USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 980 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 157 MET CE :methyl -146:sc= -3.05 (180deg=-8.16!) USER MOD Set 1.2: B 174 SER OG : rot 180:sc= -1.63! USER MOD Set 2.1: B 156 HIS : no HE2:sc= -16.1! C(o=-20!,f=-24!) USER MOD Set 2.2: B 171 CYS SG : rot -127:sc= -4.41 USER MOD Set 3.1: B 151 LYS NZ :NH3+ -157:sc= 0 (180deg=0) USER MOD Set 3.2: B 155 ASN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Set 4.1: B 125 HIS : no HE2:sc= -9.28! C(o=-14!,f=-33!) USER MOD Set 4.2: B 129 CYS SG : rot 149:sc= -1.15! USER MOD Set 4.3: B 142 CYS SG : rot -136:sc= 1.01 USER MOD Set 4.4: B 147 CYS SG : rot -141:sc= -4.53! USER MOD Single : A 10 GLN : amide:sc= -0.309 X(o=-0.31,f=-0.26) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot -91:sc= 0.0346 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 CYS SG : rot -90:sc= -1.4 USER MOD Single : A 19 ASN : amide:sc= -1.04! C(o=-1!,f=-1.8!) USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 SER OG : rot 180:sc= -0.417 USER MOD Single : A 27 ASN : amide:sc= -4.43! C(o=-4.4!,f=-4.1!) USER MOD Single : A 30 GLN : amide:sc= -0.188 X(o=-0.19,f=-0.097) USER MOD Single : A 40 GLN :FLIP amide:sc= 0.741 F(o=-0.84,f=0.74) USER MOD Single : B 112 LYS NZ :NH3+ 169:sc= 1.29 (180deg=1.13) USER MOD Single : B 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 117 GLN : amide:sc= -4.14 X(o=-4.1,f=-3.9!) USER MOD Single : B 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 119 GLN :FLIP amide:sc= -0.157 F(o=-0.81,f=-0.16) USER MOD Single : B 127 HIS : no HE2:sc= 0.211 K(o=0.21,f=-4.6!) USER MOD Single : B 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 130 GLN : amide:sc= -1.81 X(o=-1.8,f=-1.7) USER MOD Single : B 134 GLN : amide:sc= -0.0154 K(o=-0.015,f=-1.2!) USER MOD Single : B 136 ASN : amide:sc= -0.222 X(o=-0.22,f=0.2) USER MOD Single : B 141 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 146 HIS : no HD1:sc= -4.32! C(o=-4.3!,f=-6.5!) USER MOD Single : B 149 THR OG1 : rot 103:sc= 1.19 USER MOD Single : B 150 MET CE :methyl 172:sc= 0 (180deg=-0.0745) USER MOD Single : B 152 ASN : amide:sc= -0.046 X(o=-0.046,f=0) USER MOD Single : B 158 THR OG1 : rot 76:sc= 0.528 USER MOD Single : B 159 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 161 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 162 SER OG : rot 126:sc= 1.32 USER MOD Single : B 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 SER OG : rot 65:sc= 0.264 USER MOD Single : B 167 GLN : amide:sc= -0.274 K(o=-0.27,f=-1.3!) USER MOD Single : B 170 HIS :FLIP no HE2:sc= -5.25! C(o=-7.3!,f=-5.3!) USER MOD Single : B 173 SER OG : rot -150:sc= -0.0913 USER MOD Single : B 176 GLN : amide:sc= -2.72 K(o=-2.7,f=-12!) USER MOD Single : B 179 SER OG : rot -74:sc= -3.24! USER MOD Single : B 180 HIS : no HE2:sc= -7.64! C(o=-7.6!,f=-12!) USER MOD Single : B 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 183 ASN :FLIP amide:sc= -2.1 F(o=-4!,f=-2.1) USER MOD Single : B 185 THR OG1 : rot 180:sc= 0.00824 USER MOD Single : B 187 HIS : no HD1:sc= -0.0792 X(o=-0.079,f=-0.47) USER MOD Single : B 192 CYS SG : rot 112:sc= -5.25! USER MOD Single : B 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 83 N LEU A 8 2.440 1.346 -23.834 1.00 0.00 N ATOM 84 CA LEU A 8 2.230 1.396 -22.394 1.00 0.00 C ATOM 85 C LEU A 8 2.309 2.825 -21.875 1.00 0.00 C ATOM 86 O LEU A 8 3.292 3.527 -22.115 1.00 0.00 O ATOM 87 CB LEU A 8 3.276 0.543 -21.677 1.00 0.00 C ATOM 88 CG LEU A 8 2.876 0.094 -20.273 1.00 0.00 C ATOM 89 CD1 LEU A 8 2.851 -1.424 -20.180 1.00 0.00 C ATOM 90 CD2 LEU A 8 3.816 0.678 -19.229 1.00 0.00 C ATOM 0 HA LEU A 8 1.233 1.004 -22.191 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.482 -0.340 -22.282 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.205 1.109 -21.612 1.00 0.00 H new ATOM 0 HG LEU A 8 1.871 0.467 -20.073 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.564 -1.722 -19.172 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.130 -1.820 -20.895 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.841 -1.819 -20.407 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.511 0.344 -18.237 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.834 0.343 -19.428 1.00 0.00 H new ATOM 0 HD23 LEU A 8 3.778 1.766 -19.273 1.00 0.00 H new ATOM 102 N PRO A 9 1.281 3.280 -21.136 1.00 0.00 N ATOM 103 CA PRO A 9 1.267 4.629 -20.573 1.00 0.00 C ATOM 104 C PRO A 9 2.549 4.919 -19.803 1.00 0.00 C ATOM 105 O PRO A 9 2.744 4.419 -18.695 1.00 0.00 O ATOM 106 CB PRO A 9 0.067 4.609 -19.624 1.00 0.00 C ATOM 107 CG PRO A 9 -0.829 3.548 -20.164 1.00 0.00 C ATOM 108 CD PRO A 9 0.072 2.514 -20.782 1.00 0.00 C ATOM 0 HA PRO A 9 1.198 5.401 -21.340 1.00 0.00 H new ATOM 0 HB2 PRO A 9 0.374 4.385 -18.603 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.435 5.576 -19.601 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -1.437 3.111 -19.372 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -1.516 3.958 -20.904 1.00 0.00 H new ATOM 0 HD2 PRO A 9 0.297 1.708 -20.083 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -0.385 2.056 -21.660 1.00 0.00 H new ATOM 116 N GLN A 10 3.426 5.716 -20.399 1.00 0.00 N ATOM 117 CA GLN A 10 4.693 6.053 -19.767 1.00 0.00 C ATOM 118 C GLN A 10 4.599 7.382 -19.024 1.00 0.00 C ATOM 119 O GLN A 10 3.903 8.300 -19.458 1.00 0.00 O ATOM 120 CB GLN A 10 5.809 6.104 -20.815 1.00 0.00 C ATOM 121 CG GLN A 10 5.771 7.343 -21.698 1.00 0.00 C ATOM 122 CD GLN A 10 6.963 7.430 -22.630 1.00 0.00 C ATOM 123 OE1 GLN A 10 7.663 8.442 -22.670 1.00 0.00 O ATOM 124 NE2 GLN A 10 7.202 6.365 -23.387 1.00 0.00 N ATOM 0 H GLN A 10 3.283 6.139 -21.316 1.00 0.00 H new ATOM 0 HA GLN A 10 4.928 5.277 -19.039 1.00 0.00 H new ATOM 0 HB2 GLN A 10 6.773 6.061 -20.307 1.00 0.00 H new ATOM 0 HB3 GLN A 10 5.742 5.218 -21.446 1.00 0.00 H new ATOM 0 HG2 GLN A 10 4.854 7.337 -22.287 1.00 0.00 H new ATOM 0 HG3 GLN A 10 5.741 8.233 -21.069 1.00 0.00 H new ATOM 0 HE21 GLN A 10 6.596 5.547 -23.322 1.00 0.00 H new ATOM 0 HE22 GLN A 10 7.991 6.365 -24.033 1.00 0.00 H new ATOM 133 N LEU A 11 5.303 7.479 -17.901 1.00 0.00 N ATOM 134 CA LEU A 11 5.301 8.691 -17.097 1.00 0.00 C ATOM 135 C LEU A 11 6.722 9.196 -16.870 1.00 0.00 C ATOM 136 O LEU A 11 7.682 8.429 -16.939 1.00 0.00 O ATOM 137 CB LEU A 11 4.614 8.437 -15.754 1.00 0.00 C ATOM 138 CG LEU A 11 3.137 8.051 -15.844 1.00 0.00 C ATOM 139 CD1 LEU A 11 2.660 7.452 -14.531 1.00 0.00 C ATOM 140 CD2 LEU A 11 2.294 9.261 -16.218 1.00 0.00 C ATOM 0 H LEU A 11 5.884 6.728 -17.528 1.00 0.00 H new ATOM 0 HA LEU A 11 4.747 9.456 -17.640 1.00 0.00 H new ATOM 0 HB2 LEU A 11 5.150 7.643 -15.234 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.702 9.335 -15.143 1.00 0.00 H new ATOM 0 HG LEU A 11 3.024 7.298 -16.624 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.607 7.184 -14.615 1.00 0.00 H new ATOM 0 HD12 LEU A 11 3.245 6.560 -14.304 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.786 8.182 -13.731 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.245 8.969 -16.278 1.00 0.00 H new ATOM 0 HD22 LEU A 11 2.413 10.035 -15.460 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.619 9.646 -17.184 1.00 0.00 H new ATOM 152 N THR A 12 6.849 10.491 -16.599 1.00 0.00 N ATOM 153 CA THR A 12 8.150 11.099 -16.362 1.00 0.00 C ATOM 154 C THR A 12 8.537 10.996 -14.894 1.00 0.00 C ATOM 155 O THR A 12 7.677 10.983 -14.015 1.00 0.00 O ATOM 156 CB THR A 12 8.125 12.564 -16.790 1.00 0.00 C ATOM 157 OG1 THR A 12 7.668 12.689 -18.125 1.00 0.00 O ATOM 158 CG2 THR A 12 9.474 13.242 -16.699 1.00 0.00 C ATOM 0 H THR A 12 6.064 11.139 -16.538 1.00 0.00 H new ATOM 0 HA THR A 12 8.892 10.562 -16.952 1.00 0.00 H new ATOM 0 HB THR A 12 7.446 13.055 -16.092 1.00 0.00 H new ATOM 0 HG1 THR A 12 7.658 13.635 -18.380 1.00 0.00 H new ATOM 0 HG21 THR A 12 9.382 14.280 -17.018 1.00 0.00 H new ATOM 0 HG22 THR A 12 9.829 13.209 -15.669 1.00 0.00 H new ATOM 0 HG23 THR A 12 10.185 12.726 -17.344 1.00 0.00 H new ATOM 166 N SER A 13 9.840 10.929 -14.634 1.00 0.00 N ATOM 167 CA SER A 13 10.348 10.834 -13.277 1.00 0.00 C ATOM 168 C SER A 13 9.679 11.860 -12.363 1.00 0.00 C ATOM 169 O SER A 13 9.618 11.673 -11.147 1.00 0.00 O ATOM 170 CB SER A 13 11.864 11.034 -13.262 1.00 0.00 C ATOM 171 OG SER A 13 12.283 11.845 -14.347 1.00 0.00 O ATOM 0 H SER A 13 10.563 10.939 -15.353 1.00 0.00 H new ATOM 0 HA SER A 13 10.114 9.838 -12.902 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.164 11.496 -12.322 1.00 0.00 H new ATOM 0 HB3 SER A 13 12.362 10.066 -13.314 1.00 0.00 H new ATOM 0 HG SER A 13 12.501 11.277 -15.115 1.00 0.00 H new ATOM 177 N TYR A 14 9.179 12.943 -12.956 1.00 0.00 N ATOM 178 CA TYR A 14 8.517 13.994 -12.192 1.00 0.00 C ATOM 179 C TYR A 14 7.049 13.652 -11.959 1.00 0.00 C ATOM 180 O TYR A 14 6.546 13.766 -10.842 1.00 0.00 O ATOM 181 CB TYR A 14 8.632 15.333 -12.924 1.00 0.00 C ATOM 182 CG TYR A 14 8.157 16.514 -12.110 1.00 0.00 C ATOM 183 CD1 TYR A 14 8.751 16.830 -10.895 1.00 0.00 C ATOM 184 CD2 TYR A 14 7.113 17.315 -12.557 1.00 0.00 C ATOM 185 CE1 TYR A 14 8.319 17.910 -10.148 1.00 0.00 C ATOM 186 CE2 TYR A 14 6.676 18.397 -11.817 1.00 0.00 C ATOM 187 CZ TYR A 14 7.283 18.691 -10.614 1.00 0.00 C ATOM 188 OH TYR A 14 6.850 19.767 -9.874 1.00 0.00 O ATOM 0 H TYR A 14 9.221 13.114 -13.961 1.00 0.00 H new ATOM 0 HA TYR A 14 9.011 14.074 -11.224 1.00 0.00 H new ATOM 0 HB2 TYR A 14 9.672 15.494 -13.208 1.00 0.00 H new ATOM 0 HB3 TYR A 14 8.054 15.283 -13.847 1.00 0.00 H new ATOM 0 HD1 TYR A 14 9.564 16.222 -10.528 1.00 0.00 H new ATOM 0 HD2 TYR A 14 6.635 17.088 -13.499 1.00 0.00 H new ATOM 0 HE1 TYR A 14 8.791 18.141 -9.204 1.00 0.00 H new ATOM 0 HE2 TYR A 14 5.863 19.009 -12.179 1.00 0.00 H new ATOM 0 HH TYR A 14 6.114 20.212 -10.344 1.00 0.00 H new ATOM 198 N ASP A 15 6.367 13.227 -13.018 1.00 0.00 N ATOM 199 CA ASP A 15 4.957 12.862 -12.924 1.00 0.00 C ATOM 200 C ASP A 15 4.740 11.817 -11.835 1.00 0.00 C ATOM 201 O ASP A 15 3.662 11.732 -11.247 1.00 0.00 O ATOM 202 CB ASP A 15 4.455 12.331 -14.268 1.00 0.00 C ATOM 203 CG ASP A 15 4.125 13.443 -15.244 1.00 0.00 C ATOM 204 OD1 ASP A 15 5.065 14.118 -15.712 1.00 0.00 O ATOM 205 OD2 ASP A 15 2.928 13.638 -15.540 1.00 0.00 O ATOM 0 H ASP A 15 6.767 13.127 -13.951 1.00 0.00 H new ATOM 0 HA ASP A 15 4.391 13.756 -12.663 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.214 11.682 -14.705 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.567 11.720 -14.105 1.00 0.00 H new ATOM 210 N CYS A 16 5.775 11.027 -11.569 1.00 0.00 N ATOM 211 CA CYS A 16 5.707 9.992 -10.552 1.00 0.00 C ATOM 212 C CYS A 16 6.069 10.561 -9.188 1.00 0.00 C ATOM 213 O CYS A 16 5.392 10.304 -8.195 1.00 0.00 O ATOM 214 CB CYS A 16 6.660 8.856 -10.908 1.00 0.00 C ATOM 215 SG CYS A 16 6.226 7.264 -10.170 1.00 0.00 S ATOM 0 H CYS A 16 6.674 11.087 -12.048 1.00 0.00 H new ATOM 0 HA CYS A 16 4.687 9.609 -10.510 1.00 0.00 H new ATOM 0 HB2 CYS A 16 6.687 8.746 -11.992 1.00 0.00 H new ATOM 0 HB3 CYS A 16 7.666 9.128 -10.590 1.00 0.00 H new ATOM 0 HG CYS A 16 6.809 7.148 -9.014 1.00 0.00 H new ATOM 221 N GLU A 17 7.143 11.339 -9.154 1.00 0.00 N ATOM 222 CA GLU A 17 7.600 11.954 -7.915 1.00 0.00 C ATOM 223 C GLU A 17 6.534 12.889 -7.358 1.00 0.00 C ATOM 224 O GLU A 17 6.257 12.892 -6.159 1.00 0.00 O ATOM 225 CB GLU A 17 8.895 12.729 -8.158 1.00 0.00 C ATOM 226 CG GLU A 17 9.858 12.691 -6.982 1.00 0.00 C ATOM 227 CD GLU A 17 10.017 14.044 -6.314 1.00 0.00 C ATOM 228 OE1 GLU A 17 8.987 14.655 -5.961 1.00 0.00 O ATOM 229 OE2 GLU A 17 11.171 14.491 -6.146 1.00 0.00 O ATOM 0 H GLU A 17 7.714 11.559 -9.970 1.00 0.00 H new ATOM 0 HA GLU A 17 7.788 11.165 -7.187 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.393 12.321 -9.038 1.00 0.00 H new ATOM 0 HB3 GLU A 17 8.650 13.767 -8.383 1.00 0.00 H new ATOM 0 HG2 GLU A 17 9.502 11.968 -6.249 1.00 0.00 H new ATOM 0 HG3 GLU A 17 10.832 12.343 -7.326 1.00 0.00 H new ATOM 236 N VAL A 18 5.939 13.681 -8.242 1.00 0.00 N ATOM 237 CA VAL A 18 4.901 14.625 -7.851 1.00 0.00 C ATOM 238 C VAL A 18 3.673 13.901 -7.307 1.00 0.00 C ATOM 239 O VAL A 18 3.140 14.267 -6.260 1.00 0.00 O ATOM 240 CB VAL A 18 4.476 15.515 -9.035 1.00 0.00 C ATOM 241 CG1 VAL A 18 3.492 16.584 -8.580 1.00 0.00 C ATOM 242 CG2 VAL A 18 5.695 16.150 -9.689 1.00 0.00 C ATOM 0 H VAL A 18 6.159 13.687 -9.238 1.00 0.00 H new ATOM 0 HA VAL A 18 5.325 15.253 -7.067 1.00 0.00 H new ATOM 0 HB VAL A 18 3.977 14.887 -9.774 1.00 0.00 H new ATOM 0 HG11 VAL A 18 3.205 17.201 -9.432 1.00 0.00 H new ATOM 0 HG12 VAL A 18 2.605 16.108 -8.162 1.00 0.00 H new ATOM 0 HG13 VAL A 18 3.960 17.210 -7.820 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.376 16.775 -10.523 1.00 0.00 H new ATOM 0 HG22 VAL A 18 6.223 16.762 -8.958 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.360 15.368 -10.055 1.00 0.00 H new ATOM 252 N ASN A 19 3.225 12.875 -8.026 1.00 0.00 N ATOM 253 CA ASN A 19 2.056 12.108 -7.610 1.00 0.00 C ATOM 254 C ASN A 19 2.407 11.138 -6.482 1.00 0.00 C ATOM 255 O ASN A 19 1.539 10.728 -5.712 1.00 0.00 O ATOM 256 CB ASN A 19 1.477 11.342 -8.800 1.00 0.00 C ATOM 257 CG ASN A 19 0.018 11.672 -9.045 1.00 0.00 C ATOM 258 OD1 ASN A 19 -0.878 10.992 -8.546 1.00 0.00 O ATOM 259 ND2 ASN A 19 -0.228 12.723 -9.819 1.00 0.00 N ATOM 0 H ASN A 19 3.652 12.557 -8.896 1.00 0.00 H new ATOM 0 HA ASN A 19 1.308 12.807 -7.237 1.00 0.00 H new ATOM 0 HB2 ASN A 19 2.055 11.575 -9.694 1.00 0.00 H new ATOM 0 HB3 ASN A 19 1.580 10.271 -8.624 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -1.191 12.994 -10.020 1.00 0.00 H new ATOM 0 HD22 ASN A 19 0.546 13.259 -10.212 1.00 0.00 H new ATOM 266 N ALA A 20 3.682 10.775 -6.392 1.00 0.00 N ATOM 267 CA ALA A 20 4.146 9.854 -5.363 1.00 0.00 C ATOM 268 C ALA A 20 5.670 9.872 -5.264 1.00 0.00 C ATOM 269 O ALA A 20 6.353 9.108 -5.944 1.00 0.00 O ATOM 270 CB ALA A 20 3.649 8.445 -5.653 1.00 0.00 C ATOM 0 H ALA A 20 4.413 11.106 -7.021 1.00 0.00 H new ATOM 0 HA ALA A 20 3.740 10.178 -4.405 1.00 0.00 H new ATOM 0 HB1 ALA A 20 4.003 7.767 -4.876 1.00 0.00 H new ATOM 0 HB2 ALA A 20 2.559 8.440 -5.670 1.00 0.00 H new ATOM 0 HB3 ALA A 20 4.028 8.117 -6.621 1.00 0.00 H new ATOM 276 N PRO A 21 6.223 10.754 -4.414 1.00 0.00 N ATOM 277 CA PRO A 21 7.663 10.878 -4.228 1.00 0.00 C ATOM 278 C PRO A 21 8.197 9.945 -3.149 1.00 0.00 C