USER MOD reduce.3.24.130724 H: found=0, std=0, add=1366, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1362 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: B 49 LYS NZ :NH3+ 162:sc= -0.107 (180deg=-0.539) USER MOD Set 1.2: B 87 ASN : amide:sc= -1.36 K(o=-1.5,f=-6.2!) USER MOD Set 2.1: B 30 LYS NZ :NH3+ -170:sc= -0.0757 (180deg=0) USER MOD Set 2.2: B 64 ASN : amide:sc= -3.72! C(o=-3.8!,f=-14!) USER MOD Set 3.1: A 30 LYS NZ :NH3+ -170:sc= -0.0675 (180deg=0) USER MOD Set 3.2: A 64 ASN : amide:sc= -3.78! C(o=-3.8!,f=-15!) USER MOD Set 4.1: A 49 LYS NZ :NH3+ 162:sc= -0.0773 (180deg=-0.566) USER MOD Set 4.2: A 87 ASN : amide:sc= -1.28 K(o=-1.4,f=-6.6!) USER MOD Single : A 1 GLY N :NH3+ 145:sc= 0.0111 (180deg=0) USER MOD Single : A 2 SER OG : rot 170:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl -144:sc= -0.166 (180deg=-1.22) USER MOD Single : A 10 THR OG1 : rot 67:sc= 0.367 USER MOD Single : A 13 ASN :FLIP amide:sc= -2.97! C(o=-7.5!,f=-3!) USER MOD Single : A 16 HIS : no HE2:sc= -2.92 K(o=-2.9,f=-4!) USER MOD Single : A 18 HIS : no HD1:sc= -0.589 X(o=-0.59,f=-0.84) USER MOD Single : A 19 SER OG : rot -169:sc= -0.505 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ -146:sc= -0.218 (180deg=-1.3!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.261) USER MOD Single : A 29 SER OG : rot 180:sc=0.000181 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN :FLIP amide:sc= -1.18! F(o=-1.8,f=-1.2!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 GLN :FLIP amide:sc= -4.32! C(o=-8.8!,f=-4.3!) USER MOD Single : A 39 THR OG1 : rot 85:sc= 0.338 USER MOD Single : A 42 SER OG : rot -66:sc= 1.12 USER MOD Single : A 48 GLN : amide:sc= -0.0118 K(o=-0.012,f=-0.86) USER MOD Single : A 56 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.0179) USER MOD Single : A 58 MET CE :methyl -153:sc= 0 (180deg=-0.00145) USER MOD Single : A 59 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.00736) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 118:sc= 1.24 USER MOD Single : A 85 CYS SG : rot -154:sc= 0.565! USER MOD Single : A 86 ASN : amide:sc= -1.72! C(o=-1.7!,f=-2.9!) USER MOD Single : B 1 GLY N :NH3+ 136:sc= 0.0093 (180deg=0) USER MOD Single : B 2 SER OG : rot 170:sc= 0 USER MOD Single : B 6 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 MET CE :methyl -143:sc= -0.15 (180deg=-1.27) USER MOD Single : B 10 THR OG1 : rot 67:sc= 0.384 USER MOD Single : B 13 ASN :FLIP amide:sc= -3.05! C(o=-7.4!,f=-3.1!) USER MOD Single : B 16 HIS : no HE2:sc= -2.93 K(o=-2.9,f=-4!) USER MOD Single : B 18 HIS : no HD1:sc= -0.607 X(o=-0.61,f=-0.84) USER MOD Single : B 19 SER OG : rot -161:sc= -0.366 USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 LYS NZ :NH3+ -149:sc= -0.225 (180deg=-1.32!) USER MOD Single : B 26 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.305) USER MOD Single : B 29 SER OG : rot 180:sc=0.000742 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 GLN : amide:sc= -1.68 X(o=-1.7,f=-1.2!) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 GLN :FLIP amide:sc= -4.15! C(o=-8.7!,f=-4.2!) USER MOD Single : B 39 THR OG1 : rot 86:sc= 0.339 USER MOD Single : B 42 SER OG : rot -68:sc= 1.19 USER MOD Single : B 48 GLN : amide:sc= -0.0107 K(o=-0.011,f=-0.8) USER MOD Single : B 56 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.0194) USER MOD Single : B 58 MET CE :methyl -153:sc= 0 (180deg=-0.00288) USER MOD Single : B 59 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.00793) USER MOD Single : B 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 TYR OH : rot 180:sc= 0 USER MOD Single : B 82 THR OG1 : rot 116:sc= 1.28 USER MOD Single : B 85 CYS SG : rot -158:sc= 0.518! USER MOD Single : B 86 ASN : amide:sc= -1.48! C(o=-1.5!,f=-2.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 154.260 18.887 4.245 1.00 0.00 N ATOM 2 CA GLY A 1 153.932 17.467 4.196 1.00 0.00 C ATOM 3 C GLY A 1 153.139 17.134 2.938 1.00 0.00 C ATOM 4 O GLY A 1 152.255 17.888 2.532 1.00 0.00 O ATOM 0 H1 GLY A 1 154.237 19.215 5.232 1.00 0.00 H new ATOM 0 H2 GLY A 1 155.211 19.037 3.852 1.00 0.00 H new ATOM 0 H3 GLY A 1 153.566 19.423 3.686 1.00 0.00 H new ATOM 0 HA2 GLY A 1 154.848 16.877 4.220 1.00 0.00 H new ATOM 0 HA3 GLY A 1 153.354 17.193 5.078 1.00 0.00 H new ATOM 8 N SER A 2 153.462 16.001 2.323 1.00 0.00 N ATOM 9 CA SER A 2 152.772 15.578 1.110 1.00 0.00 C ATOM 10 C SER A 2 151.344 15.146 1.429 1.00 0.00 C ATOM 11 O SER A 2 151.043 14.746 2.554 1.00 0.00 O ATOM 12 CB SER A 2 153.523 14.419 0.457 1.00 0.00 C ATOM 13 OG SER A 2 154.827 14.852 0.091 1.00 0.00 O ATOM 0 H SER A 2 154.192 15.363 2.642 1.00 0.00 H new ATOM 0 HA SER A 2 152.740 16.422 0.421 1.00 0.00 H new ATOM 0 HB2 SER A 2 153.587 13.577 1.147 1.00 0.00 H new ATOM 0 HB3 SER A 2 152.983 14.070 -0.423 1.00 0.00 H new ATOM 0 HG SER A 2 155.365 14.078 -0.178 1.00 0.00 H new ATOM 19 N GLU A 3 150.469 15.230 0.433 1.00 0.00 N ATOM 20 CA GLU A 3 149.075 14.845 0.618 1.00 0.00 C ATOM 21 C GLU A 3 148.963 13.353 0.917 1.00 0.00 C ATOM 22 O GLU A 3 147.997 12.905 1.533 1.00 0.00 O ATOM 23 CB GLU A 3 148.272 15.176 -0.641 1.00 0.00 C ATOM 24 CG GLU A 3 148.290 16.688 -0.877 1.00 0.00 C ATOM 25 CD GLU A 3 147.479 17.031 -2.122 1.00 0.00 C ATOM 26 OE1 GLU A 3 146.933 16.118 -2.719 1.00 0.00 O ATOM 27 OE2 GLU A 3 147.418 18.202 -2.460 1.00 0.00 O ATOM 0 H GLU A 3 150.698 15.559 -0.505 1.00 0.00 H new ATOM 0 HA GLU A 3 148.674 15.403 1.464 1.00 0.00 H new ATOM 0 HB2 GLU A 3 148.695 14.658 -1.502 1.00 0.00 H new ATOM 0 HB3 GLU A 3 147.245 14.827 -0.532 1.00 0.00 H new ATOM 0 HG2 GLU A 3 147.877 17.205 -0.010 1.00 0.00 H new ATOM 0 HG3 GLU A 3 149.317 17.034 -0.995 1.00 0.00 H new ATOM 34 N LEU A 4 149.958 12.590 0.475 1.00 0.00 N ATOM 35 CA LEU A 4 149.958 11.148 0.700 1.00 0.00 C ATOM 36 C LEU A 4 150.224 10.833 2.169 1.00 0.00 C ATOM 37 O LEU A 4 149.724 9.842 2.701 1.00 0.00 O ATOM 38 CB LEU A 4 151.028 10.485 -0.170 1.00 0.00 C ATOM 39 CG LEU A 4 150.949 8.964 -0.017 1.00 0.00 C ATOM 40 CD1 LEU A 4 149.613 8.458 -0.570 1.00 0.00 C ATOM 41 CD2 LEU A 4 152.101 8.318 -0.791 1.00 0.00 C ATOM 0 H LEU A 4 150.768 12.941 -0.036 1.00 0.00 H new ATOM 0 HA LEU A 4 148.977 10.757 0.430 1.00 0.00 H new ATOM 0 HB2 LEU A 4 150.885 10.763 -1.214 1.00 0.00 H new ATOM 0 HB3 LEU A 4 152.017 10.838 0.121 1.00 0.00 H new ATOM 0 HG LEU A 4 151.023 8.701 1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 4 149.560 7.375 -0.459 1.00 0.00 H new ATOM 0 HD12 LEU A 4 148.793 8.919 -0.019 1.00 0.00 H new ATOM 0 HD13 LEU A 4 149.534 8.719 -1.625 1.00 0.00 H new ATOM 0 HD21 LEU A 4 152.048 7.234 -0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 4 152.025 8.583 -1.845 1.00 0.00 H new ATOM 0 HD23 LEU A 4 153.051 8.676 -0.395 1.00 0.00 H new ATOM 53 N GLU A 5 151.014 11.681 2.819 1.00 0.00 N ATOM 54 CA GLU A 5 151.341 11.480 4.226 1.00 0.00 C ATOM 55 C GLU A 5 150.082 11.543 5.086 1.00 0.00 C ATOM 56 O GLU A 5 149.866 10.694 5.949 1.00 0.00 O ATOM 57 CB GLU A 5 152.334 12.548 4.688 1.00 0.00 C ATOM 58 CG GLU A 5 153.710 12.259 4.086 1.00 0.00 C ATOM 59 CD GLU A 5 154.706 13.326 4.523 1.00 0.00 C ATOM 60 OE1 GLU A 5 154.280 14.290 5.139 1.00 0.00 O ATOM 61 OE2 GLU A 5 155.882 13.164 4.237 1.00 0.00 O ATOM 0 H GLU A 5 151.437 12.508 2.398 1.00 0.00 H new ATOM 0 HA GLU A 5 151.791 10.493 4.338 1.00 0.00 H new ATOM 0 HB2 GLU A 5 151.991 13.536 4.381 1.00 0.00 H new ATOM 0 HB3 GLU A 5 152.396 12.556 5.776 1.00 0.00 H new ATOM 0 HG2 GLU A 5 154.056 11.275 4.404 1.00 0.00 H new ATOM 0 HG3 GLU A 5 153.643 12.237 2.998 1.00 0.00 H new ATOM 68 N THR A 6 149.254 12.556 4.845 1.00 0.00 N ATOM 69 CA THR A 6 148.021 12.717 5.607 1.00 0.00 C ATOM 70 C THR A 6 146.922 11.819 5.046 1.00 0.00 C ATOM 71 O THR A 6 145.951 11.507 5.735 1.00 0.00 O ATOM 72 CB THR A 6 147.565 14.179 5.561 1.00 0.00 C ATOM 73 OG1 THR A 6 146.559 14.388 6.542 1.00 0.00 O ATOM 74 CG2 THR A 6 147.004 14.501 4.175 1.00 0.00 C ATOM 0 H THR A 6 149.413 13.271 4.135 1.00 0.00 H new ATOM 0 HA THR A 6 148.215 12.430 6.641 1.00 0.00 H new ATOM 0 HB THR A 6 148.415 14.831 5.764 1.00 0.00 H new ATOM 0 HG1 THR A 6 146.266 15.323 6.516 1.00 0.00 H new ATOM 0 HG21 THR A 6 146.681 15.542 4.146 1.00 0.00 H new ATOM 0 HG22 THR A 6 147.777 14.340 3.423 1.00 0.00 H new ATOM 0 HG23 THR A 6 146.154 13.851 3.966 1.00 0.00 H new ATOM 82 N ALA A 7 147.082 11.410 3.792 1.00 0.00 N ATOM 83 CA ALA A 7 146.096 10.549 3.147 1.00 0.00 C ATOM 84 C ALA A 7 145.857 9.289 3.975 1.00 0.00 C ATOM 85 O ALA A 7 144.714 8.905 4.223 1.00 0.00 O ATOM 86 CB ALA A 7 146.578 10.157 1.750 1.00 0.00 C ATOM 0 H ALA A 7 147.879 11.658 3.205 1.00 0.00 H new ATOM 0 HA ALA A 7 145.159 11.101 3.068 1.00 0.00 H new ATOM 0 HB1 ALA A 7 145.836 9.514 1.276 1.00 0.00 H new ATOM 0 HB2 ALA A 7 146.718 11.055 1.148 1.00 0.00 H new ATOM 0 HB3 ALA A 7 147.524 9.622 1.828 1.00 0.00 H new ATOM 92 N MET A 8 146.944 8.651 4.399 1.00 0.00 N ATOM 93 CA MET A 8 146.840 7.434 5.196 1.00 0.00 C ATOM 94 C MET A 8 146.352 7.753 6.605 1.00 0.00 C ATOM 95 O MET A 8 145.695 6.933 7.246 1.00 0.00 O ATOM 96 CB MET A 8 148.204 6.744 5.270 1.00 0.00 C ATOM 97 CG MET A 8 148.827 6.693 3.874 1.00 0.00 C ATOM 98 SD MET A 8 147.660 5.932 2.719 1.00 0.00 S ATOM 99 CE MET A 8 147.633 4.289 3.476 1.00 0.00 C ATOM 0 H MET A 8 147.899 8.953 4.206 1.00 0.00 H new ATOM 0 HA MET A 8 146.120 6.770 4.719 1.00 0.00 H new ATOM 0 HB2 MET A 8 148.860 7.284 5.953 1.00 0.00 H new ATOM 0 HB3 MET A 8 148.092 5.735 5.667 1.00 0.00 H new ATOM 0 HG2 MET A 8 149.081 7.699 3.541 1.00 0.00 H new ATOM 0 HG3 MET A 8 149.755 6.122 3.899 1.00 0.00 H new ATOM 0 HE1 MET A 8 147.549 3.531 2.697 1.00 0.00 H new ATOM 0 HE2 MET A 8 148.554 4.132 4.037 1.00 0.00 H new ATOM 0 HE3 MET A 8 146.780 4.213 4.150 1.00 0.00 H new ATOM 109 N GLU A 9 146.678 8.950 7.081 1.00 0.00 N ATOM 110 CA GLU A 9 146.269 9.369 8.417 1.00 0.00 C ATOM 111 C GLU A 9 144.750 9.490 8.501 1.00 0.00 C ATOM 112 O GLU A 9 144.173 9.433 9.586 1.00 0.00 O ATOM 113 CB GLU A 9 146.910 10.714 8.760 1.00 0.00 C ATOM 114 CG GLU A 9 148.433 10.566 8.777 1.00 0.00 C ATOM 115 CD GLU A 9 148.866 9.759 9.995 1.00 0.00 C ATOM 116 OE1 GLU A 9 148.070 9.632 10.911 1.00 0.00 O ATOM 117 OE2 GLU A 9 149.989 9.280 9.995 1.00 0.00 O ATOM 0 H GLU A 9 147.221 9.643 6.566 1.00 0.00 H new ATOM 0 HA GLU A 9 146.601 8.615 9.131 1.00 0.00 H new ATOM 0 HB2 GLU A 9 146.616 11.466 8.028 1.00 0.00 H new ATOM 0 HB3 GLU A 9 146.557 11.060 9.732 1.00 0.00 H new ATOM 0 HG2 GLU A 9 148.769 10.072 7.865 1.00 0.00 H new ATOM 0 HG3 GLU A 9 148.902 11.550 8.797 1.00 0.00 H new ATOM 124 N THR A 10 144.109 9.663 7.350 1.00 0.00 N ATOM 125 CA THR A 10 142.658 9.794 7.309 1.00 0.00 C ATOM 126 C THR A 10 141.988 8.430 7.446 1.00 0.00 C ATOM 127 O THR A 10 141.032 8.271 8.204 1.00 0.00 O ATOM 128 CB THR A 10 142.227 10.447 5.995 1.00 0.00 C ATOM 129 OG1 THR A 10 142.983 11.632 5.786 1.00 0.00 O ATOM 130 CG2 THR A 10 140.739 10.792 6.061 1.00 0.00 C ATOM 0 H THR A 10 144.567 9.715 6.440 1.00 0.00 H new ATOM 0 HA THR A 10 142.348 10.422 8.145 1.00 0.00 H new ATOM 0 HB THR A 10 142.401 9.756 5.170 1.00 0.00 H new ATOM 0 HG1 THR A 10 143.924 11.399 5.640 1.00 0.00 H new ATOM 0 HG21 THR A 10 140.432 11.257 5.125 1.00 0.00 H new ATOM 0 HG22 THR A 10 140.161 9.882 6.221 1.00 0.00 H new ATOM 0 HG23 THR A 10 140.562 11.483 6.885 1.00 0.00 H new ATOM 138 N LEU A 11 142.494 7.451 6.703 1.00 0.00 N ATOM 139 CA LEU A 11 141.934 6.105 6.746 1.00 0.00 C ATOM 140 C LEU A 11 142.175 5.461 8.109 1.00 0.00 C ATOM 141 O LEU A 11 141.306 4.769 8.641 1.00 0.00 O ATOM 142 CB LEU A 11 142.566 5.241 5.652 1.00 0.00 C ATOM 143 CG LEU A 11 142.021 5.664 4.283 1.00 0.00 C ATOM 144 CD1 LEU A 11 143.044 5.327 3.198 1.00 0.00 C ATOM 145 CD2 LEU A 11 140.714 4.916 3.996 1.00 0.00 C ATOM 0 H LEU A 11 143.285 7.563 6.068 1.00 0.00 H new ATOM 0 HA LEU A 11 140.859 6.176 6.579 1.00 0.00 H new ATOM 0 HB2 LEU A 11 143.651 5.348 5.672 1.00 0.00 H new ATOM 0 HB3 LEU A 11 142.346 4.189 5.833 1.00 0.00 H new ATOM 0 HG LEU A 11 141.833 6.738 4.287 1.00 0.00 H new ATOM 0 HD11 LEU A 11 142.655 5.628 2.225 1.00 0.00 H new ATOM 0 HD12 LEU A 11 143.974 5.859 3.397 1.00 0.00 H new ATOM 0 HD13 LEU A 11 143.233 4.253 3.197 1.00 0.00 H new ATOM 0 HD21 LEU A 11 140.328 5.218 3.022 1.00 0.00 H new ATOM 0 HD22 LEU A 11 140.902 3.842 3.995 1.00 0.00 H new ATOM 0 HD23 LEU A 11 139.981 5.155 4.767 1.00 0.00 H new ATOM 157 N ILE A 12 143.358 5.691 8.667 1.00 0.00 N ATOM 158 CA ILE A 12 143.700 5.126 9.969 1.00 0.00 C ATOM 159 C ILE A 12 142.859 5.778 11.069 1.00 0.00 C ATOM 160 O ILE A 12 142.444 5.119 12.022 1.00 0.00 O ATOM 161 CB ILE A 12 145.205 5.325 10.237 1.00 0.00 C ATOM 162 CG1 ILE A 12 145.740 4.172 11.095 1.00 0.00 C ATOM 163 CG2 ILE A 12 145.453 6.655 10.959 1.00 0.00 C ATOM 164 CD1 ILE A 12 144.900 4.031 12.366 1.00 0.00 C ATOM 0 H ILE A 12 144.091 6.260 8.244 1.00 0.00 H new ATOM 0 HA ILE A 12 143.482 4.058 9.968 1.00 0.00 H new ATOM 0 HB ILE A 12 145.726 5.340 9.280 1.00 0.00 H new ATOM 0 HG12 ILE A 12 145.713 3.242 10.527 1.00 0.00 H new ATOM 0 HG13 ILE A 12 146.782 4.356 11.357 1.00 0.00 H new ATOM 0 HG21 ILE A 12 146.521 6.777 11.139 1.00 0.00 H new ATOM 0 HG22 ILE A 12 145.093 7.477 10.341 1.00 0.00 H new ATOM 0 HG23 ILE A 12 144.922 6.657 11.911 1.00 0.00 H new ATOM 0 HD11 ILE A 12 145.287 3.210 12.969 1.00 0.00 H new ATOM 0 HD12 ILE A 12 144.949 4.957 12.939 1.00 0.00 H new ATOM 0 HD13 ILE A 12 143.864 3.826 12.097 1.00 0.00 H new ATOM 176 N ASN A 13 142.613 7.077 10.927 1.00 0.00 N ATOM 177 CA ASN A 13 141.825 7.808 11.913 1.00 0.00 C ATOM 178 C ASN A 13 140.392 7.282 11.960 1.00 0.00 C ATOM 179 O ASN A 13 139.932 6.803 12.997 1.00 0.00 O ATOM 180 CB ASN A 13 141.811 9.298 11.567 1.00 0.00 C ATOM 181 CG ASN A 13 143.162 9.924 11.895 1.00 0.00 C ATOM 182 OD1 ASN A 13 144.181 9.154 12.163 1.00 0.00 O flip ATOM 183 ND2 ASN A 13 143.294 11.148 11.907 1.00 0.00 N flip ATOM 0 H ASN A 13 142.945 7.641 10.145 1.00 0.00 H new ATOM 0 HA ASN A 13 142.282 7.664 12.892 1.00 0.00 H new ATOM 0 HB2 ASN A 13 141.587 9.432 10.509 1.00 0.00 H new ATOM 0 HB3 ASN A 13 141.022 9.802 12.126 1.00 0.00 H new ATOM 0 HD21 ASN A 13 142.497 11.749 11.697 1.00 0.00 H new ATOM 0 HD22 ASN A 13 144.200 11.561 12.127 1.00 0.00 H new ATOM 190 N VAL A 14 139.691 7.379 10.835 1.00 0.00 N ATOM 191 CA VAL A 14 138.310 6.915 10.763 1.00 0.00 C ATOM 192 C VAL A 14 138.205 5.458 11.207 1.00 0.00 C ATOM 193 O VAL A 14 137.182 5.036 11.747 1.00 0.00 O ATOM 194 CB VAL A 14 137.780 7.053 9.334 1.00 0.00 C ATOM 195 CG1 VAL A 14 137.730 8.532 8.947 1.00 0.00 C ATOM 196 CG2 VAL A 14 138.705 6.306 8.370 1.00 0.00 C ATOM 0 H VAL A 14 140.053 7.772 9.966 1.00 0.00 H new ATOM 0 HA VAL A 14 137.710 7.531 11.433 1.00 0.00 H new ATOM 0 HB VAL A 14 136.778 6.629 9.278 1.00 0.00 H new ATOM 0 HG11 VAL A 14 137.352 8.629 7.929 1.00 0.00 H new ATOM 0 HG12 VAL A 14 137.070 9.065 9.631 1.00 0.00 H new ATOM 0 HG13 VAL A 14 138.732 8.957 9.004 1.00 0.00 H new ATOM 0 HG21 VAL A 14 138.327 6.405 7.353 1.00 0.00 H new ATOM 0 HG22 VAL A 14 139.708 6.729 8.427 1.00 0.00 H new ATOM 0 HG23 VAL A 14 138.740 5.251 8.643 1.00 0.00 H new ATOM 206 N PHE A 15 139.268 4.695 10.978 1.00 0.00 N ATOM 207 CA PHE A 15 139.282 3.287 11.361 1.00 0.00 C ATOM 208 C PHE A 15 139.123 3.142 12.871 1.00 0.00 C ATOM 209 O PHE A 15 138.353 2.308 13.347 1.00 0.00 O ATOM 210 CB PHE A 15 140.595 2.639 10.916 1.00 0.00 C ATOM 211 CG PHE A 15 140.632 1.204 11.384 1.00 0.00 C ATOM 212 CD1 PHE A 15 141.087 0.900 12.672 1.00 0.00 C ATOM 213 CD2 PHE A 15 140.212 0.177 10.529 1.00 0.00 C ATOM 214 CE1 PHE A 15 141.123 -0.429 13.107 1.00 0.00 C ATOM 215 CE2 PHE A 15 140.248 -1.153 10.964 1.00 0.00 C ATOM 216 CZ PHE A 15 140.704 -1.456 12.253 1.00 0.00 C ATOM 0 H PHE A 15 140.125 5.024 10.533 1.00 0.00 H new ATOM 0 HA PHE A 15 138.447 2.786 10.871 1.00 0.00 H new ATOM 0 HB2 PHE A 15 140.684 2.681 9.830 1.00 0.00 H new ATOM 0 HB3 PHE A 15 141.442 3.189 11.327 1.00 0.00 H new ATOM 0 HD1 PHE A 15 141.411 1.692 13.331 1.00 0.00 H new ATOM 0 HD2 PHE A 15 139.861 0.411 9.535 1.00 0.00 H new ATOM 0 HE1 PHE A 15 141.474 -0.663 14.101 1.00 0.00 H new ATOM 0 HE2 PHE A 15 139.924 -1.945 10.306 1.00 0.00 H new ATOM 0 HZ PHE A 15 140.732 -2.482 12.588 1.00 0.00 H new ATOM 226 N HIS A 16 139.855 3.962 13.620 1.00 0.00 N ATOM 227 CA HIS A 16 139.786 3.918 15.077 1.00 0.00 C ATOM 228 C HIS A 16 138.474 4.521 15.570 1.00 0.00 C ATOM 229 O HIS A 16 137.942 4.114 16.602 1.00 0.00 O ATOM 230 CB HIS A 16 140.961 4.692 15.677 1.00 0.00 C ATOM 231 CG HIS A 16 142.223 3.889 15.519 1.00 0.00 C ATOM 232 ND1 HIS A 16 142.273 2.529 15.780 1.00 0.00 N ATOM 233 CD2 HIS A 16 143.490 4.243 15.127 1.00 0.00 C ATOM 234 CE1 HIS A 16 143.533 2.117 15.544 1.00 0.00 C ATOM 235 NE2 HIS A 16 144.316 3.123 15.143 1.00 0.00 N ATOM 0 H HIS A 16 140.498 4.660 13.246 1.00 0.00 H new ATOM 0 HA HIS A 16 139.836 2.876 15.394 1.00 0.00 H new ATOM 0 HB2 HIS A 16 141.066 5.657 15.180 1.00 0.00 H new ATOM 0 HB3 HIS A 16 140.776 4.895 16.732 1.00 0.00 H new ATOM 0 HD1 HIS A 16 141.497 1.946 16.094 1.00 0.00 H new ATOM 0 HD2 HIS A 16 143.799 5.240 14.848 1.00 0.00 H new ATOM 0 HE1 HIS A 16 143.870 1.098 15.664 1.00 0.00 H new ATOM 244 N ALA A 17 137.961 5.495 14.825 1.00 0.00 N ATOM 245 CA ALA A 17 136.711 6.150 15.196 1.00 0.00 C ATOM 246 C ALA A 17 135.576 5.134 15.266 1.00 0.00 C ATOM 247 O ALA A 17 134.630 5.299 16.036 1.00 0.00 O ATOM 248 CB ALA A 17 136.367 7.233 14.174 1.00 0.00 C ATOM 0 H ALA A 17 138.387 5.846 13.967 1.00 0.00 H new ATOM 0 HA ALA A 17 136.837 6.605 16.178 1.00 0.00 H new ATOM 0 HB1 ALA A 17 135.433 7.717 14.458 1.00 0.00 H new ATOM 0 HB2 ALA A 17 137.166 7.974 14.146 1.00 0.00 H new ATOM 0 HB3 ALA A 17 136.257 6.781 13.188 1.00 0.00 H new ATOM 254 N HIS A 18 135.677 4.084 14.457 1.00 0.00 N ATOM 255 CA HIS A 18 134.652 3.047 14.436 1.00 0.00 C ATOM 256 C HIS A 18 135.029 1.901 15.369 1.00 0.00 C ATOM 257 O HIS A 18 134.269 1.547 16.270 1.00 0.00 O ATOM 258 CB HIS A 18 134.479 2.513 13.014 1.00 0.00 C ATOM 259 CG HIS A 18 133.882 3.586 12.144 1.00 0.00 C ATOM 260 ND1 HIS A 18 132.629 4.124 12.389 1.00 0.00 N ATOM 261 CD2 HIS A 18 134.357 4.232 11.030 1.00 0.00 C ATOM 262 CE1 HIS A 18 132.392 5.049 11.442 1.00 0.00 C ATOM 263 NE2 HIS A 18 133.414 5.155 10.588 1.00 0.00 N ATOM 0 H HIS A 18 136.452 3.929 13.812 1.00 0.00 H new ATOM 0 HA HIS A 18 133.713 3.484 14.777 1.00 0.00 H new ATOM 0 HB2 HIS A 18 135.442 2.199 12.613 1.00 0.00 H new ATOM 0 HB3 HIS A 18 133.834 1.634 13.020 1.00 0.00 H new ATOM 0 HD2 HIS A 18 135.316 4.052 10.567 1.00 0.00 H new ATOM 0 HE1 HIS A 18 131.487 5.634 11.379 1.00 0.00 H new ATOM 0 HE2 HIS A 18 133.487 5.779 9.784 1.00 0.00 H new ATOM 272 N SER A 19 136.207 1.327 15.148 1.00 0.00 N ATOM 273 CA SER A 19 136.674 0.221 15.975 1.00 0.00 C ATOM 274 C SER A 19 136.816 0.663 17.428 1.00 0.00 C ATOM 275 O SER A 19 136.683 -0.145 18.349 1.00 0.00 O ATOM 276 CB SER A 19 138.021 -0.284 15.460 1.00 0.00 C ATOM 277 OG SER A 19 138.331 -1.520 16.090 1.00 0.00 O ATOM 0 H SER A 19 136.852 1.607 14.409 1.00 0.00 H new ATOM 0 HA SER A 19 135.941 -0.584 15.921 1.00 0.00 H new ATOM 0 HB2 SER A 19 137.985 -0.413 14.378 1.00 0.00 H new ATOM 0 HB3 SER A 19 138.801 0.449 15.668 1.00 0.00 H new ATOM 0 HG SER A 19 139.262 -1.759 15.901 1.00 0.00 H new ATOM 283 N GLY A 20 137.087 1.948 17.627 1.00 0.00 N ATOM 284 CA GLY A 20 137.245 2.486 18.973 1.00 0.00 C ATOM 285 C GLY A 20 136.117 2.014 19.884 1.00 0.00 C ATOM 286 O GLY A 20 136.236 2.055 21.109 1.00 0.00 O ATOM 0 H GLY A 20 137.201 2.632 16.879 1.00 0.00 H new ATOM 0 HA2 GLY A 20 138.205 2.173 19.384 1.00 0.00 H new ATOM 0 HA3 GLY A 20 137.255 3.575 18.935 1.00 0.00 H new ATOM 290 N LYS A 21 135.022 1.566 19.278 1.00 0.00 N ATOM 291 CA LYS A 21 133.877 1.088 20.046 1.00 0.00 C ATOM 292 C LYS A 21 134.231 -0.192 20.793 1.00 0.00 C ATOM 293 O LYS A 21 135.401 -0.561 20.894 1.00 0.00 O ATOM 294 CB LYS A 21 132.695 0.825 19.110 1.00 0.00 C ATOM 295 CG LYS A 21 133.023 -0.355 18.193 1.00 0.00 C ATOM 296 CD LYS A 21 131.957 -0.465 17.102 1.00 0.00 C ATOM 297 CE LYS A 21 130.646 -0.960 17.716 1.00 0.00 C ATOM 298 NZ LYS A 21 129.724 -1.402 16.631 1.00 0.00 N ATOM 0 H LYS A 21 134.903 1.524 18.266 1.00 0.00 H new ATOM 0 HA LYS A 21 133.603 1.854 20.771 1.00 0.00 H new ATOM 0 HB2 LYS A 21 131.798 0.609 19.691 1.00 0.00 H new ATOM 0 HB3 LYS A 21 132.484 1.714 18.515 1.00 0.00 H new ATOM 0 HG2 LYS A 21 134.006 -0.217 17.743 1.00 0.00 H new ATOM 0 HG3 LYS A 21 133.064 -1.278 18.771 1.00 0.00 H new ATOM 0 HD2 LYS A 21 131.805 0.505 16.628 1.00 0.00 H new ATOM 0 HD3 LYS A 21 132.288 -1.152 16.323 1.00 0.00 H new ATOM 0 HE2 LYS A 21 130.842 -1.786 18.400 1.00 0.00 H new ATOM 0 HE3 LYS A 21 130.183 -0.165 18.