.210 -1.357 1.158 1.00 0.00 C ATOM 1131 CD2 LEU A 74 6.209 -1.098 2.697 1.00 0.00 C ATOM 0 H LEU A 74 6.511 2.173 0.357 1.00 0.00 H new ATOM 0 HA LEU A 74 8.217 -0.083 1.244 1.00 0.00 H new ATOM 0 HB2 LEU A 74 5.809 -0.014 -0.557 1.00 0.00 H new ATOM 0 HB3 LEU A 74 6.681 -1.437 -0.022 1.00 0.00 H new ATOM 0 HG LEU A 74 5.125 0.465 1.753 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.571 -1.418 2.039 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.664 -0.876 0.346 1.00 0.00 H new ATOM 0 HD13 LEU A 74 4.504 -2.361 0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 74 5.531 -1.164 3.548 1.00 0.00 H new ATOM 0 HD22 LEU A 74 6.591 -2.091 2.460 1.00 0.00 H new ATOM 0 HD23 LEU A 74 7.041 -0.439 2.946 1.00 0.00 H new ATOM 1143 N HIS A 75 9.399 -0.532 -0.895 1.00 0.00 N ATOM 1144 CA HIS A 75 10.311 -0.610 -2.023 1.00 0.00 C ATOM 1145 C HIS A 75 9.537 -1.005 -3.282 1.00 0.00 C ATOM 1146 O HIS A 75 8.430 -1.535 -3.194 1.00 0.00 O ATOM 1147 CB HIS A 75 11.473 -1.557 -1.720 1.00 0.00 C ATOM 1148 CG HIS A 75 12.825 -1.020 -2.124 1.00 0.00 C ATOM 1149 ND1 HIS A 75 13.474 -1.417 -3.281 1.00 0.00 N ATOM 1150 CD2 HIS A 75 13.643 -0.115 -1.515 1.00 0.00 C ATOM 1151 CE1 HIS A 75 14.630 -0.773 -3.353 1.00 0.00 C ATOM 1152 NE2 HIS A 75 14.733 0.033 -2.258 1.00 0.00 N ATOM 0 H HIS A 75 9.485 -1.296 -0.224 1.00 0.00 H new ATOM 0 HA HIS A 75 10.755 0.369 -2.203 1.00 0.00 H new ATOM 0 HB2 HIS A 75 11.484 -1.772 -0.652 1.00 0.00 H new ATOM 0 HB3 HIS A 75 11.301 -2.503 -2.234 1.00 0.00 H new ATOM 0 HD2 HIS A 75 13.439 0.395 -0.585 1.00 0.00 H new ATOM 0 HE1 HIS A 75 15.362 -0.870 -4.141 1.00 0.00 H new ATOM 0 HE2 HIS A 75 15.518 0.648 -2.045 1.00 0.00 H new ATOM 1160 N GLY A 76 10.149 -0.732 -4.425 1.00 0.00 N ATOM 1161 CA GLY A 76 9.531 -1.053 -5.700 1.00 0.00 C ATOM 1162 C GLY A 76 9.726 -2.530 -6.048 1.00 0.00 C ATOM 1163 O GLY A 76 9.001 -3.078 -6.877 1.00 0.00 O ATOM 0 H GLY A 76 11.067 -0.292 -4.495 1.00 0.00 H new ATOM 0 HA2 GLY A 76 8.466 -0.823 -5.660 1.00 0.00 H new ATOM 0 HA3 GLY A 76 9.963 -0.431 -6.484 1.00 0.00 H new ATOM 1167 N ASN A 77 10.710 -3.134 -5.397 1.00 0.00 N ATOM 1168 CA ASN A 77 11.010 -4.537 -5.627 1.00 0.00 C ATOM 1169 C ASN A 77 10.267 -5.388 -4.595 1.00 0.00 C ATOM 1170 O ASN A 77 10.182 -6.607 -4.737 1.00 0.00 O ATOM 1171 CB ASN A 77 12.507 -4.812 -5.477 1.00 0.00 C ATOM 1172 CG ASN A 77 13.072 -5.473 -6.736 1.00 0.00 C ATOM 1173 OD1 ASN A 77 12.885 -6.653 -6.986 1.00 0.00 O ATOM 1174 ND2 ASN A 77 13.772 -4.650 -7.512 1.00 0.00 N ATOM 0 H ASN A 77 11.310 -2.677 -4.710 1.00 0.00 H new ATOM 0 HA ASN A 77 10.698 -4.787 -6.641 1.00 0.00 H new ATOM 0 HB2 ASN A 77 13.034 -3.878 -5.285 1.00 0.00 H new ATOM 0 HB3 ASN A 77 12.677 -5.458 -4.615 1.00 0.00 H new ATOM 0 HD21 ASN A 77 14.191 -4.996 -8.375 1.00 0.00 H new ATOM 0 HD22 ASN A 77 13.890 -3.673 -7.244 1.00 0.00 H new ATOM 1181 N VAL A 78 9.750 -4.712 -3.580 1.00 0.00 N ATOM 1182 CA VAL A 78 9.017 -5.392 -2.524 1.00 0.00 C ATOM 1183 C VAL A 78 7.780 -6.066 -3.120 1.00 0.00 C ATOM 1184 O VAL A 78 7.257 -5.620 -4.141 1.00 0.00 O ATOM 1185 CB VAL A 78 8.680 -4.406 -1.404 1.00 0.00 C ATOM 1186 CG1 VAL A 78 7.479 -4.892 -0.590 1.00 0.00 C ATOM 1187 CG2 VAL A 78 9.892 -4.165 -0.502 1.00 0.00 C ATOM 0 H VAL A 78 9.824 -3.701 -3.466 1.00 0.00 H new ATOM 0 HA VAL A 78 9.629 -6.175 -2.077 1.00 0.00 H new ATOM 0 HB VAL A 78 8.411 -3.455 -1.864 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.260 -4.173 0.200 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.612 -4.989 -1.243 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.708 -5.861 -0.146 1.00 0.00 H new ATOM 0 HG21 VAL A 78 9.625 -3.460 0.286 1.00 0.00 H new ATOM 0 HG22 VAL A 78 10.206 -5.108 -0.054 1.00 0.00 H new ATOM 0 HG23 VAL A 78 10.710 -3.755 -1.094 1.00 0.00 H new ATOM 1197 N THR A 79 7.348 -7.129 -2.459 1.00 0.00 N ATOM 1198 CA THR A 79 6.182 -7.869 -2.910 1.00 0.00 C ATOM 1199 C THR A 79 5.310 -8.269 -1.719 1.00 0.00 C ATOM 1200 O THR A 79 5.823 -8.688 -0.682 1.00 0.00 O ATOM 1201 CB THR A 79 6.669 -9.062 -3.735 1.00 0.00 C ATOM 1202 OG1 THR A 79 7.835 -9.507 -3.046 1.00 0.00 O ATOM 1203 CG2 THR A 79 7.187 -8.649 -5.114 1.00 0.00 C ATOM 0 H THR A 79 7.785 -7.496 -1.614 1.00 0.00 H new ATOM 0 HA THR A 79 5.545 -7.254 -3.546 1.00 0.00 H new ATOM 0 HB THR A 79 5.855 -9.778 -3.853 1.00 0.00 H new ATOM 0 HG1 THR A 79 8.215 -10.280 -3.512 1.00 0.00 H new ATOM 0 HG21 THR A 79 7.520 -9.533 -5.657 1.00 0.00 H new ATOM 0 HG22 THR A 79 6.388 -8.160 -5.671 1.00 0.00 H new ATOM 0 HG23 THR A 79 8.023 -7.959 -4.997 