ATOM 279 O PRO A 21 7.432 9.343 -2.397 1.00 0.00 O ATOM 280 CB PRO A 21 7.820 12.332 -3.799 1.00 0.00 C ATOM 281 CG PRO A 21 6.552 12.668 -3.081 1.00 0.00 C ATOM 282 CD PRO A 21 5.488 11.708 -3.567 1.00 0.00 C ATOM 0 HA PRO A 21 8.220 10.611 -5.126 1.00 0.00 H new ATOM 0 HB2 PRO A 21 8.686 12.460 -3.149 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.969 12.983 -4.661 1.00 0.00 H new ATOM 0 HG2 PRO A 21 6.686 12.578 -2.003 1.00 0.00 H new ATOM 0 HG3 PRO A 21 6.259 13.699 -3.281 1.00 0.00 H new ATOM 0 HD2 PRO A 21 4.996 11.205 -2.735 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.712 12.226 -4.131 1.00 0.00 H new ATOM 290 N ILE A 22 9.517 9.836 -3.077 1.00 0.00 N ATOM 291 CA ILE A 22 10.160 8.981 -2.088 1.00 0.00 C ATOM 292 C ILE A 22 10.430 9.744 -0.790 1.00 0.00 C ATOM 293 O ILE A 22 10.765 9.148 0.233 1.00 0.00 O ATOM 294 CB ILE A 22 11.484 8.403 -2.625 1.00 0.00 C ATOM 295 CG1 ILE A 22 11.276 7.833 -4.031 1.00 0.00 C ATOM 296 CG2 ILE A 22 12.020 7.333 -1.683 1.00 0.00 C ATOM 297 CD1 ILE A 22 12.477 7.084 -4.567 1.00 0.00 C ATOM 0 H ILE A 22 10.164 10.329 -3.692 1.00 0.00 H new ATOM 0 HA ILE A 22 9.473 8.160 -1.882 1.00 0.00 H new ATOM 0 HB ILE A 22 12.221 9.205 -2.681 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.417 7.163 -4.018 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.034 8.649 -4.712 1.00 0.00 H new ATOM 0 HG21 ILE A 22 12.955 6.936 -2.078 1.00 0.00 H new ATOM 0 HG22 ILE A 22 12.197 7.769 -0.700 1.00 0.00 H new ATOM 0 HG23 ILE A 22 11.292 6.527 -1.596 1.00 0.00 H new ATOM 0 HD11 ILE A 22 12.256 6.709 -5.566 1.00 0.00 H new ATOM 0 HD12 ILE A 22 13.334 7.756 -4.613 1.00 0.00 H new ATOM 0 HD13 ILE A 22 12.707 6.247 -3.908 1.00 0.00 H new ATOM 309 N GLN A 23 10.278 11.069 -0.839 1.00 0.00 N ATOM 310 CA GLN A 23 10.500 11.917 0.332 1.00 0.00 C ATOM 311 C GLN A 23 11.989 12.109 0.593 1.00 0.00 C ATOM 312 O GLN A 23 12.456 11.980 1.725 1.00 0.00 O ATOM 313 CB GLN A 23 9.826 11.319 1.567 1.00 0.00 C ATOM 314 CG GLN A 23 9.168 12.353 2.467 1.00 0.00 C ATOM 315 CD GLN A 23 9.055 11.884 3.904 1.00 0.00 C ATOM 316 OE1 GLN A 23 9.514 12.557 4.827 1.00 0.00 O ATOM 317 NE2 GLN A 23 8.440 10.724 4.102 1.00 0.00 N ATOM 0 H GLN A 23 10.002 11.578 -1.679 1.00 0.00 H new ATOM 0 HA GLN A 23 10.057 12.891 0.126 1.00 0.00 H new ATOM 0 HB2 GLN A 23 9.074 10.599 1.246 1.00 0.00 H new ATOM 0 HB3 GLN A 23 10.569 10.768 2.144 1.00 0.00 H new ATOM 0 HG2 GLN A 23 9.744 13.278 2.434 1.00 0.00 H new ATOM 0 HG3 GLN A 23 8.174 12.583 2.084 1.00 0.00 H new ATOM 0 HE21 GLN A 23 8.074 10.199 3.308 1.00 0.00 H new ATOM 0 HE22 GLN A 23 8.333 10.358 5.048 1.00 0.00 H new ATOM 326 N GLY A 24 12.729 12.418 -0.462 1.00 0.00 N ATOM 327 CA GLY A 24 14.159 12.623 -0.331 1.00 0.00 C ATOM 328 C GLY A 24 14.873 11.374 0.138 1.00 0.00 C ATOM 329 O GLY A 24 14.269 10.509 0.773 1.00 0.00 O ATOM 0 H GLY A 24 12.365 12.531 -1.408 1.00 0.00 H new ATOM 0 HA2 GLY A 24 14.569 12.936 -1.291 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.345 13.433 0.374 1.00 0.00 H new ATOM 333 N SER A 25 16.160 11.267 -0.179 1.00 0.00 N ATOM 334 CA SER A 25 16.944 10.105 0.209 1.00 0.00 C ATOM 335 C SER A 25 16.483 8.884 -0.572 1.00 0.00 C ATOM 336 O SER A 25 15.448 8.293 -0.265 1.00 0.00 O ATOM 337 CB SER A 25 16.823 9.846 1.713 1.00 0.00 C ATOM 338 OG SER A 25 16.498 11.035 2.411 1.00 0.00 O ATOM 0 H SER A 25 16.679 11.971 -0.703 1.00 0.00 H new ATOM 0 HA SER A 25 17.991 10.302 -0.021 1.00 0.00 H new ATOM 0 HB2 SER A 25 16.056 9.093 1.895 1.00 0.00 H new ATOM 0 HB3 SER A 25 17.762 9.443 2.092 1.00 0.00 H new ATOM 0 HG SER A 25 16.425 10.842 3.369 1.00 0.00 H new ATOM 344 N ARG A 26 17.256 8.522 -1.591 1.00 0.00 N ATOM 345 CA ARG A 26 16.949 7.389 -2.437 1.00 0.00 C ATOM 346 C ARG A 26 16.432 6.205 -1.626 1.00 0.00 C ATOM 347 O ARG A 26 16.626 6.134 -0.412 1.00 0.00 O ATOM 348 CB ARG A 26 18.198 6.988 -3.215 1.00 0.00 C ATOM 349 CG ARG A 26 19.116 8.148 -3.577 1.00 0.00 C ATOM 350 CD ARG A 26 20.045 7.786 -4.725 1.00 0.00 C ATOM 351 NE ARG A 26 20.930 8.891 -5.083 1.00 0.00 N ATOM 352 CZ ARG A 26 21.911 8.795 -5.978 1.00 0.00 C ATOM 353 NH1 ARG A 26 22.136 7.648 -6.606 1.00 0.00 N ATOM 354 NH2 ARG A 26 22.669 9.850 -6.244 1.00 0.00 N ATOM 0 H ARG A 26 18.113 9.011 -1.848 1.00 0.00 H new ATOM 0 HA ARG A 26 16.159 7.681 -3.129 1.00 0.00 H new ATOM 0 HB2 ARG A 26 18.762 6.265 -2.625 1.00 0.00 H new ATOM 0 HB3 ARG A 26 17.893 6.483 -4.131 1.00 0.00 H new ATOM 0 HG2 ARG A 26 18.516 9.016 -3.852 1.00 0.00 H new ATOM 0 HG3 ARG A 26 19.706 8.432 -2.706 1.00 0.00 H new ATOM 0 HD2 ARG A 26 20.643 6.918 -4.447 1.00 0.00 H new ATOM 0 HD3 ARG A 26 19.453 7.500 -5.594 1.00 0.00 H new ATOM 0 HE ARG A 26 20.788 9.789 -4.620 1.00 0.00 H new ATOM 0 HH11 ARG A 26 21.556 6.834 -6.404 1.00 0.00 H new ATOM 0 HH12 ARG A 26 22.889 7.581 -7.291 1.00 0.00 H new ATOM 0 HH21 ARG A 26 22.500 10.734 -5.763 1.00 0.00 H new ATOM 0 HH22 ARG A 26 23.421 9.778 -6.929 1.00 0.00 H new ATOM 368 N ASN A 27 15.764 5.284 -2.307 1.00 0.00 N ATOM 369 CA ASN A 27 15.204 4.109 -1.658 1.00 0.00 C ATOM 370 C ASN A 27 16.179 2.935 -1.713 1.00 0.00 C ATOM 371 O ASN A 27 17.181 2.972 -2.428 1.00 0.00 O ATOM 372 CB ASN A 27 13.860 3.753 -2.307 1.00 0.00 C ATOM 373 CG ASN A 27 13.459 2.300 -2.136 1.00 0.00 C ATOM 374 OD1 ASN A 27 13.102 1.866 -1.040 1.00 0.00 O ATOM 375 ND2 ASN A 27 13.515 1.543 -3.224 1.00 0.00 N ATOM 0 H ASN A 27 15.597 5.329 -3.312 1.00 0.00 H new ATOM 0 HA ASN A 27 15.032 4.333 -0.605 1.00 0.00 H new ATOM 0 HB2 ASN A 27 13.083 4.387 -1.880 1.00 0.00 H new ATOM 0 HB3 ASN A 27 13.910 3.983 -3.371 1.00 0.00 H new ATOM 0 HD21 ASN A 27 13.256 0.558 -3.174 1.00 0.00 H new ATOM 0 HD22 ASN A 27 13.817 1.946 -4.111 1.00 0.00 H new ATOM 382 N LEU A 28 15.876 1.906 -0.937 1.00 0.00 N ATOM 383 CA LEU A 28 16.699 0.719 -0.854 1.00 0.00 C ATOM 384 C LEU A 28 16.673 -0.089 -2.152 1.00 0.00 C ATOM 385 O LEU A 28 17.617 -0.045 -2.940 1.00 0.00 O ATOM 386 CB LEU A 28 16.212 -0.134 0.311 1.00 0.00 C ATOM 387 CG LEU A 28 17.083 -0.074 1.563 1.00 0.00 C ATOM 388 CD1 LEU A 28 16.484 -0.925 2.673 1.00 0.00 C ATOM 389 CD2 LEU A 28 18.502 -0.521 1.250 1.00 0.00 C ATOM 0 H LEU A 28 15.046 1.875 -0.345 1.00 0.00 H new ATOM 0 HA LEU A 28 17.733 1.025 -0.692 1.00 0.00 H new ATOM 0 HB2 LEU A 28 15.202 0.180 0.574 1.00 0.00 H new ATOM 0 HB3 LEU A 28 16.148 -1.171 -0.019 1.00 0.00 H new ATOM 0 HG LEU A 28 17.119 0.960 1.907 1.00 0.00 H new ATOM 0 HD11 LEU A 28 17.119 -0.869 3.557 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.488 -0.555 2.918 1.00 0.00 H new ATOM 0 HD13 LEU A 28 16.415 -1.961 2.340 1.00 0.00 H new ATOM 0 HD21 LEU A 28 19.107 -0.471 2.155 1.00 0.00 H new ATOM 0 HD22 LEU A 28 18.487 -1.546 0.879 1.00 0.00 H new ATOM 0 HD23 LEU A 28 18.930 0.133 0.491 1.00 0.00 H new ATOM 401 N LEU A 29 15.592 -0.836 -2.359 1.00 0.00 N ATOM 402 CA LEU A 29 15.452 -1.665 -3.553 1.00 0.00 C ATOM 403 C LEU A 29 15.548 -0.813 -4.814 1.00 0.00 C ATOM 404 O LEU A 29 14.951 0.259 -4.900 1.00 0.00 O ATOM 405 CB LEU A 29 14.130 -2.456 -3.548 1.00 0.00 C ATOM 406 CG LEU A 29 13.154 -2.144 -2.406 1.00 0.00 C ATOM 407 CD1 LEU A 29 11.759 -2.643 -2.752 1.00 0.00 C ATOM 408 CD2 LEU A 29 13.638 -2.758 -1.098 1.00 0.00 C ATOM 0 H LEU A 29 14.801 -0.884 -1.717 1.00 0.00 H new ATOM 0 HA LEU A 29 16.272 -2.383 -3.546 1.00 0.00 H new ATOM 0 HB2 LEU A 29 13.619 -2.274 -4.494 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.368 -3.519 -3.514 1.00 0.00 H new ATOM 0 HG LEU A 29 13.111 -1.063 -2.275 1.00 0.00 H new ATOM 0 HD11 LEU A 29 11.077 -2.415 -1.933 1.00 0.00 H new ATOM 0 HD12 LEU A 29 11.412 -2.151 -3.661 1.00 0.00 H new ATOM 0 HD13 LEU A 29 11.787 -3.721 -2.911 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.931 -2.524 -0.302 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.714 -3.840 -1.210 1.00 0.00 H new ATOM 0 HD23 LEU A 29 14.617 -2.350 -0.845 1.00 0.00 H new ATOM 420 N GLN A 30 16.317 -1.292 -5.783 1.00 0.00 N ATOM 421 CA GLN A 30 16.509 -0.576 -7.031 1.00 0.00 C ATOM 422 C GLN A 30 16.644 -1.539 -8.210 1.00 0.00 C ATOM 423 O GLN A 30 15.725 -1.682 -9.014 1.00 0.00 O ATOM 424 CB GLN A 30 17.751 0.303 -6.925 1.00 0.00 C ATOM 425 CG GLN A 30 17.524 1.723 -7.399 1.00 0.00 C ATOM 426 CD GLN A 30 18.738 2.314 -8.087 1.00 0.00 C ATOM 427 OE1 GLN A 30 19.257 1.748 -9.050 1.00 0.00 O ATOM 428 NE2 GLN A 30 19.200 3.458 -7.595 1.00 0.00 N ATOM 0 H GLN A 30 16.819 -2.178 -5.725 1.00 0.00 H new ATOM 0 HA GLN A 30 15.632 0.047 -7.211 1.00 0.00 H new ATOM 0 HB2 GLN A 30 18.086 0.323 -5.888 1.00 0.00 H new ATOM 0 HB3 GLN A 30 18.554 -0.144 -7.511 1.00 0.00 H new ATOM 0 HG2 GLN A 30 16.678 1.741 -8.086 1.00 0.00 H new ATOM 0 HG3 GLN A 30 17.255 2.347 -6.547 1.00 0.00 H new ATOM 0 HE21 GLN A 30 18.739 3.892 -6.796 1.00 0.00 H new ATOM 0 HE22 GLN A 30 20.016 3.902 -8.017 1.00 0.00 H new ATOM 437 N GLY A 31 17.796 -2.193 -8.312 1.00 0.00 N ATOM 438 CA GLY A 31 18.022 -3.123 -9.393 1.00 0.00 C ATOM 439 C GLY A 31 17.581 -4.529 -9.049 1.00 0.00 C ATOM 440 O GLY A 31 16.395 -4.850 -9.121 1.00 0.00 O ATOM 0 H GLY A 31 18.576 -2.093 -7.662 1.00 0.00 H new ATOM 0 HA2 GLY A 31 17.485 -2.783 -10.278 1.00 0.00 H new ATOM 0 HA3 GLY A 31 19.082 -3.130 -9.647 1.00 0.00 H new ATOM 444 N GLU A 32 18.536 -5.369 -8.667 1.00 0.00 N ATOM 445 CA GLU A 32 18.238 -6.749 -8.303 1.00 0.00 C ATOM 446 C GLU A 32 17.559 -6.815 -6.938 1.00 0.00 C ATOM 447 O GLU A 32 16.890 -7.797 -6.617 1.00 0.00 O ATOM 448 CB GLU A 32 19.520 -7.585 -8.292 1.00 0.00 C ATOM 449 CG GLU A 32 19.297 -9.037 -7.901 1.00 0.00 C ATOM 450 CD GLU A 32 20.235 -9.986 -8.621 1.00 0.00 C ATOM 451 OE1 GLU A 32 21.401 -10.107 -8.191 1.00 0.00 O ATOM 452 OE2 GLU A 32 19.803 -10.607 -9.615 1.00 0.00 O ATOM 0 H GLU A 32 19.523 -5.119 -8.601 1.00 0.00 H new ATOM 0 HA GLU A 32 17.555 -7.157 -9.048 1.00 0.00 H new ATOM 0 HB2 GLU A 32 19.975 -7.550 -9.282 1.00 0.00 H new ATOM 0 HB3 GLU A 32 20.231 -7.136 -7.598 1.00 0.00 H new ATOM 0 HG2 GLU A 32 19.433 -9.145 -6.825 1.00 0.00 H new ATOM 0 HG3 GLU A 32 18.266 -9.314 -8.121 1.00 0.00 H new ATOM 459 N GLU A 33 17.727 -5.764 -6.141 1.00 0.00 N ATOM 460 CA GLU A 33 17.121 -5.711 -4.818 1.00 0.00 C ATOM 461 C GLU A 33 15.629 -5.448 -4.921 1.00 0.00 C ATOM 462 O GLU A 33 14.856 -5.819 -4.038 1.00 0.00 O ATOM 463 CB GLU A 33 17.791 -4.638 -3.959 1.00 0.00 C ATOM 464 CG GLU A 33 19.251 -4.928 -3.651 1.00 0.00 C ATOM 465 CD GLU A 33 19.551 -4.902 -2.165 1.00 0.00 C ATOM 466 OE1 GLU A 33 18.865 -4.158 -1.433 1.00 0.00 O ATOM 467 OE2 GLU A 33 20.473 -5.624 -1.732 1.00 0.00 O ATOM 0 H GLU A 33 18.276 -4.941 -6.389 1.00 0.00 H new ATOM 0 HA GLU A 33 17.269 -6.679 -4.339 1.00 0.00 H new ATOM 0 HB2 GLU A 33 17.720 -3.678 -4.471 1.00 0.00 H new ATOM 0 HB3 GLU A 33 17.243 -4.541 -3.022 1.00 0.00 H new ATOM 0 HG2 GLU A 33 19.516 -5.905 -4.054 1.00 0.00 H new ATOM 0 HG3 GLU A 33 19.878 -4.194 -4.157 1.00 0.00 H new ATOM 474 N LEU A 34 15.231 -4.817 -6.013 1.00 0.00 N ATOM 475 CA LEU A 34 13.842 -4.512 -6.255 1.00 0.00 C ATOM 476 C LEU A 34 13.043 -5.794 -6.422 1.00 0.00 C ATOM 477 O LEU A 34 11.908 -5.895 -5.961 1.00 0.00 O ATOM 478 CB LEU A 34 13.728 -3.646 -7.505 1.00 0.00 C ATOM 479 CG LEU A 34 13.313 -2.200 -7.250 1.00 0.00 C ATOM 480 CD1 LEU A 34 13.111 -1.461 -8.565 1.00 0.00 C ATOM 481 CD2 LEU A 34 12.046 -2.139 -6.408 1.00 0.00 C ATOM 0 H LEU A 34 15.863 -4.505 -6.750 1.00 0.00 H new ATOM 0 HA LEU A 34 13.436 -3.967 -5.403 1.00 0.00 H new ATOM 0 HB2 LEU A 34 14.689 -3.647 -8.019 1.00 0.00 H new ATOM 0 HB3 LEU A 34 13.005 -4.102 -8.181 1.00 0.00 H new ATOM 0 HG LEU A 34 14.115 -1.712 -6.697 1.00 0.00 H new ATOM 0 HD11 LEU A 34 12.815 -0.432 -8.362 1.00 0.00 H new ATOM 0 HD12 LEU A 34 14.042 -1.466 -9.132 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.331 -1.955 -9.144 1.00 0.00 H new ATOM 0 HD21 LEU A 34 11.771 -1.098 -6.240 1.00 0.00 H new ATOM 0 HD22 LEU A 34 11.237 -2.649 -6.931 1.00 0.00 H new ATOM 0 HD23 LEU A 34 12.222 -2.627 -5.449 1.00 0.00 H new ATOM 493 N LEU A 35 13.652 -6.778 -7.077 1.00 0.00 N ATOM 494 CA LEU A 35 12.998 -8.060 -7.294 1.00 0.00 C ATOM 495 C LEU A 35 13.034 -8.890 -6.020 1.00 0.00 C ATOM 496 O LEU A 35 12.066 -9.571 -5.682 1.00 0.00 O ATOM 497 CB LEU A 35 13.669 -8.822 -8.441 1.00 0.00 C ATOM 498 CG LEU A 35 14.153 -7.954 -9.605 1.00 0.00 C ATOM 499 CD1 LEU A 35 14.679 -8.825 -10.736 1.00 0.00 C ATOM 500 CD2 LEU A 35 13.032 -7.053 -10.101 1.00 0.00 C ATOM 0 H LEU A 35 14.593 -6.711 -7.464 1.00 0.00 H new ATOM 0 HA LEU A 35 11.959 -7.875 -7.565 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.520 -9.373 -8.041 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.965 -9.559 -8.827 1.00 0.00 H new ATOM 0 HG LEU A 35 14.968 -7.323 -9.249 1.00 0.00 H new ATOM 0 HD11 LEU A 35 15.019 -8.191 -11.555 1.00 0.00 H new ATOM 0 HD12 LEU A 35 15.512 -9.428 -10.374 1.00 0.00 H new ATOM 0 HD13 LEU A 35 13.884 -9.481 -11.090 1.00 0.00 H new ATOM 0 HD21 LEU A 35 13.394 -6.443 -10.929 1.00 0.00 H new ATOM 0 HD22 LEU A 35 12.196 -7.665 -10.440 1.00 0.00 H new ATOM 0 HD23 LEU A 35 12.701 -6.404 -9.290 1.00 0.00 H new ATOM 512 N ARG A 36 14.150 -8.814 -5.302 1.00 0.00 N ATOM 513 CA ARG A 36 14.294 -9.543 -4.052 1.00 0.00 C ATOM 514 C ARG A 36 13.409 -8.910 -2.989 1.00 0.00 C ATOM 515 O ARG A 36 12.848 -9.598 -2.135 1.00 0.00 O ATOM 516 CB ARG A 36 15.754 -9.540 -3.593 1.00 0.00 C ATOM 517 CG ARG A 36 16.556 -10.721 -4.114 1.00 0.00 C ATOM 518 CD ARG A 36 17.824 -10.931 -3.303 1.00 0.00 C ATOM 519 NE ARG A 36 18.288 -12.316 -3.361 1.00 0.00 N ATOM 520 CZ ARG A 36 19.453 -12.727 -2.866 1.00 0.00 C ATOM 521 NH1 ARG A 36 20.274 -11.867 -2.277 1.00 0.00 N ATOM 522 NH2 ARG A 36 19.798 -14.004 -2.960 1.00 0.00 N ATOM 0 H ARG A 36 14.963 -8.257 -5.565 1.00 0.00 H new ATOM 0 HA ARG A 36 13.987 -10.577 -4.208 1.00 0.00 H new ATOM 0 HB2 ARG A 36 16.228 -8.615 -3.922 1.00 0.00 H new ATOM 0 HB3 ARG A 36 15.784 -9.543 -2.503 1.00 0.00 H new ATOM 0 HG2 ARG A 36 15.945 -11.623 -4.077 1.00 0.00 H new ATOM 0 HG3 ARG A 36 16.814 -10.554 -5.160 1.00 0.00 H new ATOM 0 HD2 ARG A 36 18.607 -10.271 -3.676 1.00 0.00 H new ATOM 0 HD3 ARG A 36 17.641 -10.653 -2.265 1.00 0.00 H new ATOM 0 HE ARG A 36 17.684 -13.007 -3.806 1.00 0.00 H new ATOM 0 HH11 ARG A 36 20.014 -10.884 -2.201 1.00 0.00 H new ATOM 0 HH12 ARG A 36 21.165 -12.189 -1.900 1.00 0.00 H new ATOM 0 HH21 