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 128.833 -1.738 17.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 129.528 -0.603 15.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 130.167 -2.173 16.092 1.00 0.00 H new ATOM 312 N GLU A 22 133.212 -0.867 21.316 1.00 0.00 N ATOM 313 CA GLU A 22 133.428 -2.107 22.053 1.00 0.00 C ATOM 314 C GLU A 22 133.964 -3.194 21.126 1.00 0.00 C ATOM 315 O GLU A 22 134.291 -2.931 19.969 1.00 0.00 O ATOM 316 CB GLU A 22 132.115 -2.576 22.683 1.00 0.00 C ATOM 317 CG GLU A 22 131.520 -1.446 23.526 1.00 0.00 C ATOM 318 CD GLU A 22 130.257 -1.931 24.229 1.00 0.00 C ATOM 319 OE1 GLU A 22 129.852 -3.053 23.971 1.00 0.00 O ATOM 320 OE2 GLU A 22 129.712 -1.174 25.015 1.00 0.00 O ATOM 0 H GLU A 22 132.236 -0.579 21.244 1.00 0.00 H new ATOM 0 HA GLU A 22 134.161 -1.918 22.837 1.00 0.00 H new ATOM 0 HB2 GLU A 22 131.412 -2.872 21.905 1.00 0.00 H new ATOM 0 HB3 GLU A 22 132.291 -3.454 23.305 1.00 0.00 H new ATOM 0 HG2 GLU A 22 132.249 -1.108 24.262 1.00 0.00 H new ATOM 0 HG3 GLU A 22 131.288 -0.591 22.891 1.00 0.00 H new ATOM 327 N GLY A 23 134.052 -4.415 21.643 1.00 0.00 N ATOM 328 CA GLY A 23 134.551 -5.534 20.852 1.00 0.00 C ATOM 329 C GLY A 23 136.034 -5.365 20.543 1.00 0.00 C ATOM 330 O GLY A 23 136.740 -4.626 21.229 1.00 0.00 O ATOM 0 H GLY A 23 133.787 -4.654 22.598 1.00 0.00 H new ATOM 0 HA2 GLY A 23 134.393 -6.466 21.394 1.00 0.00 H new ATOM 0 HA3 GLY A 23 133.988 -5.606 19.922 1.00 0.00 H new ATOM 334 N ASP A 24 136.500 -6.053 19.506 1.00 0.00 N ATOM 335 CA ASP A 24 137.901 -5.969 19.114 1.00 0.00 C ATOM 336 C ASP A 24 138.217 -4.590 18.545 1.00 0.00 C ATOM 337 O ASP A 24 137.859 -4.280 17.409 1.00 0.00 O ATOM 338 CB ASP A 24 138.217 -7.040 18.069 1.00 0.00 C ATOM 339 CG ASP A 24 137.899 -8.424 18.626 1.00 0.00 C ATOM 340 OD1 ASP A 24 138.449 -8.765 19.660 1.00 0.00 O ATOM 341 OD2 ASP A 24 137.109 -9.121 18.011 1.00 0.00 O ATOM 0 H ASP A 24 135.932 -6.671 18.926 1.00 0.00 H new ATOM 0 HA ASP A 24 138.516 -6.133 19.999 1.00 0.00 H new ATOM 0 HB2 ASP A 24 137.635 -6.860 17.165 1.00 0.00 H new ATOM 0 HB3 ASP A 24 139.269 -6.985 17.787 1.00 0.00 H new ATOM 346 N LYS A 25 138.887 -3.766 19.343 1.00 0.00 N ATOM 347 CA LYS A 25 139.245 -2.420 18.908 1.00 0.00 C ATOM 348 C LYS A 25 140.352 -2.472 17.859 1.00 0.00 C ATOM 349 O LYS A 25 140.446 -1.597 16.999 1.00 0.00 O ATOM 350 CB LYS A 25 139.715 -1.595 20.108 1.00 0.00 C ATOM 351 CG LYS A 25 138.642 -1.622 21.198 1.00 0.00 C ATOM 352 CD LYS A 25 139.046 -0.684 22.338 1.00 0.00 C ATOM 353 CE LYS A 25 139.988 -1.419 23.296 1.00 0.00 C ATOM 354 NZ LYS A 25 139.282 -2.594 23.880 1.00 0.00 N ATOM 0 H LYS A 25 139.191 -4.003 20.287 1.00 0.00 H new ATOM 0 HA LYS A 25 138.365 -1.953 18.466 1.00 0.00 H new ATOM 0 HB2 LYS A 25 140.651 -1.997 20.495 1.00 0.00 H new ATOM 0 HB3 LYS A 25 139.912 -0.568 19.802 1.00 0.00 H new ATOM 0 HG2 LYS A 25 137.681 -1.316 20.784 1.00 0.00 H new ATOM 0 HG3 LYS A 25 138.518 -2.637 21.575 1.00 0.00 H new ATOM 0 HD2 LYS A 25 139.537 0.202 21.937 1.00 0.00 H new ATOM 0 HD3 LYS A 25 138.160 -0.342 22.873 1.00 0.00 H new ATOM 0 HE2 LYS A 25 140.882 -1.745 22.765 1.00 0.00 H new ATOM 0 HE3 LYS A 25 140.315 -0.747 24.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 139.606 -2.743 24.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 138.257 -2.419 23.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 139.490 -3.441 23.313 1.00 0.00 H new ATOM 368 N TYR A 26 141.189 -3.501 17.939 1.00 0.00 N ATOM 369 CA TYR A 26 142.288 -3.654 16.993 1.00 0.00 C ATOM 370 C TYR A 26 141.765 -4.053 15.617 1.00 0.00 C ATOM 371 O TYR A 26 142.336 -3.676 14.593 1.00 0.00 O ATOM 372 CB TYR A 26 143.265 -4.718 17.496 1.00 0.00 C ATOM 373 CG TYR A 26 143.774 -4.330 18.864 1.00 0.00 C ATOM 374 CD1 TYR A 26 144.770 -3.353 18.989 1.00 0.00 C ATOM 375 CD2 TYR A 26 143.251 -4.947 20.007 1.00 0.00 C ATOM 376 CE1 TYR A 26 145.242 -2.993 20.257 1.00 0.00 C ATOM 377 CE2 TYR A 26 143.723 -4.587 21.274 1.00 0.00 C ATOM 378 CZ TYR A 26 144.719 -3.610 21.399 1.00 0.00 C ATOM 379 OH TYR A 26 145.184 -3.255 22.649 1.00 0.00 O ATOM 0 H TYR A 26 141.128 -4.236 18.643 1.00 0.00 H new ATOM 0 HA TYR A 26 142.802 -2.697 16.908 1.00 0.00 H new ATOM 0 HB2 TYR A 26 142.770 -5.688 17.542 1.00 0.00 H new ATOM 0 HB3 TYR A 26 144.099 -4.818 16.801 1.00 0.00 H new ATOM 0 HD1 TYR A 26 145.174 -2.877 18.107 1.00 0.00 H new ATOM 0 HD2 TYR A 26 142.483 -5.701 19.911 1.00 0.00 H new ATOM 0 HE1 TYR A 26 146.009 -2.239 20.354 1.00 0.00 H new ATOM 0 HE2 TYR A 26 143.319 -5.062 22.156 1.00 0.00 H new ATOM 0 HH TYR A 26 144.715 -3.777 23.333 1.00 0.00 H new ATOM 389 N LYS A 27 140.678 -4.821 15.598 1.00 0.00 N ATOM 390 CA LYS A 27 140.086 -5.273 14.340 1.00 0.00 C ATOM 391 C LYS A 27 138.692 -4.678 14.155 1.00 0.00 C ATOM 392 O LYS A 27 137.938 -4.531 15.116 1.00 0.00 O ATOM 393 CB LYS A 27 139.996 -6.799 14.326 1.00 0.00 C ATOM 394 CG LYS A 27 141.346 -7.395 14.732 1.00 0.00 C ATOM 395 CD LYS A 27 142.408 -7.006 13.702 1.00 0.00 C ATOM 396 CE LYS A 27 143.616 -7.935 13.839 1.00 0.00 C ATOM 397 NZ LYS A 27 144.113 -7.903 15.244 1.00 0.00 N ATOM 0 H LYS A 27 140.191 -5.142 16.435 1.00 0.00 H new ATOM 0 HA LYS A 27 140.722 -4.937 13.521 1.00 0.00 H new ATOM 0 HB2 LYS A 27 139.218 -7.134 15.012 1.00 0.00 H new ATOM 0 HB3 LYS A 27 139.717 -7.148 13.332 1.00 0.00 H new ATOM 0 HG2 LYS A 27 141.633 -7.033 15.719 1.00 0.00 H new ATOM 0 HG3 LYS A 27 141.270 -8.480 14.800 1.00 0.00 H new ATOM 0 HD2 LYS A 27 141.996 -7.074 12.695 1.00 0.00 H new ATOM 0 HD3 LYS A 27 142.713 -5.970 13.852 1.00 0.00 H new ATOM 0 HE2 LYS A 27 143.338 -8.952 13.564 1.00 0.00 H new ATOM 0 HE3 LYS A 27 144.406 -7.624 13.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 145.084 -8.274 15.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 144.104 -6.923 15.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 143.498 -8.490 15.843 1.00 0.00 H new ATOM 411 N LEU A 28 138.360 -4.340 12.913 1.00 0.00 N ATOM 412 CA LEU A 28 137.055 -3.762 12.607 1.00 0.00 C ATOM 413 C LEU A 28 136.107 -4.837 12.083 1.00 0.00 C ATOM 414 O LEU A 28 136.505 -5.707 11.309 1.00 0.00 O ATOM 415 CB LEU A 28 137.208 -2.656 11.559 1.00 0.00 C ATOM 416 CG LEU A 28 135.845 -2.018 11.274 1.00 0.00 C ATOM 417 CD1 LEU A 28 135.313 -1.350 12.545 1.00 0.00 C ATOM 418 CD2 LEU A 28 136.001 -0.967 10.171 1.00 0.00 C ATOM 0 H LEU A 28 138.973 -4.455 12.106 1.00 0.00 H new ATOM 0 HA LEU A 28 136.638 -3.339 13.521 1.00 0.00 H new ATOM 0 HB2 LEU A 28 137.907 -1.899 11.915 1.00 0.00 H new ATOM 0 HB3 LEU A 28 137.626 -3.068 10.641 1.00 0.00 H new ATOM 0 HG LEU A 28 135.143 -2.787 10.952 1.00 0.00 H new ATOM 0 HD11 LEU A 28 134.343 -0.897 12.339 1.00 0.00 H new ATOM 0 HD12 LEU A 28 135.205 -2.097 13.331 1.00 0.00 H new ATOM 0 HD13 LEU A 28 136.012 -0.579 12.871 1.00 0.00 H new ATOM 0 HD21 LEU A 28 135.033 -0.510 9.964 1.00 0.00 H new ATOM 0 HD22 LEU A 28 136.703 -0.199 10.497 1.00 0.00 H new ATOM 0 HD23 LEU A 28 136.378 -1.443 9.266 1.00 0.00 H new ATOM 430 N SER A 29 134.850 -4.769 12.510 1.00 0.00 N ATOM 431 CA SER A 29 133.852 -5.741 12.077 1.00 0.00 C ATOM 432 C SER A 29 133.343 -5.397 10.681 1.00 0.00 C ATOM 433 O SER A 29 133.568 -4.294 10.181 1.00 0.00 O ATOM 434 CB SER A 29 132.681 -5.761 13.059 1.00 0.00 C ATOM 435 OG SER A 29 132.144 -4.449 13.176 1.00 0.00 O ATOM 0 H SER A 29 134.500 -4.057 13.151 1.00 0.00 H new ATOM 0 HA SER A 29 134.318 -6.726 12.050 1.00 0.00 H new ATOM 0 HB2 SER A 29 131.912 -6.452 12.712 1.00 0.00 H new ATOM 0 HB3 SER A 29 133.014 -6.118 14.033 1.00 0.00 H new ATOM 0 HG SER A 29 131.392 -4.458 13.804 1.00 0.00 H new ATOM 441 N LYS A 30 132.657 -6.348 10.054 1.00 0.00 N ATOM 442 CA LYS A 30 132.123 -6.132 8.713 1.00 0.00 C ATOM 443 C LYS A 30 130.721 -5.531 8.782 1.00 0.00 C ATOM 444 O LYS A 30 130.225 -4.979 7.800 1.00 0.00 O ATOM 445 CB LYS A 30 132.075 -7.458 7.952 1.00 0.00 C ATOM 446 CG LYS A 30 133.500 -7.940 7.675 1.00 0.00 C ATOM 447 CD LYS A 30 133.455 -9.212 6.827 1.00 0.00 C ATOM 448 CE LYS A 30 134.870 -9.772 6.669 1.00 0.00 C ATOM 449 NZ LYS A 30 134.795 -11.211 6.287 1.00 0.00 N ATOM 0 H LYS A 30 132.459 -7.268 10.448 1.00 0.00 H new ATOM 0 HA LYS A 30 132.778 -5.435 8.190 1.00 0.00 H new ATOM 0 HB2 LYS A 30 131.534 -8.204 8.534 1.00 0.00 H new ATOM 0 HB3 LYS A 30 131.534 -7.332 7.014 1.00 0.00 H new ATOM 0 HG2 LYS A 30 134.063 -7.164 7.156 1.00 0.00 H new ATOM 0 HG3 LYS A 30 134.018 -8.135 8.614 1.00 0.00 H new ATOM 0 HD2 LYS A 30 132.810 -9.953 7.299 1.00 0.00 H new ATOM 0 HD3 LYS A 30 133.028 -8.994 5.848 1.00 0.00 H new ATOM 0 HE2 LYS A 30 135.412 -9.210 5.908 1.00 0.00 H new ATOM 0 HE3 LYS A 30 135.423 -9.661 7.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 135.743 -11.635 6.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 134.153 -11.709 6.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 134.437 -11.294 5.314 1.00 0.00 H new ATOM 463 N LYS A 31 130.090 -5.641 9.947 1.00 0.00 N ATOM 464 CA LYS A 31 128.747 -5.102 10.128 1.00 0.00 C ATOM 465 C LYS A 31 128.749 -3.587 9.956 1.00 0.00 C ATOM 466 O LYS A 31 128.064 -3.051 9.085 1.00 0.00 O ATOM 467 CB LYS A 31 128.224 -5.459 11.521 1.00 0.00 C ATOM 468 CG LYS A 31 127.894 -6.952 11.577 1.00 0.00 C ATOM 469 CD LYS A 31 127.261 -7.285 12.930 1.00 0.00 C ATOM 470 CE LYS A 31 126.859 -8.761 12.957 1.00 0.00 C ATOM 471 NZ LYS A 31 126.808 -9.236 14.368 1.00 0.00 N ATOM 0 H LYS A 31 130.483 -6.094 10.772 1.00 0.00 H new ATOM 0 HA LYS A 31 128.096 -5.541 9.372 1.00 0.00 H new ATOM 0 HB2 LYS A 31 128.971 -5.213 12.275 1.00 0.00 H new ATOM 0 HB3 LYS A 31 127.335 -4.871 11.749 1.00 0.00 H new ATOM 0 HG2 LYS A 31 127.211 -7.215 10.769 1.00 0.00 H new ATOM 0 HG3 LYS A 31 128.800 -7.541 11.433 1.00 0.00 H new ATOM 0 HD2 LYS A 31 127.966 -7.074 13.735 1.00 0.00 H new ATOM 0 HD3 LYS A 31 126.387 -6.656 13.099 1.00 0.00 H new ATOM 0 HE2 LYS A 31 125.887 -8.893 12.482 1.00 0.00 H new ATOM 0 HE3 LYS A 31 127.575 -9.354 12.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 126.535 -10.239 14.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 127.745 -9.124 14.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 126.109 -8.677 14.897 1.00 0.00 H new ATOM 485 N GLN A 32 129.525 -2.902 10.791 1.00 0.00 N ATOM 486 CA GLN A 32 129.610 -1.448 10.721 1.00 0.00 C ATOM 487 C GLN A 32 130.217 -1.011 9.392 1.00 0.00 C ATOM 488 O GLN A 32 129.882 0.050 8.863 1.00 0.00 O ATOM 489 CB GLN A 32 130.465 -0.919 11.874 1.00 0.00 C ATOM 490 CG GLN A 32 129.783 -1.240 13.206 1.00 0.00 C ATOM 491 CD GLN A 32 128.466 -0.480 13.314 1.00 0.00 C ATOM 492 OE1 GLN A 32 127.422 -1.072 13.826 1.00 0.00 O flip ATOM 493 NE2 GLN A 32 128.386 0.685 12.923 1.00 0.00 N flip ATOM 0 H GLN A 32 130.100 -3.327 11.519 1.00 0.00 H new ATOM 0 HA GLN A 32 128.603 -1.039 10.799 1.00 0.00 H new ATOM 0 HB2 GLN A 32 131.456 -1.371 11.843 1.00 0.00 H new ATOM 0 HB3 GLN A 32 130.603 0.158 11.774 1.00 0.00 H new ATOM 0 HG2 GLN A 32 129.601 -2.312 13.282 1.00 0.00 H new ATOM 0 HG3 GLN A 32 130.438 -0.969 14.034 1.00 0.00 H new ATOM 0 HE21 GLN A 32 129.203 1.146 12.523 1.00 0.00 H new ATOM 0 HE22 GLN A 32 127.502 1.189 12.999 1.00 0.00 H new ATOM 502 N LEU A 33 131.113 -1.835 8.858 1.00 0.00 N ATOM 503 CA LEU A 33 131.765 -1.527 7.590 1.00 0.00 C ATOM 504 C LEU A 33 130.734 -1.119 6.541 1.00 0.00 C ATOM 505 O LEU A 33 130.923 -0.141 5.819 1.00 0.00 O ATOM 506 CB LEU A 33 132.545 -2.748 7.097 1.00 0.00 C ATOM 507 CG LEU A 33 133.319 -2.391 5.826 1.00 0.00 C ATOM 508 CD1 LEU A 33 134.400 -1.354 6.151 1.00 0.00 C ATOM 509 CD2 LEU A 33 133.978 -3.655 5.263 1.00 0.00 C ATOM 0 H LEU A 33 131.403 -2.717 9.281 1.00 0.00 H new ATOM 0 HA LEU A 33 132.452 -0.695 7.747 1.00 0.00 H new ATOM 0 HB2 LEU A 33 133.234 -3.087 7.870 1.00 0.00 H new ATOM 0 HB3 LEU A 33 131.860 -3.572 6.897 1.00 0.00 H new ATOM 0 HG LEU A 33 132.632 -1.975 5.089 1.00 0.00 H new ATOM 0 HD11 LEU A 33 134.948 -1.103 5.243 1.00 0.00 H new ATOM 0 HD12 LEU A 33 133.933 -0.455 6.553 1.00 0.00 H new ATOM 0 HD13 LEU A 33 135.089 -1.765 6.889 1.00 0.00 H new ATOM 0 HD21 LEU A 33 134.530 -3.405 4.357 1.00 0.00 H new ATOM 0 HD22 LEU A 33 134.663 -4.069 6.003 1.00 0.00 H new ATOM 0 HD23 LEU A 33 133.210 -4.392 5.028 1.00 0.00 H new ATOM 521 N LYS A 34 129.644 -1.874 6.465 1.00 0.00 N ATOM 522 CA LYS A 34 128.590 -1.583 5.500 1.00 0.00 C ATOM 523 C LYS A 34 127.848 -0.306 5.882 1.00 0.00 C ATOM 524 O LYS A 34 127.267 0.364 5.029 1.00 0.00 O ATOM 525 CB LYS A 34 127.603 -2.750 5.439 1.00 0.00 C ATOM 526 CG LYS A 34 126.629 -2.536 4.278 1.00 0.00 C ATOM 527 CD LYS A 34 125.574 -3.645 4.286 1.00 0.00 C ATOM 528 CE LYS A 34 124.777 -3.600 2.981 1.00 0.00 C ATOM 529 NZ LYS A 34 124.001 -4.864 2.830 1.00 0.00 N ATOM 0 H LYS A 34 129.467 -2.687 7.055 1.00 0.00 H new ATOM 0 HA LYS A 34 129.049 -1.442 4.521 1.00 0.00 H new ATOM 0 HB2 LYS A 34 128.141 -3.689 5.308 1.00 0.00 H new ATOM 0 HB3 LYS A 34 127.055 -2.826 6.378 1.00 0.00 H new ATOM 0 HG2 LYS A 34 126.149 -1.562 4.367 1.00 0.00 H new ATOM 0 HG3 LYS A 34 127.169 -2.540 3.331 1.00 0.00 H new ATOM 0 HD2 LYS A 34 126.054 -4.617 4.398 1.00 0.00 H new ATOM 0 HD3 LYS A 34 124.905 -3.519 5.138 1.00 0.00 H new ATOM 0 HE2 LYS A 34 124.102 -2.744 2.984 1.00 0.00 H new ATOM 0 HE3 LYS A 34 125.451 -3.471 2.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 123.459 -4.835 1.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 124.655 -5.672 2.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 123.347 -4.968 3.632 1.00 0.00 H new ATOM 543 N GLU A 35 127.866 0.022 7.170 1.00 0.00 N ATOM 544 CA GLU A 35 127.185 1.218 7.654 1.00 0.00 C ATOM 545 C GLU A 35 128.032 2.466 7.416 1.00 0.00 C ATOM 546 O GLU A 35 127.590 3.411 6.764 1.00 0.00 O ATOM 547 CB GLU A 35 126.888 1.079 9.149 1.00 0.00 C ATOM 548 CG GLU A 35 126.051 2.271 9.617 1.00 0.00 C ATOM 549 CD GLU A 35 125.784 2.165 11.113 1.00 0.00 C ATOM 550 OE1 GLU A 35 126.387 1.312 11.744 1.00 0.00 O ATOM 551 OE2 GLU A 35 124.980 2.938 11.609 1.00 0.00 O ATOM 0 H GLU A 35 128.341 -0.519 7.893 1.00 0.00 H new ATOM 0 HA GLU A 35 126.251 1.323 7.102 1.00 0.00 H new ATOM 0 HB2 GLU A 35 126.353 0.149 9.339 1.00 0.00 H new ATOM 0 HB3 GLU A 35 127.820 1.032 9.713 1.00 0.00 H new ATOM 0 HG2 GLU A 35 126.574 3.202 9.398 1.00 0.00 H new ATOM 0 HG3 GLU A 35 125.107 2.300 9.072 1.00 0.00 H new ATOM 558 N LEU A 36 129.248 2.467 7.956 1.00 0.00 N ATOM 559 CA LEU A 36 130.139 3.612 7.800 1.00 0.00 C ATOM 560 C LEU A 36 130.477 3.848 6.331 1.00 0.00 C ATOM 561 O LEU A 36 130.699 4.984 5.913 1.00 0.00 O ATOM 562 CB LEU A 36 131.427 3.389 8.603 1.00 0.00 C ATOM 563 CG LEU A 36 132.197 2.170 8.051 1.00 0.00 C ATOM 564 CD1 LEU A 36 133.311 2.636 7.103 1.00 0.00 C ATOM 565 CD2 LEU A 36 132.823 1.388 9.212 1.00 0.00 C ATOM 0 H LEU A 36 129.636 1.696 8.500 1.00 0.00 H new ATOM 0 HA LEU A 36 129.626 4.496 8.179 1.00 0.00 H new ATOM 0 HB2 LEU A 36 132.055 4.279 8.551 1.00 0.00 H new ATOM 0 HB3 LEU A 36 131.186 3.230 9.654 1.00 0.00 H new ATOM 0 HG LEU A 36 131.501 1.531 7.507 1.00 0.00 H new ATOM 0 HD11 LEU A 36 133.848 1.769 6.719 1.00 0.00 H new ATOM 0 HD12 LEU A 36 132.874 3.189 6.272 1.00 0.00 H new ATOM 0 HD13 LEU A 36 134.003 3.281 7.644 1.00 0.00 H new ATOM 0 HD21 LEU A 36 133.366 0.528 8.820 1.00 0.00 H new ATOM 0 HD22 LEU A 36 133.511 2.034 9.757 1.00 0.00 H new ATOM 0 HD23 LEU A 36 132.037 1.045 9.885 1.00 0.00 H new ATOM 577 N LEU A 37 130.517 2.772 5.550 1.00 0.00 N ATOM 578 CA LEU A 37 130.831 2.888 4.129 1.00 0.00 C ATOM 579 C LEU A 37 129.921 3.920 3.465 1.00 0.00 C ATOM 580 O LEU A 37 130.389 4.797 2.741 1.00 0.00 O ATOM 581 CB LEU A 37 130.667 1.524 3.440 1.00 0.00 C ATOM 582 CG LEU A 37 132.014 0.789 3.391 1.00 0.00 C ATOM 583 CD1 LEU A 37 131.785 -0.655 2.935 1.00 0.00 C ATOM 584 CD2 LEU A 37 132.965 1.494 2.407 1.00 0.00 C ATOM 0 H LEU A 37 130.338 1.821 5.872 1.00 0.00 H new ATOM 0 HA LEU A 37 131.865 3.217 4.027 1.00 0.00 H new ATOM 0 HB2 LEU A 37 129.935 0.922 3.979 1.00 0.00 H new ATOM 0 HB3 LEU A 37 130.283 1.663 2.429 1.00 0.00 H new ATOM 0 HG LEU A 37 132.463 0.796 4.384 1.00 0.00 H new ATOM 0 HD11 LEU A 37 132.739 -1.181 2.899 1.00 0.00 H new ATOM 0 HD12 LEU A 37 131.120 -1.157 3.638 1.00 0.00 H new ATOM 0 HD13 LEU A 37 131.332 -0.656 1.943 1.00 0.00 H new ATOM 0 HD21 LEU A 37 133.918 0.965 2.379 1.00 0.00 H new ATOM 0 HD22 LEU A 37 132.522 1.496 1.411 1.00 0.00 H new ATOM 0 HD23 LEU A 37 133.130 2.521 2.733 1.00 0.00 H new ATOM 596 N GLN A 38 128.620 3.805 3.714 1.00 0.00 N ATOM 597 CA GLN A 38 127.657 4.732 3.130 1.00 0.00 C ATOM 598 C GLN A 38 127.737 6.097 3.807 1.00 0.00 C ATOM 599 O GLN A 38 127.836 7.126 3.139 1.00 0.00 O ATOM 600 CB GLN A 38 126.241 4.173 3.276 1.00 0.00 C ATOM 601 CG GLN A 38 126.236 2.689 2.902 1.00 0.00 C ATOM 602 CD GLN A 38 126.878 2.495 1.532 1.00 0.00 C ATOM 603 OE1 GLN A 38 128.178 2.491 1.427 1.00 0.00 O flip ATOM 604 NE2 GLN A 38 126.177 2.344 0.532 1.00 0.00 N flip ATOM 0 H GLN A 38 128.211 3.086 4.311 1.00 0.00 H new ATOM 0 HA GLN A 38 127.897 4.852 2.073 1.00 0.00 H new ATOM 0 HB2 GLN A 38 125.892 4.302 4.300 1.00 0.00 H new ATOM 0 HB3 GLN A 38 125.554 4.723 2.633 1.00 0.00 H new ATOM 0 HG2 GLN A 38 126.779 2.114 3.652 1.00 0.00 H new ATOM 0 HG3 GLN A 38 125.213 2.312 2.890 1.00 0.00 H new ATOM 0 HE21 GLN A 38 125.161 2.347 0.616 1.00 0.00 H new ATOM 0 HE22 GLN A 38 126.612 2.215 -0.381 1.00 0.00 H new ATOM 613 N THR A 39 127.692 6.099 5.134 1.00 0.00 N ATOM 614 CA THR A 39 127.756 7.345 5.890 1.00 0.00 C ATOM 615 C THR A 39 129.012 8.134 5.525 1.00 0.00 C ATOM 616 O THR A 39 128.969 9.355 5.382 1.00 0.00 O ATOM 617 CB THR A 39 127.757 7.048 7.391 1.00 0.00 C ATOM 618 OG1 THR A 39 126.695 6.155 7.695 1.00 0.00 O ATOM 619 CG2 THR A 39 127.572 8.350 8.172 1.00 0.00 C ATOM 0 H THR A 39 127.612 5.258 5.706 1.00 0.00 H new ATOM 0 HA THR A 39 126.880 7.943 5.638 1.00 0.00 H new ATOM 0 HB THR A 39 128.707 6.593 7.671 1.00 0.00 H new ATOM 0 HG1 THR A 39 126.990 5.233 7.544 1.00 0.00 H new ATOM 0 HG21 THR A 39 127.573 8.136 9.241 1.00 0.00 H new ATOM 0 HG22 THR A 39 128.388 9.034 7.938 1.00 0.00 H new ATOM 0 HG23 THR A 39 126.623 8.809 7.895 1.00 0.00 H new ATOM 627 N GLU A 40 130.127 7.427 5.382 1.00 0.00 N ATOM 628 CA GLU A 40 131.389 8.074 5.036 1.00 0.00 C ATOM 629 C GLU A 40 131.445 8.381 3.544 1.00 0.00 C ATOM 630 O GLU A 40 132.337 9.093 3.082 1.00 0.00 O ATOM 631 CB GLU A 40 132.561 7.167 5.417 1.00 0.00 C ATOM 632 CG GLU A 40 132.636 7.036 6.940 1.00 0.00 C ATOM 633 CD GLU A 40 132.952 8.390 7.565 1.00 0.00 C ATOM 634 OE1 GLU A 40 133.390 9.267 6.840 1.00 0.00 O ATOM 635 OE2 GLU A 40 132.750 8.530 8.761 1.00 0.00 O ATOM 0 H GLU A 40 130.185 6.415 5.499 1.00 0.00 H new ATOM 0 HA GLU A 40 131.458 9.011 5.589 1.00 0.00 H new ATOM 0 HB2 GLU A 40 132.435 6.184 4.963 1.00 0.00 H new ATOM 0 HB3 GLU A 40 133.493 7.579 5.031 1.00 0.00 H new ATOM 0 HG2 GLU A 40 131.690 6.659 7.328 1.00 0.00 H new ATOM 0 HG3 GLU A 40 133.403 6.312 7.214 1.00 0.00 H new ATOM 642 N LEU A 41 130.489 7.839 2.793 1.00 0.00 N ATOM 643 CA LEU A 41 130.440 8.060 1.349 1.00 0.00 C ATOM 644 C LEU A 41 129.050 8.523 0.922 1.00 0.00 C ATOM 645 O LEU A 41 128.808 9.719 0.759 1.00 0.00 O ATOM 