1.00 0.00 H new ATOM 1211 N LEU A 80 4.006 -8.126 -1.906 1.00 0.00 N ATOM 1212 CA LEU A 80 3.058 -8.468 -0.860 1.00 0.00 C ATOM 1213 C LEU A 80 3.480 -9.784 -0.204 1.00 0.00 C ATOM 1214 O LEU A 80 3.209 -10.010 0.974 1.00 0.00 O ATOM 1215 CB LEU A 80 1.632 -8.487 -1.414 1.00 0.00 C ATOM 1216 CG LEU A 80 0.994 -7.120 -1.672 1.00 0.00 C ATOM 1217 CD1 LEU A 80 -0.388 -7.271 -2.310 1.00 0.00 C ATOM 1218 CD2 LEU A 80 0.944 -6.288 -0.389 1.00 0.00 C ATOM 0 H LEU A 80 3.584 -7.778 -2.767 1.00 0.00 H new ATOM 0 HA LEU A 80 3.062 -7.707 -0.080 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.634 -9.047 -2.349 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.999 -9.035 -0.716 1.00 0.00 H new ATOM 0 HG LEU A 80 1.620 -6.580 -2.383 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.819 -6.285 -2.483 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.295 -7.797 -3.260 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -1.037 -7.839 -1.643 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.486 -5.321 -0.600 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.354 -6.813 0.362 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.956 -6.136 -0.014 1.00 0.00 H new ATOM 1230 N GLY A 81 4.137 -10.618 -0.996 1.00 0.00 N ATOM 1231 CA GLY A 81 4.600 -11.906 -0.507 1.00 0.00 C ATOM 1232 C GLY A 81 5.603 -11.731 0.635 1.00 0.00 C ATOM 1233 O GLY A 81 5.516 -12.417 1.652 1.00 0.00 O ATOM 0 H GLY A 81 4.360 -10.427 -1.973 1.00 0.00 H new ATOM 0 HA2 GLY A 81 3.750 -12.495 -0.162 1.00 0.00 H new ATOM 0 HA3 GLY A 81 5.064 -12.463 -1.321 1.00 0.00 H new ATOM 1237 N ALA A 82 6.531 -10.809 0.429 1.00 0.00 N ATOM 1238 CA ALA A 82 7.549 -10.535 1.429 1.00 0.00 C ATOM 1239 C ALA A 82 6.913 -9.801 2.610 1.00 0.00 C ATOM 1240 O ALA A 82 7.409 -9.877 3.733 1.00 0.00 O ATOM 1241 CB ALA A 82 8.689 -9.737 0.792 1.00 0.00 C ATOM 0 H ALA A 82 6.600 -10.242 -0.416 1.00 0.00 H new ATOM 0 HA ALA A 82 7.974 -11.464 1.809 1.00 0.00 H new ATOM 0 HB1 ALA A 82 9.453 -9.531 1.542 1.00 0.00 H new ATOM 0 HB2 ALA A 82 9.126 -10.314 -0.022 1.00 0.00 H new ATOM 0 HB3 ALA A 82 8.301 -8.796 0.402 1.00 0.00 H new ATOM 1247 N LEU A 83 5.823 -9.106 2.317 1.00 0.00 N ATOM 1248 CA LEU A 83 5.114 -8.359 3.341 1.00 0.00 C ATOM 1249 C LEU A 83 4.228 -9.315 4.143 1.00 0.00 C ATOM 1250 O LEU A 83 3.540 -8.897 5.073 1.00 0.00 O ATOM 1251 CB LEU A 83 4.349 -7.189 2.718 1.00 0.00 C ATOM 1252 CG LEU A 83 5.197 -6.153 1.977 1.00 0.00 C ATOM 1253 CD1 LEU A 83 4.311 -5.122 1.275 1.00 0.00 C ATOM 1254 CD2 LEU A 83 6.207 -5.495 2.919 1.00 0.00 C ATOM 0 H LEU A 83 5.414 -9.045 1.385 1.00 0.00 H new ATOM 0 HA LEU A 83 5.819 -7.912 4.043 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.612 -7.591 2.022 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.797 -6.680 3.508 1.00 0.00 H new ATOM 0 HG LEU A 83 5.767 -6.668 1.204 1.00 0.00 H new ATOM 0 HD11 LEU A 83 4.938 -4.397 0.756 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.667 -5.626 0.555 1.00 0.00 H new ATOM 0 HD13 LEU A 83 3.696 -4.607 2.014 1.00 0.00 H new ATOM 0 HD21 LEU A 83 6.796 -4.763 2.367 1.00 0.00 H new ATOM 0 HD22 LEU A 83 5.677 -4.996 3.730 1.00 0.00 H new ATOM 0 HD23 LEU A 83 6.869 -6.256 3.332 1.00 0.00 H new ATOM 1266 N LYS A 84 4.274 -10.580 3.753 1.00 0.00 N ATOM 1267 CA LYS A 84 3.484 -11.599 4.423 1.00 0.00 C ATOM 1268 C LYS A 84 2.191 -10.973 4.947 1.00 0.00 C ATOM 1269 O LYS A 84 1.812 -11.192 6.097 1.00 0.00 O ATOM 1270 CB LYS A 84 4.314 -12.294 5.505 1.00 0.00 C ATOM 1271 CG LYS A 84 5.016 -11.271 6.399 1.00 0.00 C ATOM 1272 CD LYS A 84 4.054 -10.707 7.447 1.00 0.00 C ATOM 1273 CE LYS A 84 4.817 -10.171 8.660 1.00 0.00 C ATOM 1274 NZ LYS A 84 3.877 -9.800 9.741 1.00 0.00 N ATOM 0 H LYS A 84 4.846 -10.923 2.981 1.00 0.00 H new ATOM 0 HA LYS A 84 3.197 -12.382 3.721 1.00 0.00 H new ATOM 0 HB2 LYS A 84 3.669 -12.930 6.111 1.00 0.00 H new ATOM 0 HB3 LYS A 84 5.055 -12.944 5.039 1.00 0.00 H new ATOM 0 HG2 LYS A 84 5.866 -11.739 6.895 1.00 0.00 H new ATOM 0 HG3 LYS A 84 5.411 -10.459 5.788 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.458 -9.908 7.006 1.00 0.00 H new ATOM 0 HD3 LYS A 84 3.360 -11.485 7.764 1.00 0.00 H new ATOM 0 HE2 LYS A 84 5.515 -10.926 9.021 1.00 0.00 H new ATOM 0 HE3 LYS A 84 5.408 -9.302 8.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 4.411 -9.438 10.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 3.227 -9.064 9.