ARG A 36 19.171 -14.670 -3.411 1.00 0.00 H new ATOM 0 HH22 ARG A 36 20.691 -14.320 -2.581 1.00 0.00 H new ATOM 536 N ALA A 37 13.283 -7.590 -3.060 1.00 0.00 N ATOM 537 CA ALA A 37 12.465 -6.846 -2.126 1.00 0.00 C ATOM 538 C ALA A 37 10.990 -6.982 -2.473 1.00 0.00 C ATOM 539 O ALA A 37 10.175 -7.343 -1.624 1.00 0.00 O ATOM 540 CB ALA A 37 12.872 -5.385 -2.115 1.00 0.00 C ATOM 0 H ALA A 37 13.744 -7.014 -3.764 1.00 0.00 H new ATOM 0 HA ALA A 37 12.621 -7.260 -1.130 1.00 0.00 H new ATOM 0 HB1 ALA A 37 12.248 -4.839 -1.408 1.00 0.00 H new ATOM 0 HB2 ALA A 37 13.917 -5.301 -1.817 1.00 0.00 H new ATOM 0 HB3 ALA A 37 12.744 -4.964 -3.112 1.00 0.00 H new ATOM 546 N LEU A 38 10.650 -6.697 -3.732 1.00 0.00 N ATOM 547 CA LEU A 38 9.263 -6.801 -4.188 1.00 0.00 C ATOM 548 C LEU A 38 8.646 -8.122 -3.737 1.00 0.00 C ATOM 549 O LEU A 38 7.436 -8.221 -3.537 1.00 0.00 O ATOM 550 CB LEU A 38 9.183 -6.696 -5.716 1.00 0.00 C ATOM 551 CG LEU A 38 8.952 -5.287 -6.271 1.00 0.00 C ATOM 552 CD1 LEU A 38 8.670 -5.347 -7.764 1.00 0.00 C ATOM 553 CD2 LEU A 38 7.803 -4.602 -5.544 1.00 0.00 C ATOM 0 H LEU A 38 11.310 -6.395 -4.448 1.00 0.00 H new ATOM 0 HA LEU A 38 8.705 -5.976 -3.746 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.109 -7.086 -6.138 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.377 -7.341 -6.065 1.00 0.00 H new ATOM 0 HG LEU A 38 9.858 -4.703 -6.108 1.00 0.00 H new ATOM 0 HD11 LEU A 38 8.508 -4.339 -8.144 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.520 -5.796 -8.277 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.779 -5.950 -7.942 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.657 -3.603 -5.954 1.00 0.00 H new ATOM 0 HD22 LEU A 38 6.891 -5.185 -5.674 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.037 -4.527 -4.482 1.00 0.00 H new ATOM 565 N ASP A 39 9.495 -9.133 -3.575 1.00 0.00 N ATOM 566 CA ASP A 39 9.046 -10.450 -3.144 1.00 0.00 C ATOM 567 C ASP A 39 9.193 -10.600 -1.636 1.00 0.00 C ATOM 568 O ASP A 39 9.679 -11.618 -1.142 1.00 0.00 O ATOM 569 CB ASP A 39 9.839 -11.543 -3.862 1.00 0.00 C ATOM 570 CG ASP A 39 9.039 -12.820 -4.035 1.00 0.00 C ATOM 571 OD1 ASP A 39 8.124 -12.834 -4.885 1.00 0.00 O ATOM 572 OD2 ASP A 39 9.327 -13.803 -3.322 1.00 0.00 O ATOM 0 H ASP A 39 10.500 -9.063 -3.737 1.00 0.00 H new ATOM 0 HA ASP A 39 7.992 -10.554 -3.401 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.151 -11.178 -4.840 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.746 -11.760 -3.298 1.00 0.00 H new ATOM 577 N GLN A 40 8.765 -9.575 -0.912 1.00 0.00 N ATOM 578 CA GLN A 40 8.840 -9.580 0.544 1.00 0.00 C ATOM 579 C GLN A 40 7.477 -9.279 1.150 1.00 0.00 C ATOM 580 O GLN A 40 7.347 -8.445 2.048 1.00 0.00 O ATOM 581 CB GLN A 40 9.872 -8.560 1.030 1.00 0.00 C ATOM 582 CG GLN A 40 10.207 -8.689 2.507 1.00 0.00 C ATOM 583 CD GLN A 40 9.941 -7.412 3.280 1.00 0.00 C ATOM 584 OE1 GLN A 40 10.897 -7.014 4.113 1.00 0.00 O flip ATOM 585 NE2 GLN A 40 8.890 -6.790 3.130 1.00 0.00 N flip ATOM 0 H GLN A 40 8.361 -8.727 -1.310 1.00 0.00 H new ATOM 0 HA GLN A 40 9.152 -10.573 0.868 1.00 0.00 H new ATOM 0 HB2 GLN A 40 10.786 -8.675 0.447 1.00 0.00 H new ATOM 0 HB3 GLN A 40 9.496 -7.555 0.838 1.00 0.00 H new ATOM 0 HG2 GLN A 40 9.620 -9.500 2.939 1.00 0.00 H new ATOM 0 HG3 GLN A 40 11.257 -8.963 2.615 1.00 0.00 H new ATOM 0 HE21 GLN A 40 8.183 -7.132 2.479 1.00 0.00 H new ATOM 0 HE22 GLN A 40 8.726 -5.932 3.656 1.00 0.00 H new ATOM 594 N VAL A 41 6.463 -9.969 0.648 1.00 0.00 N ATOM 595 CA VAL A 41 5.102 -9.793 1.123 1.00 0.00 C ATOM 596 C VAL A 41 4.628 -11.013 1.905 1.00 0.00 C ATOM 597 O VAL A 41 4.377 -12.071 1.330 1.00 0.00 O ATOM 598 CB VAL A 41 4.129 -9.531 -0.042 1.00 0.00 C ATOM 599 CG1 VAL A 41 2.749 -9.168 0.485 1.00 0.00 C ATOM 600 CG2 VAL A 41 4.666 -8.435 -0.950 1.00 0.00 C ATOM 0 H VAL A 41 6.561 -10.661 -0.095 1.00 0.00 H new ATOM 0 HA VAL A 41 5.108 -8.925 1.782 1.00 0.00 H new ATOM 0 HB VAL A 41 4.039 -10.445 -0.628 1.00 0.00 H new ATOM 0 HG11 VAL A 41 2.076 -8.987 -0.353 1.00 0.00 H new ATOM 0 HG12 VAL A 41 2.363 -9.989 1.090 1.00 0.00 H new ATOM 0 HG13 VAL A 41 2.818 -8.268 1.096 1.00 0.00 H new ATOM 0 HG21 VAL A 41 3.965 -8.264 -1.767 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.788 -7.515 -0.378 1.00 0.00 H new ATOM 0 HG23 VAL A 41 5.630 -8.739 -1.357 1.00 0.00 H new ATOM 712 N ALA B 108 -0.855 18.883 -7.015 1.00 0.00 N ATOM 713 CA ALA B 108 -1.143 17.516 -6.612 1.00 0.00 C ATOM 714 C ALA B 108 -2.449 17.021 -7.227 1.00 0.00 C ATOM 715 O ALA B 108 -3.480 16.965 -6.557 1.00 0.00 O ATOM 716 CB ALA B 108 -1.202 17.414 -5.095 1.00 0.00 C ATOM 0 HA ALA B 108 -0.337 16.881 -6.979 1.00 0.00 H new ATOM 0 HB1 ALA B 108 -1.418 16.385 -4.808 1.00 0.00 H new ATOM 0 HB2 ALA B 108 -0.243 17.715 -4.673 1.00 0.00 H new ATOM 0 HB3 ALA B 108 -1.987 18.069 -4.717 1.00 0.00 H new ATOM 722 N ASP B 109 -2.396 16.661 -8.505 1.00 0.00 N ATOM 723 CA ASP B 109 -3.573 16.170 -9.210 1.00 0.00 C ATOM 724 C ASP B 109 -3.670 14.647 -9.113 1.00 0.00 C ATOM 725 O ASP B 109 -2.873 13.930 -9.717 1.00 0.00 O ATOM 726 CB ASP B 109 -3.527 16.595 -10.679 1.00 0.00 C ATOM 727 CG ASP B 109 -4.889 17.002 -11.205 1.00 0.00 C ATOM 728 OD1 ASP B 109 -5.731 17.445 -10.393 1.00 0.00 O ATOM 729 OD2 ASP B 109 -5.116 16.879 -12.427 1.00 0.00 O ATOM 0 H ASP B 109 -1.550 16.700 -9.073 1.00 0.00 H new ATOM 0 HA ASP B 109 -4.455 16.604 -8.740 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -2.833 17.428 -10.792 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -3.139 15.773 -11.280 1.00 0.00 H new ATOM 734 N PRO B 110 -4.648 14.131 -8.346 1.00 0.00 N ATOM 735 CA PRO B 110 -4.836 12.686 -8.176 1.00 0.00 C ATOM 736 C PRO B 110 -5.434 12.020 -9.412 1.00 0.00 C ATOM 737 O PRO B 110 -5.467 10.793 -9.510 1.00 0.00 O ATOM 738 CB PRO B 110 -5.807 12.596 -6.999 1.00 0.00 C ATOM 739 CG PRO B 110 -6.587 13.862 -7.058 1.00 0.00 C ATOM 740 CD PRO B 110 -5.645 14.910 -7.585 1.00 0.00 C ATOM 0 HA PRO B 110 -3.890 12.171 -8.012 1.00 0.00 H new ATOM 0 HB2 PRO B 110 -6.457 11.725 -7.087 1.00 0.00 H new ATOM 0 HB3 PRO B 110 -5.275 12.502 -6.052 1.00 0.00 H new ATOM 0 HG2 PRO B 110 -7.454 13.755 -7.709 1.00 0.00 H new ATOM 0 HG3 PRO B 110 -6.961 14.135 -6.071 1.00 0.00 H new ATOM 0 HD2 PRO B 110 -6.161 15.630 -8.220 1.00 0.00 H new ATOM 0 HD3 PRO B 110 -5.180 15.474 -6.776 1.00 0.00 H new ATOM 748 N GLU B 111 -5.907 12.831 -10.355 1.00 0.00 N ATOM 749 CA GLU B 111 -6.506 12.316 -11.579 1.00 0.00 C ATOM 750 C GLU B 111 -5.573 11.339 -12.286 1.00 0.00 C ATOM 751 O GLU B 111 -6.017 10.474 -13.041 1.00 0.00 O ATOM 752 CB GLU B 111 -6.869 13.466 -12.521 1.00 0.00 C ATOM 753 CG GLU B 111 -8.071 14.272 -12.060 1.00 0.00 C ATOM 754 CD GLU B 111 -8.244 15.560 -12.841 1.00 0.00 C ATOM 755 OE1 GLU B 111 -7.246 16.041 -13.420 1.00 0.00 O ATOM 756 OE2 GLU B 111 -9.375 16.087 -12.876 1.00 0.00 O ATOM 0 H GLU B 111 -5.886 13.849 -10.293 1.00 0.00 H new ATOM 0 HA GLU B 111 -7.414 11.780 -11.303 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -6.011 14.131 -12.617 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -7.071 13.062 -13.513 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -8.971 13.666 -12.162 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -7.963 14.505 -11.001 1.00 0.00 H new ATOM 763 N LYS B 112 -4.283 11.485 -12.032 1.00 0.00 N ATOM 764 CA LYS B 112 -3.277 10.620 -12.638 1.00 0.00 C ATOM 765 C LYS B 112 -2.930 9.450 -11.723 1.00 0.00 C ATOM 766 O LYS B 112 -2.365 8.450 -12.168 1.00 0.00 O ATOM 767 CB LYS B 112 -2.015 11.422 -12.961 1.00 0.00 C ATOM 768 CG LYS B 112 -2.045 12.074 -14.334 1.00 0.00 C ATOM 769 CD LYS B 112 -0.856 12.999 -14.538 1.00 0.00 C ATOM 770 CE LYS B 112 -0.681 13.371 -16.003 1.00 0.00 C ATOM 771 NZ LYS B 112 0.630 12.913 -16.539 1.00 0.00 N ATOM 0 H LYS B 112 -3.904 12.197 -11.408 1.00 0.00 H new ATOM 0 HA LYS B 112 -3.694 10.218 -13.561 1.00 0.00 H new ATOM 0 HB2 LYS B 112 -1.881 12.194 -12.204 1.00 0.00 H new ATOM 0 HB3 LYS B 112 -1.149 10.762 -12.900 1.00 0.00 H new ATOM 0 HG2 LYS B 112 -2.044 11.303 -15.104 1.00 0.00 H new ATOM 0 HG3 LYS B 112 -2.970 12.638 -14.450 1.00 0.00 H new ATOM 0 HD2 LYS B 112 -0.992 13.904 -13.946 1.00 0.00 H new ATOM 0 HD3 LYS B 112 0.050 12.514 -14.174 1.00 0.00 H new ATOM 0 HE2 LYS B 112 -1.487 12.929 -16.589 1.00 0.00 H new ATOM 0 HE3 LYS B 112 -0.761 14.452 -16.115 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 0.637 13.016 -17.574 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 1.393 13.488 -16.129 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 0.777 11.914 -16.290 1.00 0.00 H new ATOM 785 N ARG B 113 -3.272 9.573 -10.441 1.00 0.00 N ATOM 786 CA ARG B 113 -2.997 8.520 -9.468 1.00 0.00 C ATOM 787 C ARG B 113 -3.480 7.166 -9.974 1.00 0.00 C ATOM 788 O ARG B 113 -2.957 6.122 -9.587 1.00 0.00 O ATOM 789 CB ARG B 113 -3.661 8.848 -8.129 1.00 0.00 C ATOM 790 CG ARG B 113 -3.353 7.841 -7.034 1.00 0.00 C ATOM 791 CD ARG B 113 -3.990 8.244 -5.714 1.00 0.00 C ATOM 792 NE ARG B 113 -5.418 8.518 -5.858 1.00 0.00 N ATOM 793 CZ ARG B 113 -6.159 9.098 -4.917 1.00 0.00 C ATOM 794 NH1 ARG B 113 -5.614 9.466 -3.763 1.00 0.00 N ATOM 795 NH2 ARG B 113 -7.451 9.311 -5.129 1.00 0.00 N ATOM 0 H ARG B 113 -3.740 10.392 -10.053 1.00 0.00 H new ATOM 0 HA ARG B 113 -1.918 8.466 -9.326 1.00 0.00 H new ATOM 0 HB2 ARG B 113 -3.336 9.836 -7.804 1.00 0.00 H new ATOM 0 HB3 ARG B 113 -4.741 8.899 -8.271 1.00 0.00 H new ATOM 0 HG2 ARG B 113 -3.717 6.857 -7.330 1.00 0.00 H new ATOM 0 HG3 ARG B 113 -2.274 7.757 -6.908 1.00 0.00 H new ATOM 0 HD2 ARG B 113 -3.845 7.448 -4.983 1.00 0.00 H new ATOM 0 HD3 ARG B 113 -3.488 9.130 -5.324 1.00 0.00 H new ATOM 0 HE ARG B 113 -5.873 8.249 -6.730 1.00 0.00 H new ATOM 0 HH11 ARG B 113 -4.621 9.305 -3.593 1.00 0.00 H new ATOM 0 HH12 ARG B 113 -6.188 9.910 -3.046 1.00 0.00 H new ATOM 0 HH21 ARG B 113 -7.876 9.030 -6.013 1.00 0.00 H new ATOM 0 HH22 ARG B 113 -8.020 9.755 -4.408 1.00 0.00 H new ATOM 809 N LYS B 114 -4.480 7.197 -10.844 1.00 0.00 N ATOM 810 CA LYS B 114 -5.036 5.977 -11.414 1.00 0.00 C ATOM 811 C LYS B 114 -4.055 5.348 -12.397 1.00 0.00 C ATOM 812 O LYS B 114 -3.880 4.129 -12.421 1.00 0.00 O ATOM 813 CB LYS B 114 -6.367 6.274 -12.113 1.00 0.00 C ATOM 814 CG LYS B 114 -7.526 5.439 -11.593 1.00 0.00 C ATOM 815 CD LYS B 114 -7.648 5.536 -10.080 1.00 0.00 C ATOM 816 CE LYS B 114 -9.095 5.422 -9.630 1.00 0.00 C ATOM 817 NZ LYS B 114 -9.341 6.158 -8.359 1.00 0.00 N ATOM 0 H LYS B 114 -4.924 8.055 -11.171 1.00 0.00 H new ATOM 0 HA LYS B 114 -5.215 5.270 -10.604 1.00 0.00 H new ATOM 0 HB2 LYS B 114 -6.606 7.330 -11.988 1.00 0.00 H new ATOM 0 HB3 LYS B 114 -6.254 6.097 -13.183 1.00 0.00 H new ATOM 0 HG2 LYS B 114 -8.454 5.774 -12.056 1.00 0.00 H new ATOM 0 HG3 LYS B 114 -7.384 4.398 -11.882 1.00 0.00 H new ATOM 0 HD2 LYS B 114 -7.058 4.746 -9.615 1.00 0.00 H new ATOM 0 HD3 LYS B 114 -7.234 6.485 -9.741 1.00 0.00 H new ATOM 0 HE2 LYS B 114 -9.749 5.814 -10.409 1.00 0.00 H new ATOM 0 HE3 LYS B 114 -9.352 4.371 -9.497 1.00 0.00 H new ATOM 0 HZ1 LYS B 114 -10.339 6.056 -8.086 1.00 0.00 H new ATOM 0 HZ2 LYS B 114 -8.735 5.768 -7.609 1.00 0.00 H new ATOM 0 HZ3 LYS B 114 -9.120 7.165 -8.493 1.00 0.00 H new ATOM 831 N LEU B 115 -3.411 6.187 -13.205 1.00 0.00 N ATOM 832 CA LEU B 115 -2.443 5.707 -14.183 1.00 0.00 C ATOM 833 C LEU B 115 -1.177 5.228 -13.489 1.00 0.00 C ATOM 834 O LEU B 115 -0.553 4.250 -13.905 1.00 0.00 O ATOM 835 CB LEU B 115 -2.105 6.811 -15.188 1.00 0.00 C ATOM 836 CG LEU B 115 -3.084 6.946 -16.355 1.00 0.00 C ATOM 837 CD1 LEU B 115 -2.792 8.207 -17.153 1.00 0.00 C ATOM 838 CD2 LEU B 115 -3.016 5.718 -17.251 1.00 0.00 C ATOM 0 H LEU B 115 -3.542 7.198 -13.201 1.00 0.00 H new ATOM 0 HA LEU B 115 -2.886 4.868 -14.720 1.00 0.00 H new ATOM 0 HB2 LEU B 115 -2.062 7.763 -14.658 1.00 0.00 H new ATOM 0 HB3 LEU B 115 -1.109 6.624 -15.589 1.00 0.00 H new ATOM 0 HG LEU B 115 -4.094 7.022 -15.951 1.00 0.00 H new ATOM 0 HD11 LEU B 115 -3.498 8.286 -17.979 1.00 0.00 H new ATOM 0 HD12 LEU B 115 -2.891 9.078 -16.506 1.00 0.00 H new ATOM 0 HD13 LEU B 115 -1.777 8.161 -17.547 1.00 0.00 H new ATOM 0 HD21 LEU B 115 -3.719 5.830 -18.076 1.00 0.00 H new ATOM 0 HD22 LEU B 115 -2.006 5.612 -17.647 1.00 0.00 H new ATOM 0 HD23 LEU B 115 -3.274 4.831 -16.673 1.00 0.00 H new ATOM 850 N ILE B 116 -0.814 5.921 -12.423 1.00 0.00 N ATOM 851 CA ILE B 116 0.369 5.573 -11.650 1.00 0.00 C ATOM 852 C ILE B 116 0.129 4.296 -10.859 1.00 0.00 C ATOM 853 O ILE B 116 1.042 3.496 -10.655 1.00 0.00 O ATOM 854 CB ILE B 116 0.770 6.707 -10.686 1.00 0.00 C ATOM 855 CG1 ILE B 116 0.959 8.014 -11.458 1.00 0.00 C ATOM 856 CG2 ILE B 116 2.040 6.343 -9.931 1.00 0.00 C ATOM 857 CD1 ILE B 116 0.457 9.233 -10.717 1.00 0.00 C ATOM 0 H ILE B 116 -1.323 6.732 -12.071 1.00 0.00 H new ATOM 0 HA ILE B 116 1.185 5.418 -12.356 1.00 0.00 H new ATOM 0 HB ILE B 116 -0.030 6.845 -9.959 1.00 0.00 H new ATOM 0 HG12 ILE B 116 2.018 8.145 -11.680 1.00 0.00 H new ATOM 0 HG13 ILE B 116 0.439 7.940 -12.413 1.00 0.00 H new ATOM 0 HG21 ILE B 116 2.307 7.156 -9.256 1.00 0.00 H new ATOM 0 HG22 ILE B 116 1.873 5.433 -9.355 1.00 0.00 H new ATOM 0 HG23 ILE B 116 2.851 6.180 -10.641 1.00 0.00 H new ATOM 0 HD11 ILE B 116 0.624 10.122 -11.325 1.00 0.00 H new ATOM 0 HD12 ILE B 116 -0.609 9.124 -10.518 1.00 0.00 H new ATOM 0 HD13 ILE B 116 0.994 9.332 -9.774 1.00 0.00 H new ATOM 869 N GLN B 117 -1.112 4.105 -10.422 1.00 0.00 N ATOM 870 CA GLN B 117 -1.477 2.918 -9.665 1.00 0.00 C ATOM 871 C GLN B 117 -1.446 1.689 -10.564 1.00 0.00 C ATOM 872 O GLN B 117 -1.033 0.612 -10.143 1.00 0.00 O ATOM 873 CB GLN B 117 -2.866 3.081 -9.042 1.00 0.00 C ATOM 874 CG GLN B 117 -2.834 3.341 -7.545 1.00 0.00 C ATOM 875 CD GLN B 117 -3.842 4.387 -7.114 1.00 0.00 C ATOM 876 OE1 GLN B 117 -4.766 4.720 -7.856 1.00 0.00 O ATOM 877 NE2 GLN B 117 -3.669 4.912 -5.906 1.00 0.00 N ATOM 0 H GLN B 117 -1.880 4.758 -10.580 1.00 0.00 H new ATOM 0 HA GLN B 117 -0.752 2.786 -8.862 1.00 0.00 H new ATOM 0 HB2 GLN B 117 -3.382 3.905 -9.535 1.00 0.00 H new ATOM 0 HB3 GLN B 117 -3.449 2.180 -9.234 1.00 0.00 H new ATOM 0 HG2 GLN B 117 -3.032 2.410 -7.014 1.00 0.00 H new ATOM 0 HG3 GLN B 117 -1.834 3.665 -7.257 1.00 0.00 H new ATOM 0 HE21 GLN B 117 -2.889 4.606 -5.324 1.00 0.00 H new ATOM 0 HE22 GLN B 117 -4.316 5.621 -5.560 1.00 0.00 H new ATOM 886 N GLN B 118 -1.879 1.861 -11.809 1.00 0.00 N ATOM 887 CA GLN B 118 -1.891 0.764 -12.769 1.00 0.00 C ATOM 888 C GLN B 118 -0.486 0.249 -13.002 1.00 0.00 C ATOM 889 O GLN B 118 -0.227 -0.949 -12.902 1.00 0.00 O ATOM 890 CB GLN B 118 -2.514 1.213 -14.091 1.00 0.00 C ATOM 891 CG GLN B 118 -3.979 1.598 -13.972 1.00 0.00 C ATOM 892 CD GLN B 118 -4.868 0.814 -14.917 1.00 0.00 C ATOM 893 OE1 GLN B 118 -5.310 -0.291 -14.600 1.00 0.00 O ATOM 894 NE2 GLN B 118 -5.136 1.383 -16.087 1.00 0.00 N ATOM 0 H GLN B 118 -2.225 2.748 -12.176 1.00 0.00 H new ATOM 0 HA GLN B 118 -2.496 -0.044 -12.357 1.00 0.00 H new ATOM 0 HB2 GLN B 118 -1.953 2.064 -14.477 1.00 0.00 H new ATOM 0 HB3 GLN B 118 -2.416 0.409 -14.821 1.00 0.00 H new ATOM 0 HG2 GLN B 118 -4.311 1.434 -12.947 1.00 0.00 H new ATOM 0 HG3 GLN B 118 -4.088 2.663 -14.176 1.00 0.00 H new ATOM 0 HE21 GLN B 118 -4.749 2.300 -16.309 1.00 0.00 H new ATOM 0 HE22 GLN B 118 -5.729 0.903 -16.764 1.00 0.00 H new ATOM 903 N GLN B 119 0.420 1.161 -13.297 1.00 0.00 N ATOM 904 CA GLN B 119 1.810 0.799 -13.530 1.00 0.00 C ATOM 905 C GLN B 119 2.408 0.180 -12.277 1.00 0.00 C ATOM 906 O GLN B 119 3.273 -0.693 -12.350 1.00 0.00 O ATOM 907 CB GLN B 119 2.623 2.021 -13.967 1.00 0.00 C ATOM 908 CG GLN B 119 3.135 1.931 -15.395 1.00 0.00 C ATOM 909 CD GLN B 119 3.575 3.275 -15.943 1.00 0.00 C ATOM 910 OE1 GLN B 119 2.641 4.215 -16.022 1.00 0.00 O flip ATOM 911 NE2 GLN B 119 4.740 3.465 -16.291 1.00 0.00 N flip ATOM 0 H GLN B 119 0.222 2.158 -13.382 1.00 0.00 H new ATOM 0 HA GLN B 119 1.846 0.064 -14.334 1.00 0.00 H new ATOM 0 HB2 GLN B 119 2.005 2.913 -13.867 1.00 0.00 H new ATOM 0 HB3 GLN B 119 3.471 2.143 -13.293 1.00 0.00 H new ATOM 0 HG2 GLN B 119 3.973 1.235 -15.433 1.00 0.00 H new ATOM 0 HG3 GLN B 119 2.352 1.522 -16.033 1.00 0.00 H new ATOM 0 HE21 GLN B 119 5.425 2.713 -16.213 1.00 0.00 H new ATOM 0 HE22 GLN B 119 5.021 4.374 -16.658 1.00 0.00 H new ATOM 920 N LEU B 120 1.919 0.623 -11.128 1.00 0.00 N ATOM 921 CA LEU B 120 2.378 0.097 -9.853 1.00 0.00 C ATOM 922 C LEU B 120 1.773 -1.281 -9.627 1.00 0.00 C ATOM 923 O LEU B 120 2.460 -2.216 -9.221 1.00 0.00 O ATOM 924 CB LEU B 120 1.992 1.039 -8.710 1.00 0.00 C ATOM 925 CG LEU B 120 2.923 0.999 -7.497 1.00 0.00 C ATOM 926 CD1 LEU B 120 2.946 2.350 -6.799 1.00 0.00 C ATOM 927 CD2 LEU B 120 2.494 -0.096 -6.532 1.00 0.00 C ATOM 0 H LEU B 120 1.204 1.346 -11.054 1.00 0.00 H new ATOM 0 HA LEU B 120 3.465 0.016 -9.873 1.00 0.00 H new ATOM 0 HB2 LEU B 120 1.963 2.059 -9.094 1.00 0.00 H new ATOM 0 HB3 LEU B 120 0.982 0.793 -8.382 1.00 0.00 H new ATOM 0 HG LEU B 120 3.932 0.775 -7.843 1.00 0.00 H new ATOM 0 HD11 LEU B 120 3.613 2.304 -5.938 1.00 0.00 H new ATOM 0 HD12 LEU B 120 3.301 3.112 -7.493 1.00 0.00 H new ATOM 0 HD13 LEU B 120 1.940 2.604 -6.465 1.00 0.00 H new ATOM 0 HD21 LEU B 120 3.167 -0.110 -5.675 1.00 0.00 H new ATOM 0 HD22 LEU B 120 1.477 0.097 -6.191 1.00 0.00 H new ATOM 0 HD23 LEU B 120 2.530 -1.061 -7.037 1.00 0.00 H new ATOM 939 N VAL B 121 0.480 -1.399 -9.918 1.00 0.00 N ATOM 940 CA VAL B 121 -0.225 -2.662 -9.771 1.00 0.00 C ATOM 941 C VAL B 121 0.276 -3.668 -10.795 1.00 0.00 C ATOM 942 O VAL B 121 0.428 -4.847 -10.486 1.00 0.00 O ATOM 943 CB VAL B 121 -1.750 -2.487 -9.931 1.00 0.00 C ATOM 944 CG1 VAL B 121 -2.465 -3.821 -9.776 1.00 0.00 C ATOM 945 CG2 VAL B 121 -2.279 -1.474 -8.928 1.00 0.00 C ATOM 0 H VAL B 121 -0.099 -0.631 -10.258 1.00 0.00 H new ATOM 0 HA VAL B 121 -0.026 -3.029 -8.764 1.00 0.00 H new ATOM 0 HB VAL B 121 -1.948 -2.111 -10.935 1.00 0.00 H new ATOM 0 HG11 VAL B 121 -3.539 -3.674 -9.892 1.00 0.00 H new ATOM 0 HG12 VAL B 121 -2.109 -4.515 -10.537 1.00 0.00 H new ATOM 0 HG13 VAL B 121 -2.260 -4.231 -8.787 1.00 0.00 H new ATOM 0 HG21 VAL B 121 -3.356 -1.364 -9.056 1.00 0.00 H new ATOM 0 HG22 VAL B 121 -2.067 -1.819 -7.916 1.00 0.00 H new ATOM 0 HG23 VAL B 121 -1.794 -0.512 -9.092 1.00 0.00 H new ATOM 955 N LEU B 122 0.547 -3.204 -12.016 1.00 0.00 N ATOM 956 CA LEU B 122 1.044 -4.083 -13.047 1.00 0.00 C ATOM 957 C LEU B 122 2.423 -4.601 -12.650 1.00 0.00 C ATOM 958 O LEU B 122 2.740 -5.770 -12.861 1.00 0.00 O ATOM 959 CB LEU B 122 1.077 -3.341 -14.385 1.00 0.00 C ATOM 960 CG LEU B 122 2.428 -3.305 -15.096 1.00 0.00 C ATOM 961 CD1 LEU B 122 2.905 -4.713 -15.431 1.00 0.00 C ATOM 962 CD2 LEU B 122 2.343 -2.463 -16.357 1.00 0.00 C ATOM 0 H LEU B 122 0.428 -2.232 -12.302 1.00 0.00 H new ATOM 0 HA LEU B 122 0.383 -4.942 -13.161 1.00 0.00 H new ATOM 0 HB2 LEU B 122 0.349 -3.803 -15.052 1.00 0.00 H new ATOM 0 HB3 LEU B 122 0.749 -2.315 -14.217 1.00 0.00 H new ATOM 0 HG LEU B 122 3.153 -2.851 -14.421 1.00 0.00 H new ATOM 0 HD11 LEU B 122 3.869 -4.660 -15.937 1.00 0.00 H new ATOM 0 HD12 LEU B 122 3.009 -5.290 -14.512 1.00 0.00 H new ATOM 0 HD13 LEU B 122 2.179 -5.197 -16.084 1.00 0.00 H new ATOM 0 HD21 LEU B 122 3.315 -2.448 -16.851 1.00 0.00 H new ATOM 0 HD22 LEU B 122 1.600 -2.890 -17.030 1.00 0.00 H new ATOM 0 HD23 LEU B 122 2.053 -1.445 -16.096 1.00 0.00 H new ATOM 974 N LEU B 123 3.229 -3.731 -12.042 1.00 0.00 N ATOM 975 CA LEU B 123 4.551 -4.124 -11.587 1.00 0.00 C ATOM 976 C LEU B 123 4.383 -5.112 -10.451 1.00 0.00 C ATOM 977 O LEU B 123 5.058 -6.138 -10.386 1.00 0.00 O ATOM 978 CB LEU B 123 5.354 -2.907 -11.121 1.00 0.00 C ATOM 979 CG LEU B 123 6.249 -2.272 -12.186 1.00 0.00 C ATOM 980 CD1 LEU B 123 6.823 -0.957 -11.683 1.00 0.00 C ATOM 981 CD2 LEU B 123 7.365 -3.227 -12.582 1.00 0.00 C ATOM 0 H LEU B 123 2.987 -2.758 -11.857 1.00 0.00 H new ATOM 0 HA LEU B 123 5.102 -4.582 -12.409 1.00 0.00 H new ATOM 0 HB2 LEU B 123 4.659 -2.151 -10.755 1.00 0.00 H new ATOM 0 HB3 LEU B 123 5.976 -3.204 -10.276 1.00 0.00 H new ATOM 0 HG LEU B 123 5.644 -2.067 -13.069 1.00 0.00 H new ATOM 0 HD11 LEU B 123 7.457 -0.519 -12.453 1.00 0.00 H new ATOM 0 HD12 LEU B 123 6.009 -0.271 -11.449 1.00 0.00 H new ATOM 0 HD13 LEU B 123 7.414 -1.138 -10.785 1.00 0.00 H new ATOM 0 HD21 LEU B 123 7.992 -2.759 -13.341 1.00 0.00 H new ATOM 0 HD22 LEU B 123 7.970 -3.463 -11.706 1.00 0.00 H new ATOM 0 HD23 LEU B 123 6.934 -4.144 -12.983 1.00 0.00 H new ATOM 993 N LEU B 124 3.428 -4.800 -9.583 1.00 0.00 N ATOM 994 CA LEU B 124 3.092 -5.657 -8.465 1.00 0.00 C ATOM 995 C LEU B 124 2.619 -6.988 -9.016 1.00 0.00 C ATOM 996 O LEU B 124 3.047 -8.063 -8.590 1.00 0.00 O ATOM 997 CB LEU B 124 1.987 -4.994 -7.641 1.00 0.00 C ATOM 998 CG LEU B 124 2.453 -3.879 -6.704 1.00 0.00 C ATOM 999 CD1 LEU B 124 1.283 -3.317 -5.914 1.00 0.00 C ATOM 1000 CD2 LEU B 124 3.538 -4.383 -5.769 1.00 0.00 C ATOM 0 H LEU B 124 2.870 -3.948 -9.638 1.00 0.00 H new ATOM 0 HA LEU B 124 3.957 -5.816 -7.822 1.00 0.00 H new ATOM 0 HB2 LEU B 124 1.242 -4.585 -8.324 1.00 0.00 H new ATOM 0 HB3 LEU B 124 1.489 -5.761 -7.048 1.00 0.00 H new ATOM 0 HG LEU B 124 2.871 -3.076 -7.311 1.00 0.00 H new ATOM 0 HD11 LEU B 124 1.637 -2.525 -5.254 1.00 0.00 H new ATOM 0 HD12 LEU B 124 0.541 -2.912 -6.602 1.00 0.00 H new ATOM 0 HD13 LEU B 124 0.831 -4.111 -5.319 1.00 0.00 H new ATOM 0 HD21 LEU B 124 3.856 -3.574 -5.111 1.00 0.00 H new ATOM 0 HD22 LEU B 124 3.149 -5.206 -5.170 1.00 0.00 H new ATOM 0 HD23 LEU B 124 4.390 -4.731 -6.354 1.00 0.00 H new ATOM 1012 N HIS B 125 1.759 -6.883 -10.013 1.00 0.00 N ATOM 1013 CA HIS B 125 1.232 -8.038 -10.711 1.00 0.00 C ATOM 1014 C HIS B 125 2.384 -8.827 -11.286 1.00 0.00 C ATOM 1015 O HIS B 125 2.738 -9.899 -10.802 1.00 0.00 O ATOM 1016 CB HIS B 125 0.321 -7.591 -11.856 1.00 0.00 C ATOM 1017 CG HIS B 125 0.082 -8.654 -12.885 1.00 0.00 C ATOM 1018 ND1 HIS B 125 -0.959 -9.553 -12.833 1.00 0.00 N ATOM 1019 CD2 HIS B 125 0.788 -8.963 -14.005 1.00 0.00 C ATOM 1020 CE1 HIS B 125 -0.855 -10.364 -13.894 1.00 0.00 C ATOM 1021 NE2 HIS B 125 0.187 -10.048 -14.637 1.00 0.00 N ATOM 0 H HIS B 125 1.407 -5.991 -10.361 1.00 0.00 H new ATOM 0 HA HIS B 125 0.659 -8.649 -10.013 1.00 0.00 H new ATOM 0 HB2 HIS B 125 -0.637 -7.275 -11.444 1.00 0.00 H new ATOM 0 HB3 HIS B 125 0.762 -6.721 -12.341 1.00 0.00 H new ATOM 0 HD1 HIS B 125 -1.681 -9.594 -12.114 1.00 0.00 H new ATOM 0 HD2 HIS B 125 1.673 -8.449 -14.349 1.00 0.00 H new ATOM 0 HE1 HIS B 125 -1.537 -11.172 -14.113 1.00 0.00 H new ATOM 1029 N ALA B 126 2.966 -8.253 -12.326 1.00 0.00 N ATOM 1030 CA ALA B 126 4.103 -8.852 -13.011 1.00 0.00 C ATOM 1031 C ALA B 126 5.097 -9.417 -12.003 1.00 0.00 C ATOM 1032 O ALA B 126 5.745 -10.435 -12.250 1.00 0.00 O ATOM 1033 CB ALA B 126 4.780 -7.825 -13.908 1.00 0.00 C ATOM 0 H ALA B 126 2.666 -7.361 -12.719 1.00 0.00 H new ATOM 0 HA ALA B 126 3.741 -9.671 -13.632 1.00 0.00 H new ATOM 0 HB1 ALA B 126 5.628 -8.286 -14.414 1.00 0.00 H new ATOM 0 HB2 ALA B 126 4.068 -7.464 -14.650 1.00 0.00 H new ATOM 0 HB3 ALA B 126 5.130 -6.988 -13.303 1.00 0.00 H new ATOM 1039 N HIS B 127 5.196 -8.749 -10.852 1.00 0.00 N ATOM 1040 CA HIS B 127 6.090 -9.178 -9.786 1.00 0.00 C ATOM 1041 C HIS B 127 5.767 -10.614 -9.377 1.00 0.00 C ATOM 1042 O HIS B 127 6.659 -11.453 -9.250 1.00 0.00 O ATOM 1043 CB HIS B 127 5.966 -8.222 -8.586 1.00 0.00 C ATOM 1044 CG HIS B 127 5.841 -8.904 -7.256 1.00 0.00 C ATOM 1045 ND1 HIS B 127 4.637 -9.066 -6.605 1.00 0.00 N ATOM 1046 CD2 HIS B 127 6.777 -9.471 -6.458 1.00 0.00 C ATOM 1047 CE1 HIS B 127 4.836 -9.704 -5.464 1.00 0.00 C ATOM 1048 NE2 HIS B 127 6.125 -9.961 -5.352 1.00 0.00 N ATOM 0 H HIS B 127 4.664 -7.906 -10.638 1.00 0.00 H new ATOM 0 HA HIS B 127 7.119 -9.150 -10.144 1.00 0.00 H new ATOM 0 HB2 HIS B 127 6.840 -7.571 -8.565 1.00 0.00 H new ATOM 0 HB3 HIS B 127 5.096 -7.583 -8.735 1.00 0.00 H new ATOM 0 HD1 HIS B 127 3.733 -8.744 -6.950 1.00 0.00 H new ATOM 0 HD2 HIS B 127 7.838 -9.527 -6.654 1.00 0.00 H new ATOM 0 HE1 HIS B 127 4.074 -9.969 -4.747 1.00 0.00 H new ATOM 1057 N LYS B 128 4.481 -10.886 -9.176 1.00 0.00 N ATOM 1058 CA LYS B 128 4.029 -12.217 -8.784 1.00 0.00 C ATOM 1059 C LYS B 128 3.558 -13.018 -9.999 1.00 0.00 C ATOM 1060 O LYS B 128 3.585 -14.248 -9.990 1.00 0.00 O ATOM 1061 CB LYS B 128 2.895 -12.110 -7.761 1.00 0.00 C ATOM 1062 CG LYS B 128 1.689 -11.340 -8.271 1.00 0.00 C ATOM 1063 CD LYS B 128 0.492 -11.504 -7.348 1.00 0.00 C ATOM 1064 CE LYS B 128 0.310 -10.292 -6.448 1.00 0.00 C ATOM 1065 NZ LYS B 128 -1.095 -10.156 -5.974 1.00 0.00 N ATOM 0 H LYS B 128 3.732 -10.201 -9.278 1.00 0.00 H new ATOM 0 HA LYS B 128 4.872 -12.740 -8.333 1.00 0.00 H new ATOM 0 HB2 LYS B 128 2.580 -13.113 -7.473 1.00 0.00 H new ATOM 0 HB3 LYS B 128 3.273 -11.624 -6.861 1.00 0.00 H new ATOM 0 HG2 LYS B 128 1.941 -10.283 -8.358 1.00 0.00 H new ATOM 0 HG3 LYS B 128 1.429 -11.689 -9.271 1.00 0.00 H new ATOM 0 HD2 LYS B 128 -0.409 -11.655 -7.943 1.00 0.00 H new ATOM 0 HD3 LYS B 128 0.623 -12.396 -6.736 1.00 0.00 H new ATOM 0 HE2 LYS B 128 0.976 -10.375 -5.589 1.00 0.00 H new ATOM 0 HE3 LYS B 128 0.599 -9.391 -6.990 1.00 0.00 H new ATOM 0 HZ1 LYS B 128 -1.176 -9.318 -5.364 1.00 0.00 H new ATOM 0 HZ2 LYS B 128 -1.729 -10.051 -6.792 1.00 0.00 H new ATOM 0 HZ3 LYS B 128 -1.363 -11.004 -5.435 1.00 0.00 H new ATOM 1079 N CYS B 129 3.123 -12.311 -11.040 1.00 0.00 N ATOM 1080 CA CYS B 129 2.642 -12.949 -12.262 1.00 0.00 C ATOM 1081 C CYS B 129 3.646 -13.974 -12.779 1.00 0.00 C ATOM 1082 O CYS B 129 3.299 -15.132 -13.015 1.00 0.00 O ATOM 1083 CB CYS B 129 2.371 -11.895 -13.339 1.00 0.00 C ATOM 1084 SG CYS B 129 1.349 -12.489 -14.727 1.00 0.00 S ATOM 0 H CYS B 129 3.094 -11.292 -11.061 1.00 0.00 H new ATOM 0 HA CYS B 129 1.713 -13.468 -12.027 1.00 0.00 H new ATOM 0 HB2 CYS B 129 1.876 -11.040 -12.878 1.00 0.00 H new ATOM 0 HB3 CYS B 129 3.324 -11.539 -13.731 1.00 0.00 H new ATOM 0 HG CYS B 129 0.649 -11.503 -15.204 1.00 0.00 H new ATOM 1089 N GLN B 130 4.891 -13.545 -12.954 1.00 0.00 N ATOM 1090 CA GLN B 130 5.938 -14.434 -13.441 1.00 0.00 C ATOM 1091 C GLN B 130 6.243 -15.530 -12.428 1.00 0.00 C ATOM 1092 O GLN B 130 6.784 -16.580 -12.773 1.00 0.00 O ATOM 1093 CB GLN B 130 7.209 -13.641 -13.758 1.00 0.00 C ATOM 1094 CG GLN B 130 7.316 -13.222 -15.216 1.00 0.00 C ATOM 1095 CD GLN B 130 8.721 -13.380 -15.765 1.00 0.00 C ATOM 1096 OE1 GLN B 130 8.912 -13.861 -16.882 1.00 0.00 O ATOM 1097 NE2 GLN B 130 9.713 -12.975 -14.981 1.00 0.00 N ATOM 0 H GLN B 130 5.199 -12.591 -12.767 1.00 0.00 H new ATOM 0 HA GLN B 130 5.578 -14.905 -14.355 1.00 0.00 H new ATOM 0 HB2 GLN B 130 7.238 -12.751 -13.130 1.00 0.00 H new ATOM 0 HB3 GLN B 130 8.078 -14.244 -13.497 1.00 0.00 H new ATOM 0 HG2 GLN B 130 6.627 -13.819 -15.814 1.00 0.00 H new ATOM 0 HG3 GLN B 130 7.006 -12.182 -15.315 1.00 0.00 H new ATOM 0 HE21 GLN B 130 9.509 -12.582 -14.062 1.00 0.00 H new ATOM 0 HE22 GLN B 130 10.679 -13.057 -15.298 1.00 0.00 H new ATOM 1106 N ARG B 131 5.887 -15.276 -11.178 1.00 0.00 N ATOM 1107 CA ARG B 131 6.113 -16.235 -10.102 1.00 0.00 C ATOM 1108 C ARG B 131 4.891 -17.119 -9.874 1.00 0.00 C ATOM 1109 O ARG B 131 4.942 -18.083 -9.109 1.00 0.00 O ATOM 1110 CB ARG B 131 6.487 -15.512 -8.808 1.00 0.00 C ATOM 1111 CG ARG B 131 7.980 -15.272 -8.655 1.00 0.00 C ATOM 1112 CD ARG B 131 8.309 -14.635 -7.314 1.00 0.00 C ATOM 1113 NE ARG B 131 8.535 -13.196 -7.433 1.00 0.00 N ATOM 1114 CZ ARG B 131 9.549 -12.659 -8.106 1.00 0.00 C ATOM 1115 NH1 ARG B 131 10.433 -13.434 -8.720 1.00 0.00 N ATOM 1116 NH2 ARG B 131 9.679 -11.340 -8.166 1.00 0.00 N ATOM 0 H ARG B 131 5.438 -14.410 -10.881 1.00 0.00 H new ATOM 0 HA ARG B 131 6.941 -16.876 -10.403 1.00 0.00 H new ATOM 0 HB2 ARG B 131 5.968 -14.554 -8.774 1.00 0.00 H new ATOM 0 HB3 ARG B 131 6.133 -16.097 -7.959 1.00 0.00 H new ATOM 0 HG2 ARG B 131 8.513 -16.218 -8.750 1.00 0.00 H new ATOM 0 HG3 ARG B 131 8.330 -14.627 -9.461 1.00 0.00 H new ATOM 0 HD2 ARG B 131 7.492 -14.817 -6.616 1.00 0.00 H new ATOM 0 HD3 ARG B 131 9.197 -15.108 -6.896 1.00 0.00 H new ATOM 0 HE ARG B 131 7.877 -12.567 -6.973 1.00 0.00 H new ATOM 0 HH11 ARG B 131 10.338 -14.449 -8.678 1.00 0.00 H new ATOM 0 HH12 ARG B 131 11.208 -13.015 -9.234 1.00 0.00 H new ATOM 0 HH21 ARG B 131 9.002 -10.739 -7.696 1.00 0.00 H new ATOM 0 HH22 ARG B 131 10.456 -10.927 -8.682 1.00 0.00 H new ATOM 1130 N ARG B 132 3.799 -16.782 -10.540 1.00 0.00 N ATOM 1131 CA ARG B 132 2.557 -17.538 -10.413 1.00 0.00 C ATOM 1132 C ARG B 132 2.694 -18.923 -11.042 1.00 0.00 C ATOM 1133 O ARG B 132 2.051 -19.878 -10.606 1.00 0.00 O ATOM 1134 CB ARG B 132 1.402 -16.775 -11.067 1.00 0.00 C ATOM 1135 CG ARG B 132 0.328 -16.337 -10.084 1.00 0.00 C ATOM 1136 CD ARG B 132 -0.850 -17.299 -10.079 1.00 0.00 C ATOM 1137 NE ARG