646 CB LEU A 41 130.796 6.765 0.616 1.00 0.00 C ATOM 647 CG LEU A 41 132.164 6.269 1.090 1.00 0.00 C ATOM 648 CD1 LEU A 41 132.427 4.873 0.526 1.00 0.00 C ATOM 649 CD2 LEU A 41 133.254 7.228 0.605 1.00 0.00 C ATOM 0 H LEU A 41 129.742 7.247 3.157 1.00 0.00 H new ATOM 0 HA LEU A 41 131.161 8.836 1.093 1.00 0.00 H new ATOM 0 HB2 LEU A 41 130.037 6.007 0.806 1.00 0.00 H new ATOM 0 HB3 LEU A 41 130.813 6.937 -0.460 1.00 0.00 H new ATOM 0 HG LEU A 41 132.175 6.228 2.179 1.00 0.00 H new ATOM 0 HD11 LEU A 41 133.402 4.521 0.865 1.00 0.00 H new ATOM 0 HD12 LEU A 41 131.653 4.188 0.874 1.00 0.00 H new ATOM 0 HD13 LEU A 41 132.414 4.912 -0.563 1.00 0.00 H new ATOM 0 HD21 LEU A 41 134.228 6.873 0.943 1.00 0.00 H new ATOM 0 HD22 LEU A 41 133.242 7.271 -0.484 1.00 0.00 H new ATOM 0 HD23 LEU A 41 133.070 8.223 1.010 1.00 0.00 H new ATOM 661 N SER A 42 128.143 7.568 0.739 1.00 0.00 N ATOM 662 CA SER A 42 126.781 7.891 0.328 1.00 0.00 C ATOM 663 C SER A 42 126.788 8.680 -0.977 1.00 0.00 C ATOM 664 O SER A 42 126.143 9.723 -1.086 1.00 0.00 O ATOM 665 CB SER A 42 126.086 8.708 1.417 1.00 0.00 C ATOM 666 OG SER A 42 124.849 9.199 0.917 1.00 0.00 O ATOM 0 H SER A 42 128.324 6.572 0.867 1.00 0.00 H new ATOM 0 HA SER A 42 126.238 6.959 0.173 1.00 0.00 H new ATOM 0 HB2 SER A 42 125.916 8.090 2.299 1.00 0.00 H new ATOM 0 HB3 SER A 42 126.721 9.538 1.727 1.00 0.00 H new ATOM 0 HG SER A 42 125.019 9.840 0.195 1.00 0.00 H new ATOM 672 N GLY A 43 127.522 8.177 -1.965 1.00 0.00 N ATOM 673 CA GLY A 43 127.603 8.845 -3.258 1.00 0.00 C ATOM 674 C GLY A 43 128.066 7.880 -4.344 1.00 0.00 C ATOM 675 O GLY A 43 127.478 7.818 -5.424 1.00 0.00 O ATOM 0 H GLY A 43 128.065 7.316 -1.896 1.00 0.00 H new ATOM 0 HA2 GLY A 43 126.628 9.254 -3.522 1.00 0.00 H new ATOM 0 HA3 GLY A 43 128.294 9.685 -3.194 1.00 0.00 H new ATOM 679 N PHE A 44 129.123 7.130 -4.052 1.00 0.00 N ATOM 680 CA PHE A 44 129.657 6.172 -5.014 1.00 0.00 C ATOM 681 C PHE A 44 128.594 5.150 -5.405 1.00 0.00 C ATOM 682 O PHE A 44 128.639 4.581 -6.496 1.00 0.00 O ATOM 683 CB PHE A 44 130.865 5.446 -4.415 1.00 0.00 C ATOM 684 CG PHE A 44 132.067 6.362 -4.429 1.00 0.00 C ATOM 685 CD1 PHE A 44 132.595 6.807 -5.647 1.00 0.00 C ATOM 686 CD2 PHE A 44 132.653 6.764 -3.223 1.00 0.00 C ATOM 687 CE1 PHE A 44 133.710 7.655 -5.657 1.00 0.00 C ATOM 688 CE2 PHE A 44 133.767 7.611 -3.234 1.00 0.00 C ATOM 689 CZ PHE A 44 134.296 8.057 -4.451 1.00 0.00 C ATOM 0 H PHE A 44 129.624 7.166 -3.164 1.00 0.00 H new ATOM 0 HA PHE A 44 129.964 6.719 -5.905 1.00 0.00 H new ATOM 0 HB2 PHE A 44 130.645 5.134 -3.394 1.00 0.00 H new ATOM 0 HB3 PHE A 44 131.078 4.542 -4.985 1.00 0.00 H new ATOM 0 HD1 PHE A 44 132.143 6.497 -6.578 1.00 0.00 H new ATOM 0 HD2 PHE A 44 132.245 6.420 -2.284 1.00 0.00 H new ATOM 0 HE1 PHE A 44 134.118 7.999 -6.596 1.00 0.00 H new ATOM 0 HE2 PHE A 44 134.219 7.921 -2.303 1.00 0.00 H new ATOM 0 HZ PHE A 44 135.156 8.711 -4.459 1.00 0.00 H new ATOM 699 N LEU A 45 127.638 4.920 -4.510 1.00 0.00 N ATOM 700 CA LEU A 45 126.571 3.961 -4.776 1.00 0.00 C ATOM 701 C LEU A 45 125.511 4.574 -5.689 1.00 0.00 C ATOM 702 O LEU A 45 124.650 3.870 -6.215 1.00 0.00 O ATOM 703 CB LEU A 45 125.926 3.513 -3.459 1.00 0.00 C ATOM 704 CG LEU A 45 126.003 4.650 -2.432 1.00 0.00 C ATOM 705 CD1 LEU A 45 124.837 4.533 -1.447 1.00 0.00 C ATOM 706 CD2 LEU A 45 127.327 4.561 -1.664 1.00 0.00 C ATOM 0 H LEU A 45 127.580 5.380 -3.602 1.00 0.00 H new ATOM 0 HA LEU A 45 127.004 3.095 -5.277 1.00 0.00 H new ATOM 0 HB2 LEU A 45 124.886 3.233 -3.629 1.00 0.00 H new ATOM 0 HB3 LEU A 45 126.435 2.629 -3.076 1.00 0.00 H new ATOM 0 HG LEU A 45 125.947 5.607 -2.951 1.00 0.00 H new ATOM 0 HD11 LEU A 45 124.894 5.342 -0.718 1.00 0.00 H new ATOM 0 HD12 LEU A 45 123.894 4.599 -1.990 1.00 0.00 H new ATOM 0 HD13 LEU A 45 124.892 3.575 -0.930 1.00 0.00 H new ATOM 0 HD21 LEU A 45 127.380 5.370 -0.935 1.00 0.00 H new ATOM 0 HD22 LEU A 45 127.385 3.603 -1.148 1.00 0.00 H new ATOM 0 HD23 LEU A 45 128.159 4.647 -2.362 1.00 0.00 H new ATOM 718 N ASP A 46 125.581 5.889 -5.872 1.00 0.00 N ATOM 719 CA ASP A 46 124.621 6.583 -6.723 1.00 0.00 C ATOM 720 C ASP A 46 125.090 6.585 -8.174 1.00 0.00 C ATOM 721 O ASP A 46 124.489 7.236 -9.029 1.00 0.00 O ATOM 722 CB ASP A 46 124.441 8.023 -6.240 1.00 0.00 C ATOM 723 CG ASP A 46 123.300 8.689 -7.001 1.00 0.00 C ATOM 724 OD1 ASP A 46 122.645 8.002 -7.769 1.00 0.00 O ATOM 725 OD2 ASP A 46 123.097 9.876 -6.807 1.00 0.00 O ATOM 0 H ASP A 46 126.286 6.491 -5.447 1.00 0.00 H new ATOM 0 HA ASP A 46 123.668 6.058 -6.664 1.00 0.00 H new ATOM 0 HB2 ASP A 46 124.231 8.033 -5.171 1.00 0.00 H new ATOM 0 HB3 ASP A 46 125.364 8.583 -6.389 1.00 0.00 H new ATOM 730 N ALA A 47 126.165 5.852 -8.445 1.00 0.00 N ATOM 731 CA ALA A 47 126.705 5.778 -9.799 1.00 0.00 C ATOM 732 C ALA A 47 127.483 4.481 -9.993 1.00 0.00 C ATOM 733 O ALA A 47 128.694 4.500 -10.217 1.00 0.00 O ATOM 734 CB ALA A 47 127.624 6.971 -10.061 1.00 0.00 C ATOM 0 H ALA A 47 126.676 5.305 -7.752 1.00 0.00 H new ATOM 0 HA ALA A 47 125.874 5.800 -10.504 1.00 0.00 H new ATOM 0 HB1 ALA A 47 128.023 6.908 -11.074 1.00 0.00 H new ATOM 0 HB2 ALA A 47 127.059 7.897 -9.950 1.00 0.00 H new ATOM 0 HB3 ALA A 47 128.447 6.960 -9.346 1.00 0.00 H new ATOM 740 N GLN A 48 126.781 3.356 -9.904 1.00 0.00 N ATOM 741 CA GLN A 48 127.416 2.054 -10.071 1.00 0.00 C ATOM 742 C GLN A 48 127.282 1.570 -11.511 1.00 0.00 C ATOM 743 O GLN A 48 126.182 1.271 -11.976 1.00 0.00 O ATOM 744 CB GLN A 48 126.775 1.037 -9.126 1.00 0.00 C ATOM 745 CG GLN A 48 127.229 1.318 -7.693 1.00 0.00 C ATOM 746 CD GLN A 48 126.591 0.313 -6.737 1.00 0.00 C ATOM 747 OE1 GLN A 48 125.456 -0.112 -6.948 1.00 0.00 O ATOM 748 NE2 GLN A 48 127.260 -0.091 -5.692 1.00 0.00 N ATOM 0 H GLN A 48 125.779 3.319 -9.718 1.00 0.00 H new ATOM 0 HA GLN A 48 128.475 2.155 -9.833 1.00 0.00 H new ATOM 0 HB2 GLN A 48 125.689 1.096 -9.193 1.00 0.00 H new ATOM 0 HB3 GLN A 48 127.058 0.025 -9.417 1.00 0.00 H new ATOM 0 HG2 GLN A 48 128.315 1.255 -7.628 1.00 0.00 H new ATOM 0 HG3 GLN A 48 126.951 2.332 -7.407 1.00 0.00 H new ATOM 0 HE21 GLN A 48 128.201 0.264 -5.520 1.00 0.00 H new ATOM 0 HE22 GLN A 48 126.842 -0.761 -5.047 1.00 0.00 H new ATOM 757 N LYS A 49 128.409 1.493 -12.211 1.00 0.00 N ATOM 758 CA LYS A 49 128.408 1.042 -13.598 1.00 0.00 C ATOM 759 C LYS A 49 128.685 -0.456 -13.672 1.00 0.00 C ATOM 760 O LYS A 49 127.829 -1.237 -14.087 1.00 0.00 O ATOM 761 CB LYS A 49 129.472 1.799 -14.396 1.00 0.00 C ATOM 762 CG LYS A 49 129.031 3.252 -14.583 1.00 0.00 C ATOM 763 CD LYS A 49 130.019 3.971 -15.504 1.00 0.00 C ATOM 764 CE LYS A 49 129.550 5.409 -15.732 1.00 0.00 C ATOM 765 NZ LYS A 49 129.508 6.133 -14.431 1.00 0.00 N ATOM 0 H LYS A 49 129.329 1.735 -11.844 1.00 0.00 H new ATOM 0 HA LYS A 49 127.425 1.242 -14.025 1.00 0.00 H new ATOM 0 HB2 LYS A 49 130.428 1.762 -13.874 1.00 0.00 H new ATOM 0 HB3 LYS A 49 129.620 1.325 -15.366 1.00 0.00 H new ATOM 0 HG2 LYS A 49 128.029 3.287 -15.010 1.00 0.00 H new ATOM 0 HG3 LYS A 49 128.984 3.756 -13.618 1.00 0.00 H new ATOM 0 HD2 LYS A 49 131.015 3.968 -15.060 1.00 0.00 H new ATOM 0 HD3 LYS A 49 130.093 3.446 -16.456 1.00 0.00 H new ATOM 0 HE2 LYS A 49 130.225 5.917 -16.421 1.00 0.00 H new ATOM 0 HE3 LYS A 49 128.562 5.411 -16.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 129.491 7.158 -14.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 128.653 5.857 -13.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 130.350 5.890 -13.871 1.00 0.00 H new ATOM 779 N ASP A 50 129.887 -0.850 -13.264 1.00 0.00 N ATOM 780 CA ASP A 50 130.267 -2.258 -13.286 1.00 0.00 C ATOM 781 C ASP A 50 129.346 -3.074 -12.385 1.00 0.00 C ATOM 782 O ASP A 50 128.761 -2.546 -11.439 1.00 0.00 O ATOM 783 CB ASP A 50 131.715 -2.417 -12.817 1.00 0.00 C ATOM 784 CG ASP A 50 132.659 -1.728 -13.797 1.00 0.00 C ATOM 785 OD1 ASP A 50 132.202 -1.355 -14.864 1.00 0.00 O ATOM 786 OD2 ASP A 50 133.823 -1.585 -13.464 1.00 0.00 O ATOM 0 H ASP A 50 130.610 -0.220 -12.917 1.00 0.00 H new ATOM 0 HA ASP A 50 130.175 -2.624 -14.309 1.00 0.00 H new ATOM 0 HB2 ASP A 50 131.833 -1.987 -11.822 1.00 0.00 H new ATOM 0 HB3 ASP A 50 131.967 -3.475 -12.739 1.00 0.00 H new ATOM 791 N VAL A 51 129.220 -4.364 -12.684 1.00 0.00 N ATOM 792 CA VAL A 51 128.366 -5.249 -11.895 1.00 0.00 C ATOM 793 C VAL A 51 129.210 -6.271 -11.141 1.00 0.00 C ATOM 794 O VAL A 51 129.150 -6.357 -9.914 1.00 0.00 O ATOM 795 CB VAL A 51 127.379 -5.977 -12.819 1.00 0.00 C ATOM 796 CG1 VAL A 51 126.047 -6.196 -12.094 1.00 0.00 C ATOM 797 CG2 VAL A 51 127.143 -5.130 -14.069 1.00 0.00 C ATOM 0 H VAL A 51 129.696 -4.819 -13.463 1.00 0.00 H new ATOM 0 HA VAL A 51 127.813 -4.648 -11.173 1.00 0.00 H new ATOM 0 HB VAL A 51 127.795 -6.944 -13.100 1.00 0.00 H new ATOM 0 HG11 VAL A 51 125.353 -6.713 -12.757 1.00 0.00 H new ATOM 0 HG12 VAL A 51 126.213 -6.799 -11.201 1.00 0.00 H new ATOM 0 HG13 VAL A 51 125.626 -5.232 -11.808 1.00 0.00 H new ATOM 0 HG21 VAL A 51 126.443 -5.642 -14.729 1.00 0.00 H new ATOM 0 HG22 VAL A 51 126.729 -4.164 -13.781 1.00 0.00 H new ATOM 0 HG23 VAL A 51 128.088 -4.979 -14.590 1.00 0.00 H new ATOM 807 N ASP A 52 129.990 -7.046 -11.885 1.00 0.00 N ATOM 808 CA ASP A 52 130.839 -8.063 -11.280 1.00 0.00 C ATOM 809 C ASP A 52 131.666 -7.467 -10.144 1.00 0.00 C ATOM 810 O ASP A 52 131.736 -8.032 -9.052 1.00 0.00 O ATOM 811 CB ASP A 52 131.773 -8.660 -12.334 1.00 0.00 C ATOM 812 CG ASP A 52 132.501 -7.545 -13.077 1.00 0.00 C ATOM 813 OD1 ASP A 52 131.939 -6.467 -13.187 1.00 0.00 O ATOM 814 OD2 ASP A 52 133.610 -7.785 -13.526 1.00 0.00 O ATOM 0 H ASP A 52 130.052 -6.990 -12.902 1.00 0.00 H new ATOM 0 HA ASP A 52 130.199 -8.847 -10.875 1.00 0.00 H new ATOM 0 HB2 ASP A 52 132.495 -9.323 -11.858 1.00 0.00 H new ATOM 0 HB3 ASP A 52 131.201 -9.264 -13.038 1.00 0.00 H new ATOM 819 N ALA A 53 132.290 -6.324 -10.410 1.00 0.00 N ATOM 820 CA ALA A 53 133.110 -5.662 -9.403 1.00 0.00 C ATOM 821 C ALA A 53 132.246 -5.170 -8.247 1.00 0.00 C ATOM 822 O ALA A 53 132.636 -5.263 -7.083 1.00 0.00 O ATOM 823 CB ALA A 53 133.851 -4.478 -10.029 1.00 0.00 C ATOM 0 H ALA A 53 132.244 -5.840 -11.307 1.00 0.00 H new ATOM 0 HA ALA A 53 133.833 -6.382 -9.020 1.00 0.00 H new ATOM 0 HB1 ALA A 53 134.462 -3.989 -9.270 1.00 0.00 H new ATOM 0 HB2 ALA A 53 134.492 -4.835 -10.835 1.00 0.00 H new ATOM 0 HB3 ALA A 53 133.128 -3.766 -10.428 1.00 0.00 H new ATOM 829 N VAL A 54 131.069 -4.649 -8.575 1.00 0.00 N ATOM 830 CA VAL A 54 130.156 -4.146 -7.556 1.00 0.00 C ATOM 831 C VAL A 54 129.640 -5.290 -6.688 1.00 0.00 C ATOM 832 O VAL A 54 129.307 -5.093 -5.520 1.00 0.00 O ATOM 833 CB VAL A 54 128.977 -3.430 -8.216 1.00 0.00 C ATOM 834 CG1 VAL A 54 127.933 -3.080 -7.155 1.00 0.00 C ATOM 835 CG2 VAL A 54 129.473 -2.148 -8.886 1.00 0.00 C ATOM 0 H VAL A 54 130.726 -4.564 -9.532 1.00 0.00 H new ATOM 0 HA VAL A 54 130.698 -3.442 -6.925 1.00 0.00 H new ATOM 0 HB VAL A 54 128.528 -4.082 -8.965 1.00 0.00 H new ATOM 0 HG11 VAL A 54 127.093 -2.570 -7.626 1.00 0.00 H new ATOM 0 HG12 VAL A 54 127.581 -3.994 -6.676 1.00 0.00 H new ATOM 0 HG13 VAL A 54 128.380 -2.427 -6.406 1.00 0.00 H new ATOM 0 HG21 VAL A 54 128.634 -1.636 -9.357 1.00 0.00 H new ATOM 0 HG22 VAL A 54 129.922 -1.496 -8.137 1.00 0.00 H new ATOM 0 HG23 VAL A 54 130.217 -2.397 -9.642 1.00 0.00 H new ATOM 845 N ASP A 55 129.581 -6.485 -7.266 1.00 0.00 N ATOM 846 CA ASP A 55 129.107 -7.654 -6.535 1.00 0.00 C ATOM 847 C ASP A 55 130.236 -8.252 -5.703 1.00 0.00 C ATOM 848 O ASP A 55 129.994 -8.994 -4.751 1.00 0.00 O ATOM 849 CB ASP A 55 128.580 -8.704 -7.515 1.00 0.00 C ATOM 850 CG ASP A 55 127.886 -9.827 -6.750 1.00 0.00 C ATOM 851 OD1 ASP A 55 127.255 -9.532 -5.749 1.00 0.00 O ATOM 852 OD2 ASP A 55 127.996 -10.965 -7.177 1.00 0.00 O ATOM 0 H ASP A 55 129.853 -6.669 -8.232 1.00 0.00 H new ATOM 0 HA ASP A 55 128.301 -7.345 -5.869 1.00 0.00 H new ATOM 0 HB2 ASP A 55 127.882 -8.243 -8.214 1.00 0.00 H new ATOM 0 HB3 ASP A 55 129.402 -9.108 -8.105 1.00 0.00 H new ATOM 857 N LYS A 56 131.470 -7.925 -6.074 1.00 0.00 N ATOM 858 CA LYS A 56 132.633 -8.436 -5.359 1.00 0.00 C ATOM 859 C LYS A 56 132.564 -8.057 -3.881 1.00 0.00 C ATOM 860 O LYS A 56 132.655 -8.917 -3.006 1.00 0.00 O ATOM 861 CB LYS A 56 133.917 -7.870 -5.989 1.00 0.00 C ATOM 862 CG LYS A 56 135.019 -8.935 -5.980 1.00 0.00 C ATOM 863 CD LYS A 56 134.864 -9.836 -7.207 1.00 0.00 C ATOM 864 CE LYS A 56 135.943 -10.920 -7.185 1.00 0.00 C ATOM 865 NZ LYS A 56 135.553 -11.990 -6.224 1.00 0.00 N ATOM 0 H LYS A 56 131.689 -7.313 -6.860 1.00 0.00 H new ATOM 0 HA LYS A 56 132.642 -9.523 -5.435 1.00 0.00 H new ATOM 0 HB2 LYS A 56 133.719 -7.548 -7.012 1.00 0.00 H new ATOM 0 HB3 LYS A 56 134.246 -6.990 -5.436 1.00 0.00 H new ATOM 0 HG2 LYS A 56 136.000 -8.459 -5.986 1.00 0.00 H new ATOM 0 HG3 LYS A 56 134.958 -9.529 -5.068 1.00 0.00 H new ATOM 0 HD2 LYS A 56 133.875 -10.293 -7.213 1.00 0.00 H new ATOM 0 HD3 LYS A 56 134.947 -9.244 -8.119 1.00 0.00 H new ATOM 0 HE2 LYS A 56 136.071 -11.341 -8.182 1.00 0.00 H new ATOM 0 HE3 LYS A 56 136.901 -10.488 -6.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 136.386 -12.283 -5.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 134.822 -11.628 -5.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 135.179 -12.807 -6.747 1.00 0.00 H new ATOM 879 N VAL A 57 132.404 -6.766 -3.612 1.00 0.00 N ATOM 880 CA VAL A 57 132.324 -6.288 -2.236 1.00 0.00 C ATOM 881 C VAL A 57 131.104 -6.875 -1.535 1.00 0.00 C ATOM 882 O VAL A 57 131.163 -7.228 -0.357 1.00 0.00 O ATOM 883 CB VAL A 57 132.242 -4.761 -2.217 1.00 0.00 C ATOM 884 CG1 VAL A 57 130.934 -4.309 -2.868 1.00 0.00 C ATOM 885 CG2 VAL A 57 132.285 -4.268 -0.769 1.00 0.00 C ATOM 0 H VAL A 57 132.328 -6.037 -4.321 1.00 0.00 H new ATOM 0 HA VAL A 57 133.221 -6.609 -1.707 1.00 0.00 H new ATOM 0 HB VAL A 57 133.084 -4.346 -2.770 1.00 0.00 H new ATOM 0 HG11 VAL A 57 130.877 -3.221 -2.853 1.00 0.00 H new ATOM 0 HG12 VAL A 57 130.900 -4.660 -3.899 1.00 0.00 H new ATOM 0 HG13 VAL A 57 130.091 -4.724 -2.316 1.00 0.00 H new ATOM 0 HG21 VAL A 57 132.227 -3.180 -0.753 1.00 0.00 H new ATOM 0 HG22 VAL A 57 131.442 -4.685 -0.218 1.00 0.00 H new ATOM 0 HG23 VAL A 57 133.217 -4.588 -0.303 1.00 0.00 H new ATOM 895 N MET A 58 129.998 -6.976 -2.266 1.00 0.00 N ATOM 896 CA MET A 58 128.768 -7.521 -1.703 1.00 0.00 C ATOM 897 C MET A 58 128.958 -8.985 -1.316 1.00 0.00 C ATOM 898 O MET A 58 128.390 -9.454 -0.329 1.00 0.00 O ATOM 899 CB MET A 58 127.634 -7.405 -2.722 1.00 0.00 C ATOM 900 CG MET A 58 126.289 -7.561 -2.008 1.00 0.00 C ATOM 901 SD MET A 58 125.876 -6.018 -1.158 1.00 0.00 S ATOM 902 CE MET A 58 125.077 -5.195 -2.558 1.00 0.00 C ATOM 0 H MET A 58 129.928 -6.690 -3.243 1.00 0.00 H new ATOM 0 HA MET A 58 128.515 -6.951 -0.809 1.00 0.00 H new ATOM 0 HB2 MET A 58 127.681 -6.440 -3.226 1.00 0.00 H new ATOM 0 HB3 MET A 58 127.741 -8.171 -3.490 1.00 0.00 H new ATOM 0 HG2 MET A 58 125.510 -7.812 -2.728 1.00 0.00 H new ATOM 0 HG3 MET A 58 126.338 -8.381 -1.292 1.00 0.00 H new ATOM 0 HE1 MET A 58 125.167 -4.115 -2.445 1.00 0.00 H new ATOM 0 HE2 MET A 58 125.559 -5.504 -3.485 1.00 0.00 H new ATOM 0 HE3 MET A 58 124.023 -5.470 -2.588 1.00 0.00 H new ATOM 912 N LYS A 59 129.758 -9.702 -2.097 1.00 0.00 N ATOM 913 CA LYS A 59 130.014 -11.111 -1.826 1.00 0.00 C ATOM 914 C LYS A 59 130.617 -11.289 -0.436 1.00 0.00 C ATOM 915 O LYS A 59 130.235 -12.193 0.306 1.00 0.00 O ATOM 916 CB LYS A 59 130.967 -11.681 -2.880 1.00 0.00 C ATOM 917 CG LYS A 59 131.355 -13.115 -2.509 1.00 0.00 C ATOM 918 CD LYS A 59 130.092 -13.948 -2.282 1.00 0.00 C ATOM 919 CE LYS A 59 130.423 -15.432 -2.443 1.00 0.00 C ATOM 920 NZ LYS A 59 130.427 -15.786 -3.890 1.00 0.00 N ATOM 0 H LYS A 59 130.238 -9.333 -2.918 1.00 0.00 H new ATOM 0 HA LYS A 59 129.067 -11.648 -1.867 1.00 0.00 H new ATOM 0 HB2 LYS A 59 130.491 -11.666 -3.860 1.00 0.00 H new ATOM 0 HB3 LYS A 59 131.860 -11.060 -2.950 1.00 0.00 H new ATOM 0 HG2 LYS A 59 131.956 -13.557 -3.304 1.00 0.00 H new ATOM 0 HG3 LYS A 59 131.969 -13.115 -1.608 1.00 0.00 H new ATOM 0 HD2 LYS A 59 129.694 -13.760 -1.285 1.00 0.00 H new ATOM 0 HD3 LYS A 59 129.319 -13.658 -2.994 1.00 0.00 H new ATOM 0 HE2 LYS A 59 131.396 -15.648 -2.002 1.00 0.00 H new ATOM 0 HE3 LYS A 59 129.690 -16.039 -1.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 131.048 -16.606 -4.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 129.460 -16.022 -4.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 130.776 -14.978 -4.444 1.00 0.00 H new ATOM 934 N GLU A 60 131.562 -10.421 -0.089 1.00 0.00 N ATOM 935 CA GLU A 60 132.210 -10.494 1.214 1.00 0.00 C ATOM 936 C GLU A 60 131.176 -10.414 2.333 1.00 0.00 C ATOM 937 O GLU A 60 131.277 -11.119 3.336 1.00 0.00 O ATOM 938 CB GLU A 60 133.217 -9.352 1.363 1.00 0.00 C ATOM 939 CG GLU A 60 133.988 -9.517 2.675 1.00 0.00 C ATOM 940 CD GLU A 60 134.888 -8.307 2.906 1.00 0.00 C ATOM 941 OE1 GLU A 60 134.368 -7.204 2.941 1.00 0.00 O ATOM 942 OE2 GLU A 60 136.085 -8.502 3.046 1.00 0.00 O ATOM 0 H GLU A 60 131.894 -9.665 -0.687 1.00 0.00 H new ATOM 0 HA GLU A 60 132.732 -11.448 1.285 1.00 0.00 H new ATOM 0 HB2 GLU A 60 133.909 -9.351 0.520 1.00 0.00 H new ATOM 0 HB3 GLU A 60 132.699 -8.393 1.352 1.00 0.00 H new ATOM 0 HG2 GLU A 60 133.290 -9.626 3.505 1.00 0.00 H new ATOM 0 HG3 GLU A 60 134.588 -10.426 2.642 1.00 0.00 H new ATOM 949 N LEU A 61 130.183 -9.549 2.153 1.00 0.00 N ATOM 950 CA LEU A 61 129.136 -9.385 3.154 1.00 0.00 C ATOM 951 C LEU A 61 128.295 -10.654 3.264 1.00 0.00 C ATOM 952 O LEU A 61 127.959 -11.095 4.364 1.00 0.00 O ATOM 953 CB LEU A 61 128.236 -8.206 2.780 1.00 0.00 C ATOM 954 CG LEU A 61 129.102 -6.991 2.446 1.00 0.00 C ATOM 955 CD1 LEU A 61 128.210 -5.762 2.262 1.00 0.00 C ATOM 956 CD2 LEU A 61 130.088 -6.738 3.590 1.00 0.00 C ATOM 0 H LEU A 61 130.082 -8.955 1.330 1.00 0.00 H new ATOM 0 HA LEU A 61 129.608 -9.191 4.117 1.00 0.00 H new ATOM 0 HB2 LEU A 61 127.612 -8.468 1.925 1.00 0.00 H new ATOM 0 HB3 LEU A 61 127.564 -7.971 3.605 1.00 0.00 H new ATOM 0 HG LEU A 61 129.653 -7.181 1.525 1.00 0.00 H new ATOM 0 HD11 LEU A 61 128.828 -4.896 2.024 1.00 0.00 H new ATOM 0 HD12 LEU A 61 127.507 -5.941 1.448 1.00 0.00 H new ATOM 0 HD13 LEU A 61 127.658 -5.572 3.183 1.00 0.00 H new ATOM 0 HD21 LEU A 61 130.706 -5.872 3.353 1.00 0.00 H new ATOM 0 HD22 LEU A 61 129.536 -6.549 4.511 1.00 0.00 H new ATOM 0 HD23 LEU A 61 130.725 -7.613 3.722 1.00 0.00 H new ATOM 968 N ASP A 62 127.961 -11.236 2.117 1.00 0.00 N ATOM 969 CA ASP A 62 127.159 -12.455 2.095 1.00 0.00 C ATOM 970 C ASP A 62 127.960 -13.633 2.638 1.00 0.00 C ATOM 971 O ASP A 62 127.406 -14.539 3.262 1.00 0.00 O ATOM 972 CB ASP A 62 126.709 -12.756 0.665 1.00 0.00 C ATOM 973 CG ASP A 62 125.793 -11.646 0.161 1.00 0.00 C ATOM 974 OD1 ASP A 62 125.398 -10.819 0.968 1.00 0.00 O ATOM 975 OD2 ASP A 62 125.499 -11.639 -1.023 1.00 0.00 O ATOM 0 H ASP A 62 128.230 -10.887 1.197 1.00 0.00 H new ATOM 0 HA ASP A 62 126.284 -12.305 2.727 1.00 0.00 H new ATOM 0 HB2 ASP A 62 127.578 -12.846 0.013 1.00 0.00 H new ATOM 0 HB3 ASP A 62 126.187 -13.712 0.633 1.00 0.00 H new ATOM 980 N GLU A 63 129.267 -13.616 2.395 1.00 0.00 N ATOM 981 CA GLU A 63 130.137 -14.688 2.863 1.00 0.00 C ATOM 982 C GLU A 63 129.876 -14.988 4.336 1.00 0.00 C ATOM 983 O GLU A 63 129.979 -16.134 4.774 1.00 0.00 O ATOM 984 CB GLU A 63 131.602 -14.293 2.672 1.00 0.00 C ATOM 985 CG GLU A 63 132.499 -15.497 2.961 1.00 0.00 C ATOM 986 CD GLU A 63 133.964 -15.072 2.941 1.00 0.00 C ATOM 987 OE1 GLU A 63 134.213 -13.878 2.902 1.00 0.00 O ATOM 988 OE2 GLU A 63 134.814 -15.946 2.964 1.00 0.00 O ATOM 0 H GLU A 63 129.744 -12.876 1.880 1.00 0.00 H new ATOM 0 HA GLU A 63 129.923 -15.583 2.279 1.00 0.00 H new ATOM 0 HB2 GLU A 63 131.765 -13.942 1.653 1.00 0.00 H new ATOM 0 HB3 GLU A 63 131.857 -13.469 3.338 1.00 0.00 H new ATOM 0 HG2 GLU A 63 132.248 -15.923 3.933 1.00 0.00 H new ATOM 0 HG3 GLU A 63 132.327 -16.276 2.218 1.00 0.00 H new ATOM 995 N ASN A 64 129.539 -13.950 5.095 1.00 0.00 N ATOM 996 CA ASN A 64 129.267 -14.115 6.518 1.00 