USER MOD reduce.3.24.130724 H: found=0, std=0, add=1188, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1177 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: C 122 CYS SG : rot 139:sc= 1.92 USER MOD Set 1.2: C 125 CYS SG : rot -161:sc= 0.503 USER MOD Set 1.3: C 144 CYS SG : rot -138:sc= -0.371! USER MOD Set 1.4: C 146 GLN :FLIP amide:sc= -0.0541 F(o=0.9,f=2) USER MOD Set 2.1: C 94 CYS SG : rot 89:sc= 2.01 USER MOD Set 2.2: C 97 CYS SG : rot -56:sc= 0.2 USER MOD Set 2.3: C 116 HIS : no HE2:sc= -0.119 K(o=-1.8,f=-3.2) USER MOD Set 2.4: C 119 CYS SG : rot -162:sc= -3.89! USER MOD Set 3.1: B 11 CYS SG : rot -173:sc= 0.629 USER MOD Set 3.2: B 14 CYS SG : rot -164:sc= -0.459 USER MOD Set 3.3: B 27 HIS : no HE2:sc= -2.34! C(o=-5.1!,f=-8!) USER MOD Set 3.4: B 32 CYS SG : rot -39:sc= -2.9! USER MOD Set 4.1: A 232 HIS : no HD1:sc= -0.919 K(o=-0.77,f=-3.7!) USER MOD Set 4.2: A 238 ASN : amide:sc= 0.152 K(o=-0.77,f=-1.3!) USER MOD Set 5.1: A 231 TYR OH : rot 165:sc= 0.00413 USER MOD Set 5.2: A 235 ASN : amide:sc= 1.12 K(o=0.94,f=-1.2) USER MOD Set 5.3: A 237 GLN : amide:sc= -0.183 K(o=0.94,f=-4.6!) USER MOD Set 6.1: A 204 CYS SG : rot 140:sc= 2.09 USER MOD Set 6.2: A 207 CYS SG : rot -39:sc= 0.287! USER MOD Set 6.3: A 225 CYS SG : rot 172:sc= 1.8! USER MOD Set 6.4: A 228 CYS SG : rot 78:sc= -1.3! USER MOD Single : A 206 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 210 THR OG1 : rot -161:sc= 0.729 USER MOD Single : A 212 THR OG1 : rot 171:sc= 0.924 USER MOD Single : A 220 THR OG1 : rot -88:sc= 0.949 USER MOD Single : A 222 HIS : no HD1:sc= 0.252 K(o=0.28,f=-6.5!) USER MOD Single : A 223 TYR OH : rot -140:sc= 0.551 USER MOD Single : A 226 ASN : amide:sc= 1.03 K(o=1,f=-4.9!) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 MET CE :methyl 161:sc= -0.0536 (180deg=-0.426) USER MOD Single : B 1 GLY N :NH3+ -138:sc= 0.0874 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 106:sc= 1.25 USER MOD Single : B 22 SER OG : rot 180:sc= 0.0345 USER MOD Single : B 23 THR OG1 : rot 157:sc= -2.72! USER MOD Single : B 28 GLN :FLIP amide:sc= 0 F(o=-0.89,f=0) USER MOD Single : B 30 TYR OH : rot -144:sc= 1.3 USER MOD Single : B 31 TYR OH : rot -179:sc= -0.0707 USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 34 HIS : no HD1:sc= -0.113 X(o=-0.11,f=-0.035) USER MOD Single : C 96 SER OG : rot 180:sc= -0.0467 USER MOD Single : C 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 104 TYR OH : rot 180:sc= 0 USER MOD Single : C 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 107 THR OG1 : rot 140:sc= 0.813 USER MOD Single : C 108 MET CE :methyl 160:sc= -0.155 (180deg=-0.706) USER MOD Single : C 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 115 TYR OH : rot 180:sc= 0 USER MOD Single : C 121 LYS NZ :NH3+ -166:sc= 0.784 (180deg=0.324) USER MOD Single : C 126 GLN : amide:sc= 0.828 K(o=0.83,f=-0.0068) USER MOD Single : C 127 LYS NZ :NH3+ -151:sc= 1.62 (180deg=1) USER MOD Single : C 128 HIS : no HD1:sc= 0.85 K(o=0.85,f=-4.3!) USER MOD Single : C 130 SER OG : rot 115:sc= 1.3 USER MOD Single : C 135 TYR OH : rot 180:sc= 0 USER MOD Single : C 139 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : C 140 SER OG : rot 83:sc= 0.107 USER MOD Single : C 149 TYR OH : rot 180:sc= 0 USER MOD Single : C 152 THR OG1 : rot -91:sc= 1.25 USER MOD Single : C 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 155 ASN : amide:sc= 0.15 X(o=0.15,f=0) USER MOD Single : C 158 SER OG : rot 180:sc= 0 USER MOD Single : C 161 SER OG : rot 180:sc= 0 USER MOD Single : C 164 SER OG : rot 180:sc= 0 USER MOD Single : C 169 MET CE :methyl -139:sc= 0 (180deg=-0.733) USER MOD Single : C 175 THR OG1 : rot 84:sc= 1.35 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 200 -4.332 6.025 8.216 1.00 0.91 N ATOM 2 CA GLU A 200 -4.058 4.628 7.816 1.00 0.71 C ATOM 3 C GLU A 200 -3.771 4.551 6.326 1.00 0.62 C ATOM 4 O GLU A 200 -3.867 5.555 5.623 1.00 0.70 O ATOM 5 CB GLU A 200 -5.238 3.724 8.178 1.00 0.79 C ATOM 6 CG GLU A 200 -5.431 3.566 9.678 1.00 0.88 C ATOM 7 CD GLU A 200 -4.127 3.696 10.442 1.00 1.29 C ATOM 8 OE1 GLU A 200 -3.413 2.684 10.594 1.00 1.63 O ATOM 9 OE2 GLU A 200 -3.804 4.824 10.869 1.00 1.61 O ATOM 0 HA GLU A 200 -3.179 4.281 8.358 1.00 0.71 H new ATOM 0 HB2 GLU A 200 -6.149 4.134 7.742 1.00 0.79 H new ATOM 0 HB3 GLU A 200 -5.085 2.741 7.732 1.00 0.79 H new ATOM 0 HG2 GLU A 200 -6.134 4.319 10.033 1.00 0.88 H new ATOM 0 HG3 GLU A 200 -5.875 2.592 9.885 1.00 0.88 H new ATOM 18 N ALA A 201 -3.424 3.358 5.852 1.00 0.56 N ATOM 19 CA ALA A 201 -3.098 3.158 4.445 1.00 0.57 C ATOM 20 C ALA A 201 -4.344 2.910 3.592 1.00 0.57 C ATOM 21 O ALA A 201 -4.908 3.843 3.022 1.00 0.89 O ATOM 22 CB ALA A 201 -2.111 2.007 4.294 1.00 0.62 C ATOM 0 H ALA A 201 -3.362 2.515 6.423 1.00 0.56 H new ATOM 0 HA ALA A 201 -2.638 4.077 4.082 1.00 0.57 H new ATOM 0 HB1 ALA A 201 -1.875 1.866 3.239 1.00 0.62 H new ATOM 0 HB2 ALA A 201 -1.198 2.236 4.843 1.00 0.62 H new ATOM 0 HB3 ALA A 201 -2.554 1.094 4.691 1.00 0.62 H new ATOM 28 N ARG A 202 -4.781 1.658 3.519 1.00 0.40 N ATOM 29 CA ARG A 202 -5.941 1.309 2.712 1.00 0.35 C ATOM 30 C ARG A 202 -6.995 0.591 3.546 1.00 0.33 C ATOM 31 O ARG A 202 -6.861 0.468 4.764 1.00 0.33 O ATOM 32 CB ARG A 202 -5.511 0.427 1.536 1.00 0.37 C ATOM 33 CG ARG A 202 -6.202 0.764 0.224 1.00 0.36 C ATOM 34 CD ARG A 202 -5.470 1.854 -0.541 1.00 0.28 C ATOM 35 NE ARG A 202 -5.561 3.161 0.115 1.00 0.46 N ATOM 36 CZ ARG A 202 -4.934 4.255 -0.319 1.00 0.44 C ATOM 37 NH1 ARG A 202 -4.158 4.200 -1.394 1.00 0.42 N ATOM 38 NH2 ARG A 202 -5.072 5.405 0.329 1.00 0.72 N ATOM 0 H ARG A 202 -4.351 0.872 4.007 1.00 0.40 H new ATOM 0 HA ARG A 202 -6.382 2.230 2.331 1.00 0.35 H new ATOM 0 HB2 ARG A 202 -4.433 0.519 1.401 1.00 0.37 H new ATOM 0 HB3 ARG A 202 -5.713 -0.615 1.784 1.00 0.37 H new ATOM 0 HG2 ARG A 202 -6.265 -0.132 -0.393 1.00 0.36 H new ATOM 0 HG3 ARG A 202 -7.224 1.086 0.425 1.00 0.36 H new ATOM 0 HD2 ARG A 202 -4.421 1.577 -0.647 1.00 0.28 H new ATOM 0 HD3 ARG A 202 -5.883 1.927 -1.547 1.00 0.28 H new ATOM 0 HE ARG A 202 -6.138 3.239 0.953 1.00 0.46 H new ATOM 0 HH11 ARG A 202 -4.039 3.318 -1.892 1.00 0.42 H new ATOM 0 HH12 ARG A 202 -3.681 5.040 -1.722 1.00 0.42 H new ATOM 0 HH21 ARG A 202 -5.659 5.454 1.162 1.00 0.72 H new ATOM 0 HH22 ARG A 202 -4.591 6.240 -0.006 1.00 0.72 H new ATOM 52 N GLU A 203 -8.044 0.136 2.879 1.00 0.37 N ATOM 53 CA GLU A 203 -9.135 -0.570 3.527 1.00 0.39 C ATOM 54 C GLU A 203 -9.246 -1.986 2.968 1.00 0.37 C ATOM 55 O GLU A 203 -8.607 -2.315 1.967 1.00 0.36 O ATOM 56 CB GLU A 203 -10.462 0.178 3.310 1.00 0.48 C ATOM 57 CG GLU A 203 -10.300 1.659 2.970 1.00 0.49 C ATOM 58 CD GLU A 203 -10.239 1.928 1.475 1.00 0.51 C ATOM 59 OE1 GLU A 203 -9.151 1.771 0.878 1.00 0.55 O ATOM 60 OE2 GLU A 203 -11.274 2.309 0.891 1.00 0.53 O ATOM 0 H GLU A 203 -8.162 0.247 1.872 1.00 0.37 H new ATOM 0 HA GLU A 203 -8.929 -0.620 4.596 1.00 0.39 H new ATOM 0 HB2 GLU A 203 -11.013 -0.309 2.506 1.00 0.48 H new ATOM 0 HB3 GLU A 203 -11.068 0.088 4.212 1.00 0.48 H new ATOM 0 HG2 GLU A 203 -11.132 2.217 3.399 1.00 0.49 H new ATOM 0 HG3 GLU A 203 -9.390 2.035 3.438 1.00 0.49 H new ATOM 67 N CYS A 204 -10.045 -2.816 3.629 1.00 0.39 N ATOM 68 CA CYS A 204 -10.264 -4.188 3.195 1.00 0.39 C ATOM 69 C CYS A 204 -11.664 -4.309 2.609 1.00 0.42 C ATOM 70 O CYS A 204 -12.521 -3.455 2.848 1.00 0.54 O ATOM 71 CB CYS A 204 -10.090 -5.167 4.371 1.00 0.41 C ATOM 72 SG CYS A 204 -10.501 -6.910 3.998 1.00 0.46 S ATOM 0 H CYS A 204 -10.555 -2.558 4.474 1.00 0.39 H new ATOM 0 HA CYS A 204 -9.527 -4.444 2.434 1.00 0.39 H new ATOM 0 HB2 CYS A 204 -9.056 -5.119 4.713 1.00 0.41 H new ATOM 0 HB3 CYS A 204 -10.716 -4.832 5.198 1.00 0.41 H new ATOM 0 HG CYS A 204 -9.641 -7.693 4.579 1.00 0.46 H new ATOM 77 N VAL A 205 -11.896 -5.366 1.852 1.00 0.38 N ATOM 78 CA VAL A 205 -13.193 -5.588 1.240 1.00 0.40 C ATOM 79 C VAL A 205 -14.156 -6.212 2.240 1.00 0.48 C ATOM 80 O VAL A 205 -15.375 -6.152 2.066 1.00 0.52 O ATOM 81 CB VAL A 205 -13.089 -6.506 0.003 1.00 0.38 C ATOM 82 CG1 VAL A 205 -12.155 -5.907 -1.038 1.00 0.36 C ATOM 83 CG2 VAL A 205 -12.627 -7.900 0.404 1.00 0.47 C ATOM 0 H VAL A 205 -11.202 -6.085 1.646 1.00 0.38 H new ATOM 0 HA VAL A 205 -13.568 -4.615 0.923 1.00 0.40 H new ATOM 0 HB VAL A 205 -14.081 -6.591 -0.441 1.00 0.38 H new ATOM 0 HG11 VAL A 205 -12.097 -6.571 -1.900 1.00 0.36 H new ATOM 0 HG12 VAL A 205 -12.536 -4.936 -1.353 1.00 0.36 H new ATOM 0 HG13 VAL A 205 -11.161 -5.784 -0.608 1.00 0.36 H new ATOM 0 HG21 VAL A 205 -12.561 -8.530 -0.483 1.00 0.47 H new ATOM 0 HG22 VAL A 205 -11.648 -7.836 0.878 1.00 0.47 H new ATOM 0 HG23 VAL A 205 -13.342 -8.333 1.104 1.00 0.47 H new ATOM 93 N ASN A 206 -13.607 -6.799 3.297 1.00 0.51 N ATOM 94 CA ASN A 206 -14.433 -7.457 4.299 1.00 0.60 C ATOM 95 C ASN A 206 -14.224 -6.880 5.695 1.00 0.63 C ATOM 96 O ASN A 206 -15.111 -6.994 6.543 1.00 0.72 O ATOM 97 CB ASN A 206 -14.159 -8.959 4.311 1.00 0.65 C ATOM 98 CG ASN A 206 -15.432 -9.783 4.294 1.00 0.79 C ATOM 99 OD1 ASN A 206 -16.076 -9.977 5.324 1.00 0.88 O ATOM 100 ND2 ASN A 206 -15.800 -10.285 3.125 1.00 1.26 N ATOM 0 H ASN A 206 -12.604 -6.832 3.481 1.00 0.51 H new ATOM 0 HA ASN A 206 -15.472 -7.277 4.023 1.00 0.60 H new ATOM 0 HB2 ASN A 206 -13.549 -9.221 3.446 1.00 0.65 H new ATOM 0 HB3 ASN A 206 -13.578 -9.212 5.198 1.00 0.65 H new ATOM 0 HD21 ASN A 206 -16.644 -10.854 3.057 1.00 1.26 H new ATOM 0 HD22 ASN A 206 -15.240 -10.102 2.292 1.00 1.26 H new ATOM 107 N CYS A 207 -13.073 -6.259 5.949 1.00 0.57 N ATOM 108 CA CYS A 207 -12.829 -5.685 7.264 1.00 0.61 C ATOM 109 C CYS A 207 -12.160 -4.305 7.177 1.00 0.58 C ATOM 110 O CYS A 207 -12.836 -3.285 7.040 1.00 0.62 O ATOM 111 CB CYS A 207 -12.029 -6.668 8.156 1.00 0.63 C ATOM 112 SG CYS A 207 -10.264 -6.920 7.733 1.00 0.55 S ATOM 0 H CYS A 207 -12.314 -6.144 5.278 1.00 0.57 H new ATOM 0 HA CYS A 207 -13.797 -5.524 7.739 1.00 0.61 H new ATOM 0 HB2 CYS A 207 -12.084 -6.314 9.185 1.00 0.63 H new ATOM 0 HB3 CYS A 207 -12.527 -7.637 8.125 1.00 0.63 H new ATOM 0 HG CYS A 207 -10.127 -6.949 6.441 1.00 0.55 H new ATOM 117 N GLY A 208 -10.844 -4.285 7.254 1.00 0.54 N ATOM 118 CA GLY A 208 -10.098 -3.049 7.194 1.00 0.52 C ATOM 119 C GLY A 208 -9.022 -3.013 8.257 1.00 0.49 C ATOM 120 O GLY A 208 -8.843 -2.005 8.937 1.00 0.52 O ATOM 0 H GLY A 208 -10.267 -5.120 7.359 1.00 0.54 H new ATOM 0 HA2 GLY A 208 -9.645 -2.941 6.209 1.00 0.52 H new ATOM 0 HA3 GLY A 208 -10.775 -2.205 7.328 1.00 0.52 H new ATOM 124 N ALA A 209 -8.319 -4.129 8.412 1.00 0.47 N ATOM 125 CA ALA A 209 -7.266 -4.236 9.408 1.00 0.46 C ATOM 126 C ALA A 209 -5.954 -3.667 8.886 1.00 0.42 C ATOM 127 O ALA A 209 -5.251 -4.307 8.105 1.00 0.41 O ATOM 128 CB ALA A 209 -7.084 -5.686 9.836 1.00 0.49 C ATOM 0 H ALA A 209 -8.462 -4.973 7.858 1.00 0.47 H new ATOM 0 HA ALA A 209 -7.565 -3.649 10.277 1.00 0.46 H new ATOM 0 HB1 ALA A 209 -6.292 -5.748 10.582 1.00 0.49 H new ATOM 0 HB2 ALA A 209 -8.015 -6.059 10.263 1.00 0.49 H new ATOM 0 HB3 ALA A 209 -6.815 -6.290 8.970 1.00 0.49 H new ATOM 134 N THR A 210 -5.624 -2.469 9.344 1.00 0.45 N ATOM 135 CA THR A 210 -4.396 -1.788 8.941 1.00 0.48 C ATOM 136 C THR A 210 -3.165 -2.491 9.527 1.00 0.47 C ATOM 137 O THR A 210 -2.026 -2.202 9.150 1.00 0.47 O ATOM 138 CB THR A 210 -4.430 -0.308 9.399 1.00 0.61 C ATOM 139 OG1 THR A 210 -3.376 0.449 8.784 1.00 0.67 O ATOM 140 CG2 THR A 210 -4.311 -0.212 10.913 1.00 0.70 C ATOM 0 H THR A 210 -6.195 -1.940 10.003 1.00 0.45 H new ATOM 0 HA THR A 210 -4.328 -1.823 7.854 1.00 0.48 H new ATOM 0 HB THR A 210 -5.387 0.111 9.088 1.00 0.61 H new ATOM 0 HG1 THR A 210 -3.227 1.274 9.291 1.00 0.67 H new ATOM 0 HG21 THR A 210 -4.337 0.835 11.214 1.00 0.70 H new ATOM 0 HG22 THR A 210 -5.141 -0.744 11.378 1.00 0.70 H new ATOM 0 HG23 THR A 210 -3.370 -0.658 11.233 1.00 0.70 H new ATOM 148 N ALA A 211 -3.418 -3.438 10.429 1.00 0.49 N ATOM 149 CA ALA A 211 -2.360 -4.187 11.096 1.00 0.52 C ATOM 150 C ALA A 211 -1.624 -5.124 10.141 1.00 0.44 C ATOM 151 O ALA A 211 -0.511 -5.563 10.439 1.00 0.44 O ATOM 152 CB ALA A 211 -2.939 -4.978 12.259 1.00 0.64 C ATOM 0 H ALA A 211 -4.360 -3.705 10.716 1.00 0.49 H new ATOM 0 HA ALA A 211 -1.633 -3.465 11.467 1.00 0.52 H new ATOM 0 HB1 ALA A 211 -2.143 -5.535 12.752 1.00 0.64 H new ATOM 0 HB2 ALA A 211 -3.398 -4.293 12.972 1.00 0.64 H new ATOM 0 HB3 ALA A 211 -3.692 -5.673 11.887 1.00 0.64 H new ATOM 158 N THR A 212 -2.239 -5.437 9.003 1.00 0.42 N ATOM 159 CA THR A 212 -1.615 -6.321 8.025 1.00 0.41 C ATOM 160 C THR A 212 -0.288 -5.728 7.543 1.00 0.37 C ATOM 161 O THR A 212 -0.193 -4.525 7.289 1.00 0.34 O ATOM 162 CB THR A 212 -2.548 -6.594 6.818 1.00 0.40 C ATOM 163 OG1 THR A 212 -1.924 -7.510 5.909 1.00 0.46 O ATOM 164 CG2 THR A 212 -2.899 -5.309 6.082 1.00 0.30 C ATOM 0 H THR A 212 -3.162 -5.094 8.738 1.00 0.42 H new ATOM 0 HA THR A 212 -1.425 -7.274 8.518 1.00 0.41 H new ATOM 0 HB THR A 212 -3.469 -7.030 7.205 1.00 0.40 H new ATOM 0 HG1 THR A 212 -2.574 -7.794 5.233 1.00 0.46 H new ATOM 0 HG21 THR A 212 -3.554 -5.538 5.242 1.00 0.30 H new ATOM 0 HG22 THR A 212 -3.408 -4.627 6.763 1.00 0.30 H new ATOM 0 HG23 THR A 212 -1.987 -4.840 5.713 1.00 0.30 H new ATOM 172 N PRO A 213 0.767 -6.556 7.448 1.00 0.45 N ATOM 173 CA PRO A 213 2.088 -6.103 7.005 1.00 0.49 C ATOM 174 C PRO A 213 2.058 -5.545 5.585 1.00 0.49 C ATOM 175 O PRO A 213 2.695 -4.533 5.286 1.00 0.56 O ATOM 176 CB PRO A 213 2.953 -7.368 7.074 1.00 0.59 C ATOM 177 CG PRO A 213 1.988 -8.502 7.080 1.00 0.62 C ATOM 178 CD PRO A 213 0.755 -7.992 7.772 1.00 0.55 C ATOM 0 HA PRO A 213 2.467 -5.289 7.623 1.00 0.49 H new ATOM 0 HB2 PRO A 213 3.628 -7.430 6.221 1.00 0.59 H new ATOM 0 HB3 PRO A 213 3.572 -7.373 7.971 1.00 0.59 H new ATOM 0 HG2 PRO A 213 1.760 -8.826 6.065 1.00 0.62 H new ATOM 0 HG3 PRO A 213 2.402 -9.364 7.604 1.00 0.62 H new ATOM 0 HD2 PRO A 213 -0.147 -8.482 7.404 1.00 0.55 H new ATOM 0 HD3 PRO A 213 0.795 -8.164 8.848 1.00 0.55 H new ATOM 186 N LEU A 214 1.295 -6.195 4.718 1.00 0.43 N ATOM 187 CA LEU A 214 1.180 -5.773 3.335 1.00 0.44 C ATOM 188 C LEU A 214 -0.216 -6.072 2.817 1.00 0.39 C ATOM 189 O LEU A 214 -0.726 -7.176 2.995 1.00 0.46 O ATOM 190 CB LEU A 214 2.227 -6.478 2.466 1.00 0.53 C ATOM 191 CG LEU A 214 2.168 -6.144 0.973 1.00 0.63 C ATOM 192 CD1 LEU A 214 2.559 -4.695 0.729 1.00 0.74 C ATOM 193 CD2 LEU A 214 3.069 -7.081 0.184 1.00 0.74 C ATOM 0 H LEU A 214 0.745 -7.021 4.953 1.00 0.43 H new ATOM 0 HA LEU A 214 1.358 -4.699 3.284 1.00 0.44 H new ATOM 0 HB2 LEU A 214 3.218 -6.222 2.840 1.00 0.53 H new ATOM 0 HB3 LEU A 214 2.109 -7.555 2.586 1.00 0.53 H new ATOM 0 HG LEU A 214 1.142 -6.281 0.631 1.00 0.63 H new ATOM 0 HD11 LEU A 214 2.510 -4.480 -0.338 1.00 0.74 H new ATOM 0 HD12 LEU A 214 1.873 -4.038 1.263 1.00 0.74 H new ATOM 0 HD13 LEU A 214 3.575 -4.527 1.087 1.00 0.74 H new ATOM 0 HD21 LEU A 214 3.016 -6.830 -0.875 1.00 0.74 H new ATOM 0 HD22 LEU A 214 4.097 -6.975 0.531 1.00 0.74 H new ATOM 0 HD23 LEU A 214 2.741 -8.110 0.330 1.00 0.74 H new ATOM 205 N TRP A 215 -0.827 -5.087 2.182 1.00 0.31 N ATOM 206 CA TRP A 215 -2.164 -5.251 1.640 1.00 0.27 C ATOM 207 C TRP A 215 -2.134 -6.140 0.407 1.00 0.32 C ATOM 208 O TRP A 215 -1.314 -5.944 -0.492 1.00 0.40 O ATOM 209 CB TRP A 215 -2.770 -3.891 1.288 1.00 0.25 C ATOM 210 CG TRP A 215 -3.087 -3.054 2.490 1.00 0.28 C ATOM 211 CD1 TRP A 215 -2.320 -2.062 3.024 1.00 0.36 C ATOM 212 CD2 TRP A 215 -4.258 -3.143 3.308 1.00 0.31 C ATOM 213 NE1 TRP A 215 -2.942 -1.525 4.126 1.00 0.41 N ATOM 214 CE2 TRP A 215 -4.134 -2.175 4.320 1.00 0.38 C ATOM 215 CE3 TRP A 215 -5.400 -3.947 3.281 1.00 0.37 C ATOM 216 CZ2 TRP A 215 -5.107 -1.990 5.297 1.00 0.45 C ATOM 217 CZ3 TRP A 215 -6.366 -3.762 4.252 1.00 0.46 C ATOM 218 CH2 TRP A 215 -6.213 -2.791 5.248 1.00 0.48 C ATOM 0 H TRP A 215 -0.418 -4.165 2.029 1.00 0.31 H new ATOM 0 HA TRP A 215 -2.784 -5.726 2.400 1.00 0.27 H new ATOM 0 HB2 TRP A 215 -2.076 -3.347 0.648 1.00 0.25 H new ATOM 0 HB3 TRP A 215 -3.682 -4.046 0.711 1.00 0.25 H new ATOM 0 HD1 TRP A 215 -1.363 -1.744 2.638 1.00 0.36 H new ATOM 0 HE1 TRP A 215 -2.577 -0.768 4.704 1.00 0.41 H new ATOM 0 HE3 TRP A 215 -5.526 -4.699 2.516 1.00 0.37 H new ATOM 0 HZ2 TRP A 215 -4.992 -1.241 6.066 1.00 0.45 H new ATOM 0 HZ3 TRP A 215 -7.254 -4.377 4.242 1.00 0.46 H new ATOM 0 HH2 TRP A 215 -6.985 -2.672 5.994 1.00 0.48 H new ATOM 229 N ARG A 216 -3.019 -7.120 0.379 1.00 0.33 N ATOM 230 CA ARG A 216 -3.110 -8.040 -0.741 1.00 0.39 C ATOM 231 C ARG A 216 -3.946 -7.407 -1.842 1.00 0.37 C ATOM 232 O ARG A 216 -5.172 -7.408 -1.780 1.00 0.46 O ATOM 233 CB ARG A 216 -3.732 -9.374 -0.306 1.00 0.46 C ATOM 234 CG ARG A 216 -2.743 -10.369 0.290 1.00 0.55 C ATOM 235 CD ARG A 216 -2.089 -9.834 1.553 1.00 0.57 C ATOM 236 NE ARG A 216 -1.277 -10.845 2.229 1.00 0.55 N ATOM 237 CZ ARG A 216 0.045 -10.961 2.092 1.00 0.73 C ATOM 238 NH1 ARG A 216 0.710 -10.175 1.255 1.00 1.02 N ATOM 239 NH2 ARG A 216 0.702 -11.884 2.781 1.00 0.80 N ATOM 0 H ARG A 216 -3.690 -7.300 1.126 1.00 0.33 H new ATOM 0 HA ARG A 216 -2.106 -8.243 -1.113 1.00 0.39 H new ATOM 0 HB2 ARG A 216 -4.513 -9.174 0.428 1.00 0.46 H new ATOM 0 HB3 ARG A 216 -4.215 -9.833 -1.168 1.00 0.46 H new ATOM 0 HG2 ARG A 216 -3.259 -11.302 0.516 1.00 0.55 H new ATOM 0 HG3 ARG A 216 -1.974 -10.601 -0.446 1.00 0.55 H new ATOM 0 HD2 ARG A 216 -1.463 -8.978 1.301 1.00 0.57 H new ATOM 0 HD3 ARG A 216 -2.860 -9.475 2.235 1.00 0.57 H new ATOM 0 HE ARG A 216 -1.752 -11.504 2.845 1.00 0.55 H new ATOM 0 HH11 ARG A 216 0.210 -9.473 0.708 1.00 1.02 H new ATOM 0 HH12 ARG A 216 1.721 -10.272 1.158 1.00 1.02 H new ATOM 0 HH21 ARG A 216 0.197 -12.504 3.414 1.00 0.80 H new ATOM 0 HH22 ARG A 216 1.713 -11.974 2.678 1.00 0.80 H new ATOM 253 N ARG A 217 -3.276 -6.844 -2.828 1.00 0.38 N ATOM 254 CA ARG A 217 -3.954 -6.189 -3.931 1.00 0.39 C ATOM 255 C ARG A 217 -3.759 -6.963 -5.224 1.00 0.44 C ATOM 256 O ARG A 217 -2.648 -7.385 -5.548 1.00 0.50 O ATOM 257 CB ARG A 217 -3.425 -4.766 -4.087 1.00 0.43 C ATOM 258 CG ARG A 217 -4.174 -3.933 -5.113 1.00 0.45 C ATOM 259 CD ARG A 217 -3.214 -3.253 -6.072 1.00 0.43 C ATOM 260 NE ARG A 217 -3.717 -1.966 -6.549 1.00 0.52 N ATOM 261 CZ ARG A 217 -4.171 -1.752 -7.786 1.00 1.07 C ATOM 262 NH1 ARG A 217 -4.293 -2.765 -8.643 1.00 1.43 N ATOM 263 NH2 ARG A 217 -4.530 -0.529 -8.157 1.00 1.46 N ATOM 0 H ARG A 217 -2.258 -6.827 -2.888 1.00 0.38 H new ATOM 0 HA ARG A 217 -5.021 -6.157 -3.712 1.00 0.39 H new ATOM 0 HB2 ARG A 217 -3.475 -4.264 -3.121 1.00 0.43 H new ATOM 0 HB3 ARG A 217 -2.373 -4.810 -4.369 1.00 0.43 H new ATOM 0 HG2 ARG A 217 -4.860 -4.569 -5.671 1.00 0.45 H new ATOM 0 HG3 ARG A 217 -4.778 -3.182 -4.605 1.00 0.45 H new ATOM 0 HD2 ARG A 217 -2.255 -3.103 -5.576 1.00 0.43 H new ATOM 0 HD3 ARG A 217 -3.033 -3.907 -6.925 1.00 0.43 H new ATOM 0 HE ARG A 217 -3.721 -1.183 -5.896 1.00 0.52 H new ATOM 0 HH11 ARG A 217 -4.039 -3.710 -8.355 1.00 1.43 H new ATOM 0 HH12 ARG A 217 -4.640 -2.595 -9.587 1.00 1.43 H new ATOM 0 HH21 ARG A 217 -4.459 0.246 -7.497 1.00 1.46 H new ATOM 0 HH22 ARG A 217 -4.877 -0.364 -9.102 1.00 1.46 H new ATOM 277 N ASP A 218 -4.847 -7.154 -5.951 1.00 0.44 N ATOM 278 CA ASP A 218 -4.801 -7.865 -7.216 1.00 0.50 C ATOM 279 C ASP A 218 -4.566 -6.879 -8.360 1.00 0.54 C ATOM 280 O ASP A 218 -4.248 -5.706 -8.127 1.00 0.57 O ATOM 281 CB ASP A 218 -6.100 -8.649 -7.444 1.00 0.51 C ATOM 282 CG ASP A 218 -7.203 -7.789 -8.022 1.00 0.51 C ATOM 283 OD1 ASP A 218 -7.624 -6.827 -7.355 1.00 0.48 O ATOM 284 OD2 ASP A 218 -7.637 -8.059 -9.159 1.00 0.59 O ATOM 0 H ASP A 218 -5.775 -6.825 -5.685 1.00 0.44 H new ATOM 0 HA ASP A 218 -3.975 -8.576 -7.187 1.00 0.50 H new ATOM 0 HB2 ASP A 218 -5.903 -9.483 -8.118 1.00 0.51 H new ATOM 0 HB3 ASP A 218 -6.434 -9.075 -6.498 1.00 0.51 H new ATOM 289 N ARG A 219 -4.730 -7.347 -9.589 1.00 0.60 N ATOM 290 CA ARG A 219 -4.525 -6.509 -10.760 1.00 0.65 C ATOM 291 C ARG A 219 -5.634 -5.467 -10.913 1.00 0.63 C ATOM 292 O ARG A 219 -5.372 -4.347 -11.349 1.00 0.68 O ATOM 293 CB ARG A 219 -4.442 -7.367 -12.024 1.00 0.72 C ATOM 294 CG ARG A 219 -3.638 -6.721 -13.144 1.00 0.86 C ATOM 295 CD ARG A 219 -3.958 -7.343 -14.492 1.00 0.94 C ATOM 296 NE ARG A 219 -5.294 -6.971 -14.962 1.00 0.91 N ATOM 297 CZ ARG A 219 -6.042 -7.731 -15.761 1.00 1.12 C ATOM 298 NH1 ARG A 219 -5.594 -8.910 -16.176 1.00 1.57 N ATOM 299 NH2 ARG A 219 -7.241 -7.309 -16.145 1.00 1.34 N ATOM 0 H ARG A 219 -5.005 -8.306 -9.801 1.00 0.60 H new ATOM 0 HA ARG A 219 -3.582 -5.980 -10.619 1.00 0.65 H new ATOM 0 HB2 ARG A 219 -3.993 -8.328 -11.773 1.00 0.72 H new ATOM 0 HB3 ARG A 219 -5.451 -7.571 -12.382 1.00 0.72 H new ATOM 0 HG2 ARG A 219 -3.851 -5.652 -13.176 1.00 0.86 H new ATOM 0 HG3 ARG A 219 -2.573 -6.828 -12.937 1.00 0.86 H new ATOM 0 HD2 ARG A 219 -3.215 -7.026 -15.224 1.00 0.94 H new ATOM 0 HD3 ARG A 219 -3.889 -8.428 -14.417 1.00 0.94 H new ATOM 0 HE ARG A 219 -5.676 -6.075 -14.659 1.00 0.91 H new ATOM 0 HH11 ARG A 219 -4.673 -9.238 -15.883 1.00 1.57 H new ATOM 0 HH12 ARG A 219 -6.170 -9.488 -16.788 1.00 1.57 H new ATOM 0 HH21 ARG A 219 -7.589 -6.404 -15.828 1.00 1.34 H new ATOM 0 HH22 ARG A 219 -7.814 -7.890 -16.757 1.00 1.34 H new ATOM 313 N THR A 220 -6.863 -5.821 -10.549 1.00 0.59 N ATOM 314 CA THR A 220 -7.982 -4.894 -10.680 1.00 0.62 C ATOM 315 C THR A 220 -7.906 -3.793 -9.624 1.00 0.58 C ATOM 316 O THR A 220 -7.945 -2.603 -9.954 1.00 0.70 O ATOM 317 CB THR A 220 -9.349 -5.619 -10.602 1.00 0.65 C ATOM 318 OG1 THR A 220 -9.535 -6.231 -9.320 1.00 0.82 O ATOM 319 CG2 THR A 220 -9.457 -6.684 -11.686 1.00 0.90 C ATOM 0 H THR A 220 -7.108 -6.734 -10.165 1.00 0.59 H new ATOM 0 HA THR A 220 -7.904 -4.440 -11.668 1.00 0.62 H new ATOM 0 HB THR A 220 -10.125 -4.869 -10.753 1.00 0.65 H new ATOM 0 HG1 THR A 220 -9.152 -7.133 -9.330 1.00 0.82 H new ATOM 0 HG21 THR A 220 -10.425 -7.181 -11.613 1.00 0.90 H new ATOM 0 HG22 THR A 220 -9.362 -6.217 -12.666 1.00 0.90 H new ATOM 0 HG23 THR A 220 -8.662 -7.418 -11.556 1.00 0.90 H new ATOM 327 N GLY A 221 -7.760 -4.183 -8.364 1.00 0.47 N ATOM 328 CA GLY A 221 -7.672 -3.204 -7.299 1.00 0.44 C ATOM 329 C GLY A 221 -8.380 -3.631 -6.027 1.00 0.41 C ATOM 330 O GLY A 221 -8.710 -2.795 -5.187 1.00 0.43 O ATOM 0 H GLY A 221 -7.701 -5.155 -8.062 1.00 0.47 H new ATOM 0 HA2 GLY A 221 -6.622 -3.015 -7.075 1.00 0.44 H new ATOM 0 HA3 GLY A 221 -8.099 -2.263 -7.645 1.00 0.44 H new ATOM 334 N HIS A 222 -8.612 -4.927 -5.871 1.00 0.41 N ATOM 335 CA HIS A 222 -9.277 -5.438 -4.680 1.00 0.41 C ATOM 336 C HIS A 222 -8.291 -5.523 -3.527 1.00 0.37 C ATOM 337 O HIS A 222 -7.515 -6.471 -3.435 1.00 0.42 O ATOM 338 CB HIS A 222 -9.899 -6.816 -4.942 1.00 0.48 C ATOM 339 CG HIS A 222 -11.293 -6.748 -5.477 1.00 0.60 C ATOM 340 ND1 HIS A 222 -12.306 -7.596 -5.073 1.00 0.75 N ATOM 341 CD2 HIS A 222 -11.848 -5.914 -6.388 1.00 0.72 C ATOM 342 CE1 HIS A 222 -13.414 -7.283 -5.712 1.00 0.90 C ATOM 343 NE2 HIS A 222 -13.165 -6.267 -6.514 1.00 0.90 N ATOM 0 H HIS A 222 -8.351 -5.641 -6.551 1.00 0.41 H new ATOM 0 HA HIS A 222 -10.078 -4.747 -4.417 1.00 0.41 H new ATOM 0 HB2 HIS A 222 -9.273 -7.360 -5.649 1.00 0.48 H new ATOM 0 HB3 HIS A 222 -9.902 -7.387 -4.014 1.00 0.48 H new ATOM 0 HD2 HIS A 222 -11.345 -5.118 -6.917 1.00 0.72 H new ATOM 0 HE1 HIS A 222 -14.368 -7.777 -5.598 1.00 0.90 H new ATOM 0 HE2 HIS A 222 -13.843 -5.817 -7.129 1.00 0.90 H new ATOM 352 N TYR A 223 -8.311 -4.513 -2.671 1.00 0.33 N ATOM 353 CA TYR A 223 -7.421 -4.471 -1.522 1.00 0.29 C ATOM 354 C TYR A 223 -7.950 -5.350 -0.402 1.00 0.31 C ATOM 355 O TYR A 223 -9.030 -5.116 0.135 1.00 0.33 O ATOM 356 CB TYR A 223 -7.245 -3.033 -1.034 1.00 0.28 C ATOM 357 CG TYR A 223 -6.274 -2.237 -1.868 1.00 0.32 C ATOM 358 CD1 TYR A 223 -4.912 -2.285 -1.608 1.00 0.45 C ATOM 359 CD2 TYR A 223 -6.715 -1.446 -2.922 1.00 0.40 C ATOM 360 CE1 TYR A 223 -4.014 -1.569 -2.372 1.00 0.58 C ATOM 361 CE2 TYR A 223 -5.825 -0.724 -3.690 1.00 0.54 C ATOM 362 CZ TYR A 223 -4.476 -0.790 -3.411 1.00 0.60 C ATOM 363 OH TYR A 223 -3.583 -0.081 -4.180 1.00 0.78 O ATOM 0 H TYR A 223 -8.935 -3.710 -2.751 1.00 0.33 H new ATOM 0 HA TYR A 223 -6.448 -4.854 -1.829 1.00 0.29 H new ATOM 0 HB2 TYR A 223 -8.214 -2.533 -1.040 1.00 0.28 H new ATOM 0 HB3 TYR A 223 -6.900 -3.047 -0.000 1.00 0.28 H new ATOM 0 HD1 TYR A 223 -4.549 -2.894 -0.793 1.00 0.45 H new ATOM 0 HD2 TYR A 223 -7.771 -1.396 -3.143 1.00 0.40 H new ATOM 0 HE1 TYR A 223 -2.957 -1.618 -2.158 1.00 0.58 H new ATOM 0 HE2 TYR A 223 -6.182 -0.111 -4.504 1.00 0.54 H new ATOM 0 HH TYR A 223 -3.955 0.802 -4.383 1.00 0.78 H new ATOM 373 N LEU A 224 -7.197 -6.382 -0.088 1.00 0.33 N ATOM 374 CA LEU A 224 -7.562 -7.306 0.966 1.00 0.37 C ATOM 375 C LEU A 224 -6.504 -7.272 2.060 1.00 0.36 C ATOM 376 O LEU A 224 -5.321 -7.106 1.770 1.00 0.34 O ATOM 377 CB LEU A 224 -7.687 -8.724 0.403 1.00 0.42 C ATOM 378 CG LEU A 224 -8.166 -8.814 -1.051 1.00 0.48 C ATOM 379 CD1 LEU A 224 -7.449 -9.938 -1.782 1.00 0.52 C ATOM 380 CD2 LEU A 224 -9.668 -9.027 -1.105 1.00 0.61 C ATOM 0 H LEU A 224 -6.317 -6.604 -0.554 1.00 0.33 H new ATOM 0 HA LEU A 224 -8.524 -7.010 1.385 1.00 0.37 H new ATOM 0 HB2 LEU A 224 -6.716 -9.214 0.479 1.00 0.42 H new ATOM 0 HB3 LEU A 224 -8.378 -9.287 1.031 1.00 0.42 H new ATOM 0 HG LEU A 224 -7.930 -7.872 -1.546 1.00 0.48 H new ATOM 0 HD11 LEU A 224 -7.802 -9.986 -2.812 1.00 0.52 H new ATOM 0 HD12 LEU A 224 -6.375 -9.750 -1.775 1.00 0.52 H new ATOM 0 HD13 LEU A 224 -7.654 -10.885 -1.284 1.00 0.52 H new ATOM 0 HD21 LEU A 224 -9.990 -9.088 -2.145 1.00 0.61 H new ATOM 0 HD22 LEU A 224 -9.923 -9.954 -0.591 1.00 0.61 H new ATOM 0 HD23 LEU A 224 -10.172 -8.192 -0.618 1.00 0.61 H new ATOM 392 N CYS A 225 -6.929 -7.410 3.307 1.00 0.38 N ATOM 393 CA CYS A 225 -6.006 -7.399 4.434 1.00 0.38 C ATOM 394 C CYS A 225 -5.006 -8.549 4.315 1.00 0.41 C ATOM 395 O CYS A 225 -3.835 -8.353 3.982 1.00 0.39 O ATOM 396 CB CYS A 225 -6.801 -7.528 5.734 1.00 0.43 C ATOM 397 SG CYS A 225 -7.953 -8.944 5.738 1.00 0.51 S ATOM 0 H CYS A 225 -7.908 -7.531 3.565 1.00 0.38 H new ATOM 0 HA CYS A 225 -5.451 -6.461 4.436 1.00 0.38 H new ATOM 0 HB2 CYS A 225 -6.107 -7.631 6.568 1.00 0.43 H new ATOM 0 HB3 CYS A 225 -7.364 -6.610 5.900 1.00 0.43 H new ATOM 0 HG CYS A 225 -8.460 -9.087 6.926 1.00 0.51 H new ATOM 402 N ASN A 226 -5.502 -9.741 4.598 1.00 0.47 N ATOM 403 CA ASN A 226 -4.732 -10.973 4.537 1.00 0.51 C ATOM 404 C ASN A 226 -5.651 -12.136 4.878 1.00 0.59 C ATOM 405 O ASN A 226 -5.625 -13.182 4.230 1.00 0.64 O ATOM 406 CB ASN A 226 -3.545 -10.939 5.510 1.00 0.51 C ATOM 407 CG ASN A 226 -2.561 -12.075 5.273 1.00 0.54 C ATOM 408 OD1 ASN A 226 -2.352 -12.511 4.140 1.00 0.63 O ATOM 409 ND2 ASN A 226 -1.938 -12.553 6.340 1.00 0.68 N ATOM 0 H ASN A 226 -6.471 -9.883 4.883 1.00 0.47 H new ATOM 0 HA ASN A 226 -4.329 -11.090 3.531 1.00 0.51 H new ATOM 0 HB2 ASN A 226 -3.025 -9.986 5.410 1.00 0.51 H new ATOM 0 HB3 ASN A 226 -3.917 -10.993 6.533 1.00 0.51 H new ATOM 0 HD21 ASN A 226 -1.259 -13.308 6.239 1.00 0.68 H new ATOM 0 HD22 ASN A 226 -2.137 -12.166 7.263 1.00 0.68 H new ATOM 416 N ALA A 227 -6.499 -11.924 5.881 1.00 0.61 N ATOM 417 CA ALA A 227 -7.441 -12.944 6.323 1.00 0.68 C ATOM 418 C ALA A 227 -8.594 -13.076 5.341 1.00 0.68 C ATOM 419 O ALA A 227 -8.905 -14.174 4.877 1.00 0.73 O ATOM 420 CB ALA A 227 -7.960 -12.615 7.714 1.00 0.70 C ATOM 0 H ALA A 227 -6.552 -11.050 6.404 1.00 0.61 H new ATOM 0 HA ALA A 227 -6.919 -13.900 6.363 1.00 0.68 H new ATOM 0 HB1 ALA A 227 -8.663 -13.385 8.032 1.00 0.70 H new ATOM 0 HB2 ALA A 227 -7.125 -12.575 8.414 1.00 0.70 H new ATOM 0 HB3 ALA A 227 -8.465 -11.649 7.695 1.00 0.70 H new ATOM 426 N CYS A 228 -9.228 -11.955 5.015 1.00 0.64 N ATOM 427 CA CYS A 228 -10.333 -11.971 4.074 1.00 0.65 C ATOM 428 C CYS A 228 -9.812 -12.131 2.646 1.00 0.64 C ATOM 429 O CYS A 228 -10.566 -12.450 1.729 1.00 0.69 O ATOM 430 CB CYS A 228 -11.157 -10.688 4.182 1.00 0.62 C ATOM 431 SG CYS A 228 -11.316 -10.017 5.872 1.00 0.62 S ATOM 0 H CYS A 228 -8.996 -11.034 5.386 1.00 0.64 H new ATOM 0 HA CYS A 228 -10.973 -12.819 4.319 1.00 0.65 H new ATOM 0 HB2 CYS A 228 -10.704 -9.928 3.546 1.00 0.62 H new ATOM 0 HB3 CYS A 228 -12.155 -10.880 3.788 1.00 0.62 H new ATOM 0 HG CYS A 228 -10.223 -9.392 6.195 1.00 0.62 H new ATOM 436 N GLY A 229 -8.513 -11.914 2.474 1.00 0.61 N ATOM 437 CA GLY A 229 -7.895 -12.031 1.167 1.00 0.63 C ATOM 438 C GLY A 229 -7.920 -13.447 0.633 1.00 0.69 C ATOM 439 O GLY A 229 -7.893 -13.662 -0.581 1.00 0.70 O ATOM 0 H GLY A 229 -7.872 -11.657 3.224 1.00 0.61 H new ATOM 0 HA2 GLY A 229 -8.410 -11.374 0.466 1.00 0.63 H new ATOM 0 HA3 GLY A 229 -6.862 -11.688 1.226 1.00 0.63 H new ATOM 443 N LEU A 230 -7.995 -14.416 1.537 1.00 0.74 N ATOM 444 CA LEU A 230 -8.023 -15.819 1.147 1.00 0.82 C ATOM 445 C LEU A 230 -9.362 -16.181 0.509 1.00 0.83 C ATOM 446 O LEU A 230 -9.500 -17.233 -0.108 1.00 0.90 O ATOM 447 CB LEU A 230 -7.758 -16.717 2.359 1.00 0.90 C ATOM 448 CG LEU A 230 -6.403 -16.506 3.039 1.00 0.95 C ATOM 449 CD1 LEU A 230 -6.219 -17.492 4.180 1.00 1.09 C ATOM 450 CD2 LEU A 230 -5.265 -16.637 2.033 1.00 0.98 C ATOM 0 H LEU A 230 -8.037 -14.256 2.543 1.00 0.74 H new ATOM 0 HA LEU A 230 -7.236 -15.980 0.410 1.00 0.82 H new ATOM 0 HB2 LEU A 230 -8.546 -16.551 3.094 1.00 0.90 H new ATOM 0 HB3 LEU A 230 -7.831 -17.758 2.043 1.00 0.90 H new ATOM 0 HG LEU A 230 -6.383 -15.496 3.448 1.00 0.95 H new ATOM 0 HD11 LEU A 230 -5.250 -17.327 4.651 1.00 1.09 H new ATOM 0 HD12 LEU A 230 -7.010 -17.348 4.916 1.00 1.09 H new ATOM 0 HD13 LEU A 230 -6.265 -18.510 3.792 1.00 1.09 H new ATOM 0 HD21 LEU A 230 -4.312 -16.483 2.539 1.00 0.98 H new ATOM 0 HD22 LEU A 230 -5.284 -17.633 1.590 1.00 0.98 H new ATOM 0 HD23 LEU A 230 -5.384 -15.889 1.249 1.00 0.98 H new ATOM 462 N TYR A 231 -10.340 -15.294 0.645 1.00 0.79 N ATOM 463 CA TYR A 231 -11.671 -15.512 0.084 1.00 0.82 C ATOM 464 C TYR A 231 -11.608 -15.538 -1.442 1.00 0.80 C ATOM 465 O TYR A 231 -12.365 -16.258 -2.097 1.00 0.85 O ATOM 466 CB TYR A 231 -12.613 -14.399 0.555 1.00 0.79 C ATOM 467 CG TYR A 231 -14.080 -14.765 0.541 1.00 0.90 C ATOM 468 CD1 TYR A 231 -14.590 -15.710 1.422 1.00 1.04 C ATOM 469 CD2 TYR A 231 -14.956 -14.147 -0.338 1.00 0.96 C ATOM 470 CE1 TYR A 231 -15.938 -16.026 1.427 1.00 1.19 C ATOM 471 CE2 TYR A 231 -16.301 -14.459 -0.343 1.00 1.11 C ATOM 472 CZ TYR A 231 -16.787 -15.398 0.542 1.00 1.20 C ATOM 473 OH TYR A 231 -18.132 -15.704 0.545 1.00 1.38 O ATOM 0 H TYR A 231 -10.236 -14.410 1.143 1.00 0.79 H new ATOM 0 HA TYR A 231 -12.049 -16.474 0.429 1.00 0.82 H new ATOM 0 HB2 TYR A 231 -12.334 -14.110 1.568 1.00 0.79 H new ATOM 0 HB3 TYR A 231 -12.465 -13.524 -0.078 1.00 0.79 H new ATOM 0 HD1 TYR A 231 -13.925 -16.206 2.114 1.00 1.04 H new ATOM 0 HD2 TYR A 231 -14.580 -13.409 -1.031 1.00 0.96 H new ATOM 0 HE1 TYR A 231 -16.322 -16.760 2.120 1.00 1.19 H new ATOM 0 HE2 TYR A 231 -16.969 -13.970 -1.037 1.00 1.11 H new ATOM 0 HH TYR A 231 -18.624 -15.020 0.045 1.00 1.38 H new ATOM 483 N HIS A 232 -10.666 -14.784 -1.998 1.00 0.74 N ATOM 484 CA HIS A 232 -10.501 -14.697 -3.447 1.00 0.73 C ATOM 485 C HIS A 232 -9.679 -15.863 -3.992 1.00 0.75 C ATOM 486 O HIS A 232 -9.485 -15.977 -5.203 1.00 0.77 O ATOM 487 CB HIS A 232 -9.816 -13.380 -3.820 1.00 0.73 C ATOM 488 CG HIS A 232 -10.398 -12.710 -5.030 1.00 0.73 C ATOM 489 ND1 HIS A 232 -10.393 -13.273 -6.289 1.00 0.95 N ATOM 490 CD2 HIS A 232 -11.016 -11.515 -5.160 1.00 0.74 C ATOM 491 CE1 HIS A 232 -10.980 -12.448 -7.138 1.00 0.95 C ATOM 492 NE2 HIS A 232 -11.370 -11.371 -6.481 1.00 0.78 N ATOM 0 H HIS A 232 -10.002 -14.222 -1.466 1.00 0.74 H new ATOM 0 HA HIS A 232 -11.495 -14.740 -3.893 1.00 0.73 H new ATOM 0 HB2 HIS A 232 -9.880 -12.697 -2.973 1.00 0.73 H new ATOM 0 HB3 HIS A 232 -8.757 -13.570 -3.997 1.00 0.73 H new ATOM 0 HD2 HIS A 232 -11.199 -10.802 -4.369 1.00 0.74 H new ATOM 0 HE1 HIS A 232 -11.118 -12.625 -8.194 1.00 0.95 H new ATOM 0 HE2 HIS A 232 -11.852 -10.568 -6.885 1.00 0.78 H new ATOM 501 N LYS A 233 -9.198 -16.727 -3.105 1.00 0.80 N ATOM 502 CA LYS A 233 -8.384 -17.868 -3.522 1.00 0.84 C ATOM 503 C LYS A 233 -8.983 -19.188 -3.056 1.00 0.87 C ATOM 504 O LYS A 233 -9.225 -20.084 -3.862 1.00 0.94 O ATOM 505 CB LYS A 233 -6.955 -17.722 -2.987 1.00 0.85 C ATOM 506 CG LYS A 233 -5.949 -17.317 -4.051 1.00 0.83 C ATOM 507 CD LYS A 233 -5.675 -18.458 -5.016 1.00 0.94 C ATOM 508 CE LYS A 233 -5.018 -17.962 -6.295 1.00 1.08 C ATOM 509 NZ LYS A 233 -4.715 -19.072 -7.238 1.00 1.28 N ATOM 0 H LYS A 233 -9.355 -16.662 -2.099 1.00 0.80 H new ATOM 0 HA LYS A 233 -8.363 -17.878 -4.612 1.00 0.84 H new ATOM 0 HB2 LYS A 233 -6.948 -16.979 -2.190 1.00 0.85 H new ATOM 0 HB3 LYS A 233 -6.643 -18.668 -2.544 1.00 0.85 H new ATOM 0 HG2 LYS A 233 -6.326 -16.455 -4.602 1.00 0.83 H new ATOM 0 HG3 LYS A 233 -5.018 -17.009 -3.575 1.00 0.83 H new ATOM 0 HD2 LYS A 233 -5.030 -19.194 -4.536 1.00 0.94 H new ATOM 0 HD3 LYS A 233 -6.610 -18.963 -5.258 1.00 0.94 H new ATOM 0 HE2 LYS A 233 -5.675 -17.242 -6.783 1.00 1.08 H new ATOM 0 HE3 LYS A 233 -4.096 -17.436 -6.047 1.00 1.08 H new ATOM 0 HZ1 LYS A 233 -4.268 -18.687 -8.095 1.00 1.28 H new ATOM 0 HZ2 LYS A 233 -4.067 -19.747 -6.783 1.00 1.28 H new ATOM 0 HZ3 LYS A 233 -5.597 -19.559 -7.496 1.00 1.28 H new ATOM 523 N MET A 234 -9.228 -19.299 -1.758 1.00 0.86 N ATOM 524 CA MET A 234 -9.790 -20.518 -1.186 1.00 0.91 C ATOM 525 C MET A 234 -11.198 -20.752 -1.714 1.00 0.99 C ATOM 526 O MET A 234 -11.511 -21.824 -2.233 1.00 1.09 O ATOM 527 CB MET A 234 -9.812 -20.428 0.342 1.00 0.88 C ATOM 528 CG MET A 234 -9.732 -21.780 1.031 1.00 0.92 C ATOM 529 SD MET A 234 -8.092 -22.522 0.910 1.00 1.07 S ATOM 530 CE MET A 234 -7.156 -21.454 2.007 1.00 1.14 C ATOM 0 H MET A 234 -9.047 -18.560 -1.079 1.00 0.86 H new ATOM 0 HA MET A 234 -9.161 -21.358 -1.480 1.00 0.91 H new ATOM 0 HB2 MET A 234 -8.977 -19.810 0.674 1.00 0.88 H new ATOM 0 HB3 MET A 234 -10.726 -19.923 0.655 1.00 0.88 H new ATOM 0 HG2 MET A 234 -9.998 -21.665 2.082 1.00 0.92 H new ATOM 0 HG3 MET A 234 -10.466 -22.454 0.588 1.00 0.92 H new ATOM 0 HE1 MET A 234 -6.236 -21.956 2.307 1.00 1.14 H new ATOM 0 HE2 MET A 234 -6.911 -20.526 1.490 1.00 1.14 H new ATOM 0 HE3 MET A 234 -7.752 -21.230 2.892 1.00 1.14 H new ATOM 540 N ASN A 235 -12.039 -19.736 -1.587 1.00 0.96 N ATOM 541 CA ASN A 235 -13.417 -19.817 -2.056 1.00 1.04 C ATOM 542 C ASN A 235 -13.481 -19.573 -3.554 1.00 1.06 C ATOM 543 O ASN A 235 -14.332 -20.121 -4.250 1.00 1.20 O ATOM 544 CB ASN A 235 -14.298 -18.798 -1.333 1.00 1.02 C ATOM 545 CG ASN A 235 -14.821 -19.310 -0.006 1.00 1.15 C ATOM 546 OD1 ASN A 235 -14.062 -19.818 0.821 1.00 1.23 O ATOM 547 ND2 ASN A 235 -16.120 -19.180 0.200 1.00 1.25 N ATOM 0 H ASN A 235 -11.791 -18.843 -1.162 1.00 0.96 H new ATOM 0 HA ASN A 235 -13.788 -20.819 -1.839 1.00 1.04 H new ATOM 0 HB2 ASN A 235 -13.727 -17.885 -1.165 1.00 1.02 