USER MOD reduce.3.24.130724 H: found=0, std=0, add=1589, rem=0, adj=61 USER MOD reduce.3.24.130724 removed 1590 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 85 GLN : amide:sc= 0.76 X(o=0.71,f=0.42) USER MOD Set 1.2: B 88 CYS SG : rot -170:sc= -0.0529 USER MOD Set 2.1: B 71 THR OG1 : rot 166:sc= 1.15 USER MOD Set 2.2: B 75 HIS : no HE2:sc= 0.591 K(o=1.7,f=-5.7!) USER MOD Set 3.1: B 34 TYR OH : rot -153:sc= 1.17 USER MOD Set 3.2: B 61 SER OG : rot -136:sc= 0.319 USER MOD Set 3.3: B 64 HIS : no HD1:sc= 0.159 K(o=1.7,f=-11!) USER MOD Set 4.1: B 60 ASN : amide:sc= -0.909 K(o=-1.8,f=-3.1!) USER MOD Set 4.2: B 65 ASN : amide:sc= -0.911 K(o=-1.8,f=-6.1!) USER MOD Set 5.1: B 57 SER OG : rot -141:sc= 0.922 USER MOD Set 5.2: B 59 HIS : no HE2:sc= 0.446 K(o=1.4,f=-5.9!) USER MOD Set 6.1: A 258 THR OG1 : rot 121:sc= 0.769 USER MOD Set 6.2: A 263 HIS : no HD1:sc= 0.115 K(o=0.88,f=-7!) USER MOD Set 7.1: A 256 TYR OH : rot 180:sc= 0 USER MOD Set 7.2: A 267 THR OG1 : rot -138:sc= 0.398 USER MOD Set 7.3: B 73 HIS : no HD1:sc= 0.512 K(o=0.91,f=-1.3) USER MOD Set 8.1: A 250 SER OG : rot -180:sc= 1.22 USER MOD Set 8.2: B 130 ASN : amide:sc= 1.8 K(o=3,f=-1.3) USER MOD Set 9.1: A 206 THR OG1 : rot -159:sc= 0.89 USER MOD Set 9.2: A 209 GLN : amide:sc= -0.264 K(o=0.63,f=-5.8!) USER MOD Set10.1: A 203 ASN : amide:sc= 1.37 K(o=2.8,f=1.6) USER MOD Set10.2: A 210 ASN : amide:sc= 1.39 K(o=2.8,f=1.6) USER MOD Single : A 211 GLN : amide:sc= 0.0484 X(o=0.048,f=-0.12) USER MOD Single : A 214 ASN : amide:sc= 0 X(o=0,f=-0.064) USER MOD Single : A 217 LYS NZ :NH3+ 176:sc= 1.22 (180deg=1.14) USER MOD Single : A 219 CYS SG : rot -146:sc= -0.908 USER MOD Single : A 226 ASN : amide:sc= 1.07 K(o=1.1,f=-2.1) USER MOD Single : A 228 GLN : amide:sc= 1.28 K(o=1.3,f=-0.21) USER MOD Single : A 231 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 232 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 233 GLN : amide:sc=-0.00169 X(o=-0.0017,f=-0.0094) USER MOD Single : A 235 LYS NZ :NH3+ -150:sc= 1.28 (180deg=1.21) USER MOD Single : A 236 HIS : no HD1:sc= 6.9e-05 X(o=6.9e-05,f=-0.38) USER MOD Single : A 237 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 238 SER OG : rot 180:sc= 0.00107 USER MOD Single : A 240 SER OG : rot -86:sc= 0.147 USER MOD Single : A 241 SER OG : rot 180:sc= 0.0196 USER MOD Single : A 243 LYS NZ :NH3+ -129:sc= 1.07 (180deg=-1.68) USER MOD Single : A 244 GLN :FLIP amide:sc= -0.32 F(o=-1.7!,f=-0.32) USER MOD Single : A 251 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 254 HIS : +bothHN:sc= 1.62 K(o=1.6,f=-7.7!) USER MOD Single : A 257 SER OG : rot 99:sc= -0.0724 USER MOD Single : A 265 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 266 SER OG : rot 180:sc= -1.29 USER MOD Single : B 1 GLY N :NH3+ -132:sc= 1.3 (180deg=0.929) USER MOD Single : B 2 SER OG : rot 180:sc= 0.114 USER MOD Single : B 3 LYS NZ :NH3+ 168:sc=-0.00126 (180deg=-0.104) USER MOD Single : B 8 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0385) USER MOD Single : B 12 SER OG : rot 180:sc= 0.097 USER MOD Single : B 16 SER OG : rot 180:sc= 0.167 USER MOD Single : B 19 SER OG : rot 106:sc= 0.764 USER MOD Single : B 20 HIS : no HD1:sc= -0.745 X(o=-0.74,f=-0.38) USER MOD Single : B 24 SER OG : rot 180:sc= 0.0141 USER MOD Single : B 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 THR OG1 : rot 83:sc= 1.45 USER MOD Single : B 30 CYS SG : rot -160:sc= -4.06! USER MOD Single : B 35 THR OG1 : rot 180:sc= -0.0156 USER MOD Single : B 36 THR OG1 : rot 180:sc= -2.05! USER MOD Single : B 37 LYS NZ :NH3+ 148:sc= 1.23 (180deg=-0.308!) USER MOD Single : B 39 LYS NZ :NH3+ 173:sc= 0.334 (180deg=0.191) USER MOD Single : B 44 TYR OH : rot 92:sc= 1.28 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 LYS NZ :NH3+ -130:sc= -0.159 (180deg=-0.667) USER MOD Single : B 48 MET CE :methyl -132:sc= -0.406 (180deg=-1.22) USER MOD Single : B 50 LYS NZ :NH3+ -145:sc= 0.0259 (180deg=-0.855) USER MOD Single : B 51 TYR OH : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD Single : B 54 THR OG1 : rot 180:sc= 0.0155 USER MOD Single : B 62 TYR OH : rot 173:sc= 0.0989 USER MOD Single : B 63 ASN : amide:sc= 0.468 K(o=0.47,f=-1.4!) USER MOD Single : B 78 SER OG : rot 180:sc= 0.141 USER MOD Single : B 81 ASN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : B 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 83 TYR OH : rot 150:sc= -1.9! USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 89 THR OG1 : rot 180:sc= 0.0561 USER MOD Single : B 91 SER OG : rot -17:sc= 0.737 USER MOD Single : B 95 CYS SG : rot 160:sc= -0.0629 USER MOD Single : B 96 LYS NZ :NH3+ -107:sc= 1.24 (180deg=-0.742) USER MOD Single : B 99 ASN : amide:sc= -1.95! C(o=-1.9!,f=-2.6!) USER MOD Single : B 100 LYS NZ :NH3+ -140:sc= -0.146 (180deg=-0.813) USER MOD Single : B 102 TYR OH : rot 180:sc= 0 USER MOD Single : B 104 MET CE :methyl -138:sc= -1.1 (180deg=-1.99) USER MOD Single : B 105 TYR OH : rot 31:sc= 1.19 USER MOD Single : B 106 SER OG : rot 74:sc= 1.28 USER MOD Single : B 109 THR OG1 : rot -75:sc= 1.24 USER MOD Single : B 114 SER OG : rot 180:sc= 0 USER MOD Single : B 119 SER OG : rot 63:sc= -0.163 USER MOD Single : B 125 LYS NZ :NH3+ 159:sc= 0.891 (180deg=-0.108!) USER MOD Single : B 127 HIS :FLIP no HD1:sc= -0.238 F(o=-1.3,f=-0.24) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 202 -11.009 16.453 -12.026 1.00 0.00 N ATOM 2 CA ALA A 202 -10.912 16.302 -10.558 1.00 0.00 C ATOM 3 C ALA A 202 -11.457 14.944 -10.120 1.00 0.00 C ATOM 4 O ALA A 202 -10.694 14.007 -9.879 1.00 0.00 O ATOM 5 CB ALA A 202 -11.656 17.433 -9.861 1.00 0.00 C ATOM 0 HA ALA A 202 -9.861 16.353 -10.272 1.00 0.00 H new ATOM 0 HB1 ALA A 202 -11.577 17.310 -8.781 1.00 0.00 H new ATOM 0 HB2 ALA A 202 -11.219 18.389 -10.150 1.00 0.00 H new ATOM 0 HB3 ALA A 202 -12.706 17.412 -10.152 1.00 0.00 H new ATOM 11 N ASN A 203 -12.776 14.833 -10.038 1.00 0.00 N ATOM 12 CA ASN A 203 -13.412 13.588 -9.627 1.00 0.00 C ATOM 13 C ASN A 203 -13.587 12.665 -10.827 1.00 0.00 C ATOM 14 O ASN A 203 -14.525 12.814 -11.612 1.00 0.00 O ATOM 15 CB ASN A 203 -14.767 13.870 -8.966 1.00 0.00 C ATOM 16 CG ASN A 203 -15.433 12.618 -8.417 1.00 0.00 C ATOM 17 OD1 ASN A 203 -15.151 12.187 -7.300 1.00 0.00 O ATOM 18 ND2 ASN A 203 -16.330 12.032 -9.194 1.00 0.00 N ATOM 0 H ASN A 203 -13.426 15.589 -10.250 1.00 0.00 H new ATOM 0 HA ASN A 203 -12.770 13.094 -8.898 1.00 0.00 H new ATOM 0 HB2 ASN A 203 -14.628 14.586 -8.156 1.00 0.00 H new ATOM 0 HB3 ASN A 203 -15.430 14.338 -9.694 1.00 0.00 H new ATOM 0 HD21 ASN A 203 -16.814 11.194 -8.872 1.00 0.00 H new ATOM 0 HD22 ASN A 203 -16.538 12.419 -10.115 1.00 0.00 H new ATOM 25 N GLY A 204 -12.671 11.717 -10.968 1.00 0.00 N ATOM 26 CA GLY A 204 -12.728 10.780 -12.075 1.00 0.00 C ATOM 27 C GLY A 204 -13.486 9.520 -11.718 1.00 0.00 C ATOM 28 O GLY A 204 -13.163 8.431 -12.193 1.00 0.00 O ATOM 0 H GLY A 204 -11.885 11.579 -10.333 1.00 0.00 H new ATOM 0 HA2 GLY A 204 -13.205 11.259 -12.930 1.00 0.00 H new ATOM 0 HA3 GLY A 204 -11.715 10.518 -12.380 1.00 0.00 H new ATOM 32 N LEU A 205 -14.492 9.674 -10.872 1.00 0.00 N ATOM 33 CA LEU A 205 -15.316 8.562 -10.436 1.00 0.00 C ATOM 34 C LEU A 205 -16.753 8.781 -10.877 1.00 0.00 C ATOM 35 O LEU A 205 -17.187 9.918 -11.060 1.00 0.00 O ATOM 36 CB LEU A 205 -15.257 8.419 -8.912 1.00 0.00 C ATOM 37 CG LEU A 205 -14.065 7.630 -8.373 1.00 0.00 C ATOM 38 CD1 LEU A 205 -13.894 7.877 -6.882 1.00 0.00 C ATOM 39 CD2 LEU A 205 -14.246 6.146 -8.645 1.00 0.00 C ATOM 0 H LEU A 205 -14.759 10.573 -10.470 1.00 0.00 H new ATOM 0 HA LEU A 205 -14.935 7.646 -10.889 1.00 0.00 H new ATOM 0 HB2 LEU A 205 -15.241 9.416 -8.471 1.00 0.00 H new ATOM 0 HB3 LEU A 205 -16.174 7.936 -8.574 1.00 0.00 H new ATOM 0 HG LEU A 205 -13.165 7.970 -8.886 1.00 0.00 H new ATOM 0 HD11 LEU A 205 -13.041 7.307 -6.514 1.00 0.00 H new ATOM 0 HD12 LEU A 205 -13.724 8.939 -6.706 1.00 0.00 H new ATOM 0 HD13 LEU A 205 -14.795 7.562 -6.355 1.00 0.00 H new ATOM 0 HD21 LEU A 205 -13.389 5.597 -8.255 1.00 0.00 H new ATOM 0 HD22 LEU A 205 -15.155 5.795 -8.156 1.00 0.00 H new ATOM 0 HD23 LEU A 205 -14.325 5.980 -9.719 1.00 0.00 H new ATOM 51 N THR A 206 -17.479 7.696 -11.063 1.00 0.00 N ATOM 52 CA THR A 206 -18.862 7.778 -11.472 1.00 0.00 C ATOM 53 C THR A 206 -19.737 8.127 -10.271 1.00 0.00 C ATOM 54 O THR A 206 -19.451 7.700 -9.151 1.00 0.00 O ATOM 55 CB THR A 206 -19.320 6.449 -12.094 1.00 0.00 C ATOM 56 OG1 THR A 206 -18.592 5.360 -11.504 1.00 0.00 O ATOM 57 CG2 THR A 206 -19.094 6.457 -13.597 1.00 0.00 C ATOM 0 H THR A 206 -17.130 6.746 -10.936 1.00 0.00 H new ATOM 0 HA THR A 206 -18.959 8.561 -12.224 1.00 0.00 H new ATOM 0 HB THR A 206 -20.385 6.324 -11.900 1.00 0.00 H new ATOM 0 HG1 THR A 206 -18.625 4.583 -12.101 1.00 0.00 H new ATOM 0 HG21 THR A 206 -19.424 5.508 -14.020 1.00 0.00 H new ATOM 0 HG22 THR A 206 -19.662 7.272 -14.046 1.00 0.00 H new ATOM 0 HG23 THR A 206 -18.033 6.597 -13.805 1.00 0.00 H new ATOM 65 N VAL A 207 -20.800 8.895 -10.504 1.00 0.00 N ATOM 66 CA VAL A 207 -21.708 9.308 -9.436 1.00 0.00 C ATOM 67 C VAL A 207 -22.206 8.100 -8.643 1.00 0.00 C ATOM 68 O VAL A 207 -22.404 8.174 -7.429 1.00 0.00 O ATOM 69 CB VAL A 207 -22.913 10.095 -9.997 1.00 0.00 C ATOM 70 CG1 VAL A 207 -23.819 10.581 -8.875 1.00 0.00 C ATOM 71 CG2 VAL A 207 -22.436 11.267 -10.841 1.00 0.00 C ATOM 0 H VAL A 207 -21.054 9.245 -11.428 1.00 0.00 H new ATOM 0 HA VAL A 207 -21.146 9.962 -8.769 1.00 0.00 H new ATOM 0 HB VAL A 207 -23.491 9.422 -10.630 1.00 0.00 H new ATOM 0 HG11 VAL A 207 -24.659 11.132 -9.298 1.00 0.00 H new ATOM 0 HG12 VAL A 207 -24.193 9.725 -8.313 1.00 0.00 H new ATOM 0 HG13 VAL A 207 -23.255 11.234 -8.209 1.00 0.00 H new ATOM 0 HG21 VAL A 207 -23.298 11.811 -11.229 1.00 0.00 H new ATOM 0 HG22 VAL A 207 -21.831 11.935 -10.228 1.00 0.00 H new ATOM 0 HG23 VAL A 207 -21.837 10.896 -11.673 1.00 0.00 H new ATOM 81 N ALA A 208 -22.389 6.983 -9.335 1.00 0.00 N ATOM 82 CA ALA A 208 -22.843 5.755 -8.702 1.00 0.00 C ATOM 83 C ALA A 208 -21.831 5.278 -7.660 1.00 0.00 C ATOM 84 O ALA A 208 -22.199 4.930 -6.539 1.00 0.00 O ATOM 85 CB ALA A 208 -23.076 4.677 -9.749 1.00 0.00 C ATOM 0 H ALA A 208 -22.229 6.904 -10.339 1.00 0.00 H new ATOM 0 HA ALA A 208 -23.786 5.958 -8.194 1.00 0.00 H new ATOM 0 HB1 ALA A 208 -23.416 3.763 -9.261 1.00 0.00 H new ATOM 0 HB2 ALA A 208 -23.834 5.014 -10.456 1.00 0.00 H new ATOM 0 HB3 ALA A 208 -22.146 4.480 -10.281 1.00 0.00 H new ATOM 91 N GLN A 209 -20.552 5.294 -8.031 1.00 0.00 N ATOM 92 CA GLN A 209 -19.484 4.861 -7.133 1.00 0.00 C ATOM 93 C GLN A 209 -19.254 5.881 -6.028 1.00 0.00 C ATOM 94 O GLN A 209 -18.959 5.518 -4.890 1.00 0.00 O ATOM 95 CB GLN A 209 -18.183 4.638 -7.906 1.00 0.00 C ATOM 96 CG GLN A 209 -18.220 3.430 -8.823 1.00 0.00 C ATOM 97 CD GLN A 209 -16.853 3.077 -9.365 1.00 0.00 C ATOM 98 OE1 GLN A 209 -16.116 2.300 -8.766 1.00 0.00 O ATOM 99 NE2 GLN A 209 -16.505 3.653 -10.502 1.00 0.00 N ATOM 0 H GLN A 209 -20.230 5.603 -8.948 1.00 0.00 H new ATOM 0 HA GLN A 209 -19.795 3.919 -6.681 1.00 0.00 H new ATOM 0 HB2 GLN A 209 -17.965 5.527 -8.498 1.00 0.00 H new ATOM 0 HB3 GLN A 209 -17.364 4.520 -7.196 1.00 0.00 H new ATOM 0 HG2 GLN A 209 -18.624 2.576 -8.279 1.00 0.00 H new ATOM 0 HG3 GLN A 209 -18.897 3.628 -9.654 1.00 0.00 H new ATOM 0 HE21 GLN A 209 -17.149 4.293 -10.967 1.00 0.00 H new ATOM 0 HE22 GLN A 209 -15.593 3.458 -10.914 1.00 0.00 H new ATOM 108 N ASN A 210 -19.390 7.158 -6.372 1.00 0.00 N ATOM 109 CA ASN A 210 -19.207 8.239 -5.408 1.00 0.00 C ATOM 110 C ASN A 210 -20.151 8.062 -4.225 1.00 0.00 C ATOM 111 O ASN A 210 -19.777 8.297 -3.076 1.00 0.00 O ATOM 112 CB ASN A 210 -19.445 9.605 -6.063 1.00 0.00 C ATOM 113 CG ASN A 210 -18.194 10.181 -6.705 1.00 0.00 C ATOM 114 OD1 ASN A 210 -17.933 9.971 -7.887 1.00 0.00 O ATOM 115 ND2 ASN A 210 -17.413 10.918 -5.931 1.00 0.00 N ATOM 0 H ASN A 210 -19.627 7.471 -7.314 1.00 0.00 H new ATOM 0 HA ASN A 210 -18.177 8.200 -5.052 1.00 0.00 H new ATOM 0 HB2 ASN A 210 -20.224 9.508 -6.820 1.00 0.00 H new ATOM 0 HB3 ASN A 210 -19.815 10.303 -5.312 1.00 0.00 H new ATOM 0 HD21 ASN A 210 -16.563 11.333 -6.312 1.00 0.00 H new ATOM 0 HD22 ASN A 210 -17.662 11.071 -4.954 1.00 0.00 H new ATOM 122 N GLN A 211 -21.373 7.627 -4.517 1.00 0.00 N ATOM 123 CA GLN A 211 -22.374 7.401 -3.484 1.00 0.00 C ATOM 124 C GLN A 211 -21.983 6.215 -2.611 1.00 0.00 C ATOM 125 O GLN A 211 -22.079 6.278 -1.387 1.00 0.00 O ATOM 126 CB GLN A 211 -23.746 7.159 -4.113 1.00 0.00 C ATOM 127 CG GLN A 211 -24.377 8.414 -4.690 1.00 0.00 C ATOM 128 CD GLN A 211 -25.515 8.104 -5.641 1.00 0.00 C ATOM 129 OE1 GLN A 211 -26.668 7.975 -5.230 1.00 0.00 O ATOM 130 NE2 GLN A 211 -25.197 7.970 -6.917 1.00 0.00 N ATOM 0 H GLN A 211 -21.693 7.424 -5.464 1.00 0.00 H new ATOM 0 HA GLN A 211 -22.427 8.292 -2.859 1.00 0.00 H new ATOM 0 HB2 GLN A 211 -23.649 6.414 -4.903 1.00 0.00 H new ATOM 0 HB3 GLN A 211 -24.413 6.739 -3.360 1.00 0.00 H new ATOM 0 HG2 GLN A 211 -24.747 9.038 -3.877 1.00 0.00 H new ATOM 0 HG3 GLN A 211 -23.616 8.992 -5.215 1.00 0.00 H new ATOM 0 HE21 GLN A 211 -24.229 8.085 -7.216 1.00 0.00 H new ATOM 0 HE22 GLN A 211 -25.920 7.752 -7.603 1.00 0.00 H new ATOM 139 N VAL A 212 -21.526 5.143 -3.252 1.00 0.00 N ATOM 140 CA VAL A 212 -21.110 3.935 -2.543 1.00 0.00 C ATOM 141 C VAL A 212 -19.975 4.242 -1.568 1.00 0.00 C ATOM 142 O VAL A 212 -20.046 3.892 -0.390 1.00 0.00 O ATOM 143 CB VAL A 212 -20.654 2.830 -3.526 1.00 0.00 C ATOM 144 CG1 VAL A 212 -20.228 1.574 -2.777 1.00 0.00 C ATOM 145 CG2 VAL A 212 -21.758 2.510 -4.521 1.00 0.00 C ATOM 0 H VAL A 212 -21.434 5.086 -4.266 1.00 0.00 H new ATOM 0 HA VAL A 212 -21.976 3.574 -1.988 1.00 0.00 H new ATOM 0 HB VAL A 212 -19.791 3.204 -4.076 1.00 0.00 H new ATOM 0 HG11 VAL A 212 -19.912 0.814 -3.491 1.00 0.00 H new ATOM 0 HG12 VAL A 212 -19.399 1.812 -2.110 1.00 0.00 H new ATOM 0 HG13 VAL A 212 -21.067 1.197 -2.193 1.00 0.00 H new ATOM 0 HG21 VAL A 212 -21.418 1.731 -5.203 1.00 0.00 H new ATOM 0 HG22 VAL A 212 -22.641 2.163 -3.985 1.00 0.00 H new ATOM 0 HG23 VAL A 212 -22.007 3.406 -5.089 1.00 0.00 H new ATOM 155 N LEU A 213 -18.942 4.917 -2.064 1.00 0.00 N ATOM 156 CA LEU A 213 -17.789 5.278 -1.243 1.00 0.00 C ATOM 157 C LEU A 213 -18.208 6.167 -0.075 1.00 0.00 C ATOM 158 O LEU A 213 -17.763 5.974 1.059 1.00 0.00 O ATOM 159 CB LEU A 213 -16.737 5.993 -2.096 1.00 0.00 C ATOM 160 CG LEU A 213 -15.532 6.544 -1.327 1.00 0.00 C ATOM 161 CD1 LEU A 213 -14.732 5.415 -0.694 1.00 0.00 C ATOM 162 CD2 LEU A 213 -14.648 7.375 -2.246 1.00 0.00 C ATOM 0 H LEU A 213 -18.879 5.226 -3.034 1.00 0.00 H new ATOM 0 HA LEU A 213 -17.358 4.362 -0.839 1.00 0.00 H new ATOM 0 HB2 LEU A 213 -16.376 5.299 -2.855 1.00 0.00 H new ATOM 0 HB3 LEU A 213 -17.219 6.817 -2.622 1.00 0.00 H new ATOM 0 HG LEU A 213 -15.902 7.187 -0.529 1.00 0.00 H new ATOM 0 HD11 LEU A 213 -13.881 5.830 -0.153 1.00 0.00 H new ATOM 0 HD12 LEU A 213 -15.367 4.863 -0.002 1.00 0.00 H new ATOM 0 HD13 LEU A 213 -14.373 4.742 -1.473 1.00 0.00 H new ATOM 0 HD21 LEU A 213 -13.797 7.759 -1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 213 -14.290 6.753 -3.066 1.00 0.00 H new ATOM 0 HD23 LEU A 213 -15.223 8.209 -2.647 1.00 0.00 H new ATOM 174 N ASN A 214 -19.075 7.133 -0.355 1.00 0.00 N ATOM 175 CA ASN A 214 -19.552 8.049 0.671 1.00 0.00 C ATOM 176 C ASN A 214 -20.359 7.302 1.730 1.00 0.00 C ATOM 177 O ASN A 214 -20.208 7.551 2.922 1.00 0.00 O ATOM 178 CB ASN A 214 -20.396 9.164 0.047 1.00 0.00 C ATOM 179 CG ASN A 214 -20.932 10.132 1.083 1.00 0.00 C ATOM 180 OD1 ASN A 214 -22.026 9.945 1.612 1.00 0.00 O ATOM 181 ND2 ASN A 214 -20.169 11.174 1.377 1.00 0.00 N ATOM 0 H ASN A 214 -19.461 7.301 -1.284 1.00 0.00 H new ATOM 0 HA ASN A 214 -18.685 8.499 1.154 1.00 0.00 H new ATOM 0 HB2 ASN A 214 -19.793 9.710 -0.678 1.00 0.00 H new ATOM 0 HB3 ASN A 214 -21.230 8.723 -0.499 1.00 0.00 H new ATOM 0 HD21 ASN A 214 -20.483 11.858 2.065 1.00 0.00 H new ATOM 0 HD22 ASN A 214 -19.267 11.292 0.915 1.00 0.00 H new ATOM 188 N LEU A 215 -21.187 6.363 1.285 1.00 0.00 N ATOM 189 CA LEU A 215 -22.025 5.574 2.185 1.00 0.00 C ATOM 190 C LEU A 215 -21.188 4.815 3.211 1.00 0.00 C ATOM 191 O LEU A 215 -21.591 4.667 4.363 1.00 0.00 O ATOM 192 CB LEU A 215 -22.876 4.584 1.384 1.00 0.00 C ATOM 193 CG LEU A 215 -24.375 4.896 1.336 1.00 0.00 C ATOM 194 CD1 LEU A 215 -24.979 4.858 2.731 1.00 0.00 C ATOM 195 CD2 LEU A 215 -24.623 6.248 0.687 1.00 0.00 C ATOM 0 H LEU A 215 -21.297 6.127 0.299 1.00 0.00 H new ATOM 0 HA LEU A 215 -22.675 6.266 2.720 1.00 0.00 H new ATOM 0 HB2 LEU A 215 -22.497 4.548 0.363 1.00 0.00 H new ATOM 0 HB3 LEU A 215 -22.742 3.589 1.809 1.00 0.00 H new ATOM 0 HG LEU A 215 -24.860 4.130 0.731 1.00 0.00 H new ATOM 0 HD11 LEU A 215 -26.044 5.083 2.673 1.00 0.00 H new ATOM 0 HD12 LEU A 215 -24.840 3.866 3.161 1.00 0.00 H new ATOM 0 HD13 LEU A 215 -24.486 5.598 3.361 1.00 0.00 H new ATOM 0 HD21 LEU A 215 -25.694 6.449 0.663 1.00 0.00 H new ATOM 0 HD22 LEU A 215 -24.120 7.025 1.262 1.00 0.00 H new ATOM 0 HD23 LEU A 215 -24.233 6.240 -0.331 1.00 0.00 H new ATOM 207 N ILE A 216 -20.022 4.345 2.788 1.00 0.00 N ATOM 208 CA ILE A 216 -19.137 3.592 3.667 1.00 0.00 C ATOM 209 C ILE A 216 -18.485 4.498 4.711 1.00 0.00 C ATOM 210 O ILE A 216 -18.479 4.184 5.901 1.00 0.00 O ATOM 211 CB ILE A 216 -18.031 2.864 2.870 1.00 0.00 C ATOM 212 CG1 ILE A 216 -18.644 2.020 1.750 1.00 0.00 C ATOM 213 CG2 ILE A 216 -17.198 1.988 3.797 1.00 0.00 C ATOM 214 CD1 ILE A 216 -17.628 1.450 0.785 1.00 0.00 C ATOM 0 H ILE A 216 -19.667 4.472 1.840 1.00 0.00 H new ATOM 0 HA ILE A 216 -19.757 2.852 4.172 1.00 0.00 H new ATOM 0 HB ILE A 216 -17.380 3.614 2.421 1.00 0.00 H new ATOM 0 HG12 ILE A 216 -19.209 1.200 2.194 1.00 0.00 H new ATOM 0 HG13 ILE A 216 -19.354 2.632 1.194 1.00 0.00 H new ATOM 0 HG21 ILE A 216 -16.423 1.482 3.221 1.00 0.00 H new ATOM 0 HG22 ILE A 216 -16.733 2.608 4.563 1.00 0.00 H new ATOM 0 HG23 ILE A 216 -17.840 1.246 4.271 1.00 0.00 H new ATOM 0 HD11 ILE A 216 -18.140 0.865 0.021 1.00 0.00 H new ATOM 0 HD12 ILE A 216 -17.079 2.264 0.311 1.00 0.00 H new ATOM 0 HD13 ILE A 216 -16.931 0.810 1.326 1.00 0.00 H new ATOM 226 N LYS A 217 -17.954 5.633 4.268 1.00 0.00 N ATOM 227 CA LYS A 217 -17.281 6.559 5.176 1.00 0.00 C ATOM 228 C LYS A 217 -18.271 7.363 6.025 1.00 0.00 C ATOM 229 O LYS A 217 -17.913 7.881 7.081 1.00 0.00 O ATOM 230 CB LYS A 217 -16.351 7.496 4.397 1.00 0.00 C ATOM 231 CG LYS A 217 -17.060 8.420 3.416 1.00 0.00 C ATOM 232 CD LYS A 217 -17.201 9.829 3.975 1.00 0.00 C ATOM 233 CE LYS A 217 -15.868 10.365 4.478 1.00 0.00 C ATOM 234 NZ LYS A 217 -15.998 11.723 5.068 1.00 0.00 N ATOM 0 H LYS A 217 -17.975 5.934 3.294 1.00 0.00 H new ATOM 0 HA LYS A 217 -16.684 5.959 5.863 1.00 0.00 H new ATOM 0 HB2 LYS A 217 -15.790 8.103 5.108 1.00 0.00 H new ATOM 0 HB3 LYS A 217 -15.626 6.894 3.850 1.00 0.00 H new ATOM 0 HG2 LYS A 217 -16.503 8.454 2.480 1.00 0.00 H new ATOM 0 HG3 LYS A 217 -18.047 8.019 3.186 1.00 0.00 H new ATOM 0 HD2 LYS A 217 -17.592 10.491 3.202 1.00 0.00 H new ATOM 0 HD3 LYS A 217 -17.925 9.828 4.790 1.00 0.00 H new ATOM 0 HE2 LYS A 217 -15.462 9.683 5.225 1.00 0.00 H new ATOM 0 HE3 LYS A 217 -15.156 10.395 3.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 217 -15.081 12.021 5.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 217 -16.296 12.394 4.