0.00 C ATOM 997 C ASN A 64 128.485 -12.922 7.058 1.00 0.00 C ATOM 998 O ASN A 64 127.356 -13.068 7.526 1.00 0.00 O ATOM 999 CB ASN A 64 130.582 -14.255 7.288 1.00 0.00 C ATOM 1000 CG ASN A 64 131.536 -13.131 6.899 1.00 0.00 C ATOM 1001 OD1 ASN A 64 131.695 -12.165 7.645 1.00 0.00 O ATOM 1002 ND2 ASN A 64 132.183 -13.198 5.768 1.00 0.00 N ATOM 0 H ASN A 64 129.448 -12.994 4.752 1.00 0.00 H new ATOM 0 HA ASN A 64 128.669 -15.017 6.651 1.00 0.00 H new ATOM 0 HB2 ASN A 64 130.390 -14.225 8.361 1.00 0.00 H new ATOM 0 HB3 ASN A 64 131.038 -15.221 7.073 1.00 0.00 H new ATOM 0 HD21 ASN A 64 132.822 -12.449 5.501 1.00 0.00 H new ATOM 0 HD22 ASN A 64 132.050 -13.999 5.151 1.00 0.00 H new ATOM 1009 N GLY A 65 129.092 -11.742 6.989 1.00 0.00 N ATOM 1010 CA GLY A 65 128.442 -10.530 7.474 1.00 0.00 C ATOM 1011 C GLY A 65 128.666 -10.358 8.972 1.00 0.00 C ATOM 1012 O GLY A 65 128.027 -9.523 9.613 1.00 0.00 O ATOM 0 H GLY A 65 130.026 -11.599 6.605 1.00 0.00 H new ATOM 0 HA2 GLY A 65 128.834 -9.664 6.941 1.00 0.00 H new ATOM 0 HA3 GLY A 65 127.373 -10.576 7.264 1.00 0.00 H new ATOM 1016 N ASP A 66 129.577 -11.153 9.524 1.00 0.00 N ATOM 1017 CA ASP A 66 129.878 -11.082 10.949 1.00 0.00 C ATOM 1018 C ASP A 66 131.357 -11.360 11.197 1.00 0.00 C ATOM 1019 O ASP A 66 131.760 -11.677 12.316 1.00 0.00 O ATOM 1020 CB ASP A 66 129.030 -12.102 11.713 1.00 0.00 C ATOM 1021 CG ASP A 66 129.254 -13.498 11.142 1.00 0.00 C ATOM 1022 OD1 ASP A 66 130.334 -13.740 10.628 1.00 0.00 O ATOM 1023 OD2 ASP A 66 128.342 -14.304 11.226 1.00 0.00 O ATOM 0 H ASP A 66 130.116 -11.850 9.010 1.00 0.00 H new ATOM 0 HA ASP A 66 129.644 -10.078 11.302 1.00 0.00 H new ATOM 0 HB2 ASP A 66 129.293 -12.086 12.771 1.00 0.00 H new ATOM 0 HB3 ASP A 66 127.975 -11.836 11.642 1.00 0.00 H new ATOM 1028 N GLY A 67 132.161 -11.238 10.146 1.00 0.00 N ATOM 1029 CA GLY A 67 133.596 -11.478 10.260 1.00 0.00 C ATOM 1030 C GLY A 67 134.327 -10.217 10.708 1.00 0.00 C ATOM 1031 O GLY A 67 133.720 -9.296 11.255 1.00 0.00 O ATOM 0 H GLY A 67 131.847 -10.976 9.212 1.00 0.00 H new ATOM 0 HA2 GLY A 67 133.778 -12.281 10.974 1.00 0.00 H new ATOM 0 HA3 GLY A 67 133.990 -11.809 9.299 1.00 0.00 H new ATOM 1035 N GLU A 68 135.636 -10.184 10.474 1.00 0.00 N ATOM 1036 CA GLU A 68 136.447 -9.031 10.857 1.00 0.00 C ATOM 1037 C GLU A 68 137.406 -8.656 9.731 1.00 0.00 C ATOM 1038 O GLU A 68 137.706 -9.472 8.860 1.00 0.00 O ATOM 1039 CB GLU A 68 137.244 -9.353 12.122 1.00 0.00 C ATOM 1040 CG GLU A 68 136.289 -9.817 13.223 1.00 0.00 C ATOM 1041 CD GLU A 68 137.053 -10.021 14.527 1.00 0.00 C ATOM 1042 OE1 GLU A 68 138.273 -10.032 14.480 1.00 0.00 O ATOM 1043 OE2 GLU A 68 136.409 -10.164 15.552 1.00 0.00 O ATOM 0 H GLU A 68 136.156 -10.937 10.024 1.00 0.00 H new ATOM 0 HA GLU A 68 135.783 -8.189 11.050 1.00 0.00 H new ATOM 0 HB2 GLU A 68 137.980 -10.130 11.913 1.00 0.00 H new ATOM 0 HB3 GLU A 68 137.795 -8.472 12.451 1.00 0.00 H new ATOM 0 HG2 GLU A 68 135.500 -9.078 13.366 1.00 0.00 H new ATOM 0 HG3 GLU A 68 135.805 -10.747 12.927 1.00 0.00 H new ATOM 1050 N VAL A 69 137.882 -7.414 9.755 1.00 0.00 N ATOM 1051 CA VAL A 69 138.807 -6.936 8.730 1.00 0.00 C ATOM 1052 C VAL A 69 139.933 -6.125 9.363 1.00 0.00 C ATOM 1053 O VAL A 69 139.733 -5.449 10.373 1.00 0.00 O ATOM 1054 CB VAL A 69 138.059 -6.071 7.716 1.00 0.00 C ATOM 1055 CG1 VAL A 69 139.005 -5.678 6.582 1.00 0.00 C ATOM 1056 CG2 VAL A 69 136.880 -6.863 7.145 1.00 0.00 C ATOM 0 H VAL A 69 137.645 -6.724 10.468 1.00 0.00 H new ATOM 0 HA VAL A 69 139.237 -7.799 8.222 1.00 0.00 H new ATOM 0 HB VAL A 69 137.690 -5.171 8.208 1.00 0.00 H new ATOM 0 HG11 VAL A 69 138.470 -5.061 5.860 1.00 0.00 H new ATOM 0 HG12 VAL A 69 139.846 -5.115 6.988 1.00 0.00 H new ATOM 0 HG13 VAL A 69 139.375 -6.577 6.089 1.00 0.00 H new ATOM 0 HG21 VAL A 69 136.345 -6.248 6.421 1.00 0.00 H new ATOM 0 HG22 VAL A 69 137.250 -7.763 6.653 1.00 0.00 H new ATOM 0 HG23 VAL A 69 136.204 -7.143 7.953 1.00 0.00 H new ATOM 1066 N ASP A 70 141.117 -6.195 8.764 1.00 0.00 N ATOM 1067 CA ASP A 70 142.269 -5.463 9.279 1.00 0.00 C ATOM 1068 C ASP A 70 142.341 -4.072 8.658 1.00 0.00 C ATOM 1069 O ASP A 70 141.339 -3.542 8.180 1.00 0.00 O ATOM 1070 CB ASP A 70 143.555 -6.230 8.971 1.00 0.00 C ATOM 1071 CG ASP A 70 143.401 -7.691 9.381 1.00 0.00 C ATOM 1072 OD1 ASP A 70 143.178 -7.936 10.555 1.00 0.00 O ATOM 1073 OD2 ASP A 70 143.510 -8.543 8.514 1.00 0.00 O ATOM 0 H ASP A 70 141.304 -6.747 7.927 1.00 0.00 H new ATOM 0 HA ASP A 70 142.158 -5.360 10.358 1.00 0.00 H new ATOM 0 HB2 ASP A 70 143.782 -6.164 7.907 1.00 0.00 H new ATOM 0 HB3 ASP A 70 144.393 -5.780 9.504 1.00 0.00 H new ATOM 1078 N PHE A 71 143.535 -3.486 8.670 1.00 0.00 N ATOM 1079 CA PHE A 71 143.726 -2.154 8.107 1.00 0.00 C ATOM 1080 C PHE A 71 144.029 -2.238 6.613 1.00 0.00 C ATOM 1081 O PHE A 71 143.335 -1.636 5.793 1.00 0.00 O ATOM 1082 CB PHE A 71 144.878 -1.447 8.822 1.00 0.00 C ATOM 1083 CG PHE A 71 145.086 -0.081 8.215 1.00 0.00 C ATOM 1084 CD1 PHE A 71 144.116 0.915 8.380 1.00 0.00 C ATOM 1085 CD2 PHE A 71 146.250 0.191 7.486 1.00 0.00 C ATOM 1086 CE1 PHE A 71 144.310 2.182 7.816 1.00 0.00 C ATOM 1087 CE2 PHE A 71 146.444 1.458 6.922 1.00 0.00 C ATOM 1088 CZ PHE A 71 145.473 2.453 7.087 1.00 0.00 C ATOM 0 H PHE A 71 144.378 -3.908 9.060 1.00 0.00 H new ATOM 0 HA PHE A 71 142.806 -1.587 8.247 1.00 0.00 H new ATOM 0 HB2 PHE A 71 144.657 -1.354 9.885 1.00 0.00 H new ATOM 0 HB3 PHE A 71 145.790 -2.037 8.736 1.00 0.00 H new ATOM 0 HD1 PHE A 71 143.218 0.706 8.942 1.00 0.00 H new ATOM 0 HD2 PHE A 71 146.999 -0.577 7.359 1.00 0.00 H new ATOM 0 HE1 PHE A 71 143.562 2.950 7.944 1.00 0.00 H new ATOM 0 HE2 PHE A 71 147.342 1.667 6.360 1.00 0.00 H new ATOM 0 HZ PHE A 71 145.622 3.430 6.651 1.00 0.00 H new ATOM 1098 N GLN A 72 145.070 -2.987 6.267 1.00 0.00 N ATOM 1099 CA GLN A 72 145.463 -3.143 4.870 1.00 0.00 C ATOM 1100 C GLN A 72 144.314 -3.717 4.046 1.00 0.00 C ATOM 1101 O GLN A 72 144.035 -3.248 2.943 1.00 0.00 O ATOM 1102 CB GLN A 72 146.677 -4.070 4.768 1.00 0.00 C ATOM 1103 CG GLN A 72 147.828 -3.496 5.597 1.00 0.00 C ATOM 1104 CD GLN A 72 149.061 -4.384 5.458 1.00 0.00 C ATOM 1105 OE1 GLN A 72 149.575 -4.893 6.455 1.00 0.00 O ATOM 1106 NE2 GLN A 72 149.569 -4.601 4.276 1.00 0.00 N ATOM 0 H GLN A 72 145.655 -3.494 6.931 1.00 0.00 H new ATOM 0 HA GLN A 72 145.721 -2.160 4.476 1.00 0.00 H new ATOM 0 HB2 GLN A 72 146.418 -5.066 5.126 1.00 0.00 H new ATOM 0 HB3 GLN A 72 146.982 -4.175 3.727 1.00 0.00 H new ATOM 0 HG2 GLN A 72 148.058 -2.484 5.264 1.00 0.00 H new ATOM 0 HG3 GLN A 72 147.535 -3.428 6.645 1.00 0.00 H new ATOM 0 HE21 GLN A 72 149.142 -4.178 3.452 1.00 0.00 H new ATOM 0 HE22 GLN A 72 150.393 -5.193 4.176 1.00 0.00 H new ATOM 1115 N GLU A 73 143.650 -4.733 4.588 1.00 0.00 N ATOM 1116 CA GLU A 73 142.534 -5.361 3.890 1.00 0.00 C ATOM 1117 C GLU A 73 141.329 -4.424 3.866 1.00 0.00 C ATOM 1118 O GLU A 73 140.493 -4.494 2.965 1.00 0.00 O ATOM 1119 CB GLU A 73 142.153 -6.670 4.584 1.00 0.00 C ATOM 1120 CG GLU A 73 143.182 -7.751 4.245 1.00 0.00 C ATOM 1121 CD GLU A 73 144.513 -7.438 4.921 1.00 0.00 C ATOM 1122 OE1 GLU A 73 144.530 -6.572 5.782 1.00 0.00 O ATOM 1123 OE2 GLU A 73 145.496 -8.070 4.571 1.00 0.00 O ATOM 0 H GLU A 73 143.863 -5.136 5.500 1.00 0.00 H new ATOM 0 HA GLU A 73 142.839 -5.572 2.865 1.00 0.00 H new ATOM 0 HB2 GLU A 73 142.109 -6.522 5.663 1.00 0.00 H new ATOM 0 HB3 GLU A 73 141.160 -6.987 4.265 1.00 0.00 H new ATOM 0 HG2 GLU A 73 142.819 -8.725 4.573 1.00 0.00 H new ATOM 0 HG3 GLU A 73 143.318 -7.808 3.165 1.00 0.00 H new ATOM 1130 N TYR A 74 141.249 -3.551 4.864 1.00 0.00 N ATOM 1131 CA TYR A 74 140.146 -2.601 4.955 1.00 0.00 C ATOM 1132 C TYR A 74 140.239 -1.567 3.831 1.00 0.00 C ATOM 1133 O TYR A 74 139.306 -1.408 3.044 1.00 0.00 O ATOM 1134 CB TYR A 74 140.178 -1.916 6.332 1.00 0.00 C ATOM 1135 CG TYR A 74 139.548 -0.543 6.266 1.00 0.00 C ATOM 1136 CD1 TYR A 74 138.171 -0.410 6.051 1.00 0.00 C ATOM 1137 CD2 TYR A 74 140.347 0.596 6.424 1.00 0.00 C ATOM 1138 CE1 TYR A 74 137.593 0.863 5.992 1.00 0.00 C ATOM 1139 CE2 TYR A 74 139.768 1.870 6.365 1.00 0.00 C ATOM 1140 CZ TYR A 74 138.391 2.003 6.150 1.00 0.00 C ATOM 1141 OH TYR A 74 137.820 3.258 6.094 1.00 0.00 O ATOM 0 H TYR A 74 141.932 -3.481 5.619 1.00 0.00 H new ATOM 0 HA TYR A 74 139.200 -3.131 4.844 1.00 0.00 H new ATOM 0 HB2 TYR A 74 139.647 -2.529 7.060 1.00 0.00 H new ATOM 0 HB3 TYR A 74 141.209 -1.832 6.677 1.00 0.00 H new ATOM 0 HD1 TYR A 74 137.555 -1.289 5.931 1.00 0.00 H new ATOM 0 HD2 TYR A 74 141.409 0.492 6.591 1.00 0.00 H new ATOM 0 HE1 TYR A 74 136.531 0.966 5.825 1.00 0.00 H new ATOM 0 HE2 TYR A 74 140.383 2.749 6.485 1.00 0.00 H new ATOM 0 HH TYR A 74 138.513 3.939 6.224 1.00 0.00 H new ATOM 1151 N VAL A 75 141.368 -0.869 3.764 1.00 0.00 N ATOM 1152 CA VAL A 75 141.565 0.143 2.733 1.00 0.00 C ATOM 1153 C VAL A 75 141.277 -0.436 1.351 1.00 0.00 C ATOM 1154 O VAL A 75 140.827 0.273 0.451 1.00 0.00 O ATOM 1155 CB VAL A 75 143.000 0.669 2.781 1.00 0.00 C ATOM 1156 CG1 VAL A 75 143.217 1.441 4.083 1.00 0.00 C ATOM 1157 CG2 VAL A 75 143.974 -0.508 2.721 1.00 0.00 C ATOM 0 H VAL A 75 142.153 -0.984 4.405 1.00 0.00 H new ATOM 0 HA VAL A 75 140.873 0.964 2.921 1.00 0.00 H new ATOM 0 HB VAL A 75 143.173 1.331 1.932 1.00 0.00 H new ATOM 0 HG11 VAL A 75 144.240 1.816 4.117 1.00 0.00 H new ATOM 0 HG12 VAL A 75 142.521 2.279 4.129 1.00 0.00 H new ATOM 0 HG13 VAL A 75 143.045 0.779 4.932 1.00 0.00 H new ATOM 0 HG21 VAL A 75 144.998 -0.135 2.755 1.00 0.00 H new ATOM 0 HG22 VAL A 75 143.800 -1.168 3.571 1.00 0.00 H new ATOM 0 HG23 VAL A 75 143.820 -1.061 1.794 1.00 0.00 H new ATOM 1167 N VAL A 76 141.535 -1.730 1.191 1.00 0.00 N ATOM 1168 CA VAL A 76 141.296 -2.394 -0.086 1.00 0.00 C ATOM 1169 C VAL A 76 139.809 -2.384 -0.420 1.00 0.00 C ATOM 1170 O VAL A 76 139.419 -2.126 -1.559 1.00 0.00 O ATOM 1171 CB VAL A 76 141.800 -3.838 -0.026 1.00 0.00 C ATOM 1172 CG1 VAL A 76 141.290 -4.611 -1.245 1.00 0.00 C ATOM 1173 CG2 VAL A 76 143.330 -3.842 -0.027 1.00 0.00 C ATOM 0 H VAL A 76 141.906 -2.336 1.923 1.00 0.00 H new ATOM 0 HA VAL A 76 141.836 -1.855 -0.864 1.00 0.00 H new ATOM 0 HB VAL A 76 141.433 -4.312 0.884 1.00 0.00 H new ATOM 0 HG11 VAL A 76 141.650 -5.639 -1.201 1.00 0.00 H new ATOM 0 HG12 VAL A 76 140.200 -4.608 -1.248 1.00 0.00 H new ATOM 0 HG13 VAL A 76 141.657 -4.137 -2.156 1.00 0.00 H new ATOM 0 HG21 VAL A 76 143.691 -4.870 0.016 1.00 0.00 H new ATOM 0 HG22 VAL A 76 143.694 -3.367 -0.938 1.00 0.00 H new ATOM 0 HG23 VAL A 76 143.696 -3.292 0.840 1.00 0.00 H new ATOM 1183 N LEU A 77 138.982 -2.666 0.580 1.00 0.00 N ATOM 1184 CA LEU A 77 137.538 -2.688 0.382 1.00 0.00 C ATOM 1185 C LEU A 77 137.023 -1.292 0.050 1.00 0.00 C ATOM 1186 O LEU A 77 136.154 -1.129 -0.806 1.00 0.00 O ATOM 1187 CB LEU A 77 136.847 -3.205 1.646 1.00 0.00 C ATOM 1188 CG LEU A 77 136.972 -4.730 1.713 1.00 0.00 C ATOM 1189 CD1 LEU A 77 136.907 -5.187 3.172 1.00 0.00 C ATOM 1190 CD2 LEU A 77 135.824 -5.373 0.927 1.00 0.00 C ATOM 0 H LEU A 77 139.284 -2.881 1.530 1.00 0.00 H new ATOM 0 HA LEU A 77 137.312 -3.353 -0.452 1.00 0.00 H new ATOM 0 HB2 LEU A 77 137.298 -2.754 2.530 1.00 0.00 H new ATOM 0 HB3 LEU A 77 135.796 -2.916 1.642 1.00 0.00 H new ATOM 0 HG LEU A 77 137.925 -5.033 1.280 1.00 0.00 H new ATOM 0 HD11 LEU A 77 136.996 -6.272 3.218 1.00 0.00 H new ATOM 0 HD12 LEU A 77 137.724 -4.732 3.733 1.00 0.00 H new ATOM 0 HD13 LEU A 77 135.955 -4.883 3.607 1.00 0.00 H new ATOM 0 HD21 LEU A 77 135.913 -6.458 0.975 1.00 0.00 H new ATOM 0 HD22 LEU A 77 134.871 -5.068 1.360 1.00 0.00 H new ATOM 0 HD23 LEU A 77 135.870 -5.051 -0.113 1.00 0.00 H new ATOM 1202 N VAL A 78 137.564 -0.288 0.732 1.00 0.00 N ATOM 1203 CA VAL A 78 137.151 1.091 0.500 1.00 0.00 C ATOM 1204 C VAL A 78 137.485 1.521 -0.925 1.00 0.00 C ATOM 1205 O VAL A 78 136.808 2.370 -1.503 1.00 0.00 O ATOM 1206 CB VAL A 78 137.853 2.020 1.491 1.00 0.00 C ATOM 1207 CG1 VAL A 78 137.574 3.475 1.112 1.00 0.00 C ATOM 1208 CG2 VAL A 78 137.326 1.752 2.902 1.00 0.00 C ATOM 0 H VAL A 78 138.284 -0.402 1.445 1.00 0.00 H new ATOM 0 HA VAL A 78 136.072 1.154 0.642 1.00 0.00 H new ATOM 0 HB VAL A 78 138.927 1.836 1.462 1.00 0.00 H new ATOM 0 HG11 VAL A 78 138.074 4.137 1.818 1.00 0.00 H new ATOM 0 HG12 VAL A 78 137.948 3.667 0.107 1.00 0.00 H new ATOM 0 HG13 VAL A 78 136.500 3.659 1.141 1.00 0.00 H new ATOM 0 HG21 VAL A 78 137.826 2.414 3.609 1.00 0.00 H new ATOM 0 HG22 VAL A 78 136.252 1.936 2.930 1.00 0.00 H new ATOM 0 HG23 VAL A 78 137.524 0.715 3.173 1.00 0.00 H new ATOM 1218 N ALA A 79 138.534 0.929 -1.485 1.00 0.00 N ATOM 1219 CA ALA A 79 138.950 1.256 -2.844 1.00 0.00 C ATOM 1220 C ALA A 79 138.181 0.418 -3.862 1.00 0.00 C ATOM 1221 O ALA A 79 138.120 0.762 -5.043 1.00 0.00 O ATOM 1222 CB ALA A 79 140.451 1.004 -3.005 1.00 0.00 C ATOM 0 H ALA A 79 139.109 0.225 -1.023 1.00 0.00 H new ATOM 0 HA ALA A 79 138.735 2.309 -3.023 1.00 0.00 H new ATOM 0 HB1 ALA A 79 140.754 1.250 -4.023 1.00 0.00 H new ATOM 0 HB2 ALA A 79 141.002 1.627 -2.301 1.00 0.00 H new ATOM 0 HB3 ALA A 79 140.667 -0.046 -2.806 1.00 0.00 H new ATOM 1228 N ALA A 80 137.607 -0.687 -3.401 1.00 0.00 N ATOM 1229 CA ALA A 80 136.856 -1.575 -4.283 1.00 0.00 C ATOM 1230 C ALA A 80 135.627 -0.875 -4.859 1.00 0.00 C ATOM 1231 O ALA A 80 135.532 -0.667 -6.069 1.00 0.00 O ATOM 1232 CB ALA A 80 136.419 -2.824 -3.515 1.00 0.00 C ATOM 0 H ALA A 80 137.646 -0.989 -2.428 1.00 0.00 H new ATOM 0 HA ALA A 80 137.508 -1.859 -5.109 1.00 0.00 H new ATOM 0 HB1 ALA A 80 135.859 -3.482 -4.179 1.00 0.00 H new ATOM 0 HB2 ALA A 80 137.299 -3.348 -3.142 1.00 0.00 H new ATOM 0 HB3 ALA A 80 135.787 -2.533 -2.676 1.00 0.00 H new ATOM 1238 N LEU A 81 134.684 -0.522 -3.991 1.00 0.00 N ATOM 1239 CA LEU A 81 133.464 0.144 -4.439 1.00 0.00 C ATOM 1240 C LEU A 81 133.787 1.472 -5.122 1.00 0.00 C ATOM 1241 O LEU A 81 132.972 2.006 -5.873 1.00 0.00 O ATOM 1242 CB LEU A 81 132.508 0.370 -3.255 1.00 0.00 C ATOM 1243 CG LEU A 81 132.996 1.520 -2.364 1.00 0.00 C ATOM 1244 CD1 LEU A 81 132.009 1.718 -1.211 1.00 0.00 C ATOM 1245 CD2 LEU A 81 134.372 1.181 -1.791 1.00 0.00 C ATOM 0 H LEU A 81 134.738 -0.683 -2.985 1.00 0.00 H new ATOM 0 HA LEU A 81 132.973 -0.503 -5.166 1.00 0.00 H new ATOM 0 HB2 LEU A 81 131.508 0.594 -3.628 1.00 0.00 H new ATOM 0 HB3 LEU A 81 132.431 -0.544 -2.666 1.00 0.00 H new ATOM 0 HG LEU A 81 133.064 2.432 -2.957 1.00 0.00 H new ATOM 0 HD11 LEU A 81 132.352 2.534 -0.575 1.00 0.00 H new ATOM 0 HD12 LEU A 81 131.025 1.959 -1.612 1.00 0.00 H new ATOM 0 HD13 LEU A 81 131.947 0.802 -0.624 1.00 0.00 H new ATOM 0 HD21 LEU A 81 134.715 2.000 -1.159 1.00 0.00 H new ATOM 0 HD22 LEU A 81 134.305 0.269 -1.198 1.00 0.00 H new ATOM 0 HD23 LEU A 81 135.079 1.032 -2.607 1.00 0.00 H new ATOM 1257 N THR A 82 134.977 1.999 -4.855 1.00 0.00 N ATOM 1258 CA THR A 82 135.392 3.264 -5.451 1.00 0.00 C ATOM 1259 C THR A 82 135.721 3.081 -6.928 1.00 0.00 C ATOM 1260 O THR A 82 135.232 3.823 -7.780 1.00 0.00 O ATOM 1261 CB THR A 82 136.620 3.808 -4.717 1.00 0.00 C ATOM 1262 OG1 THR A 82 136.301 4.009 -3.347 1.00 0.00 O ATOM 1263 CG2 THR A 82 137.043 5.138 -5.345 1.00 0.00 C ATOM 0 H THR A 82 135.666 1.574 -4.235 1.00 0.00 H new ATOM 0 HA THR A 82 134.569 3.973 -5.360 1.00 0.00 H new ATOM 0 HB THR A 82 137.439 3.093 -4.798 1.00 0.00 H new ATOM 0 HG1 THR A 82 136.865 3.432 -2.792 1.00 0.00 H new ATOM 0 HG21 THR A 82 137.918 5.525 -4.822 1.00 0.00 H new ATOM 0 HG22 THR A 82 137.288 4.983 -6.396 1.00 0.00 H new ATOM 0 HG23 THR A 82 136.226 5.855 -5.265 1.00 0.00 H new ATOM 1271 N VAL A 83 136.554 2.089 -7.226 1.00 0.00 N ATOM 1272 CA VAL A 83 136.944 1.820 -8.605 1.00 0.00 C ATOM 1273 C VAL A 83 135.736 1.394 -9.433 1.00 0.00 C ATOM 1274 O VAL A 83 135.606 1.774 -10.597 1.00 0.00 O ATOM 1275 CB VAL A 83 138.003 0.719 -8.643 1.00 0.00 C ATOM 1276 CG1 VAL A 83 138.242 0.288 -10.091 1.00 0.00 C ATOM 1277 CG2 VAL A 83 139.310 1.250 -8.048 1.00 0.00 C ATOM 0 H VAL A 83 136.969 1.462 -6.537 1.00 0.00 H new ATOM 0 HA VAL A 83 137.356 2.736 -9.030 1.00 0.00 H new ATOM 0 HB VAL A 83 137.658 -0.136 -8.062 1.00 0.00 H new ATOM 0 HG11 VAL A 83 138.997 -0.497 -10.117 1.00 0.00 H new ATOM 0 HG12 VAL A 83 137.312 -0.089 -10.517 1.00 0.00 H new ATOM 0 HG13 VAL A 83 138.587 1.143 -10.673 1.00 0.00 H new ATOM 0 HG21 VAL A 83 140.067 0.466 -8.074 1.00 0.00 H new ATOM 0 HG22 VAL A 83 139.653 2.105 -8.630 1.00 0.00 H new ATOM 0 HG23 VAL A 83 139.142 1.557 -7.016 1.00 0.00 H new ATOM 1287 N ALA A 84 134.857 0.604 -8.826 1.00 0.00 N ATOM 1288 CA ALA A 84 133.664 0.131 -9.521 1.00 0.00 C ATOM 1289 C ALA A 84 132.888 1.303 -10.115 1.00 0.00 C ATOM 1290 O ALA A 84 132.344 1.204 -11.215 1.00 0.00 O ATOM 1291 CB ALA A 84 132.765 -0.637 -8.550 1.00 0.00 C ATOM 0 H ALA A 84 134.946 0.280 -7.863 1.00 0.00 H new ATOM 0 HA ALA A 84 133.976 -0.530 -10.329 1.00 0.00 H new ATOM 0 HB1 ALA A 84 131.877 -0.987 -9.076 1.00 0.00 H new ATOM 0 HB2 ALA A 84 133.309 -1.492 -8.149 1.00 0.00 H new ATOM 0 HB3 ALA A 84 132.468 0.020 -7.733 1.00 0.00 H new ATOM 1297 N CYS A 85 132.842 2.409 -9.381 1.00 0.00 N ATOM 1298 CA CYS A 85 132.130 3.593 -9.846 1.00 0.00 C ATOM 1299 C CYS A 85 133.070 4.521 -10.609 1.00 0.00 C ATOM 1300 O CYS A 85 132.661 5.192 -11.556 1.00 0.00 O ATOM 1301 CB CYS A 85 131.528 4.339 -8.655 1.00 0.00 C ATOM 1302 SG CYS A 85 130.557 3.189 -7.650 1.00 0.00 S ATOM 0 H CYS A 85 133.286 2.510 -8.468 1.00 0.00 H new ATOM 0 HA CYS A 85 131.332 3.274 -10.517 1.00 0.00 H new ATOM 0 HB2 CYS A 85 132.320 4.785 -8.053 1.00 0.00 H new ATOM 0 HB3 CYS A 85 130.896 5.155 -9.005 1.00 0.00 H new ATOM 0 HG CYS A 85 129.636 3.845 -7.009 1.00 0.00 H new ATOM 1308 N ASN A 86 134.331 4.551 -10.191 1.00 0.00 N ATOM 1309 CA ASN A 86 135.321 5.402 -10.843 1.00 0.00 C ATOM 1310 C ASN A 86 135.201 5.295 -12.359 1.00 0.00 C ATOM 1311 O ASN A 86 134.977 4.211 -12.899 1.00 0.00 O ATOM 1312 CB ASN A 86 136.729 4.990 -10.411 1.00 0.00 C ATOM 1313 CG ASN A 86 137.742 6.036 -10.866 1.00 0.00 C ATOM 1314 OD1 ASN A 86 138.480 5.811 -11.824 1.00 0.00 O ATOM 1315 ND2 ASN A 86 137.820 7.174 -10.230 1.00 0.00 N ATOM 0 H ASN A 86 134.690 4.001 -9.411 1.00 0.00 H new ATOM 0 HA ASN A 86 135.138 6.435 -10.546 1.00 0.00 H new ATOM 0 HB2 ASN A 86 136.768 4.881 -9.327 1.00 0.00 H new ATOM 0 HB3 ASN A 86 136.980 4.019 -10.838 1.00 0.00 H new ATOM 0 HD21 ASN A 86 138.494 7.879 -10.527 1.00 0.00 H new ATOM 0 HD22 ASN A 86 137.207 7.358 -9.436 1.00 0.00 H new ATOM 1322 N ASN A 87 135.352 6.426 -13.041 1.00 0.00 N ATOM 1323 CA ASN A 87 135.258 6.447 -14.495 1.00 0.00 C ATOM 1324 C ASN A 87 136.132 7.555 -15.074 1.00 0.00 C ATOM 1325 O ASN A 87 135.675 8.361 -15.883 1.00 0.00 O ATOM 1326 CB ASN A 87 133.805 6.665 -14.921 1.00 0.00 C ATOM 1327 CG ASN A 87 133.302 8.002 -14.387 1.00 0.00 C ATOM 1328 OD1 ASN A 87 134.079 8.786 -13.841 1.00 0.00 O ATOM 1329 ND2 ASN A 87 132.040 8.312 -14.512 1.00 0.00 N ATOM 0 H ASN A 87 135.539 7.333 -12.613 1.00 0.00 H new ATOM 0 HA ASN A 87 135.609 5.488 -14.876 1.00 0.00 H new ATOM 0 HB2 ASN A 87 133.729 6.646 -16.008 1.00 0.00 H new ATOM 0 HB3 ASN A 87 133.181 5.855 -14.544 1.00 0.00 H new ATOM 0 HD21 ASN A 87 131.697 9.205 -14.157 1.00 0.00 H new ATOM 0 HD22 ASN A 87 131.398 7.662 -14.964 1.00 0.00 H new ATOM 1336 N PHE A 88 137.392 7.588 -14.653 1.00 0.00 N ATOM 1337 CA PHE A 88 138.323 8.602 -15.134 1.00 0.00 C ATOM 1338 C PHE A 88 138.727 8.318 -16.579 1.00 0.00 C ATOM 1339 O PHE A 88 138.859 9.237 -17.387 1.00 0.00 O ATOM 1340 CB PHE A 88 139.572 8.628 -14.250 1.00 0.00 C ATOM 1341 CG PHE A 88 139.303 9.455 -13.015 1.00 0.00 C ATOM 1342 CD1 PHE A 88 138.279 9.088 -12.135 1.00 0.00 C ATOM 1343 CD2 PHE A 88 140.080 10.588 -12.751 1.00 0.00 C ATOM 1344 CE1 PHE A 88 138.031 9.855 -10.990 1.00 0.00 C ATOM 1345 CE2 PHE A 88 139.833 11.356 -11.607 1.00 0.00 C ATOM 1346 CZ PHE A 88 138.809 10.989 -10.726 1.00 0.00 C ATOM 0 H PHE A 88 137.790 6.929 -13.984 1.00 0.00 H new ATOM 0 HA PHE A 88 137.827 9.572 -15.090 1.00 0.00 H new ATOM 0 HB2 PHE A 88 139.850 7.613 -13.966 