B 132 -2.085 -16.649 -9.647 1.00 0.00 N ATOM 1138 CZ ARG B 132 -3.286 -17.218 -9.718 1.00 0.00 C ATOM 1139 NH1 ARG B 132 -3.418 -18.448 -10.199 1.00 0.00 N ATOM 1140 NH2 ARG B 132 -4.358 -16.556 -9.303 1.00 0.00 N ATOM 0 H ARG B 132 3.744 -15.987 -11.177 1.00 0.00 H new ATOM 0 HA ARG B 132 2.344 -17.664 -9.352 1.00 0.00 H new ATOM 0 HB2 ARG B 132 1.799 -15.896 -11.574 1.00 0.00 H new ATOM 0 HB3 ARG B 132 0.948 -17.405 -11.831 1.00 0.00 H new ATOM 0 HG2 ARG B 132 0.753 -16.276 -9.082 1.00 0.00 H new ATOM 0 HG3 ARG B 132 -0.019 -15.337 -10.344 1.00 0.00 H new ATOM 0 HD2 ARG B 132 -0.987 -17.710 -11.079 1.00 0.00 H new ATOM 0 HD3 ARG B 132 -0.631 -18.137 -9.418 1.00 0.00 H new ATOM 0 HE ARG B 132 -2.023 -15.704 -9.269 1.00 0.00 H new ATOM 0 HH11 ARG B 132 -2.596 -18.962 -10.517 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -4.341 -18.879 -10.251 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -4.261 -15.612 -8.930 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -5.279 -16.991 -9.357 1.00 0.00 H new ATOM 1154 N GLU B 133 3.534 -19.022 -12.067 1.00 0.00 N ATOM 1155 CA GLU B 133 3.752 -20.289 -12.755 1.00 0.00 C ATOM 1156 C GLU B 133 4.637 -21.218 -11.927 1.00 0.00 C ATOM 1157 O GLU B 133 4.558 -22.439 -12.051 1.00 0.00 O ATOM 1158 CB GLU B 133 4.391 -20.046 -14.124 1.00 0.00 C ATOM 1159 CG GLU B 133 3.753 -18.905 -14.900 1.00 0.00 C ATOM 1160 CD GLU B 133 4.035 -18.982 -16.388 1.00 0.00 C ATOM 1161 OE1 GLU B 133 5.000 -19.674 -16.774 1.00 0.00 O ATOM 1162 OE2 GLU B 133 3.290 -18.351 -17.166 1.00 0.00 O ATOM 0 H GLU B 133 4.074 -18.241 -12.439 1.00 0.00 H new ATOM 0 HA GLU B 133 2.783 -20.769 -12.892 1.00 0.00 H new ATOM 0 HB2 GLU B 133 5.451 -19.833 -13.988 1.00 0.00 H new ATOM 0 HB3 GLU B 133 4.322 -20.959 -14.715 1.00 0.00 H new ATOM 0 HG2 GLU B 133 2.675 -18.918 -14.737 1.00 0.00 H new ATOM 0 HG3 GLU B 133 4.123 -17.956 -14.513 1.00 0.00 H new ATOM 1169 N GLN B 134 5.480 -20.630 -11.084 1.00 0.00 N ATOM 1170 CA GLN B 134 6.378 -21.407 -10.237 1.00 0.00 C ATOM 1171 C GLN B 134 5.595 -22.339 -9.317 1.00 0.00 C ATOM 1172 O GLN B 134 6.047 -23.441 -9.004 1.00 0.00 O ATOM 1173 CB GLN B 134 7.261 -20.475 -9.405 1.00 0.00 C ATOM 1174 CG GLN B 134 8.662 -21.014 -9.168 1.00 0.00 C ATOM 1175 CD GLN B 134 9.413 -20.238 -8.104 1.00 0.00 C ATOM 1176 OE1 GLN B 134 8.812 -19.685 -7.182 1.00 0.00 O ATOM 1177 NE2 GLN B 134 10.734 -20.193 -8.227 1.00 0.00 N ATOM 0 H GLN B 134 5.560 -19.620 -10.969 1.00 0.00 H new ATOM 0 HA GLN B 134 7.009 -22.015 -10.885 1.00 0.00 H new ATOM 0 HB2 GLN B 134 7.332 -19.511 -9.908 1.00 0.00 H new ATOM 0 HB3 GLN B 134 6.781 -20.298 -8.442 1.00 0.00 H new ATOM 0 HG2 GLN B 134 8.599 -22.061 -8.872 1.00 0.00 H new ATOM 0 HG3 GLN B 134 9.223 -20.980 -10.102 1.00 0.00 H new ATOM 0 HE21 GLN B 134 11.190 -20.666 -9.007 1.00 0.00 H new ATOM 0 HE22 GLN B 134 11.293 -19.685 -7.541 1.00 0.00 H new ATOM 1186 N ALA B 135 4.421 -21.889 -8.887 1.00 0.00 N ATOM 1187 CA ALA B 135 3.578 -22.683 -8.001 1.00 0.00 C ATOM 1188 C ALA B 135 2.545 -23.481 -8.790 1.00 0.00 C ATOM 1189 O ALA B 135 2.256 -24.632 -8.465 1.00 0.00 O ATOM 1190 CB ALA B 135 2.890 -21.784 -6.985 1.00 0.00 C ATOM 0 H ALA B 135 4.032 -20.980 -9.137 1.00 0.00 H new ATOM 0 HA ALA B 135 4.216 -23.391 -7.472 1.00 0.00 H new ATOM 0 HB1 ALA B 135 2.264 -22.389 -6.329 1.00 0.00 H new ATOM 0 HB2 ALA B 135 3.642 -21.265 -6.391 1.00 0.00 H new ATOM 0 HB3 ALA B 135 2.271 -21.053 -7.506 1.00 0.00 H new ATOM 1196 N ASN B 136 1.991 -22.861 -9.827 1.00 0.00 N ATOM 1197 CA ASN B 136 0.988 -23.516 -10.660 1.00 0.00 C ATOM 1198 C ASN B 136 1.618 -24.101 -11.920 1.00 0.00 C ATOM 1199 O ASN B 136 0.950 -24.263 -12.941 1.00 0.00 O ATOM 1200 CB ASN B 136 -0.112 -22.524 -11.043 1.00 0.00 C ATOM 1201 CG ASN B 136 -0.672 -21.786 -9.842 1.00 0.00 C ATOM 1202 OD1 ASN B 136 0.006 -20.953 -9.240 1.00 0.00 O ATOM 1203 ND2 ASN B 136 -1.915 -22.090 -9.487 1.00 0.00 N ATOM 0 H ASN B 136 2.219 -21.908 -10.110 1.00 0.00 H new ATOM 0 HA ASN B 136 0.552 -24.331 -10.083 1.00 0.00 H new ATOM 0 HB2 ASN B 136 0.286 -21.802 -11.756 1.00 0.00 H new ATOM 0 HB3 ASN B 136 -0.919 -23.057 -11.546 1.00 0.00 H new ATOM 0 HD21 ASN B 136 -2.345 -21.626 -8.686 1.00 0.00 H new ATOM 0 HD22 ASN B 136 -2.440 -22.787 -10.015 1.00 0.00 H new ATOM 1210 N GLY B 137 2.909 -24.417 -11.845 1.00 0.00 N ATOM 1211 CA GLY B 137 3.603 -24.980 -12.989 1.00 0.00 C ATOM 1212 C GLY B 137 3.440 -24.137 -14.240 1.00 0.00 C ATOM 1213 O GLY B 137 3.280 -22.920 -14.159 1.00 0.00 O ATOM 0 H GLY B 137 3.485 -24.293 -11.013 1.00 0.00 H new ATOM 0 HA2 GLY B 137 4.663 -25.076 -12.755 1.00 0.00 H new ATOM 0 HA3 GLY B 137 3.226 -25.985 -13.180 1.00 0.00 H new ATOM 1217 N GLU B 138 3.481 -24.785 -15.399 1.00 0.00 N ATOM 1218 CA GLU B 138 3.335 -24.088 -16.669 1.00 0.00 C ATOM 1219 C GLU B 138 1.906 -23.589 -16.853 1.00 0.00 C ATOM 1220 O GLU B 138 0.993 -24.374 -17.107 1.00 0.00 O ATOM 1221 CB GLU B 138 3.720 -25.007 -17.830 1.00 0.00 C ATOM 1222 CG GLU B 138 3.612 -24.343 -19.194 1.00 0.00 C ATOM 1223 CD GLU B 138 2.670 -25.078 -20.128 1.00 0.00 C ATOM 1224 OE1 GLU B 138 1.702 -25.693 -19.634 1.00 0.00 O ATOM 1225 OE2 GLU B 138 2.901 -25.037 -21.356 1.00 0.00 O ATOM 0 H GLU B 138 3.614 -25.793 -15.484 1.00 0.00 H new ATOM 0 HA GLU B 138 4.004 -23.228 -16.661 1.00 0.00 H new ATOM 0 HB2 GLU B 138 4.743 -25.354 -17.684 1.00 0.00 H new ATOM 0 HB3 GLU B 138 3.079 -25.888 -17.813 1.00 0.00 H new ATOM 0 HG2 GLU B 138 3.266 -23.317 -19.068 1.00 0.00 H new ATOM 0 HG3 GLU B 138 4.601 -24.292 -19.648 1.00 0.00 H new ATOM 1232 N VAL B 139 1.719 -22.280 -16.721 1.00 0.00 N ATOM 1233 CA VAL B 139 0.401 -21.677 -16.869 1.00 0.00 C ATOM 1234 C VAL B 139 0.317 -20.854 -18.148 1.00 0.00 C ATOM 1235 O VAL B 139 1.335 -20.424 -18.693 1.00 0.00 O ATOM 1236 CB VAL B 139 0.052 -20.772 -15.676 1.00 0.00 C ATOM 1237 CG1 VAL B 139 -1.437 -20.467 -15.652 1.00 0.00 C ATOM 1238 CG2 VAL B 139 0.496 -21.409 -14.366 1.00 0.00 C ATOM 0 H VAL B 139 2.465 -21.616 -16.512 1.00 0.00 H new ATOM 0 HA VAL B 139 -0.314 -22.498 -16.912 1.00 0.00 H new ATOM 0 HB VAL B 139 0.590 -19.831 -15.793 1.00 0.00 H new ATOM 0 HG11 VAL B 139 -1.663 -19.825 -14.800 1.00 0.00 H new ATOM 0 HG12 VAL B 139 -1.719 -19.959 -16.574 1.00 0.00 H new ATOM 0 HG13 VAL B 139 -1.998 -21.398 -15.564 1.00 0.00 H new ATOM 0 HG21 VAL B 139 0.239 -20.751 -13.536 1.00 0.00 H new ATOM 0 HG22 VAL B 139 -0.007 -22.367 -14.239 1.00 0.00 H new ATOM 0 HG23 VAL B 139 1.575 -21.565 -14.385 1.00 0.00 H new ATOM 1248 N ARG B 140 -0.902 -20.638 -18.621 1.00 0.00 N ATOM 1249 CA ARG B 140 -1.127 -19.865 -19.835 1.00 0.00 C ATOM 1250 C ARG B 140 -0.628 -18.434 -19.667 1.00 0.00 C ATOM 1251 O ARG B 140 -0.678 -17.874 -18.572 1.00 0.00 O ATOM 1252 CB ARG B 140 -2.614 -19.861 -20.195 1.00 0.00 C ATOM 1253 CG ARG B 140 -3.522 -19.535 -19.019 1.00 0.00 C ATOM 1254 CD ARG B 140 -4.501 -18.418 -19.354 1.00 0.00 C ATOM 1255 NE ARG B 140 -4.243 -17.212 -18.572 1.00 0.00 N ATOM 1256 CZ ARG B 140 -5.087 -16.187 -18.490 1.00 0.00 C ATOM 1257 NH1 ARG B 140 -6.244 -16.216 -19.141 1.00 0.00 N ATOM 1258 NH2 ARG B 140 -4.774 -15.128 -17.757 1.00 0.00 N ATOM 0 H ARG B 140 -1.753 -20.988 -18.181 1.00 0.00 H new ATOM 0 HA ARG B 140 -0.567 -20.334 -20.644 1.00 0.00 H new ATOM 0 HB2 ARG B 140 -2.786 -19.134 -20.989 1.00 0.00 H new ATOM 0 HB3 ARG B 140 -2.886 -20.838 -20.594 1.00 0.00 H new ATOM 0 HG2 ARG B 140 -4.075 -20.428 -18.728 1.00 0.00 H new ATOM 0 HG3 ARG B 140 -2.916 -19.242 -18.162 1.00 0.00 H new ATOM 0 HD2 ARG B 140 -4.433 -18.183 -20.416 1.00 0.00 H new ATOM 0 HD3 ARG B 140 -5.519 -18.760 -19.168 1.00 0.00 H new ATOM 0 HE ARG B 140 -3.364 -17.152 -18.058 1.00 0.00 H new ATOM 0 HH11 ARG B 140 -6.490 -17.027 -19.708 1.00 0.00 H new ATOM 0 HH12 ARG B 140 -6.887 -15.427 -19.074 1.00 0.00 H new ATOM 0 HH21 ARG B 140 -3.886 -15.099 -17.256 1.00 0.00 H new ATOM 0 HH22 ARG B 140 -5.421 -14.342 -17.694 1.00 0.00 H new ATOM 1272 N GLN B 141 -0.147 -17.847 -20.758 1.00 0.00 N ATOM 1273 CA GLN B 141 0.361 -16.480 -20.729 1.00 0.00 C ATOM 1274 C GLN B 141 -0.786 -15.475 -20.678 1.00 0.00 C ATOM 1275 O GLN B 141 -1.449 -15.225 -21.684 1.00 0.00 O ATOM 1276 CB GLN B 141 1.234 -16.212 -21.956 1.00 0.00 C ATOM 1277 CG GLN B 141 0.489 -16.343 -23.274 1.00 0.00 C ATOM 1278 CD GLN B 141 1.401 -16.720 -24.425 1.00 0.00 C ATOM 1279 OE1 GLN B 141 2.395 -16.044 -24.692 1.00 0.00 O ATOM 1280 NE2 GLN B 141 1.066 -17.805 -25.113 1.00 0.00 N ATOM 0 H GLN B 141 -0.098 -18.296 -21.673 1.00 0.00 H new ATOM 0 HA GLN B 141 0.965 -16.362 -19.829 1.00 0.00 H new ATOM 0 HB2 GLN B 141 1.651 -15.208 -21.882 1.00 0.00 H new ATOM 0 HB3 GLN B 141 2.074 -16.907 -21.953 1.00 0.00 H new ATOM 0 HG2 GLN B 141 -0.292 -17.097 -23.172 1.00 0.00 H new ATOM 0 HG3 GLN B 141 -0.007 -15.399 -23.502 1.00 0.00 H new ATOM 0 HE21 GLN B 141 0.233 -18.335 -24.856 1.00 0.00 H new ATOM 0 HE22 GLN B 141 1.642 -18.109 -25.898 1.00 0.00 H new ATOM 1289 N CYS B 142 -1.019 -14.910 -19.492 1.00 0.00 N ATOM 1290 CA CYS B 142 -2.084 -13.942 -19.282 1.00 0.00 C ATOM 1291 C CYS B 142 -2.228 -12.988 -20.469 1.00 0.00 C ATOM 1292 O CYS B 142 -1.241 -12.624 -21.107 1.00 0.00 O ATOM 1293 CB CYS B 142 -1.825 -13.142 -18.003 1.00 0.00 C ATOM 1294 SG CYS B 142 -0.180 -12.358 -17.935 1.00 0.00 S ATOM 0 H CYS B 142 -0.473 -15.114 -18.655 1.00 0.00 H new ATOM 0 HA CYS B 142 -3.017 -14.497 -19.184 1.00 0.00 H new ATOM 0 HB2 CYS B 142 -2.588 -12.369 -17.910 1.00 0.00 H new ATOM 0 HB3 CYS B 142 -1.936 -13.804 -17.144 1.00 0.00 H new ATOM 0 HG CYS B 142 0.333 -12.527 -16.752 1.00 0.00 H new ATOM 1299 N ASN B 143 -3.464 -12.590 -20.754 1.00 0.00 N ATOM 1300 CA ASN B 143 -3.736 -11.681 -21.860 1.00 0.00 C ATOM 1301 C ASN B 143 -3.555 -10.229 -21.427 1.00 0.00 C ATOM 1302 O ASN B 143 -4.476 -9.418 -21.531 1.00 0.00 O ATOM 1303 CB ASN B 143 -5.156 -11.897 -22.388 1.00 0.00 C ATOM 1304 CG ASN B 143 -5.264 -13.124 -23.273 1.00 0.00 C ATOM 1305 OD1 ASN B 143 -5.385 -13.013 -24.493 1.00 0.00 O ATOM 1306 ND2 ASN B 143 -5.217 -14.301 -22.661 1.00 0.00 N ATOM 0 H ASN B 143 -4.292 -12.883 -20.235 1.00 0.00 H new ATOM 0 HA ASN B 143 -3.024 -11.894 -22.658 1.00 0.00 H new ATOM 0 HB2 ASN B 143 -5.842 -11.998 -21.547 1.00 0.00 H new ATOM 0 HB3 ASN B 143 -5.469 -11.018 -22.951 1.00 0.00 H new ATOM 0 HD21 ASN B 143 -5.282 -15.162 -23.205 1.00 0.00 H new ATOM 0 HD22 ASN B 143 -5.116 -14.345 -21.647 1.00 0.00 H new ATOM 1313 N LEU B 144 -2.361 -9.908 -20.941 1.00 0.00 N ATOM 1314 CA LEU B 144 -2.057 -8.556 -20.491 1.00 0.00 C ATOM 1315 C LEU B 144 -0.650 -8.144 -20.922 1.00 0.00 C ATOM 1316 O LEU B 144 0.318 -8.360 -20.194 1.00 0.00 O ATOM 1317 CB LEU B 144 -2.176 -8.462 -18.969 1.00 0.00 C ATOM 1318 CG LEU B 144 -3.590 -8.215 -18.436 1.00 0.00 C ATOM 1319 CD1 LEU B 144 -3.999 -9.319 -17.472 1.00 0.00 C ATOM 1320 CD2 LEU B 144 -3.671 -6.856 -17.753 1.00 0.00 C ATOM 0 H LEU B 144 -1.588 -10.567 -20.849 1.00 0.00 H new ATOM 0 HA LEU B 144 -2.777 -7.878 -20.950 1.00 0.00 H new ATOM 0 HB2 LEU B 144 -1.798 -9.387 -18.534 1.00 0.00 H new ATOM 0 HB3 LEU B 144 -1.528 -7.658 -18.620 1.00 0.00 H new ATOM 0 HG LEU B 144 -4.281 -8.221 -19.279 1.00 0.00 H new ATOM 0 HD11 LEU B 144 -5.007 -9.126 -17.104 1.00 0.00 H new ATOM 0 HD12 LEU B 144 -3.979 -10.279 -17.988 1.00 0.00 H new ATOM 0 HD13 LEU B 144 -3.305 -9.344 -16.632 1.00 0.00 H new ATOM 0 HD21 LEU B 144 -4.683 -6.696 -17.380 1.00 0.00 H new ATOM 0 HD22 LEU B 144 -2.968 -6.825 -16.921 1.00 0.00 H new ATOM 0 HD23 LEU B 144 -3.420 -6.073 -18.469 1.00 0.00 H new ATOM 1332 N PRO B 145 -0.519 -7.539 -22.115 1.00 0.00 N ATOM 1333 CA PRO B 145 0.779 -7.096 -22.633 1.00 0.00 C ATOM 1334 C PRO B 145 1.533 -6.221 -21.634 1.00 0.00 C ATOM 1335 O PRO B 145 2.758 -6.117 -21.686 1.00 0.00 O ATOM 1336 CB PRO B 145 0.409 -6.288 -23.879 1.00 0.00 C ATOM 1337 CG PRO B 145 -0.907 -6.836 -24.308 1.00 0.00 C ATOM 1338 CD PRO B 145 -1.621 -7.237 -23.047 1.00 0.00 C ATOM 0 HA PRO B 145 1.444 -7.935 -22.836 1.00 0.00 H new ATOM 0 HB2 PRO B 145 0.341 -5.224 -23.655 1.00 0.00 H new ATOM 0 HB3 PRO B 145 1.159 -6.401 -24.662 1.00 0.00 H new ATOM 0 HG2 PRO B 145 -1.479 -6.090 -24.860 1.00 0.00 H new ATOM 0 HG3 PRO B 145 -0.776 -7.691 -24.971 1.00 0.00 H new ATOM 0 HD2 PRO B 145 -2.257 -6.435 -22.672 1.00 0.00 H new ATOM 0 HD3 PRO B 145 -2.262 -8.104 -23.206 1.00 0.00 H new ATOM 1346 N HIS B 146 0.790 -5.592 -20.728 1.00 0.00 N ATOM 1347 CA HIS B 146 1.384 -4.725 -19.718 1.00 0.00 C ATOM 1348 C HIS B 146 2.372 -5.492 -18.843 1.00 0.00 C ATOM 1349 O HIS B 146 3.495 -5.040 -18.617 1.00 0.00 O ATOM 1350 CB HIS B 146 0.289 -4.105 -18.847 1.00 0.00 C ATOM 1351 CG HIS B 146 -0.088 -2.715 -19.254 1.00 0.00 C ATOM 1352 ND1 HIS B 146 0.099 -2.225 -20.530 1.00 0.00 N ATOM 1353 CD2 HIS B 146 -0.646 -1.705 -18.544 1.00 0.00 C ATOM 1354 CE1 HIS B 146 -0.327 -0.976 -20.586 1.00 0.00 C ATOM 1355 NE2 HIS B 146 -0.784 -0.637 -19.395 1.00 0.00 N ATOM 0 H HIS B 146 -0.226 -5.667 -20.673 1.00 0.00 H new ATOM 0 HA HIS B 146 1.928 -3.933 -20.232 1.00 0.00 H new ATOM 0 HB2 HIS B 146 -0.597 -4.739 -18.887 1.00 0.00 H new ATOM 0 HB3 HIS B 146 0.625 -4.092 -17.810 1.00 0.00 H new ATOM 0 HD2 HIS B 146 -0.929 -1.735 -17.502 1.00 0.00 H new ATOM 0 HE1 HIS B 146 -0.305 -0.340 -21.458 1.00 0.00 H new ATOM 0 HE2 HIS B 146 -1.176 0.271 -19.147 1.00 0.00 H new ATOM 1364 N CYS B 147 1.946 -6.651 -18.348 1.00 0.00 N ATOM 1365 CA CYS B 147 2.794 -7.477 -17.490 1.00 0.00 C ATOM 1366 C CYS B 147 4.119 -7.793 -18.175 1.00 0.00 C ATOM 1367 O CYS B 147 5.176 -7.326 -17.751 1.00 0.00 O ATOM 1368 CB CYS B 147 2.095 -8.789 -17.109 1.00 0.00 C ATOM 1369 SG CYS B 147 0.275 -8.705 -17.013 1.00 0.00 S ATOM 0 H CYS B 147 1.020 -7.040 -18.525 1.00 0.00 H new ATOM 0 HA CYS B 147 2.986 -6.904 -16.583 1.00 0.00 H new ATOM 0 HB2 CYS B 147 2.369 -9.552 -17.838 1.00 0.00 H new ATOM 0 HB3 CYS B 147 2.478 -9.118 -16.143 1.00 0.00 H new ATOM 0 HG CYS B 147 -0.140 -9.415 -16.006 1.00 0.00 H new ATOM 1374 N ARG B 148 4.049 -8.595 -19.234 1.00 0.00 N ATOM 1375 CA ARG B 148 5.236 -8.991 -19.991 1.00 0.00 C ATOM 1376 C ARG B 148 6.170 -7.804 -20.223 1.00 0.00 C ATOM 1377 O ARG B 148 7.390 -7.936 -20.130 1.00 0.00 O ATOM 1378 CB ARG B 148 4.828 -9.600 -21.333 1.00 0.00 C ATOM 1379 CG ARG B 148 6.006 -10.090 -22.162 1.00 0.00 C ATOM 1380 CD ARG B 148 5.566 -10.531 -23.548 1.00 0.00 C ATOM 