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 3.331 -10.637 10.029 1.00 0.00 H new ATOM 1288 N LEU A 85 1.549 -10.205 4.080 1.00 0.00 N ATOM 1289 CA LEU A 85 0.305 -9.545 4.441 1.00 0.00 C ATOM 1290 C LEU A 85 -0.816 -10.583 4.513 1.00 0.00 C ATOM 1291 O LEU A 85 -0.787 -11.585 3.799 1.00 0.00 O ATOM 1292 CB LEU A 85 0.013 -8.390 3.481 1.00 0.00 C ATOM 1293 CG LEU A 85 -0.048 -6.996 4.107 1.00 0.00 C ATOM 1294 CD1 LEU A 85 1.051 -6.818 5.157 1.00 0.00 C ATOM 1295 CD2 LEU A 85 0.006 -5.909 3.032 1.00 0.00 C ATOM 0 H LEU A 85 1.867 -10.024 3.128 1.00 0.00 H new ATOM 0 HA LEU A 85 0.386 -9.094 5.430 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.780 -8.385 2.706 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.938 -8.586 2.987 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.004 -6.894 4.620 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.985 -5.818 5.587 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.925 -7.561 5.945 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.026 -6.948 4.688 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.039 -4.928 3.504 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.936 -5.999 2.470 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.840 -6.025 2.355 1.00 0.00 H new ATOM 1307 N PRO A 86 -1.803 -10.302 5.405 1.00 0.00 N ATOM 1308 CA PRO A 86 -2.932 -11.200 5.580 1.00 0.00 C ATOM 1309 C PRO A 86 -3.910 -11.086 4.410 1.00 0.00 C ATOM 1310 O PRO A 86 -4.198 -9.986 3.941 1.00 0.00 O ATOM 1311 CB PRO A 86 -3.549 -10.802 6.911 1.00 0.00 C ATOM 1312 CG PRO A 86 -3.033 -9.403 7.208 1.00 0.00 C ATOM 1313 CD PRO A 86 -1.871 -9.126 6.268 1.00 0.00 C ATOM 0 HA PRO A 86 -2.637 -12.249 5.591 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -4.638 -10.813 6.856 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -3.263 -11.499 7.698 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -3.823 -8.666 7.065 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -2.710 -9.327 8.246 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -2.039 -8.219 5.688 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.941 -8.985 6.819 1.00 0.00 H new ATOM 1321 N PHE A 87 -4.394 -12.238 3.970 1.00 0.00 N ATOM 1322 CA PHE A 87 -5.334 -12.282 2.863 1.00 0.00 C ATOM 1323 C PHE A 87 -6.747 -11.923 3.328 1.00 0.00 C ATOM 1324 O PHE A 87 -7.009 -11.850 4.528 1.00 0.00 O ATOM 1325 CB PHE A 87 -5.334 -13.716 2.332 1.00 0.00 C ATOM 1326 CG PHE A 87 -3.997 -14.158 1.732 1.00 0.00 C ATOM 1327 CD1 PHE A 87 -3.238 -13.270 1.036 1.00 0.00 C ATOM 1328 CD2 PHE A 87 -3.569 -15.438 1.895 1.00 0.00 C ATOM 1329 CE1 PHE A 87 -1.997 -13.680 0.480 1.00 0.00 C ATOM 1330 CE2 PHE A 87 -2.328 -15.848 1.338 1.00 0.00 C ATOM 1331 CZ PHE A 87 -1.569 -14.960 0.643 1.00 0.00 C ATOM 0 H PHE A 87 -4.153 -13.149 4.360 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.039 -11.565 2.097 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.598 -14.393 3.144 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.110 -13.811 1.573 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -3.579 -12.253 0.906 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -4.172 -16.143 2.448 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -1.393 -12.975 -0.072 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -1.988 -16.865 1.467 1.00 0.00 H new ATOM 0 HZ PHE A 87 -0.625 -15.272 0.220 1.00 0.00 H new ATOM 1341 N GLY A 88 -7.620 -11.709 2.355 1.00 0.00 N ATOM 1342 CA GLY A 88 -8.999 -11.359 2.650 1.00 0.00 C ATOM 1343 C GLY A 88 -9.070 -10.170 3.610 1.00 0.00 C ATOM 1344 O GLY A 88 -10.015 -10.053 4.389 1.00 0.00 O ATOM 0 H GLY A 88 -7.399 -11.771 1.361 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -9.522 -11.116 1.725 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -9.510 -12.216 3.089 1.00 0.00 H new ATOM 1348 N LYS A 89 -8.058 -9.319 3.523 1.00 0.00 N ATOM 1349 CA LYS A 89 -7.994 -8.143 4.374 1.00 0.00 C ATOM 1350 C LYS A 89 -7.874 -6.893 3.501 1.00 0.00 C ATOM 1351 O LYS A 89 -7.825 -6.989 2.276 1.00 0.00 O ATOM 1352 CB LYS A 89 -6.870 -8.287 5.402 1.00 0.00 C ATOM 1353 CG LYS A 89 -7.311 -9.155 6.581 1.00 0.00 C ATOM 1354 CD LYS A 89 -7.373 -8.337 7.872 1.00 0.00 C ATOM 1355 CE LYS A 89 -6.789 -9.123 9.048 1.00 0.00 C ATOM 1356 NZ LYS A 89 -6.802 -8.301 10.278 1.00 0.00 N ATOM 0 H LYS A 89 -7.276 -9.421 2.876 1.00 0.00 H new ATOM 0 HA LYS A 89 -8.912 -8.040 4.952 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -5.994 -8.730 4.928 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -6.574 -7.302 5.762 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -8.290 -9.587 6.373 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -6.616 -9.985 6.706 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -6.822 -7.405 7.743 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -8.407 -8.068 8.087 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -7.366 -10.034 9.206 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -5.768 -9.428 8.