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 217 -16.708 11.705 5.828 1.00 0.00 H new ATOM 248 N ALA A 218 -19.509 7.470 5.568 1.00 0.00 N ATOM 249 CA ALA A 218 -20.526 8.209 6.304 1.00 0.00 C ATOM 250 C ALA A 218 -21.448 7.256 7.057 1.00 0.00 C ATOM 251 O ALA A 218 -22.567 7.617 7.427 1.00 0.00 O ATOM 252 CB ALA A 218 -21.330 9.096 5.364 1.00 0.00 C ATOM 0 H ALA A 218 -19.834 7.056 4.694 1.00 0.00 H new ATOM 0 HA ALA A 218 -20.023 8.845 7.032 1.00 0.00 H new ATOM 0 HB1 ALA A 218 -22.084 9.640 5.933 1.00 0.00 H new ATOM 0 HB2 ALA A 218 -20.663 9.806 4.875 1.00 0.00 H new ATOM 0 HB3 ALA A 218 -21.819 8.479 4.610 1.00 0.00 H new ATOM 258 N CYS A 219 -20.978 6.039 7.272 1.00 0.00 N ATOM 259 CA CYS A 219 -21.755 5.037 7.979 1.00 0.00 C ATOM 260 C CYS A 219 -21.442 5.078 9.472 1.00 0.00 C ATOM 261 O CYS A 219 -20.276 5.039 9.871 1.00 0.00 O ATOM 262 CB CYS A 219 -21.464 3.646 7.413 1.00 0.00 C ATOM 263 SG CYS A 219 -22.427 2.318 8.173 1.00 0.00 S ATOM 0 H CYS A 219 -20.059 5.721 6.966 1.00 0.00 H new ATOM 0 HA CYS A 219 -22.814 5.256 7.841 1.00 0.00 H new ATOM 0 HB2 CYS A 219 -21.661 3.654 6.341 1.00 0.00 H new ATOM 0 HB3 CYS A 219 -20.403 3.429 7.541 1.00 0.00 H new ATOM 0 HG CYS A 219 -21.709 1.236 8.225 1.00 0.00 H new ATOM 269 N PRO A 220 -22.481 5.164 10.318 1.00 0.00 N ATOM 270 CA PRO A 220 -22.324 5.208 11.774 1.00 0.00 C ATOM 271 C PRO A 220 -22.090 3.821 12.376 1.00 0.00 C ATOM 272 O PRO A 220 -22.695 3.456 13.389 1.00 0.00 O ATOM 273 CB PRO A 220 -23.663 5.780 12.236 1.00 0.00 C ATOM 274 CG PRO A 220 -24.642 5.291 11.226 1.00 0.00 C ATOM 275 CD PRO A 220 -23.900 5.231 9.917 1.00 0.00 C ATOM 0 HA PRO A 220 -21.459 5.794 12.084 1.00 0.00 H new ATOM 0 HB2 PRO A 220 -23.919 5.434 13.237 1.00 0.00 H new ATOM 0 HB3 PRO A 220 -23.639 6.869 12.272 1.00 0.00 H new ATOM 0 HG2 PRO A 220 -25.027 4.309 11.501 1.00 0.00 H new ATOM 0 HG3 PRO A 220 -25.499 5.962 11.158 1.00 0.00 H new ATOM 0 HD2 PRO A 220 -24.192 4.359 9.332 1.00 0.00 H new ATOM 0 HD3 PRO A 220 -24.101 6.109 9.303 1.00 0.00 H new ATOM 283 N ARG A 221 -21.207 3.056 11.750 1.00 0.00 N ATOM 284 CA ARG A 221 -20.889 1.713 12.207 1.00 0.00 C ATOM 285 C ARG A 221 -19.389 1.555 12.414 1.00 0.00 C ATOM 286 O ARG A 221 -18.592 1.968 11.569 1.00 0.00 O ATOM 287 CB ARG A 221 -21.380 0.679 11.193 1.00 0.00 C ATOM 288 CG ARG A 221 -22.867 0.383 11.287 1.00 0.00 C ATOM 289 CD ARG A 221 -23.126 -0.977 11.921 1.00 0.00 C ATOM 290 NE ARG A 221 -22.446 -2.058 11.203 1.00 0.00 N ATOM 291 CZ ARG A 221 -22.941 -2.658 10.115 1.00 0.00 C ATOM 292 NH1 ARG A 221 -24.104 -2.267 9.604 1.00 0.00 N ATOM 293 NH2 ARG A 221 -22.268 -3.639 9.522 1.00 0.00 N ATOM 0 H ARG A 221 -20.695 3.347 10.917 1.00 0.00 H new ATOM 0 HA ARG A 221 -21.393 1.550 13.160 1.00 0.00 H new ATOM 0 HB2 ARG A 221 -21.153 1.034 10.188 1.00 0.00 H new ATOM 0 HB3 ARG A 221 -20.825 -0.248 11.336 1.00 0.00 H new ATOM 0 HG2 ARG A 221 -23.357 1.159 11.875 1.00 0.00 H new ATOM 0 HG3 ARG A 221 -23.308 0.411 10.291 1.00 0.00 H new ATOM 0 HD2 ARG A 221 -22.790 -0.963 12.958 1.00 0.00 H new ATOM 0 HD3 ARG A 221 -24.198 -1.171 11.936 1.00 0.00 H new ATOM 0 HE ARG A 221 -21.541 -2.372 11.554 1.00 0.00 H new ATOM 0 HH11 ARG A 221 -24.623 -1.506 10.042 1.00 0.00 H new ATOM 0 HH12 ARG A 221 -24.477 -2.728 8.774 1.00 0.00 H new ATOM 0 HH21 ARG A 221 -21.368 -3.939 9.896 1.00 0.00 H new ATOM 0 HH22 ARG A 221 -22.652 -4.092 8.693 1.00 0.00 H new ATOM 307 N PRO A 222 -18.986 0.957 13.544 1.00 0.00 N ATOM 308 CA PRO A 222 -17.572 0.728 13.865 1.00 0.00 C ATOM 309 C PRO A 222 -16.899 -0.195 12.848 1.00 0.00 C ATOM 310 O PRO A 222 -15.688 -0.131 12.633 1.00 0.00 O ATOM 311 CB PRO A 222 -17.617 0.062 15.247 1.00 0.00 C ATOM 312 CG PRO A 222 -18.959 0.403 15.798 1.00 0.00 C ATOM 313 CD PRO A 222 -19.875 0.475 14.615 1.00 0.00 C ATOM 0 HA PRO A 222 -16.993 1.651 13.847 1.00 0.00 H new ATOM 0 HB2 PRO A 222 -17.485 -1.017 15.169 1.00 0.00 H new ATOM 0 HB3 PRO A 222 -16.820 0.435 15.891 1.00 0.00 H new ATOM 0 HG2 PRO A 222 -19.295 -0.353 16.508 1.00 0.00 H new ATOM 0 HG3 PRO A 222 -18.933 1.353 16.332 1.00 0.00 H new ATOM 0 HD2 PRO A 222 -20.305 -0.498 14.377 1.00 0.00 H new ATOM 0 HD3 PRO A 222 -20.707 1.158 14.788 1.00 0.00 H new ATOM 321 N GLU A 223 -17.701 -1.044 12.216 1.00 0.00 N ATOM 322 CA GLU A 223 -17.201 -1.982 11.219 1.00 0.00 C ATOM 323 C GLU A 223 -17.119 -1.319 9.851 1.00 0.00 C ATOM 324 O GLU A 223 -16.525 -1.865 8.923 1.00 0.00 O ATOM 325 CB GLU A 223 -18.115 -3.210 11.122 1.00 0.00 C ATOM 326 CG GLU A 223 -18.321 -3.946 12.434 1.00 0.00 C ATOM 327 CD GLU A 223 -19.305 -3.247 13.348 1.00 0.00 C ATOM 328 OE1 GLU A 223 -20.230 -2.578 12.836 1.00 0.00 O ATOM 329 OE2 GLU A 223 -19.153 -3.360 14.581 1.00 0.00 O ATOM 0 H GLU A 223 -18.706 -1.102 12.378 1.00 0.00 H new ATOM 0 HA GLU A 223 -16.205 -2.295 11.532 1.00 0.00 H new ATOM 0 HB2 GLU A 223 -19.086 -2.895 10.740 1.00 0.00 H new ATOM 0 HB3 GLU A 223 -17.695 -3.903 10.393 1.00 0.00 H new ATOM 0 HG2 GLU A 223 -18.677 -4.955 12.228 1.00 0.00 H new ATOM 0 HG3 GLU A 223 -17.363 -4.044 12.945 1.00 0.00 H new ATOM 336 N GLY A 224 -17.704 -0.137 9.740 1.00 0.00 N ATOM 337 CA GLY A 224 -17.720 0.567 8.478 1.00 0.00 C ATOM 338 C GLY A 224 -18.943 0.186 7.678 1.00 0.00 C ATOM 339 O GLY A 224 -20.061 0.558 8.037 1.00 0.00 O ATOM 0 H GLY A 224 -18.170 0.349 10.506 1.00 0.00 H new ATOM 0 HA2 GLY A 224 -17.714 1.643 8.654 1.00 0.00 H new ATOM 0 HA3 GLY A 224 -16.819 0.331 7.911 1.00 0.00 H new ATOM 343 N LEU A 225 -18.747 -0.578 6.618 1.00 0.00 N ATOM 344 CA LEU A 225 -19.853 -1.017 5.787 1.00 0.00 C ATOM 345 C LEU A 225 -19.508 -2.342 5.128 1.00 0.00 C ATOM 346 O LEU A 225 -18.758 -2.388 4.157 1.00 0.00 O ATOM 347 CB LEU A 225 -20.197 0.040 4.733 1.00 0.00 C ATOM 348 CG LEU A 225 -21.642 -0.001 4.221 1.00 0.00 C ATOM 349 CD1 LEU A 225 -22.623 0.076 5.382 1.00 0.00 C ATOM 350 CD2 LEU A 225 -21.897 1.137 3.244 1.00 0.00 C ATOM 0 H LEU A 225 -17.831 -0.907 6.312 1.00 0.00 H new ATOM 0 HA LEU A 225 -20.731 -1.155 6.418 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -20.004 1.027 5.154 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -19.523 -0.082 3.885 1.00 0.00 H new ATOM 0 HG LEU A 225 -21.791 -0.947 3.700 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -23.643 0.046 4.999 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -22.461 -0.769 6.052 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -22.468 1.007 5.928 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -22.928 1.090 2.892 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -21.727 2.091 3.744 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -21.219 1.046 2.395 1.00 0.00 H new ATOM 362 N ASN A 226 -20.045 -3.417 5.687 1.00 0.00 N ATOM 363 CA ASN A 226 -19.801 -4.762 5.178 1.00 0.00 C ATOM 364 C ASN A 226 -20.427 -4.944 3.798 1.00 0.00 C ATOM 365 O ASN A 226 -21.292 -4.164 3.392 1.00 0.00 O ATOM 366 CB ASN A 226 -20.379 -5.798 6.148 1.00 0.00 C ATOM 367 CG ASN A 226 -19.714 -5.773 7.515 1.00 0.00 C ATOM 368 OD1 ASN A 226 -19.959 -4.878 8.327 1.00 0.00 O ATOM 369 ND2 ASN A 226 -18.890 -6.770 7.794 1.00 0.00 N ATOM 0 H ASN A 226 -20.659 -3.384 6.501 1.00 0.00 H new ATOM 0 HA ASN A 226 -18.724 -4.905 5.090 1.00 0.00 H new ATOM 0 HB2 ASN A 226 -21.447 -5.618 6.267 1.00 0.00 H new ATOM 0 HB3 ASN A 226 -20.269 -6.792 5.716 1.00 0.00 H new ATOM 0 HD21 ASN A 226 -18.434 -6.815 8.705 1.00 0.00 H new ATOM 0 HD22 ASN A 226 -18.711 -7.493 7.098 1.00 0.00 H new ATOM 376 N PHE A 227 -20.008 -5.990 3.090 1.00 0.00 N ATOM 377 CA PHE A 227 -20.528 -6.273 1.755 1.00 0.00 C ATOM 378 C PHE A 227 -22.030 -6.510 1.826 1.00 0.00 C ATOM 379 O PHE A 227 -22.789 -6.052 0.969 1.00 0.00 O ATOM 380 CB PHE A 227 -19.825 -7.496 1.153 1.00 0.00 C ATOM 381 CG PHE A 227 -20.013 -7.642 -0.333 1.00 0.00 C ATOM 382 CD1 PHE A 227 -19.171 -6.986 -1.219 1.00 0.00 C ATOM 383 CD2 PHE A 227 -21.023 -8.442 -0.844 1.00 0.00 C ATOM 384 CE1 PHE A 227 -19.333 -7.124 -2.583 1.00 0.00 C ATOM 385 CE2 PHE A 227 -21.191 -8.581 -2.209 1.00 0.00 C ATOM 386 CZ PHE A 227 -20.345 -7.922 -3.079 1.00 0.00 C ATOM 0 H PHE A 227 -19.309 -6.656 3.419 1.00 0.00 H new ATOM 0 HA PHE A 227 -20.333 -5.414 1.112 1.00 0.00 H new ATOM 0 HB2 PHE A 227 -18.759 -7.432 1.369 1.00 0.00 H new ATOM 0 HB3 PHE A 227 -20.197 -8.395 1.646 1.00 0.00 H new ATOM 0 HD1 PHE A 227 -18.379 -6.359 -0.837 1.00 0.00 H new ATOM 0 HD2 PHE A 227 -21.686 -8.962 -0.168 1.00 0.00 H new ATOM 0 HE1 PHE A 227 -18.669 -6.609 -3.261 1.00 0.00 H new ATOM 0 HE2 PHE A 227 -21.984 -9.205 -2.595 1.00 0.00 H new ATOM 0 HZ PHE A 227 -20.475 -8.031 -4.146 1.00 0.00 H new ATOM 396 N GLN A 228 -22.447 -7.216 2.871 1.00 0.00 N ATOM 397 CA GLN A 228 -23.855 -7.518 3.097 1.00 0.00 C ATOM 398 C GLN A 228 -24.646 -6.231 3.334 1.00 0.00 C ATOM 399 O GLN A 228 -25.808 -6.119 2.944 1.00 0.00 O ATOM 400 CB GLN A 228 -24.003 -8.446 4.308 1.00 0.00 C ATOM 401 CG GLN A 228 -23.379 -7.881 5.575 1.00 0.00 C ATOM 402 CD GLN A 228 -24.218 -8.133 6.807 1.00 0.00 C ATOM 403 OE1 GLN A 228 -24.838 -9.190 6.949 1.00 0.00 O ATOM 404 NE2 GLN A 228 -24.268 -7.152 7.694 1.00 0.00 N ATOM 0 H GLN A 228 -21.821 -7.594 3.583 1.00 0.00 H new ATOM 0 HA GLN A 228 -24.250 -8.015 2.211 1.00 0.00 H new ATOM 0 HB2 GLN A 228 -25.062 -8.635 4.485 1.00 0.00 H new ATOM 0 HB3 GLN A 228 -23.541 -9.407 4.080 1.00 0.00 H new ATOM 0 HG2 GLN A 228 -22.393 -8.323 5.717 1.00 0.00 H new ATOM 0 HG3 GLN A 228 -23.233 -6.808 5.454 1.00 0.00 H new ATOM 0 HE21 GLN A 228 -23.739 -6.294 7.536 1.00 0.00 H new ATOM 0 HE22 GLN A 228 -24.836 -7.254 8.535 1.00 0.00 H new ATOM 413 N ASP A 229 -23.995 -5.260 3.960 1.00 0.00 N ATOM 414 CA ASP A 229 -24.621 -3.982 4.269 1.00 0.00 C ATOM 415 C ASP A 229 -24.715 -3.114 3.025 1.00 0.00 C ATOM 416 O ASP A 229 -25.708 -2.419 2.818 1.00 0.00 O ATOM 417 CB ASP A 229 -23.826 -3.244 5.347 1.00 0.00 C ATOM 418 CG ASP A 229 -24.090 -3.772 6.739 1.00 0.00 C ATOM 419 OD1 ASP A 229 -25.063 -3.319 7.374 1.00 0.00 O ATOM 420 OD2 ASP A 229 -23.314 -4.626 7.215 1.00 0.00 O ATOM 0 H ASP A 229 -23.025 -5.335 4.266 1.00 0.00 H new ATOM 0 HA ASP A 229 -25.627 -4.182 4.638 1.00 0.00 H new ATOM 0 HB2 ASP A 229 -22.762 -3.328 5.128 1.00 0.00 H new ATOM 0 HB3 ASP A 229 -24.075 -2.183 5.313 1.00 0.00 H new ATOM 425 N LEU A 230 -23.674 -3.168 2.203 1.00 0.00 N ATOM 426 CA LEU A 230 -23.606 -2.388 0.968 1.00 0.00 C ATOM 427 C LEU A 230 -24.846 -2.590 0.103 1.00 0.00 C ATOM 428 O LEU A 230 -25.516 -1.626 -0.272 1.00 0.00 O ATOM 429 CB LEU A 230 -22.358 -2.773 0.168 1.00 0.00 C ATOM 430 CG LEU A 230 -21.050 -2.159 0.664 1.00 0.00 C ATOM 431 CD1 LEU A 230 -19.862 -2.875 0.041 1.00 0.00 C ATOM 432 CD2 LEU A 230 -21.003 -0.674 0.338 1.00 0.00 C ATOM 0 H LEU A 230 -22.854 -3.751 2.371 1.00 0.00 H new ATOM 0 HA LEU A 230 -23.555 -1.336 1.249 1.00 0.00 H new ATOM 0 HB2 LEU A 230 -22.259 -3.858 0.181 1.00 0.00 H new ATOM 0 HB3 LEU A 230 -22.507 -2.479 -0.871 1.00 0.00 H new ATOM 0 HG LEU A 230 -21.000 -2.277 1.746 1.00 0.00 H new ATOM 0 HD11 LEU A 230 -18.937 -2.427 0.403 1.00 0.00 H new ATOM 0 HD12 LEU A 230 -19.887 -3.929 0.317 1.00 0.00 H new ATOM 0 HD13 LEU A 230 -19.910 -2.782 -1.044 1.00 0.00 H new ATOM 0 HD21 LEU A 230 -20.065 -0.252 0.698 1.00 0.00 H new ATOM 0 HD22 LEU A 230 -21.073 -0.536 -0.741 1.00 0.00 H new ATOM 0 HD23 LEU A 230 -21.838 -0.168 0.823 1.00 0.00 H new ATOM 444 N LYS A 231 -25.156 -3.846 -0.190 1.00 0.00 N ATOM 445 CA LYS A 231 -26.306 -4.174 -1.026 1.00 0.00 C ATOM 446 C LYS A 231 -27.622 -3.947 -0.283 1.00 0.00 C ATOM 447 O LYS A 231 -28.664 -3.744 -0.903 1.00 0.00 O ATOM 448 CB LYS A 231 -26.208 -5.620 -1.525 1.00 0.00 C ATOM 449 CG LYS A 231 -26.200 -6.658 -0.414 1.00 0.00 C ATOM 450 CD LYS A 231 -27.570 -7.291 -0.235 1.00 0.00 C ATOM 451 CE LYS A 231 -27.707 -7.945 1.130 1.00 0.00 C ATOM 452 NZ LYS A 231 -29.006 -8.649 1.280 1.00 0.00 N ATOM 0 H LYS A 231 -24.628 -4.655 0.138 1.00 0.00 H new ATOM 0 HA LYS A 231 -26.295 -3.505 -1.887 1.00 0.00 H new ATOM 0 HB2 LYS A 231 -27.047 -5.822 -2.191 1.00 0.00 H new ATOM 0 HB3 LYS A 231 -25.299 -5.729 -2.116 1.00 0.00 H new ATOM 0 HG2 LYS A 231 -25.467 -7.432 -0.643 1.00 0.00 H new ATOM 0 HG3 LYS A 231 -25.889 -6.191 0.520 1.00 0.00 H new ATOM 0 HD2 LYS A 231 -28.342 -6.531 -0.354 1.00 0.00 H new ATOM 0 HD3 LYS A 231 -27.733 -8.035 -1.014 1.00 0.00 H new ATOM 0 HE2 LYS A 231 -26.891 -8.653 1.277 1.00 0.00 H new ATOM 0 HE3 LYS A 231 -27.614 -7.186 1.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 -29.060 -9.081 2.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 -29.785 -7.969 1.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 -29.085 -9.390 0.555 1.00 0.00 H new ATOM 466 N ASN A 232 -27.575 -3.979 1.045 1.00 0.00 N ATOM 467 CA ASN A 232 -28.776 -3.770 1.847 1.00 0.00 C ATOM 468 C ASN A 232 -29.180 -2.302 1.819 1.00 0.00 C ATOM 469 O ASN A 232 -30.361 -1.974 1.713 1.00 0.00 O ATOM 470 CB ASN A 232 -28.563 -4.230 3.294 1.00 0.00 C ATOM 471 CG ASN A 232 -29.851 -4.222 4.103 1.00 0.00 C ATOM 472 OD1 ASN A 232 -30.942 -4.389 3.560 1.00 0.00 O ATOM 473 ND2 ASN A 232 -29.735 -4.028 5.408 1.00 0.00 N ATOM 0 H ASN A 232 -26.726 -4.146 1.585 1.00 0.00 H new ATOM 0 HA ASN A 232 -29.577 -4.369 1.415 1.00 0.00 H new ATOM 0 HB2 ASN A 232 -28.144 -5.236 3.294 1.00 0.00 H new ATOM 0 HB3 ASN A 232 -27.832 -3.580 3.775 1.00 0.00 H new ATOM 0 HD21 ASN A 232 -30.567 -4.014 5.997 1.00 0.00 H new ATOM 0 HD22 ASN A 232 -28.813 -3.893 5.824 1.00 0.00 H new ATOM 480 N GLN A 233 -28.193 -1.422 1.914 1.00 0.00 N ATOM 481 CA GLN A 233 -28.446 0.012 1.886 1.00 0.00 C ATOM 482 C GLN A 233 -28.763 0.458 0.463 1.00 0.00 C ATOM 483 O GLN A 233 -29.630 1.305 0.239 1.00 0.00 O ATOM 484 CB GLN A 233 -27.233 0.780 2.421 1.00 0.00 C ATOM 485 CG GLN A 233 -26.837 0.390 3.838 1.00 0.00 C ATOM 486 CD GLN A 233 -27.855 0.824 4.873 1.00 0.00 C ATOM 487 OE1 GLN A 233 -28.806 0.100 5.170 1.00 0.00 O ATOM 488 NE2 GLN A 233 -27.659 2.007 5.432 1.00 0.00 N ATOM 0 H GLN A 233 -27.210 -1.676 2.011 1.00 0.00 H new ATOM 0 HA GLN A 233 -29.302 0.228 2.525 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -26.385 0.611 1.757 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -27.450 1.848 2.395 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -26.711 -0.691 3.890 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -25.871 0.836 4.076 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -26.858 2.575 5.156 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -28.309 2.351 6.139 1.00 0.00 H new ATOM 497 N LEU A 234 -28.057 -0.120 -0.495 1.00 0.00 N ATOM 498 CA LEU A 234 -28.262 0.205 -1.896 1.00 0.00 C ATOM 499 C LEU A 234 -28.972 -0.946 -2.597 1.00 0.00 C ATOM 500 O LEU A 234 -28.369 -1.681 -3.375 1.00 0.00 O ATOM 501 CB LEU A 234 -26.923 0.502 -2.577 1.00 0.00 C ATOM 502 CG LEU A 234 -26.053 1.553 -1.878 1.00 0.00 C ATOM 503 CD1 LEU A 234 -24.683 1.632 -2.533 1.00 0.00 C ATOM 504 CD2 LEU A 234 -26.733 2.915 -1.902 1.00 0.00 C ATOM 0 H LEU A 234 -27.334 -0.819 -0.326 1.00 0.00 H new ATOM 0 HA LEU A 234 -28.886 1.096 -1.963 1.00 0.00 H new ATOM 0 HB2 LEU A 234 -26.356 -0.426 -2.648 1.00 0.00 H new ATOM 0 HB3 LEU A 234 -27.118 0.835 -3.596 1.00 0.00 H new ATOM 0 HG LEU A 234 -25.923 1.252 -0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 234 -24.079 2.383 -2.024 1.00 0.00 H new ATOM 0 HD12 LEU A 234 -24.190 0.662 -2.464 1.00 0.00 H new ATOM 0 HD13 LEU A 234 -24.796 1.907 -3.582 1.00 0.00 H new ATOM 0 HD21 LEU A 234 -26.099 3.647 -1.401 1.00 0.00 H new ATOM 0 HD22 LEU A 234 -26.895 3.222 -2.935 1.00 0.00 H new ATOM 0 HD23 LEU A 234 -27.692 2.852 -1.387 1.00 0.00 H new ATOM 516 N LYS A 235 -30.265 -1.081 -2.322 1.00 0.00 N ATOM 517 CA LYS A 235 -31.076 -2.153 -2.898 1.00 0.00 C ATOM 518 C LYS A 235 -31.184 -2.025 -4.418 1.00 0.00 C ATOM 519 O LYS A 235 -31.521 -2.983 -5.110 1.00 0.00 O ATOM 520 CB LYS A 235 -32.473 -2.154 -2.268 1.00 0.00 C ATOM 521 CG LYS A 235 -32.450 -2.130 -0.747 1.00 0.00 C ATOM 522 CD LYS A 235 -33.847 -2.243 -0.162 1.00 0.00 C ATOM 523 CE LYS A 235 -33.861 -1.903 1.322 1.00 0.00 C ATOM 524 NZ LYS A 235 -32.932 -2.761 2.107 1.00 0.00 N ATOM 0 H LYS A 235 -30.779 -0.458 -1.699 1.00 0.00 H new ATOM 0 HA LYS A 235 -30.580 -3.099 -2.679 1.00 0.00 H new ATOM 0 HB2 LYS A 235 -33.027 -1.288 -2.629 1.00 0.00 H new ATOM 0 HB3 LYS A 235 -33.013 -3.040 -2.602 1.00 0.00 H new ATOM 0 HG2 LYS A 235 -31.834 -2.951 -0.379 1.00 0.00 H new ATOM 0 HG3 LYS A 235 -31.986 -1.205 -0.405 1.00 0.00 H new ATOM 0 HD2 LYS A 235 -34.521 -1.573 -0.696 1.00 0.00 H new ATOM 0 HD3 LYS A 235 -34.222 -3.256 -0.308 1.00 0.00 H new ATOM 0 HE2 LYS A 235 -33.586 -0.857 1.455 1.00 0.00 H new ATOM 0 HE3 LYS A 235 -34.873 -2.018 1.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 235 -33.301 -2.880 3.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 235 -32.849 -3.692 1.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 235 -31.995 -2.311 2.148 1.00 0.00 H new ATOM 538 N HIS A 236 -30.892 -0.837 -4.934 1.00 0.00 N ATOM 539 CA HIS A 236 -30.946 -0.597 -6.373 1.00 0.00 C ATOM 540 C HIS A 236 -29.589 -0.890 -7.018 1.00 0.00 C ATOM 541 O HIS A 236 -29.305 -0.444 -8.131 1.00 0.00 O ATOM 542 CB HIS A 236 -31.388 0.846 -6.675 1.00 0.00 C ATOM 543 CG HIS A 236 -30.425 1.901 -6.217 1.00 0.00 C ATOM 544 ND1 HIS A 236 -30.412 2.402 -4.934 1.00 0.00 N ATOM 545 CD2 HIS A 236 -29.436 2.546 -6.879 1.00 0.00 C ATOM 546 CE1 HIS A 236 -29.460 3.308 -4.828 1.00 0.00 C ATOM 547 NE2 HIS A 236 -28.852 3.412 -5.992 1.00 0.00 N ATOM 0 H HIS A 236 -30.616 -0.026 -4.380 1.00 0.00 H new ATOM 0 HA HIS A 236 -31.686 -1.273 -6.801 1.00 0.00 H new ATOM 0 HB2 HIS A 236 -31.536 0.950 -7.750 1.00 0.00 H new ATOM 0 HB3 HIS A 236 -32.354 1.023 -6.201 1.00 0.00 H new ATOM 0 HD2 HIS A 236 -29.159 2.404 -7.913 1.00 0.00 H new ATOM 0 HE1 HIS A 236 -29.219 3.870 -3.938 1.00 0.00 H new ATOM 0 HE2 HIS A 236 -28.072 4.036 -6.200 1.00 0.00 H new ATOM 556 N MET A 237 -28.751 -1.632 -6.307 1.00 0.00 N ATOM 557 CA MET A 237 -27.433 -1.994 -6.807 1.00 0.00 C ATOM 558 C MET A 237 -27.230 -3.499 -6.703 1.00 0.00 C ATOM 559 O MET A 237 -27.405 -4.087 -5.635 1.00 0.00 O ATOM 560 CB MET A 237 -26.333 -1.256 -6.038 1.00 0.00 C ATOM 561 CG MET A 237 -26.088 0.161 -6.535 1.00 0.00 C ATOM 562 SD MET A 237 -25.580 0.209 -8.266 1.00 0.00 S ATOM 563 CE MET A 237 -25.632 1.972 -8.583 1.00 0.00 C ATOM 0 H MET A 237 -28.963 -1.996 -5.378 1.00 0.00 H new ATOM 0 HA MET A 237 -27.371 -1.698 -7.854 1.00 0.00 H new ATOM 0 HB2 MET A 237 -26.601 -1.220 -4.982 1.00 0.00 H new ATOM 0 HB3 MET A 237 -25.406 -1.824 -6.113 1.00 0.00 H new ATOM 0 HG2 MET A 237 -26.998 0.748 -6.410 1.00 0.00 H new ATOM 0 HG3 MET A 237 -25.319 0.630 -5.921 1.00 0.00 H new ATOM 0 HE1 MET A 237 -25.342 2.165 -9.616 1.00 0.00 H new ATOM 0 HE2 MET A 237 -26.643 2.342 -8.415 1.00 0.00 H new ATOM 0 HE3 MET A 237 -24.942 2.483 -7.911 1.00 0.00 H new ATOM 573 N SER A 238 -26.883 -4.117 -7.819 1.00 0.00 N ATOM 574 CA SER A 238 -26.662 -5.551 -7.863 1.00 0.00 C ATOM 575 C SER A 238 -25.318 -5.913 -7.237 1.00 0.00 C ATOM 576 O SER A 238 -24.416 -5.077 -7.157 1.00 0.00 O ATOM 577 CB SER A 238 -26.715 -6.030 -9.312 1.00 0.00 C ATOM 578 OG SER A 238 -27.738 -5.356 -10.029 1.00 0.00 O ATOM 0 H SER A 238 -26.748 -3.643 -8.712 1.00 0.00 H new ATOM 0 HA SER A 238 -27.446 -6.045 -7.289 1.00 0.00 H new ATOM 0 HB2 SER A 238 -25.752 -5.856 -9.793 1.00 0.00 H new ATOM 0 HB3 SER A 238 -26.894 -7.105 -9.338 1.00 0.00 H new ATOM 0 HG SER A 238 -27.754 -5.676 -10.955 1.00 0.00 H new ATOM 584 N VAL A 239 -25.196 -7.162 -6.798 1.00 0.00 N ATOM 585 CA VAL A 239 -23.967 -7.656 -6.186 1.00 0.00 C ATOM 586 C VAL A 239 -22.789 -7.479 -7.141 1.00 0.00 C ATOM 587 O VAL A 239 -21.692 -7.092 -6.728 1.00 0.00 O ATOM 588 CB VAL A 239 -24.098 -9.142 -5.789 1.00 0.00 C ATOM 589 CG1 VAL A 239 -22.809 -9.660 -5.179 1.00 0.00 C ATOM 590 CG2 VAL A 239 -25.255 -9.338 -4.821 1.00 0.00 C ATOM 0 H VAL A 239 -25.941 -7.856 -6.856 1.00 0.00 H new ATOM 0 HA VAL A 239 -23.789 -7.073 -5.282 1.00 0.00 H new ATOM 0 HB VAL A 239 -24.300 -9.713 -6.695 1.00 0.00 H new ATOM 0 HG11 VAL A 239 -22.930 -10.709 -4.909 1.00 0.00 H new ATOM 0 HG12 VAL A 239 -21.999 -9.563 -5.902 1.00 0.00 H new ATOM 0 HG13 VAL A 239 -22.570 -9.081 -4.287 1.00 0.00 H new ATOM 0 HG21 VAL A 239 -25.331 -10.392 -4.553 1.00 0.00 H new ATOM 0 HG22 VAL A 239 -25.081 -8.747 -3.922 1.00 0.00 H new ATOM 0 HG23 VAL A 239 -26.183 -9.016 -5.293 1.00 0.00 H new ATOM 600 N SER A 240 -23.028 -7.741 -8.420 1.00 0.00 N ATOM 601 CA SER A 240 -22.002 -7.592 -9.440 1.00 0.00 C ATOM 602 C SER A 240 -21.561 -6.135 -9.526 1.00 0.00 C ATOM 603 O SER A 240 -20.368 -5.833 -9.590 1.00 0.00 O ATOM 604 CB SER A 240 -22.554 -8.066 -10.781 1.00 0.00 C ATOM 605 OG SER A 240 -23.966 -8.189 -10.719 1.00 0.00 O ATOM 0 H SER A 240 -23.930 -8.059 -8.775 