1381 NE ARG B 148 6.184 -11.796 -23.943 1.00 0.00 N ATOM 1382 CZ ARG B 148 6.178 -12.268 -25.187 1.00 0.00 C ATOM 1383 NH1 ARG B 148 5.589 -11.585 -26.161 1.00 0.00 N ATOM 1384 NH2 ARG B 148 6.761 -13.427 -25.459 1.00 0.00 N ATOM 0 H ARG B 148 3.177 -8.986 -19.590 1.00 0.00 H new ATOM 0 HA ARG B 148 5.772 -9.736 -19.404 1.00 0.00 H new ATOM 0 HB2 ARG B 148 4.149 -10.434 -21.153 1.00 0.00 H new ATOM 0 HB3 ARG B 148 4.275 -8.857 -21.907 1.00 0.00 H new ATOM 0 HG2 ARG B 148 6.746 -9.295 -22.250 1.00 0.00 H new ATOM 0 HG3 ARG B 148 6.491 -10.922 -21.651 1.00 0.00 H new ATOM 0 HD2 ARG B 148 4.481 -10.636 -23.568 1.00 0.00 H new ATOM 0 HD3 ARG B 148 5.825 -9.759 -24.273 1.00 0.00 H new ATOM 0 HE ARG B 148 6.647 -12.349 -23.222 1.00 0.00 H new ATOM 0 HH11 ARG B 148 5.138 -10.693 -25.958 1.00 0.00 H new ATOM 0 HH12 ARG B 148 5.588 -11.952 -27.113 1.00 0.00 H new ATOM 0 HH21 ARG B 148 7.214 -13.957 -24.715 1.00 0.00 H new ATOM 0 HH22 ARG B 148 6.756 -13.789 -26.413 1.00 0.00 H new ATOM 1398 N THR B 149 5.589 -6.647 -20.521 1.00 0.00 N ATOM 1399 CA THR B 149 6.373 -5.440 -20.759 1.00 0.00 C ATOM 1400 C THR B 149 7.189 -5.080 -19.525 1.00 0.00 C ATOM 1401 O THR B 149 8.400 -4.877 -19.611 1.00 0.00 O ATOM 1402 CB THR B 149 5.460 -4.275 -21.144 1.00 0.00 C ATOM 1403 OG1 THR B 149 4.690 -4.598 -22.288 1.00 0.00 O ATOM 1404 CG2 THR B 149 6.214 -2.998 -21.444 1.00 0.00 C ATOM 0 H THR B 149 4.580 -6.519 -20.603 1.00 0.00 H new ATOM 0 HA THR B 149 7.057 -5.635 -21.585 1.00 0.00 H new ATOM 0 HB THR B 149 4.824 -4.107 -20.275 1.00 0.00 H new ATOM 0 HG1 THR B 149 3.777 -4.827 -22.014 1.00 0.00 H new ATOM 0 HG21 THR B 149 5.507 -2.212 -21.710 1.00 0.00 H new ATOM 0 HG22 THR B 149 6.780 -2.694 -20.563 1.00 0.00 H new ATOM 0 HG23 THR B 149 6.899 -3.167 -22.275 1.00 0.00 H new ATOM 1412 N MET B 150 6.526 -5.012 -18.373 1.00 0.00 N ATOM 1413 CA MET B 150 7.213 -4.686 -17.129 1.00 0.00 C ATOM 1414 C MET B 150 8.325 -5.688 -16.877 1.00 0.00 C ATOM 1415 O MET B 150 9.401 -5.329 -16.408 1.00 0.00 O ATOM 1416 CB MET B 150 6.235 -4.666 -15.952 1.00 0.00 C ATOM 1417 CG MET B 150 5.597 -3.308 -15.710 1.00 0.00 C ATOM 1418 SD MET B 150 6.812 -1.998 -15.460 1.00 0.00 S ATOM 1419 CE MET B 150 6.193 -0.742 -16.576 1.00 0.00 C ATOM 0 H MET B 150 5.524 -5.177 -18.276 1.00 0.00 H new ATOM 0 HA MET B 150 7.645 -3.690 -17.223 1.00 0.00 H new ATOM 0 HB2 MET B 150 5.449 -5.400 -16.132 1.00 0.00 H new ATOM 0 HB3 MET B 150 6.761 -4.977 -15.049 1.00 0.00 H new ATOM 0 HG2 MET B 150 4.964 -3.053 -16.560 1.00 0.00 H new ATOM 0 HG3 MET B 150 4.948 -3.367 -14.836 1.00 0.00 H new ATOM 0 HE1 MET B 150 6.753 0.182 -16.431 1.00 0.00 H new ATOM 0 HE2 MET B 150 6.311 -1.080 -17.606 1.00 0.00 H new ATOM 0 HE3 MET B 150 5.138 -0.562 -16.372 1.00 0.00 H new ATOM 1429 N LYS B 151 8.075 -6.944 -17.232 1.00 0.00 N ATOM 1430 CA LYS B 151 9.084 -7.981 -17.082 1.00 0.00 C ATOM 1431 C LYS B 151 10.337 -7.528 -17.808 1.00 0.00 C ATOM 1432 O LYS B 151 11.454 -7.622 -17.297 1.00 0.00 O ATOM 1433 CB LYS B 151 8.586 -9.292 -17.683 1.00 0.00 C ATOM 1434 CG LYS B 151 9.155 -10.525 -17.004 1.00 0.00 C ATOM 1435 CD LYS B 151 10.638 -10.675 -17.293 1.00 0.00 C ATOM 1436 CE LYS B 151 10.906 -10.809 -18.784 1.00 0.00 C ATOM 1437 NZ LYS B 151 12.029 -11.746 -19.065 1.00 0.00 N ATOM 0 H LYS B 151 7.189 -7.265 -17.622 1.00 0.00 H new ATOM 0 HA LYS B 151 9.294 -8.146 -16.025 1.00 0.00 H new ATOM 0 HB2 LYS B 151 7.498 -9.321 -17.619 1.00 0.00 H new ATOM 0 HB3 LYS B 151 8.844 -9.318 -18.742 1.00 0.00 H new ATOM 0 HG2 LYS B 151 8.997 -10.457 -15.928 1.00 0.00 H new ATOM 0 HG3 LYS B 151 8.623 -11.412 -17.349 1.00 0.00 H new ATOM 0 HD2 LYS B 151 11.175 -9.811 -16.902 1.00 0.00 H new ATOM 0 HD3 LYS B 151 11.024 -11.552 -16.773 1.00 0.00 H new ATOM 0 HE2 LYS B 151 10.005 -11.163 -19.284 1.00 0.00 H new ATOM 0 HE3 LYS B 151 11.138 -9.829 -19.201 1.00 0.00 H new ATOM 0 HZ1 LYS B 151 12.436 -11.530 -19.997 1.00 0.00 H new ATOM 0 HZ2 LYS B 151 12.761 -11.639 -18.334 1.00 0.00 H new ATOM 0 HZ3 LYS B 151 11.675 -12.724 -19.060 1.00 0.00 H new ATOM 1451 N ASN B 152 10.111 -7.009 -19.006 1.00 0.00 N ATOM 1452 CA ASN B 152 11.175 -6.494 -19.849 1.00 0.00 C ATOM 1453 C ASN B 152 11.743 -5.206 -19.261 1.00 0.00 C ATOM 1454 O ASN B 152 12.960 -5.033 -19.174 1.00 0.00 O ATOM 1455 CB ASN B 152 10.640 -6.232 -21.258 1.00 0.00 C ATOM 1456 CG ASN B 152 11.649 -6.577 -22.336 1.00 0.00 C ATOM 1457 OD1 ASN B 152 12.125 -5.703 -23.061 1.00 0.00 O ATOM 1458 ND2 ASN B 152 11.981 -7.858 -22.447 1.00 0.00 N ATOM 0 H ASN B 152 9.182 -6.934 -19.420 1.00 0.00 H new ATOM 0 HA ASN B 152 11.972 -7.236 -19.900 1.00 0.00 H new ATOM 0 HB2 ASN B 152 9.733 -6.817 -21.413 1.00 0.00 H new ATOM 0 HB3 ASN B 152 10.362 -5.182 -21.348 1.00 0.00 H new ATOM 0 HD21 ASN B 152 12.655 -8.151 -23.154 1.00 0.00 H new ATOM 0 HD22 ASN B 152 11.562 -8.549 -21.825 1.00 0.00 H new ATOM 1465 N VAL B 153 10.853 -4.302 -18.850 1.00 0.00 N ATOM 1466 CA VAL B 153 11.274 -3.035 -18.267 1.00 0.00 C ATOM 1467 C VAL B 153 12.036 -3.271 -16.970 1.00 0.00 C ATOM 1468 O VAL B 153 12.945 -2.517 -16.624 1.00 0.00 O ATOM 1469 CB VAL B 153 10.072 -2.107 -17.993 1.00 0.00 C ATOM 1470 CG1 VAL B 153 10.540 -0.772 -17.432 1.00 0.00 C ATOM 1471 CG2 VAL B 153 9.256 -1.902 -19.261 1.00 0.00 C ATOM 0 H VAL B 153 9.842 -4.426 -18.911 1.00 0.00 H new ATOM 0 HA VAL B 153 11.927 -2.548 -18.991 1.00 0.00 H new ATOM 0 HB VAL B 153 9.434 -2.583 -17.248 1.00 0.00 H new ATOM 0 HG11 VAL B 153 9.677 -0.133 -17.246 1.00 0.00 H new ATOM 0 HG12 VAL B 153 11.077 -0.938 -16.498 1.00 0.00 H new ATOM 0 HG13 VAL B 153 11.202 -0.288 -18.150 1.00 0.00 H new ATOM 0 HG21 VAL B 153 8.413 -1.245 -19.049 1.00 0.00 H new ATOM 0 HG22 VAL B 153 9.884 -1.450 -20.029 1.00 0.00 H new ATOM 0 HG23 VAL B 153 8.886 -2.864 -19.615 1.00 0.00 H new ATOM 1481 N LEU B 154 11.665 -4.327 -16.261 1.00 0.00 N ATOM 1482 CA LEU B 154 12.310 -4.675 -15.021 1.00 0.00 C ATOM 1483 C LEU B 154 13.764 -5.045 -15.269 1.00 0.00 C ATOM 1484 O LEU B 154 14.667 -4.539 -14.605 1.00 0.00 O ATOM 1485 CB LEU B 154 11.558 -5.837 -14.388 1.00 0.00 C ATOM 1486 CG LEU B 154 10.542 -5.442 -13.320 1.00 0.00 C ATOM 1487 CD1 LEU B 154 9.734 -6.651 -12.876 1.00 0.00 C ATOM 1488 CD2 LEU B 154 11.240 -4.797 -12.132 1.00 0.00 C ATOM 0 H LEU B 154 10.912 -4.958 -16.534 1.00 0.00 H new ATOM 0 HA LEU B 154 12.294 -3.822 -14.343 1.00 0.00 H new ATOM 0 HB2 LEU B 154 11.041 -6.387 -15.174 1.00 0.00 H new ATOM 0 HB3 LEU B 154 12.282 -6.520 -13.944 1.00 0.00 H new ATOM 0 HG LEU B 154 9.856 -4.713 -13.752 1.00 0.00 H new ATOM 0 HD11 LEU B 154 9.015 -6.349 -12.114 1.00 0.00 H new ATOM 0 HD12 LEU B 154 9.202 -7.067 -13.732 1.00 0.00 H new ATOM 0 HD13 LEU B 154 10.404 -7.405 -12.463 1.00 0.00 H new ATOM 0 HD21 LEU B 154 10.500 -4.522 -11.381 1.00 0.00 H new ATOM 0 HD22 LEU B 154 11.950 -5.502 -11.701 1.00 0.00 H new ATOM 0 HD23 LEU B 154 11.771 -3.904 -12.463 1.00 0.00 H new ATOM 1500 N ASN B 155 13.978 -5.915 -16.247 1.00 0.00 N ATOM 1501 CA ASN B 155 15.324 -6.343 -16.607 1.00 0.00 C ATOM 1502 C ASN B 155 16.183 -5.128 -16.935 1.00 0.00 C ATOM 1503 O ASN B 155 17.380 -5.098 -16.645 1.00 0.00 O ATOM 1504 CB ASN B 155 15.281 -7.296 -17.802 1.00 0.00 C ATOM 1505 CG ASN B 155 15.244 -8.753 -17.380 1.00 0.00 C ATOM 1506 OD1 ASN B 155 16.179 -9.253 -16.754 1.00 0.00 O ATOM 1507 ND2 ASN B 155 14.160 -9.441 -17.721 1.00 0.00 N ATOM 0 H ASN B 155 13.237 -6.338 -16.806 1.00 0.00 H new ATOM 0 HA ASN B 155 15.762 -6.871 -15.760 1.00 0.00 H new ATOM 0 HB2 ASN B 155 14.403 -7.074 -18.409 1.00 0.00 H new ATOM 0 HB3 ASN B 155 16.155 -7.125 -18.431 1.00 0.00 H new ATOM 0 HD21 ASN B 155 14.078 -10.425 -17.464 1.00 0.00 H new ATOM 0 HD22 ASN B 155 13.409 -8.986 -18.240 1.00 0.00 H new ATOM 1514 N HIS B 156 15.550 -4.120 -17.526 1.00 0.00 N ATOM 1515 CA HIS B 156 16.233 -2.885 -17.881 1.00 0.00 C ATOM 1516 C HIS B 156 16.722 -2.181 -16.628 1.00 0.00 C ATOM 1517 O HIS B 156 17.921 -2.018 -16.409 1.00 0.00 O ATOM 1518 CB HIS B 156 15.273 -1.963 -18.628 1.00 0.00 C ATOM 1519 CG HIS B 156 15.848 -0.624 -18.977 1.00 0.00 C ATOM 1520 ND1 HIS B 156 17.140 -0.237 -18.695 1.00 0.00 N ATOM 1521 CD2 HIS B 156 15.263 0.442 -19.579 1.00 0.00 C ATOM 1522 CE1 HIS B 156 17.291 1.025 -19.120 1.00 0.00 C ATOM 1523 NE2 HIS B 156 16.183 1.480 -19.665 1.00 0.00 N ATOM 0 H HIS B 156 14.560 -4.137 -17.770 1.00 0.00 H new ATOM 0 HA HIS B 156 17.085 -3.125 -18.517 1.00 0.00 H new ATOM 0 HB2 HIS B 156 14.953 -2.458 -19.545 1.00 0.00 H new ATOM 0 HB3 HIS B 156 14.382 -1.815 -18.018 1.00 0.00 H new ATOM 0 HD1 HIS B 156 17.854 -0.809 -18.244 1.00 0.00 H new ATOM 0 HD2 HIS B 156 14.244 0.478 -19.935 1.00 0.00 H new ATOM 0 HE1 HIS B 156 18.204 1.595 -19.027 1.00 0.00 H new ATOM 1531 N MET B 157 15.763 -1.760 -15.819 1.00 0.00 N ATOM 1532 CA MET B 157 16.052 -1.055 -14.573 1.00 0.00 C ATOM 1533 C MET B 157 17.140 -1.760 -13.766 1.00 0.00 C ATOM 1534 O MET B 157 18.013 -1.112 -13.188 1.00 0.00 O ATOM 1535 CB MET B 157 14.779 -0.931 -13.736 1.00 0.00 C ATOM 1536 CG MET B 157 14.742 0.312 -12.860 1.00 0.00 C ATOM 1537 SD MET B 157 14.085 -0.014 -11.212 1.00 0.00 S ATOM 1538 CE MET B 157 12.801 -1.208 -11.578 1.00 0.00 C ATOM 0 H MET B 157 14.769 -1.894 -16.002 1.00 0.00 H new ATOM 0 HA MET B 157 16.418 -0.061 -14.830 1.00 0.00 H new ATOM 0 HB2 MET B 157 13.916 -0.921 -14.402 1.00 0.00 H new ATOM 0 HB3 MET B 157 14.683 -1.814 -13.103 1.00 0.00 H new ATOM 0 HG2 MET B 157 15.750 0.718 -12.771 1.00 0.00 H new ATOM 0 HG3 MET B 157 14.133 1.075 -13.345 1.00 0.00 H new ATOM 0 HE1 MET B 157 11.967 -1.067 -10.891 1.00 0.00 H new ATOM 0 HE2 MET B 157 12.455 -1.068 -12.602 1.00 0.00 H new ATOM 0 HE3 MET B 157 13.199 -2.216 -11.464 1.00 0.00 H new ATOM 1548 N THR B 158 17.088 -3.089 -13.732 1.00 0.00 N ATOM 1549 CA THR B 158 18.077 -3.873 -12.995 1.00 0.00 C ATOM 1550 C THR B 158 19.487 -3.611 -13.522 1.00 0.00 C ATOM 1551 O THR B 158 20.475 -3.897 -12.843 1.00 0.00 O ATOM 1552 CB THR B 158 17.755 -5.366 -13.087 1.00 0.00 C ATOM 1553 OG1 THR B 158 16.361 -5.571 -13.221 1.00 0.00 O ATOM 1554 CG2 THR B 158 18.217 -6.152 -11.880 1.00 0.00 C ATOM 0 H THR B 158 16.375 -3.645 -14.204 1.00 0.00 H new ATOM 0 HA THR B 158 18.036 -3.565 -11.950 1.00 0.00 H new ATOM 0 HB THR B 158 18.294 -5.724 -13.964 1.00 0.00 H new ATOM 0 HG1 THR B 158 16.085 -5.356 -14.136 1.00 0.00 H new ATOM 0 HG21 THR B 158 17.958 -7.203 -12.009 1.00 0.00 H new ATOM 0 HG22 THR B 158 19.298 -6.055 -11.774 1.00 0.00 H new ATOM 0 HG23 THR B 158 17.729 -5.765 -10.985 1.00 0.00 H new ATOM 1562 N HIS B 159 19.576 -3.058 -14.729 1.00 0.00 N ATOM 1563 CA HIS B 159 20.860 -2.748 -15.338 1.00 0.00 C ATOM 1564 C HIS B 159 20.910 -1.284 -15.767 1.00 0.00 C ATOM 1565 O HIS B 159 21.745 -0.893 -16.582 1.00 0.00 O ATOM 1566 CB HIS B 159 21.113 -3.660 -16.541 1.00 0.00 C ATOM 1567 CG HIS B 159 22.453 -4.330 -16.513 1.00 0.00 C ATOM 1568 ND1 HIS B 159 23.509 -3.932 -17.305 1.00 0.00 N ATOM 1569 CD2 HIS B 159 22.905 -5.377 -15.783 1.00 0.00 C ATOM 1570 CE1 HIS B 159 24.553 -4.705 -17.064 1.00 0.00 C ATOM 1571 NE2 HIS B 159 24.213 -5.589 -16.144 1.00 0.00 N ATOM 0 H HIS B 159 18.769 -2.816 -15.304 1.00 0.00 H new ATOM 0 HA HIS B 159 21.642 -2.919 -14.598 1.00 0.00 H new ATOM 0 HB2 HIS B 159 20.335 -4.423 -16.578 1.00 0.00 H new ATOM 0 HB3 HIS B 159 21.028 -3.073 -17.456 1.00 0.00 H new ATOM 0 HD2 HIS B 159 22.342 -5.940 -15.053 1.00 0.00 H new ATOM 0 HE1 HIS B 159 25.520 -4.627 -17.539 1.00 0.00 H new ATOM 0 HE2 HIS B 159 24.823 -6.312 -15.763 1.00 0.00 H new ATOM 1580 N CYS B 160 20.005 -0.484 -15.211 1.00 0.00 N ATOM 1581 CA CYS B 160 19.932 0.934 -15.528 1.00 0.00 C ATOM 1582 C CYS B 160 20.435 1.771 -14.355 1.00 0.00 C ATOM 1583 O CYS B 160 19.867 1.733 -13.263 1.00 0.00 O ATOM 1584 CB CYS B 160 18.490 1.313 -15.865 1.00 0.00 C ATOM 1585 SG CYS B 160 18.293 3.002 -16.516 1.00 0.00 S ATOM 0 H CYS B 160 19.309 -0.799 -14.535 1.00 0.00 H new ATOM 0 HA CYS B 160 20.567 1.135 -16.391 1.00 0.00 H new ATOM 0 HB2 CYS B 160 18.103 0.606 -16.598 1.00 0.00 H new ATOM 0 HB3 CYS B 160 17.880 1.208 -14.968 1.00 0.00 H new ATOM 1590 N GLN B 161 21.510 2.520 -14.584 1.00 0.00 N ATOM 1591 CA GLN B 161 22.094 3.357 -13.542 1.00 0.00 C ATOM 1592 C GLN B 161 21.823 4.842 -13.788 1.00 0.00 C ATOM 1593 O GLN B 161 22.095 5.678 -12.927 1.00 0.00 O ATOM 1594 CB GLN B 161 23.602 3.110 -13.455 1.00 0.00 C ATOM 1595 CG GLN B 161 24.043 2.508 -12.130 1.00 0.00 C ATOM 1596 CD GLN B 161 25.549 2.361 -12.030 1.00 0.00 C ATOM 1597 OE1 GLN B 161 26.083 1.254 -12.092 1.00 0.00 O ATOM 1598 NE2 GLN B 161 26.243 3.483 -11.874 1.00 0.00 N ATOM 0 H GLN B 161 21.993 2.564 -15.481 1.00 0.00 H new ATOM 0 HA GLN B 161 21.623 3.085 -12.597 1.00 0.00 H new ATOM 0 HB2 GLN B 161 23.900 2.444 -14.265 1.00 0.00 H new ATOM 0 HB3 GLN B 161 24.126 4.053 -13.609 1.00 0.00 H new ATOM 0 HG2 GLN B 161 23.688 3.136 -11.313 1.00 0.00 H new ATOM 0 HG3 GLN B 161 23.577 1.530 -12.006 1.00 0.00 H new ATOM 0 HE21 GLN B 161 25.759 4.380 -11.828 1.00 0.00 H new ATOM 0 HE22 GLN B 161 27.260 3.448 -11.801 1.00 0.00 H new ATOM 1607 N SER B 162 21.290 5.168 -14.963 1.00 0.00 N ATOM 1608 CA SER B 162 20.990 6.554 -15.307 1.00 0.00 C ATOM 1609 C SER B 162 20.119 7.204 -14.235 1.00 0.00 C ATOM 1610 O SER B 162 20.442 8.273 -13.719 1.00 0.00 O ATOM 1611 CB SER B 162 20.289 6.627 -16.665 1.00 0.00 C ATOM 1612 OG SER B 162 21.045 5.967 -17.665 1.00 0.00 O ATOM 0 H SER B 162 21.058 4.492 -15.691 1.00 0.00 H new ATOM 0 HA SER B 162 21.932 7.099 -15.365 1.00 0.00 H new ATOM 0 HB2 SER B 162 19.301 6.173 -16.593 1.00 0.00 H new ATOM 0 HB3 SER B 162 20.141 7.670 -16.946 1.00 0.00 H new ATOM 0 HG SER B 162 20.485 5.296 -18.109 1.00 0.00 H new ATOM 1618 N GLY B 163 19.014 6.545 -13.906 1.00 0.00 N ATOM 1619 CA GLY B 163 18.110 7.061 -12.898 1.00 0.00 C ATOM 1620 C GLY B 163 17.516 8.398 -13.273 1.00 0.00 C ATOM 1621 O GLY B 163 18.230 9.385 -13.456 1.00 0.00 O ATOM 0 H GLY B 163 18.728 5.659 -14.322 1.00 0.00 H new ATOM 0 HA2 GLY B 163 17.305 6.344 -12.737 1.00 0.00 H new ATOM 0 HA3 GLY B 163 18.644 7.158 -11.953 1.00 0.00 H new ATOM 1625 N LYS B 164 16.198 8.420 -13.378 1.00 0.00 N ATOM 1626 CA LYS B 164 15.457 9.634 -13.727 1.00 0.00 C ATOM 1627 C LYS B 164 16.108 10.379 -14.893 1.00 0.00 C ATOM 1628 O LYS B 164 15.970 11.596 -15.014 1.00 0.00 O ATOM 1629 CB LYS B 164 15.348 