H new ATOM 0 HB3 ASN A 235 -15.140 -18.534 -1.973 1.00 1.02 H new ATOM 0 HD21 ASN A 235 -16.533 -19.507 1.073 1.00 1.25 H new ATOM 0 HD22 ASN A 235 -16.709 -18.753 -0.514 1.00 1.25 H new ATOM 554 N GLY A 236 -12.575 -18.737 -4.042 1.00 0.94 N ATOM 555 CA GLY A 236 -12.530 -18.425 -5.458 1.00 0.98 C ATOM 556 C GLY A 236 -13.564 -17.393 -5.850 1.00 0.98 C ATOM 557 O GLY A 236 -13.937 -17.292 -7.020 1.00 1.09 O ATOM 0 H GLY A 236 -11.866 -18.266 -3.479 1.00 0.94 H new ATOM 0 HA2 GLY A 236 -11.537 -18.057 -5.716 1.00 0.98 H new ATOM 0 HA3 GLY A 236 -12.692 -19.336 -6.034 1.00 0.98 H new ATOM 561 N GLN A 237 -14.029 -16.629 -4.871 1.00 0.90 N ATOM 562 CA GLN A 237 -15.029 -15.599 -5.116 1.00 0.90 C ATOM 563 C GLN A 237 -14.360 -14.241 -5.312 1.00 0.84 C ATOM 564 O GLN A 237 -13.132 -14.143 -5.316 1.00 0.79 O ATOM 565 CB GLN A 237 -16.035 -15.551 -3.962 1.00 0.92 C ATOM 566 CG GLN A 237 -17.083 -16.654 -4.033 1.00 1.05 C ATOM 567 CD GLN A 237 -17.702 -16.958 -2.684 1.00 1.11 C ATOM 568 OE1 GLN A 237 -17.237 -17.836 -1.961 1.00 1.21 O ATOM 569 NE2 GLN A 237 -18.755 -16.238 -2.335 1.00 1.17 N ATOM 0 H GLN A 237 -13.729 -16.703 -3.899 1.00 0.90 H new ATOM 0 HA GLN A 237 -15.569 -15.845 -6.030 1.00 0.90 H new ATOM 0 HB2 GLN A 237 -15.498 -15.629 -3.017 1.00 0.92 H new ATOM 0 HB3 GLN A 237 -16.535 -14.583 -3.965 1.00 0.92 H new ATOM 0 HG2 GLN A 237 -17.867 -16.360 -4.731 1.00 1.05 H new ATOM 0 HG3 GLN A 237 -16.625 -17.560 -4.431 1.00 1.05 H new ATOM 0 HE21 GLN A 237 -19.111 -15.518 -2.963 1.00 1.17 H new ATOM 0 HE22 GLN A 237 -19.211 -16.403 -1.438 1.00 1.17 H new ATOM 578 N ASN A 238 -15.165 -13.204 -5.481 1.00 0.87 N ATOM 579 CA ASN A 238 -14.650 -11.859 -5.699 1.00 0.84 C ATOM 580 C ASN A 238 -14.401 -11.146 -4.377 1.00 0.84 C ATOM 581 O ASN A 238 -15.077 -11.492 -3.390 1.00 0.96 O ATOM 582 CB ASN A 238 -15.629 -11.052 -6.551 1.00 0.95 C ATOM 583 CG ASN A 238 -14.971 -9.876 -7.245 1.00 0.91 C ATOM 584 OD1 ASN A 238 -13.779 -9.911 -7.570 1.00 0.93 O ATOM 585 ND2 ASN A 238 -15.741 -8.825 -7.480 1.00 0.96 N ATOM 586 OXT ASN A 238 -13.537 -10.238 -4.341 1.00 0.80 O ATOM 0 H ASN A 238 -16.183 -13.268 -5.471 1.00 0.87 H new ATOM 0 HA ASN A 238 -13.699 -11.943 -6.226 1.00 0.84 H new ATOM 0 HB2 ASN A 238 -16.077 -11.706 -7.299 1.00 0.95 H new ATOM 0 HB3 ASN A 238 -16.439 -10.688 -5.919 1.00 0.95 H new ATOM 0 HD21 ASN A 238 -15.355 -8.004 -7.946 1.00 0.96 H new ATOM 0 HD22 ASN A 238 -16.720 -8.837 -7.196 1.00 0.96 H new ATOM 594 N GLY B 1 -31.286 14.068 -14.600 1.00 1.44 N ATOM 595 CA GLY B 1 -32.032 14.011 -13.323 1.00 1.42 C ATOM 596 C GLY B 1 -31.680 12.774 -12.528 1.00 1.36 C ATOM 597 O GLY B 1 -30.708 12.089 -12.852 1.00 1.36 O ATOM 0 H1 GLY B 1 -30.955 15.040 -14.766 1.00 1.44 H new ATOM 0 H2 GLY B 1 -30.468 13.427 -14.553 1.00 1.44 H new ATOM 0 H3 GLY B 1 -31.910 13.777 -15.380 1.00 1.44 H new ATOM 0 HA2 GLY B 1 -31.811 14.900 -12.732 1.00 1.42 H new ATOM 0 HA3 GLY B 1 -33.103 14.022 -13.526 1.00 1.42 H new ATOM 603 N SER B 2 -32.470 12.489 -11.493 1.00 1.35 N ATOM 604 CA SER B 2 -32.252 11.323 -10.640 1.00 1.32 C ATOM 605 C SER B 2 -30.854 11.358 -10.005 1.00 1.29 C ATOM 606 O SER B 2 -30.321 12.434 -9.713 1.00 1.34 O ATOM 607 CB SER B 2 -32.454 10.042 -11.460 1.00 1.32 C ATOM 608 OG SER B 2 -33.589 10.153 -12.308 1.00 1.35 O ATOM 0 H SER B 2 -33.274 13.056 -11.224 1.00 1.35 H new ATOM 0 HA SER B 2 -32.978 11.339 -9.827 1.00 1.32 H new ATOM 0 HB2 SER B 2 -31.565 9.846 -12.060 1.00 1.32 H new ATOM 0 HB3 SER B 2 -32.579 9.192 -10.789 1.00 1.32 H new ATOM 0 HG SER B 2 -33.696 9.325 -12.821 1.00 1.35 H new ATOM 614 N LEU B 3 -30.270 10.189 -9.776 1.00 1.26 N ATOM 615 CA LEU B 3 -28.943 10.110 -9.188 1.00 1.24 C ATOM 616 C LEU B 3 -27.911 9.753 -10.253 1.00 1.23 C ATOM 617 O LEU B 3 -27.069 10.580 -10.612 1.00 1.22 O ATOM 618 CB LEU B 3 -28.916 9.086 -8.052 1.00 1.26 C ATOM 619 CG LEU B 3 -27.602 9.016 -7.269 1.00 1.27 C ATOM 620 CD1 LEU B 3 -27.333 10.334 -6.558 1.00 1.23 C ATOM 621 CD2 LEU B 3 -27.639 7.874 -6.268 1.00 1.39 C ATOM 0 H LEU B 3 -30.694 9.286 -9.988 1.00 1.26 H new ATOM 0 HA LEU B 3 -28.692 11.086 -8.774 1.00 1.24 H new ATOM 0 HB2 LEU B 3 -29.723 9.317 -7.357 1.00 1.26 H new ATOM 0 HB3 LEU B 3 -29.126 8.100 -8.468 1.00 1.26 H new ATOM 0 HG LEU B 3 -26.792 8.832 -7.975 1.00 1.27 H new ATOM 0 HD11 LEU B 3 -26.395 10.265 -6.007 1.00 1.23 H new ATOM 0 HD12 LEU B 3 -27.264 11.136 -7.293 1.00 1.23 H new ATOM 0 HD13 LEU B 3 -28.147 10.546 -5.864 1.00 1.23 H new ATOM 0 HD21 LEU B 3 -26.697 7.839 -5.721 1.00 1.39 H new ATOM 0 HD22 LEU B 3 -28.460 8.030 -5.568 1.00 1.39 H new ATOM 0 HD23 LEU B 3 -27.787 6.932 -6.796 1.00 1.39 H new ATOM 633 N LEU B 4 -28.010 8.521 -10.759 1.00 1.27 N ATOM 634 CA LEU B 4 -27.114 7.996 -11.797 1.00 1.29 C ATOM 635 C LEU B 4 -25.688 7.791 -11.284 1.00 1.24 C ATOM 636 O LEU B 4 -25.212 6.660 -11.185 1.00 1.22 O ATOM 637 CB LEU B 4 -27.103 8.902 -13.037 1.00 1.32 C ATOM 638 CG LEU B 4 -28.161 8.584 -14.102 1.00 1.42 C ATOM 639 CD1 LEU B 4 -28.122 7.111 -14.478 1.00 1.54 C ATOM 640 CD2 LEU B 4 -29.550 8.975 -13.623 1.00 1.42 C ATOM 0 H LEU B 4 -28.720 7.853 -10.458 1.00 1.27 H new ATOM 0 HA LEU B 4 -27.509 7.020 -12.079 1.00 1.29 H new ATOM 0 HB2 LEU B 4 -27.240 9.933 -12.712 1.00 1.32 H new ATOM 0 HB3 LEU B 4 -26.118 8.841 -13.500 1.00 1.32 H new ATOM 0 HG LEU B 4 -27.930 9.172 -14.990 1.00 1.42 H new ATOM 0 HD11 LEU B 4 -28.880 6.908 -15.234 1.00 1.54 H new ATOM 0 HD12 LEU B 4 -27.138 6.863 -14.875 1.00 1.54 H new ATOM 0 HD13 LEU B 4 -28.320 6.505 -13.594 1.00 1.54 H new ATOM 0 HD21 LEU B 4 -30.281 8.739 -14.396 1.00 1.42 H new ATOM 0 HD22 LEU B 4 -29.791 8.422 -12.715 1.00 1.42 H new ATOM 0 HD23 LEU B 4 -29.575 10.044 -13.414 1.00 1.42 H new ATOM 652 N LYS B 5 -25.018 8.886 -10.953 1.00 1.25 N ATOM 653 CA LYS B 5 -23.645 8.835 -10.471 1.00 1.22 C ATOM 654 C LYS B 5 -23.596 8.619 -8.963 1.00 1.16 C ATOM 655 O LYS B 5 -24.093 9.440 -8.192 1.00 1.27 O ATOM 656 CB LYS B 5 -22.909 10.126 -10.837 1.00 1.38 C ATOM 657 CG LYS B 5 -22.293 10.105 -12.226 1.00 1.49 C ATOM 658 CD LYS B 5 -20.988 9.320 -12.246 1.00 1.59 C ATOM 659 CE LYS B 5 -21.148 7.978 -12.942 1.00 1.88 C ATOM 660 NZ LYS B 5 -19.846 7.286 -13.108 1.00 2.01 N ATOM 0 H LYS B 5 -25.407 9.827 -11.010 1.00 1.25 H new ATOM 0 HA LYS B 5 -23.152 7.990 -10.952 1.00 1.22 H new ATOM 0 HB2 LYS B 5 -23.605 10.962 -10.771 1.00 1.38 H new ATOM 0 HB3 LYS B 5 -22.123 10.306 -10.103 1.00 1.38 H new ATOM 0 HG2 LYS B 5 -22.997 9.661 -12.930 1.00 1.49 H new ATOM 0 HG3 LYS B 5 -22.110 11.126 -12.559 1.00 1.49 H new ATOM 0 HD2 LYS B 5 -20.220 9.904 -12.754 1.00 1.59 H new ATOM 0 HD3 LYS B 5 -20.644 9.161 -11.224 1.00 1.59 H new ATOM 0 HE2 LYS B 5 -21.824 7.347 -12.365 1.00 1.88 H new ATOM 0 HE3 LYS B 5 -21.608 8.127 -13.919 1.00 1.88 H new ATOM 0 HZ1 LYS B 5 -19.996 6.375 -13.586 1.00 2.01 H new ATOM 0 HZ2 LYS B 5 -19.209 7.877 -13.680 1.00 2.01 H new ATOM 0 HZ3 LYS B 5 -19.419 7.121 -12.174 1.00 2.01 H new ATOM 674 N PRO B 6 -23.006 7.501 -8.525 1.00 1.02 N ATOM 675 CA PRO B 6 -22.884 7.185 -7.109 1.00 1.00 C ATOM 676 C PRO B 6 -21.715 7.920 -6.454 1.00 1.02 C ATOM 677 O PRO B 6 -20.562 7.502 -6.566 1.00 1.01 O ATOM 678 CB PRO B 6 -22.640 5.674 -7.107 1.00 0.90 C ATOM 679 CG PRO B 6 -21.962 5.395 -8.409 1.00 0.86 C ATOM 680 CD PRO B 6 -22.428 6.449 -9.381 1.00 0.95 C ATOM 0 HA PRO B 6 -23.764 7.488 -6.541 1.00 1.00 H new ATOM 0 HB2 PRO B 6 -22.017 5.375 -6.264 1.00 0.90 H new ATOM 0 HB3 PRO B 6 -23.576 5.122 -7.022 1.00 0.90 H new ATOM 0 HG2 PRO B 6 -20.878 5.427 -8.295 1.00 0.86 H new ATOM 0 HG3 PRO B 6 -22.215 4.398 -8.770 1.00 0.86 H new ATOM 0 HD2 PRO B 6 -21.601 6.832 -9.979 1.00 0.95 H new ATOM 0 HD3 PRO B 6 -23.167 6.051 -10.076 1.00 0.95 H new ATOM 688 N ALA B 7 -22.008 9.028 -5.791 1.00 1.11 N ATOM 689 CA ALA B 7 -20.980 9.808 -5.114 1.00 1.15 C ATOM 690 C ALA B 7 -21.009 9.525 -3.617 1.00 1.14 C ATOM 691 O ALA B 7 -20.889 10.431 -2.790 1.00 1.22 O ATOM 692 CB ALA B 7 -21.175 11.290 -5.383 1.00 1.26 C ATOM 0 H ALA B 7 -22.950 9.409 -5.706 1.00 1.11 H new ATOM 0 HA ALA B 7 -20.005 9.517 -5.504 1.00 1.15 H new ATOM 0 HB1 ALA B 7 -20.399 11.858 -4.870 1.00 1.26 H new ATOM 0 HB2 ALA B 7 -21.113 11.476 -6.455 1.00 1.26 H new ATOM 0 HB3 ALA B 7 -22.154 11.601 -5.017 1.00 1.26 H new ATOM 698 N ARG B 8 -21.186 8.259 -3.277 1.00 1.08 N ATOM 699 CA ARG B 8 -21.242 7.843 -1.886 1.00 1.08 C ATOM 700 C ARG B 8 -20.321 6.654 -1.650 1.00 1.01 C ATOM 701 O ARG B 8 -20.373 5.669 -2.384 1.00 1.02 O ATOM 702 CB ARG B 8 -22.676 7.470 -1.489 1.00 1.12 C ATOM 703 CG ARG B 8 -23.660 8.626 -1.558 1.00 1.21 C ATOM 704 CD ARG B 8 -23.269 9.745 -0.607 1.00 1.25 C ATOM 705 NE ARG B 8 -24.222 10.850 -0.639 1.00 1.41 N ATOM 706 CZ ARG B 8 -23.929 12.076 -1.072 1.00 1.46 C ATOM 707 NH1 ARG B 8 -22.729 12.346 -1.584 1.00 1.66 N ATOM 708 NH2 ARG B 8 -24.845 13.033 -1.014 1.00 1.61 N ATOM 0 H ARG B 8 -21.294 7.499 -3.949 1.00 1.08 H new ATOM 0 HA ARG B 8 -20.912 8.679 -1.270 1.00 1.08 H new ATOM 0 HB2 ARG B 8 -23.026 6.670 -2.142 1.00 1.12 H new ATOM 0 HB3 ARG B 8 -22.669 7.073 -0.474 1.00 1.12 H new ATOM 0 HG2 ARG B 8 -23.701 9.010 -2.577 1.00 1.21 H new ATOM 0 HG3 ARG B 8 -24.660 8.270 -1.311 1.00 1.21 H new ATOM 0 HD2 ARG B 8 -23.204 9.352 0.408 1.00 1.25 H new ATOM 0 HD3 ARG B 8 -22.278 10.114 -0.870 1.00 1.25 H new ATOM 0 HE ARG B 8 -25.171 10.673 -0.310 1.00 1.41 H new ATOM 0 HH11 ARG B 8 -22.024 11.611 -1.647 1.00 1.66 H new ATOM 0 HH12 ARG B 8 -22.515 13.288 -1.913 1.00 1.66 H new ATOM 0 HH21 ARG B 8 -25.771 12.830 -0.639 1.00 1.61 H new ATOM 0 HH22 ARG B 8 -24.623 13.972 -1.345 1.00 1.61 H new ATOM 722 N PHE B 9 -19.478 6.763 -0.634 1.00 0.97 N ATOM 723 CA PHE B 9 -18.546 5.696 -0.282 1.00 0.91 C ATOM 724 C PHE B 9 -18.690 5.358 1.197 1.00 0.91 C ATOM 725 O PHE B 9 -17.750 4.898 1.848 1.00 0.86 O ATOM 726 CB PHE B 9 -17.100 6.105 -0.602 1.00 0.88 C ATOM 727 CG PHE B 9 -16.778 7.543 -0.289 1.00 0.93 C ATOM 728 CD1 PHE B 9 -16.437 7.927 0.998 1.00 0.91 C ATOM 729 CD2 PHE B 9 -16.809 8.509 -1.284 1.00 1.04 C ATOM 730 CE1 PHE B 9 -16.134 9.244 1.287 1.00 0.98 C ATOM 731 CE2 PHE B 9 -16.506 9.827 -1.002 1.00 1.11 C ATOM 732 CZ PHE B 9 -16.169 10.194 0.287 1.00 1.07 C ATOM 0 H PHE B 9 -19.419 7.585 -0.033 1.00 0.97 H new ATOM 0 HA PHE B 9 -18.783 4.813 -0.875 1.00 0.91 H new ATOM 0 HB2 PHE B 9 -16.421 5.463 -0.042 1.00 0.88 H new ATOM 0 HB3 PHE B 9 -16.909 5.924 -1.660 1.00 0.88 H new ATOM 0 HD1 PHE B 9 -16.408 7.188 1.785 1.00 0.91 H new ATOM 0 HD2 PHE B 9 -17.073 8.227 -2.292 1.00 1.04 H new ATOM 0 HE1 PHE B 9 -15.870 9.529 2.295 1.00 0.98 H new ATOM 0 HE2 PHE B 9 -16.532 10.569 -1.787 1.00 1.11 H new ATOM 0 HZ PHE B 9 -15.933 11.224 0.511 1.00 1.07 H new ATOM 742 N MET B 10 -19.886 5.590 1.714 1.00 0.97 N ATOM 743 CA MET B 10 -20.188 5.333 3.112 1.00 0.98 C ATOM 744 C MET B 10 -21.669 5.004 3.276 1.00 1.04 C ATOM 745 O MET B 10 -22.522 5.887 3.163 1.00 1.11 O ATOM 746 CB MET B 10 -19.825 6.558 3.961 1.00 1.00 C ATOM 747 CG MET B 10 -20.283 6.471 5.412 1.00 1.02 C ATOM 748 SD MET B 10 -20.168 8.053 6.272 1.00 1.08 S ATOM 749 CE MET B 10 -21.093 7.689 7.766 1.00 1.12 C ATOM 0 H MET B 10 -20.671 5.960 1.179 1.00 0.97 H new ATOM 0 HA MET B 10 -19.598 4.481 3.450 1.00 0.98 H new ATOM 0 HB2 MET B 10 -18.744 6.692 3.941 1.00 1.00 H new ATOM 0 HB3 MET B 10 -20.265 7.445 3.505 1.00 1.00 H new ATOM 0 HG2 MET B 10 -21.314 6.119 5.443 1.00 1.02 H new ATOM 0 HG3 MET B 10 -19.678 5.732 5.936 1.00 1.02 H new ATOM 0 HE1 MET B 10 -21.114 8.572 8.405 1.00 1.12 H new ATOM 0 HE2 MET B 10 -22.113 7.408 7.503 1.00 1.12 H new ATOM 0 HE3 MET B 10 -20.615 6.866 8.298 1.00 1.12 H new ATOM 759 N CYS B 11 -21.966 3.732 3.506 1.00 1.04 N ATOM 760 CA CYS B 11 -23.340 3.288 3.687 1.00 1.11 C ATOM 761 C CYS B 11 -23.894 3.760 5.022 1.00 1.17 C ATOM 762 O CYS B 11 -23.145 3.990 5.973 1.00 1.16 O ATOM 763 CB CYS B 11 -23.405 1.767 3.624 1.00 1.10 C ATOM 764 SG CYS B 11 -22.148 1.028 2.537 1.00 1.02 S ATOM 0 H CYS B 11 -21.271 2.988 3.572 1.00 1.04 H new ATOM 0 HA CYS B 11 -23.943 3.718 2.887 1.00 1.11 H new ATOM 0 HB2 CYS B 11 -23.285 1.365 4.630 1.00 1.10 H new ATOM 0 HB3 CYS B 11 -24.394 1.468 3.277 1.00 1.10 H new ATOM 0 HG CYS B 11 -22.369 -0.248 2.422 1.00 1.02 H new ATOM 769 N LEU B 12 -25.208 3.884 5.085 1.00 1.24 N ATOM 770 CA LEU B 12 -25.884 4.307 6.302 1.00 1.32 C ATOM 771 C LEU B 12 -25.831 3.209 7.377 1.00 1.31 C ATOM 772 O LEU B 12 -25.478 3.495 8.520 1.00 1.34 O ATOM 773 CB LEU B 12 -27.337 4.691 6.005 1.00 1.42 C ATOM 774 CG LEU B 12 -27.700 6.144 6.306 1.00 1.51 C ATOM 775 CD1 LEU B 12 -27.063 7.078 5.292 1.00 1.49 C ATOM 776 CD2 LEU B 12 -29.210 6.320 6.326 1.00 1.64 C ATOM 0 H LEU B 12 -25.834 3.696 4.302 1.00 1.24 H new ATOM 0 HA LEU B 12 -25.362 5.183 6.687 1.00 1.32 H new ATOM 0 HB2 LEU B 12 -27.541 4.493 4.953 1.00 1.42 H new ATOM 0 HB3 LEU B 12 -27.993 4.042 6.584 1.00 1.42 H new ATOM 0 HG LEU B 12 -27.311 6.399 7.292 1.00 1.51 H new ATOM 0 HD11 LEU B 12 -27.334 8.108 5.525 1.00 1.49 H new ATOM 0 HD12 LEU B 12 -25.979 6.971 5.330 1.00 1.49 H new ATOM 0 HD13 LEU B 12 -27.418 6.827 4.293 1.00 1.49 H new ATOM 0 HD21 LEU B 12 -29.452 7.361 6.542 1.00 1.64 H new ATOM 0 HD22 LEU B 12 -29.621 6.046 5.355 1.00 1.64 H new ATOM 0 HD23 LEU B 12 -29.641 5.680 7.096 1.00 1.64 H new ATOM 788 N PRO B 13 -26.179 1.938 7.041 1.00 1.30 N ATOM 789 CA PRO B 13 -26.138 0.836 8.012 1.00 1.30 C ATOM 790 C PRO B 13 -24.719 0.554 8.495 1.00 1.22 C ATOM 791 O PRO B 13 -24.477 0.403 9.694 1.00 1.28 O ATOM 792 CB PRO B 13 -26.684 -0.371 7.236 1.00 1.31 C ATOM 793 CG PRO B 13 -27.380 0.199 6.052 1.00 1.34 C ATOM 794 CD PRO B 13 -26.657 1.472 5.724 1.00 1.29 C ATOM 0 HA PRO B 13 -26.714 1.069 8.907 1.00 1.30 H new ATOM 0 HB2 PRO B 13 -25.878 -1.040 6.933 1.00 1.31 H new ATOM 0 HB3 PRO B 13 -27.369 -0.955 7.850 1.00 1.31 H new ATOM 0 HG2 PRO B 13 -27.352 -0.494 5.211 1.00 1.34 H new ATOM 0 HG3 PRO B 13 -28.430 0.392 6.271 1.00 1.34 H new ATOM 0 HD2 PRO B 13 -25.831 1.300 5.034 1.00 1.29 H new ATOM 0 HD3 PRO B 13 -27.318 2.201 5.255 1.00 1.29 H new ATOM 802 N CYS B 14 -23.785 0.488 7.554 1.00 1.09 N ATOM 803 CA CYS B 14 -22.394 0.230 7.875 1.00 1.00 C ATOM 804 C CYS B 14 -21.786 1.386 8.665 1.00 1.04 C ATOM 805 O CYS B 14 -21.256 1.195 9.759 1.00 1.06 O ATOM 806 CB CYS B 14 -21.607 -0.002 6.585 1.00 0.92 C ATOM 807 SG CYS B 14 -22.296 -1.336 5.554 1.00 1.03 S ATOM 0 H CYS B 14 -23.971 0.611 6.559 1.00 1.09 H new ATOM 0 HA CYS B 14 -22.342 -0.662 8.499 1.00 1.00 H new ATOM 0 HB2 CYS B 14 -21.588 0.922 6.007 1.00 0.92 H new ATOM 0 HB3 CYS B 14 -20.574 -0.242 6.836 1.00 0.92 H new ATOM 0 HG CYS B 14 -21.416 -1.698 4.668 1.00 1.03 H new ATOM 812 N GLY B 15 -21.870 2.586 8.109 1.00 1.07 N ATOM 813 CA GLY B 15 -21.305 3.749 8.766 1.00 1.11 C ATOM 814 C GLY B 15 -19.808 3.843 8.543 1.00 1.01 C ATOM 815 O GLY B 15 -19.166 4.827 8.923 1.00 1.04 O ATOM 0 H GLY B 15 -22.320 2.776 7.213 1.00 1.07 H new ATOM 0 HA2 GLY B 15 -21.787 4.651 8.389 1.00 1.11 H new ATOM 0 HA3 GLY B 15 -21.512 3.700 9.835 1.00 1.11 H new ATOM 819 N ILE B 16 -19.257 2.807 7.930 1.00 0.95 N ATOM 820 CA ILE B 16 -17.837 2.741 7.637 1.00 0.87 C ATOM 821 C ILE B 16 -17.537 3.469 6.337 1.00 0.83 C ATOM 822 O ILE B 16 -18.021 3.082 5.270 1.00 0.84 O ATOM 823 CB ILE B 16 -17.353 1.278 7.521 1.00 0.85 C ATOM 824 CG1 ILE B 16 -17.814 0.465 8.734 1.00 0.94 C ATOM 825 CG2 ILE B 16 -15.837 1.225 7.392 1.00 0.77 C ATOM 826 CD1 ILE B 16 -17.776 -1.030 8.508 1.00 1.06 C ATOM 0 H ILE B 16 -19.783 1.989 7.622 1.00 0.95 H new ATOM 0 HA ILE B 16 -17.308 3.219 8.461 1.00 0.87 H new ATOM 0 HB ILE B 16 -17.791 0.841 6.623 1.00 0.85 H new ATOM 0 HG12 ILE B 16 -17.183 0.712 9.588 1.00 0.94 H new ATOM 0 HG13 ILE B 16 -18.831 0.760 8.994 1.00 0.94 H new ATOM 0 HG21 ILE B 16 -15.515 0.187 7.311 1.00 0.77 H new ATOM 0 HG22 ILE B 16 -15.528 1.771 6.500 1.00 0.77 H new ATOM 0 HG23 ILE B 16 -15.381 1.679 8.272 1.00 0.77 H new ATOM 0 HD11 ILE B 16 -18.115 -1.543 9.408 1.00 1.06 H new ATOM 0 HD12 ILE B 16 -18.429 -1.289 7.675 1.00 1.06 H new ATOM 0 HD13 ILE B 16 -16.756 -1.337 8.278 1.00 1.06 H new ATOM 838 N ALA B 17 -16.746 4.522 6.430 1.00 0.84 N ATOM 839 CA ALA B 17 -16.388 5.303 5.263 1.00 0.83 C ATOM 840 C ALA B 17 -15.163 4.716 4.579 1.00 0.75 C ATOM 841 O ALA B 17 -14.162 4.416 5.230 1.00 0.76 O ATOM 842 CB ALA B 17 -16.136 6.746 5.655 1.00 0.89 C ATOM 0 H ALA B 17 -16.339 4.856 7.304 1.00 0.84 H new ATOM 0 HA ALA B 17 -17.219 5.272 4.559 1.00 0.83 H new ATOM 0 HB1 ALA B 17 -15.868 7.322 4.769 1.00 0.89 H new ATOM 0 HB2 ALA B 17 -17.038 7.165 6.101 1.00 0.89 H new ATOM 0 HB3 ALA B 17 -15.320 6.790 6.377 1.00 0.89 H new ATOM 848 N PHE B 18 -15.255 4.539 3.274 1.00 0.70 N ATOM 849 CA PHE B 18 -14.155 3.994 2.498 1.00 0.63 C ATOM 850 C PHE B 18 -13.448 5.105 1.736 1.00 0.64 C ATOM 851 O PHE B 18 -13.897 6.252 1.738 1.00 0.72 O ATOM 852 CB PHE B 18 -14.664 2.921 1.529 1.00 0.59 C ATOM 853 CG PHE B 18 -14.584 1.523 2.081 1.00 0.56 C ATOM 854 CD1 PHE B 18 -14.805 1.279 3.426 1.00 0.60 C ATOM 855 CD2 PHE B 18 -14.283 0.455 1.251 1.00 0.52 C ATOM 856 CE1 PHE B 18 -14.728 -0.003 3.934 1.00 0.60 C ATOM 857 CE2 PHE B 18 -14.205 -0.830 1.753 1.00 0.53 C ATOM 858 CZ PHE B 18 -14.427 -1.059 3.097 1.00 0.56 C ATOM 0 H PHE B 18 -16.085 4.766 2.726 1.00 0.70 H new ATOM 0 HA PHE B 18 -13.442 3.532 3.181 1.00 0.63 H new ATOM 0 HB2 PHE B 18 -15.699 3.141 