1.00 0.00 H new ATOM 0 HB3 PHE A 88 140.413 9.046 -14.804 1.00 0.00 H new ATOM 0 HD1 PHE A 88 137.680 8.213 -12.339 1.00 0.00 H new ATOM 0 HD2 PHE A 88 140.871 10.870 -13.430 1.00 0.00 H new ATOM 0 HE1 PHE A 88 137.240 9.572 -10.311 1.00 0.00 H new ATOM 0 HE2 PHE A 88 140.432 12.231 -11.404 1.00 0.00 H new ATOM 0 HZ PHE A 88 138.619 11.580 -9.843 1.00 0.00 H new ATOM 1356 N PHE A 89 138.927 7.041 -16.895 1.00 0.00 N ATOM 1357 CA PHE A 89 139.322 6.644 -18.246 1.00 0.00 C ATOM 1358 C PHE A 89 138.238 5.791 -18.898 1.00 0.00 C ATOM 1359 O PHE A 89 138.063 5.819 -20.116 1.00 0.00 O ATOM 1360 CB PHE A 89 140.631 5.856 -18.193 1.00 0.00 C ATOM 1361 CG PHE A 89 141.781 6.809 -17.970 1.00 0.00 C ATOM 1362 CD1 PHE A 89 142.428 7.391 -19.067 1.00 0.00 C ATOM 1363 CD2 PHE A 89 142.197 7.111 -16.669 1.00 0.00 C ATOM 1364 CE1 PHE A 89 143.494 8.275 -18.861 1.00 0.00 C ATOM 1365 CE2 PHE A 89 143.263 7.996 -16.463 1.00 0.00 C ATOM 1366 CZ PHE A 89 143.910 8.578 -17.559 1.00 0.00 C ATOM 0 H PHE A 89 138.823 6.267 -16.239 1.00 0.00 H new ATOM 0 HA PHE A 89 139.462 7.546 -18.842 1.00 0.00 H new ATOM 0 HB2 PHE A 89 140.593 5.120 -17.390 1.00 0.00 H new ATOM 0 HB3 PHE A 89 140.775 5.306 -19.123 1.00 0.00 H new ATOM 0 HD1 PHE A 89 142.105 7.158 -20.071 1.00 0.00 H new ATOM 0 HD2 PHE A 89 141.697 6.662 -15.824 1.00 0.00 H new ATOM 0 HE1 PHE A 89 143.995 8.723 -19.706 1.00 0.00 H new ATOM 0 HE2 PHE A 89 143.585 8.229 -15.459 1.00 0.00 H new ATOM 0 HZ PHE A 89 144.731 9.262 -17.400 1.00 0.00 H new ATOM 1442 N GLY B 1 131.269 17.117 2.178 1.00 0.00 N ATOM 1443 CA GLY B 1 131.845 15.835 1.791 1.00 0.00 C ATOM 1444 C GLY B 1 132.719 15.272 2.906 1.00 0.00 C ATOM 1445 O GLY B 1 133.466 16.005 3.552 1.00 0.00 O ATOM 0 H1 GLY B 1 131.346 17.786 1.385 1.00 0.00 H new ATOM 0 H2 GLY B 1 130.267 16.987 2.425 1.00 0.00 H new ATOM 0 H3 GLY B 1 131.782 17.494 3.000 1.00 0.00 H new ATOM 0 HA2 GLY B 1 131.048 15.129 1.557 1.00 0.00 H new ATOM 0 HA3 GLY B 1 132.438 15.957 0.885 1.00 0.00 H new ATOM 1449 N SER B 2 132.619 13.964 3.126 1.00 0.00 N ATOM 1450 CA SER B 2 133.407 13.314 4.166 1.00 0.00 C ATOM 1451 C SER B 2 134.879 13.263 3.770 1.00 0.00 C ATOM 1452 O SER B 2 135.214 13.293 2.586 1.00 0.00 O ATOM 1453 CB SER B 2 132.891 11.894 4.403 1.00 0.00 C ATOM 1454 OG SER B 2 131.542 11.954 4.848 1.00 0.00 O ATOM 0 H SER B 2 132.006 13.339 2.603 1.00 0.00 H new ATOM 0 HA SER B 2 133.309 13.893 5.084 1.00 0.00 H new ATOM 0 HB2 SER B 2 132.958 11.312 3.484 1.00 0.00 H new ATOM 0 HB3 SER B 2 133.509 11.389 5.145 1.00 0.00 H new ATOM 0 HG SER B 2 131.157 11.053 4.847 1.00 0.00 H new ATOM 1460 N GLU B 3 135.753 13.184 4.768 1.00 0.00 N ATOM 1461 CA GLU B 3 137.187 13.129 4.513 1.00 0.00 C ATOM 1462 C GLU B 3 137.553 11.850 3.767 1.00 0.00 C ATOM 1463 O GLU B 3 138.566 11.794 3.070 1.00 0.00 O ATOM 1464 CB GLU B 3 137.955 13.189 5.834 1.00 0.00 C ATOM 1465 CG GLU B 3 137.675 14.523 6.529 1.00 0.00 C ATOM 1466 CD GLU B 3 138.447 14.598 7.842 1.00 0.00 C ATOM 1467 OE1 GLU B 3 139.163 13.656 8.140 1.00 0.00 O ATOM 1468 OE2 GLU B 3 138.310 15.596 8.530 1.00 0.00 O ATOM 0 H GLU B 3 135.495 13.157 5.755 1.00 0.00 H new ATOM 0 HA GLU B 3 137.459 13.985 3.895 1.00 0.00 H new ATOM 0 HB2 GLU B 3 137.656 12.362 6.478 1.00 0.00 H new ATOM 0 HB3 GLU B 3 139.024 13.080 5.650 1.00 0.00 H new ATOM 0 HG2 GLU B 3 137.965 15.349 5.879 1.00 0.00 H new ATOM 0 HG3 GLU B 3 136.607 14.626 6.719 1.00 0.00 H new ATOM 1475 N LEU B 4 136.722 10.823 3.919 1.00 0.00 N ATOM 1476 CA LEU B 4 136.971 9.549 3.255 1.00 0.00 C ATOM 1477 C LEU B 4 136.724 9.665 1.754 1.00 0.00 C ATOM 1478 O LEU B 4 137.377 8.994 0.955 1.00 0.00 O ATOM 1479 CB LEU B 4 136.060 8.468 3.844 1.00 0.00 C ATOM 1480 CG LEU B 4 136.402 7.111 3.227 1.00 0.00 C ATOM 1481 CD1 LEU B 4 137.823 6.702 3.633 1.00 0.00 C ATOM 1482 CD2 LEU B 4 135.405 6.061 3.727 1.00 0.00 C ATOM 0 H LEU B 4 135.878 10.847 4.491 1.00 0.00 H new ATOM 0 HA LEU B 4 138.013 9.275 3.417 1.00 0.00 H new ATOM 0 HB2 LEU B 4 136.182 8.427 4.926 1.00 0.00 H new ATOM 0 HB3 LEU B 4 135.016 8.714 3.650 1.00 0.00 H new ATOM 0 HG LEU B 4 136.345 7.182 2.141 1.00 0.00 H new ATOM 0 HD11 LEU B 4 138.063 5.735 3.192 1.00 0.00 H new ATOM 0 HD12 LEU B 4 138.532 7.449 3.277 1.00 0.00 H new ATOM 0 HD13 LEU B 4 137.885 6.631 4.719 1.00 0.00 H new ATOM 0 HD21 LEU B 4 135.646 5.093 3.289 1.00 0.00 H new ATOM 0 HD22 LEU B 4 135.463 5.992 4.813 1.00 0.00 H new ATOM 0 HD23 LEU B 4 134.395 6.350 3.435 1.00 0.00 H new ATOM 1494 N GLU B 5 135.778 10.519 1.380 1.00 0.00 N ATOM 1495 CA GLU B 5 135.453 10.713 -0.029 1.00 0.00 C ATOM 1496 C GLU B 5 136.655 11.264 -0.790 1.00 0.00 C ATOM 1497 O GLU B 5 136.995 10.777 -1.869 1.00 0.00 O ATOM 1498 CB GLU B 5 134.274 11.678 -0.165 1.00 0.00 C ATOM 1499 CG GLU B 5 132.988 10.976 0.278 1.00 0.00 C ATOM 1500 CD GLU B 5 131.806 11.934 0.165 1.00 0.00 C ATOM 1501 OE1 GLU B 5 132.038 13.101 -0.106 1.00 0.00 O ATOM 1502 OE2 GLU B 5 130.687 11.486 0.353 1.00 0.00 O ATOM 0 H GLU B 5 135.227 11.084 2.026 1.00 0.00 H new ATOM 0 HA GLU B 5 135.183 9.746 -0.454 1.00 0.00 H new ATOM 0 HB2 GLU B 5 134.445 12.566 0.444 1.00 0.00 H new ATOM 0 HB3 GLU B 5 134.181 12.013 -1.198 1.00 0.00 H new ATOM 0 HG2 GLU B 5 132.813 10.095 -0.340 1.00 0.00 H new ATOM 0 HG3 GLU B 5 133.089 10.629 1.306 1.00 0.00 H new ATOM 1509 N THR B 6 137.297 12.280 -0.221 1.00 0.00 N ATOM 1510 CA THR B 6 138.461 12.886 -0.858 1.00 0.00 C ATOM 1511 C THR B 6 139.717 12.068 -0.574 1.00 0.00 C ATOM 1512 O THR B 6 140.709 12.163 -1.297 1.00 0.00 O ATOM 1513 CB THR B 6 138.652 14.317 -0.347 1.00 0.00 C ATOM 1514 OG1 THR B 6 139.578 14.997 -1.185 1.00 0.00 O ATOM 1515 CG2 THR B 6 139.185 14.285 1.086 1.00 0.00 C ATOM 0 H THR B 6 137.034 12.698 0.672 1.00 0.00 H new ATOM 0 HA THR B 6 138.292 12.905 -1.935 1.00 0.00 H new ATOM 0 HB THR B 6 137.695 14.839 -0.362 1.00 0.00 H new ATOM 0 HG1 THR B 6 139.701 15.914 -0.861 1.00 0.00 H new ATOM 0 HG21 THR B 6 139.320 15.305 1.447 1.00 0.00 H new ATOM 0 HG22 THR B 6 138.474 13.764 1.727 1.00 0.00 H new ATOM 0 HG23 THR B 6 140.142 13.763 1.107 1.00 0.00 H new ATOM 1523 N ALA B 7 139.668 11.265 0.483 1.00 0.00 N ATOM 1524 CA ALA B 7 140.808 10.435 0.856 1.00 0.00 C ATOM 1525 C ALA B 7 141.243 9.559 -0.316 1.00 0.00 C ATOM 1526 O ALA B 7 142.428 9.480 -0.638 1.00 0.00 O ATOM 1527 CB ALA B 7 140.441 9.548 2.047 1.00 0.00 C ATOM 0 H ALA B 7 138.856 11.171 1.094 1.00 0.00 H new ATOM 0 HA ALA B 7 141.634 11.091 1.131 1.00 0.00 H new ATOM 0 HB1 ALA B 7 141.298 8.931 2.319 1.00 0.00 H new ATOM 0 HB2 ALA B 7 140.161 10.174 2.894 1.00 0.00 H new ATOM 0 HB3 ALA B 7 139.603 8.906 1.778 1.00 0.00 H new ATOM 1533 N MET B 8 140.276 8.904 -0.948 1.00 0.00 N ATOM 1534 CA MET B 8 140.570 8.034 -2.082 1.00 0.00 C ATOM 1535 C MET B 8 140.954 8.859 -3.307 1.00 0.00 C ATOM 1536 O MET B 8 141.727 8.409 -4.152 1.00 0.00 O ATOM 1537 CB MET B 8 139.349 7.173 -2.408 1.00 0.00 C ATOM 1538 CG MET B 8 138.784 6.580 -1.115 1.00 0.00 C ATOM 1539 SD MET B 8 140.100 5.715 -0.222 1.00 0.00 S ATOM 1540 CE MET B 8 140.395 4.422 -1.453 1.00 0.00 C ATOM 0 H MET B 8 139.289 8.957 -0.698 1.00 0.00 H new ATOM 0 HA MET B 8 141.409 7.391 -1.814 1.00 0.00 H new ATOM 0 HB2 MET B 8 138.589 7.774 -2.907 1.00 0.00 H new ATOM 0 HB3 MET B 8 139.627 6.375 -3.096 1.00 0.00 H new ATOM 0 HG2 MET B 8 138.366 7.371 -0.492 1.00 0.00 H new ATOM 0 HG3 MET B 8 137.971 5.891 -1.343 1.00 0.00 H new ATOM 0 HE1 MET B 8 140.616 3.482 -0.947 1.00 0.00 H new ATOM 0 HE2 MET B 8 139.507 4.300 -2.073 1.00 0.00 H new ATOM 0 HE3 MET B 8 141.240 4.704 -2.081 1.00 0.00 H new ATOM 1550 N GLU B 9 140.407 10.067 -3.396 1.00 0.00 N ATOM 1551 CA GLU B 9 140.698 10.946 -4.522 1.00 0.00 C ATOM 1552 C GLU B 9 142.168 11.355 -4.519 1.00 0.00 C ATOM 1553 O GLU B 9 142.715 11.742 -5.552 1.00 0.00 O ATOM 1554 CB GLU B 9 139.820 12.196 -4.446 1.00 0.00 C ATOM 1555 CG GLU B 9 138.348 11.793 -4.552 1.00 0.00 C ATOM 1556 CD GLU B 9 138.030 11.344 -5.974 1.00 0.00 C ATOM 1557 OE1 GLU B 9 138.810 11.652 -6.860 1.00 0.00 O ATOM 1558 OE2 GLU B 9 137.010 10.698 -6.156 1.00 0.00 O ATOM 0 H GLU B 9 139.764 10.457 -2.707 1.00 0.00 H new ATOM 0 HA GLU B 9 140.486 10.406 -5.445 1.00 0.00 H new ATOM 0 HB2 GLU B 9 139.997 12.721 -3.508 1.00 0.00 H new ATOM 0 HB3 GLU B 9 140.078 12.884 -5.251 1.00 0.00 H new ATOM 0 HG2 GLU B 9 138.132 10.987 -3.851 1.00 0.00 H new ATOM 0 HG3 GLU B 9 137.712 12.634 -4.277 1.00 0.00 H new ATOM 1565 N THR B 10 142.800 11.270 -3.354 1.00 0.00 N ATOM 1566 CA THR B 10 144.207 11.637 -3.232 1.00 0.00 C ATOM 1567 C THR B 10 145.103 10.524 -3.767 1.00 0.00 C ATOM 1568 O THR B 10 146.051 10.782 -4.509 1.00 0.00 O ATOM 1569 CB THR B 10 144.553 11.913 -1.767 1.00 0.00 C ATOM 1570 OG1 THR B 10 143.605 12.820 -1.221 1.00 0.00 O ATOM 1571 CG2 THR B 10 145.954 12.519 -1.680 1.00 0.00 C ATOM 0 H THR B 10 142.366 10.953 -2.487 1.00 0.00 H new ATOM 0 HA THR B 10 144.377 12.538 -3.821 1.00 0.00 H new ATOM 0 HB THR B 10 144.528 10.980 -1.203 1.00 0.00 H new ATOM 0 HG1 THR B 10 142.725 12.390 -1.183 1.00 0.00 H new ATOM 0 HG21 THR B 10 146.201 12.716 -0.637 1.00 0.00 H new ATOM 0 HG22 THR B 10 146.679 11.821 -2.099 1.00 0.00 H new ATOM 0 HG23 THR B 10 145.982 13.453 -2.242 1.00 0.00 H new ATOM 1579 N LEU B 11 144.801 9.289 -3.382 1.00 0.00 N ATOM 1580 CA LEU B 11 145.589 8.145 -3.826 1.00 0.00 C ATOM 1581 C LEU B 11 145.427 7.927 -5.329 1.00 0.00 C ATOM 1582 O LEU B 11 146.389 7.602 -6.025 1.00 0.00 O ATOM 1583 CB LEU B 11 145.150 6.886 -3.075 1.00 0.00 C ATOM 1584 CG LEU B 11 145.650 6.951 -1.627 1.00 0.00 C ATOM 1585 CD1 LEU B 11 144.733 6.117 -0.732 1.00 0.00 C ATOM 1586 CD2 LEU B 11 147.075 6.395 -1.550 1.00 0.00 C ATOM 0 H LEU B 11 144.021 9.055 -2.767 1.00 0.00 H new ATOM 0 HA LEU B 11 146.639 8.349 -3.614 1.00 0.00 H new ATOM 0 HB2 LEU B 11 144.063 6.800 -3.092 1.00 0.00 H new ATOM 0 HB3 LEU B 11 145.547 5.999 -3.568 1.00 0.00 H new ATOM 0 HG LEU B 11 145.645 7.988 -1.290 1.00 0.00 H new ATOM 0 HD11 LEU B 11 145.089 6.163 0.297 1.00 0.00 H new ATOM 0 HD12 LEU B 11 143.718 6.511 -0.783 1.00 0.00 H new ATOM 0 HD13 LEU B 11 144.738 5.081 -1.071 1.00 0.00 H new ATOM 0 HD21 LEU B 11 147.429 6.442 -0.520 1.00 0.00 H new ATOM 0 HD22 LEU B 11 147.080 5.359 -1.888 1.00 0.00 H new ATOM 0 HD23 LEU B 11 147.732 6.988 -2.187 1.00 0.00 H new ATOM 1598 N ILE B 12 144.206 8.106 -5.821 1.00 0.00 N ATOM 1599 CA ILE B 12 143.934 7.924 -7.242 1.00 0.00 C ATOM 1600 C ILE B 12 144.615 9.025 -8.060 1.00 0.00 C ATOM 1601 O ILE B 12 145.113 8.781 -9.158 1.00 0.00 O ATOM 1602 CB ILE B 12 142.410 7.929 -7.480 1.00 0.00 C ATOM 1603 CG1 ILE B 12 142.063 7.024 -8.671 1.00 0.00 C ATOM 1604 CG2 ILE B 12 141.910 9.351 -7.758 1.00 0.00 C ATOM 1605 CD1 ILE B 12 142.879 7.439 -9.897 1.00 0.00 C ATOM 0 H ILE B 12 143.396 8.374 -5.263 1.00 0.00 H new ATOM 0 HA ILE B 12 144.338 6.965 -7.566 1.00 0.00 H new ATOM 0 HB ILE B 12 141.922 7.554 -6.581 1.00 0.00 H new ATOM 0 HG12 ILE B 12 142.270 5.984 -8.421 1.00 0.00 H new ATOM 0 HG13 ILE B 12 140.998 7.092 -8.892 1.00 0.00 H new ATOM 0 HG21 ILE B 12 140.833 9.332 -7.923 1.00 0.00 H new ATOM 0 HG22 ILE B 12 142.135 9.989 -6.904 1.00 0.00 H new ATOM 0 HG23 ILE B 12 142.406 9.744 -8.645 1.00 0.00 H new ATOM 0 HD11 ILE B 12 142.627 6.792 -10.738 1.00 0.00 H new ATOM 0 HD12 ILE B 12 142.650 8.473 -10.153 1.00 0.00 H new ATOM 0 HD13 ILE B 12 143.942 7.347 -9.675 1.00 0.00 H new ATOM 1617 N ASN B 13 144.629 10.237 -7.514 1.00 0.00 N ATOM 1618 CA ASN B 13 145.248 11.366 -8.199 1.00 0.00 C ATOM 1619 C ASN B 13 146.750 11.144 -8.367 1.00 0.00 C ATOM 1620 O ASN B 13 147.258 11.102 -9.487 1.00 0.00 O ATOM 1621 CB ASN B 13 145.008 12.651 -7.405 1.00 0.00 C ATOM 1622 CG ASN B 13 143.558 13.099 -7.561 1.00 0.00 C ATOM 1623 OD1 ASN B 13 142.686 12.284 -8.085 1.00 0.00 O flip ATOM 1624 ND2 ASN B 13 143.212 14.222 -7.194 1.00 0.00 N flip ATOM 0 H ASN B 13 144.222 10.462 -6.606 1.00 0.00 H new ATOM 0 HA ASN B 13 144.796 11.455 -9.187 1.00 0.00 H new ATOM 0 HB2 ASN B 13 145.234 12.485 -6.352 1.00 0.00 H new ATOM 0 HB3 ASN B 13 145.679 13.435 -7.755 1.00 0.00 H new ATOM 0 HD21 ASN B 13 143.896 14.858 -6.784 1.00 0.00 H new ATOM 0 HD22 ASN B 13 142.241 14.516 -7.300 1.00 0.00 H new ATOM 1631 N VAL B 14 147.453 11.007 -7.247 1.00 0.00 N ATOM 1632 CA VAL B 14 148.898 10.796 -7.285 1.00 0.00 C ATOM 1633 C VAL B 14 149.245 9.593 -8.157 1.00 0.00 C ATOM 1634 O VAL B 14 150.312 9.549 -8.771 1.00 0.00 O ATOM 1635 CB VAL B 14 149.435 10.572 -5.868 1.00 0.00 C ATOM 1636 CG1 VAL B 14 149.233 11.842 -5.037 1.00 0.00 C ATOM 1637 CG2 VAL B 14 148.684 9.411 -5.212 1.00 0.00 C ATOM 0 H VAL B 14 147.051 11.038 -6.310 1.00 0.00 H new ATOM 0 HA VAL B 14 149.361 11.686 -7.712 1.00 0.00 H new ATOM 0 HB VAL B 14 150.498 10.335 -5.919 1.00 0.00 H new ATOM 0 HG11 VAL B 14 149.615 11.682 -4.029 1.00 0.00 H new ATOM 0 HG12 VAL B 14 149.769 12.670 -5.501 1.00 0.00 H new ATOM 0 HG13 VAL B 14 148.170 12.080 -4.988 1.00 0.00 H new ATOM 0 HG21 VAL B 14 149.067 9.253 -4.204 1.00 0.00 H new ATOM 0 HG22 VAL B 14 147.621 9.647 -5.163 1.00 0.00 H new ATOM 0 HG23 VAL B 14 148.828 8.505 -5.801 1.00 0.00 H new ATOM 1647 N PHE B 15 148.341 8.621 -8.208 1.00 0.00 N ATOM 1648 CA PHE B 15 148.566 7.425 -9.010 1.00 0.00 C ATOM 1649 C PHE B 15 148.706 7.788 -10.485 1.00 0.00 C ATOM 1650 O PHE B 15 149.599 7.294 -11.175 1.00 0.00 O ATOM 1651 CB PHE B 15 147.402 6.448 -8.829 1.00 0.00 C ATOM 1652 CG PHE B 15 147.607 5.248 -9.721 1.00 0.00 C ATOM 1653 CD1 PHE B 15 147.175 5.287 -11.053 1.00 0.00 C ATOM 1654 CD2 PHE B 15 148.224 4.097 -9.218 1.00 0.00 C ATOM 1655 CE1 PHE B 15 147.364 4.174 -11.882 1.00 0.00 C ATOM 1656 CE2 PHE B 15 148.413 2.985 -10.047 1.00 0.00 C ATOM 1657 CZ PHE B 15 147.983 3.023 -11.379 1.00 0.00 C ATOM 0 H PHE B 15 147.452 8.637 -7.708 1.00 0.00 H new ATOM 0 HA PHE B 15 149.490 6.953 -8.675 1.00 0.00 H new ATOM 0 HB2 PHE B 15 147.337 6.133 -7.788 1.00 0.00 H new ATOM 0 HB3 PHE B 15 146.460 6.939 -9.073 1.00 0.00 H new ATOM 0 HD1 PHE B 15 146.697 6.174 -11.440 1.00 0.00 H new ATOM 0 HD2 PHE B 15 148.554 4.067 -8.190 1.00 0.00 H new ATOM 0 HE1 PHE B 15 147.032 4.203 -12.909 1.00 0.00 H new ATOM 0 HE2 PHE B 15 148.891 2.097 -9.659 1.00 0.00 H new ATOM 0 HZ PHE B 15 148.129 2.165 -12.018 1.00 0.00 H new ATOM 1667 N HIS B 16 147.819 8.657 -10.961 1.00 0.00 N ATOM 1668 CA HIS B 16 147.854 9.083 -12.356 1.00 0.00 C ATOM 1669 C HIS B 16 149.024 10.032 -12.598 1.00 0.00 C ATOM 1670 O HIS B 16 149.591 10.068 -13.691 1.00 0.00 O ATOM 1671 CB HIS B 16 146.545 9.785 -12.721 1.00 0.00 C ATOM 1672 CG HIS B 16 145.450 8.764 -12.857 1.00 0.00 C ATOM 1673 ND1 HIS B 16 145.634 7.566 -13.531 1.00 0.00 N ATOM 1674 CD2 HIS B 16 144.151 8.747 -12.411 1.00 0.00 C ATOM 1675 CE1 HIS B 16 144.474 6.885 -13.472 1.00 0.00 C ATOM 1676 NE2 HIS B 16 143.537 7.560 -12.801 1.00 0.00 N ATOM 0 H HIS B 16 147.073 9.077 -10.406 1.00 0.00 H new ATOM 0 HA HIS B 16 147.981 8.200 -12.982 1.00 0.00 H new ATOM 0 HB2 HIS B 16 146.284 10.514 -11.953 1.00 0.00 H new ATOM 0 HB3 HIS B 16 146.663 10.334 -13.655 1.00 0.00 H new ATOM 0 HD1 HIS B 16 146.492 7.257 -13.988 1.00 0.00 H new ATOM 0 HD2 HIS B 16 143.678 9.535 -11.844 1.00 0.00 H new ATOM 0 HE1 HIS B 16 144.320 5.911 -13.914 1.00 0.00 H new ATOM 1685 N ALA B 17 149.378 10.800 -11.573 1.00 0.00 N ATOM 1686 CA ALA B 17 150.481 11.748 -11.685 1.00 0.00 C ATOM 1687 C ALA B 17 151.776 11.023 -12.036 1.00 0.00 C ATOM 1688 O ALA B 17 152.656 11.584 -12.688 1.00 0.00 O ATOM 1689 CB ALA B 17 150.657 12.502 -10.367 1.00 0.00 C ATOM 0 H ALA B 17 148.921 10.785 -10.661 1.00 0.00 H new ATOM 0 HA ALA B 17 150.248 12.457 -12.480 1.00 0.00 H new ATOM 0 HB1 ALA B 17 151.483 13.208 -10.459 1.00 0.00 H new ATOM 0 HB2 ALA B 17 149.741 13.044 -10.133 1.00 0.00 H new ATOM 0 HB3 ALA B 17 150.873 11.793 -9.568 1.00 0.00 H new ATOM 1695 N HIS B 18 151.885 9.772 -11.598 1.00 0.00 N ATOM 1696 CA HIS B 18 153.078 8.979 -11.871 1.00 0.00 C ATOM 1697 C HIS B 18 152.883 8.134 -13.126 1.00 0.00 C ATOM 1698 O HIS B 18 153.668 8.218 -14.071 1.00 0.00 O ATOM 1699 CB HIS B 18 153.382 8.067 -10.682 1.00 0.00 C ATOM 1700 CG HIS B 18 153.803 8.903 -9.505 1.00 0.00 C ATOM 1701 ND1 HIS B 18 154.935 9.702 -9.533 1.00 0.00 N ATOM 1702 CD2 HIS B 18 153.254 9.074 -8.259 1.00 0.00 C ATOM 1703 CE1 HIS B 18 155.030 10.314 -8.338 1.00 0.00 C ATOM 1704 NE2 HIS B 18 154.030 9.965 -7.524 1.00 0.00 N ATOM 0 H HIS B 18 151.168 9.289 -11.057 1.00 0.00 H new ATOM 0 HA HIS B 18 153.915 9.659 -12.030 1.00 0.00 H new ATOM 0 HB2 HIS B 18 152.501 7.478 -10.427 1.00 0.00 H new ATOM 0 HB3 HIS B 18 154.172 7.363 -10.943 1.00 0.00 H new ATOM 0 HD2 HIS B 18 152.356 8.591 -7.903 1.00 0.00 H new ATOM 0 HE1 HIS B 18 155.818 11.003 -8.070 1.00 0.00 H new ATOM 0 HE2 HIS B 18 153.870 10.283 -6.568 1.00 0.00 H new ATOM 1713 N SER B 19 151.833 7.320 -13.129 1.00 0.00 N ATOM 1714 CA SER B 19 151.546 6.463 -14.273 1.00 0.00 C ATOM 1715 C SER B 19 151.287 7.303 -15.520 1.00 0.00 C ATOM 1716 O SER B 19 151.536 6.861 -16.642 1.00 0.00 O ATOM 1717 CB SER B 19 150.324 5.593 -13.981 1.00 0.00 C ATOM 1718 OG SER B 19 150.221 4.580 -14.973 1.00 0.00 O ATOM 0 H SER B 19 151.171 7.236 -12.358 1.00 0.00 H new ATOM 0 HA SER B 19 152.412 5.825 -14.451 1.00 0.00 H new ATOM 0 HB2 SER B 19 150.412 5.142 -12.992 1.00 0.00 H new ATOM 0 HB3 SER B 19 149.421 6.204 -13.974 1.00 0.00 H new ATOM 0 HG SER B 19 149.309 4.220 -14.980 1.00 0.00 H new ATOM 1724 N GLY B 20 150.787 8.518 -15.316 1.00 0.00 N ATOM 1725 CA GLY B 20 150.498 9.412 -16.431 1.00 0.00 C ATOM 1726 C GLY B 20 151.667 9.455 -17.411 1.00 0.00 C ATOM 1727 O GLY B 20 151.508 9.854 -18.564 1.00 0.00 O ATOM 0 H GLY B 20 150.575 8.904 -14.396 1.00 0.00 H new ATOM 0 HA2 GLY B 20 149.598 9.078 -16.947 1.00 0.00 H new ATOM 0 HA3 GLY B 20 150.296 10.415 -16.055 1.00 0.00 H new ATOM 1731 N LYS B 21 152.840 9.042 -16.943 1.00 0.00 N ATOM 1732 CA LYS B 21 154.029 9.037 -17.787 1.00 0.00 C ATOM 1733 C LYS B 21 153.887 8.013 -18.908 1.00 0.00 C ATOM 1734 O LYS B 21 152.798 7.493 -19.152 1.00 0.00 O ATOM 1735 CB LYS B 21 155.265 8.709 -16.947 1.00 0.00 C ATOM 1736 CG LYS B 21 155.177 7.263 -16.453 1.00 0.00 C ATOM 1737 CD LYS B 21 156.276 7.010 -15.420 1.00 0.00 C ATOM 1738 CE LYS B 21 157.637 6.970 -16.121 1.00 0.00 C ATOM 1739 NZ LYS B 21 158.651 6.382 -15.201 1.00 0.00 N ATOM 0 H LYS B 21 152.993 8.709 -15.991 1.00 0.00 H new ATOM 0 HA LYS B 21 154.142 10.027 -18.228 1.00 0.00 H new ATOM 0 HB2 LYS B 21 156.169 8.847 -17.541 1.00 0.00 H new ATOM 0 HB3 LYS B 21 155.333 9.391 -16.099 1.00 0.00 H new ATOM 0 HG2 LYS B 21 154.198 7.077 -16.011 1.00 0.00 H new ATOM 0 HG3 LYS B 21 155.285 6.574 -17.291 1.00 0.00 H new ATOM 0 HD2 LYS B 21 156.267 7.796 -14.664 1.00 0.00 H new ATOM 0 HD3 LYS B 21 156.094 6.068 -14.903 1.00 0.00 H new ATOM 0 HE2 LYS B 21 157.571 6.378 -17.034 1.00 0.00 H new ATOM 0 HE3 LYS B 21 157.937 7.976 -16.415 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 159.576 6.354 -15.676 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 158.720 6.965 -14.342 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 158.366 5.416 -14.942 1.00 0.00 H new ATOM 1753 N GLU B 22 154.994 7.726 -19.585 1.00 0.00 N ATOM 1754 CA GLU B 22 154.981 6.760 -20.678 1.00 0.00 C ATOM 1755 C GLU B 22 154.671 5.362 -20.152 1.00 0.00 C ATOM 1756 O GLU B 22 154.335 5.189 -18.981 1.00 0.00 O ATOM 1757 CB GLU B 22 156.338 6.751 -21.383 1.00 0.00 C ATOM 1758 CG GLU B 22 156.700 8.174 -21.815 1.00 0.00 C ATOM 1759 CD GLU B 22 158.009 8.165 -22.597 1.00 0.00 C ATOM 1760 OE1 GLU B 22 158.613 7.108 -22.691 1.00 0.00 O ATOM 1761 OE2 GLU B 22 158.388 9.213 -23.091 1.00 0.00 O ATOM 0 H GLU B 22 155.905 8.145 -19.398 1.00 0.00 H new ATOM 0 HA GLU B 22 154.205 7.051 -21.386 1.00 0.00 H new ATOM 0 HB2 GLU B 22 157.104 6.357 -20.715 1.00 0.00 H new ATOM 0 HB3 GLU B 22 156.304 6.094 -22.252 1.00 0.00 H new ATOM 0 HG2 GLU B 22 155.902 8.590 -22.430 1.00 0.00 H new ATOM 0 HG3 GLU B 22 156.795 8.816 -20.939 1.00 0.00 H new ATOM 1768 N GLY B 