1.00 0.00 H new ATOM 0 HA SER A 240 -21.134 -8.197 -9.179 1.00 0.00 H new ATOM 0 HB2 SER A 240 -22.278 -7.361 -11.565 1.00 0.00 H new ATOM 0 HB3 SER A 240 -22.110 -9.026 -11.045 1.00 0.00 H new ATOM 0 HG SER A 240 -24.202 -9.074 -10.372 1.00 0.00 H new ATOM 611 N SER A 241 -22.540 -5.235 -9.503 1.00 0.00 N ATOM 612 CA SER A 241 -22.280 -3.807 -9.561 1.00 0.00 C ATOM 613 C SER A 241 -21.488 -3.365 -8.333 1.00 0.00 C ATOM 614 O SER A 241 -20.527 -2.596 -8.444 1.00 0.00 O ATOM 615 CB SER A 241 -23.602 -3.045 -9.639 1.00 0.00 C ATOM 616 OG SER A 241 -24.527 -3.719 -10.479 1.00 0.00 O ATOM 0 H SER A 241 -23.529 -5.477 -9.444 1.00 0.00 H new ATOM 0 HA SER A 241 -21.690 -3.588 -10.451 1.00 0.00 H new ATOM 0 HB2 SER A 241 -24.024 -2.937 -8.640 1.00 0.00 H new ATOM 0 HB3 SER A 241 -23.425 -2.039 -10.020 1.00 0.00 H new ATOM 0 HG SER A 241 -25.366 -3.214 -10.513 1.00 0.00 H new ATOM 622 N ILE A 242 -21.896 -3.865 -7.168 1.00 0.00 N ATOM 623 CA ILE A 242 -21.229 -3.547 -5.912 1.00 0.00 C ATOM 624 C ILE A 242 -19.779 -4.014 -5.956 1.00 0.00 C ATOM 625 O ILE A 242 -18.866 -3.267 -5.601 1.00 0.00 O ATOM 626 CB ILE A 242 -21.953 -4.194 -4.704 1.00 0.00 C ATOM 627 CG1 ILE A 242 -23.333 -3.557 -4.503 1.00 0.00 C ATOM 628 CG2 ILE A 242 -21.119 -4.064 -3.435 1.00 0.00 C ATOM 629 CD1 ILE A 242 -23.281 -2.086 -4.145 1.00 0.00 C ATOM 0 H ILE A 242 -22.691 -4.496 -7.071 1.00 0.00 H new ATOM 0 HA ILE A 242 -21.260 -2.465 -5.784 1.00 0.00 H new ATOM 0 HB ILE A 242 -22.085 -5.255 -4.917 1.00 0.00 H new ATOM 0 HG12 ILE A 242 -23.916 -3.679 -5.416 1.00 0.00 H new ATOM 0 HG13 ILE A 242 -23.860 -4.095 -3.715 1.00 0.00 H new ATOM 0 HG21 ILE A 242 -21.649 -4.526 -2.602 1.00 0.00 H new ATOM 0 HG22 ILE A 242 -20.161 -4.564 -3.577 1.00 0.00 H new ATOM 0 HG23 ILE A 242 -20.950 -3.009 -3.217 1.00 0.00 H new ATOM 0 HD11 ILE A 242 -24.295 -1.706 -4.019 1.00 0.00 H new ATOM 0 HD12 ILE A 242 -22.727 -1.957 -3.215 1.00 0.00 H new ATOM 0 HD13 ILE A 242 -22.784 -1.535 -4.943 1.00 0.00 H new ATOM 641 N LYS A 243 -19.570 -5.241 -6.426 1.00 0.00 N ATOM 642 CA LYS A 243 -18.229 -5.803 -6.523 1.00 0.00 C ATOM 643 C LYS A 243 -17.370 -4.971 -7.473 1.00 0.00 C ATOM 644 O LYS A 243 -16.180 -4.774 -7.226 1.00 0.00 O ATOM 645 CB LYS A 243 -18.283 -7.259 -6.994 1.00 0.00 C ATOM 646 CG LYS A 243 -16.922 -7.949 -7.048 1.00 0.00 C ATOM 647 CD LYS A 243 -16.392 -8.292 -5.659 1.00 0.00 C ATOM 648 CE LYS A 243 -15.537 -7.175 -5.073 1.00 0.00 C ATOM 649 NZ LYS A 243 -14.383 -6.829 -5.947 1.00 0.00 N ATOM 0 H LYS A 243 -20.312 -5.863 -6.745 1.00 0.00 H new ATOM 0 HA LYS A 243 -17.777 -5.780 -5.531 1.00 0.00 H new ATOM 0 HB2 LYS A 243 -18.937 -7.821 -6.327 1.00 0.00 H new ATOM 0 HB3 LYS A 243 -18.734 -7.292 -7.986 1.00 0.00 H new ATOM 0 HG2 LYS A 243 -17.003 -8.861 -7.639 1.00 0.00 H new ATOM 0 HG3 LYS A 243 -16.208 -7.301 -7.557 1.00 0.00 H new ATOM 0 HD2 LYS A 243 -17.231 -8.492 -4.992 1.00 0.00 H new ATOM 0 HD3 LYS A 243 -15.802 -9.207 -5.714 1.00 0.00 H new ATOM 0 HE2 LYS A 243 -16.154 -6.289 -4.922 1.00 0.00 H new ATOM 0 HE3 LYS A 243 -15.169 -7.478 -4.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 -13.508 -6.835 -5.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 -14.307 -7.527 -6.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 -14.527 -5.882 -6.353 1.00 0.00 H new ATOM 663 N GLN A 244 -17.979 -4.480 -8.549 1.00 0.00 N ATOM 664 CA GLN A 244 -17.269 -3.659 -9.525 1.00 0.00 C ATOM 665 C GLN A 244 -16.832 -2.341 -8.896 1.00 0.00 C ATOM 666 O GLN A 244 -15.684 -1.921 -9.050 1.00 0.00 O ATOM 667 CB GLN A 244 -18.143 -3.385 -10.750 1.00 0.00 C ATOM 668 CG GLN A 244 -18.089 -4.485 -11.793 1.00 0.00 C ATOM 669 CD GLN A 244 -18.160 -3.944 -13.208 1.00 0.00 C ATOM 670 OE1 GLN A 244 -17.576 -2.776 -13.433 1.00 0.00 O flip ATOM 671 NE2 GLN A 244 -18.714 -4.583 -14.100 1.00 0.00 N flip ATOM 0 H GLN A 244 -18.963 -4.637 -8.767 1.00 0.00 H new ATOM 0 HA GLN A 244 -16.385 -4.210 -9.846 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -19.176 -3.253 -10.427 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -17.829 -2.447 -11.207 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -17.167 -5.054 -11.670 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -18.915 -5.178 -11.630 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -19.153 -5.479 -13.888 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -18.735 -4.217 -15.052 1.00 0.00 H new ATOM 680 N ALA A 245 -17.753 -1.695 -8.190 1.00 0.00 N ATOM 681 CA ALA A 245 -17.458 -0.432 -7.523 1.00 0.00 C ATOM 682 C ALA A 245 -16.381 -0.643 -6.467 1.00 0.00 C ATOM 683 O ALA A 245 -15.417 0.117 -6.378 1.00 0.00 O ATOM 684 CB ALA A 245 -18.719 0.143 -6.898 1.00 0.00 C ATOM 0 H ALA A 245 -18.710 -2.025 -8.065 1.00 0.00 H new ATOM 0 HA ALA A 245 -17.088 0.281 -8.260 1.00 0.00 H new ATOM 0 HB1 ALA A 245 -18.483 1.085 -6.404 1.00 0.00 H new ATOM 0 HB2 ALA A 245 -19.463 0.317 -7.675 1.00 0.00 H new ATOM 0 HB3 ALA A 245 -19.116 -0.561 -6.166 1.00 0.00 H new ATOM 690 N VAL A 246 -16.549 -1.701 -5.681 1.00 0.00 N ATOM 691 CA VAL A 246 -15.597 -2.051 -4.638 1.00 0.00 C ATOM 692 C VAL A 246 -14.220 -2.309 -5.243 1.00 0.00 C ATOM 693 O VAL A 246 -13.201 -1.891 -4.695 1.00 0.00 O ATOM 694 CB VAL A 246 -16.071 -3.300 -3.858 1.00 0.00 C ATOM 695 CG1 VAL A 246 -14.916 -3.975 -3.134 1.00 0.00 C ATOM 696 CG2 VAL A 246 -17.170 -2.927 -2.872 1.00 0.00 C ATOM 0 H VAL A 246 -17.345 -2.336 -5.750 1.00 0.00 H new ATOM 0 HA VAL A 246 -15.530 -1.213 -3.944 1.00 0.00 H new ATOM 0 HB VAL A 246 -16.473 -4.010 -4.581 1.00 0.00 H new ATOM 0 HG11 VAL A 246 -15.284 -4.849 -2.596 1.00 0.00 H new ATOM 0 HG12 VAL A 246 -14.164 -4.286 -3.859 1.00 0.00 H new ATOM 0 HG13 VAL A 246 -14.471 -3.275 -2.427 1.00 0.00 H new ATOM 0 HG21 VAL A 246 -17.492 -3.817 -2.332 1.00 0.00 H new ATOM 0 HG22 VAL A 246 -16.789 -2.191 -2.164 1.00 0.00 H new ATOM 0 HG23 VAL A 246 -18.017 -2.505 -3.413 1.00 0.00 H new ATOM 706 N ASP A 247 -14.208 -2.973 -6.393 1.00 0.00 N ATOM 707 CA ASP A 247 -12.965 -3.293 -7.086 1.00 0.00 C ATOM 708 C ASP A 247 -12.196 -2.026 -7.435 1.00 0.00 C ATOM 709 O ASP A 247 -11.004 -1.927 -7.164 1.00 0.00 O ATOM 710 CB ASP A 247 -13.250 -4.091 -8.361 1.00 0.00 C ATOM 711 CG ASP A 247 -12.005 -4.312 -9.198 1.00 0.00 C ATOM 712 OD1 ASP A 247 -11.170 -5.157 -8.819 1.00 0.00 O ATOM 713 OD2 ASP A 247 -11.860 -3.645 -10.243 1.00 0.00 O ATOM 0 H ASP A 247 -15.049 -3.302 -6.867 1.00 0.00 H new ATOM 0 HA ASP A 247 -12.356 -3.899 -6.415 1.00 0.00 H new ATOM 0 HB2 ASP A 247 -13.680 -5.056 -8.093 1.00 0.00 H new ATOM 0 HB3 ASP A 247 -13.996 -3.564 -8.957 1.00 0.00 H new ATOM 718 N PHE A 248 -12.887 -1.051 -8.017 1.00 0.00 N ATOM 719 CA PHE A 248 -12.256 0.208 -8.397 1.00 0.00 C ATOM 720 C PHE A 248 -11.787 0.967 -7.158 1.00 0.00 C ATOM 721 O PHE A 248 -10.689 1.530 -7.138 1.00 0.00 O ATOM 722 CB PHE A 248 -13.228 1.068 -9.209 1.00 0.00 C ATOM 723 CG PHE A 248 -12.555 2.111 -10.060 1.00 0.00 C ATOM 724 CD1 PHE A 248 -12.110 3.300 -9.506 1.00 0.00 C ATOM 725 CD2 PHE A 248 -12.371 1.900 -11.417 1.00 0.00 C ATOM 726 CE1 PHE A 248 -11.493 4.258 -10.288 1.00 0.00 C ATOM 727 CE2 PHE A 248 -11.755 2.855 -12.204 1.00 0.00 C ATOM 728 CZ PHE A 248 -11.316 4.036 -11.639 1.00 0.00 C ATOM 0 H PHE A 248 -13.882 -1.108 -8.235 1.00 0.00 H new ATOM 0 HA PHE A 248 -11.387 -0.016 -9.016 1.00 0.00 H new ATOM 0 HB2 PHE A 248 -13.823 0.419 -9.851 1.00 0.00 H new ATOM 0 HB3 PHE A 248 -13.919 1.561 -8.526 1.00 0.00 H new ATOM 0 HD1 PHE A 248 -12.247 3.481 -8.450 1.00 0.00 H new ATOM 0 HD2 PHE A 248 -12.713 0.979 -11.865 1.00 0.00 H new ATOM 0 HE1 PHE A 248 -11.149 5.180 -9.842 1.00 0.00 H new ATOM 0 HE2 PHE A 248 -11.617 2.677 -13.260 1.00 0.00 H new ATOM 0 HZ PHE A 248 -10.836 4.784 -12.252 1.00 0.00 H new ATOM 738 N LEU A 249 -12.614 0.960 -6.120 1.00 0.00 N ATOM 739 CA LEU A 249 -12.289 1.644 -4.876 1.00 0.00 C ATOM 740 C LEU A 249 -11.059 1.019 -4.215 1.00 0.00 C ATOM 741 O LEU A 249 -10.239 1.725 -3.618 1.00 0.00 O ATOM 742 CB LEU A 249 -13.481 1.605 -3.918 1.00 0.00 C ATOM 743 CG LEU A 249 -14.715 2.385 -4.380 1.00 0.00 C ATOM 744 CD1 LEU A 249 -15.870 2.185 -3.411 1.00 0.00 C ATOM 745 CD2 LEU A 249 -14.388 3.863 -4.522 1.00 0.00 C ATOM 0 H LEU A 249 -13.517 0.486 -6.116 1.00 0.00 H new ATOM 0 HA LEU A 249 -12.061 2.684 -5.111 1.00 0.00 H new ATOM 0 HB2 LEU A 249 -13.766 0.565 -3.761 1.00 0.00 H new ATOM 0 HB3 LEU A 249 -13.163 1.998 -2.952 1.00 0.00 H new ATOM 0 HG LEU A 249 -15.017 2.003 -5.355 1.00 0.00 H new ATOM 0 HD11 LEU A 249 -16.737 2.747 -3.757 1.00 0.00 H new ATOM 0 HD12 LEU A 249 -16.122 1.126 -3.359 1.00 0.00 H new ATOM 0 HD13 LEU A 249 -15.580 2.538 -2.421 1.00 0.00 H new ATOM 0 HD21 LEU A 249 -15.276 4.402 -4.851 1.00 0.00 H new ATOM 0 HD22 LEU A 249 -14.060 4.257 -3.560 1.00 0.00 H new ATOM 0 HD23 LEU A 249 -13.593 3.991 -5.257 1.00 0.00 H new ATOM 757 N SER A 250 -10.941 -0.298 -4.320 1.00 0.00 N ATOM 758 CA SER A 250 -9.809 -1.020 -3.751 1.00 0.00 C ATOM 759 C SER A 250 -8.588 -0.924 -4.661 1.00 0.00 C ATOM 760 O SER A 250 -7.450 -0.875 -4.187 1.00 0.00 O ATOM 761 CB SER A 250 -10.177 -2.488 -3.513 1.00 0.00 C ATOM 762 OG SER A 250 -11.109 -2.609 -2.453 1.00 0.00 O ATOM 0 H SER A 250 -11.620 -0.892 -4.797 1.00 0.00 H new ATOM 0 HA SER A 250 -9.560 -0.560 -2.795 1.00 0.00 H new ATOM 0 HB2 SER A 250 -10.598 -2.914 -4.424 1.00 0.00 H new ATOM 0 HB3 SER A 250 -9.279 -3.059 -3.280 1.00 0.00 H new ATOM 0 HG SER A 250 -11.325 -3.555 -2.314 1.00 0.00 H new ATOM 768 N ASN A 251 -8.830 -0.901 -5.965 1.00 0.00 N ATOM 769 CA ASN A 251 -7.754 -0.802 -6.939 1.00 0.00 C ATOM 770 C ASN A 251 -7.071 0.550 -6.825 1.00 0.00 C ATOM 771 O ASN A 251 -5.848 0.627 -6.713 1.00 0.00 O ATOM 772 CB ASN A 251 -8.286 -1.003 -8.359 1.00 0.00 C ATOM 773 CG ASN A 251 -7.180 -1.267 -9.360 1.00 0.00 C ATOM 774 OD1 ASN A 251 -6.612 -0.342 -9.940 1.00 0.00 O ATOM 775 ND2 ASN A 251 -6.873 -2.538 -9.575 1.00 0.00 N ATOM 0 H ASN A 251 -9.764 -0.950 -6.372 1.00 0.00 H new ATOM 0 HA ASN A 251 -7.028 -1.588 -6.730 1.00 0.00 H new ATOM 0 HB2 ASN A 251 -8.986 -1.839 -8.367 1.00 0.00 H new ATOM 0 HB3 ASN A 251 -8.844 -0.117 -8.664 1.00 0.00 H new ATOM 0 HD21 ASN A 251 -6.141 -2.780 -10.243 1.00 0.00 H new ATOM 0 HD22 ASN A 251 -7.369 -3.274 -9.073 1.00 0.00 H new ATOM 782 N GLU A 252 -7.867 1.615 -6.837 1.00 0.00 N ATOM 783 CA GLU A 252 -7.329 2.961 -6.718 1.00 0.00 C ATOM 784 C GLU A 252 -6.704 3.136 -5.341 1.00 0.00 C ATOM 785 O GLU A 252 -5.487 3.231 -5.217 1.00 0.00 O ATOM 786 CB GLU A 252 -8.419 4.010 -6.949 1.00 0.00 C ATOM 787 CG GLU A 252 -7.891 5.318 -7.521 1.00 0.00 C ATOM 788 CD GLU A 252 -8.049 6.476 -6.561 1.00 0.00 C ATOM 789 OE1 GLU A 252 -7.236 6.592 -5.622 1.00 0.00 O ATOM 790 OE2 GLU A 252 -8.995 7.269 -6.735 1.00 0.00 O ATOM 0 H GLU A 252 -8.882 1.570 -6.928 1.00 0.00 H new ATOM 0 HA GLU A 252 -6.565 3.103 -7.482 1.00 0.00 H new ATOM 0 HB2 GLU A 252 -9.167 3.601 -7.628 1.00 0.00 H new ATOM 0 HB3 GLU A 252 -8.923 4.213 -6.004 1.00 0.00 H new ATOM 0 HG2 GLU A 252 -6.837 5.201 -7.774 1.00 0.00 H new ATOM 0 HG3 GLU A 252 -8.418 5.544 -8.448 1.00 0.00 H new ATOM 797 N GLY A 253 -7.537 3.138 -4.305 1.00 0.00 N ATOM 798 CA GLY A 253 -7.022 3.281 -2.961 1.00 0.00 C ATOM 799 C GLY A 253 -7.925 4.072 -2.039 1.00 0.00 C ATOM 800 O GLY A 253 -7.461 4.955 -1.332 1.00 0.00 O ATOM 0 H GLY A 253 -8.550 3.044 -4.373 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -6.863 2.290 -2.536 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -6.048 3.768 -3.006 1.00 0.00 H new ATOM 804 N HIS A 254 -9.211 3.755 -2.015 1.00 0.00 N ATOM 805 CA HIS A 254 -10.132 4.476 -1.141 1.00 0.00 C ATOM 806 C HIS A 254 -10.637 3.574 -0.018 1.00 0.00 C ATOM 807 O HIS A 254 -10.632 3.967 1.152 1.00 0.00 O ATOM 808 CB HIS A 254 -11.299 5.063 -1.938 1.00 0.00 C ATOM 809 CG HIS A 254 -10.891 6.178 -2.858 1.00 0.00 C ATOM 810 ND1 HIS A 254 -10.507 7.430 -2.425 1.00 0.00 N ATOM 811 CD2 HIS A 254 -10.786 6.206 -4.205 1.00 0.00 C ATOM 812 CE1 HIS A 254 -10.187 8.174 -3.468 1.00 0.00 C ATOM 813 NE2 HIS A 254 -10.348 7.455 -4.561 1.00 0.00 N ATOM 0 H HIS A 254 -9.637 3.019 -2.578 1.00 0.00 H new ATOM 0 HA HIS A 254 -9.586 5.304 -0.688 1.00 0.00 H new ATOM 0 HB2 HIS A 254 -11.765 4.270 -2.524 1.00 0.00 H new ATOM 0 HB3 HIS A 254 -12.054 5.432 -1.244 1.00 0.00 H new ATOM 0 HD1 HIS A 254 -10.475 7.734 -1.452 1.00 0.00 H new ATOM 0 HD2 HIS A 254 -11.007 5.392 -4.879 1.00 0.00 H new ATOM 0 HE1 HIS A 254 -9.850 9.199 -3.432 1.00 0.00 H new ATOM 0 HE2 HIS A 254 -10.175 7.775 -5.514 1.00 0.00 H new ATOM 822 N ILE A 255 -11.061 2.365 -0.368 1.00 0.00 N ATOM 823 CA ILE A 255 -11.545 1.411 0.623 1.00 0.00 C ATOM 824 C ILE A 255 -10.520 0.302 0.811 1.00 0.00 C ATOM 825 O ILE A 255 -9.613 0.150 -0.008 1.00 0.00 O ATOM 826 CB ILE A 255 -12.904 0.789 0.230 1.00 0.00 C ATOM 827 CG1 ILE A 255 -12.752 -0.136 -0.981 1.00 0.00 C ATOM 828 CG2 ILE A 255 -13.925 1.881 -0.057 1.00 0.00 C ATOM 829 CD1 ILE A 255 -13.976 -0.985 -1.244 1.00 0.00 C ATOM 0 H ILE A 255 -11.079 2.023 -1.329 1.00 0.00 H new ATOM 0 HA ILE A 255 -11.690 1.959 1.554 1.00 0.00 H new ATOM 0 HB ILE A 255 -13.260 0.192 1.069 1.00 0.00 H new ATOM 0 HG12 ILE A 255 -12.539 0.466 -1.865 1.00 0.00 H new ATOM 0 HG13 ILE A 255 -11.893 -0.788 -0.825 1.00 0.00 H new ATOM 0 HG21 ILE A 255 -14.877 1.426 -0.332 1.00 0.00 H new ATOM 0 HG22 ILE A 255 -14.061 2.495 0.833 1.00 0.00 H new ATOM 0 HG23 ILE A 255 -13.570 2.504 -0.878 1.00 0.00 H new ATOM 0 HD11 ILE A 255 -13.801 -1.616 -2.115 1.00 0.00 H new ATOM 0 HD12 ILE A 255 -14.177 -1.612 -0.376 1.00 0.00 H new ATOM 0 HD13 ILE A 255 -14.834 -0.339 -1.431 1.00 0.00 H new ATOM 841 N TYR A 256 -10.647 -0.463 1.883 1.00 0.00 N ATOM 842 CA TYR A 256 -9.708 -1.543 2.151 1.00 0.00 C ATOM 843 C TYR A 256 -10.312 -2.594 3.073 1.00 0.00 C ATOM 844 O TYR A 256 -11.309 -2.346 3.755 1.00 0.00 O ATOM 845 CB TYR A 256 -8.421 -0.990 2.773 1.00 0.00 C ATOM 846 CG TYR A 256 -8.629 -0.279 4.095 1.00 0.00 C ATOM 847 CD1 TYR A 256 -8.962 1.069 4.137 1.00 0.00 C ATOM 848 CD2 TYR A 256 -8.479 -0.954 5.300 1.00 0.00 C ATOM 849 CE1 TYR A 256 -9.142 1.722 5.339 1.00 0.00 C ATOM 850 CE2 TYR A 256 -8.657 -0.307 6.506 1.00 0.00 C ATOM 851 CZ TYR A 256 -8.988 1.031 6.520 1.00 0.00 C ATOM 852 OH TYR A 256 -9.161 1.678 7.721 1.00 0.00 O ATOM 0 H TYR A 256 -11.386 -0.358 2.579 1.00 0.00 H new ATOM 0 HA TYR A 256 -9.476 -2.018 1.198 1.00 0.00 H new ATOM 0 HB2 TYR A 256 -7.720 -1.811 2.921 1.00 0.00 H new ATOM 0 HB3 TYR A 256 -7.958 -0.298 2.069 1.00 0.00 H new ATOM 0 HD1 TYR A 256 -9.082 1.615 3.213 1.00 0.00 H new ATOM 0 HD2 TYR A 256 -8.219 -2.002 5.293 1.00 0.00 H new ATOM 0 HE1 TYR A 256 -9.402 2.770 5.354 1.00 0.00 H new ATOM 0 HE2 TYR A 256 -8.538 -0.846 7.434 1.00 0.00 H new ATOM 0 HH TYR A 256 -9.017 1.047 8.456 1.00 0.00 H new ATOM 862 N SER A 257 -9.689 -3.760 3.083 1.00 0.00 N ATOM 863 CA SER A 257 -10.118 -4.863 3.915 1.00 0.00 C ATOM 864 C SER A 257 -9.325 -4.861 5.215 1.00 0.00 C ATOM 865 O SER A 257 -8.103 -5.025 5.204 1.00 0.00 O ATOM 866 CB SER A 257 -9.892 -6.170 3.163 1.00 0.00 C ATOM 867 OG SER A 257 -8.670 -6.117 2.442 1.00 0.00 O ATOM 0 H SER A 257 -8.869 -3.966 2.512 1.00 0.00 H new ATOM 0 HA SER A 257 -11.177 -4.760 4.150 1.00 0.00 H new ATOM 0 HB2 SER A 257 -9.872 -7.003 3.865 1.00 0.00 H new ATOM 0 HB3 SER A 257 -10.720 -6.351 2.477 1.00 0.00 H new ATOM 0 HG SER A 257 -7.971 -6.582 2.948 1.00 0.00 H new ATOM 873 N THR A 258 -10.008 -4.651 6.328 1.00 0.00 N ATOM 874 CA THR A 258 -9.348 -4.623 7.622 1.00 0.00 C ATOM 875 C THR A 258 -8.829 -6.010 7.998 1.00 0.00 C ATOM 876 O THR A 258 -7.639 -6.288 7.868 1.00 0.00 O ATOM 877 CB THR A 258 -10.306 -4.105 8.704 1.00 0.00 C ATOM 878 OG1 THR A 258 -11.332 -3.317 8.081 1.00 0.00 O ATOM 879 CG2 THR A 258 -9.565 -3.261 9.730 1.00 0.00 C ATOM 0 H THR A 258 -11.016 -4.498 6.362 1.00 0.00 H new ATOM 0 HA THR A 258 -8.498 -3.944 7.553 1.00 0.00 H new ATOM 0 HB THR A 258 -10.747 -4.957 9.220 1.00 0.00 H new ATOM 0 HG1 THR A 258 -12.209 -3.710 8.274 1.00 0.00 H new ATOM 0 HG21 THR A 258 -10.267 -2.907 10.485 1.00 0.00 H new ATOM 0 HG22 THR A 258 -8.792 -3.864 10.207 1.00 0.00 H new ATOM 0 HG23 THR A 258 -9.104 -2.407 9.234 1.00 0.00 H new ATOM 887 N VAL A 259 -9.723 -6.880 8.454 1.00 0.00 N ATOM 888 CA VAL A 259 -9.338 -8.239 8.829 1.00 0.00 C ATOM 889 C VAL A 259 -10.025 -9.265 7.932 1.00 0.00 C ATOM 890 O VAL A 259 -9.680 -10.448 7.943 1.00 0.00 O ATOM 891 CB VAL A 259 -9.674 -8.547 10.305 1.00 0.00 C ATOM 892 CG1 VAL A 259 -8.836 -7.686 11.240 1.00 0.00 C ATOM 893 CG2 VAL A 259 -11.158 -8.346 10.577 1.00 0.00 C ATOM 0 H VAL A 259 -10.714 -6.672 8.573 1.00 0.00 H new ATOM 0 HA VAL A 259 -8.258 -8.307 8.700 1.00 0.00 H new ATOM 0 HB VAL A 259 -9.433 -9.593 10.495 1.00 0.00 H new ATOM 0 HG11 VAL A 259 -9.089 -7.919 12.274 1.00 0.00 H new ATOM 0 HG12 VAL A 259 -7.778 -7.888 11.071 1.00 0.00 H new ATOM 0 HG13 VAL A 259 -9.040 -6.633 11.045 1.00 0.00 H new ATOM 0 HG21 VAL A 259 -11.370 -8.569 11.623 1.00 0.00 H new ATOM 0 HG22 VAL A 259 -11.430 -7.312 10.364 1.00 0.00 H new ATOM 0 HG23 VAL A 259 -11.738 -9.013 9.939 1.00 0.00 H new ATOM 903 N ASP A 260 -10.981 -8.799 7.141 1.00 0.00 N ATOM 904 CA ASP A 260 -11.731 -9.666 6.241 1.00 0.00 C ATOM 905 C ASP A 260 -12.122 -8.899 4.986 1.00 0.00 C ATOM 906 O ASP A 260 -12.246 -7.675 5.024 1.00 0.00 O ATOM 907 CB ASP A 260 -12.989 -10.200 6.939 1.00 0.00 C ATOM 908 CG ASP A 260 -13.693 -11.280 6.137 1.00 0.00 C ATOM 909 OD1 ASP A 260 -14.508 -10.943 5.259 1.00 0.00 O ATOM 910 OD2 ASP A 260 -13.429 -12.476 6.382 1.00 0.00 O ATOM 0 H ASP A 260 -11.258 -7.818 7.104 1.00 0.00 H new ATOM 0 HA ASP A 260 -11.099 -10.510 5.963 1.00 0.00 H new ATOM 0 HB2 ASP A 260 -12.715 -10.599 7.916 1.00 0.00 H new ATOM 0 HB3 ASP A 260 -13.680 -9.375 7.114 1.00 0.00 H new ATOM 915 N ASP A 261 -12.314 -9.621 3.889 1.00 0.00 N ATOM 916 CA ASP A 261 -12.691 -9.021 2.612 1.00 0.00 C ATOM 917 C ASP A 261 -14.080 -8.376 2.682 1.00 0.00 C ATOM 918 O ASP A 261 -14.350 -7.396 1.994 1.00 0.00 O ATOM 919 CB ASP A 261 -12.631 -10.085 1.504 1.00 0.00 C ATOM 920 CG ASP A 261 -13.808 -10.040 0.546 1.00 0.00 C ATOM 921 OD1 ASP A 261 -13.757 -9.275 -0.437 1.00 0.00 O ATOM 922 OD2 ASP A 261 -14.789 -10.786 0.767 1.00 0.00 O ATOM 0 H ASP A 261 -12.214 -10.636 3.858 1.00 0.00 H new ATOM 0 HA ASP A 261 -11.982 -8.226 2.380 1.00 0.00 H new ATOM 0 HB2 ASP A 261 -11.709 -9.955 0.938 1.00 0.00 H new ATOM 0 HB3 ASP A 261 -12.586 -11.072 1.964 1.00 0.00 H new ATOM 927 N ASP A 262 -14.950 -8.916 3.527 1.00 0.00 N ATOM 928 CA ASP A 262 -16.307 -8.383 3.679 1.00 0.00 C ATOM 929 C ASP A 262 -16.307 -7.150 4.580 1.00 0.00 C ATOM 930 O ASP A 262 -17.165 -6.276 4.464 1.00 0.00 O ATOM 931 CB ASP A 262 -17.241 -9.460 4.248 1.00 0.00 C ATOM 932 CG ASP A 262 -18.479 -8.889 4.921 1.00 0.00 C ATOM 933 OD1 ASP A 262 -19.439 -8.522 4.211 1.00 0.00 O ATOM 934 OD2 ASP A 262 -18.500 -8.822 6.167 1.00 0.00 O ATOM 0 H ASP A 262 -14.745 -9.721 4.118 1.00 0.00 H new ATOM 0 HA ASP A 262 -16.671 -8.087 2.695 1.00 0.00 H new ATOM 0 HB2 ASP A 262 -17.549 -10.126 3.442 1.00 0.00 H new ATOM 0 HB3 ASP A 262 -16.690 -10.064 4.969 1.00 0.00 H new ATOM 939 N HIS A 263 -15.323 -7.079 5.466 1.00 0.00 N ATOM 940 CA HIS A 263 -15.205 -5.960 6.392 1.00 0.00 C ATOM 941 C HIS A 263 -14.565 -4.762 5.692 1.00 0.00 C ATOM 942 O HIS A 263 -13.364 -4.512 5.837 1.00 0.00 O ATOM 943 CB HIS A 263 -14.377 -6.371 7.614 1.00 0.00 C ATOM 944 CG HIS A 263 -14.480 -5.419 8.767 1.00 0.00 C ATOM 945 ND1 HIS A 263 -13.782 -4.236 8.830 1.00 0.00 N ATOM 946 CD2 HIS A 263 -15.199 -5.488 9.912 1.00 0.00 C ATOM 947 CE1 HIS A 263 -14.064 -3.620 9.958 1.00 0.00 C ATOM 948 NE2 HIS A 263 -14.922 -4.356 10.635 1.00 0.00 N ATOM 0 H HIS A 263 -14.593 -7.785 5.563 1.00 0.00 H new ATOM 0 HA HIS A 263 -16.202 -5.674 6.728 1.00 0.00 H new ATOM 0 HB2 HIS A 263 -14.698 -7.360 7.942 1.00 0.00 H new ATOM 0 HB3 HIS A 263 -13.331 -6.457 7.319 1.00 0.00 H new ATOM 0 HD2 HIS A 263 -15.866 -6.286 10.202 1.00 0.00 H new ATOM 0 HE1 HIS A 263 -13.660 -2.670 10.276 1.00 0.00 H new ATOM 0 HE2 HIS A 263 -15.315 -4.122 11.547 1.00 0.00 H new ATOM 957 N PHE A 264 -15.372 -4.033 4.934 1.00 0.00 N ATOM 958 CA PHE A 264 -14.897 -2.871 4.194 1.00 0.00 C ATOM 959 C PHE A 264 -14.802 -1.630 5.068 1.00 0.00 C ATOM 960 O PHE A 264 -15.711 -1.318 5.840 1.00 0.00 O ATOM 961 CB PHE A 264 -15.820 -2.567 3.015 1.00 0.00 C ATOM 962 CG PHE A 264 -15.826 -3.621 1.954 1.00 0.00 C ATOM 963 CD1 PHE A 264 -14.726 -3.801 1.134 1.00 0.00 C ATOM 964 CD2 PHE A 264 -16.935 -4.426 1.771 1.00 0.00 C ATOM 965 CE1 PHE A 264 -14.733 -4.767 0.152 1.00 0.00 C ATOM 966 CE2 PHE A 264 -16.948 -5.393 0.789 1.00 0.00 C ATOM 967 CZ PHE A 264 -15.847 -5.565 -0.023 1.00 0.00 C ATOM 0 H PHE A 264 -16.366 -4.227 4.815 1.00 0.00 H new ATOM 0 HA PHE A 264 -13.898 -3.121 3.836 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -16.836 -2.437 3.388 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -15.520 -1.619 2.568 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -13.854 -3.178 1.265 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -17.800 -4.296 2.404 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -13.868 -4.900 -0.481 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -17.820 -6.016 0.656 1.00 0.00 H new ATOM 0 HZ PHE A 264 -15.855 -6.322 -0.794 1.00 0.00 H new ATOM 977 N LYS A 265 -13.687 -0.933 4.941 1.00 0.00 N ATOM 978 CA LYS A 265 -13.457 0.301 5.669 1.00 0.00 C ATOM 979 C LYS A 265 -12.856 1.324 4.720 1.00 0.00 C ATOM 980 O LYS A 265 -12.332 0.961 3.667 1.00 0.00 O ATOM 981 CB LYS A 265 -12.529 0.081 6.866 1.00 0.00 C ATOM 982 CG LYS A 265 -13.179 -0.671 8.016 1.00 0.00 C ATOM 983 CD LYS A 265 -12.630 -0.219 9.360 1.00 0.00 C ATOM 984 CE LYS A 265 -13.209 1.124 9.776 1.00 0.00 C ATOM 985 NZ LYS A 265 -12.921 1.435 11.201 1.00 0.00 N ATOM 0 H LYS A 265 -12.917 -1.206 4.331 1.00 0.00 H new ATOM 0 HA LYS A 265 -14.409 0.663 6.057 1.00 0.00 H new ATOM 0 HB2 LYS A 265 -11.649 -0.470 6.535 1.00 0.00 H new ATOM 0 HB3 LYS A 265 -12.182 1.049 7.227 1.00 0.00 H new ATOM 0 HG2 LYS A 265 -14.257 -0.514 7.991 1.00 0.00 H new ATOM 0 HG3 LYS A 265 -13.010 -1.741 7.894 1.00 0.00 H new ATOM 0 HD2 LYS A 265 -12.861 -0.967 10.119 1.00 0.00 H new ATOM 0 HD3 LYS A 265 -11.544 -0.147 9.305 1.00 0.00 H new ATOM 0 HE2 LYS A 265 -12.796 1.909 9.143 1.00 0.00 H new ATOM 0 HE3 LYS A 265 -14.287 1.120 9.