USER MOD reduce.3.24.130724 H: found=0, std=0, add=1256, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1262 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 77 GLN : amide:sc= -1.39 K(o=-3.2,f=-0.85) USER MOD Set 1.2: B 119 LYS NZ :NH3+ 146:sc= -1.85 (180deg=-0.686) USER MOD Set 2.1: A 79 MET CE :methyl -121:sc=-0.00975 (180deg=-0.0394) USER MOD Set 2.2: B 62 SER OG : rot -60:sc= 0.937 USER MOD Set 3.1: B 51 SER OG : rot 140:sc= 0.324 USER MOD Set 3.2: B 57 LYS NZ :NH3+ 173:sc= 0.206 (180deg=-0.0482) USER MOD Set 4.1: A 62 SER OG : rot -82:sc= 1.02 USER MOD Set 4.2: B 79 MET CE :methyl -105:sc= -3.02! (180deg=-5.89!) USER MOD Set 5.1: A 55 SER OG : rot 180:sc= 0.00264 USER MOD Set 5.2: A 56 THR OG1 : rot 171:sc= -0.655 USER MOD Single : A 51 SER OG : rot 50:sc= 0.129 USER MOD Single : A 52 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -130:sc= -0.0266 (180deg=-0.305) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -1.78 X(o=-1.8,f=-1.5) USER MOD Single : A 85 THR OG1 : rot 17:sc= 0.676! USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 153:sc= -2.24 (180deg=-2.81!) USER MOD Single : A 101 SER OG : rot 82:sc= 0.411 USER MOD Single : A 104 ASN : amide:sc= -1.11 K(o=-1.1,f=-1.7) USER MOD Single : A 106 ASN : amide:sc= -0.334 X(o=-0.33,f=-0.16) USER MOD Single : A 115 TYR OH : rot -10:sc= 0.0008 USER MOD Single : A 118 SER OG : rot -47:sc= 0.718 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot -40:sc= 1.1 USER MOD Single : A 127 THR OG1 : rot -95:sc= 0.508 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 MET CE :methyl -144:sc= -0.0938 (180deg=-0.87) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 56 THR OG1 : rot 169:sc= -0.688 USER MOD Single : B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 81:sc= -1.36 USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 SER OG : rot 79:sc= 0.326 USER MOD Single : B 73 ASN : amide:sc= -0.0556 K(o=-0.056,f=-1.3) USER MOD Single : B 74 MET CE :methyl -148:sc= 0 (180deg=-0.237) USER MOD Single : B 85 THR OG1 : rot 17:sc= 0.63! USER MOD Single : B 87 SER OG : rot 180:sc= 0 USER MOD Single : B 99 MET CE :methyl 156:sc= -1.44 (180deg=-4.37!) USER MOD Single : B 101 SER OG : rot 180:sc= 0 USER MOD Single : B 104 ASN : amide:sc= -1.04 X(o=-1,f=-0.81) USER MOD Single : B 106 ASN : amide:sc= -0.904 K(o=-0.9,f=-0.21) USER MOD Single : B 115 TYR OH : rot 130:sc= 0 USER MOD Single : B 118 SER OG : rot -27:sc= 0.0303 USER MOD Single : B 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 126 SER OG : rot 72:sc= 0.431 USER MOD Single : B 127 THR OG1 : rot 180:sc= -0.312 USER MOD Single : B 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 48 0.194 117.897 10.226 1.00 0.00 N ATOM 2 CA GLY A 48 -0.277 116.638 10.870 1.00 0.00 C ATOM 3 C GLY A 48 -0.441 116.866 12.383 1.00 0.00 C ATOM 4 O GLY A 48 0.410 116.426 13.159 1.00 0.00 O ATOM 0 HA2 GLY A 48 -1.226 116.327 10.433 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.437 115.835 10.688 1.00 0.00 H new ATOM 10 N PRO A 49 -1.506 117.540 12.826 1.00 0.00 N ATOM 11 CA PRO A 49 -1.742 117.809 14.270 1.00 0.00 C ATOM 12 C PRO A 49 -2.480 116.661 14.959 1.00 0.00 C ATOM 13 O PRO A 49 -2.994 115.756 14.294 1.00 0.00 O ATOM 14 CB PRO A 49 -2.587 119.093 14.275 1.00 0.00 C ATOM 15 CG PRO A 49 -3.122 119.271 12.881 1.00 0.00 C ATOM 16 CD PRO A 49 -2.598 118.119 12.020 1.00 0.00 C ATOM 0 HA PRO A 49 -0.808 117.912 14.822 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -3.402 119.016 14.994 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -1.983 119.951 14.569 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -4.212 119.275 12.889 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -2.803 120.229 12.470 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -3.378 117.385 11.818 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -2.237 118.474 11.055 1.00 0.00 H new ATOM 24 N GLY A 50 -2.540 116.689 16.273 1.00 0.00 N ATOM 25 CA GLY A 50 -3.242 115.609 17.035 1.00 0.00 C ATOM 26 C GLY A 50 -2.214 114.698 17.696 1.00 0.00 C ATOM 27 O GLY A 50 -1.377 114.097 17.011 1.00 0.00 O ATOM 0 H GLY A 50 -2.128 117.421 16.852 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.893 116.048 17.791 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.877 115.031 16.364 1.00 0.00 H new ATOM 31 N SER A 51 -2.260 114.584 19.006 1.00 0.00 N ATOM 32 CA SER A 51 -1.290 113.711 19.734 1.00 0.00 C ATOM 33 C SER A 51 -1.714 113.583 21.195 1.00 0.00 C ATOM 34 O SER A 51 -1.721 114.572 21.936 1.00 0.00 O ATOM 35 CB SER A 51 0.117 114.307 19.656 1.00 0.00 C ATOM 36 OG SER A 51 0.043 115.710 19.871 1.00 0.00 O ATOM 0 H SER A 51 -2.934 115.064 19.602 1.00 0.00 H new ATOM 0 HA SER A 51 -1.282 112.725 19.270 1.00 0.00 H new ATOM 0 HB2 SER A 51 0.762 113.846 20.404 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.559 114.099 18.682 1.00 0.00 H new ATOM 0 HG SER A 51 -0.480 115.890 20.680 1.00 0.00 H new ATOM 42 N MET A 52 -2.060 112.387 21.616 1.00 0.00 N ATOM 43 CA MET A 52 -2.486 112.159 23.036 1.00 0.00 C ATOM 44 C MET A 52 -2.299 110.683 23.389 1.00 0.00 C ATOM 45 O MET A 52 -1.889 110.352 24.506 1.00 0.00 O ATOM 46 CB MET A 52 -3.953 112.574 23.241 1.00 0.00 C ATOM 47 CG MET A 52 -4.868 111.840 22.252 1.00 0.00 C ATOM 48 SD MET A 52 -6.541 112.523 22.364 1.00 0.00 S ATOM 49 CE MET A 52 -7.370 111.270 21.356 1.00 0.00 C ATOM 0 H MET A 52 -2.065 111.552 21.030 1.00 0.00 H new ATOM 0 HA MET A 52 -1.869 112.772 23.693 1.00 0.00 H new ATOM 0 HB2 MET A 52 -4.260 112.350 24.263 1.00 0.00 H new ATOM 0 HB3 MET A 52 -4.054 113.651 23.107 1.00 0.00 H new ATOM 0 HG2 MET A 52 -4.486 111.948 21.237 1.00 0.00 H new ATOM 0 HG3 MET A 52 -4.883 110.773 22.475 1.00 0.00 H new ATOM 0 HE1 MET A 52 -8.433 111.500 21.291 1.00 0.00 H new ATOM 0 HE2 MET A 52 -6.938 111.264 20.355 1.00 0.00 H new ATOM 0 HE3 MET A 52 -7.239 110.290 21.814 1.00 0.00 H new ATOM 59 N ASP A 53 -2.573 109.801 22.453 1.00 0.00 N ATOM 60 CA ASP A 53 -2.403 108.336 22.696 1.00 0.00 C ATOM 61 C ASP A 53 -1.231 107.859 21.842 1.00 0.00 C ATOM 62 O ASP A 53 -1.383 107.069 20.901 1.00 0.00 O ATOM 63 CB ASP A 53 -3.691 107.586 22.339 1.00 0.00 C ATOM 64 CG ASP A 53 -4.708 107.729 23.466 1.00 0.00 C ATOM 65 OD1 ASP A 53 -4.866 106.783 24.219 1.00 0.00 O ATOM 66 OD2 ASP A 53 -5.315 108.783 23.560 1.00 0.00 O ATOM 0 H ASP A 53 -2.911 110.041 21.521 1.00 0.00 H new ATOM 0 HA ASP A 53 -2.198 108.140 23.748 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -4.106 107.981 21.412 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -3.472 106.532 22.167 1.00 0.00 H new ATOM 71 N ALA A 54 -0.069 108.362 22.155 1.00 0.00 N ATOM 72 CA ALA A 54 1.168 108.023 21.399 1.00 0.00 C ATOM 73 C ALA A 54 1.473 106.525 21.469 1.00 0.00 C ATOM 74 O ALA A 54 2.146 106.002 20.579 1.00 0.00 O ATOM 75 CB ALA A 54 2.334 108.829 21.968 1.00 0.00 C ATOM 0 H ALA A 54 0.077 109.013 22.926 1.00 0.00 H new ATOM 0 HA ALA A 54 1.019 108.276 20.349 1.00 0.00 H new ATOM 0 HB1 ALA A 54 3.245 108.587 21.420 1.00 0.00 H new ATOM 0 HB2 ALA A 54 2.123 109.894 21.869 1.00 0.00 H new ATOM 0 HB3 ALA A 54 2.467 108.582 23.021 1.00 0.00 H new ATOM 81 N SER A 55 1.024 105.828 22.498 1.00 0.00 N ATOM 82 CA SER A 55 1.326 104.361 22.600 1.00 0.00 C ATOM 83 C SER A 55 0.568 103.597 21.515 1.00 0.00 C ATOM 84 O SER A 55 1.134 102.709 20.863 1.00 0.00 O ATOM 85 CB SER A 55 0.917 103.840 23.979 1.00 0.00 C ATOM 86 OG SER A 55 -0.416 104.250 24.259 1.00 0.00 O ATOM 0 H SER A 55 0.467 106.211 23.262 1.00 0.00 H new ATOM 0 HA SER A 55 2.397 104.209 22.463 1.00 0.00 H new ATOM 0 HB2 SER A 55 0.989 102.753 24.006 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.595 104.223 24.741 1.00 0.00 H new ATOM 0 HG SER A 55 -0.682 103.917 25.141 1.00 0.00 H new ATOM 92 N THR A 56 -0.683 103.936 21.294 1.00 0.00 N ATOM 93 CA THR A 56 -1.486 103.244 20.230 1.00 0.00 C ATOM 94 C THR A 56 -0.995 103.732 18.869 1.00 0.00 C ATOM 95 O THR A 56 -0.788 102.937 17.943 1.00 0.00 O ATOM 96 CB THR A 56 -3.005 103.544 20.390 1.00 0.00 C ATOM 97 OG1 THR A 56 -3.220 104.356 21.537 1.00 0.00 O ATOM 98 CG2 THR A 56 -3.813 102.244 20.546 1.00 0.00 C ATOM 0 H THR A 56 -1.183 104.663 21.805 1.00 0.00 H new ATOM 0 HA THR A 56 -1.353 102.166 20.319 1.00 0.00 H new ATOM 0 HB THR A 56 -3.339 104.064 19.492 1.00 0.00 H new ATOM 0 HG1 THR A 56 -4.151 104.661 21.552 1.00 0.00 H new ATOM 0 HG21 THR A 56 -4.871 102.484 20.656 1.00 0.00 H new ATOM 0 HG22 THR A 56 -3.672 101.620 19.663 1.00 0.00 H new ATOM 0 HG23 THR A 56 -3.469 101.706 21.429 1.00 0.00 H new ATOM 106 N LYS A 57 -0.808 105.025 18.743 1.00 0.00 N ATOM 107 CA LYS A 57 -0.331 105.618 17.459 1.00 0.00 C ATOM 108 C LYS A 57 1.054 105.073 17.129 1.00 0.00 C ATOM 109 O LYS A 57 1.368 104.839 15.960 1.00 0.00 O ATOM 110 CB LYS A 57 -0.264 107.149 17.577 1.00 0.00 C ATOM 111 CG LYS A 57 -0.410 107.789 16.189 1.00 0.00 C ATOM 112 CD LYS A 57 -0.400 109.321 16.312 1.00 0.00 C ATOM 113 CE LYS A 57 1.038 109.833 16.488 1.00 0.00 C ATOM 114 NZ LYS A 57 1.137 111.227 15.963 1.00 0.00 N ATOM 0 H LYS A 57 -0.969 105.702 19.489 1.00 0.00 H new ATOM 0 HA LYS A 57 -1.028 105.352 16.665 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -1.055 107.506 18.236 1.00 0.00 H new ATOM 0 HB3 LYS A 57 0.684 107.446 18.026 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.404 107.463 15.542 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -1.339 107.459 15.724 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -0.846 109.767 15.423 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -1.009 109.628 17.162 1.00 0.00 H new ATOM 0 HE2 LYS A 57 1.318 109.809 17.541 1.00 0.00 H new ATOM 0 HE3 LYS A 57 1.734 109.183 15.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 2.110 111.574 16.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 0.887 111.236 14.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 0.483 111.843 16.487 1.00 0.00 H new ATOM 128 N LYS A 58 1.889 104.891 18.130 1.00 0.00 N ATOM 129 CA LYS A 58 3.276 104.382 17.894 1.00 0.00 C ATOM 130 C LYS A 58 3.241 102.957 17.362 1.00 0.00 C ATOM 131 O LYS A 58 4.018 102.623 16.465 1.00 0.00 O ATOM 132 CB LYS A 58 4.104 104.431 19.188 1.00 0.00 C ATOM 133 CG LYS A 58 4.720 105.828 19.378 1.00 0.00 C ATOM 134 CD LYS A 58 5.853 106.034 18.365 1.00 0.00 C ATOM 135 CE LYS A 58 6.694 107.248 18.765 1.00 0.00 C ATOM 136 NZ LYS A 58 7.904 107.320 17.899 1.00 0.00 N ATOM 0 H LYS A 58 1.663 105.076 19.107 1.00 0.00 H new ATOM 0 HA LYS A 58 3.746 105.027 17.151 1.00 0.00 H new ATOM 0 HB2 LYS A 58 3.472 104.186 20.041 1.00 0.00 H new ATOM 0 HB3 LYS A 58 4.894 103.680 19.151 1.00 0.00 H new ATOM 0 HG2 LYS A 58 3.956 106.594 19.245 1.00 0.00 H new ATOM 0 HG3 LYS A 58 5.103 105.932 20.393 1.00 0.00 H new ATOM 0 HD2 LYS A 58 6.481 105.144 18.322 1.00 0.00 H new ATOM 0 HD3 LYS A 58 5.439 106.180 17.367 1.00 0.00 H new ATOM 0 HE2 LYS A 58 6.106 108.160 18.664 1.00 0.00 H new ATOM 0 HE3 LYS A 58 6.987 107.172 19.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 8.476 108.145 18.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 8.467 106.454 18.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 7.614 107.412 16.904 1.00 0.00 H new ATOM 150 N LEU A 59 2.374 102.111 17.881 1.00 0.00 N ATOM 151 CA LEU A 59 2.314 100.701 17.376 1.00 0.00 C ATOM 152 C LEU A 59 1.955 100.741 15.892 1.00 0.00 C ATOM 153 O LEU A 59 2.589 100.072 15.062 1.00 0.00 O ATOM 154 CB LEU A 59 1.259 99.898 18.149 1.00 0.00 C ATOM 155 CG LEU A 59 1.493 98.392 17.945 1.00 0.00 C ATOM 156 CD1 LEU A 59 2.692 97.936 18.783 1.00 0.00 C ATOM 157 CD2 LEU A 59 0.247 97.616 18.382 1.00 0.00 C ATOM 0 H LEU A 59 1.713 102.336 18.625 1.00 0.00 H new ATOM 0 HA LEU A 59 3.279 100.216 17.519 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.309 100.142 19.210 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.260 100.169 17.807 1.00 0.00 H new ATOM 0 HG LEU A 59 1.693 98.201 16.891 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.854 96.868 18.635 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.582 98.484 18.474 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.494 98.131 19.837 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.414 96.549 18.237 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.047 97.812 19.435 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.608 97.934 17.785 1.00 0.00 H new ATOM 169 N SER A 60 0.967 101.533 15.549 1.00 0.00 N ATOM 170 CA SER A 60 0.547 101.665 14.123 1.00 0.00 C ATOM 171 C SER A 60 1.667 102.333 13.326 1.00 0.00 C ATOM 172 O SER A 60 1.921 101.967 12.174 1.00 0.00 O ATOM 173 CB SER A 60 -0.726 102.508 14.027 1.00 0.00 C ATOM 174 OG SER A 60 -0.975 102.829 12.665 1.00 0.00 O ATOM 0 H SER A 60 0.430 102.099 16.206 1.00 0.00 H new ATOM 0 HA SER A 60 0.347 100.675 13.714 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.571 101.960 14.444 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.617 103.420 14.614 1.00 0.00 H new ATOM 0 HG SER A 60 -1.791 103.368 12.600 1.00 0.00 H new ATOM 180 N GLU A 61 2.330 103.308 13.915 1.00 0.00 N ATOM 181 CA GLU A 61 3.432 104.028 13.209 1.00 0.00 C ATOM 182 C GLU A 61 4.605 103.082 12.978 1.00 0.00 C ATOM 183 O GLU A 61 5.271 103.166 11.946 1.00 0.00 O ATOM 184 CB GLU A 61 3.897 105.222 14.048 1.00 0.00 C ATOM 185 CG GLU A 61 4.773 106.139 13.191 1.00 0.00 C ATOM 186 CD GLU A 61 5.334 107.273 14.043 1.00 0.00 C ATOM 187 OE1 GLU A 61 5.923 106.979 15.071 1.00 0.00 O ATOM 188 OE2 GLU A 61 5.163 108.418 13.657 1.00 0.00 O ATOM 0 H GLU A 61 2.148 103.634 14.864 1.00 0.00 H new ATOM 0 HA GLU A 61 3.061 104.385 12.248 1.00 0.00 H new ATOM 0 HB2 GLU A 61 3.035 105.773 14.425 1.00 0.00 H new ATOM 0 HB3 GLU A 61 4.457 104.874 14.916 1.00 0.00 H new ATOM 0 HG2 GLU A 61 5.589 105.567 12.750 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.188 106.548 12.367 1.00 0.00 H new ATOM 195 N SER A 62 4.879 102.198 13.916 1.00 0.00 N ATOM 196 CA SER A 62 6.024 101.248 13.764 1.00 0.00 C ATOM 197 C SER A 62 5.816 100.418 12.505 1.00 0.00 C ATOM 198 O SER A 62 6.737 100.271 11.693 1.00 0.00 O ATOM 199 CB SER A 62 6.126 100.330 14.984 1.00 0.00 C ATOM 200 OG SER A 62 5.017 99.442 15.004 1.00 0.00 O ATOM 0 H SER A 62 4.352 102.097 14.784 1.00 0.00 H new ATOM 0 HA SER A 62 6.952 101.814 13.684 1.00 0.00 H new ATOM 0 HB2 SER A 62 7.057 99.765 14.950 1.00 0.00 H new ATOM 0 HB3 SER A 62 6.147 100.923 15.898 1.00 0.00 H new ATOM 0 HG SER A 62 4.243 99.894 15.401 1.00 0.00 H new ATOM 206 N LEU A 63 4.626 99.887 12.321 1.00 0.00 N ATOM 207 CA LEU A 63 4.341 99.074 11.097 1.00 0.00 C ATOM 208 C LEU A 63 4.484 99.972 9.873 1.00 0.00 C ATOM 209 O LEU A 63 5.107 99.590 8.873 1.00 0.00 O ATOM 210 CB LEU A 63 2.921 98.502 11.167 1.00 0.00 C ATOM 211 CG LEU A 63 2.903 97.252 12.064 1.00 0.00 C ATOM 212 CD1 LEU A 63 1.470 96.954 12.500 1.00 0.00 C ATOM 213 CD2 LEU A 63 3.450 96.050 11.286 1.00 0.00 C ATOM 0 H LEU A 63 3.843 99.983 12.967 1.00 0.00 H new ATOM 0 HA LEU A 63 5.044 98.244 11.031 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.236 99.253 11.561 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.573 98.247 10.166 1.00 0.00 H new ATOM 0 HG LEU A 63 3.524 97.434 12.941 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.460 96.068 13.135 1.00 0.00 H new ATOM 0 HD12 LEU A 63 1.075 97.804 13.056 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.851 96.777 11.620 1.00 0.00 H new ATOM 0 HD21 LEU A 63 3.436 95.167 11.924 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.830 95.873 10.407 1.00 0.00 H new ATOM 0 HD23 LEU A 63 4.474 96.255 10.973 1.00 0.00 H new ATOM 225 N LYS A 64 3.937 101.164 9.945 1.00 0.00 N ATOM 226 CA LYS A 64 4.042 102.123 8.803 1.00 0.00 C ATOM 227 C LYS A 64 5.519 102.441 8.555 1.00 0.00 C ATOM 228 O LYS A 64 5.923 102.692 7.415 1.00 0.00 O ATOM 229 CB LYS A 64 3.274 103.410 9.127 1.00 0.00 C ATOM 230 CG LYS A 64 3.248 104.327 7.900 1.00 0.00 C ATOM 231 CD LYS A 64 2.474 105.604 8.230 1.00 0.00 C ATOM 232 CE LYS A 64 2.498 106.540 7.020 1.00 0.00 C ATOM 233 NZ LYS A 64 3.872 107.087 6.841 1.00 0.00 N ATOM 0 H LYS A 64 3.420 101.513 10.752 1.00 0.00 H new ATOM 0 HA LYS A 64 3.609 101.677 7.908 1.00 0.00 H new ATOM 0 HB2 LYS A 64 2.256 103.169 9.433 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.745 103.923 9.965 1.00 0.00 H new ATOM 0 HG2 LYS A 64 4.265 104.574 7.597 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.781 103.814 7.060 1.00 0.00 H new ATOM 0 HD2 LYS A 64 1.445 105.361 8.495 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.917 106.098 9.095 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.190 106.001 6.124 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.787 107.354 7.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.824 108.121 6.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 4.453 106.845 7.