23 154.787 4.367 -21.027 1.00 0.00 N ATOM 1769 CA GLY B 23 154.517 2.988 -20.639 1.00 0.00 C ATOM 1770 C GLY B 23 153.037 2.787 -20.335 1.00 0.00 C ATOM 1771 O GLY B 23 152.191 3.567 -20.776 1.00 0.00 O ATOM 0 H GLY B 23 155.064 4.489 -22.001 1.00 0.00 H new ATOM 0 HA2 GLY B 23 154.822 2.315 -21.440 1.00 0.00 H new ATOM 0 HA3 GLY B 23 155.111 2.730 -19.762 1.00 0.00 H new ATOM 1775 N ASP B 24 152.729 1.739 -19.578 1.00 0.00 N ATOM 1776 CA ASP B 24 151.346 1.447 -19.221 1.00 0.00 C ATOM 1777 C ASP B 24 150.808 2.501 -18.259 1.00 0.00 C ATOM 1778 O ASP B 24 151.137 2.499 -17.073 1.00 0.00 O ATOM 1779 CB ASP B 24 151.255 0.065 -18.571 1.00 0.00 C ATOM 1780 CG ASP B 24 151.797 -0.996 -19.523 1.00 0.00 C ATOM 1781 OD1 ASP B 24 151.287 -1.090 -20.627 1.00 0.00 O ATOM 1782 OD2 ASP B 24 152.715 -1.699 -19.133 1.00 0.00 O ATOM 0 H ASP B 24 153.413 1.082 -19.202 1.00 0.00 H new ATOM 0 HA ASP B 24 150.745 1.460 -20.130 1.00 0.00 H new ATOM 0 HB2 ASP B 24 151.822 0.054 -17.640 1.00 0.00 H new ATOM 0 HB3 ASP B 24 150.219 -0.159 -18.316 1.00 0.00 H new ATOM 1787 N LYS B 25 149.979 3.400 -18.779 1.00 0.00 N ATOM 1788 CA LYS B 25 149.401 4.458 -17.958 1.00 0.00 C ATOM 1789 C LYS B 25 148.351 3.887 -17.009 1.00 0.00 C ATOM 1790 O LYS B 25 148.128 4.419 -15.922 1.00 0.00 O ATOM 1791 CB LYS B 25 148.759 5.519 -18.852 1.00 0.00 C ATOM 1792 CG LYS B 25 149.789 6.024 -19.865 1.00 0.00 C ATOM 1793 CD LYS B 25 149.193 7.184 -20.668 1.00 0.00 C ATOM 1794 CE LYS B 25 148.371 6.630 -21.833 1.00 0.00 C ATOM 1795 NZ LYS B 25 149.256 5.840 -22.734 1.00 0.00 N ATOM 0 H LYS B 25 149.694 3.418 -19.758 1.00 0.00 H new ATOM 0 HA LYS B 25 150.198 4.912 -17.369 1.00 0.00 H new ATOM 0 HB2 LYS B 25 147.898 5.099 -19.372 1.00 0.00 H new ATOM 0 HB3 LYS B 25 148.393 6.348 -18.246 1.00 0.00 H new ATOM 0 HG2 LYS B 25 150.691 6.351 -19.349 1.00 0.00 H new ATOM 0 HG3 LYS B 25 150.081 5.216 -20.536 1.00 0.00 H new ATOM 0 HD2 LYS B 25 148.563 7.799 -20.025 1.00 0.00 H new ATOM 0 HD3 LYS B 25 149.989 7.827 -21.044 1.00 0.00 H new ATOM 0 HE2 LYS B 25 147.564 6.002 -21.456 1.00 0.00 H new ATOM 0 HE3 LYS B 25 147.907 7.447 -22.386 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 148.906 5.907 -23.711 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 150.224 6.216 -22.687 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 149.257 4.844 -22.434 1.00 0.00 H new ATOM 1809 N TYR B 26 147.708 2.804 -17.430 1.00 0.00 N ATOM 1810 CA TYR B 26 146.680 2.170 -16.611 1.00 0.00 C ATOM 1811 C TYR B 26 147.304 1.461 -15.413 1.00 0.00 C ATOM 1812 O TYR B 26 146.705 1.391 -14.341 1.00 0.00 O ATOM 1813 CB TYR B 26 145.893 1.161 -17.449 1.00 0.00 C ATOM 1814 CG TYR B 26 145.286 1.860 -18.642 1.00 0.00 C ATOM 1815 CD1 TYR B 26 144.130 2.635 -18.485 1.00 0.00 C ATOM 1816 CD2 TYR B 26 145.877 1.734 -19.905 1.00 0.00 C ATOM 1817 CE1 TYR B 26 143.566 3.283 -19.590 1.00 0.00 C ATOM 1818 CE2 TYR B 26 145.313 2.381 -21.010 1.00 0.00 C ATOM 1819 CZ TYR B 26 144.158 3.156 -20.853 1.00 0.00 C ATOM 1820 OH TYR B 26 143.602 3.794 -21.942 1.00 0.00 O ATOM 0 H TYR B 26 147.878 2.349 -18.327 1.00 0.00 H new ATOM 0 HA TYR B 26 146.006 2.946 -16.247 1.00 0.00 H new ATOM 0 HB2 TYR B 26 146.550 0.357 -17.781 1.00 0.00 H new ATOM 0 HB3 TYR B 26 145.109 0.703 -16.845 1.00 0.00 H new ATOM 0 HD1 TYR B 26 143.674 2.733 -17.511 1.00 0.00 H new ATOM 0 HD2 TYR B 26 146.769 1.137 -20.026 1.00 0.00 H new ATOM 0 HE1 TYR B 26 142.675 3.881 -19.469 1.00 0.00 H new ATOM 0 HE2 TYR B 26 145.769 2.282 -21.984 1.00 0.00 H new ATOM 0 HH TYR B 26 144.136 3.603 -22.741 1.00 0.00 H new ATOM 1830 N LYS B 27 148.510 0.930 -15.604 1.00 0.00 N ATOM 1831 CA LYS B 27 149.208 0.222 -14.532 1.00 0.00 C ATOM 1832 C LYS B 27 150.478 0.965 -14.132 1.00 0.00 C ATOM 1833 O LYS B 27 151.169 1.535 -14.976 1.00 0.00 O ATOM 1834 CB LYS B 27 149.568 -1.192 -14.994 1.00 0.00 C ATOM 1835 CG LYS B 27 148.334 -1.861 -15.604 1.00 0.00 C ATOM 1836 CD LYS B 27 147.248 -2.006 -14.535 1.00 0.00 C ATOM 1837 CE LYS B 27 146.220 -3.045 -14.990 1.00 0.00 C ATOM 1838 NZ LYS B 27 145.686 -2.664 -16.328 1.00 0.00 N ATOM 0 H LYS B 27 149.022 0.976 -16.485 1.00 0.00 H new ATOM 0 HA LYS B 27 148.547 0.169 -13.667 1.00 0.00 H new ATOM 0 HB2 LYS B 27 150.373 -1.152 -15.728 1.00 0.00 H new ATOM 0 HB3 LYS B 27 149.934 -1.779 -14.151 1.00 0.00 H new ATOM 0 HG2 LYS B 27 147.961 -1.267 -16.438 1.00 0.00 H new ATOM 0 HG3 LYS B 27 148.599 -2.840 -16.003 1.00 0.00 H new ATOM 0 HD2 LYS B 27 147.693 -2.310 -13.588 1.00 0.00 H new ATOM 0 HD3 LYS B 27 146.760 -1.046 -14.364 1.00 0.00 H new ATOM 0 HE2 LYS B 27 146.681 -4.031 -15.038 1.00 0.00 H new ATOM 0 HE3 LYS B 27 145.407 -3.108 -14.267 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 144.813 -3.197 -16.518 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 145.479 -1.645 -16.342 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 146.392 -2.884 -17.059 1.00 0.00 H new ATOM 1852 N LEU B 28 150.780 0.952 -12.837 1.00 0.00 N ATOM 1853 CA LEU B 28 151.970 1.626 -12.328 1.00 0.00 C ATOM 1854 C LEU B 28 153.109 0.628 -12.138 1.00 0.00 C ATOM 1855 O LEU B 28 152.892 -0.496 -11.685 1.00 0.00 O ATOM 1856 CB LEU B 28 151.654 2.305 -10.992 1.00 0.00 C ATOM 1857 CG LEU B 28 152.890 3.053 -10.483 1.00 0.00 C ATOM 1858 CD1 LEU B 28 153.259 4.168 -11.465 1.00 0.00 C ATOM 1859 CD2 LEU B 28 152.581 3.663 -9.113 1.00 0.00 C ATOM 0 H LEU B 28 150.220 0.485 -12.124 1.00 0.00 H new ATOM 0 HA LEU B 28 152.278 2.379 -13.053 1.00 0.00 H new ATOM 0 HB2 LEU B 28 150.823 2.999 -11.114 1.00 0.00 H new ATOM 0 HB3 LEU B 28 151.342 1.560 -10.260 1.00 0.00 H new ATOM 0 HG LEU B 28 153.725 2.358 -10.397 1.00 0.00 H new ATOM 0 HD11 LEU B 28 154.139 4.698 -11.100 1.00 0.00 H new ATOM 0 HD12 LEU B 28 153.475 3.736 -12.442 1.00 0.00 H new ATOM 0 HD13 LEU B 28 152.426 4.865 -11.553 1.00 0.00 H new ATOM 0 HD21 LEU B 28 153.458 4.197 -8.746 1.00 0.00 H new ATOM 0 HD22 LEU B 28 151.745 4.357 -9.204 1.00 0.00 H new ATOM 0 HD23 LEU B 28 152.319 2.870 -8.412 1.00 0.00 H new ATOM 1871 N SER B 29 154.321 1.047 -12.486 1.00 0.00 N ATOM 1872 CA SER B 29 155.487 0.181 -12.348 1.00 0.00 C ATOM 1873 C SER B 29 155.967 0.157 -10.900 1.00 0.00 C ATOM 1874 O SER B 29 155.564 0.990 -10.090 1.00 0.00 O ATOM 1875 CB SER B 29 156.614 0.676 -13.254 1.00 0.00 C ATOM 1876 OG SER B 29 156.907 2.031 -12.939 1.00 0.00 O ATOM 0 H SER B 29 154.521 1.973 -12.863 1.00 0.00 H new ATOM 0 HA SER B 29 155.204 -0.830 -12.641 1.00 0.00 H new ATOM 0 HB2 SER B 29 157.502 0.059 -13.120 1.00 0.00 H new ATOM 0 HB3 SER B 29 156.321 0.589 -14.300 1.00 0.00 H new ATOM 0 HG SER B 29 157.631 2.352 -13.517 1.00 0.00 H new ATOM 1882 N LYS B 30 156.827 -0.806 -10.582 1.00 0.00 N ATOM 1883 CA LYS B 30 157.352 -0.928 -9.227 1.00 0.00 C ATOM 1884 C LYS B 30 158.622 -0.097 -9.064 1.00 0.00 C ATOM 1885 O LYS B 30 159.040 0.198 -7.945 1.00 0.00 O ATOM 1886 CB LYS B 30 157.655 -2.395 -8.915 1.00 0.00 C ATOM 1887 CG LYS B 30 156.346 -3.183 -8.844 1.00 0.00 C ATOM 1888 CD LYS B 30 156.641 -4.627 -8.434 1.00 0.00 C ATOM 1889 CE LYS B 30 155.352 -5.449 -8.500 1.00 0.00 C ATOM 1890 NZ LYS B 30 155.691 -6.899 -8.584 1.00 0.00 N ATOM 0 H LYS B 30 157.172 -1.507 -11.238 1.00 0.00 H new ATOM 0 HA LYS B 30 156.599 -0.556 -8.532 1.00 0.00 H new ATOM 0 HB2 LYS B 30 158.303 -2.815 -9.684 1.00 0.00 H new ATOM 0 HB3 LYS B 30 158.191 -2.473 -7.969 1.00 0.00 H new ATOM 0 HG2 LYS B 30 155.669 -2.721 -8.125 1.00 0.00 H new ATOM 0 HG3 LYS B 30 155.845 -3.164 -9.812 1.00 0.00 H new ATOM 0 HD2 LYS B 30 157.394 -5.057 -9.095 1.00 0.00 H new ATOM 0 HD3 LYS B 30 157.051 -4.653 -7.424 1.00 0.00 H new ATOM 0 HE2 LYS B 30 154.741 -5.258 -7.618 1.00 0.00 H new ATOM 0 HE3 LYS B 30 154.762 -5.152 -9.367 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 154.832 -7.445 -8.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 156.393 -7.048 -9.337 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 156.085 -7.217 -7.675 1.00 0.00 H new ATOM 1904 N LYS B 31 159.230 0.275 -10.185 1.00 0.00 N ATOM 1905 CA LYS B 31 160.451 1.072 -10.150 1.00 0.00 C ATOM 1906 C LYS B 31 160.185 2.433 -9.514 1.00 0.00 C ATOM 1907 O LYS B 31 160.789 2.783 -8.500 1.00 0.00 O ATOM 1908 CB LYS B 31 160.989 1.266 -11.569 1.00 0.00 C ATOM 1909 CG LYS B 31 161.577 -0.051 -12.078 1.00 0.00 C ATOM 1910 CD LYS B 31 162.220 0.172 -13.449 1.00 0.00 C ATOM 1911 CE LYS B 31 162.876 -1.127 -13.923 1.00 0.00 C ATOM 1912 NZ LYS B 31 162.971 -1.120 -15.411 1.00 0.00 N ATOM 0 H LYS B 31 158.901 0.040 -11.122 1.00 0.00 H new ATOM 0 HA LYS B 31 161.191 0.542 -9.550 1.00 0.00 H new ATOM 0 HB2 LYS B 31 160.189 1.598 -12.230 1.00 0.00 H new ATOM 0 HB3 LYS B 31 161.752 2.044 -11.576 1.00 0.00 H new ATOM 0 HG2 LYS B 31 162.319 -0.426 -11.373 1.00 0.00 H new ATOM 0 HG3 LYS B 31 160.795 -0.807 -12.150 1.00 0.00 H new ATOM 0 HD2 LYS B 31 161.467 0.495 -14.168 1.00 0.00 H new ATOM 0 HD3 LYS B 31 162.964 0.966 -13.389 1.00 0.00 H new ATOM 0 HE2 LYS B 31 163.869 -1.227 -13.485 1.00 0.00 H new ATOM 0 HE3 LYS B 31 162.292 -1.985 -13.589 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 163.417 -2.002 -15.735 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 162.018 -1.044 -15.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 163.545 -0.309 -15.718 1.00 0.00 H new ATOM 1926 N GLN B 32 159.278 3.195 -10.116 1.00 0.00 N ATOM 1927 CA GLN B 32 158.939 4.515 -9.599 1.00 0.00 C ATOM 1928 C GLN B 32 158.301 4.401 -8.218 1.00 0.00 C ATOM 1929 O GLN B 32 158.456 5.285 -7.375 1.00 0.00 O ATOM 1930 CB GLN B 32 157.971 5.218 -10.554 1.00 0.00 C ATOM 1931 CG GLN B 32 158.661 5.454 -11.899 1.00 0.00 C ATOM 1932 CD GLN B 32 159.820 6.431 -11.727 1.00 0.00 C ATOM 1933 OE1 GLN B 32 159.703 7.410 -10.990 1.00 0.00 O ATOM 1934 NE2 GLN B 32 160.937 6.223 -12.367 1.00 0.00 N ATOM 0 H GLN B 32 158.768 2.924 -10.956 1.00 0.00 H new ATOM 0 HA GLN B 32 159.856 5.099 -9.517 1.00 0.00 H new ATOM 0 HB2 GLN B 32 157.077 4.611 -10.694 1.00 0.00 H new ATOM 0 HB3 GLN B 32 157.648 6.168 -10.127 1.00 0.00 H new ATOM 0 HG2 GLN B 32 159.028 4.509 -12.300 1.00 0.00 H new ATOM 0 HG3 GLN B 32 157.945 5.849 -12.620 1.00 0.00 H new ATOM 0 HE21 GLN B 32 161.032 5.411 -12.977 1.00 0.00 H new ATOM 0 HE22 GLN B 32 161.716 6.872 -12.257 1.00 0.00 H new ATOM 1943 N LEU B 33 157.580 3.307 -7.994 1.00 0.00 N ATOM 1944 CA LEU B 33 156.920 3.083 -6.712 1.00 0.00 C ATOM 1945 C LEU B 33 157.891 3.320 -5.560 1.00 0.00 C ATOM 1946 O LEU B 33 157.552 3.975 -4.574 1.00 0.00 O ATOM 1947 CB LEU B 33 156.382 1.652 -6.649 1.00 0.00 C ATOM 1948 CG LEU B 33 155.593 1.451 -5.352 1.00 0.00 C ATOM 1949 CD1 LEU B 33 154.338 2.331 -5.369 1.00 0.00 C ATOM 1950 CD2 LEU B 33 155.185 -0.019 -5.231 1.00 0.00 C ATOM 0 H LEU B 33 157.438 2.565 -8.679 1.00 0.00 H new ATOM 0 HA LEU B 33 156.092 3.786 -6.620 1.00 0.00 H new ATOM 0 HB2 LEU B 33 155.742 1.456 -7.509 1.00 0.00 H new ATOM 0 HB3 LEU B 33 157.207 0.941 -6.698 1.00 0.00 H new ATOM 0 HG LEU B 33 156.215 1.730 -4.502 1.00 0.00 H new ATOM 0 HD11 LEU B 33 153.779 2.185 -4.445 1.00 0.00 H new ATOM 0 HD12 LEU B 33 154.629 3.378 -5.456 1.00 0.00 H new ATOM 0 HD13 LEU B 33 153.712 2.056 -6.218 1.00 0.00 H new ATOM 0 HD21 LEU B 33 154.623 -0.166 -4.309 1.00 0.00 H new ATOM 0 HD22 LEU B 33 154.563 -0.295 -6.083 1.00 0.00 H new ATOM 0 HD23 LEU B 33 156.078 -0.644 -5.215 1.00 0.00 H new ATOM 1962 N LYS B 34 159.099 2.783 -5.690 1.00 0.00 N ATOM 1963 CA LYS B 34 160.113 2.941 -4.653 1.00 0.00 C ATOM 1964 C LYS B 34 160.605 4.385 -4.597 1.00 0.00 C ATOM 1965 O LYS B 34 161.080 4.847 -3.560 1.00 0.00 O ATOM 1966 CB LYS B 34 161.292 2.008 -4.930 1.00 0.00 C ATOM 1967 CG LYS B 34 162.245 2.018 -3.734 1.00 0.00 C ATOM 1968 CD LYS B 34 163.478 1.171 -4.055 1.00 0.00 C ATOM 1969 CE LYS B 34 164.292 0.948 -2.779 1.00 0.00 C ATOM 1970 NZ LYS B 34 165.284 -0.142 -3.008 1.00 0.00 N ATOM 0 H LYS B 34 159.399 2.238 -6.498 1.00 0.00 H new ATOM 0 HA LYS B 34 159.665 2.686 -3.692 1.00 0.00 H new ATOM 0 HB2 LYS B 34 160.932 0.995 -5.113 1.00 0.00 H new ATOM 0 HB3 LYS B 34 161.818 2.327 -5.830 1.00 0.00 H new ATOM 0 HG2 LYS B 34 162.544 3.040 -3.502 1.00 0.00 H new ATOM 0 HG3 LYS B 34 161.741 1.625 -2.851 1.00 0.00 H new ATOM 0 HD2 LYS B 34 163.174 0.213 -4.477 1.00 0.00 H new ATOM 0 HD3 LYS B 34 164.090 1.671 -4.806 1.00 0.00 H new ATOM 0 HE2 LYS B 34 164.804 1.867 -2.496 1.00 0.00 H new ATOM 0 HE3 LYS B 34 163.630 0.685 -1.954 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 165.838 -0.295 -2.141 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 164.784 -1.019 -3.259 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 165.922 0.127 -3.784 1.00 0.00 H new ATOM 1984 N GLU B 35 160.493 5.088 -5.718 1.00 0.00 N ATOM 1985 CA GLU B 35 160.938 6.476 -5.785 1.00 0.00 C ATOM 1986 C GLU B 35 159.890 7.417 -5.195 1.00 0.00 C ATOM 1987 O GLU B 35 160.176 8.174 -4.268 1.00 0.00 O ATOM 1988 CB GLU B 35 161.212 6.866 -7.238 1.00 0.00 C ATOM 1989 CG GLU B 35 161.812 8.273 -7.287 1.00 0.00 C ATOM 1990 CD GLU B 35 162.051 8.688 -8.734 1.00 0.00 C ATOM 1991 OE1 GLU B 35 161.592 7.983 -9.616 1.00 0.00 O ATOM 1992 OE2 GLU B 35 162.691 9.706 -8.939 1.00 0.00 O ATOM 0 H GLU B 35 160.101 4.724 -6.587 1.00 0.00 H new ATOM 0 HA GLU B 35 161.854 6.566 -5.201 1.00 0.00 H new ATOM 0 HB2 GLU B 35 161.897 6.151 -7.694 1.00 0.00 H new ATOM 0 HB3 GLU B 35 160.287 6.834 -7.814 1.00 0.00 H new ATOM 0 HG2 GLU B 35 161.139 8.981 -6.803 1.00 0.00 H new ATOM 0 HG3 GLU B 35 162.751 8.296 -6.734 1.00 0.00 H new ATOM 1999 N LEU B 36 158.679 7.371 -5.742 1.00 0.00 N ATOM 2000 CA LEU B 36 157.604 8.233 -5.263 1.00 0.00 C ATOM 2001 C LEU B 36 157.271 7.936 -3.804 1.00 0.00 C ATOM 2002 O LEU B 36 156.863 8.827 -3.059 1.00 0.00 O ATOM 2003 CB LEU B 36 156.353 8.049 -6.131 1.00 0.00 C ATOM 2004 CG LEU B 36 155.827 6.603 -6.010 1.00 0.00 C ATOM 2005 CD1 LEU B 36 154.676 6.545 -4.998 1.00 0.00 C ATOM 2006 CD2 LEU B 36 155.317 6.124 -7.376 1.00 0.00 C ATOM 0 H LEU B 36 158.419 6.752 -6.510 1.00 0.00 H new ATOM 0 HA LEU B 36 157.943 9.267 -5.334 1.00 0.00 H new ATOM 0 HB2 LEU B 36 155.580 8.752 -5.821 1.00 0.00 H new ATOM 0 HB3 LEU B 36 156.588 8.272 -7.172 1.00 0.00 H new ATOM 0 HG LEU B 36 156.640 5.960 -5.672 1.00 0.00 H new ATOM 0 HD11 LEU B 36 154.312 5.521 -4.920 1.00 0.00 H new ATOM 0 HD12 LEU B 36 155.031 6.879 -4.023 1.00 0.00 H new ATOM 0 HD13 LEU B 36 153.866 7.194 -5.331 1.00 0.00 H new ATOM 0 HD21 LEU B 36 154.946 5.103 -7.288 1.00 0.00 H new ATOM 0 HD22 LEU B 36 154.510 6.775 -7.712 1.00 0.00 H new ATOM 0 HD23 LEU B 36 156.132 6.153 -8.099 1.00 0.00 H new ATOM 2018 N LEU B 37 157.445 6.681 -3.399 1.00 0.00 N ATOM 2019 CA LEU B 37 157.154 6.291 -2.023 1.00 0.00 C ATOM 2020 C LEU B 37 157.885 7.207 -1.043 1.00 0.00 C ATOM 2021 O LEU B 37 157.290 7.718 -0.095 1.00 0.00 O ATOM 2022 CB LEU B 37 157.577 4.831 -1.788 1.00 0.00 C ATOM 2023 CG LEU B 37 156.384 3.891 -2.011 1.00 0.00 C ATOM 2024 CD1 LEU B 37 156.877 2.442 -2.021 1.00 0.00 C ATOM 2025 CD2 LEU B 37 155.351 4.075 -0.884 1.00 0.00 C ATOM 0 H LEU B 37 157.782 5.925 -3.995 1.00 0.00 H new ATOM 0 HA LEU B 37 156.081 6.384 -1.856 1.00 0.00 H new ATOM 0 HB2 LEU B 37 158.389 4.567 -2.465 1.00 0.00 H new ATOM 0 HB3 LEU B 37 157.957 4.714 -0.773 1.00 0.00 H new ATOM 0 HG LEU B 37 155.914 4.127 -2.966 1.00 0.00 H new ATOM 0 HD11 LEU B 37 156.032 1.771 -2.179 1.00 0.00 H new ATOM 0 HD12 LEU B 37 157.601 2.310 -2.825 1.00 0.00 H new ATOM 0 HD13 LEU B 37 157.349 2.212 -1.066 1.00 0.00 H new ATOM 0 HD21 LEU B 37 154.508 3.404 -1.050 1.00 0.00 H new ATOM 0 HD22 LEU B 37 155.814 3.845 0.075 1.00 0.00 H new ATOM 0 HD23 LEU B 37 154.998 5.106 -0.878 1.00 0.00 H new ATOM 2037 N GLN B 38 159.178 7.408 -1.277 1.00 0.00 N ATOM 2038 CA GLN B 38 159.979 8.262 -0.406 1.00 0.00 C ATOM 2039 C GLN B 38 159.638 9.733 -0.625 1.00 0.00 C ATOM 2040 O GLN B 38 159.378 10.468 0.327 1.00 0.00 O ATOM 2041 CB GLN B 38 161.467 8.036 -0.677 1.00 0.00 C ATOM 2042 CG GLN B 38 161.745 6.535 -0.785 1.00 0.00 C ATOM 2043 CD GLN B 38 161.186 5.813 0.436 1.00 0.00 C ATOM 2044 OE1 GLN B 38 159.910 5.546 0.497 1.00 0.00 O flip ATOM 2045 NE2 GLN B 38 161.931 5.484 1.358 1.00 0.00 N flip ATOM 0 H GLN B 38 159.691 6.995 -2.056 1.00 0.00 H new ATOM 0 HA GLN B 38 159.753 8.002 0.628 1.00 0.00 H new ATOM 0 HB2 GLN B 38 161.760 8.538 -1.599 1.00 0.00 H new ATOM 0 HB3 GLN B 38 162.064 8.470 0.125 1.00 0.00 H new ATOM 0 HG2 GLN B 38 161.291 6.137 -1.693 1.00 0.00 H new ATOM 0 HG3 GLN B 38 162.818 6.360 -0.862 1.00 0.00 H new ATOM 0 HE21 GLN B 38 162.928 5.694 1.308 1.00 0.00 H new ATOM 0 HE22 GLN B 38 161.552 5.001 2.173 1.00 0.00 H new ATOM 2054 N THR B 39 159.645 10.156 -1.884 1.00 0.00 N ATOM 2055 CA THR B 39 159.340 11.545 -2.215 1.00 0.00 C ATOM 2056 C THR B 39 157.976 11.945 -1.660 1.00 0.00 C ATOM 2057 O THR B 39 157.807 13.047 -1.141 1.00 0.00 O ATOM 2058 CB THR B 39 159.349 11.735 -3.734 1.00 0.00 C ATOM 2059 OG1 THR B 39 160.545 11.185 -4.270 1.00 0.00 O ATOM 2060 CG2 THR B 39 159.279 13.227 -4.063 1.00 0.00 C ATOM 0 H THR B 39 159.856 9.564 -2.687 1.00 0.00 H new ATOM 0 HA THR B 39 160.103 12.180 -1.764 1.00 0.00 H new ATOM 0 HB THR B 39 158.488 11.229 -4.170 1.00 0.00 H new ATOM 0 HG1 THR B 39 160.418 10.228 -4.438 1.00 0.00 H new ATOM 0 HG21 THR B 39 159.285 13.362 -5.145 1.00 0.00 H new ATOM 0 HG22 THR B 39 158.362 13.648 -3.650 1.00 0.00 H new ATOM 0 HG23 THR B 39 160.139 13.736 -3.629 1.00 0.00 H new ATOM 2068 N GLU B 40 157.008 11.043 -1.775 1.00 0.00 N ATOM 2069 CA GLU B 40 155.662 11.316 -1.284 1.00 0.00 C ATOM 2070 C GLU B 40 155.594 11.127 0.229 1.00 0.00 C ATOM 2071 O GLU B 40 154.603 11.489 0.863 1.00 0.00 O ATOM 2072 CB GLU B 40 154.658 10.381 -1.961 1.00 0.00 C ATOM 2073 CG GLU B 40 154.566 10.720 -3.450 1.00 0.00 C ATOM 2074 CD GLU B 40 153.997 12.124 -3.632 1.00 0.00 C ATOM 2075 OE1 GLU B 40 153.431 12.639 -2.682 1.00 0.00 O ATOM 2076 OE2 GLU B 40 154.137 12.662 -4.717 1.00 0.00 O ATOM 0 H GLU B 40 157.128 10.124 -2.200 1.00 0.00 H new ATOM 0 HA GLU B 40 155.413 12.350 -1.522 1.00 0.00 H new ATOM 0 HB2 GLU B 40 154.967 9.344 -1.832 1.00 0.00 H new ATOM 0 HB3 GLU B 40 153.679 10.482 -1.493 1.00 0.00 H new ATOM 0 HG2 GLU B 40 155.553 10.657 -3.907 1.00 0.00 H new ATOM 0 HG3 GLU B 40 153.932 9.993 -3.958 1.00 0.00 H new ATOM 2083 N LEU B 41 156.652 10.557 0.800 1.00 0.00 N ATOM 2084 CA LEU B 41 156.701 10.320 2.242 1.00 0.00 C ATOM 2085 C LEU B 41 157.998 10.865 2.832 1.00 0.00 C ATOM 2086 O LEU B 41 158.030 11.973 3.367 1.00 0.00 O ATOM 2087 CB LEU B 41 156.601 8.820 2.525 1.00 0.00 C ATOM 2088 CG LEU B 41 155.329 8.264 1.879 1.00 0.00 C ATOM 2089 CD1 LEU B 41 155.334 6.736 1.974 1.00 0.00 C ATOM 2090 CD2 LEU B 41 154.100 8.814 2.608 1.00 0.00 C ATOM 0 H LEU B 41 157.482 10.252 0.291 1.00 0.00 H new ATOM 0 HA LEU B 41 155.860 10.836 2.706 1.00 0.00 H new ATOM 0 HB2 LEU B 41 157.477 8.305 2.131 1.00 0.00 H new ATOM 0 HB3 LEU B 41 156.584 8.642 3.600 1.00 0.00 H new ATOM 0 HG LEU B 41 155.295 8.565 0.832 1.00 0.00 H new ATOM 0 HD11 LEU B 41 154.429 6.340 1.514 1.00 0.00 H new ATOM 0 HD12 LEU B 41 156.207 6.342 1.454 1.00 0.00 H new ATOM 0 HD13 LEU B 41 155.370 6.437 3.021 1.00 0.00 H new ATOM 0 HD21 LEU B 41 153.196 8.417 2.147 1.00 0.00 H new ATOM 0 HD22 LEU B 41 154.134 8.515 3.656 1.00 0.00 H new ATOM 0 HD23 LEU B 41 154.094 9.902 2.541 1.00 0.00 H new ATOM 2102 N SER B 42 159.065 10.077 2.735 1.00 0.00 N ATOM 2103 CA SER B 42 160.359 10.492 3.265 1.00 0.00 C ATOM 2104 C SER B 42 160.250 10.820 4.751 1.00 0.00 C ATOM 2105 O SER B 42 160.703 11.874 5.198 1.00 0.00 O ATOM 2106 CB SER B 42 160.868 11.717 2.506 1.00 0.00 C ATOM 2107 OG SER B 42 162.012 12.238 3.170 1.00 0.00 O ATOM 0 H SER B 42 159.060 9.155 2.298 1.00 0.00 H new ATOM 0 HA SER B 42 161.062 9.669 3.137 1.00 0.00 H new ATOM 0 HB2 SER B 42 161.120 11.445 1.481 1.00 0.00 H new ATOM 0 HB3 SER B 42 160.087 12.476 2.452 1.00 0.00 H new ATOM 0 HG SER B 42 161.746 12.610 4.037 1.00 0.00 H new ATOM 2113 N GLY B 43 159.645 9.912 5.510 1.00 0.00 N ATOM 2114 CA GLY