10.570 -12.517 1.00 0.00 C ATOM 1630 CG LYS B 164 15.577 9.886 -11.176 1.00 0.00 C ATOM 1631 CD LYS B 164 15.601 10.891 -10.035 1.00 0.00 C ATOM 1632 CE LYS B 164 16.873 11.722 -10.049 1.00 0.00 C ATOM 1633 NZ LYS B 164 17.985 11.051 -9.318 1.00 0.00 N ATOM 0 H LYS B 164 15.607 7.603 -13.225 1.00 0.00 H new ATOM 0 HA LYS B 164 14.459 9.322 -14.034 1.00 0.00 H new ATOM 0 HB2 LYS B 164 16.073 11.376 -12.629 1.00 0.00 H new ATOM 0 HB3 LYS B 164 14.359 11.028 -12.514 1.00 0.00 H new ATOM 0 HG2 LYS B 164 14.789 9.154 -11.001 1.00 0.00 H new ATOM 0 HG3 LYS B 164 16.520 9.340 -11.201 1.00 0.00 H new ATOM 0 HD2 LYS B 164 14.735 11.549 -10.110 1.00 0.00 H new ATOM 0 HD3 LYS B 164 15.520 10.365 -9.084 1.00 0.00 H new ATOM 0 HE2 LYS B 164 17.175 11.905 -11.080 1.00 0.00 H new ATOM 0 HE3 LYS B 164 16.676 12.694 -9.597 1.00 0.00 H new ATOM 0 HZ1 LYS B 164 18.834 11.651 -9.351 1.00 0.00 H new ATOM 0 HZ2 LYS B 164 17.707 10.899 -8.327 1.00 0.00 H new ATOM 0 HZ3 LYS B 164 18.191 10.135 -9.765 1.00 0.00 H new ATOM 1647 N SER B 165 16.816 9.647 -15.747 1.00 0.00 N ATOM 1648 CA SER B 165 17.482 10.250 -16.898 1.00 0.00 C ATOM 1649 C SER B 165 18.058 9.177 -17.817 1.00 0.00 C ATOM 1650 O SER B 165 19.089 9.383 -18.457 1.00 0.00 O ATOM 1651 CB SER B 165 18.595 11.199 -16.439 1.00 0.00 C ATOM 1652 OG SER B 165 18.682 11.248 -15.026 1.00 0.00 O ATOM 0 H SER B 165 16.944 8.638 -15.665 1.00 0.00 H new ATOM 0 HA SER B 165 16.739 10.821 -17.455 1.00 0.00 H new ATOM 0 HB2 SER B 165 19.549 10.871 -16.853 1.00 0.00 H new ATOM 0 HB3 SER B 165 18.406 12.199 -16.828 1.00 0.00 H new ATOM 0 HG SER B 165 18.957 10.372 -14.685 1.00 0.00 H new ATOM 1658 N CYS B 166 17.384 8.035 -17.880 1.00 0.00 N ATOM 1659 CA CYS B 166 17.825 6.933 -18.716 1.00 0.00 C ATOM 1660 C CYS B 166 17.253 7.062 -20.124 1.00 0.00 C ATOM 1661 O CYS B 166 16.512 7.999 -20.418 1.00 0.00 O ATOM 1662 CB CYS B 166 17.400 5.605 -18.092 1.00 0.00 C ATOM 1663 SG CYS B 166 18.569 4.237 -18.374 1.00 0.00 S ATOM 0 H CYS B 166 16.527 7.851 -17.359 1.00 0.00 H new ATOM 0 HA CYS B 166 18.912 6.962 -18.785 1.00 0.00 H new ATOM 0 HB2 CYS B 166 17.275 5.745 -17.018 1.00 0.00 H new ATOM 0 HB3 CYS B 166 16.426 5.324 -18.493 1.00 0.00 H new ATOM 1668 N GLN B 167 17.600 6.118 -20.991 1.00 0.00 N ATOM 1669 CA GLN B 167 17.118 6.132 -22.367 1.00 0.00 C ATOM 1670 C GLN B 167 15.743 5.474 -22.484 1.00 0.00 C ATOM 1671 O GLN B 167 15.227 5.297 -23.589 1.00 0.00 O ATOM 1672 CB GLN B 167 18.113 5.418 -23.283 1.00 0.00 C ATOM 1673 CG GLN B 167 19.426 6.165 -23.453 1.00 0.00 C ATOM 1674 CD GLN B 167 19.552 6.823 -24.814 1.00 0.00 C ATOM 1675 OE1 GLN B 167 19.037 6.317 -25.811 1.00 0.00 O ATOM 1676 NE2 GLN B 167 20.239 7.958 -24.860 1.00 0.00 N ATOM 0 H GLN B 167 18.213 5.334 -20.766 1.00 0.00 H new ATOM 0 HA GLN B 167 17.024 7.173 -22.675 1.00 0.00 H new ATOM 0 HB2 GLN B 167 18.318 4.426 -22.880 1.00 0.00 H new ATOM 0 HB3 GLN B 167 17.656 5.276 -24.262 1.00 0.00 H new ATOM 0 HG2 GLN B 167 19.510 6.926 -22.677 1.00 0.00 H new ATOM 0 HG3 GLN B 167 20.255 5.472 -23.311 1.00 0.00 H new ATOM 0 HE21 GLN B 167 20.649 8.341 -24.008 1.00 0.00 H new ATOM 0 HE22 GLN B 167 20.357 8.447 -25.747 1.00 0.00 H new ATOM 1685 N VAL B 168 15.151 5.110 -21.347 1.00 0.00 N ATOM 1686 CA VAL B 168 13.854 4.480 -21.333 1.00 0.00 C ATOM 1687 C VAL B 168 12.934 5.192 -20.356 1.00 0.00 C ATOM 1688 O VAL B 168 13.326 5.534 -19.241 1.00 0.00 O ATOM 1689 CB VAL B 168 13.977 3.004 -20.939 1.00 0.00 C ATOM 1690 CG1 VAL B 168 12.604 2.353 -20.795 1.00 0.00 C ATOM 1691 CG2 VAL B 168 14.826 2.255 -21.955 1.00 0.00 C ATOM 0 H VAL B 168 15.562 5.247 -20.423 1.00 0.00 H new ATOM 0 HA VAL B 168 13.433 4.545 -22.336 1.00 0.00 H new ATOM 0 HB VAL B 168 14.470 2.952 -19.968 1.00 0.00 H new ATOM 0 HG11 VAL B 168 12.725 1.307 -20.515 1.00 0.00 H new ATOM 0 HG12 VAL B 168 12.035 2.872 -20.024 1.00 0.00 H new ATOM 0 HG13 VAL B 168 12.070 2.415 -21.743 1.00 0.00 H new ATOM 0 HG21 VAL B 168 14.905 1.208 -21.662 1.00 0.00 H new ATOM 0 HG22 VAL B 168 14.361 2.323 -22.938 1.00 0.00 H new ATOM 0 HG23 VAL B 168 15.822 2.697 -21.993 1.00 0.00 H new ATOM 1701 N ALA B 169 11.716 5.411 -20.796 1.00 0.00 N ATOM 1702 CA ALA B 169 10.710 6.086 -19.986 1.00 0.00 C ATOM 1703 C ALA B 169 10.214 5.182 -18.865 1.00 0.00 C ATOM 1704 O ALA B 169 10.202 5.572 -17.697 1.00 0.00 O ATOM 1705 CB ALA B 169 9.546 6.527 -20.860 1.00 0.00 C ATOM 0 H ALA B 169 11.389 5.130 -21.720 1.00 0.00 H new ATOM 0 HA ALA B 169 11.169 6.965 -19.534 1.00 0.00 H new ATOM 0 HB1 ALA B 169 8.800 7.030 -20.245 1.00 0.00 H new ATOM 0 HB2 ALA B 169 9.906 7.212 -21.627 1.00 0.00 H new ATOM 0 HB3 ALA B 169 9.097 5.655 -21.335 1.00 0.00 H new ATOM 1711 N HIS B 170 9.797 3.978 -19.232 1.00 0.00 N ATOM 1712 CA HIS B 170 9.290 3.017 -18.270 1.00 0.00 C ATOM 1713 C HIS B 170 10.369 2.583 -17.281 1.00 0.00 C ATOM 1714 O HIS B 170 10.062 2.007 -16.237 1.00 0.00 O ATOM 1715 CB HIS B 170 8.720 1.797 -18.993 1.00 0.00 C ATOM 1716 CG HIS B 170 7.545 2.122 -19.862 1.00 0.00 C ATOM 1717 ND1 HIS B 170 7.381 2.027 -21.202 1.00 0.00 N flip ATOM 1718 CD2 HIS B 170 6.356 2.614 -19.367 1.00 0.00 C flip ATOM 1719 CE1 HIS B 170 6.111 2.459 -21.489 1.00 0.00 C flip ATOM 1720 NE2 HIS B 170 5.512 2.807 -20.365 1.00 0.00 N flip ATOM 0 H HIS B 170 9.801 3.645 -20.196 1.00 0.00 H new ATOM 0 HA HIS B 170 8.497 3.505 -17.703 1.00 0.00 H new ATOM 0 HB2 HIS B 170 9.502 1.347 -19.604 1.00 0.00 H new ATOM 0 HB3 HIS B 170 8.423 1.052 -18.255 1.00 0.00 H new ATOM 0 HD1 HIS B 170 8.073 1.696 -21.874 1.00 0.00 H new ATOM 0 HD2 HIS B 170 6.147 2.811 -18.326 1.00 0.00 H new ATOM 0 HE1 HIS B 170 5.672 2.507 -22.475 1.00 0.00 H new ATOM 1729 N CYS B 171 11.633 2.858 -17.603 1.00 0.00 N ATOM 1730 CA CYS B 171 12.730 2.483 -16.720 1.00 0.00 C ATOM 1731 C CYS B 171 12.787 3.402 -15.515 1.00 0.00 C ATOM 1732 O CYS B 171 12.489 2.999 -14.391 1.00 0.00 O ATOM 1733 CB CYS B 171 14.057 2.544 -17.472 1.00 0.00 C ATOM 1734 SG CYS B 171 15.412 1.638 -16.657 1.00 0.00 S ATOM 0 H CYS B 171 11.918 3.334 -18.459 1.00 0.00 H new ATOM 0 HA CYS B 171 12.556 1.463 -16.377 1.00 0.00 H new ATOM 0 HB2 CYS B 171 13.914 2.139 -18.474 1.00 0.00 H new ATOM 0 HB3 CYS B 171 14.350 3.588 -17.588 1.00 0.00 H new ATOM 0 HG CYS B 171 16.435 2.426 -16.512 1.00 0.00 H new ATOM 1739 N ALA B 172 13.170 4.641 -15.769 1.00 0.00 N ATOM 1740 CA ALA B 172 13.268 5.641 -14.711 1.00 0.00 C ATOM 1741 C ALA B 172 11.928 5.817 -14.004 1.00 0.00 C ATOM 1742 O ALA B 172 11.875 5.985 -12.784 1.00 0.00 O ATOM 1743 CB ALA B 172 13.750 6.969 -15.277 1.00 0.00 C ATOM 0 H ALA B 172 13.419 4.982 -16.697 1.00 0.00 H new ATOM 0 HA ALA B 172 13.995 5.291 -13.978 1.00 0.00 H new ATOM 0 HB1 ALA B 172 13.817 7.704 -14.474 1.00 0.00 H new ATOM 0 HB2 ALA B 172 14.732 6.836 -15.731 1.00 0.00 H new ATOM 0 HB3 ALA B 172 13.046 7.320 -16.032 1.00 0.00 H new ATOM 1749 N SER B 173 10.849 5.771 -14.777 1.00 0.00 N ATOM 1750 CA SER B 173 9.507 5.920 -14.226 1.00 0.00 C ATOM 1751 C SER B 173 9.213 4.813 -13.220 1.00 0.00 C ATOM 1752 O SER B 173 8.901 5.080 -12.060 1.00 0.00 O ATOM 1753 CB SER B 173 8.465 5.898 -15.345 1.00 0.00 C ATOM 1754 OG SER B 173 7.195 6.304 -14.868 1.00 0.00 O ATOM 0 H SER B 173 10.877 5.632 -15.787 1.00 0.00 H new ATOM 0 HA SER B 173 9.455 6.881 -13.713 1.00 0.00 H new ATOM 0 HB2 SER B 173 8.781 6.558 -16.153 1.00 0.00 H new ATOM 0 HB3 SER B 173 8.396 4.893 -15.762 1.00 0.00 H new ATOM 0 HG SER B 173 6.493 5.859 -15.388 1.00 0.00 H new ATOM 1760 N SER B 174 9.320 3.565 -13.672 1.00 0.00 N ATOM 1761 CA SER B 174 9.068 2.413 -12.813 1.00 0.00 C ATOM 1762 C SER B 174 9.920 2.478 -11.550 1.00 0.00 C ATOM 1763 O SER B 174 9.494 2.043 -10.480 1.00 0.00 O ATOM 1764 CB SER B 174 9.353 1.115 -13.570 1.00 0.00 C ATOM 1765 OG SER B 174 9.504 0.024 -12.677 1.00 0.00 O ATOM 0 H SER B 174 9.580 3.327 -14.629 1.00 0.00 H new ATOM 0 HA SER B 174 8.018 2.432 -12.521 1.00 0.00 H new ATOM 0 HB2 SER B 174 8.539 0.910 -14.265 1.00 0.00 H new ATOM 0 HB3 SER B 174 10.259 1.229 -14.165 1.00 0.00 H new ATOM 0 HG SER B 174 9.684 -0.793 -13.187 1.00 0.00 H new ATOM 1771 N ARG B 175 11.122 3.028 -11.679 1.00 0.00 N ATOM 1772 CA ARG B 175 12.028 3.153 -10.544 1.00 0.00 C ATOM 1773 C ARG B 175 11.395 3.995 -9.441 1.00 0.00 C ATOM 1774 O ARG B 175 11.399 3.610 -8.273 1.00 0.00 O ATOM 1775 CB ARG B 175 13.352 3.779 -10.986 1.00 0.00 C ATOM 1776 CG ARG B 175 14.367 3.915 -9.863 1.00 0.00 C ATOM 1777 CD ARG B 175 15.746 4.277 -10.393 1.00 0.00 C ATOM 1778 NE ARG B 175 16.267 5.495 -9.778 1.00 0.00 N ATOM 1779 CZ ARG B 175 16.586 5.596 -8.489 1.00 0.00 C ATOM 1780 NH1 ARG B 175 16.441 4.555 -7.679 1.00 0.00 N ATOM 1781 NH2 ARG B 175 17.052 6.741 -8.010 1.00 0.00 N ATOM 0 H ARG B 175 11.491 3.394 -12.557 1.00 0.00 H new ATOM 0 HA ARG B 175 12.223 2.155 -10.151 1.00 0.00 H new ATOM 0 HB2 ARG B 175 13.783 3.172 -11.782 1.00 0.00 H new ATOM 0 HB3 ARG B 175 13.155 4.765 -11.408 1.00 0.00 H new ATOM 0 HG2 ARG B 175 14.034 4.680 -9.162 1.00 0.00 H new ATOM 0 HG3 ARG B 175 14.424 2.978 -9.309 1.00 0.00 H new ATOM 0 HD2 ARG B 175 16.434 3.453 -10.205 1.00 0.00 H new ATOM 0 HD3 ARG B 175 15.696 4.410 -11.474 1.00 0.00 H new ATOM 0 HE ARG B 175 16.394 6.316 -10.370 1.00 0.00 H new ATOM 0 HH11 ARG B 175 16.084 3.672 -8.043 1.00 0.00 H new ATOM 0 HH12 ARG B 175 16.687 4.638 -6.693 1.00 0.00 H new ATOM 0 HH21 ARG B 175 17.166 7.544 -8.629 1.00 0.00 H new ATOM 0 HH22 ARG B 175 17.296 6.819 -7.023 1.00 0.00 H new ATOM 1795 N GLN B 176 10.852 5.146 -9.825 1.00 0.00 N ATOM 1796 CA GLN B 176 10.215 6.047 -8.871 1.00 0.00 C ATOM 1797 C GLN B 176 8.934 5.438 -8.302 1.00 0.00 C ATOM 1798 O GLN B 176 8.529 5.758 -7.185 1.00 0.00 O ATOM 1799 CB GLN B 176 9.903 7.389 -9.541 1.00 0.00 C ATOM 1800 CG GLN B 176 10.460 8.586 -8.790 1.00 0.00 C ATOM 1801 CD GLN B 176 11.118 9.598 -9.708 1.00 0.00 C ATOM 1802 OE1 GLN B 176 11.086 9.457 -10.930 1.00 0.00 O ATOM 1803 NE2 GLN B 176 11.720 10.626 -9.121 1.00 0.00 N ATOM 0 H GLN B 176 10.840 5.477 -10.790 1.00 0.00 H new ATOM 0 HA GLN B 176 10.909 6.208 -8.046 1.00 0.00 H new ATOM 0 HB2 GLN B 176 10.309 7.384 -10.553 1.00 0.00 H new ATOM 0 HB3 GLN B 176 8.822 7.498 -9.632 1.00 0.00 H new ATOM 0 HG2 GLN B 176 9.654 9.071 -8.239 1.00 0.00 H new ATOM 0 HG3 GLN B 176 11.187 8.242 -8.054 1.00 0.00 H new ATOM 0 HE21 GLN B 176 11.722 10.703 -8.104 1.00 0.00 H new ATOM 0 HE22 GLN B 176 12.180 11.339 -9.687 1.00 0.00 H new ATOM 1812 N ILE B 177 8.298 4.563 -9.076 1.00 0.00 N ATOM 1813 CA ILE B 177 7.063 3.919 -8.643 1.00 0.00 C ATOM 1814 C ILE B 177 7.301 3.014 -7.437 1.00 0.00 C ATOM 1815 O ILE B 177 6.863 3.318 -6.327 1.00 0.00 O ATOM 1816 CB ILE B 177 6.427 3.091 -9.781 1.00 0.00 C ATOM 1817 CG1 ILE B 177 6.068 3.999 -10.959 1.00 0.00 C ATOM 1818 CG2 ILE B 177 5.191 2.350 -9.285 1.00 0.00 C ATOM 1819 CD1 ILE B 177 5.668 3.241 -12.206 1.00 0.00 C ATOM 0 H ILE B 177 8.617 4.285 -10.004 1.00 0.00 H new ATOM 0 HA ILE B 177 6.377 4.717 -8.360 1.00 0.00 H new ATOM 0 HB ILE B 177 7.155 2.352 -10.117 1.00 0.00 H new ATOM 0 HG12 ILE B 177 5.250 4.656 -10.665 1.00 0.00 H new ATOM 0 HG13 ILE B 177 6.922 4.637 -11.189 1.00 0.00 H new ATOM 0 HG21 ILE B 177 4.760 1.774 -10.103 1.00 0.00 H new ATOM 0 HG22 ILE B 177 5.471 1.677 -8.475 1.00 0.00 H new ATOM 0 HG23 ILE B 177 4.457 3.069 -8.921 1.00 0.00 H new ATOM 0 HD11 ILE B 177 5.427 3.948 -13.000 1.00 0.00 H new ATOM 0 HD12 ILE B 177 6.493 2.604 -12.525 1.00 0.00 H new ATOM 0 HD13 ILE B 177 4.795 2.624 -11.992 1.00 0.00 H new ATOM 1831 N ILE B 178 7.987 1.899 -7.661 1.00 0.00 N ATOM 1832 CA ILE B 178 8.269 0.950 -6.589 1.00 0.00 C ATOM 1833 C ILE B 178 9.105 1.586 -5.484 1.00 0.00 C ATOM 1834 O ILE B 178 8.791 1.450 -4.301 1.00 0.00 O ATOM 1835 CB ILE B 178 8.999 -0.303 -7.106 1.00 0.00 C ATOM 1836 CG1 ILE B 178 8.307 -0.857 -8.354 1.00 0.00 C ATOM 1837 CG2 ILE B 178 9.055 -1.361 -6.013 1.00 0.00 C ATOM 1838 CD1 ILE B 178 8.956 -2.111 -8.899 1.00 0.00 C ATOM 0 H ILE B 178 8.358 1.630 -8.572 1.00 0.00 H new ATOM 0 HA ILE B 178 7.301 0.654 -6.185 1.00 0.00 H new ATOM 0 HB ILE B 178 10.017 -0.025 -7.379 1.00 0.00 H new ATOM 0 HG12 ILE B 178 7.265 -1.071 -8.117 1.00 0.00 H new ATOM 0 HG13 ILE B 178 8.307 -0.091 -9.130 1.00 0.00 H new ATOM 0 HG21 ILE B 178 9.573 -2.244 -6.387 1.00 0.00 H new ATOM 0 HG22 ILE B 178 9.590 -0.965 -5.150 1.00 0.00 H new ATOM 0 HG23 ILE B 178 8.042 -1.633 -5.718 1.00 0.00 H new ATOM 0 HD11 ILE B 178 8.413 -2.447 -9.783 1.00 0.00 H new ATOM 0 HD12 ILE B 178 9.991 -1.898 -9.168 1.00 0.00 H new ATOM 0 HD13 ILE B 178 8.932 -2.893 -8.140 1.00 0.00 H new ATOM 1850 N SER B 179 10.174 2.278 -5.872 1.00 0.00 N ATOM 1851 CA SER B 179 11.055 2.930 -4.905 1.00 0.00 C ATOM 1852 C SER B 179 10.248 3.721 -3.879 1.00 0.00 C ATOM 1853 O SER B 179 10.463 3.595 -2.673 1.00 0.00 O ATOM 1854 CB SER B 179 12.043 3.852 -5.621 1.00 0.00 C ATOM 1855 OG SER B 179 11.383 4.968 -6.190 1.00 0.00 O ATOM 0 H SER B 179 10.451 2.402 -6.846 1.00 0.00 H new ATOM 0 HA SER B 179 11.613 2.155 -4.379 1.00 0.00 H new ATOM 0 HB2 SER B 179 12.801 4.195 -4.916 1.00 0.00 H new ATOM 0 HB3 SER B 179 12.562 3.296 -6.402 1.00 0.00 H new ATOM 0 HG SER B 179 10.892 4.685 -6.990 1.00 0.00 H new ATOM 1861 N HIS B 180 9.309 4.524 -4.368 1.00 0.00 N ATOM 1862 CA HIS B 180 8.455 5.325 -3.501 1.00 0.00 C ATOM 1863 C HIS B 180 7.679 4.420 -2.544 1.00 0.00 C ATOM 1864 O HIS B 180 7.670 4.635 -1.333 1.00 0.00 O ATOM 1865 CB HIS B 180 7.491 6.157 -4.361 1.00 0.00 C ATOM 1866 CG HIS B 180 6.148 6.406 -3.738 1.00 0.00 C ATOM 1867 ND1 HIS B 180 5.726 7.638 -3.291 1.00 0.00 N ATOM 1868 CD2 HIS B 180 5.116 5.551 -3.505 1.00 0.00 C ATOM 1869 CE1 HIS B 180 4.483 7.499 -2.812 1.00 0.00 C ATOM 1870 NE2 HIS B 180 4.066 6.252 -2.918 1.00 0.00 N ATOM 0 H HIS B 180 9.120 4.637 -5.364 1.00 0.00 H new ATOM 0 HA HIS B 180 9.072 5.999 -2.907 1.00 0.00 H new ATOM 0 HB2 HIS B 180 7.958 7.117 -4.580 1.00 0.00 H new ATOM 0 HB3 HIS B 180 7.345 5.649 -5.314 1.00 0.00 H new ATOM 0 HD1 HIS B 180 6.265 8.504 -3.320 1.00 0.00 H new ATOM 0 HD2 HIS B 180 5.112 4.496 -3.738 1.00 0.00 H new ATOM 0 HE1 HIS B 180 3.898 8.304 -2.393 1.00 0.00 H new ATOM 1878 N TRP B 181 7.026 3.410 -3.111 1.00 0.00 N ATOM 1879 CA TRP B 181 6.231 2.456 -2.340 1.00 0.00 C ATOM 1880 C TRP B 181 6.957 1.996 -1.079 1.00 0.00 C ATOM 1881 O TRP B 181 6.521 2.270 0.039 1.00 0.00 O ATOM 1882 CB