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 4.300 106.677 5.986 1.00 0.00 H new ATOM 247 N ARG A 65 6.320 102.441 9.600 1.00 0.00 N ATOM 248 CA ARG A 65 7.772 102.744 9.456 1.00 0.00 C ATOM 249 C ARG A 65 8.481 101.595 8.751 1.00 0.00 C ATOM 250 O ARG A 65 9.455 101.831 8.039 1.00 0.00 O ATOM 251 CB ARG A 65 8.420 102.982 10.830 1.00 0.00 C ATOM 252 CG ARG A 65 8.100 104.405 11.343 1.00 0.00 C ATOM 253 CD ARG A 65 9.248 104.944 12.215 1.00 0.00 C ATOM 254 NE ARG A 65 10.243 105.676 11.361 1.00 0.00 N ATOM 255 CZ ARG A 65 9.947 106.827 10.771 1.00 0.00 C ATOM 256 NH1 ARG A 65 10.849 107.414 10.033 1.00 0.00 N ATOM 257 NH2 ARG A 65 8.768 107.396 10.910 1.00 0.00 N ATOM 0 H ARG A 65 6.019 102.241 10.554 1.00 0.00 H new ATOM 0 HA ARG A 65 7.871 103.651 8.860 1.00 0.00 H new ATOM 0 HB2 ARG A 65 8.056 102.242 11.543 1.00 0.00 H new ATOM 0 HB3 ARG A 65 9.500 102.850 10.757 1.00 0.00 H new ATOM 0 HG2 ARG A 65 7.936 105.073 10.497 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.176 104.389 11.921 1.00 0.00 H new ATOM 0 HD2 ARG A 65 8.852 105.612 12.980 1.00 0.00 H new ATOM 0 HD3 ARG A 65 9.738 104.121 12.734 1.00 0.00 H new ATOM 0 HE ARG A 65 11.173 105.277 11.231 1.00 0.00 H new ATOM 0 HH11 ARG A 65 11.768 106.988 9.915 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.635 108.299 9.574 1.00 0.00 H new ATOM 0 HH21 ARG A 65 8.052 106.952 11.484 1.00 0.00 H new ATOM 0 HH22 ARG A 65 8.571 108.281 10.443 1.00 0.00 H new ATOM 271 N ILE A 66 8.042 100.363 8.938 1.00 0.00 N ATOM 272 CA ILE A 66 8.737 99.221 8.267 1.00 0.00 C ATOM 273 C ILE A 66 8.522 99.332 6.752 1.00 0.00 C ATOM 274 O ILE A 66 9.476 99.190 5.979 1.00 0.00 O ATOM 275 CB ILE A 66 8.275 97.847 8.879 1.00 0.00 C ATOM 276 CG1 ILE A 66 9.481 96.869 8.983 1.00 0.00 C ATOM 277 CG2 ILE A 66 7.119 97.161 8.103 1.00 0.00 C ATOM 278 CD1 ILE A 66 10.077 96.537 7.598 1.00 0.00 C ATOM 0 H ILE A 66 7.243 100.108 9.519 1.00 0.00 H new ATOM 0 HA ILE A 66 9.811 99.266 8.446 1.00 0.00 H new ATOM 0 HB ILE A 66 7.885 98.084 9.869 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.253 97.311 9.613 1.00 0.00 H new ATOM 0 HG13 ILE A 66 9.160 95.948 9.470 1.00 0.00 H new ATOM 0 HG21 ILE A 66 6.861 96.221 8.590 1.00 0.00 H new ATOM 0 HG22 ILE A 66 6.248 97.816 8.094 1.00 0.00 H new ATOM 0 HG23 ILE A 66 7.435 96.964 7.079 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.916 95.852 7.718 1.00 0.00 H new ATOM 0 HD12 ILE A 66 9.313 96.071 6.976 1.00 0.00 H new ATOM 0 HD13 ILE A 66 10.423 97.454 7.121 1.00 0.00 H new ATOM 290 N GLY A 67 7.304 99.594 6.318 1.00 0.00 N ATOM 291 CA GLY A 67 7.037 99.731 4.849 1.00 0.00 C ATOM 292 C GLY A 67 7.695 101.008 4.316 1.00 0.00 C ATOM 293 O GLY A 67 8.380 100.986 3.282 1.00 0.00 O ATOM 0 H GLY A 67 6.489 99.718 6.918 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.425 98.862 4.317 1.00 0.00 H new ATOM 0 HA3 GLY A 67 5.963 99.762 4.667 1.00 0.00 H new ATOM 297 N ASP A 68 7.492 102.115 4.998 1.00 0.00 N ATOM 298 CA ASP A 68 8.080 103.420 4.552 1.00 0.00 C ATOM 299 C ASP A 68 9.603 103.340 4.560 1.00 0.00 C ATOM 300 O ASP A 68 10.256 103.738 3.589 1.00 0.00 O ATOM 301 CB ASP A 68 7.619 104.542 5.485 1.00 0.00 C ATOM 302 CG ASP A 68 6.225 105.015 5.083 1.00 0.00 C ATOM 303 OD1 ASP A 68 5.267 104.372 5.479 1.00 0.00 O ATOM 304 OD2 ASP A 68 6.137 106.011 4.385 1.00 0.00 O ATOM 0 H ASP A 68 6.938 102.168 5.853 1.00 0.00 H new ATOM 0 HA ASP A 68 7.741 103.631 3.538 1.00 0.00 H new ATOM 0 HB2 ASP A 68 7.609 104.188 6.516 1.00 0.00 H new ATOM 0 HB3 ASP A 68 8.321 105.374 5.441 1.00 0.00 H new ATOM 309 N GLU A 69 10.177 102.848 5.634 1.00 0.00 N ATOM 310 CA GLU A 69 11.668 102.741 5.732 1.00 0.00 C ATOM 311 C GLU A 69 12.188 101.803 4.647 1.00 0.00 C ATOM 312 O GLU A 69 13.302 101.996 4.146 1.00 0.00 O ATOM 313 CB GLU A 69 12.081 102.214 7.109 1.00 0.00 C ATOM 314 CG GLU A 69 13.588 102.422 7.314 1.00 0.00 C ATOM 315 CD GLU A 69 13.927 103.913 7.463 1.00 0.00 C ATOM 316 OE1 GLU A 69 13.045 104.687 7.811 1.00 0.00 O ATOM 317 OE2 GLU A 69 15.075 104.256 7.232 1.00 0.00 O ATOM 0 H GLU A 69 9.671 102.513 6.454 1.00 0.00 H new ATOM 0 HA GLU A 69 12.098 103.733 5.595 1.00 0.00 H new ATOM 0 HB2 GLU A 69 11.523 102.732 7.889 1.00 0.00 H new ATOM 0 HB3 GLU A 69 11.836 101.155 7.192 1.00 0.00 H new ATOM 0 HG2 GLU A 69 13.915 101.881 8.202 1.00 0.00 H new ATOM 0 HG3 GLU A 69 14.134 102.005 6.468 1.00 0.00 H new ATOM 324 N LEU A 70 11.414 100.802 4.267 1.00 0.00 N ATOM 325 CA LEU A 70 11.872 99.856 3.198 1.00 0.00 C ATOM 326 C LEU A 70 12.139 100.667 1.937 1.00 0.00 C ATOM 327 O LEU A 70 13.166 100.501 1.272 1.00 0.00 O ATOM 328 CB LEU A 70 10.772 98.813 2.906 1.00 0.00 C ATOM 329 CG LEU A 70 11.392 97.461 2.539 1.00 0.00 C ATOM 330 CD1 LEU A 70 10.296 96.395 2.485 1.00 0.00 C ATOM 331 CD2 LEU A 70 12.090 97.529 1.173 1.00 0.00 C ATOM 0 H LEU A 70 10.490 100.604 4.652 1.00 0.00 H new ATOM 0 HA LEU A 70 12.772 99.335 3.523 1.00 0.00 H new ATOM 0 HB2 LEU A 70 10.130 98.699 3.780 1.00 0.00 H new ATOM 0 HB3 LEU A 70 10.140 99.162 2.090 1.00 0.00 H new ATOM 0 HG LEU A 70 12.131 97.206 3.299 1.00 0.00 H new ATOM 0 HD11 LEU A 70 10.737 95.433 2.224 1.00 0.00 H new ATOM 0 HD12 LEU A 70 9.813 96.320 3.459 1.00 0.00 H new ATOM 0 HD13 LEU A 70 9.556 96.671 1.733 1.00 0.00 H new ATOM 0 HD21 LEU A 70 12.522 96.557 0.936 1.00 0.00 H new ATOM 0 HD22 LEU A 70 11.364 97.800 0.407 1.00 0.00 H new ATOM 0 HD23 LEU A 70 12.881 98.279 1.205 1.00 0.00 H new ATOM 343 N ASP A 71 11.237 101.560 1.628 1.00 0.00 N ATOM 344 CA ASP A 71 11.401 102.439 0.427 1.00 0.00 C ATOM 345 C ASP A 71 12.665 103.293 0.584 1.00 0.00 C ATOM 346 O ASP A 71 13.239 103.745 -0.410 1.00 0.00 O ATOM 347 CB ASP A 71 10.181 103.350 0.268 1.00 0.00 C ATOM 348 CG ASP A 71 10.051 103.803 -1.183 1.00 0.00 C ATOM 349 OD1 ASP A 71 9.819 104.982 -1.397 1.00 0.00 O ATOM 350 OD2 ASP A 71 10.183 102.965 -2.061 1.00 0.00 O ATOM 0 H ASP A 71 10.383 101.722 2.161 1.00 0.00 H new ATOM 0 HA ASP A 71 11.492 101.813 -0.460 1.00 0.00 H new ATOM 0 HB2 ASP A 71 9.279 102.820 0.574 1.00 0.00 H new ATOM 0 HB3 ASP A 71 10.278 104.218 0.921 1.00 0.00 H new ATOM 355 N SER A 72 13.104 103.525 1.809 1.00 0.00 N ATOM 356 CA SER A 72 14.331 104.354 2.047 1.00 0.00 C ATOM 357 C SER A 72 15.597 103.482 2.029 1.00 0.00 C ATOM 358 O SER A 72 16.710 104.016 2.078 1.00 0.00 O ATOM 359 CB SER A 72 14.224 105.075 3.391 1.00 0.00 C ATOM 360 OG SER A 72 13.158 106.013 3.338 1.00 0.00 O ATOM 0 H SER A 72 12.658 103.171 2.655 1.00 0.00 H new ATOM 0 HA SER A 72 14.404 105.088 1.245 1.00 0.00 H new ATOM 0 HB2 SER A 72 14.050 104.355 4.190 1.00 0.00 H new ATOM 0 HB3 SER A 72 15.160 105.584 3.619 1.00 0.00 H new ATOM 0 HG SER A 72 13.086 106.475 4.199 1.00 0.00 H new ATOM 366 N ASN A 73 15.460 102.169 1.956 1.00 0.00 N ATOM 367 CA ASN A 73 16.658 101.275 1.928 1.00 0.00 C ATOM 368 C ASN A 73 17.318 101.403 0.562 1.00 0.00 C ATOM 369 O ASN A 73 16.916 100.743 -0.402 1.00 0.00 O ATOM 370 CB ASN A 73 16.248 99.817 2.191 1.00 0.00 C ATOM 371 CG ASN A 73 16.492 99.453 3.653 1.00 0.00 C ATOM 372 OD1 ASN A 73 15.560 99.446 4.458 1.00 0.00 O ATOM 373 ND2 ASN A 73 17.699 99.150 4.046 1.00 0.00 N ATOM 0 H ASN A 73 14.563 101.685 1.915 1.00 0.00 H new ATOM 0 HA ASN A 73 17.359 101.569 2.709 1.00 0.00 H new ATOM 0 HB2 ASN A 73 15.195 99.678 1.946 1.00 0.00 H new ATOM 0 HB3 ASN A 73 16.817 99.150 1.543 1.00 0.00 H new ATOM 0 HD21 ASN A 73 17.872 98.907 5.021 1.00 0.00 H new ATOM 0 HD22 ASN A 73 18.470 99.156 3.378 1.00 0.00 H new ATOM 380 N MET A 74 18.307 102.253 0.470 1.00 0.00 N ATOM 381 CA MET A 74 19.018 102.480 -0.827 1.00 0.00 C ATOM 382 C MET A 74 19.634 101.181 -1.337 1.00 0.00 C ATOM 383 O MET A 74 19.669 100.960 -2.549 1.00 0.00 O ATOM 384 CB MET A 74 20.123 103.535 -0.651 1.00 0.00 C ATOM 385 CG MET A 74 19.548 104.956 -0.776 1.00 0.00 C ATOM 386 SD MET A 74 20.843 106.070 -1.373 1.00 0.00 S ATOM 387 CE MET A 74 21.601 106.425 0.232 1.00 0.00 C ATOM 0 H MET A 74 18.659 102.809 1.250 1.00 0.00 H new ATOM 0 HA MET A 74 18.290 102.837 -1.555 1.00 0.00 H new ATOM 0 HB2 MET A 74 20.596 103.414 0.324 1.00 0.00 H new ATOM 0 HB3 MET A 74 20.898 103.384 -1.402 1.00 0.00 H new ATOM 0 HG2 MET A 74 18.702 104.960 -1.464 1.00 0.00 H new ATOM 0 HG3 MET A 74 19.175 105.297 0.190 1.00 0.00 H new ATOM 0 HE1 MET A 74 22.439 107.108 0.095 1.00 0.00 H new ATOM 0 HE2 MET A 74 20.863 106.884 0.890 1.00 0.00 H new ATOM 0 HE3 MET A 74 21.958 105.497 0.679 1.00 0.00 H new ATOM 397 N GLU A 75 20.131 100.333 -0.461 1.00 0.00 N ATOM 398 CA GLU A 75 20.765 99.051 -0.920 1.00 0.00 C ATOM 399 C GLU A 75 19.712 98.160 -1.578 1.00 0.00 C ATOM 400 O GLU A 75 19.943 97.611 -2.667 1.00 0.00 O ATOM 401 CB GLU A 75 21.387 98.320 0.275 1.00 0.00 C ATOM 402 CG GLU A 75 22.687 99.017 0.686 1.00 0.00 C ATOM 403 CD GLU A 75 23.761 98.779 -0.371 1.00 0.00 C ATOM 404 OE1 GLU A 75 24.277 99.754 -0.891 1.00 0.00 O ATOM 405 OE2 GLU A 75 24.051 97.626 -0.643 1.00 0.00 O ATOM 0 H GLU A 75 20.125 100.474 0.549 1.00 0.00 H new ATOM 0 HA GLU A 75 21.546 99.280 -1.645 1.00 0.00 H new ATOM 0 HB2 GLU A 75 20.688 98.310 1.111 1.00 0.00 H new ATOM 0 HB3 GLU A 75 21.587 97.281 0.014 1.00 0.00 H new ATOM 0 HG2 GLU A 75 22.514 100.086 0.807 1.00 0.00 H new ATOM 0 HG3 GLU A 75 23.024 98.638 1.651 1.00 0.00 H new ATOM 412 N LEU A 76 18.558 98.027 -0.961 1.00 0.00 N ATOM 413 CA LEU A 76 17.468 97.189 -1.554 1.00 0.00 C ATOM 414 C LEU A 76 16.987 97.856 -2.830 1.00 0.00 C ATOM 415 O LEU A 76 16.787 97.198 -3.856 1.00 0.00 O ATOM 416 CB LEU A 76 16.292 97.062 -0.575 1.00 0.00 C ATOM 417 CG LEU A 76 16.560 95.944 0.440 1.00 0.00 C ATOM 418 CD1 LEU A 76 15.579 96.068 1.610 1.00 0.00 C ATOM 419 CD2 LEU A 76 16.367 94.581 -0.236 1.00 0.00 C ATOM 0 H LEU A 76 18.326 98.465 -0.070 1.00 0.00 H new ATOM 0 HA LEU A 76 17.854 96.192 -1.764 1.00 0.00 H new ATOM 0 HB2 LEU A 76 16.141 98.007 -0.053 1.00 0.00 H new ATOM 0 HB3 LEU A 76 15.374 96.851 -1.124 1.00 0.00 H new ATOM 0 HG LEU A 76 17.582 96.030 0.808 1.00 0.00 H new ATOM 0 HD11 LEU A 76 15.770 95.273 2.331 1.00 0.00 H new ATOM 0 HD12 LEU A 76 15.710 97.036 2.094 1.00 0.00 H new ATOM 0 HD13 LEU A 76 14.558 95.983 1.239 1.00 0.00 H new ATOM 0 HD21 LEU A 76 16.558 93.787 0.486 1.00 0.00 H new ATOM 0 HD22 LEU A 76 15.344 94.499 -0.604 1.00 0.00 H new ATOM 0 HD23 LEU A 76 17.062 94.487 -1.071 1.00 0.00 H new ATOM 431 N GLN A 77 16.801 99.150 -2.772 1.00 0.00 N ATOM 432 CA GLN A 77 16.328 99.918 -3.957 1.00 0.00 C ATOM 433 C GLN A 77 17.339 99.802 -5.091 1.00 0.00 C ATOM 434 O GLN A 77 16.956 99.737 -6.253 1.00 0.00 O ATOM 435 CB GLN A 77 16.141 101.395 -3.592 1.00 0.00 C ATOM 436 CG GLN A 77 14.865 101.571 -2.763 1.00 0.00 C ATOM 437 CD GLN A 77 14.450 103.038 -2.756 1.00 0.00 C ATOM 438 OE1 GLN A 77 13.380 103.383 -3.256 1.00 0.00 O ATOM 439 NE2 GLN A 77 15.239 103.928 -2.220 1.00 0.00 N ATOM 0 H GLN A 77 16.961 99.714 -1.937 1.00 0.00 H new ATOM 0 HA GLN A 77 15.372 99.505 -4.279 1.00 0.00 H new ATOM 0 HB2 GLN A 77 17.003 101.751 -3.028 1.00 0.00 H new ATOM 0 HB3 GLN A 77 16.082 101.998 -4.498 1.00 0.00 H new ATOM 0 HG2 GLN A 77 14.064 100.959 -3.178 1.00 0.00 H new ATOM 0 HG3 GLN A 77 15.033 101.227 -1.743 1.00 0.00 H new ATOM 0 HE21 GLN A 77 16.126 103.640 -1.806 1.00 0.00 H new ATOM 0 HE22 GLN A 77 14.969 104.912 -2.215 1.00 0.00 H new ATOM 448 N ARG A 78 18.615 99.803 -4.786 1.00 0.00 N ATOM 449 CA ARG A 78 19.655 99.726 -5.860 1.00 0.00 C ATOM 450 C ARG A 78 19.499 98.435 -6.668 1.00 0.00 C ATOM 451 O ARG A 78 19.561 98.465 -7.904 1.00 0.00 O ATOM 452 CB ARG A 78 21.066 99.781 -5.230 1.00 0.00 C ATOM 453 CG ARG A 78 21.991 100.708 -6.037 1.00 0.00 C ATOM 454 CD ARG A 78 21.629 102.169 -5.749 1.00 0.00 C ATOM 455 NE ARG A 78 22.704 103.086 -6.260 1.00 0.00 N ATOM 456 CZ ARG A 78 22.738 103.495 -7.521 1.00 0.00 C ATOM 457 NH1 ARG A 78 23.687 104.308 -7.898 1.00 0.00 N ATOM 458 NH2 ARG A 78 21.848 103.100 -8.405 1.00 0.00 N ATOM 0 H ARG A 78 18.982 99.854 -3.836 1.00 0.00 H new ATOM 0 HA ARG A 78 19.525 100.575 -6.531 1.00 0.00 H new ATOM 0 HB2 ARG A 78 20.996 100.136 -4.202 1.00 0.00 H new ATOM 0 HB3 ARG A 78 21.492 98.778 -5.193 1.00 0.00 H new ATOM 0 HG2 ARG A 78 23.032 100.521 -5.772 1.00 0.00 H new ATOM 0 HG3 ARG A 78 21.891 100.501 -7.102 1.00 0.00 H new ATOM 0 HD2 ARG A 78 20.678 102.415 -6.222 1.00 0.00 H new ATOM 0 HD3 ARG A 78 21.499 102.313 -4.676 1.00 0.00 H new ATOM 0 HE ARG A 78 23.430 103.404 -5.617 1.00 0.00 H new ATOM 0 HH11 ARG A 78 24.388 104.619 -7.226 1.00 0.00 H new ATOM 0 HH12 ARG A 78 23.727 104.632 -8.864 1.00 0.00 H new ATOM 0 HH21 ARG A 78 21.103 102.460 -8.128 1.00 0.00 H new ATOM 0 HH22 ARG A 78 21.902 103.433 -9.367 1.00 0.00 H new ATOM 472 N MET A 79 19.329 97.306 -6.008 1.00 0.00 N ATOM 473 CA MET A 79 19.214 96.006 -6.753 1.00 0.00 C ATOM 474 C MET A 79 17.884 95.930 -7.527 1.00 0.00 C ATOM 475 O MET A 79 17.879 95.589 -8.715 1.00 0.00 O ATOM 476 CB MET A 79 19.336 94.850 -5.730 1.00 0.00 C ATOM 477 CG MET A 79 19.021 93.469 -6.356 1.00 0.00 C ATOM 478 SD MET A 79 17.508 92.798 -5.614 1.00 0.00 S ATOM 479 CE MET A 79 18.223 92.326 -4.020 1.00 0.00 C ATOM 0 H MET A 79 19.266 97.230 -4.993 1.00 0.00 H new ATOM 0 HA MET A 79 20.013 95.928 -7.491 1.00 0.00 H new ATOM 0 HB2 MET A 79 20.346 94.837 -5.319 1.00 0.00 H new ATOM 0 HB3 MET A 79 18.656 95.032 -4.898 1.00 0.00 H new ATOM 0 HG2 MET A 79 18.897 93.567 -7.435 1.00 0.00 H new ATOM 0 HG3 MET A 79 19.854 92.785 -6.191 1.00 0.00 H new ATOM 0 HE1 MET A 79 18.090 91.255 -3.864 1.00 0.00 H new ATOM 0 HE2 MET A 79 19.287 92.564 -4.014 1.00 0.00 H new ATOM 0 HE3 MET A 79 17.724 92.874 -3.221 1.00 0.00 H new ATOM 489 N ILE A 80 16.777 96.234 -6.891 1.00 0.00 N ATOM 490 CA ILE A 80 15.442 96.179 -7.585 1.00 0.00 C ATOM 491 C ILE A 80 15.313 97.300 -8.620 1.00 0.00 C ATOM 492 O ILE A 80 14.880 97.069 -9.749 1.00 0.00 O ATOM 493 CB ILE A 80 14.294 96.260 -6.566 1.00 0.00 C ATOM 494 CG1 ILE A 80 14.442 97.514 -5.650 1.00 0.00 C ATOM 495 CG2 ILE A 80 14.303 94.982 -5.714 1.00 0.00 C ATOM 496 CD1 ILE A 80 13.552 98.662 -6.147 1.00 0.00 C ATOM 0 H ILE A 80 16.737 96.521 -5.913 1.00 0.00 H new ATOM 0 HA ILE A 80 15.377 95.224 -8.106 1.00 0.00 H new ATOM 0 HB ILE A 80 13.348 96.350 -7.100 1.00 0.00 H new ATOM 0 HG12 ILE A 80 14.172 97.256 -4.626 1.00 0.00 H new ATOM 0 HG13 ILE A 80 15.483 97.836 -5.633 1.00 0.00 H new ATOM 0 HG21 ILE A 80 13.493 95.025 -4.986 1.00 0.00 H new ATOM 0 HG22 ILE A 80 14.166 94.114 -6.359 1.00 0.00 H new ATOM 0 HG23 ILE A 80 15.256 94.899 -5.192 1.00 0.00 H new ATOM 0 HD11 ILE A 80 13.672 99.525 -5.492 1.00 0.00 H new ATOM 0 HD12 ILE A 80 13.841 98.933 -7.162 1.00 0.00 H new ATOM 0 HD13 ILE A 80 12.510 98.344 -6.140 1.00 0.00 H new ATOM 508 N ALA A 81 15.659 98.504 -8.240 1.00 0.00 N ATOM 509 CA ALA A 81 15.554 99.690 -9.155 1.00 0.00 C ATOM 510 C ALA A 81 16.626 99.646 -10.245 1.00 0.00 C ATOM 511 O ALA A 81 16.624 100.500 -11.139 1.00 0.00 O ATOM 512 CB ALA A 81 15.669 100.996 -8.369 1.00 0.00 C ATOM 0 H ALA A 81 16.019 98.723 -7.311 1.00 0.00 H new ATOM 0 HA ALA A 81 14.574 99.649 -9.631 1.00 0.00 H new ATOM 0 HB1 ALA A 81 15.590 101.841 -9.053 1.00 0.00 H new ATOM 0 HB2 ALA A 81 14.867 101.049 -7.633 1.00 0.00 H new ATOM 0 HB3 ALA A 81 16.632 101.031 -7.860 1.00 0.00 H new ATOM 518 N ALA A 82 17.552 98.707 -10.184 1.00 0.00 N ATOM 519 CA ALA A 82 18.639 98.658 -11.214 1.00 0.00 C ATOM 520 C ALA A 82 18.155 97.906 -12.459 1.00 0.00 C ATOM 521 O ALA A 82 18.980 97.509 -13.292 1.00 0.00 O ATOM 522 CB ALA A 82 19.857 97.922 -10.659 1.00 0.00 C ATOM 0 H ALA A 82 17.598 97.980 -9.470 1.00 0.00 H new ATOM 0 HA ALA A 82 18.905 99.683 -11.474 1.00 0.00 H new ATOM 0 HB1 ALA A 82 20.641 97.893 -11.416 1.00 0.00 H new ATOM 0 HB2 ALA A 82 20.226 98.443 -9.775 1.00 0.00 H new ATOM 0 HB3 ALA A 82 19.575 96.904 -10.389 1.00 0.00 H new ATOM 528 N VAL A 83 16.847 97.726 -12.632 1.00 0.00 N ATOM 529 CA VAL A 83 16.330 97.030 -13.857 1.00 0.00 C ATOM 530 C VAL A 83 16.961 97.685 -15.089 1.00 0.00 C ATOM 531 O VAL A 83 16.896 98.905 -15.254 1.00 0.00 O ATOM 532 CB VAL A 83 14.785 97.114 -13.946 1.00 0.00 C ATOM 533 CG1 VAL A 83 14.147 96.276 -12.832 1.00 0.00 C ATOM 534 CG2 VAL A 83 14.299 98.567 -13.810 1.00 0.00 C ATOM 0 H VAL A 83 16.129 98.033 -11.976 1.00 0.00 H new ATOM 0 HA VAL A 83 16.598 95.975 -13.806 1.00 0.00 H new ATOM 0 HB VAL A 83 14.489 96.729 -14.922 1.00 0.00 H new ATOM 0 HG11 VAL A 83 13.061 96.342 -12.904 1.00 0.00 H new ATOM 0 HG12 VAL A 83 14.455 95.236 -12.937 1.00 0.00 H new ATOM 0 HG13 VAL A 83 14.470 96.654 -11.862 1.00 0.00 H new ATOM 0 HG21 VAL A 83 13.211 98.595 -13.876 1.00 0.00 H new ATOM 0 HG22 VAL A 83 14.614 98.967 -12.846 1.00 0.00 H new ATOM 0 HG23 VAL A 83 14.727 99.170 -14.611 1.00 0.00 H new ATOM 544 N ASP A 84 17.608 96.898 -15.925 1.00 0.00 N ATOM 545 CA ASP A 84 18.290 97.438 -17.157 1.00 0.00 C ATOM 546 C ASP A 84 17.404 98.487 -17.829 1.00 0.00 C ATOM 547 O ASP A 84 16.179 98.468 -17.660 1.00 0.00 O ATOM 548 CB ASP A 84 18.572 96.301 -18.142 1.00 0.00 C ATOM 549 CG ASP A 84 19.575 95.321 -17.542 1.00 0.00 C ATOM 550 OD1 ASP A 84 20.574 95.776 -17.008 1.00 0.00 O ATOM 551 OD2 ASP A 84 19.329 94.129 -17.627 1.00 0.00 O ATOM 0 H ASP A 84 17.694 95.889 -15.805 1.00 0.00 H new ATOM 0 HA ASP A 84 19.232 97.899 -16.861 1.00 0.00 H new ATOM 0 HB2 ASP A 84 17.645 95.781 -18.384 1.00 0.00 H new ATOM 0 HB3 ASP A 84 18.963 96.707 -19.075 1.00 0.00 H new ATOM 556 N THR A 85 17.994 99.404 -18.561 1.00 0.00 N ATOM 557 CA THR A 85 17.185 100.478 -19.226 1.00 0.00 C ATOM 558 C THR A 85 16.588 99.976 -20.549 1.00 0.00 C ATOM 559 O THR A 85 15.733 100.656 -21.129 1.00 0.00 O ATOM 560 CB THR A 85 17.966 101.818 -19.416 1.00 0.00 C ATOM 561 OG1 THR A 85 17.369 102.565 -20.466 1.00 0.00 O ATOM 562 CG2 THR A 85 19.462 101.624 -19.740 1.00 0.00 C ATOM 0 H THR A 85 18.999 99.455 -18.727 1.00 0.00 H new ATOM 0 HA THR A 85 16.366 100.711 -18.546 1.00 0.00 H new ATOM 0 HB THR A 85 17.909 102.344 -18.463 1.00 0.00 H new ATOM 0 HG1 THR A 85 16.469 102.220 -20.642 1.00 0.00 H new ATOM 0 HG21 THR A 85 19.938 102.597 -19.858 1.00 0.00 H new ATOM 0 HG22 THR A 85 19.943 101.081 -18.926 1.00 0.00 H new ATOM 0 HG23 THR A 85 19.563 101.056 -20.665 1.00 0.00 H new ATOM 570 N ASP A 86 17.003 98.820 -21.044 1.00 0.00 N ATOM 571 CA ASP A 86 16.446 98.303 -22.328 1.00 0.00 C ATOM 572 C ASP A 86 15.358 97.265 -22.021 1.00 0.00 C ATOM 573 O ASP A 86 15.645 96.222 -21.424 1.00 0.00 O ATOM 574 CB ASP A 86 17.569 97.675 -23.164 1.00 0.00 C ATOM 575 CG ASP A 86 18.159 96.461 -22.451 1.00 0.00 C ATOM 576 OD1 ASP A 86 18.545 96.603 -21.304 1.00 0.00 O ATOM 577 OD2 ASP A 86 18.215 95.408 -23.066 1.00 0.00 O ATOM 0 H ASP A 86 17.703 98.221 -20.606 1.00 0.00 H new ATOM 0 HA ASP A 86 16.007 99.121 -22.899 1.00 0.00 H new ATOM 0 HB2 ASP A 86 17.181 97.378 -24.138 1.00 0.00 H new ATOM 0 HB3 ASP A 86 18.351 98.413 -23.344 1.00 0.00 H new ATOM 582 N SER A 87 14.120 97.524 -22.411 1.00 0.00 N ATOM 583 CA SER A 87 13.008 96.555 -22.145 1.00 0.00 C ATOM 584 C SER A 87 12.866 96.333 -20.618 1.00 0.00 C ATOM 585 O SER A 87 12.980 95.196 -20.142 1.00 0.00 O ATOM 586 CB SER A 87 13.285 95.228 -22.870 1.00 0.00 C ATOM 587 OG SER A 87 13.644 95.497 -24.219 1.00 0.00 O ATOM 0 H SER A 87 13.838 98.371 -22.904 1.00 0.00 H new ATOM 0 HA SER A 87 12.071 96.961 -22.525 1.00 0.00 H new ATOM 0 HB2 SER A 87 14.088 94.687 -22.369 1.00 0.00 H new ATOM 0 HB3 SER A 87 12.401 94.591 -22.837 1.00 0.00 H new ATOM 0 HG SER A 87 13.823 94.653 -24.684 1.00 0.00 H new ATOM 593 N PRO A 88 12.607 97.384 -19.831 1.00 0.00 N ATOM 594 CA PRO A 88 12.443 97.244 -18.347 1.00 0.00 C ATOM 595 C PRO A 88 11.227 96.388 -18.003 1.00 0.00 C ATOM 596 O PRO A 88 11.266 95.564 -17.080 1.00 0.00 O ATOM 597 CB PRO A 88 12.269 98.682 -17.845 1.00 0.00 C ATOM 598 CG PRO A 88 11.821 99.469 -19.030 1.00 0.00 C ATOM 599 CD PRO A 88 12.442 98.799 -20.252 1.00 0.00 C ATOM 0 