B 43 159.482 10.118 6.945 1.00 0.00 C ATOM 2115 C GLY B 43 159.229 8.796 7.662 1.00 0.00 C ATOM 2116 O GLY B 43 159.849 8.506 8.685 1.00 0.00 O ATOM 0 H GLY B 43 159.262 9.034 5.160 1.00 0.00 H new ATOM 0 HA2 GLY B 43 160.376 10.591 7.352 1.00 0.00 H new ATOM 0 HA3 GLY B 43 158.650 10.799 7.126 1.00 0.00 H new ATOM 2120 N PHE B 44 158.313 8.000 7.119 1.00 0.00 N ATOM 2121 CA PHE B 44 157.984 6.711 7.719 1.00 0.00 C ATOM 2122 C PHE B 44 159.224 5.824 7.803 1.00 0.00 C ATOM 2123 O PHE B 44 159.311 4.944 8.660 1.00 0.00 O ATOM 2124 CB PHE B 44 156.908 6.007 6.889 1.00 0.00 C ATOM 2125 CG PHE B 44 155.564 6.645 7.153 1.00 0.00 C ATOM 2126 CD1 PHE B 44 154.999 6.587 8.433 1.00 0.00 C ATOM 2127 CD2 PHE B 44 154.882 7.293 6.115 1.00 0.00 C ATOM 2128 CE1 PHE B 44 153.753 7.177 8.675 1.00 0.00 C ATOM 2129 CE2 PHE B 44 153.636 7.883 6.358 1.00 0.00 C ATOM 2130 CZ PHE B 44 153.071 7.825 7.638 1.00 0.00 C ATOM 0 H PHE B 44 157.789 8.222 6.272 1.00 0.00 H new ATOM 0 HA PHE B 44 157.609 6.888 8.727 1.00 0.00 H new ATOM 0 HB2 PHE B 44 157.151 6.074 5.829 1.00 0.00 H new ATOM 0 HB3 PHE B 44 156.875 4.947 7.142 1.00 0.00 H new ATOM 0 HD1 PHE B 44 155.525 6.087 9.233 1.00 0.00 H new ATOM 0 HD2 PHE B 44 155.317 7.337 5.128 1.00 0.00 H new ATOM 0 HE1 PHE B 44 153.317 7.132 9.662 1.00 0.00 H new ATOM 0 HE2 PHE B 44 153.110 8.383 5.558 1.00 0.00 H new ATOM 0 HZ PHE B 44 152.110 8.280 7.825 1.00 0.00 H new ATOM 2140 N LEU B 45 160.179 6.058 6.908 1.00 0.00 N ATOM 2141 CA LEU B 45 161.405 5.268 6.893 1.00 0.00 C ATOM 2142 C LEU B 45 162.364 5.743 7.982 1.00 0.00 C ATOM 2143 O LEU B 45 163.352 5.074 8.287 1.00 0.00 O ATOM 2144 CB LEU B 45 162.082 5.375 5.521 1.00 0.00 C ATOM 2145 CG LEU B 45 161.776 6.743 4.899 1.00 0.00 C ATOM 2146 CD1 LEU B 45 162.916 7.148 3.961 1.00 0.00 C ATOM 2147 CD2 LEU B 45 160.468 6.665 4.103 1.00 0.00 C ATOM 0 H LEU B 45 160.129 6.781 6.190 1.00 0.00 H new ATOM 0 HA LEU B 45 161.147 4.227 7.086 1.00 0.00 H new ATOM 0 HB2 LEU B 45 163.159 5.245 5.625 1.00 0.00 H new ATOM 0 HB3 LEU B 45 161.727 4.579 4.866 1.00 0.00 H new ATOM 0 HG LEU B 45 161.677 7.484 5.692 1.00 0.00 H new ATOM 0 HD11 LEU B 45 162.696 8.120 3.520 1.00 0.00 H new ATOM 0 HD12 LEU B 45 163.847 7.207 4.524 1.00 0.00 H new ATOM 0 HD13 LEU B 45 163.017 6.405 3.170 1.00 0.00 H new ATOM 0 HD21 LEU B 45 160.252 7.638 3.662 1.00 0.00 H new ATOM 0 HD22 LEU B 45 160.567 5.922 3.312 1.00 0.00 H new ATOM 0 HD23 LEU B 45 159.653 6.380 4.769 1.00 0.00 H new ATOM 2159 N ASP B 46 162.068 6.900 8.564 1.00 0.00 N ATOM 2160 CA ASP B 46 162.914 7.453 9.616 1.00 0.00 C ATOM 2161 C ASP B 46 162.494 6.919 10.982 1.00 0.00 C ATOM 2162 O ASP B 46 162.992 7.366 12.014 1.00 0.00 O ATOM 2163 CB ASP B 46 162.822 8.980 9.612 1.00 0.00 C ATOM 2164 CG ASP B 46 163.849 9.566 10.576 1.00 0.00 C ATOM 2165 OD1 ASP B 46 164.637 8.801 11.109 1.00 0.00 O ATOM 2166 OD2 ASP B 46 163.833 10.770 10.767 1.00 0.00 O ATOM 0 H ASP B 46 161.255 7.470 8.328 1.00 0.00 H new ATOM 0 HA ASP B 46 163.943 7.150 9.423 1.00 0.00 H new ATOM 0 HB2 ASP B 46 162.997 9.361 8.606 1.00 0.00 H new ATOM 0 HB3 ASP B 46 161.819 9.293 9.902 1.00 0.00 H new ATOM 2171 N ALA B 47 161.573 5.960 10.979 1.00 0.00 N ATOM 2172 CA ALA B 47 161.093 5.373 12.226 1.00 0.00 C ATOM 2173 C ALA B 47 160.562 3.964 11.984 1.00 0.00 C ATOM 2174 O ALA B 47 159.374 3.698 12.168 1.00 0.00 O ATOM 2175 CB ALA B 47 159.985 6.243 12.821 1.00 0.00 C ATOM 0 H ALA B 47 161.147 5.576 10.136 1.00 0.00 H new ATOM 0 HA ALA B 47 161.927 5.320 12.926 1.00 0.00 H new ATOM 0 HB1 ALA B 47 159.633 5.798 13.751 1.00 0.00 H new ATOM 0 HB2 ALA B 47 160.374 7.241 13.021 1.00 0.00 H new ATOM 0 HB3 ALA B 47 159.157 6.311 12.115 1.00 0.00 H new ATOM 2181 N GLN B 48 161.451 3.066 11.569 1.00 0.00 N ATOM 2182 CA GLN B 48 161.061 1.686 11.303 1.00 0.00 C ATOM 2183 C GLN B 48 161.319 0.808 12.523 1.00 0.00 C ATOM 2184 O GLN B 48 162.467 0.579 12.903 1.00 0.00 O ATOM 2185 CB GLN B 48 161.845 1.145 10.107 1.00 0.00 C ATOM 2186 CG GLN B 48 161.308 1.774 8.819 1.00 0.00 C ATOM 2187 CD GLN B 48 162.086 1.248 7.618 1.00 0.00 C ATOM 2188 OE1 GLN B 48 163.285 0.985 7.719 1.00 0.00 O ATOM 2189 NE2 GLN B 48 161.471 1.078 6.479 1.00 0.00 N ATOM 0 H GLN B 48 162.438 3.267 11.411 1.00 0.00 H new ATOM 0 HA GLN B 48 159.995 1.667 11.078 1.00 0.00 H new ATOM 0 HB2 GLN B 48 162.905 1.372 10.221 1.00 0.00 H new ATOM 0 HB3 GLN B 48 161.754 0.060 10.060 1.00 0.00 H new ATOM 0 HG2 GLN B 48 160.249 1.543 8.706 1.00 0.00 H new ATOM 0 HG3 GLN B 48 161.394 2.859 8.871 1.00 0.00 H new ATOM 0 HE21 GLN B 48 160.478 1.297 6.398 1.00 0.00 H new ATOM 0 HE22 GLN B 48 161.984 0.727 5.670 1.00 0.00 H new ATOM 2198 N LYS B 49 160.243 0.320 13.131 1.00 0.00 N ATOM 2199 CA LYS B 49 160.363 -0.535 14.307 1.00 0.00 C ATOM 2200 C LYS B 49 160.358 -2.005 13.902 1.00 0.00 C ATOM 2201 O LYS B 49 161.350 -2.711 14.078 1.00 0.00 O ATOM 2202 CB LYS B 49 159.205 -0.264 15.270 1.00 0.00 C ATOM 2203 CG LYS B 49 159.387 1.111 15.915 1.00 0.00 C ATOM 2204 CD LYS B 49 158.313 1.321 16.984 1.00 0.00 C ATOM 2205 CE LYS B 49 158.526 2.675 17.664 1.00 0.00 C ATOM 2206 NZ LYS B 49 158.403 3.764 16.653 1.00 0.00 N ATOM 0 H LYS B 49 159.285 0.500 12.832 1.00 0.00 H new ATOM 0 HA LYS B 49 161.307 -0.310 14.803 1.00 0.00 H new ATOM 0 HB2 LYS B 49 158.256 -0.303 14.735 1.00 0.00 H new ATOM 0 HB3 LYS B 49 159.169 -1.036 16.039 1.00 0.00 H new ATOM 0 HG2 LYS B 49 160.379 1.186 16.361 1.00 0.00 H new ATOM 0 HG3 LYS B 49 159.318 1.892 15.157 1.00 0.00 H new ATOM 0 HD2 LYS B 49 157.322 1.281 16.532 1.00 0.00 H new ATOM 0 HD3 LYS B 49 158.358 0.520 17.722 1.00 0.00 H new ATOM 0 HE2 LYS B 49 157.791 2.815 18.457 1.00 0.00 H new ATOM 0 HE3 LYS B 49 159.510 2.708 18.132 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 158.242 4.670 17.137 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 159.279 3.820 16.095 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 157.602 3.562 16.021 1.00 0.00 H new ATOM 2220 N ASP B 50 159.233 -2.458 13.357 1.00 0.00 N ATOM 2221 CA ASP B 50 159.110 -3.846 12.928 1.00 0.00 C ATOM 2222 C ASP B 50 160.135 -4.164 11.844 1.00 0.00 C ATOM 2223 O ASP B 50 160.591 -3.273 11.129 1.00 0.00 O ATOM 2224 CB ASP B 50 157.700 -4.103 12.391 1.00 0.00 C ATOM 2225 CG ASP B 50 156.677 -3.933 13.509 1.00 0.00 C ATOM 2226 OD1 ASP B 50 157.089 -3.837 14.653 1.00 0.00 O ATOM 2227 OD2 ASP B 50 155.496 -3.903 13.205 1.00 0.00 O ATOM 0 H ASP B 50 158.400 -1.889 13.203 1.00 0.00 H new ATOM 0 HA ASP B 50 159.295 -4.491 13.787 1.00 0.00 H new ATOM 0 HB2 ASP B 50 157.480 -3.412 11.578 1.00 0.00 H new ATOM 0 HB3 ASP B 50 157.637 -5.110 11.979 1.00 0.00 H new ATOM 2232 N VAL B 51 160.495 -5.439 11.729 1.00 0.00 N ATOM 2233 CA VAL B 51 161.472 -5.868 10.730 1.00 0.00 C ATOM 2234 C VAL B 51 160.800 -6.736 9.669 1.00 0.00 C ATOM 2235 O VAL B 51 160.840 -6.424 8.480 1.00 0.00 O ATOM 2236 CB VAL B 51 162.597 -6.661 11.408 1.00 0.00 C ATOM 2237 CG1 VAL B 51 163.925 -6.404 10.690 1.00 0.00 C ATOM 2238 CG2 VAL B 51 162.714 -6.218 12.866 1.00 0.00 C ATOM 0 H VAL B 51 160.128 -6.191 12.312 1.00 0.00 H new ATOM 0 HA VAL B 51 161.891 -4.984 10.250 1.00 0.00 H new ATOM 0 HB VAL B 51 162.367 -7.725 11.361 1.00 0.00 H new ATOM 0 HG11 VAL B 51 164.718 -6.971 11.178 1.00 0.00 H new ATOM 0 HG12 VAL B 51 163.843 -6.717 9.649 1.00 0.00 H new ATOM 0 HG13 VAL B 51 164.161 -5.341 10.731 1.00 0.00 H new ATOM 0 HG21 VAL B 51 163.512 -6.778 13.354 1.00 0.00 H new ATOM 0 HG22 VAL B 51 162.942 -5.153 12.905 1.00 0.00 H new ATOM 0 HG23 VAL B 51 161.772 -6.407 13.380 1.00 0.00 H new ATOM 2248 N ASP B 52 160.190 -7.830 10.112 1.00 0.00 N ATOM 2249 CA ASP B 52 159.518 -8.740 9.196 1.00 0.00 C ATOM 2250 C ASP B 52 158.567 -7.977 8.279 1.00 0.00 C ATOM 2251 O ASP B 52 158.568 -8.175 7.064 1.00 0.00 O ATOM 2252 CB ASP B 52 158.736 -9.792 9.984 1.00 0.00 C ATOM 2253 CG ASP B 52 157.842 -9.111 11.015 1.00 0.00 C ATOM 2254 OD1 ASP B 52 158.207 -8.041 11.472 1.00 0.00 O ATOM 2255 OD2 ASP B 52 156.806 -9.671 11.335 1.00 0.00 O ATOM 0 H ASP B 52 160.148 -8.106 11.093 1.00 0.00 H new ATOM 0 HA ASP B 52 160.275 -9.232 8.585 1.00 0.00 H new ATOM 0 HB2 ASP B 52 158.130 -10.392 9.305 1.00 0.00 H new ATOM 0 HB3 ASP B 52 159.426 -10.473 10.482 1.00 0.00 H new ATOM 2260 N ALA B 53 157.758 -7.104 8.870 1.00 0.00 N ATOM 2261 CA ALA B 53 156.806 -6.315 8.096 1.00 0.00 C ATOM 2262 C ALA B 53 157.538 -5.343 7.176 1.00 0.00 C ATOM 2263 O ALA B 53 157.137 -5.136 6.031 1.00 0.00 O ATOM 2264 CB ALA B 53 155.886 -5.536 9.038 1.00 0.00 C ATOM 0 H ALA B 53 157.742 -6.926 9.874 1.00 0.00 H new ATOM 0 HA ALA B 53 156.210 -6.994 7.487 1.00 0.00 H new ATOM 0 HB1 ALA B 53 155.178 -4.949 8.452 1.00 0.00 H new ATOM 0 HB2 ALA B 53 155.341 -6.234 9.674 1.00 0.00 H new ATOM 0 HB3 ALA B 53 156.483 -4.869 9.660 1.00 0.00 H new ATOM 2270 N VAL B 54 158.613 -4.750 7.686 1.00 0.00 N ATOM 2271 CA VAL B 54 159.392 -3.802 6.900 1.00 0.00 C ATOM 2272 C VAL B 54 160.078 -4.507 5.734 1.00 0.00 C ATOM 2273 O VAL B 54 160.338 -3.900 4.696 1.00 0.00 O ATOM 2274 CB VAL B 54 160.445 -3.131 7.785 1.00 0.00 C ATOM 2275 CG1 VAL B 54 161.379 -2.287 6.916 1.00 0.00 C ATOM 2276 CG2 VAL B 54 159.748 -2.230 8.807 1.00 0.00 C ATOM 0 H VAL B 54 158.962 -4.908 8.632 1.00 0.00 H new ATOM 0 HA VAL B 54 158.715 -3.045 6.503 1.00 0.00 H new ATOM 0 HB VAL B 54 161.024 -3.894 8.305 1.00 0.00 H new ATOM 0 HG11 VAL B 54 162.129 -1.809 7.546 1.00 0.00 H new ATOM 0 HG12 VAL B 54 161.873 -2.927 6.185 1.00 0.00 H new ATOM 0 HG13 VAL B 54 160.801 -1.523 6.397 1.00 0.00 H new ATOM 0 HG21 VAL B 54 160.496 -1.751 9.439 1.00 0.00 H new ATOM 0 HG22 VAL B 54 159.171 -1.467 8.285 1.00 0.00 H new ATOM 0 HG23 VAL B 54 159.081 -2.830 9.426 1.00 0.00 H new ATOM 2286 N ASP B 55 160.364 -5.792 5.914 1.00 0.00 N ATOM 2287 CA ASP B 55 161.016 -6.572 4.869 1.00 0.00 C ATOM 2288 C ASP B 55 159.989 -7.070 3.858 1.00 0.00 C ATOM 2289 O ASP B 55 160.331 -7.422 2.729 1.00 0.00 O ATOM 2290 CB ASP B 55 161.749 -7.764 5.485 1.00 0.00 C ATOM 2291 CG ASP B 55 162.608 -8.451 4.430 1.00 0.00 C ATOM 2292 OD1 ASP B 55 163.150 -7.752 3.588 1.00 0.00 O ATOM 2293 OD2 ASP B 55 162.714 -9.666 4.477 1.00 0.00 O ATOM 0 H ASP B 55 160.157 -6.312 6.767 1.00 0.00 H new ATOM 0 HA ASP B 55 161.735 -5.932 4.357 1.00 0.00 H new ATOM 0 HB2 ASP B 55 162.374 -7.429 6.313 1.00 0.00 H new ATOM 0 HB3 ASP B 55 161.029 -8.471 5.896 1.00 0.00 H new ATOM 2298 N LYS B 56 158.727 -7.100 4.275 1.00 0.00 N ATOM 2299 CA LYS B 56 157.654 -7.560 3.404 1.00 0.00 C ATOM 2300 C LYS B 56 157.613 -6.732 2.121 1.00 0.00 C ATOM 2301 O LYS B 56 157.650 -7.278 1.019 1.00 0.00 O ATOM 2302 CB LYS B 56 156.308 -7.454 4.141 1.00 0.00 C ATOM 2303 CG LYS B 56 155.413 -8.640 3.769 1.00 0.00 C ATOM 2304 CD LYS B 56 155.759 -9.836 4.658 1.00 0.00 C ATOM 2305 CE LYS B 56 154.888 -11.032 4.268 1.00 0.00 C ATOM 2306 NZ LYS B 56 155.434 -11.663 3.033 1.00 0.00 N ATOM 0 H LYS B 56 158.425 -6.813 5.206 1.00 0.00 H new ATOM 0 HA LYS B 56 157.839 -8.601 3.138 1.00 0.00 H new ATOM 0 HB2 LYS B 56 156.474 -7.437 5.218 1.00 0.00 H new ATOM 0 HB3 LYS B 56 155.813 -6.518 3.880 1.00 0.00 H new ATOM 0 HG2 LYS B 56 154.364 -8.371 3.894 1.00 0.00 H new ATOM 0 HG3 LYS B 56 155.553 -8.900 2.720 1.00 0.00 H new ATOM 0 HD2 LYS B 56 156.813 -10.090 4.550 1.00 0.00 H new ATOM 0 HD3 LYS B 56 155.598 -9.582 5.706 1.00 0.00 H new ATOM 0 HE2 LYS B 56 154.864 -11.758 5.080 1.00 0.00 H new ATOM 0 HE3 LYS B 56 153.861 -10.708 4.100 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 154.652 -11.896 2.388 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 156.085 -11.001 2.564 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 155.946 -12.532 3.285 1.00 0.00 H new ATOM 2320 N VAL B 57 157.535 -5.414 2.273 1.00 0.00 N ATOM 2321 CA VAL B 57 157.490 -4.525 1.118 1.00 0.00 C ATOM 2322 C VAL B 57 158.774 -4.638 0.304 1.00 0.00 C ATOM 2323 O VAL B 57 158.745 -4.611 -0.927 1.00 0.00 O ATOM 2324 CB VAL B 57 157.299 -3.078 1.578 1.00 0.00 C ATOM 2325 CG1 VAL B 57 158.525 -2.628 2.375 1.00 0.00 C ATOM 2326 CG2 VAL B 57 157.130 -2.174 0.355 1.00 0.00 C ATOM 0 H VAL B 57 157.502 -4.941 3.176 1.00 0.00 H new ATOM 0 HA VAL B 57 156.649 -4.819 0.490 1.00 0.00 H new ATOM 0 HB VAL B 57 156.412 -3.012 2.208 1.00 0.00 H new ATOM 0 HG11 VAL B 57 158.388 -1.597 2.702 1.00 0.00 H new ATOM 0 HG12 VAL B 57 158.649 -3.272 3.246 1.00 0.00 H new ATOM 0 HG13 VAL B 57 159.412 -2.694 1.746 1.00 0.00 H new ATOM 0 HG21 VAL B 57 156.994 -1.143 0.681 1.00 0.00 H new ATOM 0 HG22 VAL B 57 158.018 -2.242 -0.273 1.00 0.00 H new ATOM 0 HG23 VAL B 57 156.257 -2.493 -0.215 1.00 0.00 H new ATOM 2336 N MET B 58 159.899 -4.765 0.999 1.00 0.00 N ATOM 2337 CA MET B 58 161.190 -4.882 0.330 1.00 0.00 C ATOM 2338 C MET B 58 161.252 -6.159 -0.500 1.00 0.00 C ATOM 2339 O MET B 58 161.867 -6.188 -1.567 1.00 0.00 O ATOM 2340 CB MET B 58 162.315 -4.888 1.366 1.00 0.00 C ATOM 2341 CG MET B 58 163.645 -4.574 0.680 1.00 0.00 C ATOM 2342 SD MET B 58 163.755 -2.795 0.365 1.00 0.00 S ATOM 2343 CE MET B 58 164.434 -2.323 1.974 1.00 0.00 C ATOM 0 H MET B 58 159.944 -4.790 2.018 1.00 0.00 H new ATOM 0 HA MET B 58 161.312 -4.027 -0.334 1.00 0.00 H new ATOM 0 HB2 MET B 58 162.112 -4.151 2.143 1.00 0.00 H new ATOM 0 HB3 MET B 58 162.367 -5.861 1.855 1.00 0.00 H new ATOM 0 HG2 MET B 58 164.476 -4.895 1.309 1.00 0.00 H new ATOM 0 HG3 MET B 58 163.723 -5.126 -0.257 1.00 0.00 H new ATOM 0 HE1 MET B 58 164.151 -1.295 2.201 1.00 0.00 H new ATOM 0 HE2 MET B 58 164.040 -2.986 2.744 1.00 0.00 H new ATOM 0 HE3 MET B 58 165.521 -2.403 1.948 1.00 0.00 H new ATOM 2353 N LYS B 59 160.614 -7.214 -0.004 1.00 0.00 N ATOM 2354 CA LYS B 59 160.605 -8.491 -0.710 1.00 0.00 C ATOM 2355 C LYS B 59 160.003 -8.329 -2.103 1.00 0.00 C ATOM 2356 O LYS B 59 160.520 -8.874 -3.078 1.00 0.00 O ATOM 2357 CB LYS B 59 159.798 -9.519 0.086 1.00 0.00 C ATOM 2358 CG LYS B 59 159.659 -10.811 -0.724 1.00 0.00 C ATOM 2359 CD LYS B 59 161.043 -11.294 -1.163 1.00 0.00 C ATOM 2360 CE LYS B 59 160.985 -12.789 -1.483 1.00 0.00 C ATOM 2361 NZ LYS B 59 161.084 -13.572 -0.220 1.00 0.00 N ATOM 0 H LYS B 59 160.100 -7.211 0.877 1.00 0.00 H new ATOM 0 HA LYS B 59 161.633 -8.838 -0.812 1.00 0.00 H new ATOM 0 HB2 LYS B 59 160.292 -9.726 1.036 1.00 0.00 H new ATOM 0 HB3 LYS B 59 158.812 -9.118 0.320 1.00 0.00 H new ATOM 0 HG2 LYS B 59 159.169 -11.577 -0.124 1.00 0.00 H new ATOM 0 HG3 LYS B 59 159.029 -10.639 -1.597 1.00 0.00 H new ATOM 0 HD2 LYS B 59 161.373 -10.736 -2.039 1.00 0.00 H new ATOM 0 HD3 LYS B 59 161.772 -11.108 -0.374 1.00 0.00 H new ATOM 0 HE2 LYS B 59 160.054 -13.026 -1.998 1.00 0.00 H new ATOM 0 HE3 LYS B 59 161.799 -13.060 -2.156 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 160.638 -14.502 -0.352 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 162.085 -13.701 0.031 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 160.598 -13.061 0.544 1.00 0.00 H new ATOM 2375 N GLU B 60 158.910 -7.578 -2.187 1.00 0.00 N ATOM 2376 CA GLU B 60 158.249 -7.355 -3.468 1.00 0.00 C ATOM 2377 C GLU B 60 159.221 -6.748 -4.475 1.00 0.00 C ATOM 2378 O GLU B 60 159.218 -7.111 -5.651 1.00 0.00 O ATOM 2379 CB GLU B 60 157.052 -6.419 -3.282 1.00 0.00 C ATOM 2380 CG GLU B 60 156.286 -6.301 -4.602 1.00 0.00 C ATOM 2381 CD GLU B 60 155.180 -5.259 -4.470 1.00 0.00 C ATOM 2382 OE1 GLU B 60 155.496 -4.127 -4.144 1.00 0.00 O ATOM 2383 OE2 GLU B 60 154.033 -5.609 -4.698 1.00 0.00 O ATOM 0 H GLU B 60 158.467 -7.118 -1.392 1.00 0.00 H new ATOM 0 HA GLU B 60 157.903 -8.316 -3.849 1.00 0.00 H new ATOM 0 HB2 GLU B 60 156.395 -6.802 -2.501 1.00 0.00 H new ATOM 0 HB3 GLU B 60 157.393 -5.436 -2.958 1.00 0.00 H new ATOM 0 HG2 GLU B 60 156.968 -6.020 -5.404 1.00 0.00 H new ATOM 0 HG3 GLU B 60 155.858 -7.266 -4.871 1.00 0.00 H new ATOM 2390 N LEU B 61 160.051 -5.822 -4.006 1.00 0.00 N ATOM 2391 CA LEU B 61 161.023 -5.171 -4.875 1.00 0.00 C ATOM 2392 C LEU B 61 162.071 -6.172 -5.351 1.00 0.00 C ATOM 2393 O LEU B 61 162.449 -6.180 -6.522 1.00 0.00 O ATOM 2394 CB LEU B 61 161.709 -4.027 -4.126 1.00 0.00 C ATOM 2395 CG LEU B 61 160.652 -3.150 -3.455 1.00 0.00 C ATOM 2396 CD1 LEU B 61 161.317 -1.902 -2.871 1.00 0.00 C ATOM 2397 CD2 LEU B 61 159.606 -2.731 -4.490 1.00 0.00 C ATOM 0 H LEU B 61 160.070 -5.508 -3.036 1.00 0.00 H new ATOM 0 HA LEU B 61 160.498 -4.773 -5.743 1.00 0.00 H new ATOM 0 HB2 LEU B 61 162.393 -4.427 -3.378 1.00 0.00 H new ATOM 0 HB3 LEU B 61 162.305 -3.432 -4.817 1.00 0.00 H new ATOM 0 HG LEU B 61 160.170 -3.712 -2.655 1.00 0.00 H new ATOM 0 HD11 LEU B 61 160.562 -1.278 -2.393 1.00 0.00 H new ATOM 0 HD12 LEU B 61 162.063 -2.198 -2.134 1.00 0.00 H new ATOM 0 HD13 LEU B 61 161.800 -1.340 -3.670 1.00 0.00 H new ATOM 0 HD21 LEU B 61 158.852 -2.106 -4.012 1.00 0.00 H new ATOM 0 HD22 LEU B 61 160.090 -2.170 -5.289 1.00 0.00 H new ATOM 0 HD23 LEU B 61 159.130 -3.619 -4.907 1.00 0.00 H new ATOM 2409 N ASP B 62 162.536 -7.014 -4.434 1.00 0.00 N ATOM 2410 CA ASP B 62 163.541 -8.016 -4.769 1.00 0.00 C ATOM 2411 C ASP B 62 162.947 -9.089 -5.676 1.00 0.00 C ATOM 2412 O ASP B 62 163.634 -9.642 -6.534 1.00 0.00 O ATOM 2413 CB ASP B 62 164.077 -8.665 -3.492 1.00 0.00 C ATOM 2414 CG ASP B 62 164.796 -7.623 -2.641 1.00 0.00 C ATOM 2415 OD1 ASP B 62 165.015 -6.531 -3.137 1.00 0.00 O ATOM 2416 OD2 ASP B 62 165.117 -7.933 -1.505 1.00 0.00 O ATOM 0 H ASP B 62 162.235 -7.023 -3.459 1.00 0.00 H new ATOM 0 HA ASP B 62 164.357 -7.522 -5.296 1.00 0.00 H new ATOM 0 HB2 ASP B 62 163.256 -9.106 -2.926 1.00 0.00 H new ATOM 0 HB3 ASP B 62 164.761 -9.475 -3.745 1.00 0.00 H new ATOM 2421 N GLU B 63 161.665 -9.378 -5.477 1.00 0.00 N ATOM 2422 CA GLU B 63 160.986 -10.389 -6.281 1.00 0.00 C ATOM 2423 C GLU B 63 161.254 -10.162 -7.766 1.00 0.00 C ATOM 2424 O GLU B 63 161.343 -11.113 -8.543 1.00 0.00 O ATOM 2425 CB GLU B 63 159.479 -10.337 -6.019 1.00 0.00 C ATOM 2426 CG GLU B 63 158.802 -11.530 -6.695 1.00 0.00 C ATOM 2427 CD GLU B 63 157.287 -11.400 -6.585 1.00 0.00 C ATOM 2428 OE1 GLU B 63 156.832 -10.342 -6.183 1.00 0.00 O ATOM 2429 OE2 GLU B 63 156.604 -12.359 -6.906 1.00 0.00 O ATOM 0 H GLU B 63 161.079 -8.931 -4.772 1.00 0.00 H new ATOM 0 HA GLU B 63 161.371 -11.369 -6.000 1.00 0.00 H new ATOM 0 HB2 GLU B 63 159.285 -10.355 -4.947 1.00 0.00 H new ATOM 0 HB3 GLU B 63 159.064 -9.405 -6.403 1.00 0.00 H new ATOM 0 HG2 GLU B 63 159.096 -11.580 -7.743 1.00 0.00 H new ATOM 0 HG3 GLU B 63 159.131 -12.458 -6.228 1.00 0.00 H new ATOM 2436 N ASN B 64 161.380 -8.898 -8.154 1.00 0.00 N ATOM 2437 CA ASN B 64 161.637 -8.559 -9.549 1.00 0.00 C ATOM 2438 C ASN B 64 162.181 -7.139 -9.666 1.00 0.00 C ATOM 2439 O ASN B 64 163.304 -6.930 -10.124 1.00 0.00 O ATOM 2440 CB ASN B 64 160.346 -8.683 -10.361 1.00 0.00 C ATOM 2441 CG ASN B 64 159.220 -7.923 -9.668 1.00 0.00 C ATOM 2442 OD1 ASN B 64 158.871 -6.817 -10.081 1.00 0.00 O ATOM 2443 ND2 ASN B 64 158.628 -8.453 -8.634 1.00 0.00 N ATOM 0 H ASN B 64 161.309 -8.096 -7.528 1.00 0.00 H new ATOM 0 HA ASN B 64 162.381 -9.252 -9.941 1.00 0.00 H new ATOM 0 HB2 ASN B 64 160.499 -8.288 -11.365 1.00 0.00 H new ATOM 0 HB3 ASN B 64 160.074 -9.733 -10.470 1.00 0.00 H new ATOM 0 HD21 ASN B 64 157.874 -7.951 -8.165 1.00 0.00 H new ATOM 0 HD22 ASN B 64 158.919 -9.370 -8.294 1.00 0.00 H new ATOM 2450 N GLY B 65 161.376 -6.166 -9.250 1.00 0.00 N ATOM 2451 CA GLY B 65 161.787 -4.769 -9.315 1.00 0.00 C ATOM 2452 C GLY B 65 161.495 -4.179 -10.690 1.00 0.00 C ATOM 2453 O GLY B 65 161.956 -3.088 -11.021 1.00 0.00 O ATOM 0 H GLY B 65 160.443 -6.318 -8.867 1.00 0.00 H new ATOM 0 HA2 GLY B 65 161.263 -4.196 -8.550 1.00 0.00 H new ATOM 0 HA3 GLY B 65 162.852 -4.689 -9.099 1.00 0.00 H new ATOM 2457 N ASP B 66 160.724 -4.911 -11.489 1.00 0.00 N ATOM 2458 CA ASP B 66 160.374 -4.454 -12.829 1.00 0.00 C ATOM 2459 C ASP B 66 158.961 -4.897 -13.193 1.00 0.00 C ATOM 2460 O ASP B 66 158.590 -4.916 -14.367 1.00 0.00 O ATOM 2461 CB ASP B 66 161.367 -5.017 -13.847 1.00 0.00 C ATOM 2462 CG ASP B 66 161.411 -6.538 -13.747 1.00 0.00 C ATOM 2463 OD1 ASP B 66 160.406 -7.116 -13.367 1.00 0.00 O ATOM 