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -6.402 -8.849 11.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -6.232 -7.444 10.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -7.780 -8.031 10.505 1.00 0.00 H new ATOM 1370 N THR A 90 -7.832 -5.748 4.167 1.00 0.00 N ATOM 1371 CA THR A 90 -7.718 -4.479 3.467 1.00 0.00 C ATOM 1372 C THR A 90 -6.658 -3.598 4.129 1.00 0.00 C ATOM 1373 O THR A 90 -6.793 -3.226 5.294 1.00 0.00 O ATOM 1374 CB THR A 90 -9.106 -3.836 3.427 1.00 0.00 C ATOM 1375 OG1 THR A 90 -9.843 -4.655 2.525 1.00 0.00 O ATOM 1376 CG2 THR A 90 -9.094 -2.460 2.757 1.00 0.00 C ATOM 0 H THR A 90 -7.875 -5.672 5.183 1.00 0.00 H new ATOM 0 HA THR A 90 -7.380 -4.622 2.440 1.00 0.00 H new ATOM 0 HB THR A 90 -9.492 -3.742 4.442 1.00 0.00 H new ATOM 0 HG1 THR A 90 -10.791 -4.411 2.562 1.00 0.00 H new ATOM 0 HG21 THR A 90 -10.103 -2.048 2.755 1.00 0.00 H new ATOM 0 HG22 THR A 90 -8.431 -1.793 3.308 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.740 -2.558 1.731 1.00 0.00 H new ATOM 1384 N THR A 91 -5.626 -3.288 3.357 1.00 0.00 N ATOM 1385 CA THR A 91 -4.543 -2.456 3.854 1.00 0.00 C ATOM 1386 C THR A 91 -4.652 -1.041 3.284 1.00 0.00 C ATOM 1387 O THR A 91 -5.073 -0.859 2.142 1.00 0.00 O ATOM 1388 CB THR A 91 -3.222 -3.148 3.515 1.00 0.00 C ATOM 1389 OG1 THR A 91 -3.108 -4.179 4.492 1.00 0.00 O ATOM 1390 CG2 THR A 91 -2.008 -2.253 3.774 1.00 0.00 C ATOM 0 H THR A 91 -5.517 -3.598 2.391 1.00 0.00 H new ATOM 0 HA THR A 91 -4.598 -2.341 4.936 1.00 0.00 H new ATOM 0 HB THR A 91 -3.231 -3.453 2.469 1.00 0.00 H new ATOM 0 HG1 THR A 91 -2.278 -4.679 4.344 1.00 0.00 H new ATOM 0 HG21 THR A 91 -1.097 -2.793 3.517 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.082 -1.354 3.163 1.00 0.00 H new ATOM 0 HG23 THR A 91 -1.980 -1.974 4.827 1.00 0.00 H new ATOM 1398 N VAL A 92 -4.266 -0.075 4.104 1.00 0.00 N ATOM 1399 CA VAL A 92 -4.314 1.318 3.696 1.00 0.00 C ATOM 1400 C VAL A 92 -2.936 1.745 3.187 1.00 0.00 C ATOM 1401 O VAL A 92 -1.937 1.594 3.889 1.00 0.00 O ATOM 1402 CB VAL A 92 -4.820 2.185 4.851 1.00 0.00 C ATOM 1403 CG1 VAL A 92 -4.704 3.672 4.512 1.00 0.00 C ATOM 1404 CG2 VAL A 92 -6.258 1.818 5.223 1.00 0.00 C ATOM 0 H VAL A 92 -3.918 -0.230 5.050 1.00 0.00 H new ATOM 0 HA VAL A 92 -5.019 1.451 2.875 1.00 0.00 H new ATOM 0 HB VAL A 92 -4.189 1.989 5.718 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -5.070 4.266 5.349 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.660 3.921 4.320 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -5.299 3.890 3.625 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.593 2.449 6.046 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -6.907 1.971 4.361 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.300 0.772 5.527 1.00 0.00 H new ATOM 1414 N MET A 93 -2.926 2.269 1.971 1.00 0.00 N ATOM 1415 CA MET A 93 -1.686 2.719 1.360 1.00 0.00 C ATOM 1416 C MET A 93 -1.879 4.062 0.653 1.00 0.00 C ATOM 1417 O MET A 93 -2.928 4.312 0.061 1.00 0.00 O ATOM 1418 CB MET A 93 -1.207 1.675 0.350 1.00 0.00 C ATOM 1419 CG MET A 93 -0.736 0.402 1.058 1.00 0.00 C ATOM 1420 SD MET A 93 0.128 -0.653 -0.094 1.00 0.00 S ATOM 1421 CE MET A 93 0.750 -1.893 1.029 1.00 0.00 C ATOM 0 H MET A 93 -3.756 2.392 1.392 1.00 0.00 H new ATOM 0 HA MET A 93 -0.941 2.847 2.145 1.00 0.00 H new ATOM 0 HB2 MET A 93 -2.016 1.434 -0.340 1.00 0.00 H new ATOM 0 HB3 MET A 93 -0.392 2.087 -0.245 1.00 0.00 H new ATOM 0 HG2 MET A 93 -0.080 0.660 1.890 1.00 0.00 H new ATOM 0 HG3 MET A 93 -1.591 -0.128 1.478 1.00 0.00 H new ATOM 0 HE1 MET A 93 1.392 -2.587 0.486 1.00 0.00 H new ATOM 0 HE2 MET A 93 1.324 -1.412 1.821 1.00 0.00 H new ATOM 0 HE3 MET A 93 -0.085 -2.439 1.467 1.00 0.00 H new ATOM 1431 N HIS A 94 -0.850 4.892 0.739 1.00 0.00 N ATOM 1432 CA HIS A 94 -0.892 6.204 0.115 1.00 0.00 C ATOM 1433 C HIS A 94 -0.111 6.173 -1.200 1.00 0.00 C ATOM 1434 O HIS A 94 0.823 5.387 -1.352 1.00 0.00 O ATOM 1435 CB HIS A 94 -0.389 7.281 1.079 1.00 0.00 C ATOM 1436 CG HIS A 94 -1.448 7.811 2.015 1.00 0.00 C ATOM 1437 ND1 HIS A 94 -1.951 7.074 3.073 1.00 0.00 N ATOM 1438 CD2 HIS A 94 -2.093 9.013 2.042 1.00 0.00 C ATOM 1439 CE1 HIS A 94 -2.858 7.808 3.701 1.00 0.00 C ATOM 1440 NE2 HIS A 94 -2.945 9.009 3.060 1.00 0.00 N ATOM 0 H HIS A 94 0.018 4.682 1.231 1.00 