HA PRO A 88 13.293 96.744 -17.883 1.00 0.00 H new ATOM 0 HB2 PRO A 88 11.534 98.730 -17.042 1.00 0.00 H new ATOM 0 HB3 PRO A 88 13.204 99.074 -17.445 1.00 0.00 H new ATOM 0 HG2 PRO A 88 10.733 99.477 -19.102 1.00 0.00 H new ATOM 0 HG3 PRO A 88 12.143 100.507 -18.951 1.00 0.00 H new ATOM 0 HD2 PRO A 88 11.797 98.884 -21.127 1.00 0.00 H new ATOM 0 HD3 PRO A 88 13.398 99.253 -20.515 1.00 0.00 H new ATOM 607 N ARG A 89 10.156 96.552 -18.744 1.00 0.00 N ATOM 608 CA ARG A 89 8.929 95.736 -18.492 1.00 0.00 C ATOM 609 C ARG A 89 9.249 94.257 -18.729 1.00 0.00 C ATOM 610 O ARG A 89 8.551 93.381 -18.213 1.00 0.00 O ATOM 611 CB ARG A 89 7.801 96.175 -19.428 1.00 0.00 C ATOM 612 CG ARG A 89 7.404 97.616 -19.109 1.00 0.00 C ATOM 613 CD ARG A 89 6.277 98.050 -20.045 1.00 0.00 C ATOM 614 NE ARG A 89 5.909 99.484 -19.789 1.00 0.00 N ATOM 615 CZ ARG A 89 4.763 100.001 -20.207 1.00 0.00 C ATOM 616 NH1 ARG A 89 4.503 101.254 -19.951 1.00 0.00 N ATOM 617 NH2 ARG A 89 3.879 99.289 -20.872 1.00 0.00 N ATOM 0 H ARG A 89 10.081 97.217 -19.513 1.00 0.00 H new ATOM 0 HA ARG A 89 8.607 95.882 -17.461 1.00 0.00 H new ATOM 0 HB2 ARG A 89 8.125 96.097 -20.466 1.00 0.00 H new ATOM 0 HB3 ARG A 89 6.941 95.516 -19.312 1.00 0.00 H new ATOM 0 HG2 ARG A 89 7.080 97.695 -18.071 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.263 98.276 -19.226 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.589 97.927 -21.082 1.00 0.00 H new ATOM 0 HD3 ARG A 89 5.406 97.412 -19.897 1.00 0.00 H new ATOM 0 HE ARG A 89 6.562 100.078 -19.278 1.00 0.00 H new ATOM 0 HH11 ARG A 89 5.178 101.820 -19.436 1.00 0.00 H new ATOM 0 HH12 ARG A 89 3.625 101.667 -20.266 1.00 0.00 H new ATOM 0 HH21 ARG A 89 4.066 98.308 -21.080 1.00 0.00 H new ATOM 0 HH22 ARG A 89 3.006 99.718 -21.180 1.00 0.00 H new ATOM 631 N GLU A 90 10.279 93.968 -19.503 1.00 0.00 N ATOM 632 CA GLU A 90 10.653 92.551 -19.795 1.00 0.00 C ATOM 633 C GLU A 90 11.176 91.870 -18.531 1.00 0.00 C ATOM 634 O GLU A 90 10.796 90.728 -18.251 1.00 0.00 O ATOM 635 CB GLU A 90 11.722 92.509 -20.892 1.00 0.00 C ATOM 636 CG GLU A 90 11.903 91.070 -21.384 1.00 0.00 C ATOM 637 CD GLU A 90 12.680 91.065 -22.697 1.00 0.00 C ATOM 638 OE1 GLU A 90 13.653 90.337 -22.785 1.00 0.00 O ATOM 639 OE2 GLU A 90 12.289 91.795 -23.594 1.00 0.00 O ATOM 0 H GLU A 90 10.877 94.666 -19.945 1.00 0.00 H new ATOM 0 HA GLU A 90 9.767 92.018 -20.139 1.00 0.00 H new ATOM 0 HB2 GLU A 90 11.430 93.153 -21.722 1.00 0.00 H new ATOM 0 HB3 GLU A 90 12.667 92.893 -20.507 1.00 0.00 H new ATOM 0 HG2 GLU A 90 12.435 90.484 -20.634 1.00 0.00 H new ATOM 0 HG3 GLU A 90 10.930 90.599 -21.525 1.00 0.00 H new ATOM 646 N VAL A 91 12.029 92.528 -17.762 1.00 0.00 N ATOM 647 CA VAL A 91 12.562 91.878 -16.514 1.00 0.00 C ATOM 648 C VAL A 91 11.410 91.702 -15.521 1.00 0.00 C ATOM 649 O VAL A 91 11.334 90.684 -14.820 1.00 0.00 O ATOM 650 CB VAL A 91 13.745 92.672 -15.873 1.00 0.00 C ATOM 651 CG1 VAL A 91 14.779 93.046 -16.939 1.00 0.00 C ATOM 652 CG2 VAL A 91 13.281 93.966 -15.177 1.00 0.00 C ATOM 0 H VAL A 91 12.372 93.471 -17.944 1.00 0.00 H new ATOM 0 HA VAL A 91 12.974 90.906 -16.784 1.00 0.00 H new ATOM 0 HB VAL A 91 14.184 92.013 -15.124 1.00 0.00 H new ATOM 0 HG11 VAL A 91 15.596 93.599 -16.475 1.00 0.00 H new ATOM 0 HG12 VAL A 91 15.170 92.139 -17.401 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.308 93.667 -17.701 1.00 0.00 H new ATOM 0 HG21 VAL A 91 14.143 94.478 -14.749 1.00 0.00 H new ATOM 0 HG22 VAL A 91 12.797 94.617 -15.905 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.575 93.720 -14.384 1.00 0.00 H new ATOM 662 N PHE A 92 10.511 92.663 -15.465 1.00 0.00 N ATOM 663 CA PHE A 92 9.351 92.567 -14.536 1.00 0.00 C ATOM 664 C PHE A 92 8.418 91.460 -15.036 1.00 0.00 C ATOM 665 O PHE A 92 7.883 90.681 -14.241 1.00 0.00 O ATOM 666 CB PHE A 92 8.630 93.920 -14.471 1.00 0.00 C ATOM 667 CG PHE A 92 7.487 93.851 -13.484 1.00 0.00 C ATOM 668 CD1 PHE A 92 6.184 93.711 -13.956 1.00 0.00 C ATOM 669 CD2 PHE A 92 7.733 93.916 -12.107 1.00 0.00 C ATOM 670 CE1 PHE A 92 5.116 93.637 -13.057 1.00 0.00 C ATOM 671 CE2 PHE A 92 6.666 93.843 -11.204 1.00 0.00 C ATOM 672 CZ PHE A 92 5.356 93.702 -11.680 1.00 0.00 C ATOM 0 H PHE A 92 10.539 93.512 -16.030 1.00 0.00 H new ATOM 0 HA PHE A 92 9.684 92.319 -13.528 1.00 0.00 H new ATOM 0 HB2 PHE A 92 9.331 94.701 -14.174 1.00 0.00 H new ATOM 0 HB3 PHE A 92 8.253 94.188 -15.458 1.00 0.00 H new ATOM 0 HD1 PHE A 92 5.998 93.660 -15.019 1.00 0.00 H new ATOM 0 HD2 PHE A 92 8.744 94.022 -11.742 1.00 0.00 H new ATOM 0 HE1 PHE A 92 4.106 93.530 -13.425 1.00 0.00 H new ATOM 0 HE2 PHE A 92 6.852 93.895 -10.141 1.00 0.00 H new ATOM 0 HZ PHE A 92 4.532 93.644 -10.985 1.00 0.00 H new ATOM 682 N PHE A 93 8.226 91.380 -16.334 1.00 0.00 N ATOM 683 CA PHE A 93 7.339 90.328 -16.921 1.00 0.00 C ATOM 684 C PHE A 93 7.878 88.946 -16.553 1.00 0.00 C ATOM 685 O PHE A 93 7.102 88.002 -16.381 1.00 0.00 O ATOM 686 CB PHE A 93 7.285 90.479 -18.448 1.00 0.00 C ATOM 687 CG PHE A 93 6.036 89.823 -18.995 1.00 0.00 C ATOM 688 CD1 PHE A 93 4.865 90.575 -19.147 1.00 0.00 C ATOM 689 CD2 PHE A 93 6.051 88.469 -19.350 1.00 0.00 C ATOM 690 CE1 PHE A 93 3.708 89.972 -19.656 1.00 0.00 C ATOM 691 CE2 PHE A 93 4.893 87.867 -19.858 1.00 0.00 C ATOM 692 CZ PHE A 93 3.722 88.619 -20.011 1.00 0.00 C ATOM 0 H PHE A 93 8.652 92.007 -17.017 1.00 0.00 H new ATOM 0 HA PHE A 93 6.331 90.442 -16.521 1.00 0.00 H new ATOM 0 HB2 PHE A 93 7.297 91.535 -18.717 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.169 90.026 -18.897 1.00 0.00 H new ATOM 0 HD1 PHE A 93 4.854 91.619 -18.872 1.00 0.00 H new ATOM 0 HD2 PHE A 93 6.955 87.889 -19.232 1.00 0.00 H new ATOM 0 HE1 PHE A 93 2.805 90.552 -19.774 1.00 0.00 H new ATOM 0 HE2 PHE A 93 4.903 86.822 -20.132 1.00 0.00 H new ATOM 0 HZ PHE A 93 2.829 88.154 -20.403 1.00 0.00 H new ATOM 702 N ARG A 94 9.184 88.808 -16.433 1.00 0.00 N ATOM 703 CA ARG A 94 9.785 87.486 -16.076 1.00 0.00 C ATOM 704 C ARG A 94 9.432 87.140 -14.631 1.00 0.00 C ATOM 705 O ARG A 94 9.071 85.998 -14.335 1.00 0.00 O ATOM 706 CB ARG A 94 11.308 87.533 -16.235 1.00 0.00 C ATOM 707 CG ARG A 94 11.673 87.713 -17.718 1.00 0.00 C ATOM 708 CD ARG A 94 11.534 86.387 -18.491 1.00 0.00 C ATOM 709 NE ARG A 94 10.628 86.580 -19.676 1.00 0.00 N ATOM 710 CZ ARG A 94 10.774 85.891 -20.799 1.00 0.00 C ATOM 711 NH1 ARG A 94 9.967 86.133 -21.795 1.00 0.00 N ATOM 712 NH2 ARG A 94 11.699 84.965 -20.936 1.00 0.00 N ATOM 0 H ARG A 94 9.858 89.562 -16.569 1.00 0.00 H new ATOM 0 HA ARG A 94 9.385 86.724 -16.745 1.00 0.00 H new ATOM 0 HB2 ARG A 94 11.719 88.354 -15.648 1.00 0.00 H new ATOM 0 HB3 ARG A 94 11.751 86.614 -15.851 1.00 0.00 H new ATOM 0 HG2 ARG A 94 11.026 88.467 -18.166 1.00 0.00 H new ATOM 0 HG3 ARG A 94 12.696 88.080 -17.802 1.00 0.00 H new ATOM 0 HD2 ARG A 94 12.514 86.045 -18.823 1.00 0.00 H new ATOM 0 HD3 ARG A 94 11.132 85.614 -17.836 1.00 0.00 H new ATOM 0 HE ARG A 94 9.875 87.265 -19.613 1.00 0.00 H new ATOM 0 HH11 ARG A 94 9.240 86.842 -21.701 1.00 0.00 H new ATOM 0 HH12 ARG A 94 10.063 85.613 -22.667 1.00 0.00 H new ATOM 0 HH21 ARG A 94 12.332 84.758 -20.163 1.00 0.00 H new ATOM 0 HH22 ARG A 94 11.783 84.454 -21.815 1.00 0.00 H new ATOM 726 N VAL A 95 9.541 88.096 -13.730 1.00 0.00 N ATOM 727 CA VAL A 95 9.221 87.825 -12.282 1.00 0.00 C ATOM 728 C VAL A 95 7.748 87.443 -12.155 1.00 0.00 C ATOM 729 O VAL A 95 7.406 86.444 -11.506 1.00 0.00 O ATOM 730 CB VAL A 95 9.476 89.076 -11.416 1.00 0.00 C ATOM 731 CG1 VAL A 95 9.331 88.721 -9.930 1.00 0.00 C ATOM 732 CG2 VAL A 95 10.884 89.621 -11.667 1.00 0.00 C ATOM 0 H VAL A 95 9.837 89.051 -13.933 1.00 0.00 H new ATOM 0 HA VAL A 95 9.863 87.015 -11.936 1.00 0.00 H new ATOM 0 HB VAL A 95 8.744 89.837 -11.685 1.00 0.00 H new ATOM 0 HG11 VAL A 95 9.512 89.609 -9.324 1.00 0.00 H new ATOM 0 HG12 VAL A 95 8.323 88.352 -9.741 1.00 0.00 H new ATOM 0 HG13 VAL A 95 10.055 87.949 -9.668 1.00 0.00 H new ATOM 0 HG21 VAL A 95 11.048 90.503 -11.049 1.00 0.00 H new ATOM 0 HG22 VAL A 95 11.620 88.858 -11.413 1.00 0.00 H new ATOM 0 HG23 VAL A 95 10.988 89.890 -12.718 1.00 0.00 H new ATOM 742 N ALA A 96 6.877 88.219 -12.759 1.00 0.00 N ATOM 743 CA ALA A 96 5.413 87.927 -12.685 1.00 0.00 C ATOM 744 C ALA A 96 5.140 86.610 -13.412 1.00 0.00 C ATOM 745 O ALA A 96 4.397 85.750 -12.918 1.00 0.00 O ATOM 746 CB ALA A 96 4.620 89.073 -13.328 1.00 0.00 C ATOM 0 H ALA A 96 7.122 89.047 -13.303 1.00 0.00 H new ATOM 0 HA ALA A 96 5.100 87.838 -11.645 1.00 0.00 H new ATOM 0 HB1 ALA A 96 3.554 88.854 -13.271 1.00 0.00 H new ATOM 0 HB2 ALA A 96 4.829 90.002 -12.798 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.914 89.177 -14.372 1.00 0.00 H new ATOM 752 N ALA A 97 5.740 86.439 -14.568 1.00 0.00 N ATOM 753 CA ALA A 97 5.555 85.185 -15.359 1.00 0.00 C ATOM 754 C ALA A 97 6.028 83.999 -14.525 1.00 0.00 C ATOM 755 O ALA A 97 5.418 82.927 -14.559 1.00 0.00 O ATOM 756 CB ALA A 97 6.356 85.259 -16.661 1.00 0.00 C ATOM 0 H ALA A 97 6.358 87.126 -15.000 1.00 0.00 H new ATOM 0 HA ALA A 97 4.501 85.064 -15.607 1.00 0.00 H new ATOM 0 HB1 ALA A 97 6.213 84.340 -17.229 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.012 86.108 -17.252 1.00 0.00 H new ATOM 0 HB3 ALA A 97 7.414 85.383 -16.431 1.00 0.00 H new ATOM 762 N ASP A 98 7.096 84.175 -13.774 1.00 0.00 N ATOM 763 CA ASP A 98 7.624 83.069 -12.918 1.00 0.00 C ATOM 764 C ASP A 98 6.542 82.647 -11.930 1.00 0.00 C ATOM 765 O ASP A 98 6.365 81.452 -11.668 1.00 0.00 O ATOM 766 CB ASP A 98 8.867 83.536 -12.158 1.00 0.00 C ATOM 767 CG ASP A 98 10.108 83.349 -13.024 1.00 0.00 C ATOM 768 OD1 ASP A 98 10.437 82.210 -13.313 1.00 0.00 O ATOM 769 OD2 ASP A 98 10.711 84.345 -13.385 1.00 0.00 O ATOM 0 H ASP A 98 7.624 85.046 -13.721 1.00 0.00 H new ATOM 0 HA ASP A 98 7.900 82.223 -13.548 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.761 84.585 -11.881 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.971 82.971 -11.232 1.00 0.00 H new ATOM 774 N MET A 99 5.813 83.599 -11.383 1.00 0.00 N ATOM 775 CA MET A 99 4.726 83.267 -10.407 1.00 0.00 C ATOM 776 C MET A 99 3.711 82.352 -11.080 1.00 0.00 C ATOM 777 O MET A 99 3.229 81.388 -10.475 1.00 0.00 O ATOM 778 CB MET A 99 3.981 84.532 -9.966 1.00 0.00 C ATOM 779 CG MET A 99 4.946 85.572 -9.391 1.00 0.00 C ATOM 780 SD MET A 99 4.013 86.778 -8.406 1.00 0.00 S ATOM 781 CE MET A 99 3.069 87.549 -9.752 1.00 0.00 C ATOM 0 H MET A 99 5.928 84.594 -11.574 1.00 0.00 H new ATOM 0 HA MET A 99 5.184 82.788 -9.542 1.00 0.00 H new ATOM 0 HB2 MET A 99 3.448 84.958 -10.816 1.00 0.00 H new ATOM 0 HB3 MET A 99 3.232 84.274 -9.217 1.00 0.00 H new ATOM 0 HG2 MET A 99 5.698 85.083 -8.771 1.00 0.00 H new ATOM 0 HG3 MET A 99 5.477 86.077 -10.198 1.00 0.00 H new ATOM 0 HE1 MET A 99 2.134 87.948 -9.359 1.00 0.00 H new ATOM 0 HE2 MET A 99 3.654 88.359 -10.189 1.00 0.00 H new ATOM 0 HE3 MET A 99 2.852 86.804 -10.517 1.00 0.00 H new ATOM 791 N PHE A 100 3.358 82.660 -12.309 1.00 0.00 N ATOM 792 CA PHE A 100 2.341 81.844 -13.043 1.00 0.00 C ATOM 793 C PHE A 100 2.953 80.536 -13.547 1.00 0.00 C ATOM 794 O PHE A 100 2.242 79.529 -13.652 1.00 0.00 O ATOM 795 CB PHE A 100 1.767 82.650 -14.218 1.00 0.00 C ATOM 796 CG PHE A 100 0.554 81.942 -14.779 1.00 0.00 C ATOM 797 CD1 PHE A 100 0.718 80.898 -15.698 1.00 0.00 C ATOM 798 CD2 PHE A 100 -0.733 82.329 -14.383 1.00 0.00 C ATOM 799 CE1 PHE A 100 -0.402 80.243 -16.221 1.00 0.00 C ATOM 800 CE2 PHE A 100 -1.853 81.674 -14.906 1.00 0.00 C ATOM 801 CZ PHE A 100 -1.688 80.630 -15.825 1.00 0.00 C ATOM 0 H PHE A 100 3.735 83.448 -12.836 1.00 0.00 H new ATOM 0 HA PHE A 100 1.534 81.598 -12.353 1.00 0.00 H new ATOM 0 HB2 PHE A 100 1.494 83.651 -13.885 1.00 0.00 H new ATOM 0 HB3 PHE A 100 2.523 82.767 -14.995 1.00 0.00 H new ATOM 0 HD1 PHE A 100 1.710 80.598 -16.003 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -0.860 83.133 -13.674 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -0.275 79.439 -16.930 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -2.845 81.973 -14.601 1.00 0.00 H new ATOM 0 HZ PHE A 100 -2.553 80.124 -16.228 1.00 0.00 H new ATOM 811 N SER A 101 4.229 80.523 -13.883 1.00 0.00 N ATOM 812 CA SER A 101 4.851 79.265 -14.408 1.00 0.00 C ATOM 813 C SER A 101 4.931 78.200 -13.310 1.00 0.00 C ATOM 814 O SER A 101 4.623 77.031 -13.567 1.00 0.00 O ATOM 815 CB SER A 101 6.256 79.559 -14.937 1.00 0.00 C ATOM 816 OG SER A 101 7.050 80.097 -13.889 1.00 0.00 O ATOM 0 H SER A 101 4.857 81.324 -13.816 1.00 0.00 H new ATOM 0 HA SER A 101 4.227 78.887 -15.218 1.00 0.00 H new ATOM 0 HB2 SER A 101 6.711 78.646 -15.321 1.00 0.00 H new ATOM 0 HB3 SER A 101 6.204 80.263 -15.768 1.00 0.00 H new ATOM 0 HG SER A 101 7.395 79.368 -13.333 1.00 0.00 H new ATOM 822 N ASP A 102 5.321 78.565 -12.102 1.00 0.00 N ATOM 823 CA ASP A 102 5.401 77.557 -10.993 1.00 0.00 C ATOM 824 C ASP A 102 4.219 77.704 -10.026 1.00 0.00 C ATOM 825 O ASP A 102 4.093 76.910 -9.086 1.00 0.00 O ATOM 826 CB ASP A 102 6.710 77.733 -10.225 1.00 0.00 C ATOM 827 CG ASP A 102 7.896 77.464 -11.146 1.00 0.00 C ATOM 828 OD1 ASP A 102 8.758 76.693 -10.760 1.00 0.00 O ATOM 829 OD2 ASP A 102 7.925 78.036 -12.224 1.00 0.00 O ATOM 0 H ASP A 102 5.586 79.515 -11.841 1.00 0.00 H new ATOM 0 HA ASP A 102 5.364 76.562 -11.437 1.00 0.00 H new ATOM 0 HB2 ASP A 102 6.773 78.745 -9.824 1.00 0.00 H new ATOM 0 HB3 ASP A 102 6.737 77.051 -9.375 1.00 0.00 H new ATOM 834 N GLY A 103 3.362 78.690 -10.217 1.00 0.00 N ATOM 835 CA GLY A 103 2.198 78.879 -9.289 1.00 0.00 C ATOM 836 C GLY A 103 2.678 79.512 -7.975 1.00 0.00 C ATOM 837 O GLY A 103 2.023 79.364 -6.938 1.00 0.00 O ATOM 0 H GLY A 103 3.422 79.369 -10.976 1.00 0.00 H new ATOM 0 HA2 GLY A 103 1.447 79.516 -9.757 1.00 0.00 H new ATOM 0 HA3 GLY A 103 1.722 77.919 -9.088 1.00 0.00 H new ATOM 841 N ASN A 104 3.814 80.185 -7.993 1.00 0.00 N ATOM 842 CA ASN A 104 4.365 80.805 -6.745 1.00 0.00 C ATOM 843 C ASN A 104 3.534 82.017 -6.335 1.00 0.00 C ATOM 844 O ASN A 104 3.262 82.906 -7.146 1.00 0.00 O ATOM 845 CB ASN A 104 5.819 81.238 -6.968 1.00 0.00 C ATOM 846 CG ASN A 104 6.650 80.082 -7.528 1.00 0.00 C ATOM 847 OD1 ASN A 104 6.351 78.912 -7.279 1.00 0.00 O ATOM 848 ND2 ASN A 104 7.690 80.346 -8.271 1.00 0.00 N ATOM 0 H ASN A 104 4.383 80.329 -8.827 1.00 0.00 H new ATOM 0 HA ASN A 104 4.325 80.061 -5.949 1.00 0.00 H new ATOM 0 HB2 ASN A 104 5.850 82.082 -7.657 1.00 0.00 H new ATOM 0 HB3 ASN A 104 6.250 81.579 -6.027 1.00 0.00 H new ATOM 0 HD21 ASN A 104 8.256 79.584 -8.646 1.00 0.00 H new ATOM 0 HD22 ASN A 104 7.937 81.314 -8.477 1.00 0.00 H new ATOM 855 N PHE A 105 3.150 82.063 -5.079 1.00 0.00 N ATOM 856 CA PHE A 105 2.347 83.208 -4.541 1.00 0.00 C ATOM 857 C PHE A 105 2.106 82.939 -3.051 1.00 0.00 C ATOM 858 O PHE A 105 1.049 82.429 -2.656 1.00 0.00 O ATOM 859 CB PHE A 105 1.005 83.344 -5.308 1.00 0.00 C ATOM 860 CG PHE A 105 0.827 84.758 -5.840 1.00 0.00 C ATOM 861 CD1 PHE A 105 0.587 85.817 -4.953 1.00 0.00 C ATOM 862 CD2 PHE A 105 0.906 85.008 -7.217 1.00 0.00 C ATOM 863 CE1 PHE A 105 0.426 87.118 -5.441 1.00 0.00 C ATOM 864 CE2 PHE A 105 0.745 86.310 -7.705 1.00 0.00 C ATOM 865 CZ PHE A 105 0.505 87.366 -6.817 1.00 0.00 C ATOM 0 H PHE A 105 3.364 81.340 -4.392 1.00 0.00 H new ATOM 0 HA PHE A 105 2.883 84.148 -4.672 1.00 0.00 H new ATOM 0 HB2 PHE A 105 0.980 82.634 -6.135 1.00 0.00 H new ATOM 0 HB3 PHE A 105 0.176 83.093 -4.647 1.00 0.00 H new ATOM 0 HD1 PHE A 105 0.526 85.628 -3.891 1.00 0.00 H new ATOM 0 HD2 PHE A 105 1.091 84.194 -7.903 1.00 0.00 H new ATOM 0 HE1 PHE A 105 0.241 87.932 -4.756 1.00 0.00 H new ATOM 0 HE2 PHE A 105 0.806 86.500 -8.766 1.00 0.00 H new ATOM 0 HZ PHE A 105 0.381 88.371 -7.193 1.00 0.00 H new ATOM 875 N ASN A 106 3.082 83.251 -2.224 1.00 0.00 N ATOM 876 CA ASN A 106 2.953 83.005 -0.754 1.00 0.00 C ATOM 877 C ASN A 106 2.146 84.131 -0.116 1.00 0.00 C ATOM 878 O ASN A 106 1.752 85.085 -0.796 1.00 0.00 O ATOM 879 CB ASN A 106 4.341 82.923 -0.107 1.00 0.00 C ATOM 880 CG ASN A 106 4.320 81.939 1.059 1.00 0.00 C ATOM 881 OD1 ASN A 106 4.644 82.305 2.189 1.00 0.00 O ATOM 882 ND2 ASN A 106 3.954 80.704 0.848 1.00 0.00 N ATOM 0 H ASN A 106 3.967 83.668 -2.511 1.00 0.00 H new ATOM 0 HA ASN A 106 2.438 82.058 -0.595 1.00 0.00 H new ATOM 0 HB2 ASN A 106 5.077 82.607 -0.846 1.00 0.00 H new ATOM 0 HB3 ASN A 106 4.645 83.909 0.245 1.00 0.00 H new ATOM 0 HD21 ASN A 106 3.936 80.038 1.621 1.00 0.00 H new ATOM 0 HD22 ASN A 106 3.686 80.405 -0.090 1.00 0.00 H new ATOM 889 N TRP A 107 1.895 84.031 1.170 1.00 0.00 N ATOM 890 CA TRP A 107 1.109 85.083 1.881 1.00 0.00 C ATOM 891 C TRP A 107 2.064 86.132 2.450 1.00 0.00 C ATOM 892 O TRP A 107 3.016 85.806 3.165 1.00 0.00 O ATOM 893 CB TRP A 107 0.270 84.444 3.000 1.00 0.00 C ATOM 894 CG TRP A 107 -0.639 85.466 3.616 1.00 0.00 C ATOM 895 CD1 TRP A 107 -0.704 85.740 4.938 1.00 0.00 C ATOM 896 CD2 TRP A 107 -1.604 86.348 2.966 1.00 0.00 C ATOM 897 NE1 TRP A 107 -1.642 86.734 5.144 1.00 0.00 N ATOM 898 CE2 TRP A 107 -2.224 87.142 3.961 1.00 0.00 C ATOM 899 CE3 TRP A 107 -2.000 86.538 1.628 1.00 0.00 C ATOM 900 CZ2 TRP A 107 -3.198 88.090 3.642 1.00 0.00 C ATOM 901 CZ3 TRP A 107 -2.980 87.491 1.304 1.00 0.00 C ATOM 902 CH2 TRP A 107 -3.576 88.266 2.309 1.00 0.00 C ATOM 0 H TRP A 107 2.205 83.258 1.759 1.00 0.00 H new ATOM 0 HA TRP A 107 0.430 85.570 1.181 1.00 0.00 H new ATOM 0 HB2 TRP A 107 -0.318 83.619 2.597 1.00 0.00 H new ATOM 0 HB3 TRP A 107 0.927 84.025 3.762 1.00 0.00 H new ATOM 0 HD1 TRP A 107 -0.118 85.260 5.708 1.00 0.00 H new ATOM 0 HE1 TRP A 107 -1.876 87.119 6.059 1.00 0.00 H new ATOM 0 HE3 TRP A 107 -1.547 85.947 0.846 1.00 0.00 H new ATOM 0 HZ2 TRP A 107 -3.656 88.683 4.420 1.00 0.00 H new ATOM 0 HZ3 TRP A 107 -3.276 87.628 0.274 1.00 0.00 H new ATOM 0 HH2 TRP A 107 -4.327 88.999 2.053 1.00 0.00 H new ATOM 913 N GLY A 108 1.812 87.379 2.137 1.00 0.00 N ATOM 914 CA GLY A 108 2.670 88.507 2.627 1.00 0.00 C ATOM 915 C GLY A 108 3.758 88.857 1.599 1.00 0.00 C ATOM 916 O GLY A 108 4.583 89.743 1.849 1.00 0.00 O ATOM 0 H GLY A 108 1.031 87.670 1.550 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.051 89.383 2.819 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.134 88.231 3.574 1.00 0.00 H new ATOM 920 N ARG A 109 3.755 88.220 0.443 1.00 0.00 N ATOM 921 CA ARG A 109 4.758 88.547 -0.625 1.00 0.00 C ATOM 922 C ARG A 109 4.155 89.614 -1.546 1.00 0.00 C ATOM 923 O ARG A 109 4.866 90.479 -2.074 1.00 0.00 O ATOM 924 CB ARG A 109 