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 -13.333 2.358 11.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 -13.337 0.700 11.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 -11.892 1.465 11.349 1.00 0.00 H new ATOM 999 N SER A 266 -12.935 2.592 5.078 1.00 0.00 N ATOM 1000 CA SER A 266 -12.397 3.645 4.236 1.00 0.00 C ATOM 1001 C SER A 266 -11.627 4.661 5.063 1.00 0.00 C ATOM 1002 O SER A 266 -11.864 4.808 6.262 1.00 0.00 O ATOM 1003 CB SER A 266 -13.526 4.340 3.473 1.00 0.00 C ATOM 1004 OG SER A 266 -14.335 3.393 2.801 1.00 0.00 O ATOM 0 H SER A 266 -13.365 2.918 5.944 1.00 0.00 H new ATOM 0 HA SER A 266 -11.710 3.191 3.522 1.00 0.00 H new ATOM 0 HB2 SER A 266 -14.136 4.920 4.166 1.00 0.00 H new ATOM 0 HB3 SER A 266 -13.106 5.042 2.753 1.00 0.00 H new ATOM 0 HG SER A 266 -15.052 3.857 2.321 1.00 0.00 H new ATOM 1010 N THR A 267 -10.688 5.332 4.417 1.00 0.00 N ATOM 1011 CA THR A 267 -9.881 6.355 5.063 1.00 0.00 C ATOM 1012 C THR A 267 -9.774 7.567 4.144 1.00 0.00 C ATOM 1013 O THR A 267 -9.949 8.705 4.575 1.00 0.00 O ATOM 1014 CB THR A 267 -8.469 5.835 5.426 1.00 0.00 C ATOM 1015 OG1 THR A 267 -8.577 4.664 6.249 1.00 0.00 O ATOM 1016 CG2 THR A 267 -7.668 6.896 6.168 1.00 0.00 C ATOM 0 H THR A 267 -10.464 5.184 3.433 1.00 0.00 H new ATOM 0 HA THR A 267 -10.372 6.636 5.995 1.00 0.00 H new ATOM 0 HB THR A 267 -7.951 5.591 4.498 1.00 0.00 H new ATOM 0 HG1 THR A 267 -7.915 4.709 6.970 1.00 0.00 H new ATOM 0 HG21 THR A 267 -6.681 6.503 6.410 1.00 0.00 H new ATOM 0 HG22 THR A 267 -7.563 7.779 5.538 1.00 0.00 H new ATOM 0 HG23 THR A 267 -8.187 7.166 7.088 1.00 0.00 H new ATOM 1024 N ASP A 268 -9.505 7.314 2.870 1.00 0.00 N ATOM 1025 CA ASP A 268 -9.398 8.383 1.889 1.00 0.00 C ATOM 1026 C ASP A 268 -10.749 8.610 1.228 1.00 0.00 C ATOM 1027 O ASP A 268 -11.095 7.948 0.244 1.00 0.00 O ATOM 1028 CB ASP A 268 -8.341 8.054 0.831 1.00 0.00 C ATOM 1029 CG ASP A 268 -8.070 9.223 -0.100 1.00 0.00 C ATOM 1030 OD1 ASP A 268 -8.860 9.432 -1.042 1.00 0.00 O ATOM 1031 OD2 ASP A 268 -7.058 9.932 0.107 1.00 0.00 O ATOM 0 H ASP A 268 -9.357 6.378 2.493 1.00 0.00 H new ATOM 0 HA ASP A 268 -9.089 9.294 2.402 1.00 0.00 H new ATOM 0 HB2 ASP A 268 -7.414 7.764 1.326 1.00 0.00 H new ATOM 0 HB3 ASP A 268 -8.672 7.196 0.246 1.00 0.00 H new ATOM 1036 N ALA A 269 -11.526 9.515 1.801 1.00 0.00 N ATOM 1037 CA ALA A 269 -12.845 9.835 1.278 1.00 0.00 C ATOM 1038 C ALA A 269 -13.301 11.199 1.777 1.00 0.00 C ATOM 1039 O ALA A 269 -13.100 11.541 2.943 1.00 0.00 O ATOM 1040 CB ALA A 269 -13.852 8.761 1.669 1.00 0.00 C ATOM 0 H ALA A 269 -11.264 10.044 2.633 1.00 0.00 H new ATOM 0 HA ALA A 269 -12.783 9.868 0.190 1.00 0.00 H new ATOM 0 HB1 ALA A 269 -14.833 9.018 1.268 1.00 0.00 H new ATOM 0 HB2 ALA A 269 -13.535 7.800 1.263 1.00 0.00 H new ATOM 0 HB3 ALA A 269 -13.910 8.695 2.755 1.00 0.00 H new ATOM 1046 N GLU A 270 -13.910 11.971 0.893 1.00 0.00 N ATOM 1047 CA GLU A 270 -14.392 13.296 1.241 1.00 0.00 C ATOM 1048 C GLU A 270 -15.825 13.224 1.747 1.00 0.00 C ATOM 1049 O GLU A 270 -16.027 13.339 2.973 1.00 0.00 O ATOM 1050 CB GLU A 270 -14.305 14.223 0.030 1.00 0.00 C ATOM 1051 CG GLU A 270 -12.878 14.557 -0.373 1.00 0.00 C ATOM 1052 CD GLU A 270 -12.160 15.401 0.660 1.00 0.00 C ATOM 1053 OE1 GLU A 270 -12.490 16.599 0.786 1.00 0.00 O ATOM 1054 OE2 GLU A 270 -11.269 14.872 1.359 1.00 0.00 O ATOM 1055 OXT GLU A 270 -16.739 13.032 0.923 1.00 0.00 O ATOM 0 H GLU A 270 -14.083 11.701 -0.075 1.00 0.00 H new ATOM 0 HA GLU A 270 -13.764 13.697 2.036 1.00 0.00 H new ATOM 0 HB2 GLU A 270 -14.813 13.755 -0.813 1.00 0.00 H new ATOM 0 HB3 GLU A 270 -14.838 15.148 0.250 1.00 0.00 H new ATOM 0 HG2 GLU A 270 -12.323 13.632 -0.529 1.00 0.00 H new ATOM 0 HG3 GLU A 270 -12.889 15.087 -1.325 1.00 0.00 H new TER 1062 GLU A 270 ATOM 1063 N GLY B 1 31.145 5.010 -11.146 1.00 8.94 N ATOM 1064 CA GLY B 1 32.436 5.192 -10.436 1.00 8.40 C ATOM 1065 C GLY B 1 32.945 3.896 -9.843 1.00 7.55 C ATOM 1066 O GLY B 1 32.273 2.871 -9.923 1.00 7.60 O ATOM 0 H1 GLY B 1 31.195 5.464 -12.080 1.00 8.94 H new ATOM 0 H2 GLY B 1 30.954 3.995 -11.265 1.00 8.94 H new ATOM 0 H3 GLY B 1 30.380 5.443 -10.591 1.00 8.94 H new ATOM 0 HA2 GLY B 1 33.178 5.590 -11.129 1.00 8.40 H new ATOM 0 HA3 GLY B 1 32.313 5.930 -9.643 1.00 8.40 H new ATOM 1072 N SER B 2 34.133 3.935 -9.250 1.00 7.04 N ATOM 1073 CA SER B 2 34.722 2.751 -8.641 1.00 6.48 C ATOM 1074 C SER B 2 34.097 2.484 -7.275 1.00 5.66 C ATOM 1075 O SER B 2 33.952 1.337 -6.859 1.00 5.79 O ATOM 1076 CB SER B 2 36.233 2.932 -8.509 1.00 6.90 C ATOM 1077 OG SER B 2 36.620 4.226 -8.940 1.00 7.32 O ATOM 0 H SER B 2 34.707 4.775 -9.179 1.00 7.04 H new ATOM 0 HA SER B 2 34.523 1.891 -9.281 1.00 6.48 H new ATOM 0 HB2 SER B 2 36.533 2.783 -7.472 1.00 6.90 H new ATOM 0 HB3 SER B 2 36.748 2.176 -9.102 1.00 6.90 H new ATOM 0 HG SER B 2 37.591 4.325 -8.847 1.00 7.32 H new ATOM 1083 N LYS B 3 33.716 3.553 -6.588 1.00 5.14 N ATOM 1084 CA LYS B 3 33.099 3.433 -5.275 1.00 4.55 C ATOM 1085 C LYS B 3 31.661 2.947 -5.418 1.00 3.66 C ATOM 1086 O LYS B 3 31.096 3.000 -6.513 1.00 3.27 O ATOM 1087 CB LYS B 3 33.144 4.775 -4.535 1.00 4.95 C ATOM 1088 CG LYS B 3 32.424 5.903 -5.257 1.00 5.83 C ATOM 1089 CD LYS B 3 32.721 7.248 -4.616 1.00 6.50 C ATOM 1090 CE LYS B 3 31.807 8.341 -5.148 1.00 7.34 C ATOM 1091 NZ LYS B 3 30.414 8.191 -4.653 1.00 8.03 N ATOM 0 H LYS B 3 33.824 4.512 -6.918 1.00 5.14 H new ATOM 0 HA LYS B 3 33.658 2.704 -4.689 1.00 4.55 H new ATOM 0 HB2 LYS B 3 32.701 4.649 -3.547 1.00 4.95 H new ATOM 0 HB3 LYS B 3 34.185 5.060 -4.384 1.00 4.95 H new ATOM 0 HG2 LYS B 3 32.729 5.921 -6.303 1.00 5.83 H new ATOM 0 HG3 LYS B 3 31.350 5.720 -5.242 1.00 5.83 H new ATOM 0 HD2 LYS B 3 32.603 7.170 -3.535 1.00 6.50 H new ATOM 0 HD3 LYS B 3 33.760 7.519 -4.804 1.00 6.50 H new ATOM 0 HE2 LYS B 3 32.195 9.315 -4.850 1.00 7.34 H new ATOM 0 HE3 LYS B 3 31.809 8.317 -6.238 1.00 7.34 H new ATOM 0 HZ1 LYS B 3 29.875 9.054 -4.867 1.00 8.03 H new ATOM 0 HZ2 LYS B 3 29.965 7.378 -5.121 1.00 8.03 H new ATOM 0 HZ3 LYS B 3 30.426 8.036 -3.625 1.00 8.03 H new ATOM 1105 N VAL B 4 31.091 2.452 -4.324 1.00 3.57 N ATOM 1106 CA VAL B 4 29.717 1.958 -4.318 1.00 2.95 C ATOM 1107 C VAL B 4 28.758 2.993 -4.912 1.00 2.17 C ATOM 1108 O VAL B 4 28.567 4.080 -4.361 1.00 2.29 O ATOM 1109 CB VAL B 4 29.267 1.568 -2.887 1.00 3.19 C ATOM 1110 CG1 VAL B 4 29.632 2.652 -1.883 1.00 3.17 C ATOM 1111 CG2 VAL B 4 27.772 1.274 -2.847 1.00 3.40 C ATOM 0 H VAL B 4 31.563 2.382 -3.423 1.00 3.57 H new ATOM 0 HA VAL B 4 29.689 1.064 -4.941 1.00 2.95 H new ATOM 0 HB VAL B 4 29.799 0.659 -2.607 1.00 3.19 H new ATOM 0 HG11 VAL B 4 29.304 2.351 -0.888 1.00 3.17 H new ATOM 0 HG12 VAL B 4 30.712 2.797 -1.881 1.00 3.17 H new ATOM 0 HG13 VAL B 4 29.141 3.585 -2.160 1.00 3.17 H new ATOM 0 HG21 VAL B 4 27.482 1.003 -1.832 1.00 3.40 H new ATOM 0 HG22 VAL B 4 27.219 2.160 -3.158 1.00 3.40 H new ATOM 0 HG23 VAL B 4 27.545 0.449 -3.522 1.00 3.40 H new ATOM 1121 N GLU B 5 28.180 2.658 -6.056 1.00 1.82 N ATOM 1122 CA GLU B 5 27.260 3.557 -6.733 1.00 1.42 C ATOM 1123 C GLU B 5 25.927 3.627 -5.997 1.00 1.13 C ATOM 1124 O GLU B 5 25.361 2.601 -5.599 1.00 1.27 O ATOM 1125 CB GLU B 5 27.051 3.124 -8.186 1.00 1.82 C ATOM 1126 CG GLU B 5 26.843 4.292 -9.135 1.00 2.28 C ATOM 1127 CD GLU B 5 27.918 5.355 -9.002 1.00 2.98 C ATOM 1128 OE1 GLU B 5 28.946 5.262 -9.705 1.00 3.52 O ATOM 1129 OE2 GLU B 5 27.738 6.289 -8.193 1.00 3.44 O ATOM 0 H GLU B 5 28.332 1.770 -6.534 1.00 1.82 H new ATOM 0 HA GLU B 5 27.701 4.554 -6.732 1.00 1.42 H new ATOM 0 HB2 GLU B 5 27.916 2.547 -8.514 1.00 1.82 H new ATOM 0 HB3 GLU B 5 26.187 2.462 -8.240 1.00 1.82 H new ATOM 0 HG2 GLU B 5 26.828 3.923 -10.161 1.00 2.28 H new ATOM 0 HG3 GLU B 5 25.868 4.741 -8.943 1.00 2.28 H new ATOM 1136 N ASP B 6 25.440 4.844 -5.813 1.00 0.96 N ATOM 1137 CA ASP B 6 24.185 5.078 -5.116 1.00 0.89 C ATOM 1138 C ASP B 6 23.110 5.549 -6.088 1.00 0.78 C ATOM 1139 O ASP B 6 23.187 6.661 -6.616 1.00 0.84 O ATOM 1140 CB ASP B 6 24.389 6.118 -4.015 1.00 1.13 C ATOM 1141 CG ASP B 6 23.898 5.637 -2.666 1.00 1.65 C ATOM 1142 OD1 ASP B 6 24.654 4.912 -1.977 1.00 2.18 O ATOM 1143 OD2 ASP B 6 22.761 5.973 -2.290 1.00 2.32 O ATOM 0 H ASP B 6 25.900 5.693 -6.141 1.00 0.96 H new ATOM 0 HA ASP B 6 23.856 4.141 -4.667 1.00 0.89 H new ATOM 0 HB2 ASP B 6 25.448 6.366 -3.945 1.00 1.13 H new ATOM 0 HB3 ASP B 6 23.864 7.035 -4.284 1.00 1.13 H new ATOM 1148 N PRO B 7 22.111 4.692 -6.360 1.00 0.75 N ATOM 1149 CA PRO B 7 21.006 5.014 -7.273 1.00 0.68 C ATOM 1150 C PRO B 7 20.210 6.236 -6.827 1.00 0.65 C ATOM 1151 O PRO B 7 20.214 6.605 -5.653 1.00 0.80 O ATOM 1152 CB PRO B 7 20.123 3.763 -7.229 1.00 0.84 C ATOM 1153 CG PRO B 7 21.025 2.677 -6.760 1.00 0.99 C ATOM 1154 CD PRO B 7 21.986 3.334 -5.814 1.00 0.91 C ATOM 0 HA PRO B 7 21.372 5.262 -8.269 1.00 0.68 H new ATOM 0 HB2 PRO B 7 19.280 3.897 -6.551 1.00 0.84 H new ATOM 0 HB3 PRO B 7 19.709 3.536 -8.211 1.00 0.84 H new ATOM 0 HG2 PRO B 7 20.462 1.887 -6.262 1.00 0.99 H new ATOM 0 HG3 PRO B 7 21.551 2.215 -7.596 1.00 0.99 H new ATOM 0 HD2 PRO B 7 21.605 3.343 -4.793 1.00 0.91 H new ATOM 0 HD3 PRO B 7 22.946 2.818 -5.791 1.00 0.91 H new ATOM 1162 N LYS B 8 19.527 6.856 -7.776 1.00 0.64 N ATOM 1163 CA LYS B 8 18.725 8.038 -7.502 1.00 0.78 C ATOM 1164 C LYS B 8 17.250 7.661 -7.437 1.00 0.64 C ATOM 1165 O LYS B 8 16.405 8.456 -7.025 1.00 0.78 O ATOM 1166 CB LYS B 8 18.953 9.101 -8.584 1.00 1.04 C ATOM 1167 CG LYS B 8 20.320 9.775 -8.519 1.00 1.99 C ATOM 1168 CD LYS B 8 21.435 8.858 -9.007 1.00 2.65 C ATOM 1169 CE LYS B 8 22.803 9.513 -8.889 1.00 3.31 C ATOM 1170 NZ LYS B 8 22.950 10.674 -9.807 1.00 3.93 N ATOM 0 H LYS B 8 19.512 6.557 -8.751 1.00 0.64 H new ATOM 0 HA LYS B 8 19.028 8.453 -6.540 1.00 0.78 H new ATOM 0 HB2 LYS B 8 18.835 8.638 -9.564 1.00 1.04 H new ATOM 0 HB3 LYS B 8 18.179 9.864 -8.497 1.00 1.04 H new ATOM 0 HG2 LYS B 8 20.306 10.682 -9.124 1.00 1.99 H new ATOM 0 HG3 LYS B 8 20.525 10.080 -7.493 1.00 1.99 H new ATOM 0 HD2 LYS B 8 21.424 7.934 -8.429 1.00 2.65 H new ATOM 0 HD3 LYS B 8 21.252 8.586 -10.046 1.00 2.65 H new ATOM 0 HE2 LYS B 8 22.959 9.842 -7.862 1.00 3.31 H new ATOM 0 HE3 LYS B 8 23.577 8.777 -9.109 1.00 3.31 H new ATOM 0 HZ1 LYS B 8 23.928 11.026 -9.768 1.00 3.93 H new ATOM 0 HZ2 LYS B 8 22.727 10.378 -10.779 1.00 3.93 H new ATOM 0 HZ3 LYS B 8 22.298 11.430 -9.517 1.00 3.93 H new ATOM 1184 N ASP B 9 16.960 6.435 -7.846 1.00 0.46 N ATOM 1185 CA ASP B 9 15.600 5.914 -7.853 1.00 0.41 C ATOM 1186 C ASP B 9 15.649 4.403 -7.668 1.00 0.33 C ATOM 1187 O ASP B 9 16.698 3.851 -7.326 1.00 0.36 O ATOM 1188 CB ASP B 9 14.891 6.263 -9.171 1.00 0.51 C ATOM 1189 CG ASP B 9 13.399 6.498 -9.000 1.00 1.60 C ATOM 1190 OD1 ASP B 9 12.661 5.540 -8.694 1.00 2.44 O ATOM 1191 OD2 ASP B 9 12.954 7.650 -9.185 1.00 2.29 O ATOM 0 H ASP B 9 17.660 5.773 -8.182 1.00 0.46 H new ATOM 0 HA ASP B 9 15.037 6.368 -7.037 1.00 0.41 H new ATOM 0 HB2 ASP B 9 15.347 7.157 -9.597 1.00 0.51 H new ATOM 0 HB3 ASP B 9 15.046 5.455 -9.885 1.00 0.51 H new ATOM 1196 N PHE B 10 14.533 3.738 -7.897 1.00 0.42 N ATOM 1197 CA PHE B 10 14.466 2.292 -7.760 1.00 0.42 C ATOM 1198 C PHE B 10 14.978 1.610 -9.026 1.00 0.46 C ATOM 1199 O PHE B 10 15.011 2.221 -10.094 1.00 0.52 O ATOM 1200 CB PHE B 10 13.030 1.854 -7.479 1.00 0.42 C ATOM 1201 CG PHE B 10 12.653 1.896 -6.026 1.00 0.37 C ATOM 1202 CD1 PHE B 10 12.214 3.074 -5.443 1.00 0.78 C ATOM 1203 CD2 PHE B 10 12.726 0.753 -5.248 1.00 1.33 C ATOM 1204 CE1 PHE B 10 11.856 3.109 -4.111 1.00 0.60 C ATOM 1205 CE2 PHE B 10 12.371 0.783 -3.915 1.00 1.63 C ATOM 1206 CZ PHE B 10 11.934 1.963 -3.346 1.00 0.89 C ATOM 0 H PHE B 10 13.656 4.176 -8.180 1.00 0.42 H new ATOM 0 HA PHE B 10 15.098 1.997 -6.923 1.00 0.42 H new ATOM 0 HB2 PHE B 10 12.349 2.495 -8.039 1.00 0.42 H new ATOM 0 HB3 PHE B 10 12.891 0.839 -7.851 1.00 0.42 H new ATOM 0 HD1 PHE B 10 12.151 3.974 -6.037 1.00 0.78 H new ATOM 0 HD2 PHE B 10 13.065 -0.173 -5.690 1.00 1.33 H new ATOM 0 HE1 PHE B 10 11.515 4.033 -3.667 1.00 0.60 H new ATOM 0 HE2 PHE B 10 12.435 -0.115 -3.318 1.00 1.63 H new ATOM 0 HZ PHE B 10 11.654 1.989 -2.303 1.00 0.89 H new ATOM 1216 N PRO B 11 15.403 0.339 -8.921 1.00 0.49 N ATOM 1217 CA PRO B 11 15.899 -0.420 -10.070 1.00 0.57 C ATOM 1218 C PRO B 11 14.820 -0.614 -11.133 1.00 0.54 C ATOM 1219 O PRO B 11 13.627 -0.671 -10.820 1.00 0.50 O ATOM 1220 CB PRO B 11 16.314 -1.768 -9.472 1.00 0.65 C ATOM 1221 CG PRO B 11 15.593 -1.857 -8.171 1.00 0.61 C ATOM 1222 CD PRO B 11 15.454 -0.446 -7.677 1.00 0.51 C ATOM 0 HA PRO B 11 16.716 0.095 -10.575 1.00 0.57 H new ATOM 0 HB2 PRO B 11 16.040 -2.592 -10.131 1.00 0.65 H new ATOM 0 HB3 PRO B 11 17.393 -1.820 -9.328 1.00 0.65 H new ATOM 0 HG2 PRO B 11 14.616 -2.324 -8.297 1.00 0.61 H new ATOM 0 HG3 PRO B 11 16.148 -2.467 -7.458 1.00 0.61 H new ATOM 0 HD2 PRO B 11 14.551 -0.315 -7.080 1.00 0.51 H new ATOM 0 HD3 PRO B 11 16.296 -0.154 -7.050 1.00 0.51 H new ATOM 1230 N SER B 12 15.249 -0.735 -12.382 1.00 0.65 N ATOM 1231 CA SER B 12 14.341 -0.905 -13.509 1.00 0.65 C ATOM 1232 C SER B 12 13.464 -2.151 -13.360 1.00 0.62 C ATOM 1233 O SER B 12 12.360 -2.208 -13.900 1.00 0.61 O ATOM 1234 CB SER B 12 15.155 -0.987 -14.800 1.00 0.76 C ATOM 1235 OG SER B 12 16.393 -0.296 -14.668 1.00 1.24 O ATOM 0 H SER B 12 16.235 -0.718 -12.643 1.00 0.65 H new ATOM 0 HA SER B 12 13.673 -0.044 -13.539 1.00 0.65 H new ATOM 0 HB2 SER B 12 15.342 -2.031 -15.050 1.00 0.76 H new ATOM 0 HB3 SER B 12 14.582 -0.560 -15.623 1.00 0.76 H new ATOM 0 HG SER B 12 16.897 -0.364 -15.506 1.00 1.24 H new ATOM 1241 N GLU B 13 13.953 -3.136 -12.613 1.00 0.65 N ATOM 1242 CA GLU B 13 13.222 -4.384 -12.401 1.00 0.65 C ATOM 1243 C GLU B 13 12.013 -4.184 -11.487 1.00 0.61 C ATOM 1244 O GLU B 13 11.083 -4.990 -11.491 1.00 0.77 O ATOM 1245 CB GLU B 13 14.145 -5.446 -11.794 1.00 0.74 C ATOM 1246 CG GLU B 13 15.294 -5.863 -12.701 1.00 1.07 C ATOM 1247 CD GLU B 13 16.449 -4.879 -12.697 1.00 1.37 C ATOM 1248 OE1 GLU B 13 16.536 -4.050 -11.768 1.00 1.85 O ATOM 1249 OE2 GLU B 13 17.280 -4.939 -13.626 1.00 2.06 O ATOM 0 H GLU B 13 14.857 -3.095 -12.142 1.00 0.65 H new ATOM 0 HA GLU B 13 12.865 -4.718 -13.375 1.00 0.65 H new ATOM 0 HB2 GLU B 13 14.555 -5.064 -10.859 1.00 0.74 H new ATOM 0 HB3 GLU B 13 13.553 -6.327 -11.546 1.00 0.74 H new ATOM 0 HG2 GLU B 13 15.658 -6.841 -12.388 1.00 1.07 H new ATOM 0 HG3 GLU B 13 14.922 -5.972 -13.720 1.00 1.07 H new ATOM 1256 N LEU B 14 12.027 -3.113 -10.704 1.00 0.55 N ATOM 1257 CA LEU B 14 10.929 -2.837 -9.784 1.00 0.54 C ATOM 1258 C LEU B 14 10.102 -1.643 -10.241 1.00 0.49 C ATOM 1259 O LEU B 14 8.935 -1.513 -9.872 1.00 0.53 O ATOM 1260 CB LEU B 14 11.466 -2.578 -8.378 1.00 0.61 C ATOM 1261 CG LEU B 14 12.141 -3.774 -7.707 1.00 0.70 C ATOM 1262 CD1 LEU B 14 12.656 -3.384 -6.336 1.00 1.36 C ATOM 1263 CD2 LEU B 14 11.177 -4.946 -7.598 1.00 1.39 C ATOM 0 H LEU B 14 12.780 -2.425 -10.686 1.00 0.55 H new ATOM 0 HA LEU B 14 10.284 -3.716 -9.772 1.00 0.54 H new ATOM 0 HB2 LEU B 14 12.182 -1.757 -8.426 1.00 0.61 H new ATOM 0 HB3 LEU B 14 10.641 -2.246 -7.747 1.00 0.61 H new ATOM 0 HG LEU B 14 12.985 -4.083 -8.324 1.00 0.70 H new ATOM 0 HD11 LEU B 14 13.135 -4.245 -5.869 1.00 1.36 H new ATOM 0 HD12 LEU B 14 13.381 -2.576 -6.436 1.00 1.36 H new ATOM 0 HD13 LEU B 14 11.824 -3.051 -5.716 1.00 1.36 H new ATOM 0 HD21 LEU B 14 11.678 -5.786 -7.117 1.00 1.39 H new ATOM 0 HD22 LEU B 14 10.312 -4.652 -7.004 1.00 1.39 H new ATOM 0 HD23 LEU B 14 10.849 -5.241 -8.595 1.00 1.39 H new ATOM 1275 N LEU B 15 10.701 -0.781 -11.058 1.00 0.48 N ATOM 1276 CA LEU B 15 10.022 0.413 -11.560 1.00 0.49 C ATOM 1277 C LEU B 15 8.768 0.060 -12.356 1.00 0.56 C ATOM 1278 O LEU B 15 7.870 0.888 -12.514 1.00 0.70 O ATOM 1279 CB LEU B 15 10.967 1.237 -12.437 1.00 0.53 C ATOM 1280 CG LEU B 15 12.032 2.036 -11.681 1.00 0.51 C ATOM 1281 CD1 LEU B 15 12.928 2.781 -12.657 1.00 0.66 C ATOM 1282 CD2 LEU B 15 11.383 3.011 -10.709 1.00 0.56 C ATOM 0 H LEU B 15 11.660 -0.887 -11.389 1.00 0.48 H new ATOM 0 HA LEU B 15 9.721 1.001 -10.693 1.00 0.49 H new ATOM 0 HB2 LEU B 15 11.467 0.565 -13.134 1.00 0.53 H new ATOM 0 HB3 LEU B 15 10.372 1.929 -13.033 1.00 0.53 H new ATOM 0 HG LEU B 15 12.643 1.337 -11.110 1.00 0.51 H new ATOM 0 HD11 LEU B 15 13.680 3.344 -12.104 1.00 0.66 H new ATOM 0 HD12 LEU B 15 13.422 2.067 -13.316 1.00 0.66 H new ATOM 0 HD13 LEU B 15 12.326 3.467 -13.252 1.00 0.66 H new ATOM 0 HD21 LEU B 15 12.157 3.569 -10.182 1.00 0.56 H new ATOM 0 HD22 LEU B 15 10.747 3.704 -11.259 1.00 0.56 H new ATOM 0 HD23 LEU B 15 10.779 2.459 -9.989 1.00 0.56 H new ATOM 1294 N SER B 16 8.707 -1.170 -12.837 1.00 0.57 N ATOM 1295 CA SER B 16 7.578 -1.641 -13.621 1.00 0.67 C ATOM 1296 C SER B 16 6.314 -1.785 -12.773 1.00 0.67 C ATOM 1297 O SER B 16 5.199 -1.776 -13.298 1.00 0.90 O ATOM 1298 CB SER B 16 7.942 -2.983 -14.251 1.00 0.75 C ATOM 1299 OG SER B 16 9.220 -3.410 -13.803 1.00 1.42 O ATOM 0 H SER B 16 9.437 -1.869 -12.696 1.00 0.57 H new ATOM 0 HA SER B 16 7.364 -0.904 -14.395 1.00 0.67 H new ATOM 0 HB2 SER B 16 7.191 -3.729 -13.992 1.00 0.75 H new ATOM 0 HB3 SER B 16 7.941 -2.894 -15.337 1.00 0.75 H new ATOM 0 HG SER B 16 9.439 -4.272 -14.214 1.00 1.42 H new ATOM 1305 N PHE B 17 6.484 -1.904 -11.461 1.00 0.58 N ATOM 1306 CA PHE B 17 5.346 -2.067 -10.560 1.00 0.63 C ATOM 1307 C PHE B 17 5.235 -0.893 -9.594 1.00 0.58 C ATOM 1308 O PHE B 17 4.479 -0.946 -8.622 1.00 0.74 O ATOM 1309 CB PHE B 17 5.478 -3.374 -9.769 1.00 0.77 C ATOM 1310 CG PHE B 17 5.930 -4.544 -10.601 1.00 0.58 C ATOM 1311 CD1 PHE B 17 5.087 -5.109 -11.545 1.00 0.50 C ATOM 1312 CD2 PHE B 17 7.201 -5.075 -10.441 1.00 0.67 C ATOM 1313 CE1 PHE B 17 5.502 -6.179 -12.312 1.00 0.49 C ATOM 1314 CE2 PHE B 17 7.621 -6.146 -11.205 1.00 0.58 C ATOM 1315 CZ PHE B 17 6.770 -6.699 -12.142 1.00 0.46 C ATOM 0 H PHE B 17 7.393 -1.891 -10.998 1.00 0.58 H new ATOM 0 HA PHE B 17 4.442 -2.101 -11.168 1.00 0.63 H new ATOM 0 HB2 PHE B 17 6.186 -3.225 -8.954 1.00 0.77 H new ATOM 0 HB3 PHE B 17 4.516 -3.612 -9.316 1.00 0.77 H new ATOM 0 HD1 PHE B 17 4.094 -4.707 -11.682 1.00 0.50 H new ATOM 0 HD2 PHE B 17 7.870 -4.646 -9.710 1.00 0.67 H new ATOM 0 HE1 PHE B 17 4.835 -6.609 -13.045 1.00 0.49 H new ATOM 0 HE2 PHE B 17 8.613 -6.551 -11.070 1.00 0.58 H new ATOM 0 HZ PHE B 17 7.096 -7.537 -12.741 1.00 0.46 H new ATOM 1325 N LEU B 18 5.969 0.171 -9.874 1.00 0.48 N ATOM 1326 CA LEU B 18 5.962 1.343 -9.007 1.00 0.50 C ATOM 1327 C LEU B 18 5.117 2.468 -9.586 1.00 0.53 C ATOM 1328 O LEU B 18 4.886 2.532 -10.795 1.00 0.76 O ATOM 1329 CB LEU B 18 7.387 1.834 -8.765 1.00 0.49 C ATOM 1330 CG LEU B 18 8.238 0.924 -7.880 1.00 0.66 C ATOM 1331 CD1 LEU B 18 9.633 1.498 -7.727 1.00 1.27 C ATOM 1332 CD2 LEU B 18 7.582 0.739 -6.519 1.00 1.18 C ATOM 0 H LEU B 18 6.575 0.250 -10.690 1.00 0.48 H new ATOM 0 HA LEU B 18 5.517 1.044 -8.058 1.00 0.50 H new ATOM 0 HB2 LEU B 18 7.885 1.949 -9.728 1.00 0.49 H new ATOM 0 HB3 LEU B 18 7.343 2.823 -8.309 1.00 0.49 H new ATOM 0 HG LEU B 18 8.316 -0.053 -8.357 1.00 0.66 H new ATOM 0 HD11 LEU B 18 10.230 0.841 -7.094 1.00 1.27 H new ATOM 0 HD12 LEU B 18 10.102 1.581 -8.708 1.00 1.27 H new ATOM 0 HD13 LEU B 18 9.572 2.485 -7.269 1.00 1.27 H new ATOM 0 HD21 LEU B 18 8.202 0.088 -5.902 1.00 1.18 H new ATOM 0 HD22 LEU B 18 7.476 1.708 -6.031 1.00 1.18 H new ATOM 0 HD23 LEU B 18 6.598 0.288 -6.648 1.00 1.18 H new ATOM 1344 N SER B 19 4.670 3.357 -8.709 1.00 0.56 N ATOM 1345 CA SER B 19 3.845 4.489 -9.103 1.00 0.60 C ATOM 1346 C SER B 19 4.655 5.525 -9.878 1.00 0.68 C ATOM 1347 O SER B 19 4.099 6.278 -10.679 1.00 1.40 O ATOM 1348 CB SER B 19 3.226 5.138 -7.862 1.00 0.76 C ATOM 1349 OG SER B 19 4.231 5.576 -6.957 1.00 1.58 O ATOM 0 H SER B 19 4.868 3.314 -7.709 1.00 0.56 H new ATOM 0 HA SER B 19 3.055 4.119 -9.757 1.00 0.60 H new ATOM 0 HB2 SER B 19 2.608 5.985 -8.161 1.00 0.76 H new ATOM 0 HB3 SER B 19 2.570 4.424 -7.364 1.00 0.76 H new ATOM 0 HG SER B 19 4.299 6.553 -6.992 1.00 1.58 H new ATOM 1355 N HIS B 20 5.964 5.565 -9.611 1.00 0.64 N ATOM 1356 CA HIS B 20 6.895 6.508 -10.253 1.00 0.65 C ATOM 1357 C HIS B 20 6.735 7.913 -9.677 1.00 0.71 C ATOM 1358 O HIS B 20 7.718 8.613 -9.442 1.00 1.24 O ATOM 1359 CB HIS B 20 6.718 6.552 -11.779 1.00 0.73 C ATOM 1360 CG HIS B 20 7.328 5.391 -12.502 1.00 0.72 C ATOM 1361 ND1 HIS B 20 8.689 5.214 -12.632 1.00 0.67 N ATOM 1362 CD2 HIS B 20 6.752 4.353 -13.151 1.00 0.91 C ATOM 1363 CE1 HIS B 20 8.922 4.122 -13.335 1.00 0.72 C ATOM 1364 NE2 HIS B 20 7.765 3.583 -13.662 1.00 0.88 N ATOM 0 H HIS B 20 6.413 4.942 -8.940 1.00 0.64 H new ATOM 0 HA HIS B 20 7.900 6.144 -10.041 1.00 0.65 H new ATOM 0 HB2 HIS B 20 5.653 6.590 -12.009 1.00 0.73 H new ATOM 0 HB3 HIS B 20 7.159 7.474 -12.158 1.00 0.73 H new ATOM 0 HD2 HIS B 20 5.693 4.166 -13.248 1.00 0.91 H new ATOM 0 HE1 HIS B 20 9.896 3.736 -13.598 1.00 0.72 H new ATOM 0 HE2 HIS B 20 7.643 2.730 -14.208 1.00 0.88 H new ATOM 1373 N ALA B 21 5.493 8.318 -9.462 1.00 0.70 N ATOM 1374 CA ALA B 21 5.192 9.630 -8.914 1.00 0.74 C ATOM 1375 C ALA B 21 4.847 9.542 -7.434 1.00 0.73 C ATOM 1376 O ALA B 21 4.587 8.456 -6.906 1.00 0.98 O ATOM 1377 CB ALA B 21 4.045 10.267 -9.684 1.00 0.83 C ATOM 0 H ALA B 21 4.670 7.750 -9.661 1.00 0.70 H new ATOM 0 HA ALA B 21 6.081 10.253 -9.016 1.00 0.74 H new ATOM 0 HB1 ALA B 21 3.827 11.250 -9.266 1.00 0.83 H new ATOM 0 HB2 ALA B 21 4.325 10.373 -10.732 1.00 0.83 H new ATOM 0 HB3 ALA B 21 3.160 9.636 -9.607 1.00 0.83 H new ATOM 1383 N VAL B 22 4.855 10.691 -6.777 1.00 0.72 N ATOM 1384 CA VAL B 22 4.542 10.784 -5.361 1.00 0.78 C ATOM 1385 C VAL B 22 3.332 11.690 -5.155 1.00 0.74 C ATOM 1386 O VAL B 22 2.384 11.339 -4.453 1.00 0.83 O ATOM 1387 CB VAL B 22 5.740 11.348 -4.560 1.00 0.99 C ATOM 1388 CG1 VAL B 22 5.389 11.496 -3.089 1.00 1.14 C ATOM 1389 CG2 VAL B 22 6.969 10.465 -4.727 1.00 1.16 C ATOM 0 H VAL B 22 5.079 11.586 -7.212 1.00 0.72 H new ATOM 0 HA VAL B 22 4.321 9.780 -5.000 1.00 0.78 H new ATOM 0 HB VAL B 22 5.971 12.336 -4.958 1.00 0.99 H new ATOM 0 HG11 VAL B 22 6.248 11.894 -2.548 1.00 1.14 H new ATOM 0 HG12 VAL B 22 4.545 12.178 -2.983 1.00 1.14 H new ATOM 0 HG13 VAL B 22 5.122 10.522 -2.679 1.00 1.14 H new ATOM 0 HG21 VAL B 22 7.797 10.882 -4.155 1.00 1.16 H new ATOM 0 HG22 VAL B 22 6.747 9.461 -4.365 1.00 1.16 H new ATOM 0 HG23 VAL B 22 7.243 10.419 -5.781 1.00 1.16 H new ATOM 1399 N PHE B 23 3.365 12.851 -5.793 1.00 0.79 N ATOM 1400 CA PHE B 23 2.283 13.817 -5.685 1.00 0.84 C ATOM 1401 C PHE B 23 1.259 13.584 -6.792 1.00 0.90 C ATOM 1402 O PHE B 23 1.259 14.271 -7.817 1.00 1.43 O ATOM 1403 CB PHE B 23 2.837 15.244 -5.758 1.00 0.96 C ATOM 1404 CG PHE B 23 3.995 15.489 -4.829 1.00 1.14 C ATOM 1405 CD1 PHE B 23 3.779 15.818 -3.501 1.00 1.29 C ATOM 1406 CD2 PHE B 23 5.300 15.393 -5.289 1.00 2.06 C ATOM 1407 CE1 PHE B 23 4.843 16.047 -2.647 1.00 1.49 C ATOM 1408 CE2 PHE B 23 6.366 15.619 -4.440 1.00 2.41 C ATOM 1409 CZ PHE B 23 6.137 15.947 -3.118 1.00 1.85 C ATOM 0 H PHE B 23 4.134 13.147 -6.394 1.00 0.79 H new ATOM 0 HA PHE B 23 1.789 13.687 -4.722 1.00 0.84 H new ATOM 0 HB2 PHE B 23 3.153 15.450 -6.781 1.00 0.96 H new ATOM 0 HB3 PHE B 23 2.038 15.947 -5.523 1.00 0.96 H new ATOM 0 HD1 PHE B 23 2.769 15.897 -3.128 1.00 1.29 H new ATOM 0 HD2 PHE B 23 5.485 15.139 -6.322 1.00 2.06 H new ATOM 0 HE1 PHE B 23 4.662 16.304 -1.614 1.00 1.49 H new ATOM 0 HE2 PHE B 23 7.378 15.539 -4.810 1.00 2.41 H new ATOM 0 HZ PHE B 23 6.969 16.125 -2.453 1.00 1.85 H new ATOM 1419 N SER B 24 0.402 12.595 -6.587 1.00 0.72 N ATOM 1420 CA SER B 24 -0.622 12.251 -7.561 1.00 0.75 C ATOM 1421 C SER B 24 -2.010 12.301 -6.930 1.00 0.71 C ATOM 1422 O SER B 24 -2.153 12.257 -5.701 1.00 0.80 O ATOM 1423 CB SER B 24 -0.352 10.851 -8.131 1.00 0.80 C ATOM 1424 OG SER B 24 -1.320 10.489 -9.104 1.00 1.50 O ATOM 0 H SER B 24 0.396 12.013 -5.749 1.00 0.72 H new ATOM 0 HA SER B 24 -0.588 12.981 -8.370 1.00 0.75 H new ATOM 0 HB2 SER B 24 0.642 10.825 -8.578 1.00 0.80 H new ATOM 0 HB3 SER B 24 -0.357 10.121 -7.322 1.00 0.80 H new ATOM 0 HG SER B 24 -1.119 9.594 -9.448 1.00 1.50 H new ATOM 1430 N ASN B 25 -3.033 12.392 -7.774 1.00 0.75 N ATOM 1431 CA ASN B 25 -4.410 12.432 -7.304 1.00 0.77 C ATOM 1432 C ASN B 25 -4.873 11.024 -6.962 1.00 0.72 C ATOM 1433 O ASN B 25 -5.894 10.833 -6.306 1.00 1.24 O ATOM 1434 CB ASN B 25 -5.333 13.047 -8.358 1.00 0.97 C ATOM 1435 CG ASN B 25 -6.638 13.558 -7.767 1.00 1.64 C ATOM 1436 OD1 ASN B 25 -6.716 14.692 -7.290 1.00 2.39 O ATOM 1437 ND2 ASN B 25 -7.674 12.732 -7.800 1.00 2.29 N ATOM 0 H ASN B 25 -2.932 12.439 -8.788 1.00 0.75 H new ATOM 0 HA ASN B 25 -4.454 13.057 -6.412 1.00 0.77 H new ATOM 0 HB2 ASN B 25 -4.816 13.869 -8.853 1.00 0.97 H new ATOM 0 HB3 ASN B 25 -5.552 12.302 -9.123 1.00 0.97 H new ATOM 0 HD21 ASN B 25 -8.574 13.028 -7.422 1.00 2.29 H new ATOM 0 HD22 ASN B 25 -7.571 11.801 -8.203 1.00 2.29 H new ATOM 1444 N ARG B 26 -4.102 10.040 -7.400 1.00 0.92 N ATOM 1445 CA ARG B 26 -4.416 8.648 -7.127 1.00 0.91 C ATOM 1446 C ARG B 26 -3.923 8.273 -5.733 1.00 0.76 C ATOM 1447 O ARG B 26 -2.817 8.647 -5.337 1.00 0.90 O ATOM 1448 CB ARG B 26 -3.775 7.740 -8.181 1.00 1.08 C ATOM 1449 CG ARG B 26 -4.221 6.290 -8.090 1.00 1.58 C ATOM 1450 CD ARG B 26 -3.079 5.383 -7.665 1.00 2.12 C ATOM 1451 NE ARG B 26 -3.533 4.019 -7.417 1.00 2.63 N ATOM 1452 CZ ARG B 26 -3.234 2.988 -8.203 1.00 3.06 C ATOM 1453 NH1 ARG B 26 -2.453 3.159 -9.261 1.00 3.46 N ATOM 1454 NH2 ARG B 26 -3.708 1.783 -7.933 1.00 3.65 N ATOM 0 H ARG B 26 -3.253 10.182 -7.947 1.00 0.92 H new ATOM 0 HA ARG B 26 -5.497 8.513 -7.170 1.00 0.91 H new ATOM 0 HB2 ARG B 26 -4.015 8.123 -9.173 1.00 1.08 H new ATOM 0 HB3 ARG B 26 -2.691 7.785 -8.076 1.00 1.08 H new ATOM 0 HG2 ARG B 26 -5.040 6.204 -7.376 1.00 1.58 H new ATOM 0 HG3 ARG B 26 -4.605 5.965 -9.057 1.00 1.58 H new ATOM 0 HD2 ARG B 26 -2.313 5.376 -8.440 1.00 2.12 H new ATOM 0 HD3 ARG B 26 -2.615 5.781 -6.763 1.00 2.12 H new ATOM 0 HE ARG B 26 -4.112 3.846 -6.595 1.00 2.63 H new ATOM 0 HH11 ARG B 26 -2.079 4.084 -9.475 1.00 3.46 H new ATOM 0 HH12 ARG B 26 -2.226 2.366 -9.861 1.00 3.46 H new ATOM 0 HH21 ARG B 26 -4.306 1.641 -7.119 1.00 3.65 H new ATOM 0 HH22 ARG B 26 -3.476 0.996 -8.539 1.00 3.65 H new ATOM 1468 N THR B 27 -4.748 7.559 -4.991 1.00 0.62 N ATOM 1469 CA THR B 27 -4.400 7.144 -3.642 1.00 0.52 C ATOM 1470 C THR B 27 -3.618 5.833 -3.667 1.00 0.50 C ATOM 1471 O THR B 27 -3.610 5.136 -4.675 1.00 0.70 O ATOM 1472 CB THR B 27 -5.669 6.972 -2.795 1.00 0.59 C ATOM 1473 OG1 THR B 27 -6.715 7.797 -3.329 1.00 0.73 O ATOM 1474 CG2 THR B 27 -5.404 7.347 -1.347 1.00 0.78 C ATOM 0 H THR B 27 -5.670 7.252 -5.301 1.00 0.62 H new ATOM 0 HA THR B 27 -3.774 7.918 -3.198 1.00 0.52 H new ATOM 0 HB THR B 27 -5.974 5.926 -2.828 1.00 0.59 H new ATOM 0 HG1 THR B 27 -7.149 7.333 -4.075 1.00 0.73 H new ATOM 0 HG21 THR B 27 -6.316 7.218 -0.765 1.00 0.78 H new ATOM 0 HG22 THR B 27 -4.621 6.705 -0.942 1.00 0.78 H new ATOM 0 HG23 THR B 27 -5.084 8.388 -1.293 1.00 0.78 H new ATOM 1482 N LEU B 28 -2.949 5.502 -2.569 1.00 0.50 N ATOM 1483 CA LEU B 28 -2.181 4.266 -2.504 1.00 0.55 C ATOM 1484 C LEU B 28 -2.236 3.656 -1.110 1.00 0.49 C ATOM 1485 O LEU B 28 -2.804 4.236 -0.182 1.00 0.64 O ATOM 1486 CB LEU B 28 -0.726 4.506 -2.917 1.00 0.77 C ATOM 1487 CG LEU B 28 -0.453 4.414 -4.421 1.00 0.63 C ATOM 1488 CD1 LEU B 28 1.004 4.724 -4.720 1.00 1.28 C ATOM 1489 CD2 LEU B 28 -0.822 3.037 -4.949 1.00 1.33 C ATOM 0 H LEU B 28 -2.923 6.066 -1.720 1.00 0.50 H new ATOM 0 HA LEU B 28 -2.631 3.562 -3.204 1.00 0.55 H new ATOM 0 HB2 LEU B 28 -0.424 5.494 -2.569 1.00 0.77 H new ATOM 0 HB3 LEU B 28 -0.095 3.780 -2.404 1.00 0.77 H new ATOM 0 HG LEU B 28 -1.074 5.154 -4.926 1.00 0.63 H new ATOM 0 HD11 LEU B 28 1.178 4.653 -5.794 1.00 1.28 H new ATOM 0 HD12 LEU B 28 1.239 5.733 -4.380 1.00 1.28 H new ATOM 0 HD13 LEU B 28 1.642 4.009 -4.201 1.00 1.28 H new ATOM 0 HD21 LEU B 28 -0.621 2.992 -6.019 1.00 1.33 H new ATOM 0 HD22 LEU B 28 -0.229 2.280 -4.436 1.00 1.33 H new ATOM 0 HD23 LEU B 28 -1.881 2.851 -4.771 1.00 1.33 H new ATOM 1501 N ALA B 29 -1.644 2.476 -0.976 1.00 0.47 N ATOM 1502 CA ALA B 29 -1.612 1.764 0.295 1.00 0.45 C ATOM 1503 C ALA B 29 -0.262 1.083 0.491 1.00 0.45 C ATOM 1504 O ALA B 29 0.247 1.000 1.608 1.00 0.62 O ATOM 1505 CB ALA B 29 -2.738 0.742 0.359 1.00 0.56 C ATOM 0 H ALA B 29 -1.176 1.988 -1.740 1.00 0.47 H new ATOM 0 HA ALA B 29 -1.754 2.486 1.099 1.00 0.45 H new ATOM 0 HB1 ALA B 29 -2.700 0.219 1.314 1.00 0.56 H new ATOM 0 HB2 ALA B 29 -3.697 1.251 0.261 1.00 0.56 H new ATOM 0 HB3 ALA B 29 -2.624 0.024 -0.453 1.00 0.56 H new ATOM 1511 N CYS B 30 0.309 0.601 -0.603 1.00 0.40 N ATOM 1512 CA CYS B 30 1.602 -0.066 -0.559 1.00 0.41 C ATOM 1513 C CYS B 30 2.704 0.913 -0.937 1.00 0.37 C ATOM 1514 O CYS B 30 2.571 1.657 -1.912 1.00 0.42 O ATOM 1515 CB CYS B 30 1.613 -1.264 -1.509 1.00 0.55 C ATOM 1516 SG CYS B 30 3.039 -2.352 -1.305 1.00 0.75 S ATOM 0 H CYS B 30 -0.104 0.660 -1.534 1.00 0.40 H new ATOM 0 HA CYS B 30 1.779 -0.424 0.455 1.00 0.41 H new ATOM 0 HB2 CYS B 30 0.702 -1.843 -1.357 1.00 0.55 H new ATOM 0 HB3 CYS B 30 1.591 -0.900 -2.536 1.00 0.55 H new ATOM 0 HG CYS B 30 3.196 -3.068 -2.379 1.00 0.75 H new ATOM 1522 N PHE B 31 3.780 0.922 -0.163 1.00 0.35 N ATOM 1523 CA PHE B 31 4.896 1.822 -0.419 1.00 0.40 C ATOM 1524 C PHE B 31 6.222 1.096 -0.238 1.00 0.37 C ATOM 1525 O PHE B 31 6.312 0.126 0.519 1.00 0.42 O ATOM 1526 CB PHE B 31 4.833 3.034 0.516 1.00 0.51 C ATOM 1527 CG PHE B 31 3.569 3.837 0.381 1.00 0.50 C ATOM 1528 CD1 PHE B 31 3.409 4.731 -0.663 1.00 1.12 C ATOM 1529 CD2 PHE B 31 2.538 3.692 1.297 1.00 1.15 C ATOM 1530 CE1 PHE B 31 2.246 5.464 -0.792 1.00 1.04 C ATOM 1531 CE2 PHE B 31 1.372 4.424 1.170 1.00 1.26 C ATOM 1532 CZ PHE B 31 1.227 5.311 0.125 1.00 0.60 C ATOM 0 H PHE B 31 3.904 0.316 0.648 1.00 0.35 H new ATOM 0 HA PHE B 31 4.824 2.168 -1.450 1.00 0.40 H new ATOM 0 HB2 PHE B 31 4.927 2.692 1.547 1.00 0.51 H new ATOM 0 HB3 PHE B 31 5.687 3.681 0.316 1.00 0.51 H new ATOM 0 HD1 PHE B 31 4.202 4.857 -1.385 1.00 1.12 H new ATOM 0 HD2 PHE B 31 2.647 3.000 2.119 1.00 1.15 H new ATOM 0 HE1 PHE B 31 2.134 6.158 -1.612 1.00 1.04 H new ATOM 0 HE2 PHE B 31 0.576 4.301 1.889 1.00 1.26 H new ATOM 0 HZ PHE B 31 0.318 5.885 0.024 1.00 0.60 H new ATOM 1542 N ALA B 32 7.245 1.564 -0.937 1.00 0.41 N ATOM 1543 CA ALA B 32 8.566 0.965 -0.857 1.00 0.45 C ATOM 1544 C ALA B 32 9.628 2.037 -0.652 1.00 0.43 C ATOM 1545 O ALA B 32 9.583 3.096 -1.282 1.00 0.47 O ATOM 1546 CB ALA B 32 8.855 0.157 -2.112 1.00 0.54 C ATOM 0 H ALA B 32 7.183 2.362 -1.569 1.00 0.41 H new ATOM 0 HA ALA B 32 8.591 0.293 0.001 1.00 0.45 H new ATOM 0 HB1 ALA B 32 9.848 -0.286 -2.039 1.00 0.54 H new ATOM 0 HB2 ALA B 32 8.112 -0.633 -2.215 1.00 0.54 H new ATOM 0 HB3 ALA B 32 8.813 0.811 -2.983 1.00 0.54 H new ATOM 1552 N ILE B 33 10.573 1.766 0.237 1.00 0.44 N ATOM 1553 CA ILE B 33 11.640 2.712 0.530 1.00 0.45 C ATOM 1554 C ILE B 33 13.015 2.108 0.251 1.00 0.46 C ATOM 1555 O ILE B 33 13.409 1.116 0.870 1.00 0.79 O ATOM 1556 CB ILE B 33 11.589 3.178 2.001 1.00 0.50 C ATOM 1557 CG1 ILE B 33 10.271 3.899 2.290 1.00 0.56 C ATOM 1558 CG2 ILE B 33 12.771 4.086 2.317 1.00 0.61 C ATOM 1559 CD1 ILE B 33 10.074 4.245 3.751 1.00 1.04 C ATOM 0 H ILE B 33 10.622 0.897 0.769 1.00 0.44 H new ATOM 0 HA ILE B 33 11.485 3.569 -0.126 1.00 0.45 H new ATOM 0 HB ILE B 33 11.650 2.298 2.641 1.00 0.50 H new ATOM 0 HG12 ILE B 33 10.231 4.815 1.700 1.00 0.56 H new ATOM 0 HG13 ILE B 33 9.444 3.271 1.960 1.00 0.56 H new ATOM 0 HG21 ILE B 33 12.717 4.404 3.358 1.00 0.61 H new ATOM 0 HG22 ILE B 33 13.701 3.543 2.151 1.00 0.61 H new ATOM 0 HG23 ILE B 33 12.741 4.961 1.668 1.00 0.61 H new ATOM 0 HD11 ILE B 33 9.119 4.754 3.879 1.00 1.04 H new ATOM 0 HD12 ILE B 33 10.081 3.331 4.345 1.00 1.04 H new ATOM 0 HD13 ILE B 33 10.881 4.899 4.082 1.00 1.04 H new ATOM 1571 N TYR B 34 13.738 2.710 -0.680 1.00 0.31 N ATOM 1572 CA TYR B 34 15.076 2.255 -1.027 1.00 0.32 C ATOM 1573 C TYR B 34 16.086 2.975 -0.140 1.00 0.32 C ATOM 1574 O TYR B 34 16.259 4.191 -0.251 1.00 0.37 O ATOM 1575 CB TYR B 34 15.364 2.529 -2.509 1.00 0.36 C ATOM 1576 CG TYR B 34 16.655 1.925 -3.012 1.00 0.35 C ATOM 1577 CD1 TYR B 34 16.711 0.605 -3.437 1.00 1.42 C ATOM 1578 CD2 TYR B 34 17.815 2.683 -3.073 1.00 1.05 C ATOM 1579 CE1 TYR B 34 17.889 0.056 -3.904 1.00 1.46 C ATOM 1580 CE2 TYR B 34 18.995 2.144 -3.538 1.00 1.02 C ATOM 1581 CZ TYR B 34 19.029 0.831 -3.955 1.00 0.43 C ATOM 1582 OH TYR B 34 20.213 0.290 -4.419 1.00 0.50 O ATOM 0 H TYR B 34 13.419 3.520 -1.212 1.00 0.31 H new ATOM 0 HA TYR B 34 15.153 1.180 -0.864 1.00 0.32 H new ATOM 0 HB2 TYR B 34 14.538 2.141 -3.106 1.00 0.36 H new ATOM 0 HB3 TYR B 34 15.394 3.607 -2.668 1.00 0.36 H new ATOM 0 HD1 TYR B 34 15.819 -0.003 -3.402 1.00 1.42 H new ATOM 0 HD2 TYR B 34 17.793 3.713 -2.750 1.00 1.05 H new ATOM 0 HE1 TYR B 34 17.918 -0.974 -4.227 1.00 1.46 H new ATOM 0 HE2 TYR B 34 19.889 2.748 -3.575 1.00 1.02 H new ATOM 0 HH TYR B 34 20.970 0.763 -4.014 1.00 0.50 H new ATOM 1592 N THR B 35 16.730 2.230 0.750 1.00 0.35 N ATOM 1593 CA THR B 35 17.703 2.807 1.673 1.00 0.40 C ATOM 1594 C THR B 35 18.729 1.769 2.118 1.00 0.31 C ATOM 1595 O THR B 35 18.818 0.685 1.546 1.00 0.36 O ATOM 1596 CB THR B 35 17.002 3.373 2.924 1.00 0.55 C ATOM 1597 OG1 THR B 35 15.814 2.624 3.200 1.00 0.95 O ATOM 1598 CG2 THR B 35 16.651 4.838 2.745 1.00 0.34 C ATOM 0 H THR B 35 16.597 1.224 0.853 1.00 0.35 H new ATOM 0 HA THR B 35 18.212 3.610 1.139 1.00 0.40 H new ATOM 0 HB THR B 35 17.693 3.287 3.763 1.00 0.55 H new ATOM 0 HG1 THR B 35 15.375 2.988 3.997 1.00 0.95 H new ATOM 0 HG21 THR B 35 16.158 5.207 3.645 1.00 0.34 H new ATOM 0 HG22 THR B 35 17.561 5.411 2.569 1.00 0.34 H new ATOM 0 HG23 THR B 35 15.981 4.950 1.892 1.00 0.34 H new ATOM 1606 N THR B 36 19.517 2.112 3.130 1.00 0.32 N ATOM 1607 CA THR B 36 20.514 1.203 3.662 1.00 0.33 C ATOM 1608 C THR B 36 19.838 0.149 4.537 1.00 0.28 C ATOM 1609 O THR B 36 18.720 0.363 5.012 1.00 0.29 O ATOM 1610 CB THR B 36 21.571 1.973 4.473 1.00 0.43 C ATOM 1611 OG1 THR B 36 21.011 3.200 4.959 1.00 0.73 O ATOM 1612 CG2 THR B 36 22.793 2.271 3.619 1.00 0.66 C ATOM 0 H THR B 36 19.481 3.018 3.597 1.00 0.32 H new ATOM 0 HA THR B 36 21.016 0.707 2.831 1.00 0.33 H new ATOM 0 HB THR B 36 21.879 1.353 5.315 1.00 0.43 H new ATOM 0 HG1 THR B 36 21.687 3.686 5.476 1.00 0.73 H new ATOM 0 HG21 THR B 36 23.527 2.816 4.212 1.00 0.66 H new ATOM 0 HG22 THR B 36 23.230 1.335 3.270 1.00 0.66 H new ATOM 0 HG23 THR B 36 22.499 2.876 2.761 1.00 0.66 H new ATOM 1620 N LYS B 37 20.507 -0.979 4.759 1.00 0.33 N ATOM 1621 CA LYS B 37 19.932 -2.056 5.561 1.00 0.38 C ATOM 1622 C LYS B 37 19.683 -1.617 7.002 1.00 0.36 C ATOM 1623 O LYS B 37 18.761 -2.106 7.649 1.00 0.40 O ATOM 1624 CB LYS B 37 20.815 -3.309 5.520 1.00 0.50 C ATOM 1625 CG LYS B 37 22.276 -3.064 5.850 1.00 0.63 C ATOM 1626 CD LYS B 37 23.093 -4.339 5.704 1.00 0.91 C ATOM 1627 CE LYS B 37 24.543 -4.127 6.113 1.00 1.37 C ATOM 1628 NZ LYS B 37 24.685 -3.904 7.575 1.00 1.92 N ATOM 0 H LYS B 37 21.441 -1.171 4.398 1.00 0.33 H new ATOM 0 HA LYS B 37 18.967 -2.305 5.120 1.00 0.38 H new ATOM 0 HB2 LYS B 37 20.416 -4.042 6.221 1.00 0.50 H new ATOM 0 HB3 LYS B 37 20.750 -3.751 4.526 1.00 0.50 H new ATOM 0 HG2 LYS B 37 22.677 -2.294 5.190 1.00 0.63 H new ATOM 0 HG3 LYS B 37 22.363 -2.687 6.869 1.00 0.63 H new ATOM 0 HD2 LYS B 37 22.653 -5.126 6.317 1.00 0.91 H new ATOM 0 HD3 LYS B 37 23.053 -4.681 4.670 1.00 0.91 H new ATOM 0 HE2 LYS B 37 25.132 -4.996 5.820 1.00 1.37 H new ATOM 0 HE3 LYS B 37 24.949 -3.271 5.575 1.00 1.37 H new ATOM 0 HZ1 LYS B 37 25.595 -4.289 7.898 1.00 1.92 H new ATOM 0 HZ2 LYS B 37 24.650 -2.884 7.776 1.00 1.92 H new ATOM 0 HZ3 LYS B 37 23.909 -4.382 8.076 1.00 1.92 H new ATOM 1642 N GLU B 38 20.498 -0.693 7.497 1.00 0.36 N ATOM 1643 CA GLU B 38 20.334 -0.190 8.857 1.00 0.40 C ATOM 1644 C GLU B 38 19.214 0.842 8.906 1.00 0.38 C ATOM 1645 O GLU B 38 18.407 0.860 9.833 1.00 0.51 O ATOM 1646 CB GLU B 38 21.637 0.427 9.371 1.00 0.46 C ATOM 1647 CG GLU B 38 22.552 -0.568 10.063 1.00 1.24 C ATOM 1648 CD GLU B 38 22.991 -1.691 9.148 1.00 1.81 C ATOM 1649 OE1 GLU B 38 23.809 -1.439 8.241 1.00 2.37 O ATOM 1650 OE2 GLU B 38 22.521 -2.831 9.326 1.00 2.44 O ATOM 0 H GLU B 38 21.274 -0.279 6.982 1.00 0.36 H new ATOM 0 HA GLU B 38 20.073 -1.030 9.501 1.00 0.40 H new ATOM 0 HB2 GLU B 38 22.171 0.877 8.534 1.00 0.46 H new ATOM 0 HB3 GLU B 38 21.398 1.232 10.066 1.00 0.46 H new ATOM 0 HG2 GLU B 38 23.432 -0.046 10.439 1.00 1.24 H new ATOM 0 HG3 GLU B 38 22.038 -0.989 10.927 1.00 1.24 H new ATOM 1657 N LYS B 39 19.163 1.684 7.881 1.00 0.31 N ATOM 1658 CA LYS B 39 18.150 2.728 7.786 1.00 0.33 C ATOM 1659 C LYS B 39 16.756 2.117 7.718 1.00 0.30 C ATOM 1660 O LYS B 39 15.840 2.536 8.431 1.00 0.34 O ATOM 1661 CB LYS B 39 18.407 3.585 6.546 1.00 0.38 C ATOM 1662 CG LYS B 39 18.039 5.047 6.717 1.00 1.10 C ATOM 1663 CD LYS B 39 16.643 5.337 6.193 1.00 1.24 C ATOM 1664 CE LYS B 39 16.372 6.830 6.129 1.00 1.66 C ATOM 1665 NZ LYS B 39 17.430 7.562 5.375 1.00 2.36 N ATOM 0 H LYS B 39 19.817 1.663 7.098 1.00 0.31 H new ATOM 0 HA LYS B 39 18.209 3.355 8.676 1.00 0.33 H new ATOM 0 HB2 LYS B 39 19.462 3.515 6.282 1.00 0.38 H new ATOM 0 HB3 LYS B 39 17.841 3.174 5.710 1.00 0.38 H new ATOM 0 HG2 LYS B 39 18.096 5.316 7.772 1.00 1.10 H new ATOM 0 HG3 LYS B 39 18.763 5.669 6.190 1.00 1.10 H new ATOM 0 HD2 LYS B 39 16.528 4.902 5.200 1.00 1.24 H new ATOM 0 HD3 LYS B 39 15.905 4.859 6.837 1.00 1.24 H new ATOM 0 HE2 LYS B 39 15.405 7.002 5.655 1.00 1.66 H new ATOM 0 HE3 LYS B 39 16.307 7.230 7.141 1.00 1.66 H new ATOM 0 HZ1 LYS B 39 17.146 8.555 5.254 1.00 2.36 H new ATOM 0 HZ2 LYS B 39 18.325 7.519 5.903 1.00 2.36 H new ATOM 0 HZ3 LYS B 39 17.558 7.123 4.441 1.00 2.36 H new ATOM 1679 N ALA B 40 16.609 1.114 6.866 1.00 0.27 N ATOM 1680 CA ALA B 40 15.336 0.435 6.698 1.00 0.29 C ATOM 1681 C ALA B 40 15.004 -0.414 