0.00 H new ATOM 0 HA HIS A 94 -1.924 6.464 -0.122 1.00 0.00 H new ATOM 0 HB2 HIS A 94 0.431 6.871 1.669 1.00 0.00 H new ATOM 0 HB3 HIS A 94 0.018 8.110 0.501 1.00 0.00 H new ATOM 0 HD1 HIS A 94 -1.671 6.126 3.326 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -1.937 9.829 1.352 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -3.428 7.508 4.568 1.00 0.00 H new ATOM 1448 N LEU A 95 -0.522 7.037 -2.116 1.00 0.00 N ATOM 1449 CA LEU A 95 0.128 7.118 -3.413 1.00 0.00 C ATOM 1450 C LEU A 95 0.743 8.509 -3.584 1.00 0.00 C ATOM 1451 O LEU A 95 0.191 9.499 -3.105 1.00 0.00 O ATOM 1452 CB LEU A 95 -0.849 6.736 -4.527 1.00 0.00 C ATOM 1453 CG LEU A 95 -0.276 5.880 -5.658 1.00 0.00 C ATOM 1454 CD1 LEU A 95 -1.326 5.628 -6.741 1.00 0.00 C ATOM 1455 CD2 LEU A 95 0.998 6.507 -6.228 1.00 0.00 C ATOM 0 H LEU A 95 -1.297 7.687 -1.986 1.00 0.00 H new ATOM 0 HA LEU A 95 0.944 6.398 -3.476 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.686 6.199 -4.081 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -1.252 7.652 -4.960 1.00 0.00 H new ATOM 0 HG LEU A 95 -0.000 4.909 -5.246 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.893 5.017 -7.533 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.179 5.107 -6.306 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -1.656 6.580 -7.157 1.00 0.00 H new ATOM 0 HD21 LEU A 95 1.385 5.879 -7.030 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.772 7.498 -6.620 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.746 6.591 -5.440 1.00 0.00 H new ATOM 1467 N VAL A 96 1.876 8.539 -4.269 1.00 0.00 N ATOM 1468 CA VAL A 96 2.572 9.792 -4.510 1.00 0.00 C ATOM 1469 C VAL A 96 3.459 9.648 -5.748 1.00 0.00 C ATOM 1470 O VAL A 96 3.820 8.537 -6.132 1.00 0.00 O ATOM 1471 CB VAL A 96 3.352 10.206 -3.260 1.00 0.00 C ATOM 1472 CG1 VAL A 96 2.407 10.470 -2.086 1.00 0.00 C ATOM 1473 CG2 VAL A 96 4.400 9.152 -2.894 1.00 0.00 C ATOM 0 H VAL A 96 2.330 7.716 -4.665 1.00 0.00 H new ATOM 0 HA VAL A 96 1.860 10.592 -4.712 1.00 0.00 H new ATOM 0 HB VAL A 96 3.875 11.136 -3.484 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.987 10.762 -1.211 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.716 11.272 -2.348 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.843 9.564 -1.862 1.00 0.00 H new ATOM 0 HG21 VAL A 96 4.940 9.470 -2.002 1.00 0.00 H new ATOM 0 HG22 VAL A 96 3.906 8.200 -2.698 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.101 9.034 -3.720 1.00 0.00 H new ATOM 1483 N ALA A 97 3.785 10.789 -6.339 1.00 0.00 N ATOM 1484 CA ALA A 97 4.623 10.804 -7.526 1.00 0.00 C ATOM 1485 C ALA A 97 5.762 11.806 -7.328 1.00 0.00 C ATOM 1486 O ALA A 97 5.541 13.015 -7.355 1.00 0.00 O ATOM 1487 CB ALA A 97 3.766 11.129 -8.751 1.00 0.00 C ATOM 0 H ALA A 97 3.484 11.709 -6.018 1.00 0.00 H new ATOM 0 HA ALA A 97 5.071 9.825 -7.692 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.394 11.140 -9.642 1.00 0.00 H new ATOM 0 HB2 ALA A 97 2.990 10.372 -8.864 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.302 12.107 -8.622 1.00 0.00 H new ATOM 1493 N ARG A 98 6.955 11.265 -7.133 1.00 0.00 N ATOM 1494 CA ARG A 98 8.130 12.096 -6.930 1.00 0.00 C ATOM 1495 C ARG A 98 9.362 11.224 -6.682 1.00 0.00 C ATOM 1496 O ARG A 98 9.257 10.149 -6.092 1.00 0.00 O ATOM 1497 CB ARG A 98 7.936 13.043 -5.744 1.00 0.00 C ATOM 1498 CG ARG A 98 9.188 13.891 -5.510 1.00 0.00 C ATOM 1499 CD ARG A 98 9.348 14.948 -6.605 1.00 0.00 C ATOM 1500 NE ARG A 98 10.784 15.192 -6.867 1.00 0.00 N ATOM 1501 CZ ARG A 98 11.258 16.270 -7.507 1.00 0.00 C ATOM 1502 NH1 ARG A 98 10.413 17.209 -7.953 1.00 0.00 N ATOM 1503 NH2 ARG A 98 12.577 16.408 -7.700 1.00 0.00 N ATOM 0 H ARG A 98 7.134 10.261 -7.111 1.00 0.00 H new ATOM 0 HA ARG A 98 8.277 12.688 -7.833 1.00 0.00 H new ATOM 0 HB2 ARG A 98 7.081 13.693 -5.929 1.00 0.00 H new ATOM 0 HB3 ARG A 98 7.710 12.467 -4.847 1.00 0.00 H new ATOM 0 HG2 ARG A 98 9.125 14.377 -4.537 1.00 0.00 H new ATOM 0 HG3 ARG A 98 10.068 13.248 -5.489 1.00 0.00 H new ATOM 0 HD2 ARG A 98 8.855 14.615 -7.518 1.00 0.00 H new ATOM 0 HD3 ARG A 98 8.863 15.875 -6.301 1.00 0.00 H new ATOM 0 HE ARG A 98 11.455 14.496 -6.540 1.00 0.00 H new ATOM 0 HH11 ARG A 98 9.409 17.103 -7.805 1.00 0.00 H new ATOM 0 HH12 ARG A 98 10.773 18.030 -8.440 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.220 15.693 -7.360 1.00 0.00 H new ATOM 0 HH22 ARG A 98 12.938 17.228 -8.187 1.00 0.00 H new ATOM 1517 N GLU A 99 10.501 11.718 -7.144 1.00 0.00 N ATOM 1518 CA GLU A 99 11.751 10.997 -6.980 1.00 0.00 C ATOM 1519 C GLU A 99 12.091 10.856 -5.495 