TRP B 181 5.914 1.241 -3.207 1.00 0.00 C ATOM 1883 CG TRP B 181 5.046 0.229 -2.524 1.00 0.00 C ATOM 1884 CD1 TRP B 181 5.448 -0.758 -1.670 1.00 0.00 C ATOM 1885 CD2 TRP B 181 3.627 0.108 -2.640 1.00 0.00 C ATOM 1886 NE1 TRP B 181 4.361 -1.487 -1.251 1.00 0.00 N ATOM 1887 CE2 TRP B 181 3.231 -0.974 -1.832 1.00 0.00 C ATOM 1888 CE3 TRP B 181 2.654 0.811 -3.351 1.00 0.00 C ATOM 1889 CZ2 TRP B 181 1.900 -1.369 -1.718 1.00 0.00 C ATOM 1890 CZ3 TRP B 181 1.333 0.419 -3.237 1.00 0.00 C ATOM 1891 CH2 TRP B 181 0.967 -0.662 -2.427 1.00 0.00 C ATOM 0 H TRP B 181 7.032 3.229 -4.115 1.00 0.00 H new ATOM 0 HA TRP B 181 5.313 2.959 -2.036 1.00 0.00 H new ATOM 0 HB2 TRP B 181 5.420 1.575 -4.120 1.00 0.00 H new ATOM 0 HB3 TRP B 181 6.848 0.764 -3.506 1.00 0.00 H new ATOM 0 HD1 TRP B 181 6.469 -0.939 -1.369 1.00 0.00 H new ATOM 0 HE1 TRP B 181 4.391 -2.281 -0.611 1.00 0.00 H new ATOM 0 HE3 TRP B 181 2.928 1.646 -3.979 1.00 0.00 H new ATOM 0 HZ2 TRP B 181 1.615 -2.202 -1.093 1.00 0.00 H new ATOM 0 HZ3 TRP B 181 0.571 0.956 -3.782 1.00 0.00 H new ATOM 0 HH2 TRP B 181 -0.073 -0.944 -2.360 1.00 0.00 H new ATOM 1902 N LYS B 182 8.055 1.277 -1.276 1.00 0.00 N ATOM 1903 CA LYS B 182 8.840 0.749 -0.165 1.00 0.00 C ATOM 1904 C LYS B 182 9.367 1.863 0.734 1.00 0.00 C ATOM 1905 O LYS B 182 9.593 1.651 1.926 1.00 0.00 O ATOM 1906 CB LYS B 182 10.009 -0.084 -0.694 1.00 0.00 C ATOM 1907 CG LYS B 182 10.520 -1.114 0.301 1.00 0.00 C ATOM 1908 CD LYS B 182 9.436 -2.111 0.678 1.00 0.00 C ATOM 1909 CE LYS B 182 9.992 -3.521 0.803 1.00 0.00 C ATOM 1910 NZ LYS B 182 9.253 -4.488 -0.055 1.00 0.00 N ATOM 0 H LYS B 182 8.424 1.045 -2.198 1.00 0.00 H new ATOM 0 HA LYS B 182 8.181 0.118 0.432 1.00 0.00 H new ATOM 0 HB2 LYS B 182 9.698 -0.594 -1.605 1.00 0.00 H new ATOM 0 HB3 LYS B 182 10.827 0.584 -0.966 1.00 0.00 H new ATOM 0 HG2 LYS B 182 11.370 -1.644 -0.127 1.00 0.00 H new ATOM 0 HG3 LYS B 182 10.878 -0.608 1.198 1.00 0.00 H new ATOM 0 HD2 LYS B 182 8.980 -1.814 1.622 1.00 0.00 H new ATOM 0 HD3 LYS B 182 8.648 -2.095 -0.075 1.00 0.00 H new ATOM 0 HE2 LYS B 182 11.046 -3.521 0.525 1.00 0.00 H new ATOM 0 HE3 LYS B 182 9.936 -3.842 1.843 1.00 0.00 H new ATOM 0 HZ1 LYS B 182 9.663 -5.437 0.059 1.00 0.00 H new ATOM 0 HZ2 LYS B 182 8.252 -4.507 0.226 1.00 0.00 H new ATOM 0 HZ3 LYS B 182 9.327 -4.196 -1.050 1.00 0.00 H new ATOM 1924 N ASN B 183 9.562 3.048 0.166 1.00 0.00 N ATOM 1925 CA ASN B 183 10.065 4.180 0.937 1.00 0.00 C ATOM 1926 C ASN B 183 8.931 5.107 1.375 1.00 0.00 C ATOM 1927 O ASN B 183 9.177 6.212 1.858 1.00 0.00 O ATOM 1928 CB ASN B 183 11.095 4.963 0.123 1.00 0.00 C ATOM 1929 CG ASN B 183 12.056 5.735 1.005 1.00 0.00 C ATOM 1930 OD1 ASN B 183 13.254 5.995 0.491 1.00 0.00 O flip ATOM 1931 ND2 ASN B 183 11.728 6.096 2.136 1.00 0.00 N flip ATOM 0 H ASN B 183 9.381 3.249 -0.817 1.00 0.00 H new ATOM 0 HA ASN B 183 10.542 3.783 1.833 1.00 0.00 H new ATOM 0 HB2 ASN B 183 11.657 4.274 -0.507 1.00 0.00 H new ATOM 0 HB3 ASN B 183 10.579 5.655 -0.542 1.00 0.00 H new ATOM 0 HD21 ASN B 183 10.798 5.875 2.492 1.00 0.00 H new ATOM 0 HD22 ASN B 183 12.386 6.616 2.717 1.00 0.00 H new ATOM 1938 N CYS B 184 7.691 4.655 1.206 1.00 0.00 N ATOM 1939 CA CYS B 184 6.531 5.451 1.588 1.00 0.00 C ATOM 1940 C CYS B 184 6.018 5.038 2.965 1.00 0.00 C ATOM 1941 O CYS B 184 5.338 4.021 3.105 1.00 0.00 O ATOM 1942 CB CYS B 184 5.420 5.297 0.549 1.00 0.00 C ATOM 1943 SG CYS B 184 4.022 6.442 0.777 1.00 0.00 S ATOM 0 H CYS B 184 7.465 3.743 0.808 1.00 0.00 H new ATOM 0 HA CYS B 184 6.835 6.497 1.633 1.00 0.00 H new ATOM 0 HB2 CYS B 184 5.843 5.450 -0.444 1.00 0.00 H new ATOM 0 HB3 CYS B 184 5.046 4.274 0.582 1.00 0.00 H new ATOM 1948 N THR B 185 6.349 5.833 3.978 1.00 0.00 N ATOM 1949 CA THR B 185 5.923 5.552 5.344 1.00 0.00 C ATOM 1950 C THR B 185 4.406 5.412 5.428 1.00 0.00 C ATOM 1951 O THR B 185 3.674 6.048 4.671 1.00 0.00 O ATOM 1952 CB THR B 185 6.394 6.662 6.286 1.00 0.00 C ATOM 1953 OG1 THR B 185 7.729 7.037 5.992 1.00 0.00 O ATOM 1954 CG2 THR B 185 6.338 6.273 7.748 1.00 0.00 C ATOM 0 H THR B 185 6.912 6.678 3.878 1.00 0.00 H new ATOM 0 HA THR B 185 6.374 4.607 5.648 1.00 0.00 H new ATOM 0 HB THR B 185 5.705 7.490 6.121 1.00 0.00 H new ATOM 0 HG1 THR B 185 8.011 7.749 6.604 1.00 0.00 H new ATOM 0 HG21 THR B 185 6.686 7.106 8.360 1.00 0.00 H new ATOM 0 HG22 THR B 185 5.312 6.027 8.020 1.00 0.00 H new ATOM 0 HG23 THR B 185 6.977 5.406 7.919 1.00 0.00 H new ATOM 1962 N ARG B 186 3.945 4.567 6.350 1.00 0.00 N ATOM 1963 CA ARG B 186 2.522 4.324 6.544 1.00 0.00 C ATOM 1964 C ARG B 186 1.711 5.615 6.432 1.00 0.00 C ATOM 1965 O ARG B 186 0.572 5.605 5.963 1.00 0.00 O ATOM 1966 CB ARG B 186 2.278 3.670 7.906 1.00 0.00 C ATOM 1967 CG ARG B 186 1.629 2.299 7.814 1.00 0.00 C ATOM 1968 CD ARG B 186 1.489 1.653 9.183 1.00 0.00 C ATOM 1969 NE ARG B 186 2.784 1.456 9.833 1.00 0.00 N ATOM 1970 CZ ARG B 186 3.384 2.372 10.591 1.00 0.00 C ATOM 1971 NH1 ARG B 186 2.817 3.554 10.796 1.00 0.00 N ATOM 1972 NH2 ARG B 186 4.559 2.104 11.146 1.00 0.00 N ATOM 0 H ARG B 186 4.547 4.036 6.979 1.00 0.00 H new ATOM 0 HA ARG B 186 2.191 3.649 5.755 1.00 0.00 H new ATOM 0 HB2 ARG B 186 3.229 3.578 8.431 1.00 0.00 H new ATOM 0 HB3 ARG B 186 1.644 4.324 8.505 1.00 0.00 H new ATOM 0 HG2 ARG B 186 0.646 2.391 7.352 1.00 0.00 H new ATOM 0 HG3 ARG B 186 2.226 1.656 7.167 1.00 0.00 H new ATOM 0 HD2 ARG B 186 0.858 2.277 9.815 1.00 0.00 H new ATOM 0 HD3 ARG B 186 0.985 0.692 9.080 1.00 0.00 H new ATOM 0 HE ARG B 186 3.257 0.562 9.698 1.00 0.00 H new ATOM 0 HH11 ARG B 186 1.914 3.767 10.372 1.00 0.00 H new ATOM 0 HH12 ARG B 186 3.284 4.249 11.378 1.00 0.00 H new ATOM 0 HH21 ARG B 186 5.001 1.198 10.992 1.00 0.00 H new ATOM 0 HH22 ARG B 186 5.020 2.804 11.727 1.00 0.00 H new ATOM 1986 N HIS B 187 2.306 6.722 6.865 1.00 0.00 N ATOM 1987 CA HIS B 187 1.641 8.017 6.813 1.00 0.00 C ATOM 1988 C HIS B 187 1.942 8.729 5.497 1.00 0.00 C ATOM 1989 O HIS B 187 3.038 8.605 4.950 1.00 0.00 O ATOM 1990 CB HIS B 187 2.082 8.888 7.992 1.00 0.00 C ATOM 1991 CG HIS B 187 1.465 10.253 7.993 1.00 0.00 C ATOM 1992 ND1 HIS B 187 2.122 11.376 7.533 1.00 0.00 N ATOM 1993 CD2 HIS B 187 0.243 10.675 8.398 1.00 0.00 C ATOM 1994 CE1 HIS B 187 1.331 12.428 7.655 1.00 0.00 C ATOM 1995 NE2 HIS B 187 0.186 12.029 8.177 1.00 0.00 N ATOM 0 H HIS B 187 3.248 6.747 7.256 1.00 0.00 H new ATOM 0 HA HIS B 187 0.566 7.850 6.877 1.00 0.00 H new ATOM 0 HB2 HIS B 187 1.826 8.382 8.923 1.00 0.00 H new ATOM 0 HB3 HIS B 187 3.167 8.989 7.972 1.00 0.00 H new ATOM 0 HD2 HIS B 187 -0.540 10.061 8.817 1.00 0.00 H new ATOM 0 HE1 HIS B 187 1.579 13.441 7.375 1.00 0.00 H new ATOM 0 HE2 HIS B 187 -0.612 12.630 8.383 1.00 0.00 H new ATOM 2004 N ASP B 188 0.963 9.474 4.995 1.00 0.00 N ATOM 2005 CA ASP B 188 1.124 10.205 3.744 1.00 0.00 C ATOM 2006 C ASP B 188 1.382 9.248 2.584 1.00 0.00 C ATOM 2007 O ASP B 188 2.432 9.301 1.943 1.00 0.00 O ATOM 2008 CB ASP B 188 2.272 11.211 3.861 1.00 0.00 C ATOM 2009 CG ASP B 188 2.136 12.359 2.879 1.00 0.00 C ATOM 2010 OD1 ASP B 188 1.022 12.910 2.760 1.00 0.00 O ATOM 2011 OD2 ASP B 188 3.145 12.707 2.231 1.00 0.00 O ATOM 0 H ASP B 188 0.050 9.587 5.435 1.00 0.00 H new ATOM 0 HA ASP B 188 0.198 10.745 3.544 1.00 0.00 H new ATOM 0 HB2 ASP B 188 2.303 11.606 4.876 1.00 0.00 H new ATOM 0 HB3 ASP B 188 3.219 10.699 3.689 1.00 0.00 H new ATOM 2016 N CYS B 189 0.417 8.373 2.320 1.00 0.00 N ATOM 2017 CA CYS B 189 0.540 7.404 1.238 1.00 0.00 C ATOM 2018 C CYS B 189 -0.765 7.302 0.448 1.00 0.00 C ATOM 2019 O CYS B 189 -1.429 6.265 0.456 1.00 0.00 O ATOM 2020 CB CYS B 189 0.931 6.033 1.797 1.00 0.00 C ATOM 2021 SG CYS B 189 2.274 5.214 0.878 1.00 0.00 S ATOM 0 H CYS B 189 -0.458 8.315 2.841 1.00 0.00 H new ATOM 0 HA CYS B 189 1.323 7.745 0.561 1.00 0.00 H new ATOM 0 HB2 CYS B 189 1.235 6.149 2.837 1.00 0.00 H new ATOM 0 HB3 CYS B 189 0.054 5.386 1.792 1.00 0.00 H new ATOM 2026 N PRO B 190 -1.150 8.387 -0.245 1.00 0.00 N ATOM 2027 CA PRO B 190 -2.383 8.421 -1.042 1.00 0.00 C ATOM 2028 C PRO B 190 -2.418 7.337 -2.117 1.00 0.00 C ATOM 2029 O PRO B 190 -3.482 7.007 -2.640 1.00 0.00 O ATOM 2030 CB PRO B 190 -2.359 9.810 -1.689 1.00 0.00 C ATOM 2031 CG PRO B 190 -1.451 10.621 -0.832 1.00 0.00 C ATOM 2032 CD PRO B 190 -0.419 9.665 -0.307 1.00 0.00 C ATOM 0 HA PRO B 190 -3.263 8.238 -0.425 1.00 0.00 H new ATOM 0 HB2 PRO B 190 -1.994 9.761 -2.715 1.00 0.00 H new ATOM 0 HB3 PRO B 190 -3.358 10.245 -1.727 1.00 0.00 H new ATOM 0 HG2 PRO B 190 -0.985 11.423 -1.405 1.00 0.00 H new ATOM 0 HG3 PRO B 190 -2.000 11.090 -0.016 1.00 0.00 H new ATOM 0 HD2 PRO B 190 0.446 9.603 -0.967 1.00 0.00 H new ATOM 0 HD3 PRO B 190 -0.051 9.967 0.674 1.00 0.00 H new ATOM 2040 N VAL B 191 -1.252 6.791 -2.447 1.00 0.00 N ATOM 2041 CA VAL B 191 -1.159 5.751 -3.465 1.00 0.00 C ATOM 2042 C VAL B 191 -1.276 4.358 -2.851 1.00 0.00 C ATOM 2043 O VAL B 191 -2.132 3.566 -3.245 1.00 0.00 O ATOM 2044 CB VAL B 191 0.167 5.847 -4.242 1.00 0.00 C ATOM 2045 CG1 VAL B 191 0.171 4.879 -5.416 1.00 0.00 C ATOM 2046 CG2 VAL B 191 0.403 7.273 -4.718 1.00 0.00 C ATOM 0 H VAL B 191 -0.360 7.051 -2.025 1.00 0.00 H new ATOM 0 HA VAL B 191 -1.990 5.909 -4.152 1.00 0.00 H new ATOM 0 HB VAL B 191 0.981 5.571 -3.571 1.00 0.00 H new ATOM 0 HG11 VAL B 191 1.116 4.962 -5.953 1.00 0.00 H new ATOM 0 HG12 VAL B 191 0.051 3.860 -5.048 1.00 0.00 H new ATOM 0 HG13 VAL B 191 -0.651 5.121 -6.090 1.00 0.00 H new ATOM 0 HG21 VAL B 191 1.344 7.323 -5.265 1.00 0.00 H new ATOM 0 HG22 VAL B 191 -0.414 7.578 -5.372 1.00 0.00 H new ATOM 0 HG23 VAL B 191 0.448 7.941 -3.858 1.00 0.00 H new ATOM 2056 N CYS B 192 -0.409 4.064 -1.888 1.00 0.00 N ATOM 2057 CA CYS B 192 -0.415 2.763 -1.225 1.00 0.00 C ATOM 2058 C CYS B 192 -1.711 2.545 -0.451 1.00 0.00 C ATOM 2059 O CYS B 192 -2.167 1.412 -0.292 1.00 0.00 O ATOM 2060 CB CYS B 192 0.782 2.635 -0.281 1.00 0.00 C ATOM 2061 SG CYS B 192 2.350 3.264 -0.968 1.00 0.00 S ATOM 0 H CYS B 192 0.306 4.707 -1.549 1.00 0.00 H new ATOM 0 HA CYS B 192 -0.342 1.998 -1.998 1.00 0.00 H new ATOM 0 HB2 CYS B 192 0.562 3.172 0.641 1.00 0.00 H new ATOM 0 HB3 CYS B 192 0.910 1.586 -0.016 1.00 0.00 H new ATOM 0 HG CYS B 192 2.710 4.332 -0.321 1.00 0.00 H new ATOM 2066 N LEU B 193 -2.302 3.635 0.032 1.00 0.00 N ATOM 2067 CA LEU B 193 -3.547 3.557 0.792 1.00 0.00 C ATOM 2068 C LEU B 193 -4.630 2.829 -0.006 1.00 0.00 C ATOM 2069 O LEU B 193 -5.105 1.770 0.402 1.00 0.00 O ATOM 2070 CB LEU B 193 -4.027 4.961 1.172 1.00 0.00 C ATOM 2071 CG LEU B 193 -3.690 5.396 2.599 1.00 0.00 C ATOM 2072 CD1 LEU B 193 -3.708 6.912 2.711 1.00 0.00 C ATOM 2073 CD2 LEU B 193 -4.663 4.774 3.590 1.00 0.00 C ATOM 0 H LEU B 193 -1.940 4.581 -0.089 1.00 0.00 H new ATOM 0 HA LEU B 193 -3.353 2.990 1.703 1.00 0.00 H new ATOM 0 HB2 LEU B 193 -3.590 5.678 0.477 1.00 0.00 H new ATOM 0 HB3 LEU B 193 -5.108 5.007 1.040 1.00 0.00 H new ATOM 0 HG LEU B 193 -2.686 5.046 2.839 1.00 0.00 H new ATOM 0 HD11 LEU B 193 -3.466 7.204 3.733 1.00 0.00 H new ATOM 0 HD12 LEU B 193 -2.972 7.336 2.028 1.00 0.00 H new ATOM 0 HD13 LEU B 193 -4.699 7.284 2.452 1.00 0.00 H new ATOM 0 HD21 LEU B 193 -4.408 5.094 4.600 1.00 0.00 H new ATOM 0 HD22 LEU B 193 -5.678 5.094 3.353 1.00 0.00 H new ATOM 0 HD23 LEU B 193 -4.601 3.688 3.528 1.00 0.00 H new ATOM 2085 N PRO B 194 -5.035 3.388 -1.160 1.00 0.00 N ATOM 2086 CA PRO B 194 -6.065 2.782 -2.009 1.00 0.00 C ATOM 2087 C PRO B 194 -5.605 1.468 -2.630 1.00 0.00 C ATOM 2088 O PRO B 194 -6.422 0.616 -2.981 1.00 0.00 O ATOM 2089 CB PRO B 194 -6.298 3.834 -3.098 1.00 0.00 C ATOM 2090 CG PRO B 194 -5.037 4.625 -3.137 1.00 0.00 C ATOM 2091 CD PRO B 194 -4.524 4.650 -1.725 1.00 0.00 C ATOM 0 HA PRO B 194 -6.962 2.532 -1.442 1.00 0.00 H new ATOM 0 HB2 PRO B 194 -6.503 3.367 -4.062 1.00 0.00 H new ATOM 0 HB3 PRO B 194 -7.154 4.466 -2.861 1.00 0.00 H new ATOM 0 HG2 PRO B 194 -4.310 4.169 -3.809 1.00 0.00 H new ATOM 0 HG3 PRO B 194 -5.220 5.635 -3.504 1.00 0.00 H new ATOM 0 HD2 PRO B 194 -3.435 4.694 -1.693 1.00 0.00 H new ATOM 0 HD3 PRO B 194 -4.895 5.516 -1.177 1.00 0.00 H new ATOM 2099 N LEU B 195 -4.291 1.308 -2.769 1.00 0.00 N ATOM 2100 CA LEU B 195 -3.727 0.102 -3.352 1.00 0.00 C ATOM 2101 C LEU B 195 -3.718 -1.044 -2.344 1.00 0.00 C ATOM 2102 O LEU B 195 -3.969 -2.195 -2.696 1.00 0.00 O ATOM 2103 CB LEU B 195 -2.307 0.381 -3.842 1.00 0.00 C ATOM 2104 CG LEU B 195 -2.128 0.354 -5.359 1.00 0.00 C ATOM 2105 CD1 LEU B 195 -0.922 1.185 -5.770 1.00 0.00 C ATOM 2106 CD2 LEU B 195 -1.987 -1.077 -5.854 1.00 0.00 C ATOM 0 H LEU B 195 -3.600 2.002 -2.484 1.00 0.00 H new ATOM 0 HA LEU B 195 -4.350 -0.196 -4.195 1.00 0.00 H new ATOM 0 HB2 LEU B 195 -1.997 1.359 -3.473 1.00 0.00 H new ATOM 0 HB3 LEU B 195 -1.635 -0.355 -3.399 1.00 0.00 H new ATOM 0 HG LEU B 195 -3.016 0.790 -5.818 1.00 0.00 H new ATOM 0 HD11 LEU B 195 -0.811 1.154 -6.854 1.00 0.00 H new ATOM 0 HD12 LEU B 195 -1.065 2.217 -5.450 1.00 0.00 H new ATOM 0 HD13 LEU B 195 -0.025 0.781 -5.301 1.00 0.00 H new ATOM 0 HD21 LEU B 195 -1.860 -1.077 -6.937 1.00 0.00 H new ATOM 0 HD22 LEU B 195 -1.117 -1.539 -5.387 1.00 0.00 H new ATOM 0 HD23 LEU B 195 -2.882 -1.642 -5.594 1.00 0.00 H new ATOM 2118 N LYS B 196 -3.424 -0.720 -1.089 1.00 0.00 N ATOM 2119 CA LYS B 196 -3.381 -1.723 -0.033 1.00 0.00 C ATOM 2120 C LYS B 196 -3.750 -1.109 1.316 1.00 0.00 C ATOM 2121 O LYS B 196 -2.968 -1.153 2.266 1.00 0.00 O ATOM 2122 CB LYS B 196 -1.987 -2.354 0.038 1.00 0.00 C ATOM 2123 CG LYS B 196 -1.842 -3.380 1.150 1.00 0.00 C ATOM 2124 CD LYS B 196 -0.854 -4.474 0.776 1.00 0.00 C ATOM 2125 CE LYS B 196 -0.729 -5.510 1.881 1.00 0.00 C ATOM 2126 NZ LYS B 196 -1.909 -6.419 1.924 1.00 0.00 N ATOM 0 H LYS B 196 -3.212 0.229 -0.779 1.00 0.00 H new ATOM 0 HA LYS B 196 -4.111 -2.498 -0.267 1.00 0.00 H new ATOM 0 HB2 LYS B 196 -1.763 -2.830 -0.917 1.00 0.00 H new ATOM 0 HB3 LYS B 196 -1.247 -1.567 0.182 1.00 0.00 H new ATOM 0 HG2 LYS B 196 -1.509 -2.885 2.062 1.00 0.00 H new ATOM 0 HG3 LYS B 196 -2.814 -3.824 1.365 1.00 0.00 H new ATOM 0 HD2 LYS B 196 -1.178 -4.959 -0.145 1.00 0.00 H new ATOM 0 HD3 LYS B 196 0.122 -4.032 0.577 1.00 0.00 H new ATOM 0 HE2 LYS B 196 0.177 -6.097 1.728 1.00 0.00 H new ATOM 0 HE3 LYS B 196 -0.623 -5.006 2.842 1.00 0.00 H new ATOM 0 HZ1 LYS B 196 -1.786 -7.111 2.690 1.00 0.00 H new ATOM 0 HZ2 LYS B 196 -2.770 -5.862 2.095 1.00 0.00 H new ATOM 0 HZ3 LYS B 196 -1.995 -6.919 1.016 1.00 0.00 H new