5.119 87.277 -1.433 1.00 0.00 C ATOM 925 CG ARG A 109 6.609 86.929 -1.271 1.00 0.00 C ATOM 926 CD ARG A 109 7.467 87.927 -2.060 1.00 0.00 C ATOM 927 NE ARG A 109 7.138 87.868 -3.525 1.00 0.00 N ATOM 928 CZ ARG A 109 7.941 88.385 -4.444 1.00 0.00 C ATOM 929 NH1 ARG A 109 7.597 88.308 -5.701 1.00 0.00 N ATOM 930 NH2 ARG A 109 9.075 88.972 -4.127 1.00 0.00 N ATOM 0 H ARG A 109 3.095 87.483 0.196 1.00 0.00 H new ATOM 0 HA ARG A 109 5.674 88.925 -0.170 1.00 0.00 H new ATOM 0 HB2 ARG A 109 4.507 86.440 -1.096 1.00 0.00 H new ATOM 0 HB3 ARG A 109 4.891 87.434 -2.487 1.00 0.00 H new ATOM 0 HG2 ARG A 109 6.885 86.953 -0.217 1.00 0.00 H new ATOM 0 HG3 ARG A 109 6.795 85.915 -1.626 1.00 0.00 H new ATOM 0 HD2 ARG A 109 7.298 88.936 -1.685 1.00 0.00 H new ATOM 0 HD3 ARG A 109 8.523 87.704 -1.910 1.00 0.00 H new ATOM 0 HE ARG A 109 6.272 87.417 -3.821 1.00 0.00 H new ATOM 0 HH11 ARG A 109 6.722 87.855 -5.963 1.00 0.00 H new ATOM 0 HH12 ARG A 109 8.204 88.701 -6.421 1.00 0.00 H new ATOM 0 HH21 ARG A 109 9.359 89.039 -3.150 1.00 0.00 H new ATOM 0 HH22 ARG A 109 9.670 89.360 -4.859 1.00 0.00 H new ATOM 944 N VAL A 110 2.858 89.554 -1.740 1.00 0.00 N ATOM 945 CA VAL A 110 2.145 90.524 -2.617 1.00 0.00 C ATOM 946 C VAL A 110 2.367 91.948 -2.096 1.00 0.00 C ATOM 947 O VAL A 110 2.471 92.883 -2.882 1.00 0.00 O ATOM 948 CB VAL A 110 0.646 90.166 -2.670 1.00 0.00 C ATOM 949 CG1 VAL A 110 0.000 90.324 -1.285 1.00 0.00 C ATOM 950 CG2 VAL A 110 -0.069 91.071 -3.677 1.00 0.00 C ATOM 0 H VAL A 110 2.253 88.852 -1.313 1.00 0.00 H new ATOM 0 HA VAL A 110 2.540 90.472 -3.631 1.00 0.00 H new ATOM 0 HB VAL A 110 0.551 89.126 -2.982 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -1.057 90.066 -1.345 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.495 89.662 -0.575 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.103 91.356 -0.951 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -1.128 90.813 -3.710 1.00 0.00 H new ATOM 0 HG22 VAL A 110 0.042 92.112 -3.373 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.369 90.933 -4.665 1.00 0.00 H new ATOM 960 N VAL A 111 2.422 92.125 -0.797 1.00 0.00 N ATOM 961 CA VAL A 111 2.616 93.491 -0.209 1.00 0.00 C ATOM 962 C VAL A 111 3.898 94.112 -0.769 1.00 0.00 C ATOM 963 O VAL A 111 3.920 95.304 -1.101 1.00 0.00 O ATOM 964 CB VAL A 111 2.712 93.393 1.335 1.00 0.00 C ATOM 965 CG1 VAL A 111 2.876 94.797 1.948 1.00 0.00 C ATOM 966 CG2 VAL A 111 1.445 92.717 1.913 1.00 0.00 C ATOM 0 H VAL A 111 2.340 91.374 -0.112 1.00 0.00 H new ATOM 0 HA VAL A 111 1.765 94.119 -0.472 1.00 0.00 H new ATOM 0 HB VAL A 111 3.583 92.788 1.588 1.00 0.00 H new ATOM 0 HG11 VAL A 111 2.942 94.715 3.033 1.00 0.00 H new ATOM 0 HG12 VAL A 111 3.785 95.258 1.563 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.016 95.413 1.683 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.528 92.656 2.998 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.566 93.305 1.649 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.347 91.713 1.499 1.00 0.00 H new ATOM 976 N ALA A 112 4.956 93.344 -0.856 1.00 0.00 N ATOM 977 CA ALA A 112 6.255 93.888 -1.365 1.00 0.00 C ATOM 978 C ALA A 112 6.187 94.166 -2.870 1.00 0.00 C ATOM 979 O ALA A 112 6.647 95.220 -3.328 1.00 0.00 O ATOM 980 CB ALA A 112 7.380 92.889 -1.081 1.00 0.00 C ATOM 0 H ALA A 112 4.976 92.358 -0.595 1.00 0.00 H new ATOM 0 HA ALA A 112 6.454 94.828 -0.850 1.00 0.00 H new ATOM 0 HB1 ALA A 112 8.324 93.288 -1.453 1.00 0.00 H new ATOM 0 HB2 ALA A 112 7.455 92.721 -0.007 1.00 0.00 H new ATOM 0 HB3 ALA A 112 7.163 91.945 -1.581 1.00 0.00 H new ATOM 986 N LEU A 113 5.652 93.246 -3.646 1.00 0.00 N ATOM 987 CA LEU A 113 5.582 93.442 -5.135 1.00 0.00 C ATOM 988 C LEU A 113 4.524 94.466 -5.516 1.00 0.00 C ATOM 989 O LEU A 113 4.705 95.187 -6.493 1.00 0.00 O ATOM 990 CB LEU A 113 5.297 92.106 -5.839 1.00 0.00 C ATOM 991 CG LEU A 113 5.809 92.150 -7.290 1.00 0.00 C ATOM 992 CD1 LEU A 113 7.331 91.982 -7.307 1.00 0.00 C ATOM 993 CD2 LEU A 113 5.172 91.016 -8.098 1.00 0.00 C ATOM 0 H LEU A 113 5.260 92.366 -3.311 1.00 0.00 H new ATOM 0 HA LEU A 113 6.550 93.821 -5.462 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.781 91.292 -5.299 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.226 91.903 -5.829 1.00 0.00 H new ATOM 0 HG LEU A 113 5.541 93.110 -7.731 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.689 92.014 -8.336 1.00 0.00 H new ATOM 0 HD12 LEU A 113 7.792 92.788 -6.737 1.00 0.00 H new ATOM 0 HD13 LEU A 113 7.596 91.024 -6.860 1.00 0.00 H new ATOM 0 HD21 LEU A 113 5.537 91.051 -9.124 1.00 0.00 H new ATOM 0 HD22 LEU A 113 5.437 90.058 -7.651 1.00 0.00 H new ATOM 0 HD23 LEU A 113 4.088 91.131 -8.094 1.00 0.00 H new ATOM 1005 N PHE A 114 3.429 94.539 -4.798 1.00 0.00 N ATOM 1006 CA PHE A 114 2.362 95.524 -5.158 1.00 0.00 C ATOM 1007 C PHE A 114 2.881 96.933 -4.889 1.00 0.00 C ATOM 1008 O PHE A 114 2.730 97.823 -5.730 1.00 0.00 O ATOM 1009 CB PHE A 114 1.070 95.271 -4.345 1.00 0.00 C ATOM 1010 CG PHE A 114 -0.191 95.548 -5.175 1.00 0.00 C ATOM 1011 CD1 PHE A 114 -1.255 94.633 -5.138 1.00 0.00 C ATOM 1012 CD2 PHE A 114 -0.307 96.710 -5.967 1.00 0.00 C ATOM 1013 CE1 PHE A 114 -2.418 94.872 -5.882 1.00 0.00 C ATOM 1014 CE2 PHE A 114 -1.470 96.944 -6.709 1.00 0.00 C ATOM 1015 CZ PHE A 114 -2.524 96.027 -6.666 1.00 0.00 C ATOM 0 H PHE A 114 3.229 93.961 -3.982 1.00 0.00 H new ATOM 0 HA PHE A 114 2.117 95.410 -6.214 1.00 0.00 H new ATOM 0 HB2 PHE A 114 1.056 94.238 -3.997 1.00 0.00 H new ATOM 0 HB3 PHE A 114 1.068 95.906 -3.459 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -1.177 93.741 -4.534 1.00 0.00 H new ATOM 0 HD2 PHE A 114 0.505 97.421 -6.001 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -3.233 94.165 -5.851 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -1.553 97.834 -7.315 1.00 0.00 H new ATOM 0 HZ PHE A 114 -3.421 96.210 -7.238 1.00 0.00 H new ATOM 1025 N TYR A 115 3.475 97.156 -3.735 1.00 0.00 N ATOM 1026 CA TYR A 115 3.995 98.520 -3.400 1.00 0.00 C ATOM 1027 C TYR A 115 5.069 98.941 -4.430 1.00 0.00 C ATOM 1028 O TYR A 115 5.050 100.085 -4.903 1.00 0.00 O ATOM 1029 CB TYR A 115 4.503 98.530 -1.920 1.00 0.00 C ATOM 1030 CG TYR A 115 5.991 98.836 -1.789 1.00 0.00 C ATOM 1031 CD1 TYR A 115 6.448 100.153 -1.927 1.00 0.00 C ATOM 1032 CD2 TYR A 115 6.903 97.804 -1.543 1.00 0.00 C ATOM 1033 CE1 TYR A 115 7.816 100.434 -1.816 1.00 0.00 C ATOM 1034 CE2 TYR A 115 8.267 98.084 -1.433 1.00 0.00 C ATOM 1035 CZ TYR A 115 8.726 99.399 -1.571 1.00 0.00 C ATOM 1036 OH TYR A 115 10.073 99.675 -1.462 1.00 0.00 O ATOM 0 H TYR A 115 3.620 96.450 -3.013 1.00 0.00 H new ATOM 0 HA TYR A 115 3.203 99.265 -3.466 1.00 0.00 H new ATOM 0 HB2 TYR A 115 3.937 99.271 -1.355 1.00 0.00 H new ATOM 0 HB3 TYR A 115 4.299 97.560 -1.468 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.746 100.951 -2.119 1.00 0.00 H new ATOM 0 HD2 TYR A 115 6.551 96.788 -1.438 1.00 0.00 H new ATOM 0 HE1 TYR A 115 8.169 101.450 -1.920 1.00 0.00 H new ATOM 0 HE2 TYR A 115 8.968 97.285 -1.241 1.00 0.00 H new ATOM 0 HH TYR A 115 10.241 100.600 -1.737 1.00 0.00 H new ATOM 1046 N PHE A 116 5.991 98.059 -4.783 1.00 0.00 N ATOM 1047 CA PHE A 116 7.050 98.431 -5.776 1.00 0.00 C ATOM 1048 C PHE A 116 6.438 98.478 -7.176 1.00 0.00 C ATOM 1049 O PHE A 116 6.653 99.441 -7.914 1.00 0.00 O ATOM 1050 CB PHE A 116 8.226 97.430 -5.731 1.00 0.00 C ATOM 1051 CG PHE A 116 9.298 97.813 -6.753 1.00 0.00 C ATOM 1052 CD1 PHE A 116 9.645 96.914 -7.772 1.00 0.00 C ATOM 1053 CD2 PHE A 116 9.929 99.070 -6.690 1.00 0.00 C ATOM 1054 CE1 PHE A 116 10.615 97.267 -8.720 1.00 0.00 C ATOM 1055 CE2 PHE A 116 10.898 99.419 -7.637 1.00 0.00 C ATOM 1056 CZ PHE A 116 11.240 98.519 -8.652 1.00 0.00 C ATOM 0 H PHE A 116 6.050 97.106 -4.425 1.00 0.00 H new ATOM 0 HA PHE A 116 7.443 99.415 -5.521 1.00 0.00 H new ATOM 0 HB2 PHE A 116 8.659 97.414 -4.731 1.00 0.00 H new ATOM 0 HB3 PHE A 116 7.862 96.423 -5.937 1.00 0.00 H new ATOM 0 HD1 PHE A 116 9.164 95.948 -7.826 1.00 0.00 H new ATOM 0 HD2 PHE A 116 9.664 99.767 -5.908 1.00 0.00 H new ATOM 0 HE1 PHE A 116 10.881 96.573 -9.504 1.00 0.00 H new ATOM 0 HE2 PHE A 116 11.382 100.383 -7.584 1.00 0.00 H new ATOM 0 HZ PHE A 116 11.987 98.790 -9.384 1.00 0.00 H new ATOM 1066 N ALA A 117 5.692 97.464 -7.550 1.00 0.00 N ATOM 1067 CA ALA A 117 5.055 97.432 -8.908 1.00 0.00 C ATOM 1068 C ALA A 117 4.207 98.681 -9.091 1.00 0.00 C ATOM 1069 O ALA A 117 4.181 99.276 -10.174 1.00 0.00 O ATOM 1070 CB ALA A 117 4.160 96.199 -9.048 1.00 0.00 C ATOM 0 H ALA A 117 5.495 96.650 -6.968 1.00 0.00 H new ATOM 0 HA ALA A 117 5.839 97.392 -9.665 1.00 0.00 H new ATOM 0 HB1 ALA A 117 3.705 96.190 -10.039 1.00 0.00 H new ATOM 0 HB2 ALA A 117 4.759 95.298 -8.916 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.378 96.229 -8.290 1.00 0.00 H new ATOM 1076 N SER A 118 3.517 99.081 -8.049 1.00 0.00 N ATOM 1077 CA SER A 118 2.651 100.297 -8.126 1.00 0.00 C ATOM 1078 C SER A 118 3.525 101.516 -8.407 1.00 0.00 C ATOM 1079 O SER A 118 3.194 102.350 -9.258 1.00 0.00 O ATOM 1080 CB SER A 118 1.900 100.487 -6.808 1.00 0.00 C ATOM 1081 OG SER A 118 2.821 100.850 -5.788 1.00 0.00 O ATOM 0 H SER A 118 3.518 98.613 -7.143 1.00 0.00 H new ATOM 0 HA SER A 118 1.924 100.176 -8.929 1.00 0.00 H new ATOM 0 HB2 SER A 118 1.139 101.260 -6.918 1.00 0.00 H new ATOM 0 HB3 SER A 118 1.383 99.567 -6.536 1.00 0.00 H new ATOM 0 HG SER A 118 3.598 100.253 -5.821 1.00 0.00 H new ATOM 1087 N LYS A 119 4.632 101.631 -7.711 1.00 0.00 N ATOM 1088 CA LYS A 119 5.555 102.793 -7.917 1.00 0.00 C ATOM 1089 C LYS A 119 6.253 102.677 -9.276 1.00 0.00 C ATOM 1090 O LYS A 119 6.582 103.693 -9.898 1.00 0.00 O ATOM 1091 CB LYS A 119 6.610 102.822 -6.801 1.00 0.00 C ATOM 1092 CG LYS A 119 7.442 104.122 -6.881 1.00 0.00 C ATOM 1093 CD LYS A 119 8.824 103.930 -6.198 1.00 0.00 C ATOM 1094 CE LYS A 119 9.949 104.460 -7.100 1.00 0.00 C ATOM 1095 NZ LYS A 119 9.928 105.951 -7.101 1.00 0.00 N ATOM 0 H LYS A 119 4.938 100.963 -7.003 1.00 0.00 H new ATOM 0 HA LYS A 119 4.973 103.714 -7.892 1.00 0.00 H new ATOM 0 HB2 LYS A 119 6.122 102.754 -5.829 1.00 0.00 H new ATOM 0 HB3 LYS A 119 7.266 101.956 -6.890 1.00 0.00 H new ATOM 0 HG2 LYS A 119 7.582 104.407 -7.924 1.00 0.00 H new ATOM 0 HG3 LYS A 119 6.902 104.936 -6.398 1.00 0.00 H new ATOM 0 HD2 LYS A 119 8.839 104.453 -5.242 1.00 0.00 H new ATOM 0 HD3 LYS A 119 8.988 102.873 -5.986 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.914 104.100 -6.744 1.00 0.00 H new ATOM 0 HE3 LYS A 119 9.823 104.084 -8.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 10.690 106.309 -7.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 9.011 106.285 -7.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 10.069 106.301 -6.132 1.00 0.00 H new ATOM 1109 N LEU A 120 6.509 101.468 -9.729 1.00 0.00 N ATOM 1110 CA LEU A 120 7.218 101.264 -11.030 1.00 0.00 C ATOM 1111 C LEU A 120 6.336 101.691 -12.198 1.00 0.00 C ATOM 1112 O LEU A 120 6.822 102.336 -13.135 1.00 0.00 O ATOM 1113 CB LEU A 120 7.603 99.787 -11.183 1.00 0.00 C ATOM 1114 CG LEU A 120 8.610 99.624 -12.329 1.00 0.00 C ATOM 1115 CD1 LEU A 120 9.996 100.095 -11.873 1.00 0.00 C ATOM 1116 CD2 LEU A 120 8.695 98.150 -12.738 1.00 0.00 C ATOM 0 H LEU A 120 6.253 100.608 -9.245 1.00 0.00 H new ATOM 0 HA LEU A 120 8.119 101.878 -11.035 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.035 99.417 -10.253 1.00 0.00 H new ATOM 0 HB3 LEU A 120 6.713 99.189 -11.382 1.00 0.00 H new ATOM 0 HG LEU A 120 8.279 100.223 -13.178 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.707 99.977 -12.690 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.947 101.145 -11.583 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.321 99.498 -11.021 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.411 98.039 -13.552 1.00 0.00 H new ATOM 0 HD22 LEU A 120 9.020 97.554 -11.885 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.714 97.807 -13.068 1.00 0.00 H new ATOM 1128 N VAL A 121 5.064 101.352 -12.172 1.00 0.00 N ATOM 1129 CA VAL A 121 4.160 101.750 -13.297 1.00 0.00 C ATOM 1130 C VAL A 121 3.945 103.265 -13.273 1.00 0.00 C ATOM 1131 O VAL A 121 3.851 103.890 -14.335 1.00 0.00 O ATOM 1132 CB VAL A 121 2.821 100.978 -13.274 1.00 0.00 C ATOM 1133 CG1 VAL A 121 3.091 99.464 -13.324 1.00 0.00 C ATOM 1134 CG2 VAL A 121 2.015 101.306 -12.015 1.00 0.00 C ATOM 0 H VAL A 121 4.618 100.820 -11.424 1.00 0.00 H new ATOM 0 HA VAL A 121 4.644 101.480 -14.236 1.00 0.00 H new ATOM 0 HB VAL A 121 2.242 101.282 -14.146 1.00 0.00 H new ATOM 0 HG11 VAL A 121 2.144 98.925 -13.308 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.631 99.221 -14.239 1.00 0.00 H new ATOM 0 HG13 VAL A 121 3.690 99.172 -12.461 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.079 100.748 -12.027 1.00 0.00 H new ATOM 0 HG22 VAL A 121 2.591 101.029 -11.132 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.801 102.374 -11.988 1.00 0.00 H new ATOM 1144 N LEU A 122 3.877 103.872 -12.098 1.00 0.00 N ATOM 1145 CA LEU A 122 3.684 105.357 -12.021 1.00 0.00 C ATOM 1146 C LEU A 122 4.910 106.039 -12.623 1.00 0.00 C ATOM 1147 O LEU A 122 4.781 106.997 -13.395 1.00 0.00 O ATOM 1148 CB LEU A 122 3.496 105.815 -10.559 1.00 0.00 C ATOM 1149 CG LEU A 122 1.997 105.885 -10.200 1.00 0.00 C ATOM 1150 CD1 LEU A 122 1.462 104.479 -9.917 1.00 0.00 C ATOM 1151 CD2 LEU A 122 1.804 106.762 -8.956 1.00 0.00 C ATOM 0 H LEU A 122 3.947 103.399 -11.197 1.00 0.00 H new ATOM 0 HA LEU A 122 2.787 105.630 -12.576 1.00 0.00 H new ATOM 0 HB2 LEU A 122 4.004 105.123 -9.887 1.00 0.00 H new ATOM 0 HB3 LEU A 122 3.956 106.793 -10.417 1.00 0.00 H new ATOM 0 HG LEU A 122 1.451 106.316 -11.039 1.00 0.00 H new ATOM 0 HD11 LEU A 122 0.403 104.537 -9.664 1.00 0.00 H new ATOM 0 HD12 LEU A 122 1.590 103.856 -10.802 1.00 0.00 H new ATOM 0 HD13 LEU A 122 2.011 104.042 -9.083 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.744 106.809 -8.705 1.00 0.00 H new ATOM 0 HD22 LEU A 122 2.356 106.334 -8.120 1.00 0.00 H new ATOM 0 HD23 LEU A 122 2.174 107.767 -9.158 1.00 0.00 H new ATOM 1163 N LYS A 123 6.090 105.562 -12.290 1.00 0.00 N ATOM 1164 CA LYS A 123 7.345 106.166 -12.836 1.00 0.00 C ATOM 1165 C LYS A 123 7.323 106.033 -14.353 1.00 0.00 C ATOM 1166 O LYS A 123 7.603 106.993 -15.078 1.00 0.00 O ATOM 1167 CB LYS A 123 8.571 105.434 -12.261 1.00 0.00 C ATOM 1168 CG LYS A 123 9.793 106.367 -12.226 1.00 0.00 C ATOM 1169 CD LYS A 123 10.425 106.464 -13.620 1.00 0.00 C ATOM 1170 CE LYS A 123 11.729 107.262 -13.545 1.00 0.00 C ATOM 1171 NZ LYS A 123 12.112 107.712 -14.914 1.00 0.00 N ATOM 0 H LYS A 123 6.235 104.774 -11.658 1.00 0.00 H new ATOM 0 HA LYS A 123 7.407 107.218 -12.556 1.00 0.00 H new ATOM 0 HB2 LYS A 123 8.350 105.078 -11.255 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.794 104.556 -12.867 1.00 0.00 H new ATOM 0 HG2 LYS A 123 9.494 107.358 -11.885 1.00 0.00 H new ATOM 0 HG3 LYS A 123 10.526 105.992 -11.512 1.00 0.00 H new ATOM 0 HD2 LYS A 123 10.621 105.465 -14.010 1.00 0.00 H new ATOM 0 HD3 LYS A 123 9.733 106.946 -14.310 1.00 0.00 H new ATOM 0 HE2 LYS A 123 11.604 108.123 -12.888 1.00 0.00 H new ATOM 0 HE3 LYS A 123 12.521 106.647 -13.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 12.998 108.255 -14.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 12.247 106.883 -15.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 11.359 108.313 -15.305 1.00 0.00 H new ATOM 1185 N ALA A 124 6.978 104.864 -14.840 1.00 0.00 N ATOM 1186 CA ALA A 124 6.912 104.632 -16.317 1.00 0.00 C ATOM 1187 C ALA A 124 5.726 105.396 -16.916 1.00 0.00 C ATOM 1188 O ALA A 124 5.722 105.700 -18.113 1.00 0.00 O ATOM 1189 CB ALA A 124 6.764 103.135 -16.597 1.00 0.00 C ATOM 0 H ALA A 124 6.737 104.053 -14.270 1.00 0.00 H new ATOM 0 HA ALA A 124 7.832 104.994 -16.777 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.716 102.969 -17.673 1.00 0.00 H new ATOM 0 HB2 ALA A 124 7.621 102.601 -16.185 1.00 0.00 H new ATOM 0 HB3 ALA A 124 5.850 102.767 -16.132 1.00 0.00 H new ATOM 1195 N LEU A 125 4.731 105.711 -16.112 1.00 0.00 N ATOM 1196 CA LEU A 125 3.536 106.461 -16.613 1.00 0.00 C ATOM 1197 C LEU A 125 3.886 107.945 -16.776 1.00 0.00 C ATOM 1198 O LEU A 125 3.260 108.652 -17.573 1.00 0.00 O ATOM 1199 CB LEU A 125 2.381 106.298 -15.612 1.00 0.00 C ATOM 1200 CG LEU A 125 1.102 106.938 -16.164 1.00 0.00 C ATOM 1201 CD1 LEU A 125 0.502 106.045 -17.254 1.00 0.00 C ATOM 1202 CD2 LEU A 125 0.084 107.109 -15.031 1.00 0.00 C ATOM 0 H LEU A 125 4.700 105.476 -15.120 1.00 0.00 H new ATOM 0 HA LEU A 125 3.233 106.064 -17.582 1.00 0.00 H new ATOM 0 HB2 LEU A 125 2.210 105.240 -15.414 1.00 0.00 H new ATOM 0 HB3 LEU A 125 2.646 106.761 -14.662 1.00 0.00 H new ATOM 0 HG LEU A 125 1.345 107.912 -16.589 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -0.407 106.505 -17.642 1.00 0.00 H new ATOM 0 HD12 LEU A 125 1.222 105.925 -18.063 1.00 0.00 H new ATOM 0 HD13 LEU A 125 0.263 105.068 -16.833 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -0.825 107.564 -15.424 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -0.153 106.134 -14.605 1.00 0.00 H new ATOM 0 HD23 LEU A 125 0.505 107.750 -14.257 1.00 0.00 H new ATOM 1214 N SER A 126 4.873 108.422 -16.049 1.00 0.00 N ATOM 1215 CA SER A 126 5.281 109.857 -16.151 1.00 0.00 C ATOM 1216 C SER A 126 6.236 110.067 -17.336 1.00 0.00 C ATOM 1217 O SER A 126 6.896 111.108 -17.422 1.00 0.00 O ATOM 1218 CB SER A 126 5.968 110.300 -14.858 1.00 0.00 C ATOM 1219 OG SER A 126 6.265 111.688 -14.936 1.00 0.00 O ATOM 0 H SER A 126 5.416 107.870 -15.385 1.00 0.00 H new ATOM 0 HA SER A 126 4.385 110.456 -16.311 1.00 0.00 H new ATOM 0 HB2 SER A 126 5.322 110.102 -14.003 1.00 0.00 H new ATOM 0 HB3 SER A 126 6.883 109.728 -14.705 1.00 0.00 H new ATOM 0 HG SER A 126 6.580 111.905 -15.838 1.00 0.00 H new ATOM 1225 N THR A 127 6.324 109.111 -18.242 1.00 0.00 N ATOM 1226 CA THR A 127 7.233 109.251 -19.423 1.00 0.00 C ATOM 1227 C THR A 127 6.732 110.378 -20.325 1.00 0.00 C ATOM 1228 O THR A 127 7.533 111.110 -20.907 1.00 0.00 O ATOM 1229 CB THR A 127 7.273 107.940 -20.214 1.00 0.00 C ATOM 1230 OG1 THR A 127 5.946 107.493 -20.452 1.00 0.00 O ATOM 1231 CG2 THR A 127 8.036 106.880 -19.415 1.00 0.00 C ATOM 0 H THR A 127 5.799 108.237 -18.208 1.00 0.00 H new ATOM 0 HA THR A 127 8.238 109.485 -19.072 1.00 0.00 H new ATOM 0 HB THR A 127 7.778 108.105 -21.166 1.00 0.00 H new ATOM 0 HG1 THR A 127 5.688 106.850 -19.759 1.00 0.00 H new ATOM 0 HG21 THR A 127 8.063 105.948 -19.980 1.00 0.00 H new ATOM 0 HG22 THR A 127 9.054 107.224 -19.234 1.00 0.00 H new ATOM 0 HG23 THR A 127 7.535 106.712 -18.462 1.00 0.00 H new ATOM 1239 N LYS A 128 5.426 110.518 -20.446 1.00 0.00 N ATOM 1240 CA LYS A 128 4.814 111.587 -21.306 1.00 0.00 C ATOM 1241 C LYS A 128 5.167 111.347 -22.782 1.00 0.00 C ATOM 1242 O LYS A 128 4.310 110.905 -23.555 1.00 0.00 O ATOM 1243 CB LYS A 128 5.262 112.990 -20.858 1.00 0.00 C ATOM 1244 CG LYS A 128 4.585 113.358 -19.539 1.00 0.00 C ATOM 1245 CD LYS A 128 5.199 114.661 -19.009 1.00 0.00 C ATOM 1246 CE LYS A 128 4.605 115.858 -19.760 1.00 0.00 C ATOM 1247 NZ LYS A 128 5.127 117.124 -19.172 1.00 0.00 N ATOM 0 H LYS A 128 4.747 109.922 -19.973 1.00 0.00 H new ATOM 0 HA LYS A 128 3.731 111.536 -21.193 1.00 0.00 H new ATOM 0 HB2 LYS A 128 6.345 113.014 -20.739 1.00 0.00 H new ATOM 0 HB3 LYS A 128 5.009 113.723 -21.623 1.00 0.00 H new ATOM 0 HG2 LYS A 128 3.512 113.481 -19.688 1.00 0.00 H new ATOM 0 HG3 LYS A 128 4.717 112.557 -18.812 1.00 0.00 H new ATOM 0 HD2 LYS A 128 5.004 114.757 -17.941 1.00 0.00 H new ATOM 0 HD3 LYS A 128 6.281 114.641 -19.135 1.00 0.00 H new ATOM 0 HE2 LYS A 128 4.864 115.802 -20.817 1.00 0.00 H new ATOM 0 HE3 LYS A 128 3.517 115.837 -19.