1.00 0.00 C ATOM 1520 O GLU A 99 11.196 10.783 -4.654 1.00 0.00 O ATOM 1521 CB GLU A 99 12.886 11.687 -7.739 1.00 0.00 C ATOM 1522 CG GLU A 99 13.796 10.660 -8.417 1.00 0.00 C ATOM 1523 CD GLU A 99 14.473 11.258 -9.652 1.00 0.00 C ATOM 1524 OE1 GLU A 99 15.572 11.827 -9.477 1.00 0.00 O ATOM 1525 OE2 GLU A 99 13.875 11.133 -10.743 1.00 0.00 O ATOM 0 H GLU A 99 10.584 12.610 -7.632 1.00 0.00 H new ATOM 0 HA GLU A 99 11.630 9.999 -7.402 1.00 0.00 H new ATOM 0 HB2 GLU A 99 12.470 12.361 -8.488 1.00 0.00 H new ATOM 0 HB3 GLU A 99 13.470 12.298 -7.051 1.00 0.00 H new ATOM 0 HG2 GLU A 99 14.554 10.319 -7.712 1.00 0.00 H new ATOM 0 HG3 GLU A 99 13.212 9.786 -8.705 1.00 0.00 H new ATOM 1532 N THR A 100 13.386 10.821 -5.217 1.00 0.00 N ATOM 1533 CA THR A 100 13.855 10.691 -3.848 1.00 0.00 C ATOM 1534 C THR A 100 14.408 12.025 -3.344 1.00 0.00 C ATOM 1535 O THR A 100 14.387 13.022 -4.065 1.00 0.00 O ATOM 1536 CB THR A 100 14.878 9.554 -3.806 1.00 0.00 C ATOM 1537 OG1 THR A 100 15.986 10.055 -4.549 1.00 0.00 O ATOM 1538 CG2 THR A 100 14.423 8.326 -4.598 1.00 0.00 C ATOM 0 H THR A 100 14.125 10.880 -5.917 1.00 0.00 H new ATOM 0 HA THR A 100 13.038 10.439 -3.172 1.00 0.00 H new ATOM 0 HB THR A 100 15.061 9.270 -2.770 1.00 0.00 H new ATOM 0 HG1 THR A 100 16.697 9.381 -4.571 1.00 0.00 H new ATOM 0 HG21 THR A 100 15.185 7.550 -4.535 1.00 0.00 H new ATOM 0 HG22 THR A 100 13.488 7.951 -4.182 1.00 0.00 H new ATOM 0 HG23 THR A 100 14.271 8.602 -5.642 1.00 0.00 H new ATOM 1546 N LEU A 101 14.891 12.001 -2.111 1.00 0.00 N ATOM 1547 CA LEU A 101 15.449 13.196 -1.502 1.00 0.00 C ATOM 1548 C LEU A 101 16.959 13.231 -1.747 1.00 0.00 C ATOM 1549 O LEU A 101 17.574 12.197 -2.001 1.00 0.00 O ATOM 1550 CB LEU A 101 15.064 13.274 -0.023 1.00 0.00 C ATOM 1551 CG LEU A 101 13.610 12.934 0.310 1.00 0.00 C ATOM 1552 CD1 LEU A 101 13.507 12.240 1.670 1.00 0.00 C ATOM 1553 CD2 LEU A 101 12.724 14.179 0.234 1.00 0.00 C ATOM 0 H LEU A 101 14.907 11.172 -1.517 1.00 0.00 H new ATOM 0 HA LEU A 101 15.030 14.090 -1.964 1.00 0.00 H new ATOM 0 HB2 LEU A 101 15.712 12.599 0.537 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.271 14.283 0.333 1.00 0.00 H new ATOM 0 HG LEU A 101 13.244 12.232 -0.439 1.00 0.00 H new ATOM 0 HD11 LEU A 101 12.463 12.009 1.883 1.00 0.00 H new ATOM 0 HD12 LEU A 101 14.086 11.317 1.652 1.00 0.00 H new ATOM 0 HD13 LEU A 101 13.898 12.899 2.445 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.696 13.909 0.475 1.00 0.00 H new ATOM 0 HD22 LEU A 101 13.080 14.923 0.946 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.764 14.593 -0.774 1.00 0.00 H new ATOM 1565 N PRO A 102 17.527 14.464 -1.659 1.00 0.00 N ATOM 1566 CA PRO A 102 18.953 14.647 -1.869 1.00 0.00 C ATOM 1567 C PRO A 102 19.752 14.155 -0.660 1.00 0.00 C ATOM 1568 O PRO A 102 20.186 14.953 0.169 1.00 0.00 O ATOM 1569 CB PRO A 102 19.125 16.135 -2.128 1.00 0.00 C ATOM 1570 CG PRO A 102 17.865 16.798 -1.598 1.00 0.00 C ATOM 1571 CD PRO A 102 16.830 15.711 -1.360 1.00 0.00 C ATOM 0 HA PRO A 102 19.333 14.064 -2.708 1.00 0.00 H new ATOM 0 HB2 PRO A 102 20.011 16.520 -1.623 1.00 0.00 H new ATOM 0 HB3 PRO A 102 19.253 16.334 -3.192 1.00 0.00 H new ATOM 0 HG2 PRO A 102 18.076 17.333 -0.672 1.00 0.00 H new ATOM 0 HG3 PRO A 102 17.491 17.532 -2.312 1.00 0.00 H new ATOM 0 HD2 PRO A 102 16.469 15.726 -0.332 1.00 0.00 H new ATOM 0 HD3 PRO A 102 15.961 15.843 -2.005 1.00 0.00 H new ATOM 1579 N GLU A 103 19.923 12.842 -0.599 1.00 0.00 N ATOM 1580 CA GLU A 103 20.663 12.234 0.494 1.00 0.00 C ATOM 1581 C GLU A 103 21.633 11.180 -0.043 1.00 0.00 C ATOM 1582 O GLU A 103 21.467 10.689 -1.159 1.00 0.00 O ATOM 1583 CB GLU A 103 19.712 11.628 1.529 1.00 0.00 C ATOM 1584 CG GLU A 103 19.117 12.712 2.429 1.00 0.00 C ATOM 1585 CD GLU A 103 17.927 12.173 3.224 1.00 0.00 C ATOM 1586 OE1 GLU A 103 18.061 11.048 3.753 1.00 0.00 O ATOM 1587 OE2 GLU A 103 16.910 12.897 3.285 1.00 0.00 O ATOM 0 H GLU A 103 19.562 12.183 -1.289 1.00 0.00 H new ATOM 0 HA GLU A 103 21.242 13.012 0.992 1.00 0.00 H new ATOM 0 HB2 GLU A 103 18.910 11.092 1.021 1.00 0.00 H new ATOM 0 HB3 GLU A 103 20.248 10.899 2.137 1.00 0.00 H new ATOM 0 HG2 GLU A 103 19.880 13.080 3.115 1.00 0.00 H new ATOM 0 HG3 GLU A 103 18.799 13.560 1.822 1.00 0.00 H new ATOM 1594 N PRO A 104 22.651 10.855 0.798 1.00 0.00 N ATOM 1595 CA PRO A 104 23.648 9.868 0.419 1.00 0.00 C ATOM 1596 C PRO A 104 23.078 8.451 0.506 1.00 0.00 C ATOM 1597 O PRO A 104 23.302 7.747 1.489 1.00 0.00 O ATOM 1598 CB PRO A 104 24.812 10.100 1.369 1.00 0.00 C ATOM 1599 CG PRO A 104 24.244 