1.268 1.00 0.59 H new ATOM 0 HB3 PHE B 18 -14.085 2.972 0.607 1.00 0.59 H new ATOM 0 HD1 PHE B 18 -15.040 2.101 4.086 1.00 0.60 H new ATOM 0 HD2 PHE B 18 -14.107 0.629 0.200 1.00 0.52 H new ATOM 0 HE1 PHE B 18 -14.903 -0.179 4.985 1.00 0.60 H new ATOM 0 HE2 PHE B 18 -13.971 -1.654 1.095 1.00 0.53 H new ATOM 0 HZ PHE B 18 -14.365 -2.062 3.492 1.00 0.56 H new ATOM 868 N SER B 19 -12.340 4.772 1.099 1.00 0.59 N ATOM 869 CA SER B 19 -11.583 5.750 0.338 1.00 0.60 C ATOM 870 C SER B 19 -11.343 5.260 -1.086 1.00 0.57 C ATOM 871 O SER B 19 -11.263 6.057 -2.025 1.00 0.60 O ATOM 872 CB SER B 19 -10.253 6.037 1.035 1.00 0.60 C ATOM 873 OG SER B 19 -10.460 6.327 2.410 1.00 0.68 O ATOM 0 H SER B 19 -11.944 3.832 1.093 1.00 0.59 H new ATOM 0 HA SER B 19 -12.161 6.672 0.285 1.00 0.60 H new ATOM 0 HB2 SER B 19 -9.591 5.177 0.935 1.00 0.60 H new ATOM 0 HB3 SER B 19 -9.757 6.879 0.551 1.00 0.60 H new ATOM 0 HG SER B 19 -9.598 6.506 2.840 1.00 0.68 H new ATOM 879 N SER B 20 -11.238 3.948 -1.246 1.00 0.52 N ATOM 880 CA SER B 20 -11.011 3.356 -2.550 1.00 0.51 C ATOM 881 C SER B 20 -12.291 2.698 -3.067 1.00 0.52 C ATOM 882 O SER B 20 -12.877 1.840 -2.403 1.00 0.54 O ATOM 883 CB SER B 20 -9.874 2.336 -2.465 1.00 0.45 C ATOM 884 OG SER B 20 -8.835 2.802 -1.615 1.00 0.44 O ATOM 0 H SER B 20 -11.307 3.274 -0.484 1.00 0.52 H new ATOM 0 HA SER B 20 -10.726 4.140 -3.252 1.00 0.51 H new ATOM 0 HB2 SER B 20 -10.258 1.388 -2.089 1.00 0.45 H new ATOM 0 HB3 SER B 20 -9.476 2.146 -3.462 1.00 0.45 H new ATOM 0 HG SER B 20 -8.859 2.309 -0.768 1.00 0.44 H new ATOM 890 N PRO B 21 -12.751 3.101 -4.261 1.00 0.54 N ATOM 891 CA PRO B 21 -13.971 2.555 -4.867 1.00 0.56 C ATOM 892 C PRO B 21 -13.833 1.080 -5.231 1.00 0.52 C ATOM 893 O PRO B 21 -14.819 0.342 -5.260 1.00 0.54 O ATOM 894 CB PRO B 21 -14.166 3.407 -6.122 1.00 0.62 C ATOM 895 CG PRO B 21 -12.816 3.957 -6.429 1.00 0.61 C ATOM 896 CD PRO B 21 -12.121 4.124 -5.111 1.00 0.58 C ATOM 0 HA PRO B 21 -14.816 2.595 -4.180 1.00 0.56 H new ATOM 0 HB2 PRO B 21 -14.546 2.809 -6.950 1.00 0.62 H new ATOM 0 HB3 PRO B 21 -14.887 4.206 -5.949 1.00 0.62 H new ATOM 0 HG2 PRO B 21 -12.260 3.282 -7.079 1.00 0.61 H new ATOM 0 HG3 PRO B 21 -12.894 4.911 -6.951 1.00 0.61 H new ATOM 0 HD2 PRO B 21 -11.046 3.966 -5.201 1.00 0.58 H new ATOM 0 HD3 PRO B 21 -12.263 5.126 -4.706 1.00 0.58 H new ATOM 904 N SER B 22 -12.604 0.657 -5.498 1.00 0.49 N ATOM 905 CA SER B 22 -12.324 -0.722 -5.854 1.00 0.47 C ATOM 906 C SER B 22 -12.641 -1.654 -4.684 1.00 0.46 C ATOM 907 O SER B 22 -13.134 -2.769 -4.874 1.00 0.48 O ATOM 908 CB SER B 22 -10.862 -0.849 -6.270 1.00 0.47 C ATOM 909 OG SER B 22 -10.429 0.327 -6.936 1.00 0.48 O ATOM 0 H SER B 22 -11.780 1.258 -5.473 1.00 0.49 H new ATOM 0 HA SER B 22 -12.958 -1.014 -6.691 1.00 0.47 H new ATOM 0 HB2 SER B 22 -10.242 -1.025 -5.391 1.00 0.47 H new ATOM 0 HB3 SER B 22 -10.738 -1.711 -6.925 1.00 0.47 H new ATOM 0 HG SER B 22 -9.489 0.229 -7.194 1.00 0.48 H new ATOM 915 N THR B 23 -12.368 -1.186 -3.472 1.00 0.45 N ATOM 916 CA THR B 23 -12.640 -1.960 -2.272 1.00 0.46 C ATOM 917 C THR B 23 -14.125 -1.887 -1.924 1.00 0.51 C ATOM 918 O THR B 23 -14.701 -2.833 -1.378 1.00 0.54 O ATOM 919 CB THR B 23 -11.813 -1.432 -1.087 1.00 0.44 C ATOM 920 OG1 THR B 23 -10.951 -0.377 -1.533 1.00 0.56 O ATOM 921 CG2 THR B 23 -10.981 -2.542 -0.468 1.00 0.41 C ATOM 0 H THR B 23 -11.956 -0.269 -3.296 1.00 0.45 H new ATOM 0 HA THR B 23 -12.362 -2.996 -2.466 1.00 0.46 H new ATOM 0 HB THR B 23 -12.500 -1.052 -0.330 1.00 0.44 H new ATOM 0 HG1 THR B 23 -10.711 0.193 -0.773 1.00 0.56 H new ATOM 0 HG21 THR B 23 -10.406 -2.143 0.367 1.00 0.41 H new ATOM 0 HG22 THR B 23 -11.639 -3.334 -0.110 1.00 0.41 H new ATOM 0 HG23 THR B 23 -10.300 -2.947 -1.217 1.00 0.41 H new ATOM 929 N LEU B 24 -14.738 -0.756 -2.265 1.00 0.53 N ATOM 930 CA LEU B 24 -16.150 -0.523 -2.000 1.00 0.59 C ATOM 931 C LEU B 24 -17.027 -1.506 -2.776 1.00 0.60 C ATOM 932 O LEU B 24 -18.091 -1.906 -2.299 1.00 0.65 O ATOM 933 CB LEU B 24 -16.530 0.916 -2.364 1.00 0.61 C ATOM 934 CG LEU B 24 -17.942 1.341 -1.951 1.00 0.66 C ATOM 935 CD1 LEU B 24 -18.029 1.530 -0.444 1.00 0.70 C ATOM 936 CD2 LEU B 24 -18.344 2.616 -2.675 1.00 0.69 C ATOM 0 H LEU B 24 -14.269 0.021 -2.731 1.00 0.53 H new ATOM 0 HA LEU B 24 -16.321 -0.679 -0.935 1.00 0.59 H new ATOM 0 HB2 LEU B 24 -15.813 1.593 -1.899 1.00 0.61 H new ATOM 0 HB3 LEU B 24 -16.431 1.039 -3.443 1.00 0.61 H new ATOM 0 HG LEU B 24 -18.636 0.549 -2.234 1.00 0.66 H new ATOM 0 HD11 LEU B 24 -19.041 1.832 -0.173 1.00 0.70 H new ATOM 0 HD12 LEU B 24 -17.784 0.592 0.055 1.00 0.70 H new ATOM 0 HD13 LEU B 24 -17.325 2.301 -0.133 1.00 0.70 H new ATOM 0 HD21 LEU B 24 -19.350 2.905 -2.371 1.00 0.69 H new ATOM 0 HD22 LEU B 24 -17.645 3.414 -2.423 1.00 0.69 H new ATOM 0 HD23 LEU B 24 -18.325 2.445 -3.751 1.00 0.69 H new ATOM 948 N GLU B 25 -16.562 -1.895 -3.965 1.00 0.58 N ATOM 949 CA GLU B 25 -17.295 -2.830 -4.819 1.00 0.60 C ATOM 950 C GLU B 25 -17.585 -4.134 -4.083 1.00 0.60 C ATOM 951 O GLU B 25 -18.732 -4.566 -3.996 1.00 0.62 O ATOM 952 CB GLU B 25 -16.504 -3.130 -6.095 1.00 0.60 C ATOM 953 CG GLU B 25 -17.235 -4.057 -7.056 1.00 0.63 C ATOM 954 CD GLU B 25 -16.292 -4.895 -7.894 1.00 0.83 C ATOM 955 OE1 GLU B 25 -15.088 -4.944 -7.574 1.00 1.15 O ATOM 956 OE2 GLU B 25 -16.755 -5.519 -8.872 1.00 1.25 O ATOM 0 H GLU B 25 -15.677 -1.575 -4.359 1.00 0.58 H new ATOM 0 HA GLU B 25 -18.241 -2.359 -5.085 1.00 0.60 H new ATOM 0 HB2 GLU B 25 -16.282 -2.192 -6.605 1.00 0.60 H new ATOM 0 HB3 GLU B 25 -15.549 -3.580 -5.824 1.00 0.60 H new ATOM 0 HG2 GLU B 25 -17.893 -4.716 -6.489 1.00 0.63 H new ATOM 0 HG3 GLU B 25 -17.869 -3.464 -7.715 1.00 0.63 H new ATOM 963 N ALA B 26 -16.537 -4.748 -3.547 1.00 0.61 N ATOM 964 CA ALA B 26 -16.680 -6.001 -2.819 1.00 0.64 C ATOM 965 C ALA B 26 -17.330 -5.765 -1.462 1.00 0.67 C ATOM 966 O ALA B 26 -18.004 -6.641 -0.920 1.00 0.72 O ATOM 967 CB ALA B 26 -15.330 -6.678 -2.660 1.00 0.66 C ATOM 0 H ALA B 26 -15.580 -4.398 -3.603 1.00 0.61 H new ATOM 0 HA ALA B 26 -17.330 -6.661 -3.394 1.00 0.64 H new ATOM 0 HB1 ALA B 26 -15.454 -7.613 -2.114 1.00 0.66 H new ATOM 0 HB2 ALA B 26 -14.909 -6.885 -3.644 1.00 0.66 H new ATOM 0 HB3 ALA B 26 -14.657 -6.022 -2.108 1.00 0.66 H new ATOM 973 N HIS B 27 -17.115 -4.576 -0.910 1.00 0.67 N ATOM 974 CA HIS B 27 -17.704 -4.218 0.370 1.00 0.71 C ATOM 975 C HIS B 27 -19.227 -4.325 0.278 1.00 0.75 C ATOM 976 O HIS B 27 -19.869 -4.928 1.143 1.00 0.80 O ATOM 977 CB HIS B 27 -17.267 -2.790 0.799 1.00 0.71 C ATOM 978 CG HIS B 27 -18.126 -2.155 1.871 1.00 0.76 C ATOM 979 ND1 HIS B 27 -17.641 -1.684 3.088 1.00 0.78 N ATOM 980 CD2 HIS B 27 -19.458 -1.956 1.912 1.00 0.81 C ATOM 981 CE1 HIS B 27 -18.661 -1.224 3.815 1.00 0.84 C ATOM 982 NE2 HIS B 27 -19.752 -1.394 3.104 1.00 0.85 N ATOM 0 H HIS B 27 -16.538 -3.847 -1.330 1.00 0.67 H new ATOM 0 HA HIS B 27 -17.349 -4.910 1.133 1.00 0.71 H new ATOM 0 HB2 HIS B 27 -16.238 -2.833 1.157 1.00 0.71 H new ATOM 0 HB3 HIS B 27 -17.272 -2.145 -0.080 1.00 0.71 H new ATOM 0 HD1 HIS B 27 -16.663 -1.690 3.377 1.00 0.78 H new ATOM 0 HD2 HIS B 27 -20.163 -2.202 1.132 1.00 0.81 H new ATOM 0 HE1 HIS B 27 -18.601 -0.793 4.803 1.00 0.84 H new ATOM 990 N GLN B 28 -19.793 -3.743 -0.775 1.00 0.75 N ATOM 991 CA GLN B 28 -21.240 -3.743 -0.976 1.00 0.81 C ATOM 992 C GLN B 28 -21.727 -5.104 -1.467 1.00 0.81 C ATOM 993 O GLN B 28 -22.319 -5.227 -2.543 1.00 0.85 O ATOM 994 CB GLN B 28 -21.636 -2.649 -1.965 1.00 0.83 C ATOM 995 CG GLN B 28 -23.024 -2.079 -1.710 1.00 1.08 C ATOM 996 CD GLN B 28 -23.404 -0.979 -2.685 1.00 1.25 C ATOM 997 OE1 GLN B 28 -22.941 -1.096 -3.919 1.00 1.36 O flip ATOM 998 NE2 GLN B 28 -24.120 -0.039 -2.333 1.00 1.57 N flip ATOM 0 H GLN B 28 -19.269 -3.263 -1.506 1.00 0.75 H new ATOM 0 HA GLN B 28 -21.716 -3.541 -0.016 1.00 0.81 H new ATOM 0 HB2 GLN B 28 -20.905 -1.842 -1.915 1.00 0.83 H new ATOM 0 HB3 GLN B 28 -21.597 -3.052 -2.977 1.00 0.83 H new ATOM 0 HG2 GLN B 28 -23.758 -2.883 -1.774 1.00 1.08 H new ATOM 0 HG3 GLN B 28 -23.068 -1.687 -0.694 1.00 1.08 H new ATOM 0 HE21 GLN B 28 -24.456 0.014 -1.371 1.00 1.57 H new ATOM 0 HE22 GLN B 28 -24.376 0.686 -3.003 1.00 1.57 H new ATOM 1007 N ALA B 29 -21.470 -6.118 -0.658 1.00 0.81 N ATOM 1008 CA ALA B 29 -21.859 -7.485 -0.954 1.00 0.83 C ATOM 1009 C ALA B 29 -21.743 -8.332 0.297 1.00 0.87 C ATOM 1010 O ALA B 29 -22.676 -9.044 0.672 1.00 0.90 O ATOM 1011 CB ALA B 29 -20.999 -8.068 -2.070 1.00 0.83 C ATOM 0 H ALA B 29 -20.981 -6.014 0.231 1.00 0.81 H new ATOM 0 HA ALA B 29 -22.895 -7.485 -1.293 1.00 0.83 H new ATOM 0 HB1 ALA B 29 -21.311 -9.093 -2.272 1.00 0.83 H new ATOM 0 HB2 ALA B 29 -21.118 -7.468 -2.972 1.00 0.83 H new ATOM 0 HB3 ALA B 29 -19.953 -8.061 -1.765 1.00 0.83 H new ATOM 1017 N TYR B 30 -20.596 -8.234 0.955 1.00 0.87 N ATOM 1018 CA TYR B 30 -20.347 -9.001 2.164 1.00 0.91 C ATOM 1019 C TYR B 30 -20.388 -8.125 3.416 1.00 0.91 C ATOM 1020 O TYR B 30 -20.781 -8.591 4.481 1.00 1.01 O ATOM 1021 CB TYR B 30 -18.980 -9.688 2.089 1.00 0.94 C ATOM 1022 CG TYR B 30 -18.630 -10.258 0.728 1.00 0.92 C ATOM 1023 CD1 TYR B 30 -19.258 -11.399 0.242 1.00 0.99 C ATOM 1024 CD2 TYR B 30 -17.662 -9.656 -0.064 1.00 0.93 C ATOM 1025 CE1 TYR B 30 -18.929 -11.920 -0.995 1.00 1.07 C ATOM 1026 CE2 TYR B 30 -17.331 -10.171 -1.302 1.00 1.01 C ATOM 1027 CZ TYR B 30 -17.967 -11.301 -1.763 1.00 1.07 C ATOM 1028 OH TYR B 30 -17.637 -11.815 -2.994 1.00 1.20 O ATOM 0 H TYR B 30 -19.824 -7.631 0.671 1.00 0.87 H new ATOM 0 HA TYR B 30 -21.140 -9.746 2.235 1.00 0.91 H new ATOM 0 HB2 TYR B 30 -18.212 -8.970 2.375 1.00 0.94 H new ATOM 0 HB3 TYR B 30 -18.953 -10.493 2.823 1.00 0.94 H new ATOM 0 HD1 TYR B 30 -20.014 -11.886 0.840 1.00 0.99 H new ATOM 0 HD2 TYR B 30 -17.159 -8.770 0.294 1.00 0.93 H new ATOM 0 HE1 TYR B 30 -19.424 -12.809 -1.358 1.00 1.07 H new ATOM 0 HE2 TYR B 30 -16.576 -9.689 -1.906 1.00 1.01 H new ATOM 0 HH TYR B 30 -16.677 -11.697 -3.151 1.00 1.20 H new ATOM 1038 N TYR B 31 -19.996 -6.856 3.294 1.00 0.86 N ATOM 1039 CA TYR B 31 -19.959 -5.975 4.458 1.00 0.87 C ATOM 1040 C TYR B 31 -21.334 -5.425 4.827 1.00 0.94 C ATOM 1041 O TYR B 31 -21.705 -5.443 6.002 1.00 1.03 O ATOM 1042 CB TYR B 31 -18.965 -4.827 4.257 1.00 0.81 C ATOM 1043 CG TYR B 31 -18.050 -4.615 5.445 1.00 0.77 C ATOM 1044 CD1 TYR B 31 -18.460 -4.953 6.730 1.00 0.88 C ATOM 1045 CD2 TYR B 31 -16.778 -4.080 5.284 1.00 0.71 C ATOM 1046 CE1 TYR B 31 -17.630 -4.772 7.818 1.00 0.89 C ATOM 1047 CE2 TYR B 31 -15.940 -3.896 6.368 1.00 0.68 C ATOM 1048 CZ TYR B 31 -16.372 -4.243 7.634 1.00 0.75 C ATOM 1049 OH TYR B 31 -15.542 -4.065 8.718 1.00 0.77 O ATOM 0 H TYR B 31 -19.705 -6.423 2.418 1.00 0.86 H new ATOM 0 HA TYR B 31 -19.622 -6.590 5.292 1.00 0.87 H new ATOM 0 HB2 TYR B 31 -18.361 -5.029 3.373 1.00 0.81 H new ATOM 0 HB3 TYR B 31 -19.517 -3.907 4.063 1.00 0.81 H new ATOM 0 HD1 TYR B 31 -19.447 -5.365 6.880 1.00 0.88 H new ATOM 0 HD2 TYR B 31 -16.439 -3.804 4.297 1.00 0.71 H new ATOM 0 HE1 TYR B 31 -17.965 -5.044 8.808 1.00 0.89 H new ATOM 0 HE2 TYR B 31 -14.952 -3.483 6.226 1.00 0.68 H new ATOM 0 HH TYR B 31 -14.696 -3.669 8.421 1.00 0.77 H new ATOM 1059 N CYS B 32 -22.086 -4.915 3.852 1.00 0.94 N ATOM 1060 CA CYS B 32 -23.417 -4.386 4.141 1.00 1.02 C ATOM 1061 C CYS B 32 -24.413 -5.526 4.347 1.00 1.07 C ATOM 1062 O CYS B 32 -25.302 -5.742 3.517 1.00 1.10 O ATOM 1063 CB CYS B 32 -23.912 -3.477 3.015 1.00 1.01 C ATOM 1064 SG CYS B 32 -22.599 -2.657 2.059 1.00 0.98 S ATOM 0 H CYS B 32 -21.803 -4.857 2.874 1.00 0.94 H new ATOM 0 HA CYS B 32 -23.343 -3.798 5.056 1.00 1.02 H new ATOM 0 HB2 CYS B 32 -24.523 -4.068 2.333 1.00 1.01 H new ATOM 0 HB3 CYS B 32 -24.561 -2.713 3.443 1.00 1.01 H new ATOM 0 HG CYS B 32 -21.647 -2.284 2.861 1.00 0.98 H new ATOM 1069 N SER B 33 -24.247 -6.248 5.450 1.00 1.09 N ATOM 1070 CA SER B 33 -25.108 -7.372 5.800 1.00 1.16 C ATOM 1071 C SER B 33 -24.961 -8.515 4.787 1.00 1.09 C ATOM 1072 O SER B 33 -24.077 -9.364 4.925 1.00 1.07 O ATOM 1073 CB SER B 33 -26.571 -6.916 5.911 1.00 1.27 C ATOM 1074 OG SER B 33 -26.666 -5.652 6.551 1.00 1.43 O ATOM 0 H SER B 33 -23.508 -6.069 6.130 1.00 1.09 H new ATOM 0 HA SER B 33 -24.795 -7.751 6.773 1.00 1.16 H new ATOM 0 HB2 SER B 33 -27.013 -6.858 4.916 1.00 1.27 H new ATOM 0 HB3 SER B 33 -27.144 -7.655 6.472 1.00 1.27 H new ATOM 0 HG SER B 33 -27.607 -5.384 6.608 1.00 1.43 H new ATOM 1080 N HIS B 34 -25.803 -8.520 3.759 1.00 1.10 N ATOM 1081 CA HIS B 34 -25.767 -9.556 2.735 1.00 1.07 C ATOM 1082 C HIS B 34 -26.409 -9.049 1.453 1.00 1.06 C ATOM 1083 O HIS B 34 -27.577 -9.319 1.183 1.00 1.14 O ATOM 1084 CB HIS B 34 -26.489 -10.827 3.210 1.00 1.14 C ATOM 1085 CG HIS B 34 -25.598 -11.812 3.901 1.00 1.09 C ATOM 1086 ND1 HIS B 34 -25.920 -12.404 5.104 1.00 1.18 N ATOM 1087 CD2 HIS B 34 -24.388 -12.310 3.552 1.00 1.04 C ATOM 1088 CE1 HIS B 34 -24.949 -13.222 5.463 1.00 1.14 C ATOM 1089 NE2 HIS B 34 -24.009 -13.183 4.540 1.00 1.06 N ATOM 0 H HIS B 34 -26.523 -7.813 3.613 1.00 1.10 H new ATOM 0 HA HIS B 34 -24.723 -9.804 2.543 1.00 1.07 H new ATOM 0 HB2 HIS B 34 -27.294 -10.543 3.888 1.00 1.14 H new ATOM 0 HB3 HIS B 34 -26.952 -11.312 2.351 1.00 1.14 H new ATOM 0 HD2 HIS B 34 -23.827 -12.066 2.662 1.00 1.04 H new ATOM 0 HE1 HIS B 34 -24.928 -13.822 6.361 1.00 1.14 H new ATOM 0 HE2 HIS B 34 -23.140 -13.716 4.557 1.00 1.06 H new ATOM 1098 N ARG B 35 -25.647 -8.307 0.664 1.00 0.99 N ATOM 1099 CA ARG B 35 -26.156 -7.763 -0.591 1.00 0.99 C ATOM 1100 C ARG B 35 -25.916 -8.756 -1.725 1.00 1.01 C ATOM 1101 O ARG B 35 -25.291 -8.432 -2.737 1.00 1.03 O ATOM 1102 CB ARG B 35 -25.489 -6.422 -0.917 1.00 0.94 C ATOM 1103 CG ARG B 35 -25.279 -5.527 0.292 1.00 0.94 C ATOM 1104 CD ARG B 35 -26.535 -4.745 0.642 1.00 1.04 C ATOM 1105 NE ARG B 35 -26.817 -3.691 -0.331 1.00 1.05 N ATOM 1106 CZ ARG B 35 -26.395 -2.432 -0.217 1.00 1.06 C ATOM 1107 NH1 ARG B 35 -25.618 -2.072 0.792 1.00 1.04 N ATOM 1108 NH2 ARG B 35 -26.734 -1.537 -1.130 1.00 1.11 N ATOM 0 H ARG B 35 -24.677 -8.067 0.867 1.00 0.99 H new ATOM 0 HA ARG B 35 -27.227 -7.594 -0.482 1.00 0.99 H new ATOM 0 HB2 ARG B 35 -24.524 -6.612 -1.387 1.00 0.94 H new ATOM 0 HB3 ARG B 35 -26.100 -5.892 -1.647 1.00 0.94 H new ATOM 0 HG2 ARG B 35 -24.980 -6.134 1.146 1.00 0.94 H new ATOM 0 HG3 ARG B 35 -24.463 -4.833 0.093 1.00 0.94 H new ATOM 0 HD2 ARG B 35 -27.384 -5.427 0.693 1.00 1.04 H new ATOM 0 HD3 ARG B 35 -26.422 -4.303 1.632 1.00 1.04 H new ATOM 0 HE ARG B 35 -27.373 -3.935 -1.151 1.00 1.05 H new ATOM 0 HH11 ARG B 35 -25.337 -2.760 1.490 1.00 1.04 H new ATOM 0 HH12 ARG B 35 -25.300 -1.106 0.871 1.00 1.04 H new ATOM 0 HH21 ARG B 35 -27.318 -1.811 -1.920 1.00 1.11 H new ATOM 0 HH22 ARG B 35 -26.412 -0.573 -1.044 1.00 1.11 H new ATOM 1122 N ILE B 36 -26.417 -9.967 -1.545 1.00 1.07 N ATOM 1123 CA ILE B 36 -26.256 -11.021 -2.530 1.00 1.12 C ATOM 1124 C ILE B 36 -27.606 -11.635 -2.871 1.00 1.32 C ATOM 1125 O ILE B 36 -27.842 -11.940 -4.055 1.00 1.45 O ATOM 1126 CB ILE B 36 -25.295 -12.125 -2.031 1.00 1.06 C ATOM 1127 CG1 ILE B 36 -25.624 -12.513 -0.585 1.00 1.12 C ATOM 1128 CG2 ILE B 36 -23.848 -11.663 -2.145 1.00 1.04 C ATOM 1129 CD1 ILE B 36 -24.834 -13.699 -0.068 1.00 1.18 C ATOM 1130 OXT ILE B 36 -28.434 -11.796 -1.950 1.00 1.45 O ATOM 0 H ILE B 36 -26.944 -10.245 -0.717 1.00 1.07 H new ATOM 0 HA ILE B 36 -25.823 -10.571 -3.423 1.00 1.12 H new ATOM 0 HB ILE B 36 -25.426 -13.006 -2.660 1.00 1.06 H new ATOM 0 HG12 ILE B 36 -25.437 -11.656 0.062 1.00 1.12 H new ATOM 0 HG13 ILE B 36 -26.688 -12.740 -0.514 1.00 1.12 H new ATOM 0 HG21 ILE B 36 -23.185 -12.452 -1.790 1.00 1.04 H new ATOM 0 HG22 ILE B 36 -23.619 -11.438 -3.187 1.00 1.04 H new ATOM 0 HG23 ILE B 36 -23.703 -10.768 -1.540 1.00 1.04 H new ATOM 0 HD11 ILE B 36 -25.125 -13.909 0.961 1.00 1.18 H new ATOM 0 HD12 ILE B 36 -25.039 -14.571 -0.689 1.00 1.18 H new ATOM 0 HD13 ILE B 36 -23.769 -13.470 -0.104 1.00 1.18 H new ATOM 1272 N ASP C 91 20.910 -4.089 -5.180 1.00 1.08 N ATOM 1273 CA ASP C 91 21.844 -2.978 -5.374 1.00 1.09 C ATOM 1274 C ASP C 91 23.161 -3.235 -4.652 1.00 1.14 C ATOM 1275 O ASP C 91 24.220 -3.292 -5.273 1.00 1.53 O ATOM 1276 CB ASP C 91 21.236 -1.669 -4.870 1.00 1.03 C ATOM 1277 CG ASP C 91 22.174 -0.496 -5.076 1.00 1.19 C ATOM 1278 OD1 ASP C 91 22.180 0.071 -6.184 1.00 1.54 O ATOM 1279 OD2 ASP C 91 22.913 -0.144 -4.131 1.00 1.34 O ATOM 0 HA ASP C 91 22.040 -2.897 -6.443 1.00 1.09 H new ATOM 0 HB2 ASP C 91 20.298 -1.480 -5.391 1.00 1.03 H new ATOM 0 HB3 ASP C 91 20.999 -1.763 -3.810 1.00 1.03 H new ATOM 1284 N GLY C 92 23.089 -3.396 -3.338 1.00 0.94 N ATOM 1285 CA GLY C 92 24.287 -3.652 -2.571 1.00 1.00 C ATOM 1286 C GLY C 92 24.245 -3.012 -1.203 1.00 0.95 C ATOM 1287 O GLY C 92 24.383 -3.696 -0.189 1.00 1.04 O ATOM 0 H GLY C 92 22.227 -3.354 -2.794 1.00 0.94 H new ATOM 0 HA2 GLY C 92 24.421 -4.728 -2.461 1.00 1.00 H new ATOM 0 HA3 GLY C 92 25.152 -3.277 -3.118 1.00 1.00 H new ATOM 1291 N LEU C 93 24.045 -1.705 -1.171 1.00 0.88 N ATOM 1292 CA LEU C 93 23.988 -0.980 0.088 1.00 0.88 C ATOM 1293 C LEU C 93 22.656 -0.258 0.250 1.00 0.83 C ATOM 1294 O LEU C 93 21.992 0.070 -0.734 1.00 0.84 O ATOM 1295 CB LEU C 93 25.143 0.018 0.189 1.00 0.98 C ATOM 1296 CG LEU C 93 26.318 -0.443 1.054 1.00 1.17 C ATOM 1297 CD1 LEU C 93 27.500 0.494 0.882 1.00 1.58 C ATOM 1298 CD2 LEU C 93 25.906 -0.515 2.517 1.00 1.17 C ATOM 0 H LEU C 93 23.920 -1.125 -2.001 1.00 0.88 H new ATOM 0 HA LEU C 93 24.081 -1.709 0.893 1.00 0.88 H new ATOM 0 HB2 LEU C 93 25.511 0.229 -0.815 1.00 0.98 H new ATOM 0 HB3 LEU C 93 24.760 0.956 0.592 1.00 0.98 H new ATOM 0 HG LEU C 93 26.616 -1.440 0.730 1.00 1.17 H new ATOM 0 HD11 LEU C 93 28.328 0.153 1.504 1.00 1.58 H new ATOM 0 HD12 LEU C 93 27.810 0.501 -0.163 1.00 1.58 H new ATOM 0 HD13 LEU C 93 27.212 1.502 1.182 1.00 1.58 H new ATOM 0 HD21 LEU C 93 26.754 -0.845 3.118 1.00 1.17 H new ATOM 0 HD22 LEU C 93 25.584 0.471 2.853 1.00 1.17 H new ATOM 0 HD23 LEU C 93 25.085 -1.223 2.629 1.00 1.17 H new ATOM 1310 N CYS C 94 22.286 -0.014 1.498 1.00 0.81 N ATOM 1311 CA CYS C 94 21.038 0.653 1.828 1.00 0.77 C ATOM 1312 C CYS C 94 21.113 2.147 1.560 1.00 0.84 C ATOM 1313 O CYS C 94 22.187 2.713 1.346 1.00 1.04 O ATOM 1314 CB CYS C 94 20.729 0.423 3.303 1.00 0.75 C ATOM 1315 SG CYS C 94 19.002 0.713 3.804 1.00 0.70 S ATOM 0 H CYS C 94 22.844 -0.274 2.311 1.00 0.81 H new ATOM 0 HA CYS C 94 20.251 0.237 1.199 1.00 0.77 H new ATOM 0 HB2 CYS C 94 20.993 -0.604 3.555 1.00 0.75 H new ATOM 0 HB3 CYS C 94 21.374 1.072 3.896 1.00 0.75 H new ATOM 0 HG CYS C 94 18.319 -0.384 3.663 1.00 0.70 H new ATOM 1320 N ALA C 95 19.954 2.773 1.591 1.00 0.79 N ATOM 1321 CA ALA C 95 19.844 4.199 1.387 1.00 0.88 C ATOM 1322 C ALA C 95 19.447 4.858 2.698 1.00 0.82 C ATOM 1323 O ALA C 95 19.422 6.082 2.815 1.00 0.92 O ATOM 1324 CB ALA C 95 18.830 4.502 0.297 1.00 1.00 C ATOM 0 H ALA C 95 19.063 2.305 1.759 1.00 0.79 H new ATOM 0 HA ALA C 95 20.805 4.598 1.064 1.00 0.88 H new ATOM 0 HB1 ALA C 95 18.759 5.580 0.156 1.00 1.00 H new ATOM 0 HB2 ALA C 95 19.147 4.034 -0.635 1.00 1.00 H new ATOM 0 HB3 ALA C 95 17.856 4.109 0.587 1.00 1.00 H new ATOM 1330 N SER C 96 19.141 4.026 3.687 1.00 0.72 N ATOM 1331 CA SER C 96 18.747 4.507 4.999 1.00 0.70 C ATOM 1332 C SER C 96 19.766 4.093 6.056 1.00 0.69 C ATOM 1333 O SER C 96 20.228 4.925 6.843 1.00 0.74 O ATOM 1334 CB SER C 96 17.364 3.974 5.374 1.00 0.70 C ATOM 1335 OG SER C 96 16.372 4.430 4.472 1.00 0.77 O ATOM 0 H SER C 96 19.160 3.010 3.601 1.00 0.72 H new ATOM 0 HA SER C 96 18.707 5.596 4.959 1.00 0.70 H new ATOM 0 HB2 SER C 96 17.381 2.884 5.378 1.00 0.70 H new ATOM 0 HB3 SER C 96 17.112 4.292 6.386 1.00 0.70 H new ATOM 0 HG SER C 96 15.499 4.071 4.737 1.00 0.77 H new ATOM 1341 N CYS C 97 20.131 2.816 6.068 1.00 0.69 N ATOM 1342 CA CYS C 97 21.083 2.326 7.044 1.00 0.69 C ATOM 1343 C CYS C 97 22.449 2.106 6.397 1.00 0.73 C ATOM 1344 O CYS C 97 22.738 2.664 5.336 1.00 0.90 O ATOM 1345 CB CYS C 97 20.556 1.047 7.726 1.00 0.67 C ATOM 1346 SG CYS C 97 20.699 -0.500 6.764 1.00 0.69 S ATOM 0 H CYS C 97 19.783 2.111 5.418 1.00 0.69 H new ATOM 0 HA CYS C 97 21.207 3.080 7.821 1.00 0.69 H new ATOM 0 HB2 CYS C 97 21.091 0.916 8.667 1.00 0.67 H new ATOM 0 HB3 CYS C 97 19.506 1.200 7.975 1.00 0.67 H new ATOM 0 HG CYS C 97 20.106 -0.354 5.616 1.00 0.69 H new ATOM 1351 N ASP C 98 23.288 1.311 7.043 1.00 0.79 N ATOM 1352 CA ASP C 98 24.623 1.036 6.533 1.00 0.82 C ATOM 1353 C ASP C 98 24.868 -0.461 6.427 1.00 0.83 C ATOM 1354 O ASP C 98 26.011 -0.922 6.501 1.00 0.97 O ATOM 1355 CB ASP C 98 25.680 1.670 7.439 1.00 0.86 C ATOM 1356 CG ASP C 98 26.123 3.032 6.946 1.00 0.96 C ATOM 1357 OD1 ASP C 98 27.063 3.096 6.126 1.00 1.32 O ATOM 1358 OD2 ASP C 98 25.543 4.050 7.380 1.00 1.41 O ATOM 0 H ASP C 98 23.068 0.844 7.923 1.00 0.79 H new ATOM 0 HA ASP C 98 24.697 1.471 5.536 1.00 0.82 H new ATOM 0 HB2 ASP C 98 25.280 1.765 8.448 1.00 0.86 H new ATOM 0 HB3 ASP C 98 26.545 1.010 7.500 1.00 0.86 H new ATOM 1363 N LYS C 99 23.797 -1.224 6.277 1.00 0.83 N ATOM 1364 CA LYS C 99 23.905 -2.671 6.153 1.00 0.85 C ATOM 1365 C LYS C 99 23.800 -3.094 4.694 1.00 0.86 C ATOM 1366 O LYS C 99 23.102 -2.458 3.901 1.00 0.92 O ATOM 1367 CB LYS C 99 22.821 -3.372 6.975 1.00 0.82 C ATOM 1368 CG LYS C 99 23.098 -3.378 8.468 1.00 0.90 C ATOM 1369 CD LYS C 99 24.226 -4.335 8.823 1.00 1.00 C ATOM 1370 CE LYS C 99 24.504 -4.332 10.316 1.00 1.21 C ATOM 1371 NZ LYS C 99 25.539 -5.330 10.688 1.00 1.44 N ATOM 0 H LYS C 99 22.842 -0.867 6.238 1.00 0.83 H new ATOM 0 HA LYS C 99 24.881 -2.966 6.538 1.00 0.85 H new ATOM 0 HB2 LYS C 99 21.865 -2.881 6.793 1.00 0.82 H new ATOM 0 HB3 LYS C 99 22.722 -4.401 6.628 1.00 0.82 H new ATOM 0 HG2 LYS C 99 23.358 -2.371 8.795 1.00 0.90 H new ATOM 0 HG3 LYS C 99 22.194 -3.664 9.005 1.00 0.90 H new ATOM 0 HD2 LYS C 99 23.965 -5.343 8.502 1.00 1.00 H new ATOM 0 HD3 LYS C 99 25.129 -4.052 8.282 1.00 1.00 H new ATOM 0 HE2 LYS C 99 24.831 -3.338 10.623 1.00 1.21 H new ATOM 0 HE3 LYS C 99 23.582 -4.546 10.857 1.00 1.21 H new ATOM 0 HZ1 LYS C 99 25.700 -5.297 11.715 1.00 1.44 H new ATOM 0 HZ2 LYS C 99 25.217 -6.281 10.419 1.00 1.44 H new ATOM 0 HZ3 LYS C 99 26.426 -5.112 10.191 1.00 1.44 H new ATOM 1385 N ARG C 100 24.498 -4.166 4.345 1.00 0.84 N ATOM 1386 CA ARG C 100 24.480 -4.676 2.984 1.00 0.88 C ATOM 1387 C ARG C 100 23.155 -5.373 2.699 1.00 0.85 C ATOM 1388 O ARG C 100 22.523 -5.924 3.605 1.00 0.85 O ATOM 1389 CB ARG C 100 25.647 -5.640 2.762 1.00 0.94 C ATOM 1390 CG ARG C 100 26.954 -4.942 2.427 1.00 1.08 C ATOM 1391 CD ARG C 100 28.152 -5.831 2.725 1.00 1.14 C ATOM 1392 NE ARG C 100 28.303 -6.079 4.158 1.00 1.20 N ATOM 1393 CZ ARG C 100 29.180 -5.448 4.941 1.00 1.28 C ATOM 1394 NH1 ARG C 100 29.996 -4.526 4.436 1.00 1.42 N ATOM 1395 NH2 ARG C 100 29.233 -5.734 6.236 1.00 1.48 N ATOM 0 H ARG C 100 25.084 -4.699 4.988 1.00 0.84 H new ATOM 0 HA ARG C 100 24.587 -3.837 2.296 1.00 0.88 H new ATOM 0 HB2 ARG C 100 25.786 -6.243 3.660 1.00 0.94 H new ATOM 0 HB3 ARG C 100 25.393 -6.326 1.954 1.00 0.94 H new ATOM 0 HG2 ARG C 100 26.959 -4.663 1.373 1.00 1.08 H new ATOM 0 HG3 ARG C 100 27.033 -4.019 3.001 1.00 1.08 H new ATOM 0 HD2 ARG C 100 28.039 -6.781 2.202 1.00 1.14 H new ATOM 0 HD3 ARG C 100 29.057 -5.361 2.340 1.00 1.14 H new ATOM 0 HE ARG C 100 27.699 -6.780 4.587 1.00 1.20 H new ATOM 0 HH11 ARG C 100 29.954 -4.297 3.443 1.00 1.42 H new ATOM 0 HH12 ARG C 100 30.663 -4.049 5.042 1.00 1.42 H new ATOM 0 HH21 ARG C 100 28.605 -6.434 6.630 1.00 1.48 H new ATOM 0 HH22 ARG C 100 29.902 -5.254 6.837 1.00 1.48 H new ATOM 1409 N ILE C 101 22.732 -5.336 1.449 1.00 0.88 N ATOM 1410 CA ILE C 101 21.482 -5.960 1.055 1.00 0.86 C ATOM 1411 C ILE C 101 21.735 -7.373 0.543 1.00 0.90 C ATOM 1412 O ILE C 101 22.619 -7.593 -0.290 1.00 0.95 O ATOM 1413 CB ILE C 101 20.757 -5.145 -0.033 1.00 0.87 C ATOM 1414 CG1 ILE C 101 20.820 -3.650 0.292 1.00 0.83 C ATOM 1415 CG2 ILE C 101 19.310 -5.605 -0.160 1.00 0.90 C ATOM 1416 CD1 ILE C 101 20.222 -2.773 -0.783 1.00 0.84 C ATOM 0 H ILE C 101 23.236 -4.880 0.688 1.00 0.88 H new ATOM 0 HA ILE C 101 20.844 -5.996 1.938 1.00 0.86 H new ATOM 0 HB ILE C 101 21.257 -5.311 -0.987 1.00 0.87 H new ATOM 0 HG12 ILE C 101 20.297 -3.468 1.231 1.00 0.83 H new ATOM 0 HG13 ILE C 101 21.860 -3.364 0.446 1.00 0.83 H new ATOM 0 HG21 ILE C 101 18.809 -5.021 -0.932 1.00 0.90 H new ATOM 0 HG22 ILE C 101 19.286 -6.661 -0.431 1.00 0.90 H new ATOM 0 HG23 ILE C 101 18.798 -5.463 0.792 1.00 0.90 H new ATOM 0 HD11 ILE C 101 20.301 -1.727 -0.485 1.00 0.84 H new ATOM 0 HD12 ILE C 101 20.760 -2.926 -1.718 1.00 0.84 H new ATOM 0 HD13 ILE C 101 19.172 -3.032 -0.922 1.00 0.84 H new ATOM 1428 N ARG C 102 20.972 -8.323 1.059 1.00 0.89 N ATOM 1429 CA ARG C 102 21.102 -9.718 0.663 1.00 0.92 C ATOM 1430 C ARG C 102 19.761 -10.242 0.156 1.00 0.91 C ATOM 1431 O ARG C 102 18.902 -9.455 -0.242 1.00 0.90 O ATOM 1432 CB ARG C 102 21.596 -10.562 1.841 1.00 0.95 C ATOM 1433 CG ARG C 102 22.962 -10.141 2.365 1.00 1.01 C ATOM 1434 CD ARG C 102 24.091 -10.625 1.462 1.00 1.09 C ATOM 1435 NE ARG C 102 24.076 -9.979 0.148 1.00 1.15 N ATOM 1436 CZ ARG C 102 24.662 -10.483 -0.938 1.00 1.37 C ATOM 1437 NH1 ARG C 102 25.323 -11.635 -0.872 1.00 1.55 N ATOM 1438 NH2 ARG C 102 24.590 -9.832 -2.093 1.00 1.48 N ATOM 0 H ARG C 102 20.250 -8.152 1.759 1.00 0.89 H new ATOM 0 HA ARG C 102 21.834 -9.790 -0.142 1.00 0.92 H new ATOM 0 HB2 ARG C 102 20.870 -10.498 2.652 1.00 0.95 H new ATOM 0 HB3 ARG C 102 21.641 -11.607 1.534 1.00 0.95 H new ATOM 0 HG2 ARG C 102 23.001 -9.055 2.445 1.00 1.01 H new ATOM 0 HG3 ARG C 102 23.104 -10.540 3.369 1.00 1.01 H new ATOM 0 HD2 ARG C 102 25.048 -10.432 1.947 1.00 1.09 H new ATOM 0 HD3 ARG C 102 24.011 -11.704 1.333 1.00 1.09 H new ATOM 0 HE ARG C 102 23.587 -9.088 0.058 1.00 1.15 H new ATOM 0 HH11 ARG C 102 25.384 -12.138 0.013 1.00 1.55 H new ATOM 0 HH12 ARG C 102 25.769 -12.015 -1.707 1.00 1.55 H new ATOM 0 HH21 ARG C 102 24.086 -8.947 -2.149 1.00 1.48 H new ATOM 0 HH22 ARG C 102 25.038 -10.217 -2.924 1.00 1.48 H new ATOM 1452 N ALA C 103 19.582 -11.564 0.180 1.00 0.94 N ATOM 1453 CA ALA C 103 18.335 -12.179 -0.276 1.00 0.96 C ATOM 1454 C ALA C 103 17.181 -11.804 0.646 1.00 0.94 C ATOM 1455 O ALA C 103 16.011 -11.888 0.272 1.00 1.30 O ATOM 1456 CB ALA C 103 18.483 -13.693 -0.357 1.00 1.06 C ATOM 0 H ALA C 103 20.283 -12.228 0.510 1.00 0.94 H new ATOM 0 HA ALA C 103 18.113 -11.801 -1.274 1.00 0.96 H new ATOM 0 HB1 ALA C 103 17.546 -14.132 -0.698 1.00 1.06 H new ATOM 0 HB2 ALA C 103 19.278 -13.944 -1.059 1.00 1.06 H new ATOM 0 HB3 ALA C 103 18.732 -14.088 0.628 1.00 1.06 H new ATOM 1462 N TYR C 104 17.524 -11.396 1.858 1.00 0.87 N ATOM 1463 CA TYR C 104 16.535 -10.982 2.835 1.00 0.81 C ATOM 1464 C TYR C 104 16.250 -9.491 2.662 1.00 0.74 C ATOM 1465 O TYR C 104 16.585 -8.668 3.517 1.00 0.82 O ATOM 1466 CB TYR C 104 17.033 -11.292 4.254 1.00 0.86 C ATOM 1467 CG TYR C 104 16.031 -10.984 5.349 1.00 0.89 C ATOM 1468 CD1 TYR C 104 14.770 -11.568 5.358 1.00 0.98 C ATOM 1469 CD2 TYR C 104 16.352 -10.103 6.372 1.00 0.90 C ATOM 1470 CE1 TYR C 104 13.859 -11.281 6.357 1.00 1.08 C ATOM 1471 CE2 TYR C 104 15.447 -9.810 7.371 1.00 1.00 C ATOM 1472 CZ TYR C 104 14.203 -10.401 7.362 1.00 1.08 C ATOM 1473 OH TYR C 104 13.302 -10.103 8.358 1.00 1.23 O ATOM 0 H TYR C 104 18.488 -11.343 2.188 1.00 0.87 H new ATOM 0 HA TYR C 104 15.608 -11.534 2.680 1.00 0.81 H new ATOM 0 HB2 TYR C 104 17.301 -12.347 4.310 1.00 0.86 H new ATOM 0 HB3 TYR C 104 17.943 -10.721 4.440 1.00 0.86 H new ATOM 0 HD1 TYR C 104 14.498 -12.257 4.572 1.00 0.98 H new ATOM 0 HD2 TYR C 104 17.327 -9.639 6.386 1.00 0.90 H new ATOM 0 HE1 TYR C 104 12.883 -11.743 6.351 1.00 1.08 H new ATOM 0 HE2 TYR C 104 15.713 -9.119 8.158 1.00 1.00 H new ATOM 0 HH TYR C 104 13.706 -9.468 8.985 1.00 1.23 H new ATOM 1483 N GLU C 105 15.671 -9.149 1.522 1.00 0.87 N ATOM 1484 CA GLU C 105 15.339 -7.767 1.218 1.00 0.84 C ATOM 1485 C GLU C 105 13.836 -7.535 1.338 1.00 0.74 C ATOM 1486 O GLU C 105 13.394 -6.774 2.197 1.00 0.74 O ATOM 1487 CB GLU C 105 15.838 -7.385 -0.182 1.00 0.96 C ATOM 1488 CG GLU C 105 15.637 -8.472 -1.227 1.00 1.04 C ATOM 1489 CD GLU C 105 14.890 -7.970 -2.444 1.00 1.16 C ATOM 1490 OE1 GLU C 105 13.782 -7.417 -2.276 1.00 1.55 O ATOM 1491 OE2 GLU C 105 15.411 -8.123 -3.568 1.00 1.43 O ATOM 0 H GLU C 105 15.421 -9.813 0.789 1.00 0.87 H new ATOM 0 HA GLU C 105 15.841 -7.128 1.944 1.00 0.84 H new ATOM 0 HB2 GLU C 105 15.321 -6.482 -0.507 1.00 0.96 H new ATOM 0 HB3 GLU C 105 16.899 -7.142 -0.125 1.00 0.96 H new ATOM 0 HG2 GLU C 105 16.608 -8.861 -1.534 1.00 1.04 H new ATOM 0 HG3 GLU C 105 15.087 -9.302 -0.783 1.00 1.04 H new ATOM 1498 N MET C 106 13.067 -8.208 0.477 1.00 0.74 N ATOM 1499 CA MET C 106 11.608 -8.091 0.463 1.00 0.75 C ATOM 1500 C MET C 106 11.203 -6.629 0.326 1.00 0.66 C ATOM 1501 O MET C 106 10.322 -6.140 1.036 1.00 0.73 O ATOM 1502 CB MET C 106 11.001 -8.708 1.729 1.00 0.84 C ATOM 1503 CG MET C 106 11.346 -10.176 1.912 1.00 0.94 C ATOM 1504 SD MET C 106 10.587 -10.898 3.382 1.00 1.07 S ATOM 1505 CE MET C 106 11.362 -12.514 3.397 1.00 1.19 C ATOM 0 H MET C 106 13.438 -8.847 -0.227 1.00 0.74 H new ATOM 0 HA MET C 106 11.222 -8.641 -0.395 1.00 0.75 H new ATOM 0 HB2 MET C 106 11.349 -8.150 2.598 1.00 0.84 H new ATOM 0 HB3 MET C 106 9.917 -8.599 1.693 1.00 0.84 H new ATOM 0 HG2 MET C 106 11.023 -10.732 1.032 1.00 0.94 H new ATOM 0 HG3 MET C 106 12.429 -10.284 1.978 1.00 0.94 H new ATOM 0 HE1 MET C 106 10.996 -13.085 4.250 1.00 1.19 H new ATOM 0 HE2 MET C 106 11.119 -13.042 2.475 1.00 1.19 H new ATOM 0 HE3 MET C 106 12.443 -12.398 3.475 1.00 1.19 H new ATOM 1515 N THR C 107 11.853 -5.949 -0.603 1.00 0.59 N ATOM 1516 CA THR C 107 11.608 -4.539 -0.833 1.00 0.52 C ATOM 1517 C THR C 107 10.785 -4.321 -2.100 1.00 0.54 C ATOM 1518 O THR C 107 10.490 -5.266 -2.836 1.00 0.68 O ATOM 1519 CB THR C 107 12.944 -3.775 -0.929 1.00 0.55 C ATOM 1520 OG1 THR C 107 12.746 -2.378 -0.679 1.00 0.56 O ATOM 1521 CG2 THR C 107 13.602 -3.971 -2.288 1.00 0.70 C ATOM 0 H THR C 107 12.560 -6.357 -1.214 1.00 0.59 H new ATOM 0 HA THR C 107 11.037 -4.154 0.012 1.00 0.52 H new ATOM 0 HB THR C 107 13.609 -4.182 -0.167 1.00 0.55 H new ATOM 0 HG1 THR C 107 13.485 -2.035 -0.134 1.00 0.56 H new ATOM 0 HG21 THR C 107 14.541 -3.419 -2.321 1.00 0.70 H new ATOM 0 HG22 THR C 107 13.799 -5.031 -2.447 1.00 0.70 H new ATOM 0 HG23 THR C 107 12.938 -3.604 -3.070 1.00 0.70 H new ATOM 1529 N MET C 108 10.419 -3.072 -2.343 1.00 0.52 N ATOM 1530 CA MET C 108 9.636 -2.711 -3.512 1.00 0.55 C ATOM 1531 C MET C 108 10.528 -2.027 -4.538 1.00 0.58 C ATOM 1532 O MET C 108 11.540 -1.421 -4.181 1.00 0.63 O ATOM 1533 CB MET C 108 8.485 -1.781 -3.117 1.00 0.55 C ATOM 1534 CG MET C 108 7.117 -2.450 -3.119 1.00 0.64 C ATOM 1535 SD MET C 108 6.960 -3.742 -1.870 1.00 1.11 S ATOM 1536 CE MET C 108 7.198 -2.799 -0.365 1.00 1.04 C ATOM 0 H MET C 108 10.655 -2.285 -1.739 1.00 0.52 H new ATOM 0 HA MET C 108 9.217 -3.618 -3.948 1.00 0.55 H new ATOM 0 HB2 MET C 108 8.680 -1.381 -2.122 1.00 0.55 H new ATOM 0 HB3 MET C 108 8.465 -0.934 -3.803 1.00 0.55 H new ATOM 0 HG2 MET C 108 6.349 -1.695 -2.950 1.00 0.64 H new ATOM 0 HG3 MET C 108 6.931 -2.880 -4.103 1.00 0.64 H new ATOM 0 HE1 MET C 108 6.789 -3.353 0.480 1.00 1.04 H new ATOM 0 HE2 MET C 108 8.263 -2.629 -0.207 1.00 1.04 H new ATOM 0 HE3 MET C 108 6.686 -1.840 -0.452 1.00 1.04 H new ATOM 1546 N ARG C 109 10.157 -2.127 -5.809 1.00 0.60 N ATOM 1547 CA ARG C 109 10.933 -1.519 -6.880 1.00 0.66 C ATOM 1548 C ARG C 109 10.930 0.005 -6.764 1.00 0.63 C ATOM 1549 O ARG C 109 9.872 0.641 -6.795 1.00 0.72 O ATOM 1550 CB ARG C 109 10.384 -1.940 -8.245 1.00 0.76 C ATOM 1551 CG ARG C 109 11.467 -2.251 -9.265 1.00 0.88 C ATOM 1552 CD ARG C 109 12.105 -3.605 -9.002 1.00 1.00 C ATOM 1553 NE ARG C 109 13.384 -3.757 -9.695 1.00 1.13 N ATOM 1554 CZ ARG C 109 13.623 -4.656 -10.650 1.00 1.29 C ATOM 1555 NH1 ARG C 109 12.654 -5.459 -11.079 1.00 1.48 N ATOM 1556 NH2 ARG C 109 14.833 -4.741 -11.191 1.00 1.48 N ATOM 0 H ARG C 109 9.323 -2.624 -6.122 1.00 0.60 H new ATOM 0 HA ARG C 109 11.961 -1.869 -6.788 1.00 0.66 H new ATOM 0 HB2 ARG C 109 9.752 -2.819 -8.118 1.00 0.76 H new ATOM 0 HB3 ARG C 109 9.748 -1.144 -8.633 1.00 0.76 H new ATOM 0 HG2 ARG C 109 11.039 -2.237 -10.267 1.00 0.88 H new ATOM 0 HG3 ARG C 109 12.232 -1.475 -9.234 1.00 0.88 H new ATOM 0 HD2 ARG C 109 12.257 -3.731 -7.930 1.00 1.00 H new ATOM 0 HD3 ARG C 109 11.424 -4.394 -9.322 1.00 1.00 H new ATOM 0 HE ARG C 109 14.145 -3.132 -9.429 1.00 1.13 H new ATOM 0 HH11 ARG C 109 11.719 -5.390 -10.677 1.00 1.48 H new ATOM 0 HH12 ARG C 109 12.846 -6.144 -11.810 1.00 1.48 H new ATOM 0 HH21 ARG C 109 15.577 -4.119 -10.876 1.00 1.48 H new ATOM 0 HH22 ARG C 109 15.018 -5.428 -11.922 1.00 1.48 H new ATOM 1570 N VAL C 110 12.117 0.579 -6.609 1.00 0.64 N ATOM 1571 CA VAL C 110 12.268 2.024 -6.495 1.00 0.62 C ATOM 1572 C VAL C 110 13.140 2.551 -7.632 1.00 0.70 C ATOM 1573 O VAL C 110 13.373 1.846 -8.613 1.00 0.79 O ATOM 1574 CB VAL C 110 12.886 2.433 -5.138 1.00 0.66 C ATOM 1575 CG1 VAL C 110 11.962 2.062 -3.986 1.00 1.02 C ATOM 1576 CG2 VAL C 110 14.256 1.797 -4.958 1.00 0.87 C ATOM 0 H VAL C 110 12.994 0.061 -6.559 1.00 0.64 H new ATOM 0 HA VAL C 110 11.272 2.462 -6.558 1.00 0.62 H new ATOM 0 HB VAL C 110 13.010 3.516 -5.135 1.00 0.66 H new ATOM 0 HG11 VAL C 110 12.419 2.360 -3.042 1.00 1.02 H new ATOM 0 HG12 VAL C 110 11.008 2.575 -4.105 1.00 1.02 H new ATOM 0 HG13 VAL C 110 11.797 0.985 -3.985 1.00 1.02 H new ATOM 0 HG21 VAL C 110 14.673 2.098 -3.997 1.00 0.87 H new ATOM 0 HG22 VAL C 110 14.160 0.712 -4.988 1.00 0.87 H new ATOM 0 HG23 VAL C 110 14.918 2.125 -5.759 1.00 0.87 H new ATOM 1586 N LYS C 111 13.628 3.782 -7.489 1.00 0.73 N ATOM 1587 CA LYS C 111 14.471 4.402 -8.508 1.00 0.83 C ATOM 1588 C LYS C 111 15.730 3.576 -8.774 1.00 0.85 C ATOM 1589 O LYS C 111 15.928 3.074 -9.881 1.00 0.93 O ATOM 1590 CB LYS C 111 14.850 5.826 -8.091 1.00 0.89 C ATOM 1591 CG LYS C 111 13.646 6.737 -7.883 1.00 0.89 C ATOM 1592 CD LYS C 111 14.043 8.208 -7.887 1.00 0.99 C ATOM 1593 CE LYS C 111 14.327 8.710 -9.298 1.00 1.22 C ATOM 1594 NZ LYS C 111 14.590 10.173 -9.328 1.00 1.41 N ATOM 0 H LYS C 111 13.453 4.371 -6.675 1.00 0.73 H new ATOM 0 HA LYS C 111 13.897 4.442 -9.434 1.00 0.83 H new ATOM 0 HB2 LYS C 111 15.428 5.784 -7.168 1.00 0.89 H new ATOM 0 HB3 LYS C 111 15.497 6.260 -8.853 1.00 0.89 H new ATOM 0 HG2 LYS C 111 12.913 6.556 -8.669 1.00 0.89 H new ATOM 0 HG3 LYS C 111 13.165 6.493 -6.936 1.00 0.89 H new ATOM 0 HD2 LYS C 111 13.244 8.802 -7.443 1.00 0.99 H new ATOM 0 HD3 LYS C 111 14.928 8.348 -7.266 1.00 0.99 H new ATOM 0 HE2 LYS C 111 15.187 8.179 -9.705 1.00 1.22 H new ATOM 0 HE3 LYS C 111 13.478 8.481 -9.942 1.00 1.22 H new ATOM 0 HZ1 LYS C 111 14.778 10.472 -10.306 1.00 1.41 H new ATOM 0 HZ2 LYS C 111 13.760 10.683 -8.964 