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 4.724 117.936 -19.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 4.859 117.177 -18.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 6.164 117.144 -19.255 1.00 0.00 H new TER 1261 LYS A 128 ATOM 1262 N GLY B 48 8.973 71.144 -7.698 1.00 0.00 N ATOM 1263 CA GLY B 48 9.198 71.626 -6.306 1.00 0.00 C ATOM 1264 C GLY B 48 10.632 72.164 -6.172 1.00 0.00 C ATOM 1265 O GLY B 48 10.818 73.381 -6.088 1.00 0.00 O ATOM 0 HA2 GLY B 48 8.481 72.409 -6.061 1.00 0.00 H new ATOM 0 HA3 GLY B 48 9.036 70.813 -5.598 1.00 0.00 H new ATOM 1271 N PRO B 49 11.650 71.300 -6.144 1.00 0.00 N ATOM 1272 CA PRO B 49 13.071 71.745 -6.012 1.00 0.00 C ATOM 1273 C PRO B 49 13.690 72.171 -7.348 1.00 0.00 C ATOM 1274 O PRO B 49 14.758 72.792 -7.369 1.00 0.00 O ATOM 1275 CB PRO B 49 13.777 70.510 -5.454 1.00 0.00 C ATOM 1276 CG PRO B 49 13.011 69.342 -5.983 1.00 0.00 C ATOM 1277 CD PRO B 49 11.576 69.818 -6.234 1.00 0.00 C ATOM 0 HA PRO B 49 13.161 72.627 -5.378 1.00 0.00 H new ATOM 0 HB2 PRO B 49 14.818 70.474 -5.774 1.00 0.00 H new ATOM 0 HB3 PRO B 49 13.779 70.517 -4.364 1.00 0.00 H new ATOM 0 HG2 PRO B 49 13.461 68.972 -6.905 1.00 0.00 H new ATOM 0 HG3 PRO B 49 13.024 68.518 -5.269 1.00 0.00 H new ATOM 0 HD2 PRO B 49 11.218 69.498 -7.212 1.00 0.00 H new ATOM 0 HD3 PRO B 49 10.888 69.410 -5.494 1.00 0.00 H new ATOM 1285 N GLY B 50 13.047 71.849 -8.452 1.00 0.00 N ATOM 1286 CA GLY B 50 13.589 72.227 -9.796 1.00 0.00 C ATOM 1287 C GLY B 50 13.674 73.746 -9.900 1.00 0.00 C ATOM 1288 O GLY B 50 14.647 74.352 -9.442 1.00 0.00 O ATOM 0 H GLY B 50 12.165 71.337 -8.476 1.00 0.00 H new ATOM 0 HA2 GLY B 50 14.575 71.786 -9.939 1.00 0.00 H new ATOM 0 HA3 GLY B 50 12.946 71.833 -10.583 1.00 0.00 H new ATOM 1292 N SER B 51 12.669 74.368 -10.484 1.00 0.00 N ATOM 1293 CA SER B 51 12.653 75.863 -10.631 1.00 0.00 C ATOM 1294 C SER B 51 13.826 76.313 -11.497 1.00 0.00 C ATOM 1295 O SER B 51 14.988 76.196 -11.092 1.00 0.00 O ATOM 1296 CB SER B 51 12.741 76.543 -9.263 1.00 0.00 C ATOM 1297 OG SER B 51 11.768 75.980 -8.392 1.00 0.00 O ATOM 0 H SER B 51 11.851 73.896 -10.869 1.00 0.00 H new ATOM 0 HA SER B 51 11.715 76.150 -11.107 1.00 0.00 H new ATOM 0 HB2 SER B 51 13.739 76.413 -8.844 1.00 0.00 H new ATOM 0 HB3 SER B 51 12.575 77.615 -9.366 1.00 0.00 H new ATOM 0 HG SER B 51 12.153 75.874 -7.497 1.00 0.00 H new ATOM 1303 N MET B 52 13.543 76.839 -12.671 1.00 0.00 N ATOM 1304 CA MET B 52 14.634 77.320 -13.577 1.00 0.00 C ATOM 1305 C MET B 52 14.674 78.855 -13.517 1.00 0.00 C ATOM 1306 O MET B 52 13.865 79.464 -12.809 1.00 0.00 O ATOM 1307 CB MET B 52 14.367 76.842 -15.022 1.00 0.00 C ATOM 1308 CG MET B 52 15.664 76.338 -15.704 1.00 0.00 C ATOM 1309 SD MET B 52 15.341 74.769 -16.555 1.00 0.00 S ATOM 1310 CE MET B 52 15.026 73.770 -15.078 1.00 0.00 C ATOM 0 H MET B 52 12.599 76.955 -13.038 1.00 0.00 H new ATOM 0 HA MET B 52 15.595 76.916 -13.258 1.00 0.00 H new ATOM 0 HB2 MET B 52 13.627 76.042 -15.010 1.00 0.00 H new ATOM 0 HB3 MET B 52 13.943 77.660 -15.604 1.00 0.00 H new ATOM 0 HG2 MET B 52 16.024 77.081 -16.416 1.00 0.00 H new ATOM 0 HG3 MET B 52 16.449 76.204 -14.959 1.00 0.00 H new ATOM 0 HE1 MET B 52 15.419 72.764 -15.228 1.00 0.00 H new ATOM 0 HE2 MET B 52 15.517 74.227 -14.218 1.00 0.00 H new ATOM 0 HE3 MET B 52 13.952 73.717 -14.897 1.00 0.00 H new ATOM 1320 N ASP B 53 15.606 79.492 -14.216 1.00 0.00 N ATOM 1321 CA ASP B 53 15.711 80.987 -14.178 1.00 0.00 C ATOM 1322 C ASP B 53 15.943 81.389 -12.731 1.00 0.00 C ATOM 1323 O ASP B 53 15.235 82.227 -12.157 1.00 0.00 O ATOM 1324 CB ASP B 53 14.443 81.635 -14.750 1.00 0.00 C ATOM 1325 CG ASP B 53 14.418 81.483 -16.266 1.00 0.00 C ATOM 1326 OD1 ASP B 53 15.294 82.039 -16.910 1.00 0.00 O ATOM 1327 OD2 ASP B 53 13.529 80.812 -16.762 1.00 0.00 O ATOM 0 H ASP B 53 16.295 79.031 -14.810 1.00 0.00 H new ATOM 0 HA ASP B 53 16.540 81.333 -14.796 1.00 0.00 H new ATOM 0 HB2 ASP B 53 13.559 81.169 -14.315 1.00 0.00 H new ATOM 0 HB3 ASP B 53 14.412 82.691 -14.482 1.00 0.00 H new ATOM 1332 N ALA B 54 16.915 80.756 -12.137 1.00 0.00 N ATOM 1333 CA ALA B 54 17.248 80.991 -10.719 1.00 0.00 C ATOM 1334 C ALA B 54 17.640 82.451 -10.473 1.00 0.00 C ATOM 1335 O ALA B 54 17.512 82.931 -9.344 1.00 0.00 O ATOM 1336 CB ALA B 54 18.392 80.067 -10.308 1.00 0.00 C ATOM 0 H ALA B 54 17.507 80.065 -12.598 1.00 0.00 H new ATOM 0 HA ALA B 54 16.365 80.777 -10.117 1.00 0.00 H new ATOM 0 HB1 ALA B 54 18.640 80.239 -9.261 1.00 0.00 H new ATOM 0 HB2 ALA B 54 18.088 79.029 -10.443 1.00 0.00 H new ATOM 0 HB3 ALA B 54 19.266 80.273 -10.926 1.00 0.00 H new ATOM 1342 N SER B 55 18.134 83.159 -11.475 1.00 0.00 N ATOM 1343 CA SER B 55 18.552 84.582 -11.261 1.00 0.00 C ATOM 1344 C SER B 55 17.324 85.461 -11.018 1.00 0.00 C ATOM 1345 O SER B 55 17.340 86.316 -10.120 1.00 0.00 O ATOM 1346 CB SER B 55 19.344 85.094 -12.470 1.00 0.00 C ATOM 1347 OG SER B 55 20.719 84.782 -12.291 1.00 0.00 O ATOM 0 H SER B 55 18.263 82.809 -12.424 1.00 0.00 H new ATOM 0 HA SER B 55 19.195 84.629 -10.382 1.00 0.00 H new ATOM 0 HB2 SER B 55 18.971 84.636 -13.386 1.00 0.00 H new ATOM 0 HB3 SER B 55 19.213 86.171 -12.576 1.00 0.00 H new ATOM 0 HG SER B 55 21.231 85.105 -13.062 1.00 0.00 H new ATOM 1353 N THR B 56 16.257 85.262 -11.769 1.00 0.00 N ATOM 1354 CA THR B 56 15.019 86.079 -11.564 1.00 0.00 C ATOM 1355 C THR B 56 14.343 85.615 -10.283 1.00 0.00 C ATOM 1356 O THR B 56 13.915 86.433 -9.460 1.00 0.00 O ATOM 1357 CB THR B 56 14.058 85.909 -12.749 1.00 0.00 C ATOM 1358 OG1 THR B 56 14.141 84.576 -13.232 1.00 0.00 O ATOM 1359 CG2 THR B 56 14.426 86.882 -13.874 1.00 0.00 C ATOM 0 H THR B 56 16.196 84.568 -12.514 1.00 0.00 H new ATOM 0 HA THR B 56 15.286 87.133 -11.491 1.00 0.00 H new ATOM 0 HB THR B 56 13.042 86.121 -12.417 1.00 0.00 H new ATOM 0 HG1 THR B 56 13.411 84.411 -13.865 1.00 0.00 H new ATOM 0 HG21 THR B 56 13.737 86.751 -14.708 1.00 0.00 H new ATOM 0 HG22 THR B 56 14.360 87.906 -13.506 1.00 0.00 H new ATOM 0 HG23 THR B 56 15.444 86.682 -14.209 1.00 0.00 H new ATOM 1367 N LYS B 57 14.243 84.317 -10.104 1.00 0.00 N ATOM 1368 CA LYS B 57 13.598 83.760 -8.881 1.00 0.00 C ATOM 1369 C LYS B 57 14.407 84.168 -7.652 1.00 0.00 C ATOM 1370 O LYS B 57 13.831 84.444 -6.599 1.00 0.00 O ATOM 1371 CB LYS B 57 13.496 82.232 -8.964 1.00 0.00 C ATOM 1372 CG LYS B 57 12.603 81.734 -7.822 1.00 0.00 C ATOM 1373 CD LYS B 57 12.261 80.256 -8.017 1.00 0.00 C ATOM 1374 CE LYS B 57 11.330 79.804 -6.885 1.00 0.00 C ATOM 1375 NZ LYS B 57 10.740 78.471 -7.208 1.00 0.00 N ATOM 0 H LYS B 57 14.586 83.617 -10.763 1.00 0.00 H new ATOM 0 HA LYS B 57 12.587 84.161 -8.802 1.00 0.00 H new ATOM 0 HB2 LYS B 57 13.080 81.933 -9.926 1.00 0.00 H new ATOM 0 HB3 LYS B 57 14.487 81.783 -8.892 1.00 0.00 H new ATOM 0 HG2 LYS B 57 13.111 81.873 -6.868 1.00 0.00 H new ATOM 0 HG3 LYS B 57 11.687 82.324 -7.785 1.00 0.00 H new ATOM 0 HD2 LYS B 57 11.779 80.106 -8.983 1.00 0.00 H new ATOM 0 HD3 LYS B 57 13.171 79.656 -8.018 1.00 0.00 H new ATOM 0 HE2 LYS B 57 11.884 79.748 -5.948 1.00 0.00 H new ATOM 0 HE3 LYS B 57 10.536 80.537 -6.742 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 10.206 78.119 -6.387 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 10.101 78.563 -8.023 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 11.501 77.801 -7.439 1.00 0.00 H new ATOM 1389 N LYS B 58 15.718 84.192 -7.759 1.00 0.00 N ATOM 1390 CA LYS B 58 16.578 84.568 -6.591 1.00 0.00 C ATOM 1391 C LYS B 58 16.300 86.008 -6.179 1.00 0.00 C ATOM 1392 O LYS B 58 16.222 86.302 -4.981 1.00 0.00 O ATOM 1393 CB LYS B 58 18.067 84.405 -6.936 1.00 0.00 C ATOM 1394 CG LYS B 58 18.522 82.964 -6.662 1.00 0.00 C ATOM 1395 CD LYS B 58 18.703 82.760 -5.148 1.00 0.00 C ATOM 1396 CE LYS B 58 18.885 81.268 -4.817 1.00 0.00 C ATOM 1397 NZ LYS B 58 17.581 80.693 -4.378 1.00 0.00 N ATOM 0 H LYS B 58 16.230 83.965 -8.612 1.00 0.00 H new ATOM 0 HA LYS B 58 16.338 83.903 -5.762 1.00 0.00 H new ATOM 0 HB2 LYS B 58 18.234 84.653 -7.984 1.00 0.00 H new ATOM 0 HB3 LYS B 58 18.663 85.101 -6.345 1.00 0.00 H new ATOM 0 HG2 LYS B 58 17.786 82.260 -7.049 1.00 0.00 H new ATOM 0 HG3 LYS B 58 19.459 82.763 -7.181 1.00 0.00 H new ATOM 0 HD2 LYS B 58 19.570 83.323 -4.801 1.00 0.00 H new ATOM 0 HD3 LYS B 58 17.835 83.152 -4.617 1.00 0.00 H new ATOM 0 HE2 LYS B 58 19.254 80.733 -5.692 1.00 0.00 H new ATOM 0 HE3 LYS B 58 19.631 81.147 -4.031 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 17.704 79.685 -4.154 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 17.247 81.197 -3.532 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 16.882 80.796 -5.141 1.00 0.00 H new ATOM 1411 N LEU B 59 16.138 86.906 -7.129 1.00 0.00 N ATOM 1412 CA LEU B 59 15.851 88.335 -6.774 1.00 0.00 C ATOM 1413 C LEU B 59 14.541 88.367 -5.991 1.00 0.00 C ATOM 1414 O LEU B 59 14.440 89.013 -4.938 1.00 0.00 O ATOM 1415 CB LEU B 59 15.717 89.186 -8.050 1.00 0.00 C ATOM 1416 CG LEU B 59 15.976 90.696 -7.736 1.00 0.00 C ATOM 1417 CD1 LEU B 59 17.327 91.142 -8.314 1.00 0.00 C ATOM 1418 CD2 LEU B 59 14.873 91.570 -8.354 1.00 0.00 C ATOM 0 H LEU B 59 16.192 86.711 -8.129 1.00 0.00 H new ATOM 0 HA LEU B 59 16.666 88.744 -6.177 1.00 0.00 H new ATOM 0 HB2 LEU B 59 16.426 88.839 -8.801 1.00 0.00 H new ATOM 0 HB3 LEU B 59 14.720 89.063 -8.472 1.00 0.00 H new ATOM 0 HG LEU B 59 15.980 90.814 -6.652 1.00 0.00 H new ATOM 0 HD11 LEU B 59 17.490 92.195 -8.086 1.00 0.00 H new ATOM 0 HD12 LEU B 59 18.126 90.547 -7.872 1.00 0.00 H new ATOM 0 HD13 LEU B 59 17.325 91.001 -9.395 1.00 0.00 H new ATOM 0 HD21 LEU B 59 15.069 92.618 -8.126 1.00 0.00 H new ATOM 0 HD22 LEU B 59 14.861 91.430 -9.435 1.00 0.00 H new ATOM 0 HD23 LEU B 59 13.906 91.283 -7.940 1.00 0.00 H new ATOM 1430 N SER B 60 13.555 87.655 -6.480 1.00 0.00 N ATOM 1431 CA SER B 60 12.233 87.583 -5.794 1.00 0.00 C ATOM 1432 C SER B 60 12.398 86.882 -4.445 1.00 0.00 C ATOM 1433 O SER B 60 11.750 87.255 -3.467 1.00 0.00 O ATOM 1434 CB SER B 60 11.237 86.806 -6.655 1.00 0.00 C ATOM 1435 OG SER B 60 11.233 87.349 -7.967 1.00 0.00 O ATOM 0 H SER B 60 13.615 87.112 -7.341 1.00 0.00 H new ATOM 0 HA SER B 60 11.856 88.594 -5.639 1.00 0.00 H new ATOM 0 HB2 SER B 60 11.510 85.751 -6.686 1.00 0.00 H new ATOM 0 HB3 SER B 60 10.239 86.865 -6.221 1.00 0.00 H new ATOM 0 HG SER B 60 11.991 86.989 -8.472 1.00 0.00 H new ATOM 1441 N GLU B 61 13.230 85.860 -4.388 1.00 0.00 N ATOM 1442 CA GLU B 61 13.434 85.097 -3.118 1.00 0.00 C ATOM 1443 C GLU B 61 14.045 85.999 -2.053 1.00 0.00 C ATOM 1444 O GLU B 61 13.655 85.926 -0.884 1.00 0.00 O ATOM 1445 CB GLU B 61 14.353 83.894 -3.368 1.00 0.00 C ATOM 1446 CG GLU B 61 14.223 82.882 -2.220 1.00 0.00 C ATOM 1447 CD GLU B 61 12.979 82.021 -2.417 1.00 0.00 C ATOM 1448 OE1 GLU B 61 11.889 82.563 -2.360 1.00 0.00 O ATOM 1449 OE2 GLU B 61 13.137 80.828 -2.624 1.00 0.00 O ATOM 0 H GLU B 61 13.779 85.523 -5.179 1.00 0.00 H new ATOM 0 HA GLU B 61 12.466 84.740 -2.767 1.00 0.00 H new ATOM 0 HB2 GLU B 61 14.093 83.418 -4.314 1.00 0.00 H new ATOM 0 HB3 GLU B 61 15.387 84.228 -3.453 1.00 0.00 H new ATOM 0 HG2 GLU B 61 15.110 82.249 -2.181 1.00 0.00 H new ATOM 0 HG3 GLU B 61 14.164 83.407 -1.267 1.00 0.00 H new ATOM 1456 N SER B 62 14.993 86.837 -2.422 1.00 0.00 N ATOM 1457 CA SER B 62 15.633 87.743 -1.418 1.00 0.00 C ATOM 1458 C SER B 62 14.562 88.649 -0.823 1.00 0.00 C ATOM 1459 O SER B 62 14.469 88.795 0.405 1.00 0.00 O ATOM 1460 CB SER B 62 16.720 88.588 -2.084 1.00 0.00 C ATOM 1461 OG SER B 62 16.137 89.380 -3.110 1.00 0.00 O ATOM 0 H SER B 62 15.347 86.929 -3.374 1.00 0.00 H new ATOM 0 HA SER B 62 16.095 87.147 -0.631 1.00 0.00 H new ATOM 0 HB2 SER B 62 17.203 89.228 -1.345 1.00 0.00 H new ATOM 0 HB3 SER B 62 17.493 87.943 -2.502 1.00 0.00 H new ATOM 0 HG SER B 62 15.721 88.796 -3.778 1.00 0.00 H new ATOM 1467 N LEU B 63 13.741 89.238 -1.663 1.00 0.00 N ATOM 1468 CA LEU B 63 12.645 90.126 -1.165 1.00 0.00 C ATOM 1469 C LEU B 63 11.650 89.275 -0.380 1.00 0.00 C ATOM 1470 O LEU B 63 11.160 89.688 0.677 1.00 0.00 O ATOM 1471 CB LEU B 63 11.943 90.818 -2.340 1.00 0.00 C ATOM 1472 CG LEU B 63 12.929 91.759 -3.050 1.00 0.00 C ATOM 1473 CD1 LEU B 63 12.367 92.156 -4.417 1.00 0.00 C ATOM 1474 CD2 LEU B 63 13.143 93.025 -2.209 1.00 0.00 C ATOM 0 H LEU B 63 13.785 89.140 -2.677 1.00 0.00 H new ATOM 0 HA LEU B 63 13.061 90.899 -0.519 1.00 0.00 H new ATOM 0 HB2 LEU B 63 11.567 90.073 -3.041 1.00 0.00 H new ATOM 0 HB3 LEU B 63 11.082 91.381 -1.981 1.00 0.00 H new ATOM 0 HG LEU B 63 13.880 91.243 -3.178 1.00 0.00 H new ATOM 0 HD11 LEU B 63 13.068 92.823 -4.919 1.00 0.00 H new ATOM 0 HD12 LEU B 63 12.220 91.262 -5.023 1.00 0.00 H new ATOM 0 HD13 LEU B 63 11.413 92.666 -4.284 1.00 0.00 H new ATOM 0 HD21 LEU B 63 13.843 93.687 -2.719 1.00 0.00 H new ATOM 0 HD22 LEU B 63 12.191 93.538 -2.075 1.00 0.00 H new ATOM 0 HD23 LEU B 63 13.547 92.751 -1.235 1.00 0.00 H new ATOM 1486 N LYS B 64 11.357 88.092 -0.874 1.00 0.00 N ATOM 1487 CA LYS B 64 10.405 87.172 -0.179 1.00 0.00 C ATOM 1488 C LYS B 64 10.949 86.837 1.204 1.00 0.00 C ATOM 1489 O LYS B 64 10.178 86.709 2.159 1.00 0.00 O ATOM 1490 CB LYS B 64 10.225 85.886 -1.003 1.00 0.00 C ATOM 1491 CG LYS B 64 9.123 84.991 -0.392 1.00 0.00 C ATOM 1492 CD LYS B 64 9.736 83.962 0.569 1.00 0.00 C ATOM 1493 CE LYS B 64 8.662 82.957 0.994 1.00 0.00 C ATOM 1494 NZ LYS B 64 9.296 81.826 1.732 1.00 0.00 N ATOM 0 H LYS B 64 11.745 87.723 -1.742 1.00 0.00 H new ATOM 0 HA LYS B 64 9.435 87.659 -0.076 1.00 0.00 H new ATOM 0 HB2 LYS B 64 9.965 86.141 -2.030 1.00 0.00 H new ATOM 0 HB3 LYS B 64 11.166 85.338 -1.039 1.00 0.00 H new ATOM 0 HG2 LYS B 64 8.399 85.608 0.140 1.00 0.00 H new ATOM 0 HG3 LYS B 64 8.581 84.478 -1.186 1.00 0.00 H new ATOM 0 HD2 LYS B 64 10.563 83.443 0.084 1.00 0.00 H new ATOM 0 HD3 LYS B 64 10.145 84.465 1.445 1.00 0.00 H new ATOM 0 HE2 LYS B 64 7.922 83.447 1.626 1.00 0.00 H new ATOM 0 HE3 LYS B 64 8.134 82.582 0.117 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 8.564 81.145 2.019 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 9.986 81.352 1.115 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 9.780 82.191 2.577 1.00 0.00 H new ATOM 1508 N ARG B 65 12.251 86.704 1.333 1.00 0.00 N ATOM 1509 CA ARG B 65 12.859 86.390 2.661 1.00 0.00 C ATOM 1510 C ARG B 65 12.529 87.531 3.619 1.00 0.00 C ATOM 1511 O ARG B 65 12.184 87.294 4.780 1.00 0.00 O ATOM 1512 CB ARG B 65 14.380 86.224 2.522 1.00 0.00 C ATOM 1513 CG ARG B 65 14.994 85.789 3.865 1.00 0.00 C ATOM 1514 CD ARG B 65 16.380 85.160 3.646 1.00 0.00 C ATOM 1515 NE ARG B 65 17.249 85.397 4.849 1.00 0.00 N ATOM 1516 CZ ARG B 65 18.219 84.561 5.196 1.00 0.00 C ATOM 1517 NH1 ARG B 65 18.941 84.835 6.248 1.00 0.00 N ATOM 1518 NH2 ARG B 65 18.479 83.469 4.511 1.00 0.00 N ATOM 0 H ARG B 65 12.919 86.801 0.568 1.00 0.00 H new ATOM 0 HA ARG B 65 12.455 85.454 3.048 1.00 0.00 H new ATOM 0 HB2 ARG B 65 14.603 85.482 1.755 1.00 0.00 H new ATOM 0 HB3 ARG B 65 14.827 87.163 2.197 1.00 0.00 H new ATOM 0 HG2 ARG B 65 15.080 86.650 4.528 1.00 0.00 H new ATOM 0 HG3 ARG B 65 14.337 85.072 4.357 1.00 0.00 H new ATOM 0 HD2 ARG B 65 16.278 84.090 3.466 1.00 0.00 H new ATOM 0 HD3 ARG B 65 16.847 85.589 2.760 1.00 0.00 H new ATOM 0 HE ARG B 65 17.088 86.228 5.418 1.00 0.00 H new ATOM 0 HH11 ARG B 65 18.755 85.680 6.788 1.00 0.00 H new ATOM 0 HH12 ARG B 65 19.691 84.204 6.530 1.00 0.00 H new ATOM 0 HH21 ARG B 65 17.927 83.242 3.684 1.00 0.00 H new ATOM 0 HH22 ARG B 65 19.233 82.849 4.807 1.00 0.00 H new ATOM 1532 N ILE B 66 12.615 88.758 3.149 1.00 0.00 N ATOM 1533 CA ILE B 66 12.294 89.935 4.015 1.00 0.00 C ATOM 1534 C ILE B 66 10.812 89.848 4.424 1.00 0.00 C ATOM 1535 O ILE B 66 10.486 90.023 5.605 1.00 0.00 O ATOM 1536 CB ILE B 66 12.627 91.248 3.240 1.00 0.00 C ATOM 1537 CG1 ILE B 66 14.159 91.530 3.305 1.00 0.00 C ATOM 1538 CG2 ILE B 66 11.832 92.468 3.770 1.00 0.00 C ATOM 1539 CD1 ILE B 66 14.657 91.778 4.749 1.00 0.00 C ATOM 0 H ILE B 66 12.896 88.991 2.197 1.00 0.00 H new ATOM 0 HA ILE B 66 12.894 89.937 4.925 1.00 0.00 H new ATOM 0 HB ILE B 66 12.325 91.099 2.203 1.00 0.00 H new ATOM 0 HG12 ILE B 66 14.699 90.685 2.878 1.00 0.00 H new ATOM 0 HG13 ILE B 66 14.391 92.399 2.690 1.00 0.00 H new ATOM 0 HG21 ILE B 66 12.101 93.355 3.196 1.00 0.00 H new ATOM 0 HG22 ILE B 66 10.764 92.279 3.666 1.00 0.00 H new ATOM 0 HG23 ILE B 66 12.071 92.629 4.821 1.00 0.00 H new ATOM 0 HD11 ILE B 66 15.730 91.969 4.736 1.00 0.00 H new ATOM 0 HD12 ILE B 66 14.140 92.641 5.169 1.00 0.00 H new ATOM 0 HD13 ILE B 66 14.452 90.899 5.360 1.00 0.00 H new ATOM 1551 N GLY B 67 9.923 89.583 3.487 1.00 0.00 N ATOM 1552 CA GLY B 67 8.466 89.484 3.827 1.00 0.00 C ATOM 1553 C GLY B 67 8.265 88.365 4.844 1.00 0.00 C ATOM 1554 O GLY B 67 7.598 88.551 5.873 1.00 0.00 O ATOM 0 H GLY B 67 10.147 89.432 2.503 1.00 0.00 H new ATOM 0 HA2 GLY B 67 8.110 90.430 4.234 1.00 0.00 H new ATOM 0 HA3 GLY B 67 7.883 89.284 2.928 1.00 0.00 H new ATOM 1558 N ASP B 68 8.842 87.213 4.581 1.00 0.00 N ATOM 1559 CA ASP B 68 8.717 86.059 5.522 1.00 0.00 C ATOM 1560 C ASP B 68 9.344 86.440 6.862 1.00 0.00 C ATOM 1561 O ASP B 68 8.866 86.017 