10.888 2.538 1.00 0.00 C ATOM 1600 CD PRO A 104 22.880 11.416 2.126 1.00 0.00 C ATOM 0 HA PRO A 104 23.970 9.972 -0.617 1.00 0.00 H new ATOM 0 HB2 PRO A 104 25.237 9.154 1.705 1.00 0.00 H new ATOM 0 HB3 PRO A 104 25.613 10.652 0.878 1.00 0.00 H new ATOM 0 HG2 PRO A 104 24.157 10.253 3.420 1.00 0.00 H new ATOM 0 HG3 PRO A 104 24.908 11.711 2.802 1.00 0.00 H new ATOM 0 HD2 PRO A 104 22.106 11.103 2.827 1.00 0.00 H new ATOM 0 HD3 PRO A 104 22.868 12.506 2.103 1.00 0.00 H new ATOM 1608 N ASN A 105 22.353 8.075 -0.537 1.00 0.00 N ATOM 1609 CA ASN A 105 21.749 6.754 -0.591 1.00 0.00 C ATOM 1610 C ASN A 105 22.723 5.779 -1.256 1.00 0.00 C ATOM 1611 O ASN A 105 23.766 6.188 -1.763 1.00 0.00 O ATOM 1612 CB ASN A 105 20.461 6.771 -1.416 1.00 0.00 C ATOM 1613 CG ASN A 105 19.241 6.497 -0.534 1.00 0.00 C ATOM 1614 OD1 ASN A 105 19.185 6.869 0.626 1.00 0.00 O ATOM 1615 ND2 ASN A 105 18.270 5.826 -1.147 1.00 0.00 N ATOM 0 H ASN A 105 22.170 8.661 -1.351 1.00 0.00 H new ATOM 0 HA ASN A 105 21.520 6.446 0.429 1.00 0.00 H new ATOM 0 HB2 ASN A 105 20.351 7.739 -1.905 1.00 0.00 H new ATOM 0 HB3 ASN A 105 20.520 6.021 -2.204 1.00 0.00 H new ATOM 0 HD21 ASN A 105 17.414 5.593 -0.643 1.00 0.00 H new ATOM 0 HD22 ASN A 105 18.381 5.544 -2.121 1.00 0.00 H new ATOM 1622 N SER A 106 22.348 4.509 -1.231 1.00 0.00 N ATOM 1623 CA SER A 106 23.175 3.473 -1.825 1.00 0.00 C ATOM 1624 C SER A 106 22.445 2.129 -1.779 1.00 0.00 C ATOM 1625 O SER A 106 22.091 1.648 -0.703 1.00 0.00 O ATOM 1626 CB SER A 106 24.524 3.368 -1.111 1.00 0.00 C ATOM 1627 OG SER A 106 24.427 2.643 0.112 1.00 0.00 O ATOM 0 H SER A 106 21.482 4.174 -0.809 1.00 0.00 H new ATOM 0 HA SER A 106 23.364 3.741 -2.864 1.00 0.00 H new ATOM 0 HB2 SER A 106 25.244 2.878 -1.767 1.00 0.00 H new ATOM 0 HB3 SER A 106 24.906 4.369 -0.910 1.00 0.00 H new ATOM 0 HG SER A 106 23.495 2.379 0.263 1.00 0.00 H new ATOM 1633 N GLN A 107 22.241 1.561 -2.958 1.00 0.00 N ATOM 1634 CA GLN A 107 21.559 0.283 -3.065 1.00 0.00 C ATOM 1635 C GLN A 107 22.554 -0.866 -2.887 1.00 0.00 C ATOM 1636 O GLN A 107 23.635 -0.853 -3.474 1.00 0.00 O ATOM 1637 CB GLN A 107 20.820 0.165 -4.400 1.00 0.00 C ATOM 1638 CG GLN A 107 19.414 -0.402 -4.200 1.00 0.00 C ATOM 1639 CD GLN A 107 19.374 -1.897 -4.527 1.00 0.00 C ATOM 1640 OE1 GLN A 107 19.778 -2.336 -5.591 1.00 0.00 O ATOM 1641 NE2 GLN A 107 18.865 -2.649 -3.556 1.00 0.00 N ATOM 0 H GLN A 107 22.536 1.963 -3.848 1.00 0.00 H new ATOM 0 HA GLN A 107 20.816 0.222 -2.269 1.00 0.00 H new ATOM 0 HB2 GLN A 107 20.757 1.145 -4.873 1.00 0.00 H new ATOM 0 HB3 GLN A 107 21.383 -0.479 -5.076 1.00 0.00 H new ATOM 0 HG2 GLN A 107 19.097 -0.243 -3.169 1.00 0.00 H new ATOM 0 HG3 GLN A 107 18.709 0.132 -4.837 1.00 0.00 H new ATOM 0 HE21 GLN A 107 18.545 -2.216 -2.690 1.00 0.00 H new ATOM 0 HE22 GLN A 107 18.794 -3.659 -3.677 1.00 0.00 H new ATOM 1650 N GLY A 108 22.154 -1.832 -2.073 1.00 0.00 N ATOM 1651 CA GLY A 108 22.997 -2.986 -1.810 1.00 0.00 C ATOM 1652 C GLY A 108 22.417 -4.247 -2.455 1.00 0.00 C ATOM 1653 O GLY A 108 21.200 -4.391 -2.561 1.00 0.00 O ATOM 0 H GLY A 108 21.257 -1.839 -1.587 1.00 0.00 H new ATOM 0 HA2 GLY A 108 24.000 -2.804 -2.196 1.00 0.00 H new ATOM 0 HA3 GLY A 108 23.092 -3.134 -0.734 1.00 0.00 H new ATOM 1657 N GLN A 109 23.316 -5.128 -2.868 1.00 0.00 N ATOM 1658 CA GLN A 109 22.909 -6.372 -3.499 1.00 0.00 C ATOM 1659 C GLN A 109 24.123 -7.278 -3.718 1.00 0.00 C ATOM 1660 O GLN A 109 25.029 -6.935 -4.476 1.00 0.00 O ATOM 1661 CB GLN A 109 22.179 -6.105 -4.817 1.00 0.00 C ATOM 1662 CG GLN A 109 20.865 -6.886 -4.884 1.00 0.00 C ATOM 1663 CD GLN A 109 21.041 -8.188 -5.668 1.00 0.00 C ATOM 1664 OE1 GLN A 109 21.019 -8.217 -6.887 1.00 0.00 O ATOM 1665 NE2 GLN A 109 21.216 -9.261 -4.902 1.00 0.00 N ATOM 0 H GLN A 109 24.325 -5.005 -2.778 1.00 0.00 H new ATOM 0 HA GLN A 109 22.213 -6.884 -2.834 1.00 0.00 H new ATOM 0 HB2 GLN A 109 21.978 -5.038 -4.916 1.00 0.00 H new ATOM 0 HB3 GLN A 109 22.817 -6.388 -5.654 1.00 0.00 H new ATOM 0 HG2 GLN A 109 20.518 -7.109 -3.875 1.00 0.00 H new ATOM 0 HG3 GLN A 109 20.097 -6.273 -5.357 1.00 0.00 H new ATOM 0 HE21 GLN A 109 21.224 -9.167 -3.886 1.00 0.00 H new ATOM 0 HE22 GLN A 109 21.342 -10.178 -5.330 1.00 0.00 H new ATOM 1674 N ARG A 110 24.101 -8.416 -3.041 1.00 0.00 N ATOM 1675 CA ARG A 110 25.189 -9.374 -3.152 1.00 0.00 C ATOM 1676 C ARG A 110 26.503 -8.740 -2.691 1.00 0.00 C ATOM 1677 O ARG A 110 27.005 -7.813 -3.325 1.00 0.00 O ATOM 1678 CB ARG A 110 25.345 -9.865 -4.593 1.00 0.00 C ATOM 1679 CG ARG A 110 24.982 -11.346 -4.709 1.00 0.00 C ATOM 