2464 OD2 ASP B 66 162.449 -7.103 -14.052 1.00 0.00 O ATOM 0 H ASP B 66 160.332 -5.817 -11.234 1.00 0.00 H new ATOM 0 HA ASP B 66 160.416 -3.365 -12.845 1.00 0.00 H new ATOM 0 HB2 ASP B 66 161.076 -4.719 -14.854 1.00 0.00 H new ATOM 0 HB3 ASP B 66 162.359 -4.604 -13.666 1.00 0.00 H new ATOM 2469 N GLY B 67 158.178 -5.254 -12.181 1.00 0.00 N ATOM 2470 CA GLY B 67 156.806 -5.696 -12.407 1.00 0.00 C ATOM 2471 C GLY B 67 155.852 -4.509 -12.460 1.00 0.00 C ATOM 2472 O GLY B 67 156.271 -3.371 -12.673 1.00 0.00 O ATOM 0 H GLY B 67 158.467 -5.246 -11.203 1.00 0.00 H new ATOM 0 HA2 GLY B 67 156.749 -6.255 -13.341 1.00 0.00 H new ATOM 0 HA3 GLY B 67 156.503 -6.375 -11.610 1.00 0.00 H new ATOM 2476 N GLU B 68 154.564 -4.783 -12.264 1.00 0.00 N ATOM 2477 CA GLU B 68 153.551 -3.730 -12.293 1.00 0.00 C ATOM 2478 C GLU B 68 152.573 -3.901 -11.134 1.00 0.00 C ATOM 2479 O GLU B 68 152.447 -4.988 -10.571 1.00 0.00 O ATOM 2480 CB GLU B 68 152.788 -3.777 -13.618 1.00 0.00 C ATOM 2481 CG GLU B 68 153.780 -3.698 -14.780 1.00 0.00 C ATOM 2482 CD GLU B 68 153.027 -3.617 -16.103 1.00 0.00 C ATOM 2483 OE1 GLU B 68 151.831 -3.858 -16.097 1.00 0.00 O ATOM 2484 OE2 GLU B 68 153.657 -3.316 -17.104 1.00 0.00 O ATOM 0 H GLU B 68 154.199 -5.718 -12.085 1.00 0.00 H new ATOM 0 HA GLU B 68 154.050 -2.766 -12.196 1.00 0.00 H new ATOM 0 HB2 GLU B 68 152.207 -4.697 -13.683 1.00 0.00 H new ATOM 0 HB3 GLU B 68 152.081 -2.949 -13.672 1.00 0.00 H new ATOM 0 HG2 GLU B 68 154.421 -2.824 -14.663 1.00 0.00 H new ATOM 0 HG3 GLU B 68 154.430 -4.573 -14.775 1.00 0.00 H new ATOM 2491 N VAL B 69 151.884 -2.818 -10.783 1.00 0.00 N ATOM 2492 CA VAL B 69 150.919 -2.856 -9.688 1.00 0.00 C ATOM 2493 C VAL B 69 149.649 -2.099 -10.068 1.00 0.00 C ATOM 2494 O VAL B 69 149.698 -1.118 -10.810 1.00 0.00 O ATOM 2495 CB VAL B 69 151.530 -2.231 -8.433 1.00 0.00 C ATOM 2496 CG1 VAL B 69 150.561 -2.387 -7.260 1.00 0.00 C ATOM 2497 CG2 VAL B 69 152.846 -2.941 -8.103 1.00 0.00 C ATOM 0 H VAL B 69 151.975 -1.909 -11.237 1.00 0.00 H new ATOM 0 HA VAL B 69 150.663 -3.897 -9.489 1.00 0.00 H new ATOM 0 HB VAL B 69 151.719 -1.172 -8.609 1.00 0.00 H new ATOM 0 HG11 VAL B 69 150.997 -1.941 -6.366 1.00 0.00 H new ATOM 0 HG12 VAL B 69 149.622 -1.885 -7.494 1.00 0.00 H new ATOM 0 HG13 VAL B 69 150.372 -3.446 -7.082 1.00 0.00 H new ATOM 0 HG21 VAL B 69 153.284 -2.498 -7.209 1.00 0.00 H new ATOM 0 HG22 VAL B 69 152.654 -3.999 -7.927 1.00 0.00 H new ATOM 0 HG23 VAL B 69 153.538 -2.832 -8.938 1.00 0.00 H new ATOM 2507 N ASP B 70 148.513 -2.563 -9.556 1.00 0.00 N ATOM 2508 CA ASP B 70 147.237 -1.922 -9.850 1.00 0.00 C ATOM 2509 C ASP B 70 146.935 -0.830 -8.828 1.00 0.00 C ATOM 2510 O ASP B 70 147.842 -0.307 -8.180 1.00 0.00 O ATOM 2511 CB ASP B 70 146.114 -2.961 -9.834 1.00 0.00 C ATOM 2512 CG ASP B 70 146.513 -4.170 -10.674 1.00 0.00 C ATOM 2513 OD1 ASP B 70 146.744 -3.992 -11.859 1.00 0.00 O ATOM 2514 OD2 ASP B 70 146.582 -5.254 -10.120 1.00 0.00 O ATOM 0 H ASP B 70 148.450 -3.374 -8.940 1.00 0.00 H new ATOM 0 HA ASP B 70 147.301 -1.470 -10.840 1.00 0.00 H new ATOM 0 HB2 ASP B 70 145.908 -3.271 -8.809 1.00 0.00 H new ATOM 0 HB3 ASP B 70 145.196 -2.523 -10.225 1.00 0.00 H new ATOM 2519 N PHE B 71 145.659 -0.489 -8.691 1.00 0.00 N ATOM 2520 CA PHE B 71 145.250 0.544 -7.746 1.00 0.00 C ATOM 2521 C PHE B 71 145.009 -0.055 -6.363 1.00 0.00 C ATOM 2522 O PHE B 71 145.608 0.375 -5.376 1.00 0.00 O ATOM 2523 CB PHE B 71 143.972 1.224 -8.239 1.00 0.00 C ATOM 2524 CG PHE B 71 143.541 2.272 -7.241 1.00 0.00 C ATOM 2525 CD1 PHE B 71 144.315 3.424 -7.060 1.00 0.00 C ATOM 2526 CD2 PHE B 71 142.369 2.091 -6.499 1.00 0.00 C ATOM 2527 CE1 PHE B 71 143.916 4.397 -6.135 1.00 0.00 C ATOM 2528 CE2 PHE B 71 141.970 3.064 -5.574 1.00 0.00 C ATOM 2529 CZ PHE B 71 142.744 4.216 -5.392 1.00 0.00 C ATOM 0 H PHE B 71 144.894 -0.909 -9.218 1.00 0.00 H new ATOM 0 HA PHE B 71 146.050 1.280 -7.674 1.00 0.00 H new ATOM 0 HB2 PHE B 71 144.144 1.683 -9.213 1.00 0.00 H new ATOM 0 HB3 PHE B 71 143.182 0.485 -8.370 1.00 0.00 H new ATOM 0 HD1 PHE B 71 145.220 3.563 -7.633 1.00 0.00 H new ATOM 0 HD2 PHE B 71 141.772 1.202 -6.639 1.00 0.00 H new ATOM 0 HE1 PHE B 71 144.512 5.286 -5.995 1.00 0.00 H new ATOM 0 HE2 PHE B 71 141.065 2.925 -5.001 1.00 0.00 H new ATOM 0 HZ PHE B 71 142.437 4.966 -4.678 1.00 0.00 H new ATOM 2539 N GLN B 72 144.126 -1.046 -6.299 1.00 0.00 N ATOM 2540 CA GLN B 72 143.807 -1.696 -5.032 1.00 0.00 C ATOM 2541 C GLN B 72 145.062 -2.285 -4.394 1.00 0.00 C ATOM 2542 O GLN B 72 145.285 -2.143 -3.193 1.00 0.00 O ATOM 2543 CB GLN B 72 142.779 -2.807 -5.259 1.00 0.00 C ATOM 2544 CG GLN B 72 141.521 -2.218 -5.900 1.00 0.00 C ATOM 2545 CD GLN B 72 140.470 -3.307 -6.082 1.00 0.00 C ATOM 2546 OE1 GLN B 72 140.027 -3.562 -7.202 1.00 0.00 O ATOM 2547 NE2 GLN B 72 140.042 -3.969 -5.042 1.00 0.00 N ATOM 0 H GLN B 72 143.621 -1.415 -7.104 1.00 0.00 H new ATOM 0 HA GLN B 72 143.392 -0.946 -4.359 1.00 0.00 H new ATOM 0 HB2 GLN B 72 143.200 -3.580 -5.902 1.00 0.00 H new ATOM 0 HB3 GLN B 72 142.528 -3.283 -4.311 1.00 0.00 H new ATOM 0 HG2 GLN B 72 141.124 -1.419 -5.274 1.00 0.00 H new ATOM 0 HG3 GLN B 72 141.768 -1.774 -6.865 1.00 0.00 H new ATOM 0 HE21 GLN B 72 140.410 -3.756 -4.115 1.00 0.00 H new ATOM 0 HE22 GLN B 72 139.339 -4.699 -5.156 1.00 0.00 H new ATOM 2556 N GLU B 73 145.879 -2.948 -5.207 1.00 0.00 N ATOM 2557 CA GLU B 73 147.109 -3.553 -4.708 1.00 0.00 C ATOM 2558 C GLU B 73 148.130 -2.475 -4.358 1.00 0.00 C ATOM 2559 O GLU B 73 148.990 -2.672 -3.500 1.00 0.00 O ATOM 2560 CB GLU B 73 147.696 -4.492 -5.764 1.00 0.00 C ATOM 2561 CG GLU B 73 146.884 -5.789 -5.809 1.00 0.00 C ATOM 2562 CD GLU B 73 145.500 -5.521 -6.392 1.00 0.00 C ATOM 2563 OE1 GLU B 73 145.307 -4.447 -6.939 1.00 0.00 O ATOM 2564 OE2 GLU B 73 144.655 -6.394 -6.285 1.00 0.00 O ATOM 0 H GLU B 73 145.714 -3.079 -6.205 1.00 0.00 H new ATOM 0 HA GLU B 73 146.874 -4.122 -3.808 1.00 0.00 H new ATOM 0 HB2 GLU B 73 147.683 -4.009 -6.741 1.00 0.00 H new ATOM 0 HB3 GLU B 73 148.738 -4.712 -5.531 1.00 0.00 H new ATOM 0 HG2 GLU B 73 147.404 -6.532 -6.414 1.00 0.00 H new ATOM 0 HG3 GLU B 73 146.790 -6.204 -4.805 1.00 0.00 H new ATOM 2571 N TYR B 74 148.025 -1.333 -5.031 1.00 0.00 N ATOM 2572 CA TYR B 74 148.940 -0.223 -4.789 1.00 0.00 C ATOM 2573 C TYR B 74 148.696 0.374 -3.402 1.00 0.00 C ATOM 2574 O TYR B 74 149.608 0.443 -2.579 1.00 0.00 O ATOM 2575 CB TYR B 74 148.747 0.839 -5.884 1.00 0.00 C ATOM 2576 CG TYR B 74 149.126 2.212 -5.375 1.00 0.00 C ATOM 2577 CD1 TYR B 74 150.462 2.513 -5.088 1.00 0.00 C ATOM 2578 CD2 TYR B 74 148.134 3.183 -5.193 1.00 0.00 C ATOM 2579 CE1 TYR B 74 150.809 3.786 -4.620 1.00 0.00 C ATOM 2580 CE2 TYR B 74 148.480 4.457 -4.723 1.00 0.00 C ATOM 2581 CZ TYR B 74 149.817 4.758 -4.437 1.00 0.00 C ATOM 2582 OH TYR B 74 150.157 6.013 -3.976 1.00 0.00 O ATOM 0 H TYR B 74 147.319 -1.153 -5.745 1.00 0.00 H new ATOM 0 HA TYR B 74 149.968 -0.584 -4.821 1.00 0.00 H new ATOM 0 HB2 TYR B 74 149.356 0.587 -6.752 1.00 0.00 H new ATOM 0 HB3 TYR B 74 147.708 0.843 -6.214 1.00 0.00 H new ATOM 0 HD1 TYR B 74 151.226 1.763 -5.228 1.00 0.00 H new ATOM 0 HD2 TYR B 74 147.103 2.950 -5.415 1.00 0.00 H new ATOM 0 HE1 TYR B 74 151.841 4.018 -4.400 1.00 0.00 H new ATOM 0 HE2 TYR B 74 147.715 5.207 -4.581 1.00 0.00 H new ATOM 0 HH TYR B 74 149.351 6.566 -3.907 1.00 0.00 H new ATOM 2592 N VAL B 75 147.463 0.805 -3.154 1.00 0.00 N ATOM 2593 CA VAL B 75 147.120 1.394 -1.864 1.00 0.00 C ATOM 2594 C VAL B 75 147.545 0.473 -0.724 1.00 0.00 C ATOM 2595 O VAL B 75 147.887 0.934 0.364 1.00 0.00 O ATOM 2596 CB VAL B 75 145.613 1.646 -1.788 1.00 0.00 C ATOM 2597 CG1 VAL B 75 145.226 2.734 -2.790 1.00 0.00 C ATOM 2598 CG2 VAL B 75 144.864 0.356 -2.125 1.00 0.00 C ATOM 0 H VAL B 75 146.693 0.759 -3.821 1.00 0.00 H new ATOM 0 HA VAL B 75 147.650 2.341 -1.766 1.00 0.00 H new ATOM 0 HB VAL B 75 145.349 1.969 -0.781 1.00 0.00 H new ATOM 0 HG11 VAL B 75 144.152 2.913 -2.736 1.00 0.00 H new ATOM 0 HG12 VAL B 75 145.760 3.654 -2.552 1.00 0.00 H new ATOM 0 HG13 VAL B 75 145.489 2.411 -3.797 1.00 0.00 H new ATOM 0 HG21 VAL B 75 143.790 0.534 -2.071 1.00 0.00 H new ATOM 0 HG22 VAL B 75 145.128 0.034 -3.132 1.00 0.00 H new ATOM 0 HG23 VAL B 75 145.139 -0.421 -1.412 1.00 0.00 H new ATOM 2608 N VAL B 76 147.524 -0.831 -0.984 1.00 0.00 N ATOM 2609 CA VAL B 76 147.913 -1.806 0.028 1.00 0.00 C ATOM 2610 C VAL B 76 149.384 -1.638 0.393 1.00 0.00 C ATOM 2611 O VAL B 76 149.753 -1.684 1.567 1.00 0.00 O ATOM 2612 CB VAL B 76 147.671 -3.225 -0.492 1.00 0.00 C ATOM 2613 CG1 VAL B 76 148.343 -4.237 0.438 1.00 0.00 C ATOM 2614 CG2 VAL B 76 146.167 -3.499 -0.536 1.00 0.00 C ATOM 0 H VAL B 76 147.244 -1.234 -1.878 1.00 0.00 H new ATOM 0 HA VAL B 76 147.308 -1.640 0.919 1.00 0.00 H new ATOM 0 HB VAL B 76 148.092 -3.319 -1.493 1.00 0.00 H new ATOM 0 HG11 VAL B 76 148.169 -5.246 0.065 1.00 0.00 H new ATOM 0 HG12 VAL B 76 149.415 -4.043 0.473 1.00 0.00 H new ATOM 0 HG13 VAL B 76 147.925 -4.144 1.440 1.00 0.00 H new ATOM 0 HG21 VAL B 76 145.992 -4.509 -0.906 1.00 0.00 H new ATOM 0 HG22 VAL B 76 145.750 -3.402 0.466 1.00 0.00 H new ATOM 0 HG23 VAL B 76 145.686 -2.781 -1.200 1.00 0.00 H new ATOM 2624 N LEU B 77 150.219 -1.444 -0.621 1.00 0.00 N ATOM 2625 CA LEU B 77 151.649 -1.270 -0.398 1.00 0.00 C ATOM 2626 C LEU B 77 151.918 0.021 0.368 1.00 0.00 C ATOM 2627 O LEU B 77 152.768 0.059 1.256 1.00 0.00 O ATOM 2628 CB LEU B 77 152.385 -1.236 -1.740 1.00 0.00 C ATOM 2629 CG LEU B 77 152.531 -2.661 -2.282 1.00 0.00 C ATOM 2630 CD1 LEU B 77 152.634 -2.620 -3.808 1.00 0.00 C ATOM 2631 CD2 LEU B 77 153.795 -3.303 -1.704 1.00 0.00 C ATOM 0 H LEU B 77 149.933 -1.403 -1.599 1.00 0.00 H new ATOM 0 HA LEU B 77 152.012 -2.110 0.193 1.00 0.00 H new ATOM 0 HB2 LEU B 77 151.836 -0.620 -2.452 1.00 0.00 H new ATOM 0 HB3 LEU B 77 153.368 -0.781 -1.616 1.00 0.00 H new ATOM 0 HG LEU B 77 151.660 -3.248 -1.992 1.00 0.00 H new ATOM 0 HD11 LEU B 77 152.738 -3.634 -4.193 1.00 0.00 H new ATOM 0 HD12 LEU B 77 151.734 -2.165 -4.221 1.00 0.00 H new ATOM 0 HD13 LEU B 77 153.504 -2.031 -4.098 1.00 0.00 H new ATOM 0 HD21 LEU B 77 153.897 -4.317 -2.091 1.00 0.00 H new ATOM 0 HD22 LEU B 77 154.666 -2.715 -1.992 1.00 0.00 H new ATOM 0 HD23 LEU B 77 153.722 -3.335 -0.617 1.00 0.00 H new ATOM 2643 N VAL B 78 151.188 1.075 0.018 1.00 0.00 N ATOM 2644 CA VAL B 78 151.358 2.364 0.680 1.00 0.00 C ATOM 2645 C VAL B 78 150.994 2.260 2.158 1.00 0.00 C ATOM 2646 O VAL B 78 151.526 2.991 2.991 1.00 0.00 O ATOM 2647 CB VAL B 78 150.474 3.416 0.008 1.00 0.00 C ATOM 2648 CG1 VAL B 78 150.500 4.706 0.830 1.00 0.00 C ATOM 2649 CG2 VAL B 78 151.001 3.698 -1.400 1.00 0.00 C ATOM 0 H VAL B 78 150.478 1.063 -0.714 1.00 0.00 H new ATOM 0 HA VAL B 78 152.404 2.660 0.595 1.00 0.00 H new ATOM 0 HB VAL B 78 149.451 3.046 -0.053 1.00 0.00 H new ATOM 0 HG11 VAL B 78 149.870 5.455 0.351 1.00 0.00 H new ATOM 0 HG12 VAL B 78 150.126 4.505 1.834 1.00 0.00 H new ATOM 0 HG13 VAL B 78 151.523 5.078 0.892 1.00 0.00 H new ATOM 0 HG21 VAL B 78 150.372 4.448 -1.881 1.00 0.00 H new ATOM 0 HG22 VAL B 78 152.024 4.068 -1.338 1.00 0.00 H new ATOM 0 HG23 VAL B 78 150.983 2.779 -1.986 1.00 0.00 H new ATOM 2659 N ALA B 79 150.080 1.349 2.474 1.00 0.00 N ATOM 2660 CA ALA B 79 149.651 1.156 3.854 1.00 0.00 C ATOM 2661 C ALA B 79 150.586 0.193 4.583 1.00 0.00 C ATOM 2662 O ALA B 79 150.618 0.157 5.813 1.00 0.00 O ATOM 2663 CB ALA B 79 148.225 0.604 3.885 1.00 0.00 C ATOM 0 H ALA B 79 149.624 0.736 1.798 1.00 0.00 H new ATOM 0 HA ALA B 79 149.680 2.122 4.359 1.00 0.00 H new ATOM 0 HB1 ALA B 79 147.912 0.463 4.919 1.00 0.00 H new ATOM 0 HB2 ALA B 79 147.552 1.307 3.395 1.00 0.00 H new ATOM 0 HB3 ALA B 79 148.194 -0.352 3.363 1.00 0.00 H new ATOM 2669 N ALA B 80 151.334 -0.594 3.816 1.00 0.00 N ATOM 2670 CA ALA B 80 152.254 -1.566 4.401 1.00 0.00 C ATOM 2671 C ALA B 80 153.357 -0.876 5.200 1.00 0.00 C ATOM 2672 O ALA B 80 153.447 -1.043 6.416 1.00 0.00 O ATOM 2673 CB ALA B 80 152.883 -2.414 3.293 1.00 0.00 C ATOM 0 H ALA B 80 151.323 -0.579 2.796 1.00 0.00 H new ATOM 0 HA ALA B 80 151.686 -2.202 5.080 1.00 0.00 H new ATOM 0 HB1 ALA B 80 153.569 -3.138 3.734 1.00 0.00 H new ATOM 0 HB2 ALA B 80 152.099 -2.941 2.749 1.00 0.00 H new ATOM 0 HB3 ALA B 80 153.430 -1.768 2.606 1.00 0.00 H new ATOM 2679 N LEU B 81 154.197 -0.107 4.513 1.00 0.00 N ATOM 2680 CA LEU B 81 155.292 0.591 5.181 1.00 0.00 C ATOM 2681 C LEU B 81 154.758 1.559 6.236 1.00 0.00 C ATOM 2682 O LEU B 81 155.485 1.966 7.142 1.00 0.00 O ATOM 2683 CB LEU B 81 156.159 1.340 4.156 1.00 0.00 C ATOM 2684 CG LEU B 81 155.449 2.605 3.654 1.00 0.00 C ATOM 2685 CD1 LEU B 81 156.352 3.325 2.650 1.00 0.00 C ATOM 2686 CD2 LEU B 81 154.139 2.224 2.965 1.00 0.00 C ATOM 0 H LEU B 81 154.143 0.048 3.506 1.00 0.00 H new ATOM 0 HA LEU B 81 155.911 -0.152 5.683 1.00 0.00 H new ATOM 0 HB2 LEU B 81 157.113 1.610 4.609 1.00 0.00 H new ATOM 0 HB3 LEU B 81 156.380 0.685 3.314 1.00 0.00 H new ATOM 0 HG LEU B 81 155.237 3.259 4.500 1.00 0.00 H new ATOM 0 HD11 LEU B 81 155.852 4.224 2.291 1.00 0.00 H new ATOM 0 HD12 LEU B 81 157.289 3.600 3.135 1.00 0.00 H new ATOM 0 HD13 LEU B 81 156.560 2.664 1.808 1.00 0.00 H new ATOM 0 HD21 LEU B 81 153.639 3.125 2.611 1.00 0.00 H new ATOM 0 HD22 LEU B 81 154.350 1.569 2.119 1.00 0.00 H new ATOM 0 HD23 LEU B 81 153.493 1.705 3.673 1.00 0.00 H new ATOM 2698 N THR B 82 153.486 1.925 6.112 1.00 0.00 N ATOM 2699 CA THR B 82 152.871 2.846 7.060 1.00 0.00 C ATOM 2700 C THR B 82 152.621 2.156 8.397 1.00 0.00 C ATOM 2701 O THR B 82 152.996 2.670 9.452 1.00 0.00 O ATOM 2702 CB THR B 82 151.546 3.366 6.498 1.00 0.00 C ATOM 2703 OG1 THR B 82 151.785 4.038 5.270 1.00 0.00 O ATOM 2704 CG2 THR B 82 150.911 4.337 7.496 1.00 0.00 C ATOM 0 H THR B 82 152.866 1.601 5.370 1.00 0.00 H new ATOM 0 HA THR B 82 153.553 3.681 7.218 1.00 0.00 H new ATOM 0 HB THR B 82 150.870 2.528 6.329 1.00 0.00 H new ATOM 0 HG1 THR B 82 151.344 3.554 4.541 1.00 0.00 H new ATOM 0 HG21 THR B 82 149.967 4.706 7.094 1.00 0.00 H new ATOM 0 HG22 THR B 82 150.727 3.821 8.439 1.00 0.00 H new ATOM 0 HG23 THR B 82 151.586 5.176 7.667 1.00 0.00 H new ATOM 2712 N VAL B 83 151.984 0.990 8.346 1.00 0.00 N ATOM 2713 CA VAL B 83 151.687 0.240 9.560 1.00 0.00 C ATOM 2714 C VAL B 83 152.974 -0.203 10.250 1.00 0.00 C ATOM 2715 O VAL B 83 153.068 -0.189 11.478 1.00 0.00 O ATOM 2716 CB VAL B 83 150.841 -0.987 9.221 1.00 0.00 C ATOM 2717 CG1 VAL B 83 150.724 -1.883 10.456 1.00 0.00 C ATOM 2718 CG2 VAL B 83 149.445 -0.537 8.786 1.00 0.00 C ATOM 0 H VAL B 83 151.666 0.547 7.484 1.00 0.00 H new ATOM 0 HA VAL B 83 151.132 0.890 10.237 1.00 0.00 H new ATOM 0 HB VAL B 83 151.314 -1.543 8.412 1.00 0.00 H new ATOM 0 HG11 VAL B 83 150.121 -2.758 10.215 1.00 0.00 H new ATOM 0 HG12 VAL B 83 151.718 -2.203 10.769 1.00 0.00 H new ATOM 0 HG13 VAL B 83 150.250 -1.327 11.265 1.00 0.00 H new ATOM 0 HG21 VAL B 83 148.840 -1.411 8.544 1.00 0.00 H new ATOM 0 HG22 VAL B 83 148.973 0.018 9.597 1.00 0.00 H new ATOM 0 HG23 VAL B 83 149.526 0.103 7.907 1.00 0.00 H new ATOM 2728 N ALA B 84 153.962 -0.596 9.453 1.00 0.00 N ATOM 2729 CA ALA B 84 155.239 -1.043 9.999 1.00 0.00 C ATOM 2730 C ALA B 84 155.811 0.002 10.951 1.00 0.00 C ATOM 2731 O ALA B 84 156.395 -0.335 11.980 1.00 0.00 O ATOM 2732 CB ALA B 84 156.232 -1.297 8.863 1.00 0.00 C ATOM 0 H ALA B 84 153.905 -0.614 8.435 1.00 0.00 H new ATOM 0 HA ALA B 84 155.072 -1.968 10.551 1.00 0.00 H new ATOM 0 HB1 ALA B 84 157.183 -1.630 9.279 1.00 0.00 H new ATOM 0 HB2 ALA B 84 155.837 -2.066 8.199 1.00 0.00 H new ATOM 0 HB3 ALA B 84 156.385 -0.376 8.301 1.00 0.00 H new ATOM 2738 N CYS B 85 155.640 1.272 10.601 1.00 0.00 N ATOM 2739 CA CYS B 85 156.145 2.359 11.432 1.00 0.00 C ATOM 2740 C CYS B 85 155.077 2.820 12.418 1.00 0.00 C ATOM 2741 O CYS B 85 155.387 3.224 13.539 1.00 0.00 O ATOM 2742 CB CYS B 85 156.571 3.535 10.551 1.00 0.00 C ATOM 2743 SG CYS B 85 157.701 2.946 9.266 1.00 0.00 S ATOM 0 H CYS B 85 155.159 1.573 9.753 1.00 0.00 H new ATOM 0 HA CYS B 85 157.006 1.994 11.991 1.00 0.00 H new ATOM 0 HB2 CYS B 85 155.696 3.999 10.096 1.00 0.00 H new ATOM 0 HB3 CYS B 85 157.058 4.299 11.156 1.00 0.00 H new ATOM 0 HG CYS B 85 158.416 3.939 8.828 1.00 0.00 H new ATOM 2749 N ASN B 86 153.819 2.757 11.994 1.00 0.00 N ATOM 2750 CA ASN B 86 152.713 3.172 12.850 1.00 0.00 C ATOM 2751 C ASN B 86 152.892 2.620 14.260 1.00 0.00 C ATOM 2752 O ASN B 86 153.320 1.481 14.442 1.00 0.00 O ATOM 2753 CB ASN B 86 151.387 2.673 12.271 1.00 0.00 C ATOM 2754 CG ASN B 86 150.220 3.329 13.000 1.00 0.00 C ATOM 2755 OD1 ASN B 86 149.560 2.690 13.819 1.00 0.00 O ATOM 2756 ND2 ASN B 86 149.924 4.575 12.749 1.00 0.00 N ATOM 0 H ASN B 86 153.541 2.425 11.070 1.00 0.00 H new ATOM 0 HA ASN B 86 152.703 4.261 12.895 1.00 0.00 H new ATOM 0 HB2 ASN B 86 151.336 2.902 11.207 1.00 0.00 H new ATOM 0 HB3 ASN B 86 151.324 1.589 12.367 1.00 0.00 H new ATOM 0 HD21 ASN B 86 149.144 5.021 13.232 1.00 0.00 H new ATOM 0 HD22 ASN B 86 150.472 5.103 12.070 1.00 0.00 H new ATOM 2763 N ASN B 87 152.563 3.437 15.256 1.00 0.00 N ATOM 2764 CA ASN B 87 152.692 3.019 16.646 1.00 0.00 C ATOM 2765 C ASN B 87 151.652 3.718 17.515 1.00 0.00 C ATOM 2766 O ASN B 87 151.982 4.300 18.549 1.00 0.00 O ATOM 2767 CB ASN B 87 154.094 3.348 17.161 1.00 0.00 C ATOM 2768 CG ASN B 87 154.338 4.851 17.086 1.00 0.00 C ATOM 2769 OD1 ASN B 87 153.419 5.615 16.789 1.00 0.00 O ATOM 2770 ND2 ASN B 87 155.527 5.324 17.337 1.00 0.00 N ATOM 0 H ASN B 87 152.208 4.385 15.127 1.00 0.00 H new ATOM 0 HA ASN B 87 152.528 1.943 16.699 1.00 0.00 H new ATOM 0 HB2 ASN B 87 154.202 3.005 18.190 1.00 0.00 H new ATOM 0 HB3 ASN B 87 154.841 2.820 16.568 1.00 0.00 H new ATOM 0 HD21 ASN B 87 155.697 6.328 17.288 1.00 0.00 H new ATOM 0 HD22 ASN B 87 156.287 4.689 17.583 1.00 0.00 H new ATOM 2777 N PHE B 88 150.395 3.658 17.089 1.00 0.00 N ATOM 2778 CA PHE B 88 149.314 4.290 17.837 1.00 0.00 C ATOM 2779 C PHE B 88 149.006 3.503 19.108 1.00 0.00 C ATOM 2780 O PHE B 88 148.737 4.085 20.157 1.00 0.00 O ATOM 2781 CB PHE B 88 148.054 4.368 16.968 1.00 0.00 C ATOM 2782 CG PHE B 88 148.138 5.574 16.061 1.00 0.00 C ATOM 2783 CD1 PHE B 88 149.186 5.687 15.141 1.00 0.00 C ATOM 2784 CD2 PHE B 88 147.165 6.577 16.141 1.00 0.00 C ATOM 2785 CE1 PHE B 88 149.262 6.804 14.300 1.00 0.00 C ATOM 2786 CE2 PHE B 88 147.240 7.694 15.301 1.00 0.00 C ATOM 2787 CZ PHE B 88 148.289 7.807 14.380 1.00 0.00 C ATOM 0 H PHE B 88 150.101 3.182 16.236 1.00 0.00 H new ATOM 0 HA PHE B 88 149.631 5.296 18.114 1.00 0.00 H new ATOM 0 HB2 PHE B 88 147.953 3.460 16.374 1.00 0.00 H new ATOM 0 HB3 PHE B 88 147.168 4.436 17.599 1.00 0.00 H new ATOM 0 HD1 PHE B 88 149.936 4.913 15.079 1.00 0.00 H new ATOM 0 HD2 PHE B 88 146.356 6.489 16.851 1.00 0.00 H new ATOM 0 HE1 PHE B 88 150.071 6.892 13.590 1.00 0.00 H new ATOM 0 HE2 PHE B 88 146.490 8.468 15.363 1.00 0.00 H new ATOM 0 HZ PHE B 88 148.347 8.668 13.731 1.00 0.00 H new ATOM 2797 N PHE B 89 149.045 2.176 19.004 1.00 0.00 N ATOM 2798 CA PHE B 89 148.765 1.315 20.152 1.00 0.00 C ATOM 2799 C PHE B 89 150.000 0.508 20.536 1.00 0.00 C ATOM 2800 O PHE B 89 150.201 0.184 21.706 1.00 0.00 O ATOM 2801 CB PHE B 89 147.615 0.364 19.817 1.00 0.00 C ATOM 2802 CG PHE B 89 146.309 1.119 19.869 1.00 0.00 C ATOM 2803 CD1 PHE B 89 145.599 1.206 21.073 1.00 0.00 C ATOM 2804 CD2 PHE B 89 145.808 1.733 18.716 1.00 0.00 C ATOM 2805 CE1 PHE B 89 144.388 1.907 21.123 1.00 0.00 C ATOM 2806 CE2 PHE B 89 144.598 2.435 18.765 1.00 0.00 C ATOM 2807 CZ PHE B 89 143.888 2.522 19.969 1.00 0.00 C ATOM 0 H PHE B 89 149.266 1.676 18.143 1.00 0.00 H new ATOM 0 HA PHE B 89 148.485 1.946 20.996 1.00 0.00 H new ATOM 0 HB2 PHE B 89 147.760 -0.065 18.826 1.00 0.00 H new ATOM 0 HB3 PHE B 89 147.597 -0.465 20.524 1.00 0.00 H new ATOM 0 HD1 PHE B 89 145.986 0.732 21.963 1.00 0.00 H new ATOM 0 HD2 PHE B 89 146.355 1.665 17.787 1.00 0.00 H new ATOM 0 HE1 PHE B 89 143.840 1.973 22.051 1.00 0.00 H new ATOM 0 HE2 PHE B 89 144.212 2.909 17.875 1.00 0.00 H new ATOM 0 HZ PHE B 89 142.954 3.064 20.007 1.00 0.00 H new