7.919 1.00 0.00 O ATOM 1562 CB ASP B 68 9.424 84.828 4.943 1.00 0.00 C ATOM 1563 CG ASP B 68 8.721 83.553 5.402 1.00 0.00 C ATOM 1564 OD1 ASP B 68 9.410 82.639 5.822 1.00 0.00 O ATOM 1565 OD2 ASP B 68 7.504 83.511 5.325 1.00 0.00 O ATOM 0 H ASP B 68 9.398 87.025 3.747 1.00 0.00 H new ATOM 0 HA ASP B 68 7.664 85.818 5.666 1.00 0.00 H new ATOM 0 HB2 ASP B 68 9.426 84.879 3.854 1.00 0.00 H new ATOM 0 HB3 ASP B 68 10.466 84.813 5.263 1.00 0.00 H new ATOM 1570 N GLU B 69 10.395 87.234 6.835 1.00 0.00 N ATOM 1571 CA GLU B 69 11.068 87.666 8.097 1.00 0.00 C ATOM 1572 C GLU B 69 10.063 88.421 8.958 1.00 0.00 C ATOM 1573 O GLU B 69 10.031 88.242 10.181 1.00 0.00 O ATOM 1574 CB GLU B 69 12.268 88.569 7.773 1.00 0.00 C ATOM 1575 CG GLU B 69 13.248 88.601 8.955 1.00 0.00 C ATOM 1576 CD GLU B 69 12.806 89.647 9.972 1.00 0.00 C ATOM 1577 OE1 GLU B 69 12.829 90.818 9.633 1.00 0.00 O ATOM 1578 OE2 GLU B 69 12.453 89.262 11.073 1.00 0.00 O ATOM 0 H GLU B 69 10.815 87.602 5.981 1.00 0.00 H new ATOM 0 HA GLU B 69 11.430 86.791 8.637 1.00 0.00 H new ATOM 0 HB2 GLU B 69 12.776 88.203 6.881 1.00 0.00 H new ATOM 0 HB3 GLU B 69 11.922 89.579 7.552 1.00 0.00 H new ATOM 0 HG2 GLU B 69 13.293 87.620 9.427 1.00 0.00 H new ATOM 0 HG3 GLU B 69 14.252 88.830 8.599 1.00 0.00 H new ATOM 1585 N LEU B 70 9.235 89.250 8.350 1.00 0.00 N ATOM 1586 CA LEU B 70 8.213 90.015 9.131 1.00 0.00 C ATOM 1587 C LEU B 70 7.285 89.016 9.809 1.00 0.00 C ATOM 1588 O LEU B 70 6.961 89.160 10.994 1.00 0.00 O ATOM 1589 CB LEU B 70 7.390 90.921 8.207 1.00 0.00 C ATOM 1590 CG LEU B 70 8.201 92.161 7.808 1.00 0.00 C ATOM 1591 CD1 LEU B 70 7.503 92.867 6.643 1.00 0.00 C ATOM 1592 CD2 LEU B 70 8.292 93.131 8.992 1.00 0.00 C ATOM 0 H LEU B 70 9.228 89.426 7.345 1.00 0.00 H new ATOM 0 HA LEU B 70 8.716 90.641 9.868 1.00 0.00 H new ATOM 0 HB2 LEU B 70 7.096 90.369 7.314 1.00 0.00 H new ATOM 0 HB3 LEU B 70 6.472 91.226 8.710 1.00 0.00 H new ATOM 0 HG LEU B 70 9.204 91.851 7.514 1.00 0.00 H new ATOM 0 HD11 LEU B 70 8.076 93.749 6.356 1.00 0.00 H new ATOM 0 HD12 LEU B 70 7.434 92.187 5.794 1.00 0.00 H new ATOM 0 HD13 LEU B 70 6.501 93.169 6.948 1.00 0.00 H new ATOM 0 HD21 LEU B 70 8.869 94.008 8.700 1.00 0.00 H new ATOM 0 HD22 LEU B 70 7.289 93.439 9.288 1.00 0.00 H new ATOM 0 HD23 LEU B 70 8.782 92.637 9.831 1.00 0.00 H new ATOM 1604 N ASP B 71 6.867 88.002 9.085 1.00 0.00 N ATOM 1605 CA ASP B 71 5.964 86.959 9.671 1.00 0.00 C ATOM 1606 C ASP B 71 6.758 86.063 10.628 1.00 0.00 C ATOM 1607 O ASP B 71 6.181 85.451 11.533 1.00 0.00 O ATOM 1608 CB ASP B 71 5.351 86.111 8.555 1.00 0.00 C ATOM 1609 CG ASP B 71 4.174 85.308 9.098 1.00 0.00 C ATOM 1610 OD1 ASP B 71 3.284 85.913 9.673 1.00 0.00 O ATOM 1611 OD2 ASP B 71 4.179 84.099 8.933 1.00 0.00 O ATOM 0 H ASP B 71 7.115 87.852 8.107 1.00 0.00 H new ATOM 0 HA ASP B 71 5.163 87.452 10.223 1.00 0.00 H new ATOM 0 HB2 ASP B 71 5.019 86.753 7.740 1.00 0.00 H new ATOM 0 HB3 ASP B 71 6.103 85.437 8.144 1.00 0.00 H new ATOM 1616 N SER B 72 8.060 85.973 10.445 1.00 0.00 N ATOM 1617 CA SER B 72 8.913 85.118 11.332 1.00 0.00 C ATOM 1618 C SER B 72 9.608 85.969 12.407 1.00 0.00 C ATOM 1619 O SER B 72 10.471 85.462 13.131 1.00 0.00 O ATOM 1620 CB SER B 72 9.969 84.403 10.491 1.00 0.00 C ATOM 1621 OG SER B 72 9.324 83.574 9.533 1.00 0.00 O ATOM 0 H SER B 72 8.570 86.463 9.710 1.00 0.00 H new ATOM 0 HA SER B 72 8.273 84.387 11.826 1.00 0.00 H new ATOM 0 HB2 SER B 72 10.605 85.132 9.989 1.00 0.00 H new ATOM 0 HB3 SER B 72 10.616 83.803 11.131 1.00 0.00 H new ATOM 0 HG SER B 72 9.013 84.122 8.783 1.00 0.00 H new ATOM 1627 N ASN B 73 9.254 87.235 12.529 1.00 0.00 N ATOM 1628 CA ASN B 73 9.887 88.114 13.558 1.00 0.00 C ATOM 1629 C ASN B 73 9.070 88.029 14.840 1.00 0.00 C ATOM 1630 O ASN B 73 8.042 88.698 14.983 1.00 0.00 O ATOM 1631 CB ASN B 73 9.941 89.566 13.066 1.00 0.00 C ATOM 1632 CG ASN B 73 10.733 90.442 14.043 1.00 0.00 C ATOM 1633 OD1 ASN B 73 11.537 89.940 14.835 1.00 0.00 O ATOM 1634 ND2 ASN B 73 10.558 91.734 14.028 1.00 0.00 N ATOM 0 H ASN B 73 8.548 87.693 11.952 1.00 0.00 H new ATOM 0 HA ASN B 73 10.908 87.780 13.743 1.00 0.00 H new ATOM 0 HB2 ASN B 73 10.403 89.604 12.080 1.00 0.00 H new ATOM 0 HB3 ASN B 73 8.929 89.956 12.959 1.00 0.00 H new ATOM 0 HD21 ASN B 73 11.084 92.327 14.669 1.00 0.00 H new ATOM 0 HD22 ASN B 73 9.895 92.151 13.375 1.00 0.00 H new ATOM 1641 N MET B 74 9.506 87.204 15.761 1.00 0.00 N ATOM 1642 CA MET B 74 8.775 87.023 17.056 1.00 0.00 C ATOM 1643 C MET B 74 8.488 88.376 17.712 1.00 0.00 C ATOM 1644 O MET B 74 7.516 88.500 18.460 1.00 0.00 O ATOM 1645 CB MET B 74 9.602 86.155 18.009 1.00 0.00 C ATOM 1646 CG MET B 74 8.728 85.712 19.186 1.00 0.00 C ATOM 1647 SD MET B 74 9.626 84.499 20.184 1.00 0.00 S ATOM 1648 CE MET B 74 8.254 84.046 21.273 1.00 0.00 C ATOM 0 H MET B 74 10.351 86.639 15.669 1.00 0.00 H new ATOM 0 HA MET B 74 7.827 86.529 16.846 1.00 0.00 H new ATOM 0 HB2 MET B 74 9.988 85.283 17.481 1.00 0.00 H new ATOM 0 HB3 MET B 74 10.464 86.715 18.373 1.00 0.00 H new ATOM 0 HG2 MET B 74 8.459 86.574 19.797 1.00 0.00 H new ATOM 0 HG3 MET B 74 7.798 85.279 18.819 1.00 0.00 H new ATOM 0 HE1 MET B 74 8.642 83.787 22.258 1.00 0.00 H new ATOM 0 HE2 MET B 74 7.568 84.888 21.363 1.00 0.00 H new ATOM 0 HE3 MET B 74 7.725 83.190 20.855 1.00 0.00 H new ATOM 1658 N GLU B 75 9.307 89.379 17.464 1.00 0.00 N ATOM 1659 CA GLU B 75 9.076 90.724 18.088 1.00 0.00 C ATOM 1660 C GLU B 75 7.795 91.335 17.521 1.00 0.00 C ATOM 1661 O GLU B 75 6.956 91.855 18.270 1.00 0.00 O ATOM 1662 CB GLU B 75 10.261 91.649 17.796 1.00 0.00 C ATOM 1663 CG GLU B 75 11.529 91.079 18.436 1.00 0.00 C ATOM 1664 CD GLU B 75 12.689 92.051 18.247 1.00 0.00 C ATOM 1665 OE1 GLU B 75 12.931 92.836 19.149 1.00 0.00 O ATOM 1666 OE2 GLU B 75 13.317 91.997 17.202 1.00 0.00 O ATOM 0 H GLU B 75 10.124 89.321 16.856 1.00 0.00 H new ATOM 0 HA GLU B 75 8.977 90.605 19.167 1.00 0.00 H new ATOM 0 HB2 GLU B 75 10.399 91.750 16.720 1.00 0.00 H new ATOM 0 HB3 GLU B 75 10.061 92.647 18.187 1.00 0.00 H new ATOM 0 HG2 GLU B 75 11.362 90.901 19.498 1.00 0.00 H new ATOM 0 HG3 GLU B 75 11.773 90.117 17.986 1.00 0.00 H new ATOM 1673 N LEU B 76 7.626 91.268 16.218 1.00 0.00 N ATOM 1674 CA LEU B 76 6.395 91.828 15.567 1.00 0.00 C ATOM 1675 C LEU B 76 5.188 91.043 16.061 1.00 0.00 C ATOM 1676 O LEU B 76 4.150 91.612 16.414 1.00 0.00 O ATOM 1677 CB LEU B 76 6.515 91.681 14.030 1.00 0.00 C ATOM 1678 CG LEU B 76 6.702 93.053 13.365 1.00 0.00 C ATOM 1679 CD1 LEU B 76 7.317 92.882 11.969 1.00 0.00 C ATOM 1680 CD2 LEU B 76 5.341 93.759 13.246 1.00 0.00 C ATOM 0 H LEU B 76 8.294 90.846 15.573 1.00 0.00 H new ATOM 0 HA LEU B 76 6.283 92.883 15.818 1.00 0.00 H new ATOM 0 HB2 LEU B 76 7.359 91.036 13.786 1.00 0.00 H new ATOM 0 HB3 LEU B 76 5.621 91.199 13.635 1.00 0.00 H new ATOM 0 HG LEU B 76 7.372 93.656 13.977 1.00 0.00 H new ATOM 0 HD11 LEU B 76 7.446 93.860 11.506 1.00 0.00 H new ATOM 0 HD12 LEU B 76 8.286 92.391 12.056 1.00 0.00 H new ATOM 0 HD13 LEU B 76 6.656 92.273 11.352 1.00 0.00 H new ATOM 0 HD21 LEU B 76 5.476 94.732 12.774 1.00 0.00 H new ATOM 0 HD22 LEU B 76 4.668 93.152 12.640 1.00 0.00 H new ATOM 0 HD23 LEU B 76 4.913 93.894 14.239 1.00 0.00 H new ATOM 1692 N GLN B 77 5.327 89.748 16.078 1.00 0.00 N ATOM 1693 CA GLN B 77 4.226 88.850 16.527 1.00 0.00 C ATOM 1694 C GLN B 77 3.935 89.077 18.009 1.00 0.00 C ATOM 1695 O GLN B 77 2.784 89.000 18.426 1.00 0.00 O ATOM 1696 CB GLN B 77 4.631 87.385 16.293 1.00 0.00 C ATOM 1697 CG GLN B 77 3.464 86.448 16.633 1.00 0.00 C ATOM 1698 CD GLN B 77 3.786 85.026 16.182 1.00 0.00 C ATOM 1699 OE1 GLN B 77 3.734 84.093 16.985 1.00 0.00 O ATOM 1700 NE2 GLN B 77 4.116 84.801 14.939 1.00 0.00 N ATOM 0 H GLN B 77 6.177 89.262 15.793 1.00 0.00 H new ATOM 0 HA GLN B 77 3.326 89.073 15.954 1.00 0.00 H new ATOM 0 HB2 GLN B 77 4.928 87.244 15.254 1.00 0.00 H new ATOM 0 HB3 GLN B 77 5.496 87.137 16.908 1.00 0.00 H new ATOM 0 HG2 GLN B 77 3.275 86.464 17.706 1.00 0.00 H new ATOM 0 HG3 GLN B 77 2.554 86.796 16.144 1.00 0.00 H new ATOM 0 HE21 GLN B 77 4.159 85.574 14.275 1.00 0.00 H new ATOM 0 HE22 GLN B 77 4.331 83.852 14.632 1.00 0.00 H new ATOM 1709 N ARG B 78 4.946 89.308 18.811 1.00 0.00 N ATOM 1710 CA ARG B 78 4.726 89.485 20.282 1.00 0.00 C ATOM 1711 C ARG B 78 3.829 90.690 20.570 1.00 0.00 C ATOM 1712 O ARG B 78 2.894 90.583 21.378 1.00 0.00 O ATOM 1713 CB ARG B 78 6.074 89.682 20.984 1.00 0.00 C ATOM 1714 CG ARG B 78 5.912 89.488 22.498 1.00 0.00 C ATOM 1715 CD ARG B 78 5.828 87.995 22.825 1.00 0.00 C ATOM 1716 NE ARG B 78 5.774 87.790 24.313 1.00 0.00 N ATOM 1717 CZ ARG B 78 6.162 86.655 24.880 1.00 0.00 C ATOM 1718 NH1 ARG B 78 6.096 86.543 26.178 1.00 0.00 N ATOM 1719 NH2 ARG B 78 6.608 85.639 24.173 1.00 0.00 N ATOM 0 H ARG B 78 5.918 89.382 18.510 1.00 0.00 H new ATOM 0 HA ARG B 78 4.232 88.589 20.659 1.00 0.00 H new ATOM 0 HB2 ARG B 78 6.803 88.972 20.594 1.00 0.00 H new ATOM 0 HB3 ARG B 78 6.459 90.680 20.776 1.00 0.00 H new ATOM 0 HG2 ARG B 78 6.755 89.938 23.023 1.00 0.00 H new ATOM 0 HG3 ARG B 78 5.012 89.996 22.845 1.00 0.00 H new ATOM 0 HD2 ARG B 78 4.942 87.563 22.359 1.00 0.00 H new ATOM 0 HD3 ARG B 78 6.692 87.476 22.410 1.00 0.00 H new ATOM 0 HE ARG B 78 5.429 88.546 24.904 1.00 0.00 H new ATOM 0 HH11 ARG B 78 5.750 87.321 26.740 1.00 0.00 H new ATOM 0 HH12 ARG B 78 6.390 85.678 26.631 1.00 0.00 H new ATOM 0 HH21 ARG B 78 6.663 85.710 23.157 1.00 0.00 H new ATOM 0 HH22 ARG B 78 6.898 84.780 24.641 1.00 0.00 H new ATOM 1733 N MET B 79 4.087 91.828 19.954 1.00 0.00 N ATOM 1734 CA MET B 79 3.243 93.037 20.236 1.00 0.00 C ATOM 1735 C MET B 79 1.846 92.891 19.632 1.00 0.00 C ATOM 1736 O MET B 79 0.851 93.164 20.312 1.00 0.00 O ATOM 1737 CB MET B 79 3.921 94.317 19.728 1.00 0.00 C ATOM 1738 CG MET B 79 4.210 94.231 18.228 1.00 0.00 C ATOM 1739 SD MET B 79 5.182 95.678 17.738 1.00 0.00 S ATOM 1740 CE MET B 79 4.998 95.496 15.948 1.00 0.00 C ATOM 0 H MET B 79 4.837 91.968 19.277 1.00 0.00 H new ATOM 0 HA MET B 79 3.136 93.116 21.318 1.00 0.00 H new ATOM 0 HB2 MET B 79 3.280 95.176 19.929 1.00 0.00 H new ATOM 0 HB3 MET B 79 4.852 94.479 20.272 1.00 0.00 H new ATOM 0 HG2 MET B 79 4.755 93.315 18.001 1.00 0.00 H new ATOM 0 HG3 MET B 79 3.277 94.195 17.665 1.00 0.00 H new ATOM 0 HE1 MET B 79 5.928 95.118 15.523 1.00 0.00 H new ATOM 0 HE2 MET B 79 4.190 94.796 15.735 1.00 0.00 H new ATOM 0 HE3 MET B 79 4.765 96.465 15.506 1.00 0.00 H new ATOM 1750 N ILE B 80 1.743 92.485 18.384 1.00 0.00 N ATOM 1751 CA ILE B 80 0.394 92.340 17.743 1.00 0.00 C ATOM 1752 C ILE B 80 -0.371 91.172 18.360 1.00 0.00 C ATOM 1753 O ILE B 80 -1.573 91.277 18.612 1.00 0.00 O ATOM 1754 CB ILE B 80 0.518 92.150 16.227 1.00 0.00 C ATOM 1755 CG1 ILE B 80 1.427 90.930 15.881 1.00 0.00 C ATOM 1756 CG2 ILE B 80 1.093 93.434 15.614 1.00 0.00 C ATOM 1757 CD1 ILE B 80 0.561 89.742 15.441 1.00 0.00 C ATOM 0 H ILE B 80 2.534 92.249 17.784 1.00 0.00 H new ATOM 0 HA ILE B 80 -0.162 93.260 17.926 1.00 0.00 H new ATOM 0 HB ILE B 80 -0.470 91.949 15.812 1.00 0.00 H new ATOM 0 HG12 ILE B 80 2.123 91.198 15.086 1.00 0.00 H new ATOM 0 HG13 ILE B 80 2.025 90.653 16.749 1.00 0.00 H new ATOM 0 HG21 ILE B 80 1.186 93.312 14.535 1.00 0.00 H new ATOM 0 HG22 ILE B 80 0.427 94.270 15.828 1.00 0.00 H new ATOM 0 HG23 ILE B 80 2.075 93.634 16.043 1.00 0.00 H new ATOM 0 HD11 ILE B 80 1.202 88.894 15.201 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -0.117 89.467 16.249 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -0.018 90.020 14.560 1.00 0.00 H new ATOM 1769 N ALA B 81 0.295 90.068 18.603 1.00 0.00 N ATOM 1770 CA ALA B 81 -0.385 88.873 19.206 1.00 0.00 C ATOM 1771 C ALA B 81 -0.616 89.086 20.706 1.00 0.00 C ATOM 1772 O ALA B 81 -1.286 88.269 21.347 1.00 0.00 O ATOM 1773 CB ALA B 81 0.447 87.612 18.981 1.00 0.00 C ATOM 0 H ALA B 81 1.288 89.941 18.408 1.00 0.00 H new ATOM 0 HA ALA B 81 -1.351 88.748 18.716 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -0.062 86.756 19.425 1.00 0.00 H new ATOM 0 HB2 ALA B 81 0.572 87.445 17.911 1.00 0.00 H new ATOM 0 HB3 ALA B 81 1.425 87.734 19.446 1.00 0.00 H new ATOM 1779 N ALA B 82 -0.085 90.151 21.281 1.00 0.00 N ATOM 1780 CA ALA B 82 -0.280 90.403 22.748 1.00 0.00 C ATOM 1781 C ALA B 82 -1.615 91.137 22.985 1.00 0.00 C ATOM 1782 O ALA B 82 -1.947 91.460 24.130 1.00 0.00 O ATOM 1783 CB ALA B 82 0.876 91.250 23.292 1.00 0.00 C ATOM 0 H ALA B 82 0.473 90.853 20.795 1.00 0.00 H new ATOM 0 HA ALA B 82 -0.300 89.446 23.269 1.00 0.00 H new ATOM 0 HB1 ALA B 82 0.727 91.428 24.357 1.00 0.00 H new ATOM 0 HB2 ALA B 82 1.817 90.721 23.141 1.00 0.00 H new ATOM 0 HB3 ALA B 82 0.907 92.204 22.765 1.00 0.00 H new ATOM 1789 N VAL B 83 -2.400 91.377 21.942 1.00 0.00 N ATOM 1790 CA VAL B 83 -3.727 92.053 22.103 1.00 0.00 C ATOM 1791 C VAL B 83 -4.714 90.996 22.626 1.00 0.00 C ATOM 1792 O VAL B 83 -5.360 90.298 21.834 1.00 0.00 O ATOM 1793 CB VAL B 83 -4.204 92.596 20.741 1.00 0.00 C ATOM 1794 CG1 VAL B 83 -5.507 93.369 20.926 1.00 0.00 C ATOM 1795 CG2 VAL B 83 -3.148 93.541 20.153 1.00 0.00 C ATOM 0 H VAL B 83 -2.166 91.127 20.981 1.00 0.00 H new ATOM 0 HA VAL B 83 -3.657 92.891 22.796 1.00 0.00 H new ATOM 0 HB VAL B 83 -4.361 91.756 20.064 1.00 0.00 H new ATOM 0 HG11 VAL B 83 -5.843 93.752 19.962 1.00 0.00 H new ATOM 0 HG12 VAL B 83 -6.268 92.706 21.338 1.00 0.00 H new ATOM 0 HG13 VAL B 83 -5.342 94.202 21.610 1.00 0.00 H new ATOM 0 HG21 VAL B 83 -3.494 93.919 19.191 1.00 0.00 H new ATOM 0 HG22 VAL B 83 -2.987 94.376 20.835 1.00 0.00 H new ATOM 0 HG23 VAL B 83 -2.212 93.000 20.015 1.00 0.00 H new ATOM 1805 N ASP B 84 -4.827 90.844 23.935 1.00 0.00 N ATOM 1806 CA ASP B 84 -5.756 89.811 24.517 1.00 0.00 C ATOM 1807 C ASP B 84 -7.140 89.955 23.889 1.00 0.00 C ATOM 1808 O ASP B 84 -7.400 90.916 23.157 1.00 0.00 O ATOM 1809 CB ASP B 84 -5.851 89.946 26.043 1.00 0.00 C ATOM 1810 CG ASP B 84 -4.457 90.020 26.661 1.00 0.00 C ATOM 1811 OD1 ASP B 84 -4.140 89.155 27.461 1.00 0.00 O ATOM 1812 OD2 ASP B 84 -3.728 90.941 26.330 1.00 0.00 O ATOM 0 H ASP B 84 -4.314 91.393 24.624 1.00 0.00 H new ATOM 0 HA ASP B 84 -5.355 88.822 24.293 1.00 0.00 H new ATOM 0 HB2 ASP B 84 -6.417 90.841 26.300 1.00 0.00 H new ATOM 0 HB3 ASP B 84 -6.394 89.096 26.456 1.00 0.00 H new ATOM 1817 N THR B 85 -8.020 89.010 24.138 1.00 0.00 N ATOM 1818 CA THR B 85 -9.392 89.058 23.530 1.00 0.00 C ATOM 1819 C THR B 85 -10.407 89.745 24.463 1.00 0.00 C ATOM 1820 O THR B 85 -11.536 90.010 24.038 1.00 0.00 O ATOM 1821 CB THR B 85 -9.905 87.654 23.067 1.00 0.00 C ATOM 1822 OG1 THR B 85 -11.325 87.662 23.018 1.00 0.00 O ATOM 1823 CG2 THR B 85 -9.452 86.498 23.982 1.00 0.00 C ATOM 0 H THR B 85 -7.846 88.204 24.739 1.00 0.00 H new ATOM 0 HA THR B 85 -9.300 89.666 22.630 1.00 0.00 H new ATOM 0 HB THR B 85 -9.470 87.478 22.083 1.00 0.00 H new ATOM 0 HG1 THR B 85 -11.647 88.588 23.018 1.00 0.00 H new ATOM 0 HG21 THR B 85 -9.845 85.556 23.600 1.00 0.00 H new ATOM 0 HG22 THR B 85 -8.363 86.456 24.003 1.00 0.00 H new ATOM 0 HG23 THR B 85 -9.828 86.664 24.992 1.00 0.00 H new ATOM 1831 N ASP B 86 -10.064 90.011 25.716 1.00 0.00 N ATOM 1832 CA ASP B 86 -11.049 90.644 26.649 1.00 0.00 C ATOM 1833 C ASP B 86 -11.141 92.158 26.417 1.00 0.00 C ATOM 1834 O ASP B 86 -12.209 92.665 26.058 1.00 0.00 O ATOM 1835 CB ASP B 86 -10.669 90.338 28.107 1.00 0.00 C ATOM 1836 CG ASP B 86 -9.194 90.633 28.363 1.00 0.00 C ATOM 1837 OD1 ASP B 86 -8.365 89.917 27.826 1.00 0.00 O ATOM 1838 OD2 ASP B 86 -8.916 91.570 29.093 1.00 0.00 O ATOM 0 H ASP B 86 -9.149 89.815 26.121 1.00 0.00 H new ATOM 0 HA ASP B 86 -12.032 90.219 26.447 1.00 0.00 H new ATOM 0 HB2 ASP B 86 -11.285 90.935 28.780 1.00 0.00 H new ATOM 0 HB3 ASP B 86 -10.878 89.291 28.329 1.00 0.00 H new ATOM 1843 N SER B 87 -10.068 92.885 26.638 1.00 0.00 N ATOM 1844 CA SER B 87 -10.094 94.381 26.462 1.00 0.00 C ATOM 1845 C SER B 87 -9.181 94.854 25.304 1.00 0.00 C ATOM 1846 O SER B 87 -9.615 95.694 24.514 1.00 0.00 O ATOM 1847 CB SER B 87 -9.657 95.062 27.761 1.00 0.00 C ATOM 1848 OG SER B 87 -10.766 95.136 28.649 1.00 0.00 O ATOM 0 H SER B 87 -9.169 92.506 26.935 1.00 0.00 H new ATOM 0 HA SER B 87 -11.118 94.659 26.212 1.00 0.00 H new ATOM 0 HB2 SER B 87 -8.843 94.502 28.223 1.00 0.00 H new ATOM 0 HB3 SER B 87 -9.277 96.062 27.551 1.00 0.00 H new ATOM 0 HG SER B 87 -10.489 95.570 29.483 1.00 0.00 H new ATOM 1854 N PRO B 88 -7.937 94.378 25.179 1.00 0.00 N ATOM 1855 CA PRO B 88 -7.004 94.826 24.089 1.00 0.00 C ATOM 1856 C PRO B 88 -7.626 94.846 22.689 1.00 0.00 C ATOM 1857 O PRO B 88 -7.115 95.543 21.793 1.00 0.00 O ATOM 1858 CB PRO B 88 -5.848 93.834 24.167 1.00 0.00 C ATOM 1859 CG PRO B 88 -5.802 93.451 25.599 1.00 0.00 C ATOM 1860 CD PRO B 88 -7.259 93.387 26.049 1.00 0.00 C ATOM 0 HA PRO B 88 -6.706 95.863 24.241 1.00 0.00 H new ATOM 0 HB2 PRO B 88 -6.021 92.968 23.527 1.00 0.00 H new ATOM 0 HB3 PRO B 88 -4.911 94.287 23.844 1.00 0.00 H new ATOM 0 HG2 PRO B 88 -5.307 92.489 25.733 1.00 0.00 H new ATOM 0 HG3 PRO B 88 -5.242 94.181 26.183 1.00 0.00 H new ATOM 0 HD2 PRO B 88 -7.675 92.388 25.919 1.00 0.00 H new ATOM 0 HD3 PRO B 88 -7.364 93.641 27.104 1.00 0.00 H new ATOM 1868 N ARG B 89 -8.710 94.133 22.467 1.00 0.00 N ATOM 1869 CA ARG B 89 -9.336 94.146 21.100 1.00 0.00 C ATOM 1870 C ARG B 89 -9.752 95.579 20.780 1.00 0.00 C ATOM 1871 O ARG B 89 -9.811 95.962 19.606 1.00 0.00 O ATOM 1872 CB ARG B 89 -10.566 93.236 21.062 1.00 0.00 C ATOM 1873 CG ARG B 89 -10.130 91.778 21.171 1.00 0.00 C ATOM 1874 CD ARG B 89 -11.369 90.894 21.302 1.00 0.00 C ATOM 1875 NE ARG B 89 -12.194 90.963 20.048 1.00 0.00 N ATOM 1876 CZ ARG B 89 -11.913 90.224 18.982 1.00 0.00 C ATOM 1877 NH1 ARG B 89 -12.682 90.309 17.932 1.00 0.00 N ATOM 1878 NH2 ARG B 89 -10.875 89.417 18.951 1.00 0.00 N ATOM 0 H ARG B 89 -9.182 93.552 23.160 1.00 0.00 H new ATOM 0 HA ARG B 89 -8.618 93.781 20.366 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -11.241 93.486 21.881 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -11.118 93.392 20.135 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -9.555 91.491 20.291 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -9.479 91.644 22.035 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -11.070 89.863 21.492 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -11.965 91.216 22.156 1.00 0.00 H new ATOM 0 HE ARG B 89 -12.993 91.596 20.015 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -13.486 90.937 17.938 