1680 CD ARG A 110 26.134 -12.232 -4.230 1.00 0.00 C ATOM 1681 NE ARG A 110 25.918 -13.628 -4.673 1.00 0.00 N ATOM 1682 CZ ARG A 110 26.881 -14.558 -4.723 1.00 0.00 C ATOM 1683 NH1 ARG A 110 28.132 -14.247 -4.356 1.00 0.00 N ATOM 1684 NH2 ARG A 110 26.593 -15.799 -5.139 1.00 0.00 N ATOM 0 H ARG A 110 23.347 -8.697 -2.414 1.00 0.00 H new ATOM 0 HA ARG A 110 24.949 -10.225 -2.514 1.00 0.00 H new ATOM 0 HB2 ARG A 110 24.706 -9.277 -5.252 1.00 0.00 H new ATOM 0 HB3 ARG A 110 26.372 -9.711 -4.924 1.00 0.00 H new ATOM 0 HG2 ARG A 110 24.090 -11.553 -4.118 1.00 0.00 H new ATOM 0 HG3 ARG A 110 24.741 -11.585 -5.745 1.00 0.00 H new ATOM 0 HD2 ARG A 110 27.079 -11.859 -4.625 1.00 0.00 H new ATOM 0 HD3 ARG A 110 26.205 -12.194 -3.143 1.00 0.00 H new ATOM 0 HE ARG A 110 24.977 -13.899 -4.958 1.00 0.00 H new ATOM 0 HH11 ARG A 110 28.351 -13.303 -4.039 1.00 0.00 H new ATOM 0 HH12 ARG A 110 28.865 -14.955 -4.394 1.00 0.00 H new ATOM 0 HH21 ARG A 110 25.641 -16.035 -5.418 1.00 0.00 H new ATOM 0 HH22 ARG A 110 27.326 -16.507 -5.177 1.00 0.00 H new ATOM 1698 N SER A 111 27.022 -9.266 -1.591 1.00 0.00 N ATOM 1699 CA SER A 111 28.268 -8.763 -1.038 1.00 0.00 C ATOM 1700 C SER A 111 28.760 -9.693 0.073 1.00 0.00 C ATOM 1701 O SER A 111 28.137 -9.787 1.130 1.00 0.00 O ATOM 1702 CB SER A 111 28.099 -7.340 -0.503 1.00 0.00 C ATOM 1703 OG SER A 111 29.337 -6.635 -0.459 1.00 0.00 O ATOM 0 H SER A 111 26.603 -10.035 -1.068 1.00 0.00 H new ATOM 0 HA SER A 111 29.010 -8.736 -1.836 1.00 0.00 H new ATOM 0 HB2 SER A 111 27.395 -6.797 -1.134 1.00 0.00 H new ATOM 0 HB3 SER A 111 27.668 -7.378 0.497 1.00 0.00 H new ATOM 0 HG SER A 111 29.186 -5.730 -0.114 1.00 0.00 H new ATOM 1709 N GLY A 112 29.873 -10.357 -0.204 1.00 0.00 N ATOM 1710 CA GLY A 112 30.455 -11.276 0.759 1.00 0.00 C ATOM 1711 C GLY A 112 30.610 -12.675 0.158 1.00 0.00 C ATOM 1712 O GLY A 112 30.067 -12.960 -0.908 1.00 0.00 O ATOM 0 H GLY A 112 30.387 -10.277 -1.081 1.00 0.00 H new ATOM 0 HA2 GLY A 112 31.428 -10.904 1.080 1.00 0.00 H new ATOM 0 HA3 GLY A 112 29.824 -11.326 1.647 1.00 0.00 H new ATOM 1716 N PRO A 113 31.374 -13.532 0.887 1.00 0.00 N ATOM 1717 CA PRO A 113 31.607 -14.894 0.436 1.00 0.00 C ATOM 1718 C PRO A 113 30.366 -15.762 0.650 1.00 0.00 C ATOM 1719 O PRO A 113 29.459 -15.383 1.389 1.00 0.00 O ATOM 1720 CB PRO A 113 32.811 -15.371 1.233 1.00 0.00 C ATOM 1721 CG PRO A 113 32.919 -14.434 2.425 1.00 0.00 C ATOM 1722 CD PRO A 113 32.033 -13.229 2.154 1.00 0.00 C ATOM 0 HA PRO A 113 31.805 -14.955 -0.634 1.00 0.00 H new ATOM 0 HB2 PRO A 113 32.680 -16.403 1.558 1.00 0.00 H new ATOM 0 HB3 PRO A 113 33.717 -15.340 0.628 1.00 0.00 H new ATOM 0 HG2 PRO A 113 32.606 -14.940 3.338 1.00 0.00 H new ATOM 0 HG3 PRO A 113 33.953 -14.122 2.573 1.00 0.00 H new ATOM 0 HD2 PRO A 113 31.307 -13.084 2.954 1.00 0.00 H new ATOM 0 HD3 PRO A 113 32.620 -12.313 2.086 1.00 0.00 H new ATOM 1730 N SER A 114 30.366 -16.911 -0.009 1.00 0.00 N ATOM 1731 CA SER A 114 29.252 -17.837 0.099 1.00 0.00 C ATOM 1732 C SER A 114 29.660 -19.212 -0.432 1.00 0.00 C ATOM 1733 O SER A 114 30.724 -19.360 -1.032 1.00 0.00 O ATOM 1734 CB SER A 114 28.028 -17.317 -0.658 1.00 0.00 C ATOM 1735 OG SER A 114 26.980 -16.926 0.225 1.00 0.00 O ATOM 0 H SER A 114 31.121 -17.222 -0.620 1.00 0.00 H new ATOM 0 HA SER A 114 28.983 -17.927 1.152 1.00 0.00 H new ATOM 0 HB2 SER A 114 28.318 -16.467 -1.275 1.00 0.00 H new ATOM 0 HB3 SER A 114 27.663 -18.091 -1.333 1.00 0.00 H new ATOM 0 HG SER A 114 27.329 -16.292 0.886 1.00 0.00 H new ATOM 1741 N SER A 115 28.792 -20.185 -0.193 1.00 0.00 N ATOM 1742 CA SER A 115 29.049 -21.543 -0.640 1.00 0.00 C ATOM 1743 C SER A 115 30.322 -22.080 0.019 1.00 0.00 C ATOM 1744 O SER A 115 31.056 -21.330 0.660 1.00 0.00 O ATOM 1745 CB SER A 115 29.173 -21.608 -2.164 1.00 0.00 C ATOM 1746 OG SER A 115 28.739 -22.862 -2.682 1.00 0.00 O ATOM 0 H SER A 115 27.910 -20.059 0.304 1.00 0.00 H new ATOM 0 HA SER A 115 28.204 -22.165 -0.344 1.00 0.00 H new ATOM 0 HB2 SER A 115 28.583 -20.808 -2.610 1.00 0.00 H new ATOM 0 HB3 SER A 115 30.211 -21.437 -2.451 1.00 0.00 H new ATOM 0 HG SER A 115 28.832 -22.863 -3.658 1.00 0.00 H new ATOM 1752 N GLY A 116 30.544 -23.373 -0.162 1.00 0.00 N ATOM 1753 CA GLY A 116 31.715 -24.018 0.407 1.00 0.00 C ATOM 1754 C GLY A 116 31.341 -25.346 1.070 1.00 0.00 C ATOM 1755 O GLY A 116 30.637 -26.163 0.479 1.00 0.00 O ATOM 0 H GLY A 116 29.933 -23.992 -0.695 1.00 0.00 H new ATOM 0 HA2 GLY A 116 32.454 -24.193 -0.375 1.00 0.00 H new ATOM 0 HA3 GLY A 116 32.177 -23.358 1.141 1.00 0.00 H new TER 1759 GLY A 116