1.00 1.41 H new ATOM 0 HZ3 LYS C 111 15.416 10.389 -8.735 1.00 1.41 H new ATOM 1608 N ASP C 112 16.575 3.427 -7.762 1.00 0.80 N ATOM 1609 CA ASP C 112 17.806 2.657 -7.911 1.00 0.83 C ATOM 1610 C ASP C 112 18.176 1.978 -6.600 1.00 0.79 C ATOM 1611 O ASP C 112 17.955 0.778 -6.436 1.00 0.80 O ATOM 1612 CB ASP C 112 18.956 3.550 -8.389 1.00 0.94 C ATOM 1613 CG ASP C 112 20.218 2.759 -8.686 1.00 0.96 C ATOM 1614 OD1 ASP C 112 20.113 1.632 -9.216 1.00 1.16 O ATOM 1615 OD2 ASP C 112 21.323 3.264 -8.395 1.00 0.98 O ATOM 0 H ASP C 112 16.433 3.826 -6.834 1.00 0.80 H new ATOM 0 HA ASP C 112 17.632 1.889 -8.665 1.00 0.83 H new ATOM 0 HB2 ASP C 112 18.647 4.086 -9.286 1.00 0.94 H new ATOM 0 HB3 ASP C 112 19.171 4.300 -7.627 1.00 0.94 H new ATOM 1620 N LYS C 113 18.727 2.749 -5.666 1.00 0.83 N ATOM 1621 CA LYS C 113 19.112 2.215 -4.365 1.00 0.85 C ATOM 1622 C LYS C 113 17.869 1.773 -3.595 1.00 0.74 C ATOM 1623 O LYS C 113 17.055 2.596 -3.170 1.00 0.73 O ATOM 1624 CB LYS C 113 19.917 3.254 -3.566 1.00 0.96 C ATOM 1625 CG LYS C 113 19.293 4.645 -3.529 1.00 0.99 C ATOM 1626 CD LYS C 113 20.202 5.648 -2.835 1.00 1.20 C ATOM 1627 CE LYS C 113 19.493 6.971 -2.589 1.00 1.15 C ATOM 1628 NZ LYS C 113 20.406 7.991 -2.008 1.00 1.42 N ATOM 0 H LYS C 113 18.916 3.744 -5.787 1.00 0.83 H new ATOM 0 HA LYS C 113 19.752 1.346 -4.517 1.00 0.85 H new ATOM 0 HB2 LYS C 113 20.035 2.895 -2.544 1.00 0.96 H new ATOM 0 HB3 LYS C 113 20.916 3.329 -3.995 1.00 0.96 H new ATOM 0 HG2 LYS C 113 19.090 4.980 -4.546 1.00 0.99 H new ATOM 0 HG3 LYS C 113 18.335 4.601 -3.010 1.00 0.99 H new ATOM 0 HD2 LYS C 113 20.542 5.235 -1.885 1.00 1.20 H new ATOM 0 HD3 LYS C 113 21.089 5.818 -3.445 1.00 1.20 H new ATOM 0 HE2 LYS C 113 19.084 7.343 -3.528 1.00 1.15 H new ATOM 0 HE3 LYS C 113 18.651 6.812 -1.915 1.00 1.15 H new ATOM 0 HZ1 LYS C 113 19.884 8.878 -1.856 1.00 1.42 H new ATOM 0 HZ2 LYS C 113 20.777 7.647 -1.099 1.00 1.42 H new ATOM 0 HZ3 LYS C 113 21.196 8.162 -2.662 1.00 1.42 H new ATOM 1642 N VAL C 114 17.715 0.464 -3.455 1.00 0.73 N ATOM 1643 CA VAL C 114 16.570 -0.103 -2.759 1.00 0.67 C ATOM 1644 C VAL C 114 16.784 -0.113 -1.250 1.00 0.68 C ATOM 1645 O VAL C 114 17.911 -0.234 -0.765 1.00 0.86 O ATOM 1646 CB VAL C 114 16.253 -1.535 -3.247 1.00 0.72 C ATOM 1647 CG1 VAL C 114 15.675 -1.515 -4.656 1.00 0.69 C ATOM 1648 CG2 VAL C 114 17.489 -2.420 -3.190 1.00 0.85 C ATOM 0 H VAL C 114 18.372 -0.228 -3.816 1.00 0.73 H new ATOM 0 HA VAL C 114 15.719 0.537 -2.990 1.00 0.67 H new ATOM 0 HB VAL C 114 15.504 -1.955 -2.576 1.00 0.72 H new ATOM 0 HG11 VAL C 114 15.461 -2.535 -4.976 1.00 0.69 H new ATOM 0 HG12 VAL C 114 14.754 -0.931 -4.663 1.00 0.69 H new ATOM 0 HG13 VAL C 114 16.396 -1.065 -5.339 1.00 0.69 H new ATOM 0 HG21 VAL C 114 17.236 -3.421 -3.539 1.00 0.85 H new ATOM 0 HG22 VAL C 114 18.267 -2.000 -3.827 1.00 0.85 H new ATOM 0 HG23 VAL C 114 17.851 -2.474 -2.163 1.00 0.85 H new ATOM 1658 N TYR C 115 15.690 0.021 -0.516 1.00 0.64 N ATOM 1659 CA TYR C 115 15.732 0.032 0.939 1.00 0.63 C ATOM 1660 C TYR C 115 15.486 -1.370 1.495 1.00 0.64 C ATOM 1661 O TYR C 115 15.149 -2.293 0.756 1.00 0.91 O ATOM 1662 CB TYR C 115 14.665 0.983 1.496 1.00 0.63 C ATOM 1663 CG TYR C 115 14.754 2.409 0.985 1.00 0.69 C ATOM 1664 CD1 TYR C 115 14.105 2.799 -0.184 1.00 0.85 C ATOM 1665 CD2 TYR C 115 15.477 3.369 1.681 1.00 0.85 C ATOM 1666 CE1 TYR C 115 14.178 4.103 -0.641 1.00 0.93 C ATOM 1667 CE2 TYR C 115 15.555 4.674 1.229 1.00 0.99 C ATOM 1668 CZ TYR C 115 14.903 5.034 0.070 1.00 0.93 C ATOM 1669 OH TYR C 115 14.984 6.331 -0.384 1.00 1.09 O ATOM 0 H TYR C 115 14.754 0.125 -0.908 1.00 0.64 H new ATOM 0 HA TYR C 115 16.721 0.373 1.244 1.00 0.63 H new ATOM 0 HB2 TYR C 115 13.680 0.585 1.251 1.00 0.63 H new ATOM 0 HB3 TYR C 115 14.742 0.996 2.583 1.00 0.63 H new ATOM 0 HD1 TYR C 115 13.535 2.071 -0.743 1.00 0.85 H new ATOM 0 HD2 TYR C 115 15.987 3.092 2.591 1.00 0.85 H new ATOM 0 HE1 TYR C 115 13.670 4.389 -1.550 1.00 0.93 H new ATOM 0 HE2 TYR C 115 16.124 5.407 1.782 1.00 0.99 H new ATOM 0 HH TYR C 115 15.532 6.860 0.233 1.00 1.09 H new ATOM 1679 N HIS C 116 15.656 -1.519 2.800 1.00 0.56 N ATOM 1680 CA HIS C 116 15.423 -2.799 3.462 1.00 0.54 C ATOM 1681 C HIS C 116 13.961 -2.886 3.877 1.00 0.51 C ATOM 1682 O HIS C 116 13.269 -1.873 3.881 1.00 0.50 O ATOM 1683 CB HIS C 116 16.314 -2.947 4.699 1.00 0.57 C ATOM 1684 CG HIS C 116 17.714 -3.380 4.402 1.00 0.61 C ATOM 1685 ND1 HIS C 116 18.821 -2.608 4.681 1.00 0.63 N ATOM 1686 CD2 HIS C 116 18.187 -4.531 3.870 1.00 0.67 C ATOM 1687 CE1 HIS C 116 19.914 -3.265 4.331 1.00 0.68 C ATOM 1688 NE2 HIS C 116 19.558 -4.440 3.836 1.00 0.71 N ATOM 0 H HIS C 116 15.955 -0.770 3.424 1.00 0.56 H new ATOM 0 HA HIS C 116 15.666 -3.602 2.766 1.00 0.54 H new ATOM 0 HB2 HIS C 116 16.345 -1.993 5.226 1.00 0.57 H new ATOM 0 HB3 HIS C 116 15.859 -3.670 5.376 1.00 0.57 H new ATOM 0 HD1 HIS C 116 18.800 -1.675 5.093 1.00 0.63 H new ATOM 0 HD2 HIS C 116 17.595 -5.369 3.533 1.00 0.67 H new ATOM 0 HE1 HIS C 116 20.927 -2.904 4.432 1.00 0.68 H new ATOM 1696 N LEU C 117 13.496 -4.077 4.244 1.00 0.53 N ATOM 1697 CA LEU C 117 12.102 -4.253 4.660 1.00 0.54 C ATOM 1698 C LEU C 117 11.809 -3.477 5.944 1.00 0.54 C ATOM 1699 O LEU C 117 10.670 -3.090 6.205 1.00 0.61 O ATOM 1700 CB LEU C 117 11.775 -5.737 4.864 1.00 0.60 C ATOM 1701 CG LEU C 117 12.566 -6.442 5.966 1.00 0.71 C ATOM 1702 CD1 LEU C 117 11.626 -7.135 6.936 1.00 0.90 C ATOM 1703 CD2 LEU C 117 13.545 -7.437 5.367 1.00 1.03 C ATOM 0 H LEU C 117 14.056 -4.929 4.263 1.00 0.53 H new ATOM 0 HA LEU C 117 11.470 -3.860 3.863 1.00 0.54 H new ATOM 0 HB2 LEU C 117 10.712 -5.829 5.089 1.00 0.60 H new ATOM 0 HB3 LEU C 117 11.949 -6.261 3.924 1.00 0.60 H new ATOM 0 HG LEU C 117 13.134 -5.691 6.516 1.00 0.71 H new ATOM 0 HD11 LEU C 117 12.207 -7.631 7.713 1.00 0.90 H new ATOM 0 HD12 LEU C 117 10.965 -6.398 7.392 1.00 0.90 H new ATOM 0 HD13 LEU C 117 11.030 -7.874 6.400 1.00 0.90 H new ATOM 0 HD21 LEU C 117 14.099 -7.929 6.167 1.00 1.03 H new ATOM 0 HD22 LEU C 117 12.998 -8.184 4.792 1.00 1.03 H new ATOM 0 HD23 LEU C 117 14.241 -6.913 4.712 1.00 1.03 H new ATOM 1715 N GLU C 118 12.849 -3.252 6.737 1.00 0.52 N ATOM 1716 CA GLU C 118 12.708 -2.514 7.983 1.00 0.55 C ATOM 1717 C GLU C 118 13.119 -1.057 7.790 1.00 0.52 C ATOM 1718 O GLU C 118 12.809 -0.197 8.615 1.00 0.54 O ATOM 1719 CB GLU C 118 13.550 -3.158 9.086 1.00 0.63 C ATOM 1720 CG GLU C 118 15.049 -3.017 8.879 1.00 0.60 C ATOM 1721 CD GLU C 118 15.781 -4.335 8.985 1.00 0.81 C ATOM 1722 OE1 GLU C 118 15.606 -5.039 9.999 1.00 1.47 O ATOM 1723 OE2 GLU C 118 16.547 -4.673 8.060 1.00 1.05 O ATOM 0 H GLU C 118 13.798 -3.570 6.539 1.00 0.52 H new ATOM 0 HA GLU C 118 11.660 -2.544 8.282 1.00 0.55 H new ATOM 0 HB2 GLU C 118 13.282 -2.710 10.043 1.00 0.63 H new ATOM 0 HB3 GLU C 118 13.300 -4.217 9.149 1.00 0.63 H new ATOM 0 HG2 GLU C 118 15.236 -2.580 7.898 1.00 0.60 H new ATOM 0 HG3 GLU C 118 15.450 -2.323 9.618 1.00 0.60 H new ATOM 1730 N CYS C 119 13.809 -0.789 6.688 1.00 0.52 N ATOM 1731 CA CYS C 119 14.266 0.556 6.380 1.00 0.52 C ATOM 1732 C CYS C 119 13.267 1.278 5.474 1.00 0.49 C ATOM 1733 O CYS C 119 13.370 2.484 5.253 1.00 0.72 O ATOM 1734 CB CYS C 119 15.656 0.498 5.734 1.00 0.56 C ATOM 1735 SG CYS C 119 16.897 -0.386 6.744 1.00 0.60 S ATOM 0 H CYS C 119 14.064 -1.490 5.992 1.00 0.52 H new ATOM 0 HA CYS C 119 14.337 1.124 7.307 1.00 0.52 H new ATOM 0 HB2 CYS C 119 15.576 0.010 4.763 1.00 0.56 H new ATOM 0 HB3 CYS C 119 16.005 1.514 5.552 1.00 0.56 H new ATOM 0 HG CYS C 119 18.091 -0.074 6.335 1.00 0.60 H new ATOM 1740 N PHE C 120 12.299 0.531 4.969 1.00 0.43 N ATOM 1741 CA PHE C 120 11.267 1.086 4.104 1.00 0.37 C ATOM 1742 C PHE C 120 10.051 1.477 4.941 1.00 0.35 C ATOM 1743 O PHE C 120 9.299 0.615 5.396 1.00 0.43 O ATOM 1744 CB PHE C 120 10.868 0.062 3.036 1.00 0.38 C ATOM 1745 CG PHE C 120 10.204 0.663 1.828 1.00 0.37 C ATOM 1746 CD1 PHE C 120 10.900 1.527 0.999 1.00 0.45 C ATOM 1747 CD2 PHE C 120 8.891 0.353 1.515 1.00 0.44 C ATOM 1748 CE1 PHE C 120 10.298 2.073 -0.120 1.00 0.50 C ATOM 1749 CE2 PHE C 120 8.284 0.898 0.400 1.00 0.48 C ATOM 1750 CZ PHE C 120 8.987 1.759 -0.418 1.00 0.47 C ATOM 0 H PHE C 120 12.205 -0.469 5.144 1.00 0.43 H new ATOM 0 HA PHE C 120 11.657 1.974 3.606 1.00 0.37 H new ATOM 0 HB2 PHE C 120 11.758 -0.480 2.716 1.00 0.38 H new ATOM 0 HB3 PHE C 120 10.194 -0.669 3.482 1.00 0.38 H new ATOM 0 HD1 PHE C 120 11.925 1.777 1.229 1.00 0.45 H new ATOM 0 HD2 PHE C 120 8.336 -0.322 2.149 1.00 0.44 H new ATOM 0 HE1 PHE C 120 10.852 2.744 -0.760 1.00 0.50 H new ATOM 0 HE2 PHE C 120 7.259 0.650 0.168 1.00 0.48 H new ATOM 0 HZ PHE C 120 8.513 2.186 -1.289 1.00 0.47 H new ATOM 1760 N LYS C 121 9.881 2.775 5.164 1.00 0.34 N ATOM 1761 CA LYS C 121 8.769 3.285 5.961 1.00 0.35 C ATOM 1762 C LYS C 121 8.566 4.769 5.693 1.00 0.34 C ATOM 1763 O LYS C 121 9.451 5.428 5.149 1.00 0.37 O ATOM 1764 CB LYS C 121 9.025 3.055 7.463 1.00 0.41 C ATOM 1765 CG LYS C 121 10.092 3.969 8.063 1.00 0.50 C ATOM 1766 CD LYS C 121 11.495 3.593 7.604 1.00 0.87 C ATOM 1767 CE LYS C 121 12.491 4.716 7.852 1.00 1.03 C ATOM 1768 NZ LYS C 121 13.652 4.647 6.923 1.00 1.35 N ATOM 0 H LYS C 121 10.503 3.498 4.802 1.00 0.34 H new ATOM 0 HA LYS C 121 7.867 2.744 5.674 1.00 0.35 H new ATOM 0 HB2 LYS C 121 8.091 3.200 8.006 1.00 0.41 H new ATOM 0 HB3 LYS C 121 9.324 2.018 7.615 1.00 0.41 H new ATOM 0 HG2 LYS C 121 9.884 5.001 7.782 1.00 0.50 H new ATOM 0 HG3 LYS C 121 10.042 3.919 9.151 1.00 0.50 H new ATOM 0 HD2 LYS C 121 11.821 2.695 8.130 1.00 0.87 H new ATOM 0 HD3 LYS C 121 11.477 3.351 6.541 1.00 0.87 H new ATOM 0 HE2 LYS C 121 11.990 5.677 7.736 1.00 1.03 H new ATOM 0 HE3 LYS C 121 12.847 4.665 8.881 1.00 1.03 H new ATOM 0 HZ1 LYS C 121 14.411 5.269 7.269 1.00 1.35 H new ATOM 0 HZ2 LYS C 121 14.001 3.668 6.876 1.00 1.35 H new ATOM 0 HZ3 LYS C 121 13.357 4.955 5.975 1.00 1.35 H new ATOM 1782 N CYS C 122 7.400 5.283 6.064 1.00 0.33 N ATOM 1783 CA CYS C 122 7.096 6.689 5.871 1.00 0.32 C ATOM 1784 C CYS C 122 7.969 7.550 6.772 1.00 0.35 C ATOM 1785 O CYS C 122 8.309 7.158 7.892 1.00 0.39 O ATOM 1786 CB CYS C 122 5.622 6.966 6.168 1.00 0.32 C ATOM 1787 SG CYS C 122 5.130 8.712 5.968 1.00 0.35 S ATOM 0 H CYS C 122 6.651 4.744 6.500 1.00 0.33 H new ATOM 0 HA CYS C 122 7.301 6.940 4.830 1.00 0.32 H new ATOM 0 HB2 CYS C 122 5.009 6.350 5.510 1.00 0.32 H new ATOM 0 HB3 CYS C 122 5.405 6.654 7.190 1.00 0.32 H new ATOM 0 HG CYS C 122 3.971 8.772 5.382 1.00 0.35 H new ATOM 1792 N ALA C 123 8.313 8.723 6.282 1.00 0.37 N ATOM 1793 CA ALA C 123 9.138 9.652 7.028 1.00 0.42 C ATOM 1794 C ALA C 123 8.287 10.553 7.910 1.00 0.46 C ATOM 1795 O ALA C 123 8.813 11.304 8.729 1.00 0.54 O ATOM 1796 CB ALA C 123 9.979 10.487 6.077 1.00 0.45 C ATOM 0 H ALA C 123 8.031 9.058 5.361 1.00 0.37 H new ATOM 0 HA ALA C 123 9.800 9.075 7.674 1.00 0.42 H new ATOM 0 HB1 ALA C 123 10.594 11.181 6.649 1.00 0.45 H new ATOM 0 HB2 ALA C 123 10.622 9.832 5.489 1.00 0.45 H new ATOM 0 HB3 ALA C 123 9.325 11.048 5.409 1.00 0.45 H new ATOM 1802 N ALA C 124 6.973 10.469 7.761 1.00 0.41 N ATOM 1803 CA ALA C 124 6.079 11.303 8.547 1.00 0.46 C ATOM 1804 C ALA C 124 5.245 10.499 9.544 1.00 0.47 C ATOM 1805 O ALA C 124 5.308 10.750 10.747 1.00 0.56 O ATOM 1806 CB ALA C 124 5.180 12.117 7.637 1.00 0.47 C ATOM 0 H ALA C 124 6.507 9.838 7.109 1.00 0.41 H new ATOM 0 HA ALA C 124 6.705 11.977 9.132 1.00 0.46 H new ATOM 0 HB1 ALA C 124 4.516 12.736 8.240 1.00 0.47 H new ATOM 0 HB2 ALA C 124 5.791 12.755 6.998 1.00 0.47 H new ATOM 0 HB3 ALA C 124 4.586 11.446 7.017 1.00 0.47 H new ATOM 1812 N CYS C 125 4.475 9.526 9.061 1.00 0.43 N ATOM 1813 CA CYS C 125 3.623 8.744 9.953 1.00 0.45 C ATOM 1814 C CYS C 125 4.227 7.374 10.271 1.00 0.43 C ATOM 1815 O CYS C 125 3.732 6.661 11.149 1.00 0.46 O ATOM 1816 CB CYS C 125 2.208 8.601 9.368 1.00 0.45 C ATOM 1817 SG CYS C 125 2.075 7.563 7.874 1.00 0.41 S ATOM 0 H CYS C 125 4.423 9.264 8.077 1.00 0.43 H new ATOM 0 HA CYS C 125 3.553 9.288 10.895 1.00 0.45 H new ATOM 0 HB2 CYS C 125 1.557 8.185 10.137 1.00 0.45 H new ATOM 0 HB3 CYS C 125 1.829 9.596 9.133 1.00 0.45 H new ATOM 0 HG CYS C 125 0.967 7.838 7.252 1.00 0.41 H new ATOM 1822 N GLN C 126 5.298 7.022 9.563 1.00 0.40 N ATOM 1823 CA GLN C 126 5.989 5.747 9.766 1.00 0.40 C ATOM 1824 C GLN C 126 5.029 4.568 9.619 1.00 0.40 C ATOM 1825 O GLN C 126 4.803 3.817 10.568 1.00 0.56 O ATOM 1826 CB GLN C 126 6.653 5.695 11.149 1.00 0.49 C ATOM 1827 CG GLN C 126 8.034 6.333 11.214 1.00 0.53 C ATOM 1828 CD GLN C 126 7.981 7.837 11.379 1.00 0.57 C ATOM 1829 OE1 GLN C 126 7.848 8.349 12.490 1.00 0.71 O ATOM 1830 NE2 GLN C 126 8.112 8.560 10.280 1.00 0.52 N ATOM 0 H GLN C 126 5.711 7.607 8.836 1.00 0.40 H new ATOM 0 HA GLN C 126 6.759 5.672 8.998 1.00 0.40 H new ATOM 0 HB2 GLN C 126 6.003 6.193 11.868 1.00 0.49 H new ATOM 0 HB3 GLN C 126 6.734 4.653 11.460 1.00 0.49 H new ATOM 0 HG2 GLN C 126 8.590 5.901 12.046 1.00 0.53 H new ATOM 0 HG3 GLN C 126 8.583 6.092 10.304 1.00 0.53 H new ATOM 0 HE21 GLN C 126 8.220 8.099 9.376 1.00 0.52 H new ATOM 0 HE22 GLN C 126 8.105 9.578 10.336 1.00 0.52 H new ATOM 1839 N LYS C 127 4.451 4.415 8.437 1.00 0.39 N ATOM 1840 CA LYS C 127 3.520 3.324 8.187 1.00 0.41 C ATOM 1841 C LYS C 127 3.940 2.514 6.969 1.00 0.37 C ATOM 1842 O LYS C 127 4.677 3.002 6.111 1.00 0.41 O ATOM 1843 CB LYS C 127 2.102 3.863 7.994 1.00 0.44 C ATOM 1844 CG LYS C 127 1.510 4.483 9.251 1.00 0.60 C ATOM 1845 CD LYS C 127 1.208 3.432 10.309 1.00 0.93 C ATOM 1846 CE LYS C 127 1.131 4.048 11.698 1.00 1.17 C ATOM 1847 NZ LYS C 127 2.472 4.446 12.206 1.00 1.58 N ATOM 0 H LYS C 127 4.609 5.030 7.638 1.00 0.39 H new ATOM 0 HA LYS C 127 3.534 2.667 9.057 1.00 0.41 H new ATOM 0 HB2 LYS C 127 2.111 4.610 7.200 1.00 0.44 H new ATOM 0 HB3 LYS C 127 1.456 3.051 7.660 1.00 0.44 H new ATOM 0 HG2 LYS C 127 2.205 5.218 9.656 1.00 0.60 H new ATOM 0 HG3 LYS C 127 0.594 5.017 8.997 1.00 0.60 H new ATOM 0 HD2 LYS C 127 0.264 2.939 10.075 1.00 0.93 H new ATOM 0 HD3 LYS C 127 1.981 2.664 10.292 1.00 0.93 H new ATOM 0 HE2 LYS C 127 0.479 4.921 11.672 1.00 1.17 H new ATOM 0 HE3 LYS C 127 0.680 3.334 12.387 1.00 1.17 H new ATOM 0 HZ1 LYS C 127 2.480 4.390 13.244 1.00 1.58 H new ATOM 0 HZ2 LYS C 127 3.194 3.805 11.819 1.00 1.58 H new ATOM 0 HZ3 LYS C 127 2.680 5.421 11.910 1.00 1.58 H new ATOM 1861 N HIS C 128 3.479 1.269 6.918 1.00 0.40 N ATOM 1862 CA HIS C 128 3.785 0.374 5.808 1.00 0.41 C ATOM 1863 C HIS C 128 3.020 0.793 4.559 1.00 0.39 C ATOM 1864 O HIS C 128 1.860 1.201 4.636 1.00 0.39 O ATOM 1865 CB HIS C 128 3.451 -1.086 6.168 1.00 0.51 C ATOM 1866 CG HIS C 128 1.995 -1.344 6.441 1.00 0.56 C ATOM 1867 ND1 HIS C 128 1.084 -1.643 5.452 1.00 0.68 N ATOM 1868 CD2 HIS C 128 1.299 -1.342 7.602 1.00 0.64 C ATOM 1869 CE1 HIS C 128 -0.108 -1.818 5.996 1.00 0.78 C ATOM 1870 NE2 HIS C 128 -0.006 -1.641 7.298 1.00 0.76 N ATOM 0 H HIS C 128 2.888 0.854 7.638 1.00 0.40 H new ATOM 0 HA HIS C 128 4.854 0.442 5.607 1.00 0.41 H new ATOM 0 HB2 HIS C 128 3.774 -1.731 5.351 1.00 0.51 H new ATOM 0 HB3 HIS C 128 4.029 -1.371 7.047 1.00 0.51 H new ATOM 0 HD2 HIS C 128 1.697 -1.142 8.586 1.00 0.64 H new ATOM 0 HE1 HIS C 128 -1.014 -2.065 5.463 1.00 0.78 H new ATOM 0 HE2 HIS C 128 -0.771 -1.714 7.969 1.00 0.76 H new ATOM 1879 N PHE C 129 3.671 0.673 3.415 1.00 0.39 N ATOM 1880 CA PHE C 129 3.064 1.042 2.147 1.00 0.39 C ATOM 1881 C PHE C 129 2.235 -0.111 1.586 1.00 0.48 C ATOM 1882 O PHE C 129 2.221 -1.211 2.145 1.00 0.56 O ATOM 1883 CB PHE C 129 4.149 1.438 1.138 1.00 0.37 C ATOM 1884 CG PHE C 129 4.930 2.664 1.529 1.00 0.28 C ATOM 1885 CD1 PHE C 129 5.932 2.591 2.488 1.00 0.37 C ATOM 1886 CD2 PHE C 129 4.668 3.886 0.934 1.00 0.21 C ATOM 1887 CE1 PHE C 129 6.652 3.712 2.846 1.00 0.40 C ATOM 1888 CE2 PHE C 129 5.388 5.012 1.290 1.00 0.23 C ATOM 1889 CZ PHE C 129 6.380 4.924 2.247 1.00 0.33 C ATOM 0 H PHE C 129 4.625 0.321 3.338 1.00 0.39 H new ATOM 0 HA PHE C 129 2.405 1.892 2.320 1.00 0.39 H new ATOM 0 HB2 PHE C 129 4.839 0.603 1.016 1.00 0.37 H new ATOM 0 HB3 PHE C 129 3.683 1.611 0.168 1.00 0.37 H new ATOM 0 HD1 PHE C 129 6.150 1.644 2.960 1.00 0.37 H new ATOM 0 HD2 PHE C 129 3.894 3.961 0.185 1.00 0.21 H new ATOM 0 HE1 PHE C 129 7.428 3.640 3.594 1.00 0.40 H new ATOM 0 HE2 PHE C 129 5.174 5.960 0.819 1.00 0.23 H new ATOM 0 HZ PHE C 129 6.942 5.803 2.526 1.00 0.33 H new ATOM 1899 N SER C 130 1.534 0.154 0.497 1.00 0.54 N ATOM 1900 CA SER C 130 0.720 -0.852 -0.161 1.00 0.69 C ATOM 1901 C SER C 130 1.167 -1.010 -1.611 1.00 0.60 C ATOM 1902 O SER C 130 1.440 -0.022 -2.296 1.00 0.80 O ATOM 1903 CB SER C 130 -0.757 -0.461 -0.095 1.00 0.87 C ATOM 1904 OG SER C 130 -0.910 0.922 0.178 1.00 1.44 O ATOM 0 H SER C 130 1.513 1.069 0.046 1.00 0.54 H new ATOM 0 HA SER C 130 0.846 -1.806 0.351 1.00 0.69 H new ATOM 0 HB2 SER C 130 -1.243 -0.704 -1.040 1.00 0.87 H new ATOM 0 HB3 SER C 130 -1.256 -1.044 0.679 1.00 0.87 H new ATOM 0 HG SER C 130 -1.331 1.362 -0.590 1.00 1.44 H new ATOM 1910 N VAL C 131 1.263 -2.250 -2.070 1.00 0.76 N ATOM 1911 CA VAL C 131 1.688 -2.520 -3.435 1.00 0.73 C ATOM 1912 C VAL C 131 0.618 -2.078 -4.433 1.00 0.65 C ATOM 1913 O VAL C 131 -0.523 -2.544 -4.390 1.00 0.73 O ATOM 1914 CB VAL C 131 2.035 -4.017 -3.639 1.00 0.94 C ATOM 1915 CG1 VAL C 131 0.909 -4.918 -3.145 1.00 1.06 C ATOM 1916 CG2 VAL C 131 2.367 -4.309 -5.100 1.00 0.96 C ATOM 0 H VAL C 131 1.053 -3.082 -1.519 1.00 