7.922 1.00 0.28 C ATOM 1682 O ALA B 40 13.842 -0.717 8.177 1.00 0.35 O ATOM 1683 CB ALA B 40 15.356 -0.415 5.439 1.00 0.35 C ATOM 0 H ALA B 40 17.360 0.752 6.278 1.00 0.27 H new ATOM 0 HA ALA B 40 14.555 1.188 6.595 1.00 0.29 H new ATOM 0 HB1 ALA B 40 14.396 -0.919 5.325 1.00 0.35 H new ATOM 0 HB2 ALA B 40 15.537 0.222 4.573 1.00 0.35 H new ATOM 0 HB3 ALA B 40 16.149 -1.159 5.515 1.00 0.35 H new ATOM 1689 N ALA B 41 16.030 -0.798 8.678 1.00 0.32 N ATOM 1690 CA ALA B 41 15.833 -1.596 9.882 1.00 0.34 C ATOM 1691 C ALA B 41 15.187 -0.750 10.971 1.00 0.33 C ATOM 1692 O ALA B 41 14.373 -1.239 11.756 1.00 0.40 O ATOM 1693 CB ALA B 41 17.154 -2.173 10.368 1.00 0.41 C ATOM 0 H ALA B 41 17.004 -0.569 8.477 1.00 0.32 H new ATOM 0 HA ALA B 41 15.168 -2.426 9.643 1.00 0.34 H new ATOM 0 HB1 ALA B 41 16.984 -2.765 11.267 1.00 0.41 H new ATOM 0 HB2 ALA B 41 17.581 -2.808 9.592 1.00 0.41 H new ATOM 0 HB3 ALA B 41 17.845 -1.361 10.594 1.00 0.41 H new ATOM 1699 N LEU B 42 15.552 0.527 11.007 1.00 0.33 N ATOM 1700 CA LEU B 42 14.997 1.452 11.984 1.00 0.37 C ATOM 1701 C LEU B 42 13.545 1.755 11.640 1.00 0.35 C ATOM 1702 O LEU B 42 12.660 1.685 12.494 1.00 0.48 O ATOM 1703 CB LEU B 42 15.807 2.752 12.015 1.00 0.46 C ATOM 1704 CG LEU B 42 17.266 2.609 12.453 1.00 1.00 C ATOM 1705 CD1 LEU B 42 17.991 3.943 12.330 1.00 1.73 C ATOM 1706 CD2 LEU B 42 17.344 2.089 13.882 1.00 1.53 C ATOM 0 H LEU B 42 16.231 0.944 10.370 1.00 0.33 H new ATOM 0 HA LEU B 42 15.046 0.989 12.970 1.00 0.37 H new ATOM 0 HB2 LEU B 42 15.787 3.196 11.020 1.00 0.46 H new ATOM 0 HB3 LEU B 42 15.311 3.453 12.687 1.00 0.46 H new ATOM 0 HG LEU B 42 17.755 1.889 11.797 1.00 1.00 H new ATOM 0 HD11 LEU B 42 19.028 3.824 12.645 1.00 1.73 H new ATOM 0 HD12 LEU B 42 17.963 4.278 11.293 1.00 1.73 H new ATOM 0 HD13 LEU B 42 17.502 4.683 12.963 1.00 1.73 H new ATOM 0 HD21 LEU B 42 18.389 1.993 14.178 1.00 1.53 H new ATOM 0 HD22 LEU B 42 16.840 2.787 14.551 1.00 1.53 H new ATOM 0 HD23 LEU B 42 16.859 1.115 13.942 1.00 1.53 H new ATOM 1718 N LEU B 43 13.308 2.068 10.370 1.00 0.36 N ATOM 1719 CA LEU B 43 11.967 2.380 9.888 1.00 0.38 C ATOM 1720 C LEU B 43 11.061 1.158 9.980 1.00 0.36 C ATOM 1721 O LEU B 43 9.841 1.289 10.066 1.00 0.45 O ATOM 1722 CB LEU B 43 12.025 2.886 8.445 1.00 0.47 C ATOM 1723 CG LEU B 43 12.673 4.259 8.260 1.00 0.55 C ATOM 1724 CD1 LEU B 43 12.803 4.591 6.783 1.00 1.07 C ATOM 1725 CD2 LEU B 43 11.861 5.331 8.974 1.00 0.76 C ATOM 0 H LEU B 43 14.032 2.112 9.653 1.00 0.36 H new ATOM 0 HA LEU B 43 11.552 3.165 10.520 1.00 0.38 H new ATOM 0 HB2 LEU B 43 12.573 2.160 7.844 1.00 0.47 H new ATOM 0 HB3 LEU B 43 11.010 2.925 8.050 1.00 0.47 H new ATOM 0 HG LEU B 43 13.671 4.231 8.698 1.00 0.55 H new ATOM 0 HD11 LEU B 43 13.266 5.571 6.670 1.00 1.07 H new ATOM 0 HD12 LEU B 43 13.422 3.839 6.294 1.00 1.07 H new ATOM 0 HD13 LEU B 43 11.814 4.602 6.324 1.00 1.07 H new ATOM 0 HD21 LEU B 43 12.336 6.302 8.832 1.00 0.76 H new ATOM 0 HD22 LEU B 43 10.852 5.357 8.563 1.00 0.76 H new ATOM 0 HD23 LEU B 43 11.813 5.102 10.039 1.00 0.76 H new ATOM 1737 N TYR B 44 11.676 -0.023 9.970 1.00 0.41 N ATOM 1738 CA TYR B 44 10.953 -1.288 10.060 1.00 0.45 C ATOM 1739 C TYR B 44 10.026 -1.303 11.273 1.00 0.43 C ATOM 1740 O TYR B 44 8.849 -1.639 11.164 1.00 0.45 O ATOM 1741 CB TYR B 44 11.952 -2.447 10.155 1.00 0.56 C ATOM 1742 CG TYR B 44 11.415 -3.776 9.678 1.00 0.50 C ATOM 1743 CD1 TYR B 44 10.541 -4.517 10.460 1.00 1.13 C ATOM 1744 CD2 TYR B 44 11.791 -4.293 8.445 1.00 1.29 C ATOM 1745 CE1 TYR B 44 10.057 -5.736 10.030 1.00 1.14 C ATOM 1746 CE2 TYR B 44 11.309 -5.511 8.007 1.00 1.28 C ATOM 1747 CZ TYR B 44 10.442 -6.227 8.803 1.00 0.47 C ATOM 1748 OH TYR B 44 9.964 -7.438 8.371 1.00 0.50 O ATOM 0 H TYR B 44 12.688 -0.129 9.899 1.00 0.41 H new ATOM 0 HA TYR B 44 10.344 -1.402 9.163 1.00 0.45 H new ATOM 0 HB2 TYR B 44 12.837 -2.196 9.571 1.00 0.56 H new ATOM 0 HB3 TYR B 44 12.273 -2.550 11.192 1.00 0.56 H new ATOM 0 HD1 TYR B 44 10.234 -4.133 11.422 1.00 1.13 H new ATOM 0 HD2 TYR B 44 12.471 -3.734 7.819 1.00 1.29 H new ATOM 0 HE1 TYR B 44 9.380 -6.302 10.653 1.00 1.14 H new ATOM 0 HE2 TYR B 44 11.610 -5.900 7.046 1.00 1.28 H new ATOM 0 HH TYR B 44 9.147 -7.299 7.847 1.00 0.50 H new ATOM 1758 N LYS B 45 10.559 -0.924 12.426 1.00 0.49 N ATOM 1759 CA LYS B 45 9.776 -0.900 13.653 1.00 0.55 C ATOM 1760 C LYS B 45 9.071 0.441 13.822 1.00 0.46 C ATOM 1761 O LYS B 45 8.007 0.521 14.439 1.00 0.60 O ATOM 1762 CB LYS B 45 10.674 -1.184 14.860 1.00 0.68 C ATOM 1763 CG LYS B 45 11.165 -2.623 14.924 1.00 1.22 C ATOM 1764 CD LYS B 45 12.166 -2.831 16.050 1.00 1.68 C ATOM 1765 CE LYS B 45 12.571 -4.293 16.162 1.00 2.21 C ATOM 1766 NZ LYS B 45 13.616 -4.508 17.196 1.00 2.83 N ATOM 0 H LYS B 45 11.529 -0.629 12.537 1.00 0.49 H new ATOM 0 HA LYS B 45 9.016 -1.678 13.588 1.00 0.55 H new ATOM 0 HB2 LYS B 45 11.534 -0.516 14.828 1.00 0.68 H new ATOM 0 HB3 LYS B 45 10.125 -0.954 15.773 1.00 0.68 H new ATOM 0 HG2 LYS B 45 10.315 -3.291 15.066 1.00 1.22 H new ATOM 0 HG3 LYS B 45 11.626 -2.892 13.974 1.00 1.22 H new ATOM 0 HD2 LYS B 45 13.050 -2.219 15.872 1.00 1.68 H new ATOM 0 HD3 LYS B 45 11.732 -2.498 16.993 1.00 1.68 H new ATOM 0 HE2 LYS B 45 11.694 -4.894 16.404 1.00 2.21 H new ATOM 0 HE3 LYS B 45 12.940 -4.641 15.197 1.00 2.21 H new ATOM 0 HZ1 LYS B 45 13.861 -5.518 17.237 1.00 2.83 H new ATOM 0 HZ2 LYS B 45 14.463 -3.956 16.953 1.00 2.83 H new ATOM 0 HZ3 LYS B 45 13.256 -4.201 18.122 1.00 2.83 H new ATOM 1780 N LYS B 46 9.657 1.488 13.254 1.00 0.33 N ATOM 1781 CA LYS B 46 9.091 2.827 13.348 1.00 0.36 C ATOM 1782 C LYS B 46 7.734 2.917 12.656 1.00 0.37 C ATOM 1783 O LYS B 46 6.754 3.365 13.253 1.00 0.51 O ATOM 1784 CB LYS B 46 10.045 3.852 12.735 1.00 0.43 C ATOM 1785 CG LYS B 46 11.176 4.268 13.660 1.00 0.89 C ATOM 1786 CD LYS B 46 12.188 5.142 12.935 1.00 1.20 C ATOM 1787 CE LYS B 46 13.091 5.881 13.910 1.00 1.37 C ATOM 1788 NZ LYS B 46 12.320 6.794 14.796 1.00 2.09 N ATOM 0 H LYS B 46 10.526 1.435 12.722 1.00 0.33 H new ATOM 0 HA LYS B 46 8.949 3.045 14.406 1.00 0.36 H new ATOM 0 HB2 LYS B 46 10.470 3.438 11.821 1.00 0.43 H new ATOM 0 HB3 LYS B 46 9.477 4.738 12.450 1.00 0.43 H new ATOM 0 HG2 LYS B 46 10.770 4.810 14.514 1.00 0.89 H new ATOM 0 HG3 LYS B 46 11.673 3.381 14.052 1.00 0.89 H new ATOM 0 HD2 LYS B 46 12.795 4.524 12.273 1.00 1.20 H new ATOM 0 HD3 LYS B 46 11.664 5.862 12.307 1.00 1.20 H new ATOM 0 HE2 LYS B 46 13.636 5.159 14.518 1.00 1.37 H new ATOM 0 HE3 LYS B 46 13.833 6.455 13.354 1.00 1.37 H new ATOM 0 HZ1 LYS B 46 12.759 7.737 14.789 1.00 2.09 H new ATOM 0 HZ2 LYS B 46 11.341 6.865 14.453 1.00 2.09 H new ATOM 0 HZ3 LYS B 46 12.321 6.419 15.766 1.00 2.09 H new ATOM 1802 N ILE B 47 7.680 2.473 11.403 1.00 0.35 N ATOM 1803 CA ILE B 47 6.450 2.525 10.618 1.00 0.40 C ATOM 1804 C ILE B 47 5.495 1.396 10.999 1.00 0.36 C ATOM 1805 O ILE B 47 4.275 1.537 10.869 1.00 0.40 O ATOM 1806 CB ILE B 47 6.745 2.453 9.101 1.00 0.50 C ATOM 1807 CG1 ILE B 47 7.855 3.438 8.725 1.00 0.71 C ATOM 1808 CG2 ILE B 47 5.484 2.749 8.301 1.00 0.48 C ATOM 1809 CD1 ILE B 47 8.251 3.385 7.263 1.00 0.44 C ATOM 0 H ILE B 47 8.477 2.072 10.908 1.00 0.35 H new ATOM 0 HA ILE B 47 5.976 3.480 10.843 1.00 0.40 H new ATOM 0 HB ILE B 47 7.080 1.444 8.862 1.00 0.50 H new ATOM 0 HG12 ILE B 47 7.528 4.449 8.967 1.00 0.71 H new ATOM 0 HG13 ILE B 47 8.733 3.232 9.337 1.00 0.71 H new ATOM 0 HG21 ILE B 47 5.708 2.695 7.236 1.00 0.48 H new ATOM 0 HG22 ILE B 47 4.716 2.016 8.548 1.00 0.48 H new ATOM 0 HG23 ILE B 47 5.124 3.748 8.545 1.00 0.48 H new ATOM 0 HD11 ILE B 47 9.042 4.111 7.074 1.00 0.44 H new ATOM 0 HD12 ILE B 47 8.610 2.385 7.019 1.00 0.44 H new ATOM 0 HD13 ILE B 47 7.386 3.621 6.643 1.00 0.44 H new ATOM 1821 N MET B 48 6.061 0.297 11.501 1.00 0.38 N ATOM 1822 CA MET B 48 5.287 -0.886 11.896 1.00 0.45 C ATOM 1823 C MET B 48 4.062 -0.521 12.731 1.00 0.49 C ATOM 1824 O MET B 48 2.927 -0.780 12.328 1.00 0.80 O ATOM 1825 CB MET B 48 6.168 -1.862 12.679 1.00 0.53 C ATOM 1826 CG MET B 48 5.486 -3.187 12.987 1.00 0.93 C ATOM 1827 SD MET B 48 6.457 -4.238 14.087 1.00 1.51 S ATOM 1828 CE MET B 48 7.945 -4.460 13.116 1.00 1.44 C ATOM 0 H MET B 48 7.066 0.200 11.646 1.00 0.38 H new ATOM 0 HA MET B 48 4.938 -1.359 10.978 1.00 0.45 H new ATOM 0 HB2 MET B 48 7.077 -2.055 12.109 1.00 0.53 H new ATOM 0 HB3 MET B 48 6.472 -1.393 13.615 1.00 0.53 H new ATOM 0 HG2 MET B 48 4.515 -2.993 13.442 1.00 0.93 H new ATOM 0 HG3 MET B 48 5.300 -3.720 12.054 1.00 0.93 H new ATOM 0 HE1 MET B 48 8.210 -5.517 13.093 1.00 1.44 H new ATOM 0 HE2 MET B 48 7.772 -4.107 12.099 1.00 1.44 H new ATOM 0 HE3 MET B 48 8.760 -3.892 13.564 1.00 1.44 H new ATOM 1838 N GLU B 49 4.290 0.102 13.879 1.00 0.55 N ATOM 1839 CA GLU B 49 3.194 0.480 14.762 1.00 0.61 C ATOM 1840 C GLU B 49 2.787 1.939 14.555 1.00 0.57 C ATOM 1841 O GLU B 49 1.963 2.477 15.294 1.00 0.69 O ATOM 1842 CB GLU B 49 3.576 0.232 16.224 1.00 0.80 C ATOM 1843 CG GLU B 49 2.392 -0.147 17.100 1.00 1.22 C ATOM 1844 CD GLU B 49 2.804 -0.605 18.482 1.00 1.91 C ATOM 1845 OE1 GLU B 49 3.162 -1.791 18.643 1.00 2.64 O ATOM 1846 OE2 GLU B 49 2.756 0.213 19.424 1.00 2.43 O ATOM 0 H GLU B 49 5.217 0.355 14.220 1.00 0.55 H new ATOM 0 HA GLU B 49 2.335 -0.143 14.513 1.00 0.61 H new ATOM 0 HB2 GLU B 49 4.320 -0.563 16.268 1.00 0.80 H new ATOM 0 HB3 GLU B 49 4.044 1.130 16.627 1.00 0.80 H new ATOM 0 HG2 GLU B 49 1.725 0.710 17.191 1.00 1.22 H new ATOM 0 HG3 GLU B 49 1.826 -0.941 16.613 1.00 1.22 H new ATOM 1853 N LYS B 50 3.359 2.576 13.543 1.00 0.62 N ATOM 1854 CA LYS B 50 3.039 3.965 13.249 1.00 0.65 C ATOM 1855 C LYS B 50 1.716 4.048 12.502 1.00 0.54 C ATOM 1856 O LYS B 50 0.831 4.825 12.857 1.00 0.58 O ATOM 1857 CB LYS B 50 4.153 4.607 12.418 1.00 0.77 C ATOM 1858 CG LYS B 50 3.964 6.095 12.175 1.00 0.90 C ATOM 1859 CD LYS B 50 4.066 6.897 13.465 1.00 1.17 C ATOM 1860 CE LYS B 50 5.511 7.089 13.902 1.00 0.89 C ATOM 1861 NZ LYS B 50 5.946 6.054 14.876 1.00 1.33 N ATOM 0 H LYS B 50 4.044 2.155 12.915 1.00 0.62 H new ATOM 0 HA LYS B 50 2.951 4.508 14.190 1.00 0.65 H new ATOM 0 HB2 LYS B 50 5.106 4.450 12.924 1.00 0.77 H new ATOM 0 HB3 LYS B 50 4.215 4.097 11.456 1.00 0.77 H new ATOM 0 HG2 LYS B 50 4.716 6.446 11.469 1.00 0.90 H new ATOM 0 HG3 LYS B 50 2.990 6.267 11.716 1.00 0.90 H new ATOM 0 HD2 LYS B 50 3.597 7.871 13.325 1.00 1.17 H new ATOM 0 HD3 LYS B 50 3.513 6.387 14.254 1.00 1.17 H new ATOM 0 HE2 LYS B 50 6.160 7.058 13.027 1.00 0.89 H new ATOM 0 HE3 LYS B 50 5.625 8.077 14.349 1.00 0.89 H new ATOM 0 HZ1 LYS B 50 6.604 6.477 15.562 1.00 1.33 H new ATOM 0 HZ2 LYS B 50 5.116 5.679 15.378 1.00 1.33 H new ATOM 0 HZ3 LYS B 50 6.423 5.280 14.371 1.00 1.33 H new ATOM 1875 N TYR B 51 1.591 3.232 11.467 1.00 0.50 N ATOM 1876 CA TYR B 51 0.378 3.201 10.661 1.00 0.44 C ATOM 1877 C TYR B 51 -0.278 1.831 10.735 1.00 0.42 C ATOM 1878 O TYR B 51 -1.245 1.564 10.020 1.00 0.49 O ATOM 1879 CB TYR B 51 0.696 3.542 9.205 1.00 0.48 C ATOM 1880 CG TYR B 51 1.020 4.999 8.972 1.00 0.45 C ATOM 1881 CD1 TYR B 51 0.008 5.943 8.850 1.00 0.53 C ATOM 1882 CD2 TYR B 51 2.337 5.431 8.870 1.00 0.47 C ATOM 1883 CE1 TYR B 51 0.299 7.276 8.632 1.00 0.54 C ATOM 1884 CE2 TYR B 51 2.636 6.763 8.652 1.00 0.47 C ATOM 1885 CZ TYR B 51 1.614 7.680 8.534 1.00 0.47 C ATOM 1886 OH TYR B 51 1.907 9.007 8.314 1.00 0.52 O ATOM 0 H TYR B 51 2.315 2.581 11.164 1.00 0.50 H new ATOM 0 HA TYR B 51 -0.313 3.945 11.058 1.00 0.44 H new ATOM 0 HB2 TYR B 51 1.540 2.936 8.877 1.00 0.48 H new ATOM 0 HB3 TYR B 51 -0.156 3.266 8.583 1.00 0.48 H new ATOM 0 HD1 TYR B 51 -1.023 5.630 8.927 1.00 0.53 H new ATOM 0 HD2 TYR B 51 3.140 4.715 8.963 1.00 0.47 H new ATOM 0 HE1 TYR B 51 -0.499 7.998 8.539 1.00 0.54 H new ATOM 0 HE2 TYR B 51 3.665 7.083 8.575 1.00 0.47 H new ATOM 0 HH TYR B 51 2.879 9.125 8.272 1.00 0.52 H new ATOM 1896 N SER B 52 0.250 0.980 11.615 1.00 0.44 N ATOM 1897 CA SER B 52 -0.255 -0.380 11.795 1.00 0.47 C ATOM 1898 C SER B 52 -0.223 -1.137 10.469 1.00 0.40 C ATOM 1899 O SER B 52 -1.258 -1.534 9.937 1.00 0.48 O ATOM 1900 CB SER B 52 -1.674 -0.354 12.374 1.00 0.58 C ATOM 1901 OG SER B 52 -1.769 0.589 13.430 1.00 1.27 O ATOM 0 H SER B 52 1.037 1.213 12.221 1.00 0.44 H new ATOM 0 HA SER B 52 0.390 -0.901 12.503 1.00 0.47 H new ATOM 0 HB2 SER B 52 -2.387 -0.102 11.589 1.00 0.58 H new ATOM 0 HB3 SER B 52 -1.941 -1.345 12.740 1.00 0.58 H new ATOM 0 HG SER B 52 -2.682 0.592 13.785 1.00 1.27 H new ATOM 1907 N VAL B 53 0.980 -1.318 9.937 1.00 0.33 N ATOM 1908 CA VAL B 53 1.157 -2.006 8.664 1.00 0.38 C ATOM 1909 C VAL B 53 0.796 -3.482 8.774 1.00 0.45 C ATOM 1910 O VAL B 53 1.168 -4.155 9.739 1.00 1.11 O ATOM 1911 CB VAL B 53 2.604 -1.872 8.135 1.00 0.45 C ATOM 1912 CG1 VAL B 53 2.911 -0.426 7.785 1.00 0.69 C ATOM 1913 CG2 VAL B 53 3.614 -2.398 9.146 1.00 0.56 C ATOM 0 H VAL B 53 1.847 -0.998 10.368 1.00 0.33 H new ATOM 0 HA VAL B 53 0.481 -1.525 7.957 1.00 0.38 H new ATOM 0 HB VAL B 53 2.686 -2.477 7.232 1.00 0.45 H new ATOM 0 HG11 VAL B 53 3.933 -0.350 7.415 1.00 0.69 H new ATOM 0 HG12 VAL B 53 2.220 -0.083 7.015 1.00 0.69 H new ATOM 0 HG13 VAL B 53 2.801 0.195 8.674 1.00 0.69 H new ATOM 0 HG21 VAL B 53 4.621 -2.290 8.744 1.00 0.56 H new ATOM 0 HG22 VAL B 53 3.530 -1.831 10.073 1.00 0.56 H new ATOM 0 HG23 VAL B 53 3.414 -3.451 9.346 1.00 0.56 H new ATOM 1923 N THR B 54 0.053 -3.976 7.794 1.00 0.52 N ATOM 1924 CA THR B 54 -0.345 -5.371 7.774 1.00 0.45 C ATOM 1925 C THR B 54 0.863 -6.247 7.469 1.00 0.40 C ATOM 1926 O THR B 54 1.107 -7.256 8.132 1.00 0.50 O ATOM 1927 CB THR B 54 -1.432 -5.617 6.712 1.00 0.53 C ATOM 1928 OG1 THR B 54 -2.120 -4.391 6.429 1.00 0.89 O ATOM 1929 CG2 THR B 54 -2.431 -6.665 7.179 1.00 0.72 C ATOM 0 H THR B 54 -0.285 -3.429 7.003 1.00 0.52 H new ATOM 0 HA THR B 54 -0.749 -5.624 8.754 1.00 0.45 H new ATOM 0 HB THR B 54 -0.946 -5.985 5.809 1.00 0.53 H new ATOM 0 HG1 THR B 54 -2.810 -4.552 5.752 1.00 0.89 H new ATOM 0 HG21 THR B 54 -3.186 -6.817 6.408 1.00 0.72 H new ATOM 0 HG22 THR B 54 -1.911 -7.604 7.368 1.00 0.72 H new ATOM 0 HG23 THR B 54 -2.912 -6.326 8.096 1.00 0.72 H new ATOM 1937 N PHE B 55 1.634 -5.832 6.475 1.00 0.49 N ATOM 1938 CA PHE B 55 2.812 -6.567 6.073 1.00 0.46 C ATOM 1939 C PHE B 55 3.977 -5.622 5.835 1.00 0.39 C ATOM 1940 O PHE B 55 3.844 -4.621 5.129 1.00 0.45 O ATOM 1941 CB PHE B 55 2.527 -7.377 4.806 1.00 0.55 C ATOM 1942 CG PHE B 55 3.709 -8.165 4.305 1.00 0.43 C ATOM 1943 CD1 PHE B 55 4.216 -9.222 5.042 1.00 1.35 C ATOM 1944 CD2 PHE B 55 4.306 -7.851 3.094 1.00 1.16 C ATOM 1945 CE1 PHE B 55 5.296 -9.950 4.581 1.00 1.33 C ATOM 1946 CE2 PHE B 55 5.386 -8.575 2.627 1.00 1.16 C ATOM 1947 CZ PHE B 55 5.881 -9.627 3.373 1.00 0.35 C ATOM 0 H PHE B 55 1.459 -4.986 5.933 1.00 0.49 H new ATOM 0 HA PHE B 55 3.079 -7.252 6.878 1.00 0.46 H new ATOM 0 HB2 PHE B 55 1.703 -8.063 5.003 1.00 0.55 H new ATOM 0 HB3 PHE B 55 2.196 -6.698 4.020 1.00 0.55 H new ATOM 0 HD1 PHE B 55 3.762 -9.480 5.987 1.00 1.35 H new ATOM 0 HD2 PHE B 55 3.922 -7.029 2.508 1.00 1.16 H new ATOM 0 HE1 PHE B 55 5.683 -10.772 5.166 1.00 1.33 H new ATOM 0 HE2 PHE B 55 5.842 -8.319 1.682 1.00 1.16 H new ATOM 0 HZ PHE B 55 6.725 -10.196 3.012 1.00 0.35 H new ATOM 1957 N ILE B 56 5.100 -5.935 6.452 1.00 0.40 N ATOM 1958 CA ILE B 56 6.311 -5.156 6.299 1.00 0.44 C ATOM 1959 C ILE B 56 7.487 -6.114 6.142 1.00 0.40 C ATOM 1960 O ILE B 56 7.673 -7.025 6.955 1.00 0.47 O ATOM 1961 CB ILE B 56 6.532 -4.184 7.486 1.00 0.55 C ATOM 1962 CG1 ILE B 56 7.831 -3.397 7.303 1.00 0.68 C ATOM 1963 CG2 ILE B 56 6.530 -4.924 8.820 1.00 0.58 C ATOM 1964 CD1 ILE B 56 7.862 -2.096 8.074 1.00 0.85 C ATOM 0 H ILE B 56 5.197 -6.738 7.074 1.00 0.40 H new ATOM 0 HA ILE B 56 6.221 -4.532 5.410 1.00 0.44 H new ATOM 0 HB ILE B 56 5.701 -3.479 7.499 1.00 0.55 H new ATOM 0 HG12 ILE B 56 8.670 -4.017 7.619 1.00 0.68 H new ATOM 0 HG13 ILE B 56 7.972 -3.185 6.243 1.00 0.68 H new ATOM 0 HG21 ILE B 56 6.687 -4.213 9.631 1.00 0.58 H new ATOM 0 HG22 ILE B 56 5.571 -5.424 8.957 1.00 0.58 H new ATOM 0 HG23 ILE B 56 7.330 -5.664 8.827 1.00 0.58 H new ATOM 0 HD11 ILE B 56 8.812 -1.591 7.898 1.00 0.85 H new ATOM 0 HD12 ILE B 56 7.044 -1.457 7.742 1.00 0.85 H new ATOM 0 HD13 ILE B 56 7.753 -2.301 9.139 1.00 0.85 H new ATOM 1976 N SER B 57 8.247 -5.942 5.075 1.00 0.38 N ATOM 1977 CA SER B 57 9.375 -6.810 4.797 1.00 0.36 C ATOM 1978 C SER B 57 10.525 -6.034 4.167 1.00 0.38 C ATOM 1979 O SER B 57 10.313 -5.109 3.384 1.00 0.67 O ATOM 1980 CB SER B 57 8.921 -7.933 3.855 1.00 0.36 C ATOM 1981 OG SER B 57 9.973 -8.839 3.571 1.00 1.33 O ATOM 0 H SER B 57 8.102 -5.205 4.385 1.00 0.38 H new ATOM 0 HA SER B 57 9.733 -7.232 5.736 1.00 0.36 H new ATOM 0 HB2 SER B 57 8.089 -8.473 4.307 1.00 0.36 H new ATOM 0 HB3 SER B 57 8.553 -7.500 2.925 1.00 0.36 H new ATOM 0 HG SER B 57 9.926 -9.111 2.631 1.00 1.33 H new ATOM 1987 N ARG B 58 11.743 -6.410 4.516 1.00 0.32 N ATOM 1988 CA ARG B 58 12.921 -5.768 3.964 1.00 0.34 C ATOM 1989 C ARG B 58 13.613 -6.738 3.019 1.00 0.31 C ATOM 1990 O ARG B 58 13.841 -7.899 3.368 1.00 0.40 O ATOM 1991 CB ARG B 58 13.867 -5.330 5.078 1.00 0.41 C ATOM 1992 CG ARG B 58 14.875 -4.280 4.642 1.00 1.07 C ATOM 1993 CD ARG B 58 15.775 -3.860 5.793 1.00 0.92 C ATOM 1994 NE ARG B 58 16.706 -4.919 6.173 1.00 1.26 N ATOM 1995 CZ ARG B 58 16.529 -5.732 7.214 1.00 1.41 C ATOM 1996 NH1 ARG B 58 15.458 -5.610 7.985 1.00 1.79 N ATOM 1997 NH2 ARG B 58 17.429 -6.663 7.486 1.00 2.18 N ATOM 0 H ARG B 58 11.941 -7.158 5.180 1.00 0.32 H new ATOM 0 HA ARG B 58 12.625 -4.875 3.413 1.00 0.34 H new ATOM 0 HB2 ARG B 58 13.280 -4.936 5.908 1.00 0.41 H new ATOM 0 HB3 ARG B 58 14.403 -6.202 5.453 1.00 0.41 H new ATOM 0 HG2 ARG B 58 15.483 -4.674 3.828 1.00 1.07 H new ATOM 0 HG3 ARG B 58 14.349 -3.408 4.253 1.00 1.07 H new ATOM 0 HD2 ARG B 58 16.335 -2.969 5.509 1.00 0.92 H new ATOM 0 HD3 ARG B 58 15.162 -3.590 6.653 1.00 0.92 H new ATOM 0 HE ARG B 58 17.545 -5.044 5.606 1.00 1.26 H new ATOM 0 HH11 ARG B 58 14.763 -4.891 7.783 1.00 1.79 H new ATOM 0 HH12 ARG B 58 15.328 -6.235 8.780 1.00 1.79 H new ATOM 0 HH21 ARG B 58 18.258 -6.758 6.899 1.00 2.18 H new ATOM 0 HH22 ARG B 58 17.294 -7.286 8.283 1.00 2.18 H new ATOM 2011 N HIS B 59 13.909 -6.280 1.814 1.00 0.28 N ATOM 2012 CA HIS B 59 14.550 -7.128 0.817 1.00 0.29 C ATOM 2013 C HIS B 59 15.831 -6.491 0.304 1.00 0.30 C ATOM 2014 O HIS B 59 16.063 -5.298 0.504 1.00 0.37 O ATOM 2015 CB HIS B 59 13.593 -7.388 -0.353 1.00 0.34 C ATOM 2016 CG HIS B 59 12.411 -8.236 0.010 1.00 0.34 C ATOM 2017 ND1 HIS B 59 12.188 -9.490 -0.512 1.00 0.43 N ATOM 2018 CD2 HIS B 59 11.384 -8.003 0.860 1.00 0.47 C ATOM 2019 CE1 HIS B 59 11.081 -9.990 0.004 1.00 0.45 C ATOM 2020 NE2 HIS B 59 10.572 -9.108 0.843 1.00 0.48 N ATOM 0 H HIS B 59 13.717 -5.328 1.501 1.00 0.28 H new ATOM 0 HA HIS B 59 14.802 -8.076 1.292 1.00 0.29 H new ATOM 0 HB2 HIS B 59 13.238 -6.433 -0.739 1.00 0.34 H new ATOM 0 HB3 HIS B 59 14.143 -7.873 -1.159 1.00 0.34 H new ATOM 0 HD1 HIS B 59 12.786 -9.960 -1.192 1.00 0.43 H new ATOM 0 HD2 HIS B 59 11.231 -7.109 1.446 1.00 0.47 H new ATOM 0 HE1 HIS B 59 10.662 -10.959 -0.223 1.00 0.45 H new ATOM 2029 N ASN B 60 16.658 -7.290 -0.351 1.00 0.32 N ATOM 2030 CA ASN B 60 17.914 -6.804 -0.906 1.00 0.34 C ATOM 2031 C ASN B 60 17.709 -6.382 -2.353 1.00 0.38 C ATOM 2032 O ASN B 60 16.653 -6.634 -2.929 1.00 0.47 O ATOM 2033 CB ASN B 60 19.000 -7.885 -0.829 1.00 0.39 C ATOM 2034 CG ASN B 60 19.313 -8.300 0.596 1.00 0.75 C ATOM 2035 OD1 ASN B 60 18.782 -9.289 1.100 1.00 1.75 O ATOM 2036 ND2 ASN B 60 20.184 -7.552 1.255 1.00 0.96 N ATOM 0 H ASN B 60 16.482 -8.282 -0.512 1.00 0.32 H new ATOM 0 HA ASN B 60 18.240 -5.945 -0.319 1.00 0.34 H new ATOM 0 HB2 ASN B 60 18.678 -8.759 -1.395 1.00 0.39 H new ATOM 0 HB3 ASN B 60 19.909 -7.515 -1.303 1.00 0.39 H new ATOM 0 HD21 ASN B 60 20.436 -7.788 2.215 1.00 0.96 H new ATOM 0 HD22 ASN B 60 20.603 -6.739 0.803 1.00 0.96 H new ATOM 2043 N SER B 61 18.711 -5.743 -2.939 1.00 0.45 N ATOM 2044 CA SER B 61 18.615 -5.301 -4.320 1.00 0.52 C ATOM 2045 C SER B 61 19.958 -5.436 -5.032 1.00 0.54 C ATOM 2046 O SER B 61 20.202 -6.408 -5.744 1.00 0.70 O ATOM 2047 CB SER B 61 