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -12.480 89.748 17.105 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -10.260 89.346 19.761 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -10.685 88.862 18.117 1.00 0.00 H new ATOM 1892 N GLU B 90 -9.969 96.391 21.794 1.00 0.00 N ATOM 1893 CA GLU B 90 -10.302 97.820 21.565 1.00 0.00 C ATOM 1894 C GLU B 90 -9.062 98.503 20.979 1.00 0.00 C ATOM 1895 O GLU B 90 -9.189 99.442 20.187 1.00 0.00 O ATOM 1896 CB GLU B 90 -10.696 98.490 22.884 1.00 0.00 C ATOM 1897 CG GLU B 90 -12.001 97.880 23.396 1.00 0.00 C ATOM 1898 CD GLU B 90 -12.411 98.545 24.706 1.00 0.00 C ATOM 1899 OE1 GLU B 90 -12.399 97.868 25.720 1.00 0.00 O ATOM 1900 OE2 GLU B 90 -12.729 99.723 24.675 1.00 0.00 O ATOM 0 H GLU B 90 -9.927 96.113 22.774 1.00 0.00 H new ATOM 0 HA GLU B 90 -11.144 97.906 20.878 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -9.905 98.356 23.622 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -10.817 99.563 22.737 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -12.788 98.008 22.652 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -11.876 96.808 23.547 1.00 0.00 H new ATOM 1907 N VAL B 91 -7.863 98.049 21.344 1.00 0.00 N ATOM 1908 CA VAL B 91 -6.616 98.680 20.794 1.00 0.00 C ATOM 1909 C VAL B 91 -6.633 98.499 19.280 1.00 0.00 C ATOM 1910 O VAL B 91 -6.333 99.436 18.533 1.00 0.00 O ATOM 1911 CB VAL B 91 -5.267 98.122 21.436 1.00 0.00 C ATOM 1912 CG1 VAL B 91 -5.463 97.621 22.891 1.00 0.00 C ATOM 1913 CG2 VAL B 91 -4.597 96.980 20.610 1.00 0.00 C ATOM 0 H VAL B 91 -7.707 97.277 21.992 1.00 0.00 H new ATOM 0 HA VAL B 91 -6.621 99.737 21.061 1.00 0.00 H new ATOM 0 HB VAL B 91 -4.602 98.986 21.429 1.00 0.00 H new ATOM 0 HG11 VAL B 91 -4.514 97.252 23.280 1.00 0.00 H new ATOM 0 HG12 VAL B 91 -5.816 98.443 23.514 1.00 0.00 H new ATOM 0 HG13 VAL B 91 -6.197 96.816 22.903 1.00 0.00 H new ATOM 0 HG21 VAL B 91 -3.686 96.655 21.112 1.00 0.00 H new ATOM 0 HG22 VAL B 91 -5.286 96.139 20.527 1.00 0.00 H new ATOM 0 HG23 VAL B 91 -4.351 97.348 19.614 1.00 0.00 H new ATOM 1923 N PHE B 92 -6.964 97.307 18.821 1.00 0.00 N ATOM 1924 CA PHE B 92 -6.979 97.046 17.358 1.00 0.00 C ATOM 1925 C PHE B 92 -8.123 97.822 16.724 1.00 0.00 C ATOM 1926 O PHE B 92 -7.937 98.481 15.694 1.00 0.00 O ATOM 1927 CB PHE B 92 -7.130 95.538 17.095 1.00 0.00 C ATOM 1928 CG PHE B 92 -6.300 95.147 15.893 1.00 0.00 C ATOM 1929 CD1 PHE B 92 -6.918 94.836 14.681 1.00 0.00 C ATOM 1930 CD2 PHE B 92 -4.904 95.121 15.995 1.00 0.00 C ATOM 1931 CE1 PHE B 92 -6.141 94.493 13.566 1.00 0.00 C ATOM 1932 CE2 PHE B 92 -4.128 94.780 14.890 1.00 0.00 C ATOM 1933 CZ PHE B 92 -4.745 94.466 13.672 1.00 0.00 C ATOM 0 H PHE B 92 -7.222 96.512 19.405 1.00 0.00 H new ATOM 0 HA PHE B 92 -6.039 97.375 16.915 1.00 0.00 H new ATOM 0 HB2 PHE B 92 -6.810 94.972 17.970 1.00 0.00 H new ATOM 0 HB3 PHE B 92 -8.178 95.292 16.922 1.00 0.00 H new ATOM 0 HD1 PHE B 92 -7.995 94.860 14.602 1.00 0.00 H new ATOM 0 HD2 PHE B 92 -4.428 95.366 16.933 1.00 0.00 H new ATOM 0 HE1 PHE B 92 -6.618 94.250 12.628 1.00 0.00 H new ATOM 0 HE2 PHE B 92 -3.051 94.758 14.972 1.00 0.00 H new ATOM 0 HZ PHE B 92 -4.144 94.203 12.814 1.00 0.00 H new ATOM 1943 N PHE B 93 -9.289 97.773 17.325 1.00 0.00 N ATOM 1944 CA PHE B 93 -10.461 98.527 16.772 1.00 0.00 C ATOM 1945 C PHE B 93 -10.113 100.018 16.713 1.00 0.00 C ATOM 1946 O PHE B 93 -10.595 100.739 15.836 1.00 0.00 O ATOM 1947 CB PHE B 93 -11.703 98.317 17.657 1.00 0.00 C ATOM 1948 CG PHE B 93 -12.478 97.093 17.200 1.00 0.00 C ATOM 1949 CD1 PHE B 93 -12.523 95.943 18.000 1.00 0.00 C ATOM 1950 CD2 PHE B 93 -13.151 97.112 15.970 1.00 0.00 C ATOM 1951 CE1 PHE B 93 -13.237 94.817 17.573 1.00 0.00 C ATOM 1952 CE2 PHE B 93 -13.865 95.985 15.544 1.00 0.00 C ATOM 1953 CZ PHE B 93 -13.908 94.839 16.345 1.00 0.00 C ATOM 0 H PHE B 93 -9.480 97.243 18.175 1.00 0.00 H new ATOM 0 HA PHE B 93 -10.684 98.158 15.771 1.00 0.00 H new ATOM 0 HB2 PHE B 93 -11.400 98.196 18.697 1.00 0.00 H new ATOM 0 HB3 PHE B 93 -12.343 99.198 17.612 1.00 0.00 H new ATOM 0 HD1 PHE B 93 -12.006 95.925 18.948 1.00 0.00 H new ATOM 0 HD2 PHE B 93 -13.119 97.996 15.351 1.00 0.00 H new ATOM 0 HE1 PHE B 93 -13.270 93.932 18.191 1.00 0.00 H new ATOM 0 HE2 PHE B 93 -14.383 96.001 14.596 1.00 0.00 H new ATOM 0 HZ PHE B 93 -14.459 93.971 16.016 1.00 0.00 H new ATOM 1963 N ARG B 94 -9.295 100.490 17.634 1.00 0.00 N ATOM 1964 CA ARG B 94 -8.903 101.935 17.662 1.00 0.00 C ATOM 1965 C ARG B 94 -8.051 102.280 16.440 1.00 0.00 C ATOM 1966 O ARG B 94 -8.276 103.312 15.802 1.00 0.00 O ATOM 1967 CB ARG B 94 -8.109 102.232 18.941 1.00 0.00 C ATOM 1968 CG ARG B 94 -9.060 102.350 20.146 1.00 0.00 C ATOM 1969 CD ARG B 94 -9.640 103.766 20.224 1.00 0.00 C ATOM 1970 NE ARG B 94 -10.497 103.910 21.449 1.00 0.00 N ATOM 1971 CZ ARG B 94 -11.795 103.638 21.440 1.00 0.00 C ATOM 1972 NH1 ARG B 94 -12.481 103.793 22.540 1.00 0.00 N ATOM 1973 NH2 ARG B 94 -12.413 103.212 20.360 1.00 0.00 N ATOM 0 H ARG B 94 -8.880 99.924 18.374 1.00 0.00 H new ATOM 0 HA ARG B 94 -9.808 102.543 17.645 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -7.383 101.439 19.119 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -7.547 103.158 18.821 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -9.867 101.623 20.055 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -8.524 102.117 21.066 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -8.832 104.497 20.249 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -10.231 103.974 19.332 1.00 0.00 H new ATOM 0 HE ARG B 94 -10.066 104.228 22.317 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -12.018 104.119 23.388 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -13.480 103.588 22.551 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -11.892 103.081 19.493 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -13.413 103.013 20.390 1.00 0.00 H new ATOM 1987 N VAL B 95 -7.070 101.460 16.112 1.00 0.00 N ATOM 1988 CA VAL B 95 -6.181 101.763 14.930 1.00 0.00 C ATOM 1989 C VAL B 95 -7.013 101.771 13.650 1.00 0.00 C ATOM 1990 O VAL B 95 -6.904 102.695 12.836 1.00 0.00 O ATOM 1991 CB VAL B 95 -5.070 100.702 14.776 1.00 0.00 C ATOM 1992 CG1 VAL B 95 -4.062 101.154 13.713 1.00 0.00 C ATOM 1993 CG2 VAL B 95 -4.330 100.500 16.097 1.00 0.00 C ATOM 0 H VAL B 95 -6.847 100.598 16.609 1.00 0.00 H new ATOM 0 HA VAL B 95 -5.724 102.737 15.101 1.00 0.00 H new ATOM 0 HB VAL B 95 -5.536 99.763 14.477 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -3.281 100.401 13.609 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -4.572 101.281 12.758 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -3.615 102.101 14.015 1.00 0.00 H new ATOM 0 HG21 VAL B 95 -3.551 99.748 15.967 1.00 0.00 H new ATOM 0 HG22 VAL B 95 -3.877 101.441 16.408 1.00 0.00 H new ATOM 0 HG23 VAL B 95 -5.033 100.166 16.860 1.00 0.00 H new ATOM 2003 N ALA B 96 -7.818 100.757 13.454 1.00 0.00 N ATOM 2004 CA ALA B 96 -8.659 100.667 12.219 1.00 0.00 C ATOM 2005 C ALA B 96 -9.713 101.776 12.230 1.00 0.00 C ATOM 2006 O ALA B 96 -9.922 102.456 11.219 1.00 0.00 O ATOM 2007 CB ALA B 96 -9.323 99.288 12.143 1.00 0.00 C ATOM 0 H ALA B 96 -7.930 99.979 14.104 1.00 0.00 H new ATOM 0 HA ALA B 96 -8.029 100.796 11.339 1.00 0.00 H new ATOM 0 HB1 ALA B 96 -9.934 99.228 11.242 1.00 0.00 H new ATOM 0 HB2 ALA B 96 -8.555 98.515 12.113 1.00 0.00 H new ATOM 0 HB3 ALA B 96 -9.953 99.139 13.020 1.00 0.00 H new ATOM 2013 N ALA B 97 -10.378 101.962 13.348 1.00 0.00 N ATOM 2014 CA ALA B 97 -11.435 103.019 13.449 1.00 0.00 C ATOM 2015 C ALA B 97 -10.812 104.392 13.225 1.00 0.00 C ATOM 2016 O ALA B 97 -11.396 105.240 12.545 1.00 0.00 O ATOM 2017 CB ALA B 97 -12.090 102.976 14.831 1.00 0.00 C ATOM 0 H ALA B 97 -10.232 101.422 14.201 1.00 0.00 H new ATOM 0 HA ALA B 97 -12.193 102.834 12.688 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -12.857 103.748 14.894 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -12.546 101.998 14.987 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -11.335 103.151 15.597 1.00 0.00 H new ATOM 2023 N ASP B 98 -9.649 104.627 13.788 1.00 0.00 N ATOM 2024 CA ASP B 98 -8.965 105.950 13.628 1.00 0.00 C ATOM 2025 C ASP B 98 -8.536 106.137 12.174 1.00 0.00 C ATOM 2026 O ASP B 98 -8.594 107.250 11.641 1.00 0.00 O ATOM 2027 CB ASP B 98 -7.740 106.023 14.542 1.00 0.00 C ATOM 2028 CG ASP B 98 -7.334 107.477 14.759 1.00 0.00 C ATOM 2029 OD1 ASP B 98 -8.070 108.181 15.432 1.00 0.00 O ATOM 2030 OD2 ASP B 98 -6.297 107.866 14.251 1.00 0.00 O ATOM 0 H ASP B 98 -9.140 103.951 14.357 1.00 0.00 H new ATOM 0 HA ASP B 98 -9.660 106.743 13.904 1.00 0.00 H new ATOM 0 HB2 ASP B 98 -7.963 105.553 15.500 1.00 0.00 H new ATOM 0 HB3 ASP B 98 -6.913 105.468 14.099 1.00 0.00 H new ATOM 2035 N MET B 99 -8.101 105.076 11.531 1.00 0.00 N ATOM 2036 CA MET B 99 -7.650 105.164 10.107 1.00 0.00 C ATOM 2037 C MET B 99 -8.802 105.661 9.235 1.00 0.00 C ATOM 2038 O MET B 99 -8.601 106.507 8.356 1.00 0.00 O ATOM 2039 CB MET B 99 -7.192 103.778 9.626 1.00 0.00 C ATOM 2040 CG MET B 99 -6.576 103.871 8.222 1.00 0.00 C ATOM 2041 SD MET B 99 -6.685 102.255 7.411 1.00 0.00 S ATOM 2042 CE MET B 99 -8.479 102.242 7.170 1.00 0.00 C ATOM 0 H MET B 99 -8.040 104.143 11.939 1.00 0.00 H new ATOM 0 HA MET B 99 -6.817 105.863 10.032 1.00 0.00 H new ATOM 0 HB2 MET B 99 -6.462 103.368 10.323 1.00 0.00 H new ATOM 0 HB3 MET B 99 -8.040 103.093 9.613 1.00 0.00 H new ATOM 0 HG2 MET B 99 -7.100 104.623 7.632 1.00 0.00 H new ATOM 0 HG3 MET B 99 -5.535 104.187 8.289 1.00 0.00 H new ATOM 0 HE1 MET B 99 -8.730 101.580 6.341 1.00 0.00 H new ATOM 0 HE2 MET B 99 -8.966 101.887 8.079 1.00 0.00 H new ATOM 0 HE3 MET B 99 -8.823 103.251 6.945 1.00 0.00 H new ATOM 2052 N PHE B 100 -9.994 105.150 9.453 1.00 0.00 N ATOM 2053 CA PHE B 100 -11.173 105.580 8.632 1.00 0.00 C ATOM 2054 C PHE B 100 -11.747 106.884 9.195 1.00 0.00 C ATOM 2055 O PHE B 100 -12.254 107.720 8.438 1.00 0.00 O ATOM 2056 CB PHE B 100 -12.253 104.477 8.638 1.00 0.00 C ATOM 2057 CG PHE B 100 -12.992 104.439 7.311 1.00 0.00 C ATOM 2058 CD1 PHE B 100 -12.856 103.333 6.461 1.00 0.00 C ATOM 2059 CD2 PHE B 100 -13.816 105.509 6.936 1.00 0.00 C ATOM 2060 CE1 PHE B 100 -13.542 103.297 5.241 1.00 0.00 C ATOM 2061 CE2 PHE B 100 -14.501 105.473 5.715 1.00 0.00 C ATOM 2062 CZ PHE B 100 -14.363 104.367 4.868 1.00 0.00 C ATOM 0 H PHE B 100 -10.200 104.451 10.167 1.00 0.00 H new ATOM 0 HA PHE B 100 -10.851 105.748 7.604 1.00 0.00 H new ATOM 0 HB2 PHE B 100 -11.790 103.509 8.829 1.00 0.00 H new ATOM 0 HB3 PHE B 100 -12.960 104.658 9.448 1.00 0.00 H new ATOM 0 HD1 PHE B 100 -12.221 102.507 6.747 1.00 0.00 H new ATOM 0 HD2 PHE B 100 -13.923 106.362 7.589 1.00 0.00 H new ATOM 0 HE1 PHE B 100 -13.437 102.443 4.588 1.00 0.00 H new ATOM 0 HE2 PHE B 100 -15.135 106.298 5.427 1.00 0.00 H new ATOM 0 HZ PHE B 100 -14.891 104.340 3.926 1.00 0.00 H new ATOM 2072 N SER B 101 -11.696 107.067 10.500 1.00 0.00 N ATOM 2073 CA SER B 101 -12.256 108.307 11.129 1.00 0.00 C ATOM 2074 C SER B 101 -11.423 109.547 10.773 1.00 0.00 C ATOM 2075 O SER B 101 -11.987 110.633 10.599 1.00 0.00 O ATOM 2076 CB SER B 101 -12.319 108.145 12.651 1.00 0.00 C ATOM 2077 OG SER B 101 -12.875 109.320 13.226 1.00 0.00 O ATOM 0 H SER B 101 -11.287 106.403 11.157 1.00 0.00 H new ATOM 0 HA SER B 101 -13.262 108.451 10.736 1.00 0.00 H new ATOM 0 HB2 SER B 101 -12.925 107.277 12.911 1.00 0.00 H new ATOM 0 HB3 SER B 101 -11.321 107.968 13.051 1.00 0.00 H new ATOM 0 HG SER B 101 -12.918 109.219 14.200 1.00 0.00 H new ATOM 2083 N ASP B 102 -10.109 109.428 10.676 1.00 0.00 N ATOM 2084 CA ASP B 102 -9.259 110.621 10.349 1.00 0.00 C ATOM 2085 C ASP B 102 -8.937 110.680 8.850 1.00 0.00 C ATOM 2086 O ASP B 102 -8.298 111.636 8.397 1.00 0.00 O ATOM 2087 CB ASP B 102 -7.956 110.562 11.150 1.00 0.00 C ATOM 2088 CG ASP B 102 -7.371 111.962 11.297 1.00 0.00 C ATOM 2089 OD1 ASP B 102 -7.974 112.765 11.991 1.00 0.00 O ATOM 2090 OD2 ASP B 102 -6.330 112.213 10.714 1.00 0.00 O ATOM 0 H ASP B 102 -9.595 108.557 10.810 1.00 0.00 H new ATOM 0 HA ASP B 102 -9.818 111.518 10.615 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -8.143 110.132 12.134 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -7.240 109.911 10.649 1.00 0.00 H new ATOM 2095 N GLY B 103 -9.361 109.699 8.074 1.00 0.00 N ATOM 2096 CA GLY B 103 -9.076 109.716 6.602 1.00 0.00 C ATOM 2097 C GLY B 103 -7.622 109.315 6.336 1.00 0.00 C ATOM 2098 O GLY B 103 -7.064 109.663 5.289 1.00 0.00 O ATOM 0 H GLY B 103 -9.891 108.891 8.401 1.00 0.00 H new ATOM 0 HA2 GLY B 103 -9.749 109.031 6.087 1.00 0.00 H new ATOM 0 HA3 GLY B 103 -9.265 110.711 6.200 1.00 0.00 H new ATOM 2102 N ASN B 104 -6.996 108.609 7.257 1.00 0.00 N ATOM 2103 CA ASN B 104 -5.570 108.196 7.068 1.00 0.00 C ATOM 2104 C ASN B 104 -5.498 107.113 6.000 1.00 0.00 C ATOM 2105 O ASN B 104 -6.146 106.067 6.119 1.00 0.00 O ATOM 2106 CB ASN B 104 -4.995 107.654 8.380 1.00 0.00 C ATOM 2107 CG ASN B 104 -5.181 108.668 9.504 1.00 0.00 C ATOM 2108 OD1 ASN B 104 -5.068 109.875 9.286 1.00 0.00 O ATOM 2109 ND2 ASN B 104 -5.459 108.243 10.707 1.00 0.00 N ATOM 0 H ASN B 104 -7.418 108.302 8.134 1.00 0.00 H new ATOM 0 HA ASN B 104 -4.987 109.064 6.758 1.00 0.00 H new ATOM 0 HB2 ASN B 104 -5.489 106.718 8.641 1.00 0.00 H new ATOM 0 HB3 ASN B 104 -3.935 107.431 8.255 1.00 0.00 H new ATOM 0 HD21 ASN B 104 -5.583 108.911 11.468 1.00 0.00 H new ATOM 0 HD22 ASN B 104 -5.552 107.243 10.886 1.00 0.00 H new ATOM 2116 N PHE B 105 -4.725 107.345 4.963 1.00 0.00 N ATOM 2117 CA PHE B 105 -4.591 106.342 3.862 1.00 0.00 C ATOM 2118 C PHE B 105 -3.419 106.744 2.968 1.00 0.00 C ATOM 2119 O PHE B 105 -3.453 107.796 2.321 1.00 0.00 O ATOM 2120 CB PHE B 105 -5.897 106.290 3.036 1.00 0.00 C ATOM 2121 CG PHE B 105 -6.689 105.032 3.355 1.00 0.00 C ATOM 2122 CD1 PHE B 105 -7.914 105.117 4.030 1.00 0.00 C ATOM 2123 CD2 PHE B 105 -6.190 103.783 2.966 1.00 0.00 C ATOM 2124 CE1 PHE B 105 -8.638 103.953 4.313 1.00 0.00 C ATOM 2125 CE2 PHE B 105 -6.914 102.620 3.251 1.00 0.00 C ATOM 2126 CZ PHE B 105 -8.139 102.705 3.925 1.00 0.00 C ATOM 0 H PHE B 105 -4.177 108.196 4.834 1.00 0.00 H new ATOM 0 HA PHE B 105 -4.407 105.353 4.283 1.00 0.00 H new ATOM 0 HB2 PHE B 105 -6.503 107.170 3.250 1.00 0.00 H new ATOM 0 HB3 PHE B 105 -5.661 106.316 1.972 1.00 0.00 H new ATOM 0 HD1 PHE B 105 -8.299 106.080 4.332 1.00 0.00 H new ATOM 0 HD2 PHE B 105 -5.246 103.717 2.446 1.00 0.00 H new ATOM 0 HE1 PHE B 105 -9.583 104.018 4.832 1.00 0.00 H new ATOM 0 HE2 PHE B 105 -6.528 101.657 2.951 1.00 0.00 H new ATOM 0 HZ PHE B 105 -8.698 101.807 4.145 1.00 0.00 H new ATOM 2136 N ASN B 106 -2.395 105.921 2.918 1.00 0.00 N ATOM 2137 CA ASN B 106 -1.204 106.223 2.065 1.00 0.00 C ATOM 2138 C ASN B 106 -1.219 105.279 0.862 1.00 0.00 C ATOM 2139 O ASN B 106 -2.195 104.546 0.663 1.00 0.00 O ATOM 2140 CB ASN B 106 0.089 106.044 2.874 1.00 0.00 C ATOM 2141 CG ASN B 106 -0.002 106.808 4.192 1.00 0.00 C ATOM 2142 OD1 ASN B 106 -0.001 108.039 4.199 1.00 0.00 O ATOM 2143 ND2 ASN B 106 -0.084 106.146 5.313 1.00 0.00 N ATOM 0 H ASN B 106 -2.336 105.045 3.438 1.00 0.00 H new ATOM 0 HA ASN B 106 -1.244 107.257 1.722 1.00 0.00 H new ATOM 0 HB2 ASN B 106 0.260 104.986 3.070 1.00 0.00 H new ATOM 0 HB3 ASN B 106 0.941 106.403 2.296 1.00 0.00 H new ATOM 0 HD21 ASN B 106 -0.148 106.648 6.198 1.00 0.00 H new ATOM 0 HD22 ASN B 106 -0.085 105.126 5.304 1.00 0.00 H new ATOM 2150 N TRP B 107 -0.177 105.284 0.052 1.00 0.00 N ATOM 2151 CA TRP B 107 -0.143 104.391 -1.150 1.00 0.00 C ATOM 2152 C TRP B 107 0.761 103.185 -0.883 1.00 0.00 C ATOM 2153 O TRP B 107 1.949 103.328 -0.581 1.00 0.00 O ATOM 2154 CB TRP B 107 0.343 105.183 -2.375 1.00 0.00 C ATOM 2155 CG TRP B 107 0.281 104.336 -3.614 1.00 0.00 C ATOM 2156 CD1 TRP B 107 1.306 104.174 -4.483 1.00 0.00 C ATOM 2157 CD2 TRP B 107 -0.826 103.537 -4.139 1.00 0.00 C ATOM 2158 NE1 TRP B 107 0.904 103.331 -5.502 1.00 0.00 N ATOM 2159 CE2 TRP B 107 -0.400 102.911 -5.336 1.00 0.00 C ATOM 2160 CE3 TRP B 107 -2.145 103.295 -3.700 1.00 0.00 C ATOM 2161 CZ2 TRP B 107 -1.246 102.077 -6.066 1.00 0.00 C ATOM 2162 CZ3 TRP B 107 -2.997 102.456 -4.436 1.00 0.00 C ATOM 2163 CH2 TRP B 107 -2.549 101.847 -5.616 1.00 0.00 C ATOM 0 H TRP B 107 0.649 105.870 0.176 1.00 0.00 H new ATOM 0 HA TRP B 107 -1.148 104.023 -1.355 1.00 0.00 H new ATOM 0 HB2 TRP B 107 -0.272 106.073 -2.506 1.00 0.00 H new ATOM 0 HB3 TRP B 107 1.366 105.523 -2.212 1.00 0.00 H new ATOM 0 HD1 TRP B 107 2.281 104.630 -4.394 1.00 0.00 H new ATOM 0 HE1 TRP B 107 1.499 103.053 -6.282 1.00 0.00 H new ATOM 0 HE3 TRP B 107 -2.502 103.758 -2.792 1.00 0.00 H new ATOM 0 HZ2 TRP B 107 -0.896 101.611 -6.975 1.00 0.00 H new ATOM 0 HZ3 TRP B 107 -4.005 102.279 -4.090 1.00 0.00 H new ATOM 0 HH2 TRP B 107 -3.209 101.201 -6.176 1.00 0.00 H new ATOM 2174 N GLY B 108 0.202 102.003 -1.006 1.00 0.00 N ATOM 2175 CA GLY B 108 0.970 100.734 -0.785 1.00 0.00 C ATOM 2176 C GLY B 108 1.022 100.365 0.705 1.00 0.00 C ATOM 2177 O GLY B 108 1.661 99.373 1.072 1.00 0.00 O ATOM 0 H GLY B 108 -0.777 101.862 -1.256 1.00 0.00 H new ATOM 0 HA2 GLY B 108 0.506 99.923 -1.347 1.00 0.00 H new ATOM 0 HA3 GLY B 108 1.984 100.848 -1.169 1.00 0.00 H new ATOM 2181 N ARG B 109 0.352 101.112 1.560 1.00 0.00 N ATOM 2182 CA ARG B 109 0.338 100.788 3.023 1.00 0.00 C ATOM 2183 C ARG B 109 -0.865 99.888 3.333 1.00 0.00 C ATOM 2184 O ARG B 109 -0.809 99.054 4.243 1.00 0.00 O ATOM 2185 CB ARG B 109 0.266 102.088 3.858 1.00 0.00 C ATOM 2186 CG ARG B 109 1.519 102.242 4.744 1.00 0.00 C ATOM 2187 CD ARG B 109 1.478 101.233 5.899 1.00 0.00 C ATOM 2188 NE ARG B 109 0.616 101.749 7.016 1.00 0.00 N ATOM 2189 CZ ARG B 109 0.339 101.013 8.084 1.00 0.00 C ATOM 2190 NH1 ARG B 109 -0.409 101.519 9.025 1.00 0.00 N ATOM 2191 NH2 ARG B 109 0.795 99.786 8.222 1.00 0.00 N ATOM 0 H ARG B 109 -0.188 101.937 1.301 1.00 0.00 H new ATOM 0 HA ARG B 109 1.256 100.263 3.285 1.00 0.00 H new ATOM 0 HB2 ARG B 109 0.177 102.948 3.194 1.00 0.00 H new ATOM 0 HB3 ARG B 109 -0.627 102.075 4.483 1.00 0.00 H new ATOM 0 HG2 ARG B 109 2.417 102.086 4.147 1.00 0.00 H new ATOM 0 HG3 ARG B 109 1.571 103.256 5.139 1.00 0.00 H new ATOM 0 HD2 ARG B 109 1.090 100.279 5.543 1.00 0.00 H new ATOM 0 HD3 ARG B 109 2.488 101.049 6.266 1.00 0.00 H new ATOM 0 HE ARG B 109 0.233 102.692 6.951 1.00 0.00 H new ATOM 0 HH11 ARG B 109 -0.772 102.468 8.933 1.00 0.00 H new ATOM 0 HH12 ARG B 