0.76 H new ATOM 0 HA VAL C 131 2.594 -1.941 -3.616 1.00 0.73 H new ATOM 0 HB VAL C 131 2.921 -4.235 -3.043 1.00 0.94 H new ATOM 0 HG11 VAL C 131 1.183 -5.961 -3.302 1.00 1.06 H new ATOM 0 HG12 VAL C 131 0.742 -4.742 -2.082 1.00 1.06 H new ATOM 0 HG13 VAL C 131 -0.004 -4.695 -3.697 1.00 1.06 H new ATOM 0 HG21 VAL C 131 2.607 -5.366 -5.214 1.00 0.96 H new ATOM 0 HG22 VAL C 131 1.509 -4.062 -5.725 1.00 0.96 H new ATOM 0 HG23 VAL C 131 3.223 -3.708 -5.406 1.00 0.96 H new ATOM 1926 N GLY C 132 0.987 -1.153 -5.312 1.00 0.57 N ATOM 1927 CA GLY C 132 0.055 -0.666 -6.308 1.00 0.58 C ATOM 1928 C GLY C 132 -0.476 0.712 -5.981 1.00 0.52 C ATOM 1929 O GLY C 132 -1.361 1.223 -6.669 1.00 0.61 O ATOM 0 H GLY C 132 1.915 -0.732 -5.351 1.00 0.57 H new ATOM 0 HA2 GLY C 132 0.548 -0.641 -7.280 1.00 0.58 H new ATOM 0 HA3 GLY C 132 -0.779 -1.363 -6.392 1.00 0.58 H new ATOM 1933 N ASP C 133 0.057 1.317 -4.930 1.00 0.50 N ATOM 1934 CA ASP C 133 -0.373 2.649 -4.525 1.00 0.49 C ATOM 1935 C ASP C 133 0.709 3.683 -4.804 1.00 0.40 C ATOM 1936 O ASP C 133 1.845 3.343 -5.131 1.00 0.37 O ATOM 1937 CB ASP C 133 -0.765 2.673 -3.047 1.00 0.51 C ATOM 1938 CG ASP C 133 -2.219 2.309 -2.833 1.00 0.73 C ATOM 1939 OD1 ASP C 133 -3.067 2.655 -3.689 1.00 0.85 O ATOM 1940 OD2 ASP C 133 -2.532 1.671 -1.810 1.00 1.06 O ATOM 0 H ASP C 133 0.785 0.910 -4.343 1.00 0.50 H new ATOM 0 HA ASP C 133 -1.251 2.906 -5.117 1.00 0.49 H new ATOM 0 HB2 ASP C 133 -0.133 1.977 -2.494 1.00 0.51 H new ATOM 0 HB3 ASP C 133 -0.578 3.666 -2.640 1.00 0.51 H new ATOM 1945 N ARG C 134 0.349 4.947 -4.665 1.00 0.41 N ATOM 1946 CA ARG C 134 1.270 6.046 -4.922 1.00 0.37 C ATOM 1947 C ARG C 134 2.075 6.395 -3.675 1.00 0.31 C ATOM 1948 O ARG C 134 1.618 6.182 -2.555 1.00 0.31 O ATOM 1949 CB ARG C 134 0.493 7.271 -5.410 1.00 0.44 C ATOM 1950 CG ARG C 134 -0.671 7.653 -4.506 1.00 0.64 C ATOM 1951 CD ARG C 134 -1.979 7.802 -5.277 1.00 0.78 C ATOM 1952 NE ARG C 134 -2.188 6.727 -6.251 1.00 1.08 N ATOM 1953 CZ ARG C 134 -2.634 5.505 -5.945 1.00 1.74 C ATOM 1954 NH1 ARG C 134 -2.885 5.168 -4.681 1.00 2.09 N ATOM 1955 NH2 ARG C 134 -2.831 4.616 -6.911 1.00 2.18 N ATOM 0 H ARG C 134 -0.583 5.242 -4.373 1.00 0.41 H new ATOM 0 HA ARG C 134 1.971 5.731 -5.695 1.00 0.37 H new ATOM 0 HB2 ARG C 134 1.176 8.117 -5.487 1.00 0.44 H new ATOM 0 HB3 ARG C 134 0.114 7.075 -6.413 1.00 0.44 H new ATOM 0 HG2 ARG C 134 -0.792 6.894 -3.733 1.00 0.64 H new ATOM 0 HG3 ARG C 134 -0.442 8.590 -3.999 1.00 0.64 H new ATOM 0 HD2 ARG C 134 -2.811 7.816 -4.573 1.00 0.78 H new ATOM 0 HD3 ARG C 134 -1.984 8.761 -5.794 1.00 0.78 H new ATOM 0 HE ARG C 134 -1.979 6.925 -7.229 1.00 1.08 H new ATOM 0 HH11 ARG C 134 -2.737 5.846 -3.933 1.00 2.09 H new ATOM 0 HH12 ARG C 134 -3.225 4.232 -4.461 1.00 2.09 H new ATOM 0 HH21 ARG C 134 -2.642 4.867 -7.881 1.00 2.18 H new ATOM 0 HH22 ARG C 134 -3.171 3.682 -6.683 1.00 2.18 H new ATOM 1969 N TYR C 135 3.275 6.922 -3.883 1.00 0.30 N ATOM 1970 CA TYR C 135 4.153 7.315 -2.788 1.00 0.29 C ATOM 1971 C TYR C 135 5.115 8.403 -3.261 1.00 0.31 C ATOM 1972 O TYR C 135 5.185 8.700 -4.458 1.00 0.37 O ATOM 1973 CB TYR C 135 4.931 6.099 -2.253 1.00 0.30 C ATOM 1974 CG TYR C 135 6.178 5.744 -3.044 1.00 0.34 C ATOM 1975 CD1 TYR C 135 6.091 5.254 -4.344 1.00 0.37 C ATOM 1976 CD2 TYR C 135 7.444 5.888 -2.484 1.00 0.42 C ATOM 1977 CE1 TYR C 135 7.227 4.922 -5.058 1.00 0.43 C ATOM 1978 CE2 TYR C 135 8.582 5.559 -3.196 1.00 0.49 C ATOM 1979 CZ TYR C 135 8.467 5.076 -4.481 1.00 0.48 C ATOM 1980 OH TYR C 135 9.599 4.744 -5.190 1.00 0.57 O ATOM 0 H TYR C 135 3.666 7.088 -4.810 1.00 0.30 H new ATOM 0 HA TYR C 135 3.545 7.711 -1.974 1.00 0.29 H new ATOM 0 HB2 TYR C 135 5.216 6.294 -1.219 1.00 0.30 H new ATOM 0 HB3 TYR C 135 4.266 5.235 -2.243 1.00 0.30 H new ATOM 0 HD1 TYR C 135 5.121 5.131 -4.802 1.00 0.37 H new ATOM 0 HD2 TYR C 135 7.539 6.263 -1.476 1.00 0.42 H new ATOM 0 HE1 TYR C 135 7.142 4.543 -6.066 1.00 0.43 H new ATOM 0 HE2 TYR C 135 9.557 5.680 -2.747 1.00 0.49 H new ATOM 0 HH TYR C 135 10.392 4.913 -4.639 1.00 0.57 H new ATOM 1990 N LEU C 136 5.848 8.994 -2.329 1.00 0.32 N ATOM 1991 CA LEU C 136 6.806 10.038 -2.661 1.00 0.40 C ATOM 1992 C LEU C 136 8.192 9.670 -2.142 1.00 0.41 C ATOM 1993 O LEU C 136 8.323 9.073 -1.074 1.00 0.48 O ATOM 1994 CB LEU C 136 6.357 11.378 -2.075 1.00 0.45 C ATOM 1995 CG LEU C 136 7.105 12.607 -2.603 1.00 0.55 C ATOM 1996 CD1 LEU C 136 6.892 12.763 -4.101 1.00 0.63 C ATOM 1997 CD2 LEU C 136 6.653 13.861 -1.870 1.00 0.63 C ATOM 0 H LEU C 136 5.798 8.768 -1.336 1.00 0.32 H new ATOM 0 HA LEU C 136 6.855 10.132 -3.746 1.00 0.40 H new ATOM 0 HB2 LEU C 136 5.293 11.506 -2.277 1.00 0.45 H new ATOM 0 HB3 LEU C 136 6.474 11.340 -0.992 1.00 0.45 H new ATOM 0 HG LEU C 136 8.170 12.463 -2.421 1.00 0.55 H new ATOM 0 HD11 LEU C 136 7.431 13.641 -4.456 1.00 0.63 H new ATOM 0 HD12 LEU C 136 7.263 11.877 -4.616 1.00 0.63 H new ATOM 0 HD13 LEU C 136 5.828 12.883 -4.307 1.00 0.63 H new ATOM 0 HD21 LEU C 136 7.194 14.724 -2.258 1.00 0.63 H new ATOM 0 HD22 LEU C 136 5.583 14.006 -2.022 1.00 0.63 H new ATOM 0 HD23 LEU C 136 6.857 13.753 -0.805 1.00 0.63 H new ATOM 2009 N LEU C 137 9.220 10.020 -2.896 1.00 0.42 N ATOM 2010 CA LEU C 137 10.588 9.714 -2.503 1.00 0.46 C ATOM 2011 C LEU C 137 11.349 10.993 -2.184 1.00 0.46 C ATOM 2012 O LEU C 137 11.513 11.859 -3.042 1.00 0.49 O ATOM 2013 CB LEU C 137 11.298 8.933 -3.617 1.00 0.55 C ATOM 2014 CG LEU C 137 12.611 8.252 -3.211 1.00 0.64 C ATOM 2015 CD1 LEU C 137 12.676 6.841 -3.778 1.00 1.16 C ATOM 2016 CD2 LEU C 137 13.806 9.070 -3.682 1.00 1.06 C ATOM 0 H LEU C 137 9.135 10.516 -3.783 1.00 0.42 H new ATOM 0 HA LEU C 137 10.562 9.096 -1.606 1.00 0.46 H new ATOM 0 HB2 LEU C 137 10.616 8.172 -3.995 1.00 0.55 H new ATOM 0 HB3 LEU C 137 11.503 9.615 -4.442 1.00 0.55 H new ATOM 0 HG LEU C 137 12.644 8.190 -2.123 1.00 0.64 H new ATOM 0 HD11 LEU C 137 13.614 6.372 -3.480 1.00 1.16 H new ATOM 0 HD12 LEU C 137 11.840 6.256 -3.394 1.00 1.16 H new ATOM 0 HD13 LEU C 137 12.620 6.883 -4.866 1.00 1.16 H new ATOM 0 HD21 LEU C 137 14.728 8.571 -3.385 1.00 1.06 H new ATOM 0 HD22 LEU C 137 13.778 9.164 -4.768 1.00 1.06 H new ATOM 0 HD23 LEU C 137 13.768 10.062 -3.231 1.00 1.06 H new ATOM 2028 N ILE C 138 11.795 11.114 -0.945 1.00 0.49 N ATOM 2029 CA ILE C 138 12.546 12.283 -0.512 1.00 0.54 C ATOM 2030 C ILE C 138 14.001 11.886 -0.280 1.00 0.58 C ATOM 2031 O ILE C 138 14.315 10.699 -0.201 1.00 0.73 O ATOM 2032 CB ILE C 138 11.944 12.887 0.788 1.00 0.53 C ATOM 2033 CG1 ILE C 138 10.426 13.050 0.648 1.00 0.61 C ATOM 2034 CG2 ILE C 138 12.584 14.232 1.129 1.00 0.64 C ATOM 2035 CD1 ILE C 138 10.013 14.068 -0.395 1.00 0.77 C ATOM 0 H ILE C 138 11.650 10.414 -0.217 1.00 0.49 H new ATOM 0 HA ILE C 138 12.489 13.044 -1.291 1.00 0.54 H new ATOM 0 HB ILE C 138 12.157 12.195 1.603 1.00 0.53 H new ATOM 0 HG12 ILE C 138 9.989 12.085 0.393 1.00 0.61 H new ATOM 0 HG13 ILE C 138 10.011 13.343 1.612 1.00 0.61 H new ATOM 0 HG21 ILE C 138 12.139 14.625 2.043 1.00 0.64 H new ATOM 0 HG22 ILE C 138 13.656 14.098 1.275 1.00 0.64 H new ATOM 0 HG23 ILE C 138 12.414 14.933 0.312 1.00 0.64 H new ATOM 0 HD11 ILE C 138 8.925 14.127 -0.435 1.00 0.77 H new ATOM 0 HD12 ILE C 138 10.420 15.044 -0.131 1.00 0.77 H new ATOM 0 HD13 ILE C 138 10.397 13.766 -1.370 1.00 0.77 H new ATOM 2047 N ASN C 139 14.885 12.873 -0.195 1.00 0.70 N ATOM 2048 CA ASN C 139 16.306 12.620 0.027 1.00 0.73 C ATOM 2049 C ASN C 139 16.536 11.904 1.354 1.00 0.66 C ATOM 2050 O ASN C 139 17.353 10.990 1.444 1.00 0.84 O ATOM 2051 CB ASN C 139 17.095 13.933 0.021 1.00 0.90 C ATOM 2052 CG ASN C 139 16.989 14.694 -1.289 1.00 1.04 C ATOM 2053 OD1 ASN C 139 16.817 14.107 -2.358 1.00 1.12 O ATOM 2054 ND2 ASN C 139 17.100 16.010 -1.213 1.00 1.32 N ATOM 0 H ASN C 139 14.643 13.860 -0.277 1.00 0.70 H new ATOM 0 HA ASN C 139 16.655 11.982 -0.785 1.00 0.73 H new ATOM 0 HB2 ASN C 139 16.736 14.568 0.831 1.00 0.90 H new ATOM 0 HB3 ASN C 139 18.144 13.719 0.224 1.00 0.90 H new ATOM 0 HD21 ASN C 139 17.044 16.576 -2.059 1.00 1.32 H new ATOM 0 HD22 ASN C 139 17.242 16.458 -0.308 1.00 1.32 H new ATOM 2061 N SER C 140 15.807 12.326 2.379 1.00 0.57 N ATOM 2062 CA SER C 140 15.930 11.738 3.705 1.00 0.61 C ATOM 2063 C SER C 140 15.319 10.340 3.749 1.00 0.54 C ATOM 2064 O SER C 140 16.004 9.368 4.064 1.00 0.68 O ATOM 2065 CB SER C 140 15.250 12.653 4.722 1.00 0.76 C ATOM 2066 OG SER C 140 14.743 13.815 4.084 1.00 1.04 O ATOM 0 H SER C 140 15.121 13.078 2.316 1.00 0.57 H new ATOM 0 HA SER C 140 16.987 11.639 3.951 1.00 0.61 H new ATOM 0 HB2 SER C 140 14.438 12.118 5.215 1.00 0.76 H new ATOM 0 HB3 SER C 140 15.962 12.938 5.497 1.00 0.76 H new ATOM 0 HG SER C 140 13.868 13.616 3.689 1.00 1.04 H new ATOM 2072 N ASP C 141 14.040 10.243 3.410 1.00 0.53 N ATOM 2073 CA ASP C 141 13.335 8.965 3.424 1.00 0.48 C ATOM 2074 C ASP C 141 12.139 9.016 2.480 1.00 0.41 C ATOM 2075 O ASP C 141 11.960 9.995 1.755 1.00 0.46 O ATOM 2076 CB ASP C 141 12.860 8.630 4.843 1.00 0.49 C ATOM 2077 CG ASP C 141 13.392 7.303 5.339 1.00 0.72 C ATOM 2078 OD1 ASP C 141 12.918 6.254 4.868 1.00 1.10 O ATOM 2079 OD2 ASP C 141 14.282 7.299 6.220 1.00 1.06 O ATOM 0 H ASP C 141 13.467 11.036 3.121 1.00 0.53 H new ATOM 0 HA ASP C 141 14.023 8.188 3.090 1.00 0.48 H new ATOM 0 HB2 ASP C 141 13.176 9.421 5.524 1.00 0.49 H new ATOM 0 HB3 ASP C 141 11.770 8.610 4.862 1.00 0.49 H new ATOM 2084 N ILE C 142 11.314 7.982 2.498 1.00 0.37 N ATOM 2085 CA ILE C 142 10.141 7.937 1.632 1.00 0.32 C ATOM 2086 C ILE C 142 8.895 8.387 2.385 1.00 0.30 C ATOM 2087 O ILE C 142 8.850 8.335 3.610 1.00 0.32 O ATOM 2088 CB ILE C 142 9.899 6.534 1.021 1.00 0.31 C ATOM 2089 CG1 ILE C 142 10.058 5.424 2.076 1.00 0.37 C ATOM 2090 CG2 ILE C 142 10.829 6.307 -0.166 1.00 0.38 C ATOM 2091 CD1 ILE C 142 11.465 4.864 2.201 1.00 0.45 C ATOM 0 H ILE C 142 11.431 7.166 3.098 1.00 0.37 H new ATOM 0 HA ILE C 142 10.342 8.624 0.810 1.00 0.32 H new ATOM 0 HB ILE C 142 8.870 6.492 0.664 1.00 0.31 H new ATOM 0 HG12 ILE C 142 9.750 5.816 3.045 1.00 0.37 H new ATOM 0 HG13 ILE C 142 9.377 4.609 1.831 1.00 0.37 H new ATOM 0 HG21 ILE C 142 10.648 5.317 -0.586 1.00 0.38 H new ATOM 0 HG22 ILE C 142 10.639 7.064 -0.927 1.00 0.38 H new ATOM 0 HG23 ILE C 142 11.865 6.377 0.165 1.00 0.38 H new ATOM 0 HD11 ILE C 142 11.481 4.089 2.967 1.00 0.45 H new ATOM 0 HD12 ILE C 142 11.773 4.437 1.246 1.00 0.45 H new ATOM 0 HD13 ILE C 142 12.151 5.664 2.479 1.00 0.45 H new ATOM 2103 N VAL C 143 7.896 8.846 1.645 1.00 0.29 N ATOM 2104 CA VAL C 143 6.649 9.323 2.237 1.00 0.28 C ATOM 2105 C VAL C 143 5.455 8.606 1.613 1.00 0.24 C ATOM 2106 O VAL C 143 5.502 8.217 0.440 1.00 0.23 O ATOM 2107 CB VAL C 143 6.496 10.854 2.052 1.00 0.34 C ATOM 2108 CG1 VAL C 143 5.231 11.370 2.723 1.00 0.37 C ATOM 2109 CG2 VAL C 143 7.713 11.581 2.598 1.00 0.45 C ATOM 0 H VAL C 143 7.923 8.899 0.627 1.00 0.29 H new ATOM 0 HA VAL C 143 6.680 9.104 3.304 1.00 0.28 H new ATOM 0 HB VAL C 143 6.416 11.052 0.983 1.00 0.34 H new ATOM 0 HG11 VAL C 143 5.154 12.447 2.574 1.00 0.37 H new ATOM 0 HG12 VAL C 143 4.361 10.880 2.285 1.00 0.37 H new ATOM 0 HG13 VAL C 143 5.271 11.153 3.790 1.00 0.37 H new ATOM 0 HG21 VAL C 143 7.588 12.655 2.459 1.00 0.45 H new ATOM 0 HG22 VAL C 143 7.821 11.362 3.660 1.00 0.45 H new ATOM 0 HG23 VAL C 143 8.604 11.248 2.066 1.00 0.45 H new ATOM 2119 N CYS C 144 4.401 8.420 2.402 1.00 0.23 N ATOM 2120 CA CYS C 144 3.193 7.754 1.942 1.00 0.21 C ATOM 2121 C CYS C 144 2.347 8.684 1.079 1.00 0.20 C ATOM 2122 O CYS C 144 2.798 9.742 0.641 1.00 0.32 O ATOM 2123 CB CYS C 144 2.363 7.288 3.146 1.00 0.26 C ATOM 2124 SG CYS C 144 1.664 8.651 4.141 1.00 0.32 S ATOM 0 H CYS C 144 4.363 8.726 3.374 1.00 0.23 H new ATOM 0 HA CYS C 144 3.491 6.895 1.341 1.00 0.21 H new ATOM 0 HB2 CYS C 144 1.548 6.657 2.790 1.00 0.26 H new ATOM 0 HB3 CYS C 144 2.989 6.668 3.788 1.00 0.26 H new ATOM 0 HG CYS C 144 1.782 8.370 5.405 1.00 0.32 H new ATOM 2129 N GLU C 145 1.113 8.273 0.842 1.00 0.21 N ATOM 2130 CA GLU C 145 0.181 9.062 0.067 1.00 0.22 C ATOM 2131 C GLU C 145 -0.893 9.610 0.991 1.00 0.26 C ATOM 2132 O GLU C 145 -1.790 10.342 0.571 1.00 0.28 O ATOM 2133 CB GLU C 145 -0.456 8.219 -1.040 1.00 0.25 C ATOM 2134 CG GLU C 145 -1.262 7.038 -0.522 1.00 0.29 C ATOM 2135 CD GLU C 145 -2.586 6.886 -1.242 1.00 0.49 C ATOM 2136 OE1 GLU C 145 -2.615 6.274 -2.327 1.00 0.95 O ATOM 2137 OE2 GLU C 145 -3.609 7.372 -0.718 1.00 0.59 O ATOM 0 H GLU C 145 0.734 7.388 1.180 1.00 0.21 H new ATOM 0 HA GLU C 145 0.717 9.886 -0.404 1.00 0.22 H new ATOM 0 HB2 GLU C 145 -1.106 8.855 -1.641 1.00 0.25 H new ATOM 0 HB3 GLU C 145 0.329 7.850 -1.701 1.00 0.25 H new ATOM 0 HG2 GLU C 145 -0.680 6.124 -0.640 1.00 0.29 H new ATOM 0 HG3 GLU C 145 -1.444 7.165 0.545 1.00 0.29 H new ATOM 2144 N GLN C 146 -0.775 9.266 2.265 1.00 0.31 N ATOM 2145 CA GLN C 146 -1.730 9.698 3.266 1.00 0.38 C ATOM 2146 C GLN C 146 -1.393 11.097 3.759 1.00 0.38 C ATOM 2147 O GLN C 146 -2.232 11.993 3.725 1.00 0.46 O ATOM 2148 CB GLN C 146 -1.746 8.711 4.438 1.00 0.44 C ATOM 2149 CG GLN C 146 -2.316 9.283 5.729 1.00 0.67 C ATOM 2150 CD GLN C 146 -1.739 8.611 6.960 1.00 0.83 C ATOM 2151 OE1 GLN C 146 -0.601 9.105 7.426 1.00 0.86 O flip ATOM 2152 NE2 GLN C 146 -2.310 7.653 7.484 1.00 1.34 N flip ATOM 0 H GLN C 146 -0.020 8.684 2.629 1.00 0.31 H new ATOM 0 HA GLN C 146 -2.721 9.724 2.812 1.00 0.38 H new ATOM 0 HB2 GLN C 146 -2.330 7.836 4.153 1.00 0.44 H new ATOM 0 HB3 GLN C 146 -0.728 8.369 4.624 1.00 0.44 H new ATOM 0 HG2 GLN C 146 -2.111 10.353 5.772 1.00 0.67 H new ATOM 0 HG3 GLN C 146 -3.400 9.166 5.728 1.00 0.67 H new ATOM 0 HE21 GLN C 146 -3.185 7.304 7.092 1.00 1.34 H new ATOM 0 HE22 GLN C 146 -1.908 7.209 8.309 1.00 1.34 H new ATOM 2161 N ASP C 147 -0.152 11.287 4.191 1.00 0.33 N ATOM 2162 CA ASP C 147 0.276 12.578 4.711 1.00 0.35 C ATOM 2163 C ASP C 147 1.125 13.338 3.694 1.00 0.33 C ATOM 2164 O ASP C 147 1.678 14.394 4.001 1.00 0.38 O ATOM 2165 CB ASP C 147 1.035 12.407 6.040 1.00 0.40 C ATOM 2166 CG ASP C 147 2.308 11.572 5.932 1.00 0.38 C ATOM 2167 OD1 ASP C 147 3.164 11.901 5.087 1.00 0.38 O ATOM 2168 OD2 ASP C 147 2.467 10.626 6.744 1.00 0.40 O ATOM 0 H ASP C 147 0.571 10.568 4.191 1.00 0.33 H new ATOM 0 HA ASP C 147 -0.619 13.171 4.901 1.00 0.35 H new ATOM 0 HB2 ASP C 147 1.293 13.393 6.428 1.00 0.40 H new ATOM 0 HB3 ASP C 147 0.370 11.942 6.768 1.00 0.40 H new ATOM 2173 N ILE C 148 1.182 12.815 2.470 1.00 0.29 N ATOM 2174 CA ILE C 148 1.965 13.428 1.396 1.00 0.30 C ATOM 2175 C ILE C 148 1.549 14.883 1.132 1.00 0.33 C ATOM 2176 O ILE C 148 2.390 15.730 0.830 1.00 0.38 O ATOM 2177 CB ILE C 148 1.850 12.617 0.079 1.00 0.28 C ATOM 2178 CG1 ILE C 148 2.787 13.189 -0.990 1.00 0.35 C ATOM 2179 CG2 ILE C 148 0.412 12.594 -0.428 1.00 0.26 C ATOM 2180 CD1 ILE C 148 2.757 12.426 -2.298 1.00 0.65 C ATOM 0 H ILE C 148 0.692 11.963 2.196 1.00 0.29 H new ATOM 0 HA ILE C 148 3.001 13.422 1.734 1.00 0.30 H new ATOM 0 HB ILE C 148 2.150 11.590 0.290 1.00 0.28 H new ATOM 0 HG12 ILE C 148 2.516 14.228 -1.179 1.00 0.35 H new ATOM 0 HG13 ILE C 148 3.806 13.190 -0.604 1.00 0.35 H new ATOM 0 HG21 ILE C 148 0.361 12.019 -1.352 1.00 0.26 H new ATOM 0 HG22 ILE C 148 -0.231 12.133 0.322 1.00 0.26 H new ATOM 0 HG23 ILE C 148 0.076 13.614 -0.617 1.00 0.26 H new ATOM 0 HD11 ILE C 148 3.445 12.889 -3.005 1.00 0.65 H new ATOM 0 HD12 ILE C 148 3.057 11.393 -2.123 1.00 0.65 H new ATOM 0 HD13 ILE C 148 1.747 12.446 -2.708 1.00 0.65 H new ATOM 2192 N TYR C 149 0.258 15.172 1.273 1.00 0.33 N ATOM 2193 CA TYR C 149 -0.259 16.516 1.029 1.00 0.38 C ATOM 2194 C TYR C 149 0.213 17.491 2.101 1.00 0.45 C ATOM 2195 O TYR C 149 0.379 18.681 1.842 1.00 0.52 O ATOM 2196 CB TYR C 149 -1.788 16.490 0.977 1.00 0.42 C ATOM 2197 CG TYR C 149 -2.398 17.632 0.189 1.00 0.51 C ATOM 2198 CD1 TYR C 149 -2.182 17.750 -1.180 1.00 0.61 C ATOM 2199 CD2 TYR C 149 -3.190 18.588 0.812 1.00 0.68 C ATOM 2200 CE1 TYR C 149 -2.736 18.790 -1.903 1.00 0.75 C ATOM 2201 CE2 TYR C 149 -3.748 19.632 0.095 1.00 0.79 C ATOM 2202 CZ TYR C 149 -3.518 19.728 -1.261 1.00 0.77 C ATOM 2203 OH TYR C 149 -4.069 20.768 -1.979 1.00 0.93 O ATOM 0 H TYR C 149 -0.450 14.494 1.555 1.00 0.33 H new ATOM 0 HA TYR C 149 0.126 16.858 0.068 1.00 0.38 H new ATOM 0 HB2 TYR C 149 -2.110 15.546 0.537 1.00 0.42 H new ATOM 0 HB3 TYR C 149 -2.176 16.517 1.995 1.00 0.42 H new ATOM 0 HD1 TYR C 149 -1.571 17.017 -1.686 1.00 0.61 H new ATOM 0 HD2 TYR C 149 -3.373 18.515 1.874 1.00 0.68 H new ATOM 0 HE1 TYR C 149 -2.557 18.868 -2.965 1.00 0.75 H new ATOM 0 HE2 TYR C 149 -4.360 20.368 0.595 1.00 0.79 H new ATOM 0 HH TYR C 149 -4.593 21.339 -1.379 1.00 0.93 H new ATOM 2213 N GLU C 150 0.431 16.986 3.304 1.00 0.49 N ATOM 2214 CA GLU C 150 0.884 17.825 4.401 1.00 0.59 C ATOM 2215 C GLU C 150 2.404 17.936 4.393 1.00 0.60 C ATOM 2216 O GLU C 150 2.955 19.021 4.573 1.00 0.70 O ATOM 2217 CB GLU C 150 0.396 17.270 5.737 1.00 0.66 C ATOM 2218 CG GLU C 150 -1.117 17.284 5.881 1.00 0.76 C ATOM 2219 CD GLU C 150 -1.571 17.004 7.297 1.00 1.13 C ATOM 2220 OE1 GLU C 150 -1.398 17.884 8.165 1.00 1.67 O ATOM 2221 OE2 GLU C 150 -2.111 15.905 7.549 1.00 1.48 O ATOM 0 H GLU C 150 0.302 16.003 3.545 1.00 0.49 H new ATOM 0 HA GLU C 150 0.464 18.822 4.269 1.00 0.59 H new ATOM 0 HB2 GLU C 150 0.755 16.247 5.850 1.00 0.66 H new ATOM 0 HB3 GLU C 150 0.836 17.853 6.546 1.00 0.66 H new ATOM 0 HG2 GLU C 150 -1.499 18.255 5.567 1.00 0.76 H new