18.127 -3.850 -4.374 1.00 0.58 C ATOM 2048 OG SER B 61 18.827 -3.040 -3.439 1.00 1.14 O ATOM 0 H SER B 61 19.595 -5.520 -2.481 1.00 0.45 H new ATOM 0 HA SER B 61 17.895 -5.937 -4.835 1.00 0.52 H new ATOM 0 HB2 SER B 61 18.266 -3.453 -5.380 1.00 0.58 H new ATOM 0 HB3 SER B 61 17.058 -3.814 -4.163 1.00 0.58 H new ATOM 0 HG SER B 61 18.193 -2.456 -2.973 1.00 1.14 H new ATOM 2054 N TYR B 62 20.823 -4.452 -4.828 1.00 0.58 N ATOM 2055 CA TYR B 62 22.141 -4.447 -5.444 1.00 0.65 C ATOM 2056 C TYR B 62 23.185 -3.941 -4.456 1.00 0.69 C ATOM 2057 O TYR B 62 24.068 -4.686 -4.037 1.00 0.81 O ATOM 2058 CB TYR B 62 22.142 -3.575 -6.706 1.00 0.78 C ATOM 2059 CG TYR B 62 21.237 -4.094 -7.804 1.00 0.73 C ATOM 2060 CD1 TYR B 62 21.638 -5.140 -8.624 1.00 1.20 C ATOM 2061 CD2 TYR B 62 19.978 -3.542 -8.012 1.00 0.98 C ATOM 2062 CE1 TYR B 62 20.811 -5.621 -9.621 1.00 1.37 C ATOM 2063 CE2 TYR B 62 19.145 -4.022 -9.006 1.00 1.13 C ATOM 2064 CZ TYR B 62 19.567 -5.061 -9.807 1.00 1.14 C ATOM 2065 OH TYR B 62 18.744 -5.544 -10.800 1.00 1.45 O ATOM 0 H TYR B 62 20.633 -3.643 -4.237 1.00 0.58 H new ATOM 0 HA TYR B 62 22.392 -5.469 -5.728 1.00 0.65 H new ATOM 0 HB2 TYR B 62 21.832 -2.565 -6.439 1.00 0.78 H new ATOM 0 HB3 TYR B 62 23.160 -3.506 -7.089 1.00 0.78 H new ATOM 0 HD1 TYR B 62 22.612 -5.585 -8.480 1.00 1.20 H new ATOM 0 HD2 TYR B 62 19.645 -2.726 -7.388 1.00 0.98 H new ATOM 0 HE1 TYR B 62 21.139 -6.433 -10.252 1.00 1.37 H new ATOM 0 HE2 TYR B 62 18.169 -3.585 -9.154 1.00 1.13 H new ATOM 0 HH TYR B 62 17.863 -5.121 -10.729 1.00 1.45 H new ATOM 2075 N ASN B 63 23.069 -2.674 -4.076 1.00 0.72 N ATOM 2076 CA ASN B 63 24.011 -2.069 -3.137 1.00 0.85 C ATOM 2077 C ASN B 63 23.320 -1.650 -1.845 1.00 0.68 C ATOM 2078 O ASN B 63 23.980 -1.290 -0.873 1.00 0.66 O ATOM 2079 CB ASN B 63 24.677 -0.835 -3.757 1.00 1.09 C ATOM 2080 CG ASN B 63 25.738 -1.176 -4.782 1.00 1.44 C ATOM 2081 OD1 ASN B 63 26.323 -2.257 -4.763 1.00 2.15 O ATOM 2082 ND2 ASN B 63 26.007 -0.238 -5.676 1.00 1.55 N ATOM 0 H ASN B 63 22.335 -2.046 -4.402 1.00 0.72 H new ATOM 0 HA ASN B 63 24.764 -2.824 -2.911 1.00 0.85 H new ATOM 0 HB2 ASN B 63 23.913 -0.217 -4.228 1.00 1.09 H new ATOM 0 HB3 ASN B 63 25.127 -0.237 -2.964 1.00 1.09 H new ATOM 0 HD21 ASN B 63 26.723 -0.399 -6.384 1.00 1.55 H new ATOM 0 HD22 ASN B 63 25.498 0.646 -5.657 1.00 1.55 H new ATOM 2089 N HIS B 64 21.991 -1.680 -1.830 1.00 0.65 N ATOM 2090 CA HIS B 64 21.245 -1.263 -0.643 1.00 0.50 C ATOM 2091 C HIS B 64 20.074 -2.207 -0.367 1.00 0.48 C ATOM 2092 O HIS B 64 19.995 -3.300 -0.930 1.00 0.59 O ATOM 2093 CB HIS B 64 20.729 0.175 -0.809 1.00 0.48 C ATOM 2094 CG HIS B 64 21.766 1.158 -1.272 1.00 0.49 C ATOM 2095 ND1 HIS B 64 21.968 1.458 -2.599 1.00 0.99 N ATOM 2096 CD2 HIS B 64 22.658 1.908 -0.581 1.00 0.83 C ATOM 2097 CE1 HIS B 64 22.936 2.346 -2.706 1.00 0.84 C ATOM 2098 NE2 HIS B 64 23.373 2.642 -1.498 1.00 0.61 N ATOM 0 H HIS B 64 21.413 -1.984 -2.614 1.00 0.65 H new ATOM 0 HA HIS B 64 21.926 -1.301 0.207 1.00 0.50 H new ATOM 0 HB2 HIS B 64 19.905 0.172 -1.522 1.00 0.48 H new ATOM 0 HB3 HIS B 64 20.324 0.515 0.144 1.00 0.48 H new ATOM 0 HD2 HIS B 64 22.784 1.926 0.491 1.00 0.83 H new ATOM 0 HE1 HIS B 64 23.309 2.762 -3.630 1.00 0.84 H new ATOM 0 HE2 HIS B 64 24.117 3.305 -1.280 1.00 0.61 H new ATOM 2107 N ASN B 65 19.163 -1.770 0.491 1.00 0.39 N ATOM 2108 CA ASN B 65 17.998 -2.564 0.862 1.00 0.37 C ATOM 2109 C ASN B 65 16.711 -1.866 0.439 1.00 0.35 C ATOM 2110 O ASN B 65 16.708 -0.670 0.144 1.00 0.40 O ATOM 2111 CB ASN B 65 17.977 -2.790 2.376 1.00 0.38 C ATOM 2112 CG ASN B 65 18.601 -4.108 2.798 1.00 0.51 C ATOM 2113 OD1 ASN B 65 18.224 -4.679 3.817 1.00 1.38 O ATOM 2114 ND2 ASN B 65 19.561 -4.595 2.030 1.00 1.05 N ATOM 0 H ASN B 65 19.209 -0.859 0.948 1.00 0.39 H new ATOM 0 HA ASN B 65 18.064 -3.524 0.349 1.00 0.37 H new ATOM 0 HB2 ASN B 65 18.507 -1.973 2.865 1.00 0.38 H new ATOM 0 HB3 ASN B 65 16.945 -2.756 2.727 1.00 0.38 H new ATOM 0 HD21 ASN B 65 20.015 -5.474 2.277 1.00 1.05 H new ATOM 0 HD22 ASN B 65 19.847 -4.091 1.190 1.00 1.05 H new ATOM 2121 N ILE B 66 15.623 -2.619 0.413 1.00 0.37 N ATOM 2122 CA ILE B 66 14.325 -2.084 0.036 1.00 0.40 C ATOM 2123 C ILE B 66 13.282 -2.414 1.096 1.00 0.36 C ATOM 2124 O ILE B 66 13.038 -3.586 1.398 1.00 0.57 O ATOM 2125 CB ILE B 66 13.861 -2.648 -1.324 1.00 0.50 C ATOM 2126 CG1 ILE B 66 14.865 -2.284 -2.416 1.00 0.72 C ATOM 2127 CG2 ILE B 66 12.476 -2.123 -1.682 1.00 0.60 C ATOM 2128 CD1 ILE B 66 14.796 -3.182 -3.630 1.00 0.65 C ATOM 0 H ILE B 66 15.614 -3.611 0.651 1.00 0.37 H new ATOM 0 HA ILE B 66 14.430 -1.002 -0.048 1.00 0.40 H new ATOM 0 HB ILE B 66 13.805 -3.734 -1.245 1.00 0.50 H new ATOM 0 HG12 ILE B 66 14.692 -1.254 -2.727 1.00 0.72 H new ATOM 0 HG13 ILE B 66 15.872 -2.327 -2.000 1.00 0.72 H new ATOM 0 HG21 ILE B 66 12.169 -2.533 -2.644 1.00 0.60 H new ATOM 0 HG22 ILE B 66 11.763 -2.425 -0.915 1.00 0.60 H new ATOM 0 HG23 ILE B 66 12.504 -1.035 -1.744 1.00 0.60 H new ATOM 0 HD11 ILE B 66 15.538 -2.862 -4.362 1.00 0.65 H new ATOM 0 HD12 ILE B 66 14.999 -4.211 -3.333 1.00 0.65 H new ATOM 0 HD13 ILE B 66 13.801 -3.121 -4.071 1.00 0.65 H new ATOM 2140 N LEU B 67 12.687 -1.381 1.671 1.00 0.41 N ATOM 2141 CA LEU B 67 11.661 -1.552 2.686 1.00 0.39 C ATOM 2142 C LEU B 67 10.290 -1.627 2.027 1.00 0.39 C ATOM 2143 O LEU B 67 9.793 -0.638 1.493 1.00 0.59 O ATOM 2144 CB LEU B 67 11.700 -0.399 3.693 1.00 0.43 C ATOM 2145 CG LEU B 67 10.777 -0.560 4.903 1.00 0.51 C ATOM 2146 CD1 LEU B 67 11.248 -1.699 5.793 1.00 0.80 C ATOM 2147 CD2 LEU B 67 10.704 0.737 5.690 1.00 0.52 C ATOM 0 H LEU B 67 12.900 -0.408 1.449 1.00 0.41 H new ATOM 0 HA LEU B 67 11.852 -2.482 3.222 1.00 0.39 H new ATOM 0 HB2 LEU B 67 12.724 -0.284 4.050 1.00 0.43 H new ATOM 0 HB3 LEU B 67 11.437 0.523 3.175 1.00 0.43 H new ATOM 0 HG LEU B 67 9.778 -0.803 4.541 1.00 0.51 H new ATOM 0 HD11 LEU B 67 10.577 -1.795 6.647 1.00 0.80 H new ATOM 0 HD12 LEU B 67 11.247 -2.629 5.225 1.00 0.80 H new ATOM 0 HD13 LEU B 67 12.258 -1.491 6.147 1.00 0.80 H new ATOM 0 HD21 LEU B 67 10.044 0.606 6.547 1.00 0.52 H new ATOM 0 HD22 LEU B 67 11.701 1.008 6.038 1.00 0.52 H new ATOM 0 HD23 LEU B 67 10.315 1.529 5.050 1.00 0.52 H new ATOM 2159 N PHE B 68 9.703 -2.809 2.056 1.00 0.37 N ATOM 2160 CA PHE B 68 8.398 -3.044 1.461 1.00 0.41 C ATOM 2161 C PHE B 68 7.339 -3.140 2.556 1.00 0.39 C ATOM 2162 O PHE B 68 7.295 -4.122 3.300 1.00 0.57 O ATOM 2163 CB PHE B 68 8.448 -4.341 0.647 1.00 0.58 C ATOM 2164 CG PHE B 68 7.254 -4.581 -0.235 1.00 0.45 C ATOM 2165 CD1 PHE B 68 7.033 -3.796 -1.355 1.00 1.34 C ATOM 2166 CD2 PHE B 68 6.362 -5.605 0.049 1.00 1.35 C ATOM 2167 CE1 PHE B 68 5.943 -4.026 -2.174 1.00 1.59 C ATOM 2168 CE2 PHE B 68 5.270 -5.837 -0.766 1.00 1.72 C ATOM 2169 CZ PHE B 68 5.061 -5.047 -1.879 1.00 1.45 C ATOM 0 H PHE B 68 10.116 -3.633 2.492 1.00 0.37 H new ATOM 0 HA PHE B 68 8.136 -2.216 0.802 1.00 0.41 H new ATOM 0 HB2 PHE B 68 9.344 -4.329 0.026 1.00 0.58 H new ATOM 0 HB3 PHE B 68 8.548 -5.181 1.335 1.00 0.58 H new ATOM 0 HD1 PHE B 68 7.719 -2.996 -1.591 1.00 1.34 H new ATOM 0 HD2 PHE B 68 6.523 -6.228 0.917 1.00 1.35 H new ATOM 0 HE1 PHE B 68 5.781 -3.407 -3.044 1.00 1.59 H new ATOM 0 HE2 PHE B 68 4.581 -6.635 -0.533 1.00 1.72 H new ATOM 0 HZ PHE B 68 4.209 -5.227 -2.518 1.00 1.45 H new ATOM 2179 N PHE B 69 6.499 -2.122 2.668 1.00 0.41 N ATOM 2180 CA PHE B 69 5.462 -2.113 3.690 1.00 0.42 C ATOM 2181 C PHE B 69 4.112 -1.730 3.097 1.00 0.44 C ATOM 2182 O PHE B 69 4.025 -0.915 2.175 1.00 0.53 O ATOM 2183 CB PHE B 69 5.834 -1.168 4.844 1.00 0.39 C ATOM 2184 CG PHE B 69 5.978 0.275 4.447 1.00 0.39 C ATOM 2185 CD1 PHE B 69 7.148 0.734 3.866 1.00 0.48 C ATOM 2186 CD2 PHE B 69 4.945 1.173 4.665 1.00 0.36 C ATOM 2187 CE1 PHE B 69 7.284 2.059 3.507 1.00 0.51 C ATOM 2188 CE2 PHE B 69 5.075 2.498 4.307 1.00 0.39 C ATOM 2189 CZ PHE B 69 6.247 2.943 3.729 1.00 0.45 C ATOM 0 H PHE B 69 6.514 -1.297 2.069 1.00 0.41 H new ATOM 0 HA PHE B 69 5.382 -3.124 4.090 1.00 0.42 H new ATOM 0 HB2 PHE B 69 5.071 -1.244 5.619 1.00 0.39 H new ATOM 0 HB3 PHE B 69 6.772 -1.506 5.285 1.00 0.39 H new ATOM 0 HD1 PHE B 69 7.963 0.047 3.692 1.00 0.48 H new ATOM 0 HD2 PHE B 69 4.028 0.831 5.121 1.00 0.36 H new ATOM 0 HE1 PHE B 69 8.201 2.405 3.053 1.00 0.51 H new ATOM 0 HE2 PHE B 69 4.261 3.187 4.479 1.00 0.39 H new ATOM 0 HZ PHE B 69 6.353 3.981 3.451 1.00 0.45 H new ATOM 2199 N LEU B 70 3.064 -2.340 3.622 1.00 0.40 N ATOM 2200 CA LEU B 70 1.714 -2.080 3.160 1.00 0.41 C ATOM 2201 C LEU B 70 0.861 -1.512 4.283 1.00 0.37 C ATOM 2202 O LEU B 70 0.622 -2.177 5.295 1.00 0.38 O ATOM 2203 CB LEU B 70 1.076 -3.360 2.618 1.00 0.48 C ATOM 2204 CG LEU B 70 1.744 -3.939 1.370 1.00 0.65 C ATOM 2205 CD1 LEU B 70 2.768 -4.999 1.744 1.00 1.18 C ATOM 2206 CD2 LEU B 70 0.699 -4.512 0.433 1.00 1.17 C ATOM 0 H LEU B 70 3.125 -3.025 4.375 1.00 0.40 H new ATOM 0 HA LEU B 70 1.768 -1.345 2.357 1.00 0.41 H new ATOM 0 HB2 LEU B 70 1.091 -4.116 3.403 1.00 0.48 H new ATOM 0 HB3 LEU B 70 0.029 -3.158 2.390 1.00 0.48 H new ATOM 0 HG LEU B 70 2.268 -3.133 0.856 1.00 0.65 H new ATOM 0 HD11 LEU B 70 3.229 -5.395 0.839 1.00 1.18 H new ATOM 0 HD12 LEU B 70 3.536 -4.556 2.378 1.00 1.18 H new ATOM 0 HD13 LEU B 70 2.274 -5.807 2.284 1.00 1.18 H new ATOM 0 HD21 LEU B 70 1.188 -4.921 -0.451 1.00 1.17 H new ATOM 0 HD22 LEU B 70 0.149 -5.303 0.942 1.00 1.17 H new ATOM 0 HD23 LEU B 70 0.008 -3.724 0.134 1.00 1.17 H new ATOM 2218 N THR B 71 0.420 -0.279 4.107 1.00 0.39 N ATOM 2219 CA THR B 71 -0.416 0.377 5.094 1.00 0.38 C ATOM 2220 C THR B 71 -1.890 0.199 4.734 1.00 0.40 C ATOM 2221 O THR B 71 -2.322 0.622 3.662 1.00 0.52 O ATOM 2222 CB THR B 71 -0.084 1.880 5.205 1.00 0.41 C ATOM 2223 OG1 THR B 71 0.028 2.471 3.900 1.00 0.51 O ATOM 2224 CG2 THR B 71 1.215 2.094 5.963 1.00 0.47 C ATOM 0 H THR B 71 0.629 0.289 3.286 1.00 0.39 H new ATOM 0 HA THR B 71 -0.218 -0.087 6.060 1.00 0.38 H new ATOM 0 HB THR B 71 -0.898 2.358 5.750 1.00 0.41 H new ATOM 0 HG1 THR B 71 0.012 3.448 3.981 1.00 0.51 H new ATOM 0 HG21 THR B 71 1.427 3.161 6.028 1.00 0.47 H new ATOM 0 HG22 THR B 71 1.122 1.681 6.967 1.00 0.47 H new ATOM 0 HG23 THR B 71 2.029 1.594 5.438 1.00 0.47 H new ATOM 2232 N PRO B 72 -2.672 -0.447 5.615 1.00 0.43 N ATOM 2233 CA PRO B 72 -4.100 -0.686 5.381 1.00 0.48 C ATOM 2234 C PRO B 72 -4.878 0.615 5.218 1.00 0.47 C ATOM 2235 O PRO B 72 -5.753 0.724 4.361 1.00 0.86 O ATOM 2236 CB PRO B 72 -4.561 -1.437 6.637 1.00 0.67 C ATOM 2237 CG PRO B 72 -3.511 -1.174 7.659 1.00 0.74 C ATOM 2238 CD PRO B 72 -2.227 -1.004 6.901 1.00 0.56 C ATOM 0 HA PRO B 72 -4.272 -1.243 4.460 1.00 0.48 H new ATOM 0 HB2 PRO B 72 -5.535 -1.081 6.973 1.00 0.67 H new ATOM 0 HB3 PRO B 72 -4.662 -2.505 6.442 1.00 0.67 H new ATOM 0 HG2 PRO B 72 -3.744 -0.279 8.236 1.00 0.74 H new ATOM 0 HG3 PRO B 72 -3.440 -2.000 8.366 1.00 0.74 H new ATOM 0 HD2 PRO B 72 -1.541 -0.332 7.416 1.00 0.56 H new ATOM 0 HD3 PRO B 72 -1.707 -1.953 6.771 1.00 0.56 H new ATOM 2246 N HIS B 73 -4.544 1.601 6.039 1.00 0.54 N ATOM 2247 CA HIS B 73 -5.209 2.895 5.981 1.00 0.51 C ATOM 2248 C HIS B 73 -4.795 3.634 4.718 1.00 0.51 C ATOM 2249 O HIS B 73 -3.630 3.990 4.553 1.00 1.28 O ATOM 2250 CB HIS B 73 -4.881 3.739 7.218 1.00 0.69 C ATOM 2251 CG HIS B 73 -5.683 3.372 8.426 1.00 0.83 C ATOM 2252 ND1 HIS B 73 -6.930 3.892 8.690 1.00 0.83 N ATOM 2253 CD2 HIS B 73 -5.408 2.527 9.447 1.00 1.78 C ATOM 2254 CE1 HIS B 73 -7.386 3.386 9.819 1.00 0.79 C ATOM 2255 NE2 HIS B 73 -6.483 2.554 10.298 1.00 1.64 N ATOM 0 H HIS B 73 -3.818 1.530 6.752 1.00 0.54 H new ATOM 0 HA HIS B 73 -6.286 2.726 5.962 1.00 0.51 H new ATOM 0 HB2 HIS B 73 -3.821 3.631 7.450 1.00 0.69 H new ATOM 0 HB3 HIS B 73 -5.051 4.790 6.985 1.00 0.69 H new ATOM 0 HD2 HIS B 73 -4.509 1.941 9.569 1.00 1.78 H new ATOM 0 HE1 HIS B 73 -8.338 3.615 10.274 1.00 0.79 H new ATOM 0 HE2 HIS B 73 -6.570 2.018 11.161 1.00 1.64 H new ATOM 2264 N ARG B 74 -5.752 3.841 3.827 1.00 0.70 N ATOM 2265 CA ARG B 74 -5.497 4.531 2.570 1.00 0.62 C ATOM 2266 C ARG B 74 -5.139 5.990 2.825 1.00 0.53 C ATOM 2267 O ARG B 74 -5.785 6.663 3.623 1.00 0.65 O ATOM 2268 CB ARG B 74 -6.725 4.445 1.665 1.00 0.81 C ATOM 2269 CG ARG B 74 -7.244 3.032 1.468 1.00 1.10 C ATOM 2270 CD ARG B 74 -6.298 2.189 0.628 1.00 1.33 C ATOM 2271 NE ARG B 74 -6.984 1.030 0.055 1.00 1.89 N ATOM 2272 CZ ARG B 74 -6.602 0.394 -1.052 1.00 2.35 C ATOM 2273 NH1 ARG B 74 -5.507 0.769 -1.704 1.00 3.07 N ATOM 2274 NH2 ARG B 74 -7.326 -0.614 -1.510 1.00 2.72 N ATOM 0 H ARG B 74 -6.718 3.539 3.951 1.00 0.70 H new ATOM 0 HA ARG B 74 -4.655 4.047 2.074 1.00 0.62 H new ATOM 0 HB2 ARG B 74 -7.520 5.058 2.088 1.00 0.81 H new ATOM 0 HB3 ARG B 74 -6.478 4.870 0.692 1.00 0.81 H new ATOM 0 HG2 ARG B 74 -7.385 2.559 2.440 1.00 1.10 H new ATOM 0 HG3 ARG B 74 -8.221 3.069 0.987 1.00 1.10 H new ATOM 0 HD2 ARG B 74 -5.878 2.798 -0.173 1.00 1.33 H new ATOM 0 HD3 ARG B 74 -5.464 1.853 1.243 1.00 1.33 H new ATOM 0 HE ARG B 74 -7.814 0.684 0.537 1.00 1.89 H new ATOM 0 HH11 ARG B 74 -4.950 1.550 -1.358 1.00 3.07 H new ATOM 0 HH12 ARG B 74 -5.223 0.276 -2.550 1.00 3.07 H new ATOM 0 HH21 ARG B 74 -8.171 -0.900 -1.016 1.00 2.72 H new ATOM 0 HH22 ARG B 74 -7.039 -1.105 -2.357 1.00 2.72 H new ATOM 2288 N HIS B 75 -4.102 6.467 2.150 1.00 0.46 N ATOM 2289 CA HIS B 75 -3.647 7.846 2.309 1.00 0.45 C ATOM 2290 C HIS B 75 -2.806 8.274 1.117 1.00 0.47 C ATOM 2291 O HIS B 75 -2.460 7.452 0.265 1.00 0.86 O ATOM 2292 CB HIS B 75 -2.842 8.031 3.608 1.00 0.51 C ATOM 2293 CG HIS B 75 -1.968 6.868 3.987 1.00 0.56 C ATOM 2294 ND1 HIS B 75 -1.782 6.476 5.292 1.00 0.88 N ATOM 2295 CD2 HIS B 75 -1.241 6.005 3.233 1.00 0.67 C ATOM 2296 CE1 HIS B 75 -0.983 5.429 5.327 1.00 1.09 C ATOM 2297 NE2 HIS B 75 -0.639 5.118 4.093 1.00 0.97 N ATOM 0 H HIS B 75 -3.557 5.919 1.484 1.00 0.46 H new ATOM 0 HA HIS B 75 -4.535 8.476 2.366 1.00 0.45 H new ATOM 0 HB2 HIS B 75 -2.216 8.918 3.506 1.00 0.51 H new ATOM 0 HB3 HIS B 75 -3.538 8.224 4.424 1.00 0.51 H new ATOM 0 HD1 HIS B 75 -2.198 6.926 6.107 1.00 0.88 H new ATOM 0 HD2 HIS B 75 -1.152 6.014 2.157 1.00 0.67 H new ATOM 0 HE1 HIS B 75 -0.663 4.911 6.219 1.00 1.09 H new ATOM 2306 N ARG B 76 -2.475 9.557 1.068 1.00 0.54 N ATOM 2307 CA ARG B 76 -1.679 10.103 -0.026 1.00 0.51 C ATOM 2308 C ARG B 76 -0.222 9.658 0.090 1.00 0.51 C ATOM 2309 O ARG B 76 0.274 9.402 1.189 1.00 0.47 O ATOM 2310 CB ARG B 76 -1.753 11.636 -0.052 1.00 0.56 C ATOM 2311 CG ARG B 76 -3.082 12.223 0.418 1.00 1.06 C ATOM 2312 CD ARG B 76 -4.270 11.682 -0.367 1.00 0.95 C ATOM 2313 NE ARG B 76 -4.049 11.741 -1.808 1.00 1.45 N ATOM 2314 CZ ARG B 76 -4.796 11.093 -2.699 1.00 1.88 C ATOM 2315 NH1 ARG B 76 -5.865 10.405 -2.310 1.00 2.53 N ATOM 2316 NH2 ARG B 76 -4.482 11.149 -3.984 1.00 2.41 N ATOM 0 H ARG B 76 -2.745 10.242 1.774 1.00 0.54 H new ATOM 0 HA ARG B 76 -2.094 9.719 -0.958 1.00 0.51 H new ATOM 0 HB2 ARG B 76 -0.955 12.035 0.574 1.00 0.56 H new ATOM 0 HB3 ARG B 76 -1.561 11.977 -1.069 1.00 0.56 H new ATOM 0 HG2 ARG B 76 -3.219 12.001 1.476 1.00 1.06 H new ATOM 0 HG3 ARG B 76 -3.051 13.308 0.321 1.00 1.06 H new ATOM 0 HD2 ARG B 76 -4.459 10.650 -0.072 1.00 0.95 H new ATOM 0 HD3 ARG B 76 -5.162 12.255 -0.114 1.00 0.95 H new ATOM 0 HE ARG B 76 -3.277 12.312 -2.153 1.00 1.45 H new ATOM 0 HH11 ARG B 76 -6.118 10.371 -1.322 1.00 2.53 H new ATOM 0 HH12 ARG B 76 -6.432 9.911 -2.999 1.00 2.53 H new ATOM 0 HH21 ARG B 76 -3.670 11.687 -4.288 1.00 2.41 H new ATOM 0 HH22 ARG B 76 -5.052 10.654 -4.670 1.00 2.41 H new ATOM 2330 N VAL B 77 0.457 9.580 -1.049 1.00 0.63 N ATOM 2331 CA VAL B 77 1.855 9.154 -1.092 1.00 0.73 C ATOM 2332 C VAL B 77 2.774 10.195 -0.459 1.00 0.64 C ATOM 2333 O VAL B 77 3.729 9.850 0.237 1.00 0.65 O ATOM 2334 CB VAL B 77 2.320 8.895 -2.542 1.00 1.02 C ATOM 2335 CG1 VAL B 77 3.660 8.172 -2.564 1.00 1.06 C ATOM 2336 CG2 VAL B 77 1.269 8.109 -3.312 1.00 1.22 C ATOM 0 H VAL B 77 0.061 9.807 -1.961 1.00 0.63 H new ATOM 0 HA VAL B 77 1.916 8.226 -0.523 1.00 0.73 H new ATOM 0 HB VAL B 77 2.451 9.860 -3.032 1.00 1.02 H new ATOM 0 HG11 VAL B 77 3.965 8.002 -3.597 1.00 1.06 H new ATOM 0 HG12 VAL B 77 4.410 8.781 -2.060 1.00 1.06 H new ATOM 0 HG13 VAL B 77 3.565 7.215 -2.051 1.00 1.06 H new ATOM 0 HG21 VAL B 77 1.617 7.938 -4.331 1.00 1.22 H new ATOM 0 HG22 VAL B 77 1.099 7.151 -2.821 1.00 1.22 H new ATOM 0 HG23 VAL B 77 0.338 8.675 -3.337 1.00 1.22 H new ATOM 2346 N SER B 78 2.467 11.466 -0.692 1.00 0.62 N ATOM 2347 CA SER B 78 3.261 12.568 -0.164 1.00 0.67 C ATOM 2348 C SER B 78 3.373 12.502 1.358 1.00 0.52 C ATOM 2349 O SER B 78 4.433 12.781 1.919 1.00 0.52 O ATOM 2350 CB SER B 78 2.637 13.891 -0.595 1.00 0.83 C ATOM 2351 OG SER B 78 1.315 13.684 -1.064 1.00 1.33 O ATOM 0 H SER B 78 1.665 11.760 -1.249 1.00 0.62 H new ATOM 0 HA SER B 78 4.271 12.490 -0.567 1.00 0.67 H new ATOM 0 HB2 SER B 78 2.627 14.586 0.244 1.00 0.83 H new ATOM 0 HB3 SER B 78 3.241 14.347 -1.380 1.00 0.83 H new ATOM 0 HG SER B 78 0.926 14.542 -1.336 1.00 1.33 H new ATOM 2357 N ALA B 79 2.282 12.121 2.018 1.00 0.47 N ATOM 2358 CA ALA B 79 2.263 12.010 3.473 1.00 0.45 C ATOM 2359 C ALA B 79 3.290 10.988 3.953 1.00 0.40 C ATOM 2360 O ALA B 79 4.002 11.213 4.933 1.00 0.49 O ATOM 2361 CB ALA B 79 0.871 11.628 3.953 1.00 0.47 C ATOM 0 H ALA B 79 1.399 11.884 1.567 1.00 0.47 H new ATOM 0 HA ALA B 79 2.526 12.980 3.895 1.00 0.45 H new ATOM 0 HB1 ALA B 79 0.870 11.548 5.040 1.00 0.47 H new ATOM 0 HB2 ALA B 79 0.157 12.392 3.645 1.00 0.47 H new ATOM 0 HB3 ALA B 79 0.587 10.670 3.519 1.00 0.47 H new ATOM 2367 N ILE B 80 3.366 9.867 3.250 1.00 0.36 N ATOM 2368 CA ILE B 80 4.311 8.813 3.593 1.00 0.48 C ATOM 2369 C ILE B 80 5.727 9.232 3.220 1.00 0.43 C ATOM 2370 O ILE B 80 6.672 9.025 3.983 1.00 0.52 O ATOM 2371 CB ILE B 80 3.954 7.488 2.884 1.00 0.66 C ATOM 2372 CG1 ILE B 80 2.589 6.988 3.359 1.00 0.65 C ATOM 2373 CG2 ILE B 80 5.023 6.431 3.126 1.00 0.94 C ATOM 2374 CD1 ILE B 80 2.506 6.747 4.855 1.00 0.48 C ATOM 0 H ILE B 80 2.784 9.663 2.437 1.00 0.36 H new ATOM 0 HA ILE B 80 4.254 8.652 4.669 1.00 0.48 H new ATOM 0 HB ILE B 80 3.907 7.677 1.811 1.00 0.66 H new ATOM 0 HG12 ILE B 80 1.828 7.716 3.076 1.00 0.65 H new ATOM 0 HG13 ILE B 80 2.352 6.060 2.838 1.00 0.65 H new ATOM 0 HG21 ILE B 80 4.745 5.509 2.615 1.00 0.94 H new ATOM 0 HG22 ILE B 80 5.979 6.786 2.741 1.00 0.94 H new ATOM 0 HG23 ILE B 80 5.111 6.241 4.196 1.00 0.94 H new ATOM 0 HD11 ILE B 80 1.507 6.394 5.112 1.00 0.48 H new ATOM 0 HD12 ILE B 80 3.241 5.996 5.144 1.00 0.48 H new ATOM 0 HD13 ILE B 80 2.710 7.677 5.385 1.00 0.48 H new ATOM 2386 N ASN B 81 5.855 9.842 2.047 1.00 0.38 N ATOM 2387 CA ASN B 81 7.142 10.313 1.553 1.00 0.43 C ATOM 2388 C ASN B 81 7.751 11.322 2.521 1.00 0.45 C ATOM 2389 O ASN B 81 8.941 11.273 2.816 1.00 0.53 O ATOM 2390 CB ASN B 81 6.976 10.953 0.171 1.00 0.47 C ATOM 2391 CG ASN B 81 8.222 11.687 -0.290 1.00 0.57 C ATOM 2392 OD1 ASN B 81 9.293 11.098 -0.417 1.00 1.19 O ATOM 2393 ND2 ASN B 81 8.087 12.980 -0.549 1.00 0.95 N ATOM 0 H ASN B 81 5.074 10.023 1.416 1.00 0.38 H new ATOM 0 HA ASN B 81 7.812 9.457 1.472 1.00 0.43 H new ATOM 0 HB2 ASN B 81 6.726 10.179 -0.555 1.00 0.47 H new ATOM 0 HB3 ASN B 81 6.138 11.649 0.196 1.00 0.47 H new ATOM 0 HD21 ASN B 81 8.890 13.523 -0.866 1.00 0.95 H new ATOM 0 HD22 ASN B 81 7.180 13.432 -0.431 1.00 0.95 H new ATOM 2400 N ASN B 82 6.916 12.221 3.031 1.00 0.43 N ATOM 2401 CA ASN B 82 7.366 13.245 3.968 1.00 0.48 C ATOM 2402 C ASN B 82 7.873 12.619 5.265 1.00 0.44 C ATOM 2403 O ASN B 82 8.824 13.111 5.875 1.00 0.54 O ATOM 2404 CB ASN B 82 6.230 14.223 4.271 1.00 0.52 C ATOM 2405 CG ASN B 82 6.692 15.401 5.104 1.00 1.11 C ATOM 2406 OD1 ASN B 82 6.612 15.381 6.334 1.00 1.72 O ATOM 2407 ND2 ASN B 82 7.168 16.440 4.438 1.00 1.61 N ATOM 0 H ASN B 82 5.921 12.261 2.811 1.00 0.43 H new ATOM 0 HA ASN B 82 8.190 13.786 3.503 1.00 0.48 H new ATOM 0 HB2 ASN B 82 5.807 14.587 3.334 1.00 0.52 H new ATOM 0 HB3 ASN B 82 5.433 13.699 4.798 1.00 0.52 H new ATOM 0 HD21 ASN B 82 7.487 17.267 4.943 1.00 1.61 H new ATOM 0 HD22 ASN B 82 7.216 16.414 3.419 1.00 1.61 H new ATOM 2414 N TYR B 83 7.232 11.536 5.680 1.00 0.40 N ATOM 2415 CA TYR B 83 7.620 