109 -0.631 100.966 9.853 1.00 0.00 H new ATOM 0 HH21 ARG B 109 1.380 99.375 7.495 1.00 0.00 H new ATOM 0 HH22 ARG B 109 0.563 99.247 9.056 1.00 0.00 H new ATOM 2205 N VAL B 110 -1.948 100.061 2.605 1.00 0.00 N ATOM 2206 CA VAL B 110 -3.181 99.251 2.841 1.00 0.00 C ATOM 2207 C VAL B 110 -2.865 97.761 2.674 1.00 0.00 C ATOM 2208 O VAL B 110 -3.414 96.924 3.398 1.00 0.00 O ATOM 2209 CB VAL B 110 -4.291 99.703 1.865 1.00 0.00 C ATOM 2210 CG1 VAL B 110 -3.851 99.481 0.410 1.00 0.00 C ATOM 2211 CG2 VAL B 110 -5.583 98.920 2.134 1.00 0.00 C ATOM 0 H VAL B 110 -2.026 100.740 1.848 1.00 0.00 H new ATOM 0 HA VAL B 110 -3.536 99.407 3.860 1.00 0.00 H new ATOM 0 HB VAL B 110 -4.473 100.766 2.023 1.00 0.00 H new ATOM 0 HG11 VAL B 110 -4.645 99.805 -0.264 1.00 0.00 H new ATOM 0 HG12 VAL B 110 -2.948 100.058 0.211 1.00 0.00 H new ATOM 0 HG13 VAL B 110 -3.648 98.422 0.249 1.00 0.00 H new ATOM 0 HG21 VAL B 110 -6.358 99.247 1.440 1.00 0.00 H new ATOM 0 HG22 VAL B 110 -5.398 97.855 1.996 1.00 0.00 H new ATOM 0 HG23 VAL B 110 -5.912 99.101 3.157 1.00 0.00 H new ATOM 2221 N VAL B 111 -2.011 97.417 1.734 1.00 0.00 N ATOM 2222 CA VAL B 111 -1.667 95.973 1.505 1.00 0.00 C ATOM 2223 C VAL B 111 -0.989 95.427 2.762 1.00 0.00 C ATOM 2224 O VAL B 111 -1.276 94.304 3.189 1.00 0.00 O ATOM 2225 CB VAL B 111 -0.727 95.775 0.283 1.00 0.00 C ATOM 2226 CG1 VAL B 111 -0.845 94.328 -0.215 1.00 0.00 C ATOM 2227 CG2 VAL B 111 -1.095 96.720 -0.876 1.00 0.00 C ATOM 0 H VAL B 111 -1.537 98.075 1.115 1.00 0.00 H new ATOM 0 HA VAL B 111 -2.591 95.435 1.293 1.00 0.00 H new ATOM 0 HB VAL B 111 0.290 95.998 0.604 1.00 0.00 H new ATOM 0 HG11 VAL B 111 -0.188 94.184 -1.072 1.00 0.00 H new ATOM 0 HG12 VAL B 111 -0.556 93.644 0.583 1.00 0.00 H new ATOM 0 HG13 VAL B 111 -1.875 94.128 -0.510 1.00 0.00 H new ATOM 0 HG21 VAL B 111 -0.416 96.552 -1.712 1.00 0.00 H new ATOM 0 HG22 VAL B 111 -2.119 96.523 -1.195 1.00 0.00 H new ATOM 0 HG23 VAL B 111 -1.011 97.754 -0.543 1.00 0.00 H new ATOM 2237 N ALA B 112 -0.096 96.195 3.356 1.00 0.00 N ATOM 2238 CA ALA B 112 0.618 95.733 4.592 1.00 0.00 C ATOM 2239 C ALA B 112 -0.386 95.551 5.731 1.00 0.00 C ATOM 2240 O ALA B 112 -0.262 94.613 6.526 1.00 0.00 O ATOM 2241 CB ALA B 112 1.694 96.751 5.002 1.00 0.00 C ATOM 0 H ALA B 112 0.168 97.126 3.033 1.00 0.00 H new ATOM 0 HA ALA B 112 1.102 94.779 4.382 1.00 0.00 H new ATOM 0 HB1 ALA B 112 2.203 96.401 5.900 1.00 0.00 H new ATOM 0 HB2 ALA B 112 2.418 96.860 4.194 1.00 0.00 H new ATOM 0 HB3 ALA B 112 1.226 97.715 5.202 1.00 0.00 H new ATOM 2247 N LEU B 113 -1.368 96.425 5.828 1.00 0.00 N ATOM 2248 CA LEU B 113 -2.391 96.318 6.920 1.00 0.00 C ATOM 2249 C LEU B 113 -3.208 95.052 6.738 1.00 0.00 C ATOM 2250 O LEU B 113 -3.551 94.394 7.722 1.00 0.00 O ATOM 2251 CB LEU B 113 -3.324 97.540 6.908 1.00 0.00 C ATOM 2252 CG LEU B 113 -3.970 97.729 8.297 1.00 0.00 C ATOM 2253 CD1 LEU B 113 -2.972 98.406 9.244 1.00 0.00 C ATOM 2254 CD2 LEU B 113 -5.228 98.602 8.171 1.00 0.00 C ATOM 0 H LEU B 113 -1.503 97.211 5.192 1.00 0.00 H new ATOM 0 HA LEU B 113 -1.872 96.282 7.878 1.00 0.00 H new ATOM 0 HB2 LEU B 113 -2.762 98.433 6.635 1.00 0.00 H new ATOM 0 HB3 LEU B 113 -4.099 97.408 6.153 1.00 0.00 H new ATOM 0 HG LEU B 113 -4.246 96.753 8.698 1.00 0.00 H new ATOM 0 HD11 LEU B 113 -3.432 98.538 10.223 1.00 0.00 H new ATOM 0 HD12 LEU B 113 -2.083 97.783 9.341 1.00 0.00 H new ATOM 0 HD13 LEU B 113 -2.691 99.379 8.841 1.00 0.00 H new ATOM 0 HD21 LEU B 113 -5.680 98.732 9.154 1.00 0.00 H new ATOM 0 HD22 LEU B 113 -4.956 99.576 7.765 1.00 0.00 H new ATOM 0 HD23 LEU B 113 -5.942 98.118 7.505 1.00 0.00 H new ATOM 2266 N PHE B 114 -3.528 94.697 5.516 1.00 0.00 N ATOM 2267 CA PHE B 114 -4.332 93.461 5.280 1.00 0.00 C ATOM 2268 C PHE B 114 -3.463 92.243 5.590 1.00 0.00 C ATOM 2269 O PHE B 114 -3.931 91.282 6.198 1.00 0.00 O ATOM 2270 CB PHE B 114 -4.832 93.406 3.815 1.00 0.00 C ATOM 2271 CG PHE B 114 -6.325 93.062 3.734 1.00 0.00 C ATOM 2272 CD1 PHE B 114 -7.164 93.810 2.895 1.00 0.00 C ATOM 2273 CD2 PHE B 114 -6.864 91.996 4.482 1.00 0.00 C ATOM 2274 CE1 PHE B 114 -8.526 93.499 2.804 1.00 0.00 C ATOM 2275 CE2 PHE B 114 -8.227 91.690 4.389 1.00 0.00 C ATOM 2276 CZ PHE B 114 -9.057 92.440 3.549 1.00 0.00 C ATOM 0 H PHE B 114 -3.266 95.211 4.674 1.00 0.00 H new ATOM 0 HA PHE B 114 -5.206 93.466 5.932 1.00 0.00 H new ATOM 0 HB2 PHE B 114 -4.654 94.368 3.334 1.00 0.00 H new ATOM 0 HB3 PHE B 114 -4.257 92.662 3.263 1.00 0.00 H new ATOM 0 HD1 PHE B 114 -6.758 94.628 2.318 1.00 0.00 H new ATOM 0 HD2 PHE B 114 -6.224 91.414 5.128 1.00 0.00 H new ATOM 0 HE1 PHE B 114 -9.169 94.078 2.157 1.00 0.00 H new ATOM 0 HE2 PHE B 114 -8.638 90.875 4.966 1.00 0.00 H new ATOM 0 HZ PHE B 114 -10.108 92.202 3.475 1.00 0.00 H new ATOM 2286 N TYR B 115 -2.217 92.269 5.174 1.00 0.00 N ATOM 2287 CA TYR B 115 -1.291 91.116 5.422 1.00 0.00 C ATOM 2288 C TYR B 115 -1.095 90.908 6.941 1.00 0.00 C ATOM 2289 O TYR B 115 -1.135 89.764 7.419 1.00 0.00 O ATOM 2290 CB TYR B 115 0.041 91.401 4.664 1.00 0.00 C ATOM 2291 CG TYR B 115 1.280 90.855 5.375 1.00 0.00 C ATOM 2292 CD1 TYR B 115 2.315 91.725 5.744 1.00 0.00 C ATOM 2293 CD2 TYR B 115 1.383 89.487 5.659 1.00 0.00 C ATOM 2294 CE1 TYR B 115 3.448 91.233 6.395 1.00 0.00 C ATOM 2295 CE2 TYR B 115 2.520 88.993 6.312 1.00 0.00 C ATOM 2296 CZ TYR B 115 3.552 89.866 6.679 1.00 0.00 C ATOM 2297 OH TYR B 115 4.673 89.380 7.322 1.00 0.00 O ATOM 0 H TYR B 115 -1.798 93.049 4.668 1.00 0.00 H new ATOM 0 HA TYR B 115 -1.707 90.182 5.044 1.00 0.00 H new ATOM 0 HB2 TYR B 115 -0.018 90.964 3.667 1.00 0.00 H new ATOM 0 HB3 TYR B 115 0.152 92.478 4.534 1.00 0.00 H new ATOM 0 HD1 TYR B 115 2.236 92.779 5.524 1.00 0.00 H new ATOM 0 HD2 TYR B 115 0.587 88.814 5.375 1.00 0.00 H new ATOM 0 HE1 TYR B 115 4.243 91.906 6.679 1.00 0.00 H new ATOM 0 HE2 TYR B 115 2.601 87.939 6.532 1.00 0.00 H new ATOM 0 HH TYR B 115 4.399 88.823 8.081 1.00 0.00 H new ATOM 2307 N PHE B 116 -0.881 91.965 7.695 1.00 0.00 N ATOM 2308 CA PHE B 116 -0.671 91.820 9.169 1.00 0.00 C ATOM 2309 C PHE B 116 -2.031 91.605 9.857 1.00 0.00 C ATOM 2310 O PHE B 116 -2.171 90.699 10.685 1.00 0.00 O ATOM 2311 CB PHE B 116 0.150 93.043 9.690 1.00 0.00 C ATOM 2312 CG PHE B 116 -0.550 93.854 10.773 1.00 0.00 C ATOM 2313 CD1 PHE B 116 -0.965 95.165 10.505 1.00 0.00 C ATOM 2314 CD2 PHE B 116 -0.763 93.299 12.043 1.00 0.00 C ATOM 2315 CE1 PHE B 116 -1.587 95.921 11.500 1.00 0.00 C ATOM 2316 CE2 PHE B 116 -1.390 94.052 13.039 1.00 0.00 C ATOM 2317 CZ PHE B 116 -1.800 95.369 12.765 1.00 0.00 C ATOM 0 H PHE B 116 -0.843 92.923 7.348 1.00 0.00 H new ATOM 0 HA PHE B 116 -0.077 90.939 9.413 1.00 0.00 H new ATOM 0 HB2 PHE B 116 1.103 92.686 10.079 1.00 0.00 H new ATOM 0 HB3 PHE B 116 0.375 93.699 8.849 1.00 0.00 H new ATOM 0 HD1 PHE B 116 -0.803 95.592 9.526 1.00 0.00 H new ATOM 0 HD2 PHE B 116 -0.442 92.289 12.251 1.00 0.00 H new ATOM 0 HE1 PHE B 116 -1.903 96.932 11.292 1.00 0.00 H new ATOM 0 HE2 PHE B 116 -1.559 93.624 14.016 1.00 0.00 H new ATOM 0 HZ PHE B 116 -2.281 95.955 13.535 1.00 0.00 H new ATOM 2327 N ALA B 117 -3.026 92.401 9.520 1.00 0.00 N ATOM 2328 CA ALA B 117 -4.386 92.234 10.137 1.00 0.00 C ATOM 2329 C ALA B 117 -4.881 90.824 9.856 1.00 0.00 C ATOM 2330 O ALA B 117 -5.456 90.170 10.734 1.00 0.00 O ATOM 2331 CB ALA B 117 -5.373 93.240 9.539 1.00 0.00 C ATOM 0 H ALA B 117 -2.953 93.160 8.843 1.00 0.00 H new ATOM 0 HA ALA B 117 -4.315 92.407 11.211 1.00 0.00 H new ATOM 0 HB1 ALA B 117 -6.353 93.105 9.997 1.00 0.00 H new ATOM 0 HB2 ALA B 117 -5.020 94.253 9.730 1.00 0.00 H new ATOM 0 HB3 ALA B 117 -5.450 93.079 8.464 1.00 0.00 H new ATOM 2337 N SER B 118 -4.653 90.347 8.655 1.00 0.00 N ATOM 2338 CA SER B 118 -5.090 88.964 8.284 1.00 0.00 C ATOM 2339 C SER B 118 -4.404 87.964 9.216 1.00 0.00 C ATOM 2340 O SER B 118 -5.004 86.966 9.627 1.00 0.00 O ATOM 2341 CB SER B 118 -4.716 88.653 6.834 1.00 0.00 C ATOM 2342 OG SER B 118 -3.306 88.734 6.684 1.00 0.00 O ATOM 0 H SER B 118 -4.180 90.860 7.911 1.00 0.00 H new ATOM 0 HA SER B 118 -6.173 88.891 8.384 1.00 0.00 H new ATOM 0 HB2 SER B 118 -5.065 87.657 6.562 1.00 0.00 H new ATOM 0 HB3 SER B 118 -5.206 89.357 6.161 1.00 0.00 H new ATOM 0 HG SER B 118 -2.941 89.351 7.352 1.00 0.00 H new ATOM 2348 N LYS B 119 -3.154 88.210 9.536 1.00 0.00 N ATOM 2349 CA LYS B 119 -2.387 87.286 10.427 1.00 0.00 C ATOM 2350 C LYS B 119 -2.978 87.276 11.844 1.00 0.00 C ATOM 2351 O LYS B 119 -3.120 86.206 12.445 1.00 0.00 O ATOM 2352 CB LYS B 119 -0.916 87.730 10.470 1.00 0.00 C ATOM 2353 CG LYS B 119 0.000 86.554 10.860 1.00 0.00 C ATOM 2354 CD LYS B 119 0.076 86.422 12.384 1.00 0.00 C ATOM 2355 CE LYS B 119 1.169 85.416 12.758 1.00 0.00 C ATOM 2356 NZ LYS B 119 1.472 85.520 14.214 1.00 0.00 N ATOM 0 H LYS B 119 -2.629 89.022 9.212 1.00 0.00 H new ATOM 0 HA LYS B 119 -2.453 86.274 10.028 1.00 0.00 H new ATOM 0 HB2 LYS B 119 -0.620 88.119 9.496 1.00 0.00 H new ATOM 0 HB3 LYS B 119 -0.798 88.542 11.187 1.00 0.00 H new ATOM 0 HG2 LYS B 119 -0.380 85.629 10.427 1.00 0.00 H new ATOM 0 HG3 LYS B 119 0.998 86.711 10.452 1.00 0.00 H new ATOM 0 HD2 LYS B 119 0.291 87.392 12.833 1.00 0.00 H new ATOM 0 HD3 LYS B 119 -0.885 86.094 12.779 1.00 0.00 H new ATOM 0 HE2 LYS B 119 0.843 84.404 12.516 1.00 0.00 H new ATOM 0 HE3 LYS B 119 2.069 85.609 12.175 1.00 0.00 H new ATOM 0 HZ1 LYS B 119 1.716 84.580 14.586 1.00 0.00 H new ATOM 0 HZ2 LYS B 119 2.273 86.167 14.356 1.00 0.00 H new ATOM 0 HZ3 LYS B 119 0.638 85.885 14.717 1.00 0.00 H new ATOM 2370 N LEU B 120 -3.302 88.431 12.400 1.00 0.00 N ATOM 2371 CA LEU B 120 -3.852 88.477 13.802 1.00 0.00 C ATOM 2372 C LEU B 120 -5.183 87.739 13.898 1.00 0.00 C ATOM 2373 O LEU B 120 -5.416 87.016 14.874 1.00 0.00 O ATOM 2374 CB LEU B 120 -4.060 89.925 14.268 1.00 0.00 C ATOM 2375 CG LEU B 120 -4.291 89.946 15.798 1.00 0.00 C ATOM 2376 CD1 LEU B 120 -2.938 89.895 16.516 1.00 0.00 C ATOM 2377 CD2 LEU B 120 -5.039 91.224 16.208 1.00 0.00 C ATOM 0 H LEU B 120 -3.209 89.339 11.944 1.00 0.00 H new ATOM 0 HA LEU B 120 -3.119 87.989 14.444 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -3.190 90.529 14.013 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -4.915 90.364 13.754 1.00 0.00 H new ATOM 0 HG LEU B 120 -4.892 89.081 16.077 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -3.097 89.910 17.594 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -2.413 88.980 16.239 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -2.339 90.759 16.226 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -5.194 91.224 17.287 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -4.450 92.097 15.926 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -6.004 91.259 15.703 1.00 0.00 H new ATOM 2389 N VAL B 121 -6.060 87.908 12.934 1.00 0.00 N ATOM 2390 CA VAL B 121 -7.388 87.220 12.997 1.00 0.00 C ATOM 2391 C VAL B 121 -7.186 85.710 12.854 1.00 0.00 C ATOM 2392 O VAL B 121 -7.888 84.930 13.507 1.00 0.00 O ATOM 2393 CB VAL B 121 -8.369 87.776 11.948 1.00 0.00 C ATOM 2394 CG1 VAL B 121 -8.574 89.275 12.192 1.00 0.00 C ATOM 2395 CG2 VAL B 121 -7.822 87.579 10.541 1.00 0.00 C ATOM 0 H VAL B 121 -5.913 88.491 12.110 1.00 0.00 H new ATOM 0 HA VAL B 121 -7.842 87.418 13.968 1.00 0.00 H new ATOM 0 HB VAL B 121 -9.314 87.241 12.040 1.00 0.00 H new ATOM 0 HG11 VAL B 121 -9.268 89.673 11.451 1.00 0.00 H new ATOM 0 HG12 VAL B 121 -8.982 89.429 13.191 1.00 0.00 H new ATOM 0 HG13 VAL B 121 -7.618 89.792 12.107 1.00 0.00 H new ATOM 0 HG21 VAL B 121 -8.531 87.979 9.816 1.00 0.00 H new ATOM 0 HG22 VAL B 121 -6.870 88.101 10.444 1.00 0.00 H new ATOM 0 HG23 VAL B 121 -7.673 86.516 10.354 1.00 0.00 H new ATOM 2405 N LEU B 122 -6.228 85.278 12.052 1.00 0.00 N ATOM 2406 CA LEU B 122 -5.962 83.809 11.910 1.00 0.00 C ATOM 2407 C LEU B 122 -5.485 83.282 13.263 1.00 0.00 C ATOM 2408 O LEU B 122 -5.909 82.210 13.709 1.00 0.00 O ATOM 2409 CB LEU B 122 -4.885 83.541 10.836 1.00 0.00 C ATOM 2410 CG LEU B 122 -5.535 83.194 9.483 1.00 0.00 C ATOM 2411 CD1 LEU B 122 -6.026 84.469 8.795 1.00 0.00 C ATOM 2412 CD2 LEU B 122 -4.510 82.498 8.581 1.00 0.00 C ATOM 0 H LEU B 122 -5.624 85.881 11.494 1.00 0.00 H new ATOM 0 HA LEU B 122 -6.875 83.303 11.598 1.00 0.00 H new ATOM 0 HB2 LEU B 122 -4.250 84.420 10.725 1.00 0.00 H new ATOM 0 HB3 LEU B 122 -4.242 82.721 11.156 1.00 0.00 H new ATOM 0 HG LEU B 122 -6.381 82.530 9.659 1.00 0.00 H new ATOM 0 HD11 LEU B 122 -6.484 84.214 7.839 1.00 0.00 H new ATOM 0 HD12 LEU B 122 -6.761 84.964 9.429 1.00 0.00 H new ATOM 0 HD13 LEU B 122 -5.183 85.139 8.626 1.00 0.00 H new ATOM 0 HD21 LEU B 122 -4.973 82.254 7.625 1.00 0.00 H new ATOM 0 HD22 LEU B 122 -3.662 83.162 8.414 1.00 0.00 H new ATOM 0 HD23 LEU B 122 -4.165 81.582 9.061 1.00 0.00 H new ATOM 2424 N LYS B 123 -4.621 84.025 13.923 1.00 0.00 N ATOM 2425 CA LYS B 123 -4.102 83.607 15.262 1.00 0.00 C ATOM 2426 C LYS B 123 -5.280 83.482 16.217 1.00 0.00 C ATOM 2427 O LYS B 123 -5.395 82.499 16.958 1.00 0.00 O ATOM 2428 CB LYS B 123 -3.119 84.663 15.787 1.00 0.00 C ATOM 2429 CG LYS B 123 -2.150 84.042 16.806 1.00 0.00 C ATOM 2430 CD LYS B 123 -2.862 83.827 18.150 1.00 0.00 C ATOM 2431 CE LYS B 123 -1.828 83.674 19.271 1.00 0.00 C ATOM 2432 NZ LYS B 123 -2.506 83.221 20.521 1.00 0.00 N ATOM 0 H LYS B 123 -4.252 84.913 13.583 1.00 0.00 H new ATOM 0 HA LYS B 123 -3.583 82.652 15.182 1.00 0.00 H new ATOM 0 HB2 LYS B 123 -2.557 85.089 14.956 1.00 0.00 H new ATOM 0 HB3 LYS B 123 -3.670 85.481 16.252 1.00 0.00 H new ATOM 0 HG2 LYS B 123 -1.774 83.091 16.429 1.00 0.00 H new ATOM 0 HG3 LYS B 123 -1.287 84.694 16.943 1.00 0.00 H new ATOM 0 HD2 LYS B 123 -3.519 84.671 18.362 1.00 0.00 H new ATOM 0 HD3 LYS B 123 -3.491 82.938 18.100 1.00 0.00 H new ATOM 0 HE2 LYS B 123 -1.064 82.954 18.979 1.00 0.00 H new ATOM 0 HE3 LYS B 123 -1.321 84.624 19.444 1.00 0.00 H new ATOM 0 HZ1 LYS B 123 -1.802 83.118 21.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 123 -3.219 83.923 20.803 1.00 0.00 H new ATOM 0 HZ3 LYS B 123 -2.970 82.305 20.352 1.00 0.00 H new ATOM 2446 N ALA B 124 -6.155 84.459 16.205 1.00 0.00 N ATOM 2447 CA ALA B 124 -7.351 84.436 17.101 1.00 0.00 C ATOM 2448 C ALA B 124 -8.238 83.238 16.750 1.00 0.00 C ATOM 2449 O ALA B 124 -8.913 82.684 17.625 1.00 0.00 O ATOM 2450 CB ALA B 124 -8.138 85.737 16.944 1.00 0.00 C ATOM 0 H ALA B 124 -6.089 85.281 15.604 1.00 0.00 H new ATOM 0 HA ALA B 124 -7.024 84.342 18.137 1.00 0.00 H new ATOM 0 HB1 ALA B 124 -9.009 85.717 17.599 1.00 0.00 H new ATOM 0 HB2 ALA B 124 -7.503 86.581 17.212 1.00 0.00 H new ATOM 0 HB3 ALA B 124 -8.464 85.842 15.909 1.00 0.00 H new ATOM 2456 N LEU B 125 -8.245 82.827 15.498 1.00 0.00 N ATOM 2457 CA LEU B 125 -9.080 81.656 15.074 1.00 0.00 C ATOM 2458 C LEU B 125 -8.402 80.352 15.528 1.00 0.00 C ATOM 2459 O LEU B 125 -9.073 79.329 15.710 1.00 0.00 O ATOM 2460 CB LEU B 125 -9.249 81.681 13.537 1.00 0.00 C ATOM 2461 CG LEU B 125 -9.936 80.374 13.021 1.00 0.00 C ATOM 2462 CD1 LEU B 125 -11.116 80.707 12.104 1.00 0.00 C ATOM 2463 CD2 LEU B 125 -8.927 79.513 12.242 1.00 0.00 C ATOM 0 H LEU B 125 -7.703 83.258 14.749 1.00 0.00 H new ATOM 0 HA LEU B 125 -10.066 81.712 15.536 1.00 0.00 H new ATOM 0 HB2 LEU B 125 -9.845 82.547 13.248 1.00 0.00 H new ATOM 0 HB3 LEU B 125 -8.274 81.794 13.063 1.00 0.00 H new ATOM 0 HG LEU B 125 -10.299 79.822 13.888 1.00 0.00 H new ATOM 0 HD11 LEU B 125 -11.579 79.783 11.757 1.00 0.00 H new ATOM 0 HD12 LEU B 125 -11.850 81.296 12.654 1.00 0.00 H new ATOM 0 HD13 LEU B 125 -10.761 81.279 11.247 1.00 0.00 H new ATOM 0 HD21 LEU B 125 -9.419 78.607 11.889 1.00 0.00 H new ATOM 0 HD22 LEU B 125 -8.549 80.077 11.389 1.00 0.00 H new ATOM 0 HD23 LEU B 125 -8.097 79.244 12.895 1.00 0.00 H new ATOM 2475 N SER B 126 -7.106 80.373 15.719 1.00 0.00 N ATOM 2476 CA SER B 126 -6.370 79.149 16.162 1.00 0.00 C ATOM 2477 C SER B 126 -6.439 79.009 17.690 1.00 0.00 C ATOM 2478 O SER B 126 -5.558 78.394 18.303 1.00 0.00 O ATOM 2479 CB SER B 126 -4.910 79.230 15.706 1.00 0.00 C ATOM 2480 OG SER B 126 -4.869 79.436 14.301 1.00 0.00 O ATOM 0 H SER B 126 -6.520 81.197 15.585 1.00 0.00 H new ATOM 0 HA SER B 126 -6.837 78.273 15.712 1.00 0.00 H new ATOM 0 HB2 SER B 126 -4.401 80.045 16.220 1.00 0.00 H new ATOM 0 HB3 SER B 126 -4.384 78.311 15.966 1.00 0.00 H new ATOM 0 HG SER B 126 -5.160 80.349 14.096 1.00 0.00 H new ATOM 2486 N THR B 127 -7.465 79.558 18.316 1.00 0.00 N ATOM 2487 CA THR B 127 -7.602 79.458 19.801 1.00 0.00 C ATOM 2488 C THR B 127 -9.088 79.540 20.169 1.00 0.00 C ATOM 2489 O THR B 127 -9.548 80.517 20.778 1.00 0.00 O ATOM 2490 CB THR B 127 -6.803 80.582 20.477 1.00 0.00 C ATOM 2491 OG1 THR B 127 -5.517 80.667 19.880 1.00 0.00 O ATOM 2492 CG2 THR B 127 -6.654 80.284 21.970 1.00 0.00 C ATOM 0 H THR B 127 -8.214 80.072 17.852 1.00 0.00 H new ATOM 0 HA THR B 127 -7.203 78.506 20.151 1.00 0.00 H new ATOM 0 HB THR B 127 -7.330 81.528 20.351 1.00 0.00 H new ATOM 0 HG1 THR B 127 -5.005 81.384 20.308 1.00 0.00 H new ATOM 0 HG21 THR B 127 -6.087 81.084 22.446 1.00 0.00 H new ATOM 0 HG22 THR B 127 -7.641 80.217 22.428 1.00 0.00 H new ATOM 0 HG23 THR B 127 -6.128 79.338 22.102 1.00 0.00 H new ATOM 2500 N LYS B 128 -9.844 78.529 19.802 1.00 0.00 N ATOM 2501 CA LYS B 128 -11.307 78.507 20.106 1.00 0.00 C ATOM 2502 C LYS B 128 -11.564 77.535 21.255 1.00 0.00 C ATOM 2503 O LYS B 128 -12.326 77.840 22.178 1.00 0.00 O ATOM 2504 CB LYS B 128 -12.088 78.066 18.862 1.00 0.00 C ATOM 2505 CG LYS B 128 -13.576 78.433 19.001 1.00 0.00 C ATOM 2506 CD LYS B 128 -14.300 77.413 19.908 1.00 0.00 C ATOM 2507 CE LYS B 128 -15.773 77.288 19.498 1.00 0.00 C ATOM 2508 NZ LYS B 128 -16.512 76.494 20.523 1.00 0.00 N ATOM 0 H LYS B 128 -9.502 77.710 19.299 1.00 0.00 H new ATOM 0 HA LYS B 128 -11.638 79.505 20.394 1.00 0.00 H new ATOM 0 HB2 LYS B 128 -11.671 78.544 17.975 1.00 0.00 H new ATOM 0 HB3 LYS B 128 -11.984 76.990 18.723 1.00 0.00 H new ATOM 0 HG2 LYS B 128 -13.672 79.435 19.420 1.00 0.00 H new ATOM 0 HG3 LYS B 128 -14.046 78.452 18.018 1.00 0.00 H new ATOM 0 HD2 LYS B 128 -13.812 76.441 19.836 1.00 0.00 H new ATOM 0 HD3 LYS B 128 -14.231 77.728 20.949 1.00 0.00 H new ATOM 0 HE2 LYS B 128 -16.219 78.278 19.399 1.00 0.00 H new ATOM 0 HE3 LYS B 128 -15.850 76.805 18.524 1.00 0.00 H new ATOM 0 HZ1 LYS B 128 -17.510 76.410 20.244 1.00 0.00 H new ATOM 0 HZ2 LYS B 128 -16.092 75.545 20.596 1.00 0.00 H new ATOM 0 HZ3 LYS B 128 -16.449 76.972 21.444 1.00 0.00 H new TER 2522 LYS B 128