ATOM 0 HG3 GLU C 150 -1.549 16.540 5.212 1.00 0.76 H new ATOM 2228 N TRP C 151 3.069 16.812 4.149 1.00 0.52 N ATOM 2229 CA TRP C 151 4.528 16.756 4.113 1.00 0.54 C ATOM 2230 C TRP C 151 5.095 17.740 3.091 1.00 0.60 C ATOM 2231 O TRP C 151 6.069 18.448 3.370 1.00 0.68 O ATOM 2232 CB TRP C 151 4.983 15.331 3.780 1.00 0.46 C ATOM 2233 CG TRP C 151 6.473 15.165 3.711 1.00 0.50 C ATOM 2234 CD1 TRP C 151 7.256 15.224 2.593 1.00 0.55 C ATOM 2235 CD2 TRP C 151 7.360 14.909 4.807 1.00 0.56 C ATOM 2236 NE1 TRP C 151 8.572 15.028 2.929 1.00 0.63 N ATOM 2237 CE2 TRP C 151 8.663 14.829 4.280 1.00 0.63 C ATOM 2238 CE3 TRP C 151 7.182 14.741 6.183 1.00 0.62 C ATOM 2239 CZ2 TRP C 151 9.777 14.590 5.079 1.00 0.73 C ATOM 2240 CZ3 TRP C 151 8.288 14.503 6.974 1.00 0.73 C ATOM 2241 CH2 TRP C 151 9.572 14.431 6.421 1.00 0.77 C ATOM 0 H TRP C 151 2.615 15.916 3.971 1.00 0.52 H new ATOM 0 HA TRP C 151 4.906 17.038 5.096 1.00 0.54 H new ATOM 0 HB2 TRP C 151 4.586 14.649 4.532 1.00 0.46 H new ATOM 0 HB3 TRP C 151 4.551 15.037 2.824 1.00 0.46 H new ATOM 0 HD1 TRP C 151 6.892 15.399 1.591 1.00 0.55 H new ATOM 0 HE1 TRP C 151 9.356 15.030 2.277 1.00 0.63 H new ATOM 0 HE3 TRP C 151 6.196 14.796 6.620 1.00 0.62 H new ATOM 0 HZ2 TRP C 151 10.768 14.532 4.654 1.00 0.73 H new ATOM 0 HZ3 TRP C 151 8.160 14.370 8.038 1.00 0.73 H new ATOM 0 HH2 TRP C 151 10.417 14.246 7.067 1.00 0.77 H new ATOM 2252 N THR C 152 4.473 17.793 1.920 1.00 0.58 N ATOM 2253 CA THR C 152 4.922 18.679 0.854 1.00 0.65 C ATOM 2254 C THR C 152 4.757 20.148 1.235 1.00 0.75 C ATOM 2255 O THR C 152 5.608 20.976 0.916 1.00 0.85 O ATOM 2256 CB THR C 152 4.158 18.407 -0.453 1.00 0.62 C ATOM 2257 OG1 THR C 152 2.781 18.141 -0.166 1.00 0.53 O ATOM 2258 CG2 THR C 152 4.769 17.230 -1.202 1.00 0.60 C ATOM 0 H THR C 152 3.655 17.232 1.684 1.00 0.58 H new ATOM 0 HA THR C 152 5.981 18.473 0.701 1.00 0.65 H new ATOM 0 HB THR C 152 4.231 19.292 -1.085 1.00 0.62 H new ATOM 0 HG1 THR C 152 2.652 17.177 -0.048 1.00 0.53 H new ATOM 0 HG21 THR C 152 4.212 17.056 -2.123 1.00 0.60 H new ATOM 0 HG22 THR C 152 5.809 17.452 -1.443 1.00 0.60 H new ATOM 0 HG23 THR C 152 4.724 16.338 -0.577 1.00 0.60 H new ATOM 2266 N LYS C 153 3.666 20.465 1.922 1.00 0.77 N ATOM 2267 CA LYS C 153 3.399 21.835 2.344 1.00 0.87 C ATOM 2268 C LYS C 153 4.375 22.276 3.429 1.00 0.93 C ATOM 2269 O LYS C 153 4.864 23.403 3.411 1.00 1.04 O ATOM 2270 CB LYS C 153 1.968 21.971 2.865 1.00 0.87 C ATOM 2271 CG LYS C 153 0.904 21.925 1.779 1.00 0.83 C ATOM 2272 CD LYS C 153 -0.477 22.250 2.334 1.00 0.92 C ATOM 2273 CE LYS C 153 -1.001 21.142 3.235 1.00 0.90 C ATOM 2274 NZ LYS C 153 -2.059 21.631 4.156 1.00 1.14 N ATOM 0 H LYS C 153 2.952 19.792 2.199 1.00 0.77 H new ATOM 0 HA LYS C 153 3.528 22.476 1.472 1.00 0.87 H new ATOM 0 HB2 LYS C 153 1.776 21.172 3.581 1.00 0.87 H new ATOM 0 HB3 LYS C 153 1.878 22.912 3.407 1.00 0.87 H new ATOM 0 HG2 LYS C 153 1.156 22.635 0.991 1.00 0.83 H new ATOM 0 HG3 LYS C 153 0.890 20.935 1.324 1.00 0.83 H new ATOM 0 HD2 LYS C 153 -0.432 23.184 2.895 1.00 0.92 H new ATOM 0 HD3 LYS C 153 -1.172 22.407 1.509 1.00 0.92 H new ATOM 0 HE2 LYS C 153 -1.399 20.333 2.622 1.00 0.90 H new ATOM 0 HE3 LYS C 153 -0.178 20.726 3.816 1.00 0.90 H new ATOM 0 HZ1 LYS C 153 -2.390 20.846 4.753 1.00 1.14 H new ATOM 0 HZ2 LYS C 153 -1.673 22.385 4.759 1.00 1.14 H new ATOM 0 HZ3 LYS C 153 -2.856 22.004 3.602 1.00 1.14 H new ATOM 2288 N ILE C 154 4.651 21.379 4.371 1.00 0.88 N ATOM 2289 CA ILE C 154 5.559 21.676 5.475 1.00 0.95 C ATOM 2290 C ILE C 154 6.996 21.844 4.989 1.00 0.98 C ATOM 2291 O ILE C 154 7.692 22.777 5.393 1.00 1.10 O ATOM 2292 CB ILE C 154 5.514 20.571 6.556 1.00 0.91 C ATOM 2293 CG1 ILE C 154 4.091 20.422 7.105 1.00 0.91 C ATOM 2294 CG2 ILE C 154 6.493 20.881 7.681 1.00 1.02 C ATOM 2295 CD1 ILE C 154 3.935 19.278 8.085 1.00 0.90 C ATOM 0 H ILE C 154 4.258 20.438 4.392 1.00 0.88 H new ATOM 0 HA ILE C 154 5.221 22.616 5.912 1.00 0.95 H new ATOM 0 HB ILE C 154 5.809 19.627 6.098 1.00 0.91 H new ATOM 0 HG12 ILE C 154 3.801 21.351 7.595 1.00 0.91 H new ATOM 0 HG13 ILE C 154 3.403 20.272 6.273 1.00 0.91 H new ATOM 0 HG21 ILE C 154 6.446 20.092 8.432 1.00 1.02 H new ATOM 0 HG22 ILE C 154 7.504 20.939 7.278 1.00 1.02 H new ATOM 0 HG23 ILE C 154 6.230 21.834 8.140 1.00 1.02 H new ATOM 0 HD11 ILE C 154 2.902 19.234 8.431 1.00 0.90 H new ATOM 0 HD12 ILE C 154 4.193 18.340 7.593 1.00 0.90 H new ATOM 0 HD13 ILE C 154 4.597 19.436 8.937 1.00 0.90 H new ATOM 2307 N ASN C 155 7.432 20.947 4.118 1.00 0.93 N ATOM 2308 CA ASN C 155 8.793 20.993 3.597 1.00 0.96 C ATOM 2309 C ASN C 155 8.949 22.080 2.545 1.00 1.05 C ATOM 2310 O ASN C 155 9.860 22.903 2.623 1.00 1.16 O ATOM 2311 CB ASN C 155 9.194 19.636 3.016 1.00 0.90 C ATOM 2312 CG ASN C 155 9.715 18.691 4.081 1.00 0.86 C ATOM 2313 OD1 ASN C 155 10.919 18.579 4.293 1.00 1.13 O ATOM 2314 ND2 ASN C 155 8.810 18.007 4.761 1.00 0.90 N ATOM 0 H ASN C 155 6.866 20.179 3.757 1.00 0.93 H new ATOM 0 HA ASN C 155 9.456 21.231 4.429 1.00 0.96 H new ATOM 0 HB2 ASN C 155 8.333 19.185 2.522 1.00 0.90 H new ATOM 0 HB3 ASN C 155 9.960 19.780 2.254 1.00 0.90 H new ATOM 0 HD21 ASN C 155 9.104 17.358 5.491 1.00 0.90 H new ATOM 0 HD22 ASN C 155 7.818 18.128 4.555 1.00 0.90 H new ATOM 2321 N GLY C 156 8.050 22.090 1.576 1.00 1.07 N ATOM 2322 CA GLY C 156 8.109 23.077 0.520 1.00 1.18 C ATOM 2323 C GLY C 156 8.080 22.432 -0.847 1.00 1.12 C ATOM 2324 O GLY C 156 8.739 21.414 -1.078 1.00 1.47 O ATOM 0 H GLY C 156 7.277 21.429 1.501 1.00 1.07 H new ATOM 0 HA2 GLY C 156 7.269 23.764 0.616 1.00 1.18 H new ATOM 0 HA3 GLY C 156 9.018 23.669 0.625 1.00 1.18 H new ATOM 2328 N GLY C 157 7.314 23.016 -1.753 1.00 1.06 N ATOM 2329 CA GLY C 157 7.212 22.479 -3.093 1.00 1.02 C ATOM 2330 C GLY C 157 5.776 22.334 -3.549 1.00 0.95 C ATOM 2331 O GLY C 157 5.445 21.410 -4.291 1.00 1.21 O ATOM 0 H GLY C 157 6.759 23.855 -1.584 1.00 1.06 H new ATOM 0 HA2 GLY C 157 7.746 23.131 -3.784 1.00 1.02 H new ATOM 0 HA3 GLY C 157 7.702 21.506 -3.130 1.00 1.02 H new ATOM 2335 N SER C 158 4.918 23.237 -3.095 1.00 0.91 N ATOM 2336 CA SER C 158 3.514 23.211 -3.469 1.00 0.85 C ATOM 2337 C SER C 158 3.337 23.845 -4.847 1.00 0.93 C ATOM 2338 O SER C 158 3.984 24.844 -5.165 1.00 1.15 O ATOM 2339 CB SER C 158 2.684 23.956 -2.421 1.00 0.89 C ATOM 2340 OG SER C 158 3.149 23.672 -1.107 1.00 0.93 O ATOM 0 H SER C 158 5.172 23.998 -2.465 1.00 0.91 H new ATOM 0 HA SER C 158 3.168 22.178 -3.514 1.00 0.85 H new ATOM 0 HB2 SER C 158 2.737 25.029 -2.605 1.00 0.89 H new ATOM 0 HB3 SER C 158 1.636 23.669 -2.510 1.00 0.89 H new ATOM 0 HG SER C 158 2.605 24.160 -0.455 1.00 0.93 H new ATOM 2346 N GLY C 159 2.476 23.258 -5.664 1.00 0.84 N ATOM 2347 CA GLY C 159 2.250 23.781 -6.998 1.00 0.93 C ATOM 2348 C GLY C 159 0.809 24.189 -7.220 1.00 0.89 C ATOM 2349 O GLY C 159 0.235 23.924 -8.276 1.00 0.98 O ATOM 0 H GLY C 159 1.929 22.430 -5.429 1.00 0.84 H new ATOM 0 HA2 GLY C 159 2.898 24.642 -7.163 1.00 0.93 H new ATOM 0 HA3 GLY C 159 2.529 23.026 -7.734 1.00 0.93 H new ATOM 2353 N GLY C 160 0.230 24.841 -6.224 1.00 0.84 N ATOM 2354 CA GLY C 160 -1.145 25.276 -6.323 1.00 0.85 C ATOM 2355 C GLY C 160 -2.112 24.228 -5.815 1.00 0.82 C ATOM 2356 O GLY C 160 -1.998 23.047 -6.158 1.00 0.90 O ATOM 0 H GLY C 160 0.691 25.077 -5.345 1.00 0.84 H new ATOM 0 HA2 GLY C 160 -1.276 26.196 -5.753 1.00 0.85 H new ATOM 0 HA3 GLY C 160 -1.377 25.509 -7.362 1.00 0.85 H new ATOM 2360 N SER C 161 -3.057 24.650 -4.992 1.00 0.78 N ATOM 2361 CA SER C 161 -4.052 23.744 -4.439 1.00 0.77 C ATOM 2362 C SER C 161 -5.040 23.316 -5.524 1.00 0.71 C ATOM 2363 O SER C 161 -6.080 23.942 -5.729 1.00 0.83 O ATOM 2364 CB SER C 161 -4.772 24.419 -3.273 1.00 0.85 C ATOM 2365 OG SER C 161 -3.837 24.978 -2.362 1.00 1.04 O ATOM 0 H SER C 161 -3.157 25.619 -4.690 1.00 0.78 H new ATOM 0 HA SER C 161 -3.556 22.848 -4.066 1.00 0.77 H new ATOM 0 HB2 SER C 161 -5.432 25.200 -3.650 1.00 0.85 H new ATOM 0 HB3 SER C 161 -5.400 23.693 -2.757 1.00 0.85 H new ATOM 0 HG SER C 161 -4.317 25.407 -1.623 1.00 1.04 H new ATOM 2371 N GLY C 162 -4.693 22.246 -6.224 1.00 0.68 N ATOM 2372 CA GLY C 162 -5.529 21.744 -7.293 1.00 0.67 C ATOM 2373 C GLY C 162 -4.761 21.664 -8.594 1.00 0.70 C ATOM 2374 O GLY C 162 -5.274 21.187 -9.607 1.00 0.78 O ATOM 0 H GLY C 162 -3.838 21.712 -6.068 1.00 0.68 H new ATOM 0 HA2 GLY C 162 -5.908 20.756 -7.029 1.00 0.67 H new ATOM 0 HA3 GLY C 162 -6.395 22.394 -7.418 1.00 0.67 H new ATOM 2378 N GLY C 163 -3.524 22.142 -8.561 1.00 0.73 N ATOM 2379 CA GLY C 163 -2.682 22.120 -9.737 1.00 0.80 C ATOM 2380 C GLY C 163 -1.634 21.030 -9.661 1.00 0.79 C ATOM 2381 O GLY C 163 -1.671 20.181 -8.766 1.00 0.79 O ATOM 0 H GLY C 163 -3.088 22.547 -7.733 1.00 0.73 H new ATOM 0 HA2 GLY C 163 -3.299 21.969 -10.623 1.00 0.80 H new ATOM 0 HA3 GLY C 163 -2.192 23.087 -9.851 1.00 0.80 H new ATOM 2385 N SER C 164 -0.696 21.049 -10.592 1.00 0.87 N ATOM 2386 CA SER C 164 0.363 20.056 -10.625 1.00 0.90 C ATOM 2387 C SER C 164 1.446 20.394 -9.605 1.00 0.81 C ATOM 2388 O SER C 164 2.150 21.398 -9.742 1.00 0.93 O ATOM 2389 CB SER C 164 0.964 19.985 -12.028 1.00 1.13 C ATOM 2390 OG SER C 164 -0.052 20.016 -13.017 1.00 1.30 O ATOM 0 H SER C 164 -0.647 21.744 -11.337 1.00 0.87 H new ATOM 0 HA SER C 164 -0.060 19.085 -10.368 1.00 0.90 H new ATOM 0 HB2 SER C 164 1.648 20.820 -12.177 1.00 1.13 H new ATOM 0 HB3 SER C 164 1.549 19.071 -12.131 1.00 1.13 H new ATOM 0 HG SER C 164 0.356 19.971 -13.907 1.00 1.30 H new ATOM 2396 N GLY C 165 1.561 19.568 -8.574 1.00 0.76 N ATOM 2397 CA GLY C 165 2.560 19.796 -7.548 1.00 0.78 C ATOM 2398 C GLY C 165 3.933 19.305 -7.963 1.00 0.81 C ATOM 2399 O GLY C 165 4.896 20.077 -7.984 1.00 1.14 O ATOM 0 H GLY C 165 0.979 18.743 -8.429 1.00 0.76 H new ATOM 0 HA2 GLY C 165 2.610 20.861 -7.323 1.00 0.78 H new ATOM 0 HA3 GLY C 165 2.258 19.291 -6.631 1.00 0.78 H new ATOM 2403 N GLY C 166 4.017 18.023 -8.287 1.00 0.87 N ATOM 2404 CA GLY C 166 5.275 17.433 -8.703 1.00 0.96 C ATOM 2405 C GLY C 166 5.070 16.064 -9.315 1.00 0.98 C ATOM 2406 O GLY C 166 3.964 15.737 -9.749 1.00 1.12 O ATOM 0 H GLY C 166 3.229 17.375 -8.269 1.00 0.87 H new ATOM 0 HA2 GLY C 166 5.763 18.087 -9.426 1.00 0.96 H new ATOM 0 HA3 GLY C 166 5.942 17.353 -7.845 1.00 0.96 H new ATOM 2410 N ASP C 167 6.121 15.260 -9.352 1.00 0.97 N ATOM 2411 CA ASP C 167 6.022 13.921 -9.917 1.00 1.02 C ATOM 2412 C ASP C 167 5.765 12.896 -8.831 1.00 0.87 C ATOM 2413 O ASP C 167 6.549 12.758 -7.891 1.00 1.07 O ATOM 2414 CB ASP C 167 7.289 13.545 -10.686 1.00 1.25 C ATOM 2415 CG ASP C 167 7.161 13.796 -12.175 1.00 1.16 C ATOM 2416 OD1 ASP C 167 6.152 13.366 -12.773 1.00 1.44 O ATOM 2417 OD2 ASP C 167 8.069 14.425 -12.752 1.00 1.50 O ATOM 0 H ASP C 167 7.046 15.507 -9.001 1.00 0.97 H new ATOM 0 HA ASP C 167 5.182 13.925 -10.612 1.00 1.02 H new ATOM 0 HB2 ASP C 167 8.130 14.117 -10.295 1.00 1.25 H new ATOM 0 HB3 ASP C 167 7.514 12.492 -10.516 1.00 1.25 H new ATOM 2422 N VAL C 168 4.659 12.186 -8.963 1.00 0.75 N ATOM 2423 CA VAL C 168 4.285 11.159 -8.007 1.00 0.60 C ATOM 2424 C VAL C 168 4.629 9.784 -8.575 1.00 0.65 C ATOM 2425 O VAL C 168 4.486 9.548 -9.774 1.00 0.78 O ATOM 2426 CB VAL C 168 2.778 11.243 -7.654 1.00 0.61 C ATOM 2427 CG1 VAL C 168 1.910 11.051 -8.893 1.00 0.82 C ATOM 2428 CG2 VAL C 168 2.411 10.234 -6.574 1.00 0.58 C ATOM 0 H VAL C 168 3.998 12.304 -9.731 1.00 0.75 H new ATOM 0 HA VAL C 168 4.846 11.318 -7.086 1.00 0.60 H new ATOM 0 HB VAL C 168 2.586 12.242 -7.262 1.00 0.61 H new ATOM 0 HG11 VAL C 168 0.858 11.115 -8.614 1.00 0.82 H new ATOM 0 HG12 VAL C 168 2.140 11.828 -9.622 1.00 0.82 H new ATOM 0 HG13 VAL C 168 2.111 10.073 -9.330 1.00 0.82 H new ATOM 0 HG21 VAL C 168 1.348 10.315 -6.346 1.00 0.58 H new ATOM 0 HG22 VAL C 168 2.630 9.227 -6.928 1.00 0.58 H new ATOM 0 HG23 VAL C 168 2.991 10.437 -5.674 1.00 0.58 H new ATOM 2438 N MET C 169 5.103 8.884 -7.730 1.00 0.56 N ATOM 2439 CA MET C 169 5.470 7.553 -8.190 1.00 0.60 C ATOM 2440 C MET C 169 4.618 6.491 -7.518 1.00 0.56 C ATOM 2441 O MET C 169 4.048 6.721 -6.455 1.00 0.53 O ATOM 2442 CB MET C 169 6.952 7.286 -7.934 1.00 0.64 C ATOM 2443 CG MET C 169 7.870 8.083 -8.847 1.00 1.02 C ATOM 2444 SD MET C 169 9.613 7.689 -8.610 1.00 1.10 S ATOM 2445 CE MET C 169 10.372 8.805 -9.787 1.00 1.55 C ATOM 0 H MET C 169 5.242 9.046 -6.733 1.00 0.56 H new ATOM 0 HA MET C 169 5.288 7.506 -9.264 1.00 0.60 H new ATOM 0 HB2 MET C 169 7.184 7.526 -6.896 1.00 0.64 H new ATOM 0 HB3 MET C 169 7.151 6.223 -8.067 1.00 0.64 H new ATOM 0 HG2 MET C 169 7.597 7.891 -9.885 1.00 1.02 H new ATOM 0 HG3 MET C 169 7.716 9.147 -8.669 1.00 1.02 H new ATOM 0 HE1 MET C 169 11.184 8.293 -10.302 1.00 1.55 H new ATOM 0 HE2 MET C 169 9.627 9.128 -10.514 1.00 1.55 H new ATOM 0 HE3 MET C 169 10.767 9.675 -9.262 1.00 1.55 H new ATOM 2455 N VAL C 170 4.525 5.338 -8.153 1.00 0.61 N ATOM 2456 CA VAL C 170 3.751 4.225 -7.627 1.00 0.60 C ATOM 2457 C VAL C 170 4.680 3.073 -7.260 1.00 0.63 C ATOM 2458 O VAL C 170 5.475 2.622 -8.091 1.00 0.73 O ATOM 2459 CB VAL C 170 2.699 3.742 -8.654 1.00 0.65 C ATOM 2460 CG1 VAL C 170 2.009 2.465 -8.186 1.00 0.65 C ATOM 2461 CG2 VAL C 170 1.670 4.832 -8.920 1.00 0.68 C ATOM 0 H VAL C 170 4.981 5.145 -9.045 1.00 0.61 H new ATOM 0 HA VAL C 170 3.226 4.568 -6.735 1.00 0.60 H new ATOM 0 HB VAL C 170 3.223 3.519 -9.584 1.00 0.65 H new ATOM 0 HG11 VAL C 170 1.276 2.153 -8.931 1.00 0.65 H new ATOM 0 HG12 VAL C 170 2.751 1.677 -8.055 1.00 0.65 H new ATOM 0 HG13 VAL C 170 1.506 2.650 -7.237 1.00 0.65 H new ATOM 0 HG21 VAL C 170 0.939 4.473 -9.645 1.00 0.68 H new ATOM 0 HG22 VAL C 170 1.163 5.089 -7.990 1.00 0.68 H new ATOM 0 HG23 VAL C 170 2.170 5.716 -9.316 1.00 0.68 H new ATOM 2471 N VAL C 171 4.588 2.607 -6.017 1.00 0.57 N ATOM 2472 CA VAL C 171 5.430 1.510 -5.555 1.00 0.62 C ATOM 2473 C VAL C 171 5.123 0.245 -6.347 1.00 0.77 C ATOM 2474 O VAL C 171 3.970 -0.194 -6.418 1.00 0.89 O ATOM 2475 CB VAL C 171 5.267 1.220 -4.044 1.00 0.61 C ATOM 2476 CG1 VAL C 171 6.438 1.795 -3.266 1.00 1.03 C ATOM 2477 CG2 VAL C 171 3.952 1.767 -3.507 1.00 0.91 C ATOM 0 H VAL C 171 3.942 2.970 -5.316 1.00 0.57 H new ATOM 0 HA VAL C 171 6.462 1.820 -5.718 1.00 0.62 H new ATOM 0 HB VAL C 171 5.253 0.138 -3.913 1.00 0.61 H new ATOM 0 HG11 VAL C 171 6.309 1.583 -2.205 1.00 1.03 H new ATOM 0 HG12 VAL C 171 7.365 1.342 -3.616 1.00 1.03 H new ATOM 0 HG13 VAL C 171 6.481 2.874 -3.418 1.00 1.03 H new ATOM 0 HG21 VAL C 171 3.873 1.544 -2.443 1.00 0.91 H new ATOM 0 HG22 VAL C 171 3.919 2.846 -3.655 1.00 0.91 H new ATOM 0 HG23 VAL C 171 3.121 1.303 -4.038 1.00 0.91 H new ATOM 2487 N GLY C 172 6.160 -0.321 -6.955 1.00 0.81 N ATOM 2488 CA GLY C 172 6.001 -1.524 -7.748 1.00 0.96 C ATOM 2489 C GLY C 172 5.751 -2.758 -6.904 1.00 0.99 C ATOM 2490 O GLY C 172 5.292 -2.670 -5.765 1.00 1.04 O ATOM 0 H GLY C 172 7.114 0.036 -6.911 1.00 0.81 H new ATOM 0 HA2 GLY C 172 5.170 -1.389 -8.441 1.00 0.96 H new ATOM 0 HA3 GLY C 172 6.897 -1.677 -8.350 1.00 0.96 H new ATOM 2494 N GLU C 173 6.057 -3.912 -7.468 1.00 1.04 N ATOM 2495 CA GLU C 173 5.865 -5.175 -6.776 1.00 1.10 C ATOM 2496 C GLU C 173 7.109 -5.532 -5.968 1.00 1.06 C ATOM 2497 O GLU C 173 8.219 -5.135 -6.327 1.00 1.05 O ATOM 2498 CB GLU C 173 5.541 -6.281 -7.783 1.00 1.25 C ATOM 2499 CG GLU C 173 6.434 -6.265 -9.011 1.00 1.53 C ATOM 2500 CD GLU C 173 6.071 -7.343 -10.003 1.00 1.63 C ATOM 2501 OE1 GLU C 173 6.592 -8.470 -9.877 1.00 1.96 O ATOM 2502 OE2 GLU C 173 5.263 -7.070 -10.915 1.00 1.72 O ATOM 0 H GLU C 173 6.442 -4.001 -8.408 1.00 1.04 H new ATOM 0 HA GLU C 173 5.026 -5.075 -6.087 1.00 1.10 H new ATOM 0 HB2 GLU C 173 5.633 -7.249 -7.290 1.00 1.25 H new ATOM 0 HB3 GLU C 173 4.502 -6.181 -8.098 1.00 1.25 H new ATOM 0 HG2 GLU C 173 6.363 -5.291 -9.495 1.00 1.53 H new ATOM 0 HG3 GLU C 173 7.472 -6.393 -8.703 1.00 1.53 H new ATOM 2509 N PRO C 174 6.938 -6.256 -4.851 1.00 1.09 N ATOM 2510 CA PRO C 174 8.058 -6.669 -4.007 1.00 1.08 C ATOM 2511 C PRO C 174 8.884 -7.773 -4.658 1.00 1.15 C ATOM 2512 O PRO C 174 8.339 -8.674 -5.310 1.00 1.34 O ATOM 2513 CB PRO C 174 7.379 -7.178 -2.733 1.00 1.15 C ATOM 2514 CG PRO C 174 6.023 -7.612 -3.169 1.00 1.30 C ATOM 2515 CD PRO C 174 5.641 -6.710 -4.312 1.00 1.17 C ATOM 0 HA PRO C 174 8.760 -5.855 -3.826 1.00 1.08 H new ATOM 0 HB2 PRO C 174 7.936 -8.005 -2.292 1.00 1.15 H new ATOM 0 HB3 PRO C 174 7.319 -6.395 -1.977 1.00 1.15 H new ATOM 0 HG2 PRO C 174 6.030 -8.656 -3.483 1.00 1.30 H new ATOM 0 HG3 PRO C 174 5.306 -7.530 -2.352 1.00 1.30 H new ATOM 0 HD2 PRO C 174 5.059 -7.242 -5.065 1.00 1.17 H new ATOM 0 HD3 PRO C 174 5.033 -5.871 -3.974 1.00 1.17 H new ATOM 2523 N THR C 175 10.196 -7.695 -4.496 1.00 1.04 N ATOM 2524 CA THR C 175 11.092 -8.682 -5.062 1.00 1.11 C ATOM 2525 C THR C 175 11.155 -9.931 -4.188 1.00 1.12 C ATOM 2526 O THR C 175 11.172 -9.845 -2.958 1.00 1.05 O ATOM 2527 CB THR C 175 12.506 -8.102 -5.232 1.00 1.07 C ATOM 2528 OG1 THR C 175 12.593 -6.834 -4.569 1.00 1.03 O ATOM 2529 CG2 THR C 175 12.845 -7.933 -6.705 1.00 1.30 C ATOM 0 H THR C 175 10.662 -6.953 -3.974 1.00 1.04 H new ATOM 0 HA THR C 175 10.699 -8.957 -6.041 1.00 1.11 H new ATOM 0 HB THR C 175 13.220 -8.796 -4.788 1.00 1.07 H new ATOM 0 HG1 THR C 175 12.781 -6.975 -3.618 1.00 1.03 H new ATOM 0 HG21 THR C 175 13.850 -7.521 -6.802 1.00 1.30 H new ATOM 0 HG22 THR C 175 12.800 -8.902 -7.202 1.00 1.30 H new ATOM 0 HG23 THR C 175 12.128 -7.254 -7.168 1.00 1.30 H new