10.833 6.897 1.00 0.42 C ATOM 2416 C TYR B 83 8.954 10.119 6.691 1.00 0.37 C ATOM 2417 O TYR B 83 9.813 10.109 7.574 1.00 0.43 O ATOM 2418 CB TYR B 83 6.532 9.824 7.291 1.00 0.52 C ATOM 2419 CG TYR B 83 6.872 8.976 8.499 1.00 0.51 C ATOM 2420 CD1 TYR B 83 6.720 9.470 9.789 1.00 1.10 C ATOM 2421 CD2 TYR B 83 7.340 7.676 8.348 1.00 1.19 C ATOM 2422 CE1 TYR B 83 7.026 8.694 10.891 1.00 1.05 C ATOM 2423 CE2 TYR B 83 7.648 6.895 9.444 1.00 1.32 C ATOM 2424 CZ TYR B 83 7.489 7.408 10.712 1.00 0.69 C ATOM 2425 OH TYR B 83 7.798 6.632 11.807 1.00 0.84 O ATOM 0 H TYR B 83 6.438 11.123 5.191 1.00 0.40 H new ATOM 0 HA TYR B 83 7.734 11.559 7.702 1.00 0.42 H new ATOM 0 HB2 TYR B 83 5.607 10.365 7.491 1.00 0.52 H new ATOM 0 HB3 TYR B 83 6.340 9.166 6.443 1.00 0.52 H new ATOM 0 HD1 TYR B 83 6.357 10.477 9.933 1.00 1.10 H new ATOM 0 HD2 TYR B 83 7.465 7.269 7.355 1.00 1.19 H new ATOM 0 HE1 TYR B 83 6.903 9.093 11.887 1.00 1.05 H new ATOM 0 HE2 TYR B 83 8.012 5.887 9.308 1.00 1.32 H new ATOM 0 HH TYR B 83 7.646 5.688 11.592 1.00 0.84 H new ATOM 2435 N ALA B 84 9.124 9.543 5.511 1.00 0.38 N ATOM 2436 CA ALA B 84 10.338 8.815 5.176 1.00 0.42 C ATOM 2437 C ALA B 84 11.506 9.757 4.880 1.00 0.43 C ATOM 2438 O ALA B 84 12.598 9.595 5.433 1.00 0.46 O ATOM 2439 CB ALA B 84 10.076 7.904 3.989 1.00 0.53 C ATOM 0 H ALA B 84 8.430 9.566 4.764 1.00 0.38 H new ATOM 0 HA ALA B 84 10.621 8.215 6.041 1.00 0.42 H new ATOM 0 HB1 ALA B 84 10.987 7.360 3.740 1.00 0.53 H new ATOM 0 HB2 ALA B 84 9.287 7.195 4.241 1.00 0.53 H new ATOM 0 HB3 ALA B 84 9.765 8.502 3.133 1.00 0.53 H new ATOM 2445 N GLN B 85 11.271 10.749 4.024 1.00 0.54 N ATOM 2446 CA GLN B 85 12.304 11.716 3.641 1.00 0.62 C ATOM 2447 C GLN B 85 12.796 12.501 4.855 1.00 0.61 C ATOM 2448 O GLN B 85 13.854 13.130 4.819 1.00 0.70 O ATOM 2449 CB GLN B 85 11.763 12.679 2.578 1.00 0.76 C ATOM 2450 CG GLN B 85 12.836 13.269 1.677 1.00 1.12 C ATOM 2451 CD GLN B 85 13.151 12.397 0.477 1.00 1.17 C ATOM 2452 OE1 GLN B 85 12.530 12.525 -0.580 1.00 1.77 O ATOM 2453 NE2 GLN B 85 14.132 11.519 0.624 1.00 1.47 N ATOM 0 H GLN B 85 10.367 10.907 3.578 1.00 0.54 H new ATOM 0 HA GLN B 85 13.146 11.163 3.225 1.00 0.62 H new ATOM 0 HB2 GLN B 85 11.035 12.152 1.962 1.00 0.76 H new ATOM 0 HB3 GLN B 85 11.232 13.491 3.074 1.00 0.76 H new ATOM 0 HG2 GLN B 85 12.512 14.250 1.330 1.00 1.12 H new ATOM 0 HG3 GLN B 85 13.746 13.421 2.257 1.00 1.12 H new ATOM 0 HE21 GLN B 85 14.621 11.445 1.516 1.00 1.47 H new ATOM 0 HE22 GLN B 85 14.399 10.917 -0.155 1.00 1.47 H new ATOM 2462 N LYS B 86 12.020 12.455 5.927 1.00 0.62 N ATOM 2463 CA LYS B 86 12.363 13.140 7.162 1.00 0.68 C ATOM 2464 C LYS B 86 13.660 12.584 7.748 1.00 0.64 C ATOM 2465 O LYS B 86 14.456 13.318 8.335 1.00 0.76 O ATOM 2466 CB LYS B 86 11.227 12.977 8.168 1.00 0.74 C ATOM 2467 CG LYS B 86 11.392 13.806 9.426 1.00 1.15 C ATOM 2468 CD LYS B 86 10.213 13.615 10.358 1.00 1.51 C ATOM 2469 CE LYS B 86 10.058 14.791 11.298 1.00 2.02 C ATOM 2470 NZ LYS B 86 8.779 14.729 12.047 1.00 2.67 N ATOM 0 H LYS B 86 11.138 11.944 5.965 1.00 0.62 H new ATOM 0 HA LYS B 86 12.511 14.198 6.945 1.00 0.68 H new ATOM 0 HB2 LYS B 86 10.288 13.249 7.687 1.00 0.74 H new ATOM 0 HB3 LYS B 86 11.150 11.926 8.446 1.00 0.74 H new ATOM 0 HG2 LYS B 86 12.313 13.522 9.935 1.00 1.15 H new ATOM 0 HG3 LYS B 86 11.485 14.860 9.162 1.00 1.15 H new ATOM 0 HD2 LYS B 86 9.301 13.491 9.774 1.00 1.51 H new ATOM 0 HD3 LYS B 86 10.348 12.701 10.936 1.00 1.51 H new ATOM 0 HE2 LYS B 86 10.891 14.808 12.001 1.00 2.02 H new ATOM 0 HE3 LYS B 86 10.102 15.720 10.729 1.00 2.02 H new ATOM 0 HZ1 LYS B 86 8.708 15.551 12.681 1.00 2.67 H new ATOM 0 HZ2 LYS B 86 7.984 14.738 11.377 1.00 2.67 H new ATOM 0 HZ3 LYS B 86 8.748 13.855 12.609 1.00 2.67 H new ATOM 2484 N LEU B 87 13.879 11.288 7.557 1.00 0.61 N ATOM 2485 CA LEU B 87 15.071 10.624 8.076 1.00 0.66 C ATOM 2486 C LEU B 87 16.199 10.616 7.045 1.00 0.72 C ATOM 2487 O LEU B 87 17.059 9.731 7.051 1.00 0.87 O ATOM 2488 CB LEU B 87 14.735 9.190 8.499 1.00 0.69 C ATOM 2489 CG LEU B 87 14.043 9.053 9.857 1.00 0.69 C ATOM 2490 CD1 LEU B 87 12.534 9.190 9.709 1.00 0.75 C ATOM 2491 CD2 LEU B 87 14.399 7.722 10.505 1.00 0.77 C ATOM 0 H LEU B 87 13.245 10.674 7.045 1.00 0.61 H new ATOM 0 HA LEU B 87 15.414 11.185 8.946 1.00 0.66 H new ATOM 0 HB2 LEU B 87 14.095 8.745 7.737 1.00 0.69 H new ATOM 0 HB3 LEU B 87 15.657 8.609 8.520 1.00 0.69 H new ATOM 0 HG LEU B 87 14.396 9.856 10.504 1.00 0.69 H new ATOM 0 HD11 LEU B 87 12.062 9.089 10.686 1.00 0.75 H new ATOM 0 HD12 LEU B 87 12.297 10.168 9.290 1.00 0.75 H new ATOM 0 HD13 LEU B 87 12.161 8.411 9.044 1.00 0.75 H new ATOM 0 HD21 LEU B 87 13.898 7.642 11.470 1.00 0.77 H new ATOM 0 HD22 LEU B 87 14.076 6.905 9.859 1.00 0.77 H new ATOM 0 HD23 LEU B 87 15.478 7.665 10.650 1.00 0.77 H new ATOM 2503 N CYS B 88 16.201 11.603 6.163 1.00 0.73 N ATOM 2504 CA CYS B 88 17.231 11.709 5.137 1.00 0.83 C ATOM 2505 C CYS B 88 18.420 12.513 5.658 1.00 0.90 C ATOM 2506 O CYS B 88 19.221 13.035 4.886 1.00 1.14 O ATOM 2507 CB CYS B 88 16.658 12.371 3.882 1.00 0.89 C ATOM 2508 SG CYS B 88 17.020 11.489 2.345 1.00 1.71 S ATOM 0 H CYS B 88 15.501 12.344 6.136 1.00 0.73 H new ATOM 0 HA CYS B 88 17.573 10.706 4.882 1.00 0.83 H new ATOM 0 HB2 CYS B 88 15.577 12.457 3.992 1.00 0.89 H new ATOM 0 HB3 CYS B 88 17.053 13.384 3.807 1.00 0.89 H new ATOM 0 HG CYS B 88 16.680 12.227 1.331 1.00 1.71 H new ATOM 2514 N THR B 89 18.530 12.596 6.975 1.00 0.94 N ATOM 2515 CA THR B 89 19.598 13.341 7.617 1.00 1.06 C ATOM 2516 C THR B 89 20.923 12.581 7.606 1.00 1.12 C ATOM 2517 O THR B 89 21.934 13.078 7.108 1.00 1.75 O ATOM 2518 CB THR B 89 19.210 13.665 9.070 1.00 1.17 C ATOM 2519 OG1 THR B 89 18.570 12.522 9.665 1.00 1.74 O ATOM 2520 CG2 THR B 89 18.267 14.855 9.124 1.00 1.30 C ATOM 0 H THR B 89 17.883 12.150 7.625 1.00 0.94 H new ATOM 0 HA THR B 89 19.736 14.260 7.048 1.00 1.06 H new ATOM 0 HB THR B 89 20.117 13.912 9.622 1.00 1.17 H new ATOM 0 HG1 THR B 89 18.325 12.729 10.591 1.00 1.74 H new ATOM 0 HG21 THR B 89 18.006 15.066 10.161 1.00 1.30 H new ATOM 0 HG22 THR B 89 18.756 15.727 8.688 1.00 1.30 H new ATOM 0 HG23 THR B 89 17.362 14.628 8.561 1.00 1.30 H new ATOM 2528 N PHE B 90 20.910 11.370 8.149 1.00 0.82 N ATOM 2529 CA PHE B 90 22.117 10.552 8.234 1.00 0.84 C ATOM 2530 C PHE B 90 22.376 9.751 6.960 1.00 0.82 C ATOM 2531 O PHE B 90 23.503 9.323 6.714 1.00 1.55 O ATOM 2532 CB PHE B 90 22.040 9.611 9.443 1.00 0.93 C ATOM 2533 CG PHE B 90 20.738 8.864 9.571 1.00 0.90 C ATOM 2534 CD1 PHE B 90 19.664 9.423 10.249 1.00 1.35 C ATOM 2535 CD2 PHE B 90 20.592 7.601 9.021 1.00 1.07 C ATOM 2536 CE1 PHE B 90 18.472 8.737 10.374 1.00 1.51 C ATOM 2537 CE2 PHE B 90 19.403 6.911 9.143 1.00 1.20 C ATOM 2538 CZ PHE B 90 18.341 7.478 9.821 1.00 1.24 C ATOM 0 H PHE B 90 20.076 10.930 8.538 1.00 0.82 H new ATOM 0 HA PHE B 90 22.955 11.237 8.358 1.00 0.84 H new ATOM 0 HB2 PHE B 90 22.854 8.889 9.378 1.00 0.93 H new ATOM 0 HB3 PHE B 90 22.202 10.192 10.351 1.00 0.93 H new ATOM 0 HD1 PHE B 90 19.762 10.407 10.684 1.00 1.35 H new ATOM 0 HD2 PHE B 90 21.418 7.151 8.491 1.00 1.07 H new ATOM 0 HE1 PHE B 90 17.644 9.184 10.903 1.00 1.51 H new ATOM 0 HE2 PHE B 90 19.303 5.927 8.708 1.00 1.20 H new ATOM 0 HZ PHE B 90 17.411 6.938 9.918 1.00 1.24 H new ATOM 2548 N SER B 91 21.344 9.533 6.158 1.00 0.78 N ATOM 2549 CA SER B 91 21.491 8.777 4.918 1.00 0.66 C ATOM 2550 C SER B 91 20.379 9.127 3.939 1.00 0.58 C ATOM 2551 O SER B 91 19.330 9.635 4.342 1.00 0.67 O ATOM 2552 CB SER B 91 21.479 7.267 5.195 1.00 0.74 C ATOM 2553 OG SER B 91 22.530 6.890 6.069 1.00 1.42 O ATOM 0 H SER B 91 20.398 9.867 6.341 1.00 0.78 H new ATOM 0 HA SER B 91 22.450 9.046 4.476 1.00 0.66 H new ATOM 0 HB2 SER B 91 20.522 6.984 5.632 1.00 0.74 H new ATOM 0 HB3 SER B 91 21.573 6.723 4.255 1.00 0.74 H new ATOM 0 HG SER B 91 23.200 7.605 6.103 1.00 1.42 H new ATOM 2559 N PHE B 92 20.617 8.833 2.663 1.00 0.53 N ATOM 2560 CA PHE B 92 19.653 9.100 1.592 1.00 0.48 C ATOM 2561 C PHE B 92 18.366 8.296 1.791 1.00 0.46 C ATOM 2562 O PHE B 92 18.259 7.496 2.728 1.00 0.50 O ATOM 2563 CB PHE B 92 20.273 8.744 0.234 1.00 0.46 C ATOM 2564 CG PHE B 92 20.315 7.263 -0.038 1.00 0.39 C ATOM 2565 CD1 PHE B 92 21.166 6.434 0.677 1.00 1.02 C ATOM 2566 CD2 PHE B 92 19.492 6.702 -1.003 1.00 1.13 C ATOM 2567 CE1 PHE B 92 21.194 5.074 0.435 1.00 0.96 C ATOM 2568 CE2 PHE B 92 19.517 5.344 -1.250 1.00 1.19 C ATOM 2569 CZ PHE B 92 20.368 4.529 -0.530 1.00 0.45 C ATOM 0 H PHE B 92 21.483 8.403 2.340 1.00 0.53 H new ATOM 0 HA PHE B 92 19.404 10.161 1.619 1.00 0.48 H new ATOM 0 HB2 PHE B 92 19.704 9.234 -0.556 1.00 0.46 H new ATOM 0 HB3 PHE B 92 21.287 9.142 0.191 1.00 0.46 H new ATOM 0 HD1 PHE B 92 21.814 6.856 1.431 1.00 1.02 H new ATOM 0 HD2 PHE B 92 18.824 7.335 -1.568 1.00 1.13 H new ATOM 0 HE1 PHE B 92 21.860 4.438 0.999 1.00 0.96 H new ATOM 0 HE2 PHE B 92 18.872 4.920 -2.005 1.00 1.19 H new ATOM 0 HZ PHE B 92 20.388 3.466 -0.721 1.00 0.45 H new ATOM 2579 N LEU B 93 17.395 8.508 0.910 1.00 0.44 N ATOM 2580 CA LEU B 93 16.131 7.795 0.984 1.00 0.43 C ATOM 2581 C LEU B 93 15.320 7.984 -0.288 1.00 0.42 C ATOM 2582 O LEU B 93 15.081 9.110 -0.724 1.00 0.50 O ATOM 2583 CB LEU B 93 15.307 8.262 2.186 1.00 0.50 C ATOM 2584 CG LEU B 93 13.971 7.540 2.364 1.00 0.63 C ATOM 2585 CD1 LEU B 93 13.755 7.170 3.821 1.00 0.58 C ATOM 2586 CD2 LEU B 93 12.825 8.401 1.855 1.00 1.13 C ATOM 0 H LEU B 93 17.462 9.169 0.136 1.00 0.44 H new ATOM 0 HA LEU B 93 16.363 6.737 1.101 1.00 0.43 H new ATOM 0 HB2 LEU B 93 15.900 8.128 3.090 1.00 0.50 H new ATOM 0 HB3 LEU B 93 15.117 9.331 2.086 1.00 0.50 H new ATOM 0 HG LEU B 93 13.996 6.622 1.777 1.00 0.63 H new ATOM 0 HD11 LEU B 93 12.799 6.657 3.928 1.00 0.58 H new ATOM 0 HD12 LEU B 93 14.559 6.513 4.152 1.00 0.58 H new ATOM 0 HD13 LEU B 93 13.752 8.074 4.429 1.00 0.58 H new ATOM 0 HD21 LEU B 93 11.883 7.870 1.990 1.00 1.13 H new ATOM 0 HD22 LEU B 93 12.797 9.337 2.413 1.00 1.13 H new ATOM 0 HD23 LEU B 93 12.972 8.614 0.796 1.00 1.13 H new ATOM 2598 N ILE B 94 14.914 6.875 -0.881 1.00 0.42 N ATOM 2599 CA ILE B 94 14.099 6.902 -2.083 1.00 0.43 C ATOM 2600 C ILE B 94 12.756 6.244 -1.790 1.00 0.40 C ATOM 2601 O ILE B 94 12.654 5.020 -1.739 1.00 0.48 O ATOM 2602 CB ILE B 94 14.784 6.176 -3.261 1.00 0.50 C ATOM 2603 CG1 ILE B 94 16.223 6.672 -3.426 1.00 0.66 C ATOM 2604 CG2 ILE B 94 13.997 6.393 -4.548 1.00 0.65 C ATOM 2605 CD1 ILE B 94 17.064 5.821 -4.351 1.00 0.66 C ATOM 0 H ILE B 94 15.138 5.938 -0.546 1.00 0.42 H new ATOM 0 HA ILE B 94 13.959 7.943 -2.374 1.00 0.43 H new ATOM 0 HB ILE B 94 14.807 5.108 -3.045 1.00 0.50 H new ATOM 0 HG12 ILE B 94 16.203 7.693 -3.806 1.00 0.66 H new ATOM 0 HG13 ILE B 94 16.700 6.706 -2.446 1.00 0.66 H new ATOM 0 HG21 ILE B 94 14.493 5.875 -5.369 1.00 0.65 H new ATOM 0 HG22 ILE B 94 12.987 6.000 -4.428 1.00 0.65 H new ATOM 0 HG23 ILE B 94 13.947 7.459 -4.769 1.00 0.65 H new ATOM 0 HD11 ILE B 94 18.069 6.238 -4.415 1.00 0.66 H new ATOM 0 HD12 ILE B 94 17.117 4.804 -3.962 1.00 0.66 H new ATOM 0 HD13 ILE B 94 16.613 5.807 -5.343 1.00 0.66 H new ATOM 2617 N CYS B 95 11.739 7.062 -1.560 1.00 0.37 N ATOM 2618 CA CYS B 95 10.407 6.560 -1.257 1.00 0.39 C ATOM 2619 C CYS B 95 9.533 6.571 -2.506 1.00 0.41 C ATOM 2620 O CYS B 95 9.447 7.581 -3.207 1.00 0.60 O ATOM 2621 CB CYS B 95 9.763 7.406 -0.154 1.00 0.45 C ATOM 2622 SG CYS B 95 8.164 6.786 0.423 1.00 0.56 S ATOM 0 H CYS B 95 11.812 8.079 -1.578 1.00 0.37 H new ATOM 0 HA CYS B 95 10.496 5.531 -0.907 1.00 0.39 H new ATOM 0 HB2 CYS B 95 10.446 7.458 0.693 1.00 0.45 H new ATOM 0 HB3 CYS B 95 9.633 8.424 -0.522 1.00 0.45 H new ATOM 0 HG CYS B 95 7.905 7.281 1.597 1.00 0.56 H new ATOM 2628 N LYS B 96 8.898 5.442 -2.784 1.00 0.36 N ATOM 2629 CA LYS B 96 8.029 5.316 -3.943 1.00 0.40 C ATOM 2630 C LYS B 96 6.786 4.515 -3.590 1.00 0.41 C ATOM 2631 O LYS B 96 6.784 3.746 -2.628 1.00 0.70 O ATOM 2632 CB LYS B 96 8.764 4.630 -5.097 1.00 0.49 C ATOM 2633 CG LYS B 96 8.848 5.469 -6.362 1.00 0.88 C ATOM 2634 CD LYS B 96 9.928 6.530 -6.255 1.00 1.25 C ATOM 2635 CE LYS B 96 10.016 7.365 -7.520 1.00 1.61 C ATOM 2636 NZ LYS B 96 11.104 8.376 -7.446 1.00 2.13 N ATOM 0 H LYS B 96 8.970 4.596 -2.219 1.00 0.36 H new ATOM 0 HA LYS B 96 7.735 6.319 -4.254 1.00 0.40 H new ATOM 0 HB2 LYS B 96 9.774 4.378 -4.773 1.00 0.49 H new ATOM 0 HB3 LYS B 96 8.260 3.692 -5.328 1.00 0.49 H new ATOM 0 HG2 LYS B 96 9.054 4.823 -7.215 1.00 0.88 H new ATOM 0 HG3 LYS B 96 7.886 5.945 -6.548 1.00 0.88 H new ATOM 0 HD2 LYS B 96 9.719 7.178 -5.404 1.00 1.25 H new ATOM 0 HD3 LYS B 96 10.890 6.054 -6.065 1.00 1.25 H new ATOM 0 HE2 LYS B 96 10.187 6.711 -8.375 1.00 1.61 H new ATOM 0 HE3 LYS B 96 9.064 7.869 -7.689 1.00 1.61 H new ATOM 0 HZ1 LYS B 96 10.691 9.323 -7.325 1.00 2.13 H new ATOM 0 HZ2 LYS B 96 11.722 8.162 -6.637 1.00 2.13 H new ATOM 0 HZ3 LYS B 96 11.661 8.351 -8.324 1.00 2.13 H new ATOM 2650 N GLY B 97 5.733 4.704 -4.365 1.00 0.44 N ATOM 2651 CA GLY B 97 4.508 3.978 -4.130 1.00 0.43 C ATOM 2652 C GLY B 97 4.456 2.722 -4.966 1.00 0.41 C ATOM 2653 O GLY B 97 4.994 2.692 -6.074 1.00 0.53 O ATOM 0 H GLY B 97 5.705 5.349 -5.155 1.00 0.44 H new ATOM 0 HA2 GLY B 97 4.431 3.720 -3.074 1.00 0.43 H new ATOM 0 HA3 GLY B 97 3.654 4.612 -4.366 1.00 0.43 H new ATOM 2657 N VAL B 98 3.827 1.688 -4.444 1.00 0.35 N ATOM 2658 CA VAL B 98 3.726 0.426 -5.156 1.00 0.39 C ATOM 2659 C VAL B 98 2.332 0.243 -5.737 1.00 0.43 C ATOM 2660 O VAL B 98 1.339 0.230 -5.008 1.00 0.54 O ATOM 2661 CB VAL B 98 4.056 -0.768 -4.237 1.00 0.45 C ATOM 2662 CG1 VAL B 98 4.137 -2.056 -5.039 1.00 0.59 C ATOM 2663 CG2 VAL B 98 5.354 -0.525 -3.484 1.00 0.64 C ATOM 0 H VAL B 98 3.377 1.695 -3.529 1.00 0.35 H new ATOM 0 HA VAL B 98 4.454 0.455 -5.966 1.00 0.39 H new ATOM 0 HB VAL B 98 3.252 -0.868 -3.508 1.00 0.45 H new ATOM 0 HG11 VAL B 98 4.371 -2.886 -4.372 1.00 0.59 H new ATOM 0 HG12 VAL B 98 3.180 -2.241 -5.527 1.00 0.59 H new ATOM 0 HG13 VAL B 98 4.918 -1.966 -5.794 1.00 0.59 H new ATOM 0 HG21 VAL B 98 5.568 -1.379 -2.842 1.00 0.64 H new ATOM 0 HG22 VAL B 98 6.169 -0.394 -4.196 1.00 0.64 H new ATOM 0 HG23 VAL B 98 5.258 0.373 -2.873 1.00 0.64 H new ATOM 2673 N ASN B 99 2.265 0.110 -7.055 1.00 0.47 N ATOM 2674 CA ASN B 99 0.994 -0.075 -7.744 1.00 0.59 C ATOM 2675 C ASN B 99 0.621 -1.550 -7.754 1.00 0.58 C ATOM 2676 O ASN B 99 -0.555 -1.907 -7.747 1.00 0.75 O ATOM 2677 CB ASN B 99 1.068 0.445 -9.185 1.00 0.75 C ATOM 2678 CG ASN B 99 1.022 1.960 -9.278 1.00 0.90 C ATOM 2679 OD1 ASN B 99 0.518 2.638 -8.387 1.00 1.73 O ATOM 2680 ND2 ASN B 99 1.550 2.500 -10.367 1.00 1.12 N ATOM 0 H ASN B 99 3.078 0.127 -7.670 1.00 0.47 H new ATOM 0 HA ASN B 99 0.232 0.493 -7.210 1.00 0.59 H new ATOM 0 HB2 ASN B 99 1.988 0.087 -9.647 1.00 0.75 H new ATOM 0 HB3 ASN B 99 0.240 0.027 -9.758 1.00 0.75 H new ATOM 0 HD21 ASN B 99 1.547 3.513 -10.487 1.00 1.12 H new ATOM 0 HD22 ASN B 99 1.960 1.903 -11.085 1.00 1.12 H new ATOM 2687 N LYS B 100 1.638 -2.404 -7.773 1.00 0.59 N ATOM 2688 CA LYS B 100 1.431 -3.847 -7.784 1.00 0.64 C ATOM 2689 C LYS B 100 2.190 -4.495 -6.632 1.00 0.54 C ATOM 2690 O LYS B 100 3.362 -4.842 -6.769 1.00 0.53 O ATOM 2691 CB LYS B 100 1.889 -4.445 -9.117 1.00 0.74 C ATOM 2692 CG LYS B 100 1.112 -3.924 -10.313 1.00 1.19 C ATOM 2693 CD LYS B 100 1.388 -4.746 -11.564 1.00 1.37 C ATOM 2694 CE LYS B 100 0.396 -4.425 -12.670 1.00 1.82 C ATOM 2695 NZ LYS B 100 -1.010 -4.617 -12.230 1.00 2.39 N ATOM 0 H LYS B 100 2.618 -2.120 -7.781 1.00 0.59 H new ATOM 0 HA LYS B 100 0.366 -4.044 -7.662 1.00 0.64 H new ATOM 0 HB2 LYS B 100 2.948 -4.228 -9.259 1.00 0.74 H new ATOM 0 HB3 LYS B 100 1.789 -5.530 -9.073 1.00 0.74 H new ATOM 0 HG2 LYS B 100 0.045 -3.945 -10.091 1.00 1.19 H new ATOM 0 HG3 LYS B 100 1.379 -2.883 -10.495 1.00 1.19 H new ATOM 0 HD2 LYS B 100 2.401 -4.549 -11.914 1.00 1.37 H new ATOM 0 HD3 LYS B 100 1.335 -5.808 -11.322 1.00 1.37 H new ATOM 0 HE2 LYS B 100 0.537 -3.394 -12.995 1.00 1.82 H new ATOM 0 HE3 LYS B 100 0.596 -5.061 -13.532 1.00 1.82 H new ATOM 0 HZ1 LYS B 100 -1.558 -5.051 -13.000 1.00 2.39 H new ATOM 0 HZ2 LYS B 100 -1.031 -5.239 -11.397 1.00 2.39 H new ATOM 0 HZ3 LYS B 100 -1.426 -3.696 -11.985 1.00 2.39 H new ATOM 2709 N GLU B 101 1.506 -4.661 -5.509 1.00 0.63 N ATOM 2710 CA GLU B 101 2.094 -5.240 -4.300 1.00 0.66 C ATOM 2711 C GLU B 101 2.518 -6.696 -4.506 1.00 0.60 C ATOM 2712 O GLU B 101 3.686 -7.045 -4.319 1.00 0.65 O ATOM 2713 CB GLU B 101 1.104 -5.143 -3.126 1.00 0.86 C ATOM 2714 CG GLU B 101 -0.333 -4.821 -3.534 1.00 2.04 C ATOM 2715 CD GLU B 101 -1.026 -5.972 -4.240 1.00 2.82 C ATOM 2716 OE1 GLU B 101 -0.726 -6.207 -5.434 1.00 3.40 O ATOM 2717 OE2 GLU B 101 -1.862 -6.646 -3.613 1.00 3.42 O ATOM 0 H GLU B 101 0.526 -4.399 -5.406 1.00 0.63 H new ATOM 0 HA GLU B 101 2.991 -4.665 -4.069 1.00 0.66 H new ATOM 0 HB2 GLU B 101 1.111 -6.088 -2.582 1.00 0.86 H new ATOM 0 HB3 GLU B 101 1.453 -4.375 -2.435 1.00 0.86 H new ATOM 0 HG2 GLU B 101 -0.904 -4.551 -2.646 1.00 2.04 H new ATOM 0 HG3 GLU B 101 -0.331 -3.950 -4.189 1.00 2.04 H new ATOM 2724 N TYR B 102 1.567 -7.534 -4.901 1.00 0.55 N ATOM 2725 CA TYR B 102 1.821 -8.955 -5.117 1.00 0.56 C ATOM 2726 C TYR B 102 2.885 -9.161 -6.190 1.00 0.48 C ATOM 2727 O TYR B 102 3.744 -10.036 -6.071 1.00 0.57 O ATOM 2728 CB TYR B 102 0.519 -9.658 -5.513 1.00 0.66 C ATOM 2729 CG TYR B 102 0.582 -11.170 -5.468 1.00 0.71 C ATOM 2730 CD1 TYR B 102 0.992 -11.840 -4.320 1.00 0.89 C ATOM 2731 CD2 TYR B 102 0.220 -11.925 -6.574 1.00 0.77 C ATOM 2732 CE1 TYR B 102 1.038 -13.223 -4.281 1.00 1.00 C ATOM 2733 CE2 TYR B 102 0.259 -13.305 -6.541 1.00 0.89 C ATOM 2734 CZ TYR B 102 0.669 -13.950 -5.395 1.00 0.94 C ATOM 2735 OH TYR B 102 0.704 -15.329 -5.364 1.00 1.09 O ATOM 0 H TYR B 102 0.604 -7.251 -5.080 1.00 0.55 H new ATOM 0 HA TYR B 102 2.193 -9.388 -4.188 1.00 0.56 H new ATOM 0 HB2 TYR B 102 -0.277 -9.320 -4.850 1.00 0.66 H new ATOM 0 HB3 TYR B 102 0.246 -9.348 -6.522 1.00 0.66 H new ATOM 0 HD1 TYR B 102 1.279 -11.273 -3.447 1.00 0.89 H new ATOM 0 HD2 TYR B 102 -0.098 -11.425 -7.477 1.00 0.77 H new ATOM 0 HE1 TYR B 102 1.361 -13.730 -3.384 1.00 1.00 H new ATOM 0 HE2 TYR B 102 -0.031 -13.876 -7.410 1.00 0.89 H new ATOM 0 HH TYR B 102 0.412 -15.683 -6.230 1.00 1.09 H new ATOM 2745 N LEU B 103 2.840 -8.331 -7.219 1.00 0.51 N ATOM 2746 CA LEU B 103 3.789 -8.425 -8.318 1.00 0.49 C ATOM 2747 C LEU B 103 5.183 -7.997 -7.874 1.00 0.46 C ATOM 2748 O LEU B 103 6.166 -8.683 -8.154 1.00 0.53 O ATOM 2749 CB LEU B 103 3.327 -7.572 -9.500 1.00 0.56 C ATOM 2750 CG LEU B 103 2.419 -8.280 -10.511 1.00 0.62 C ATOM 2751 CD1 LEU B 103 3.159 -9.421 -11.189 1.00 1.05 C ATOM 2752 CD2 LEU B 103 1.155 -8.792 -9.840 1.00 1.19 C ATOM 0 H LEU B 103 2.155 -7.582 -7.317 1.00 0.51 H new ATOM 0 HA LEU B 103 3.835 -9.467 -8.634 1.00 0.49 H new ATOM 0 HB2 LEU B 103 2.799 -6.701 -9.112 1.00 0.56 H new ATOM 0 HB3 LEU B 103 4.208 -7.203 -10.025 1.00 0.56 H new ATOM 0 HG LEU B 103 2.131 -7.554 -11.271 1.00 0.62 H new ATOM 0 HD11 LEU B 103 2.497 -9.911 -11.903 1.00 1.05 H new ATOM 0 HD12 LEU B 103 4.031 -9.029 -11.713 1.00 1.05 H new ATOM 0 HD13 LEU B 103 3.481 -10.143 -10.438 1.00 1.05 H new ATOM 0 HD21 LEU B 103 0.527 -9.290 -10.579 1.00 1.19 H new ATOM 0 HD22 LEU B 103 1.421 -9.499 -9.054 1.00 1.19 H new ATOM 0 HD23 LEU B 103 0.609 -7.955 -9.406 1.00 1.19 H new ATOM 2764 N MET B 104 5.268 -6.874 -7.167 1.00 0.47 N ATOM 2765 CA MET B 104 6.555 -6.377 -6.699 1.00 0.47 C ATOM 2766 C MET B 104 7.172 -7.342 -5.698 1.00 0.44 C ATOM 2767 O MET B 104 8.382 -7.563 -5.710 1.00 0.52 O ATOM 2768 CB MET B 104 6.426 -4.988 -6.077 1.00 0.55 C ATOM 2769 CG MET B 104 7.771 -4.358 -5.751 1.00 0.59 C ATOM 2770 SD MET B 104 7.636 -2.639 -5.231 1.00 1.21 S ATOM 2771 CE MET B 104 9.359 -2.239 -4.954 1.00 0.88 C ATOM 0 H MET B 104 4.468 -6.296 -6.908 1.00 0.47 H new ATOM 0 HA MET B 104 7.211 -6.300 -7.566 1.00 0.47 H new ATOM 0 HB2 MET B 104 5.883 -4.338 -6.762 1.00 0.55 H new ATOM 0 HB3 MET B 104 5.833 -5.057 -5.165 1.00 0.55 H new ATOM 0 HG2 MET B 104 8.254 -4.934 -4.961 1.00 0.59 H new ATOM 0 HG3 MET B 104 8.416 -4.417 -6.628 1.00 0.59 H new ATOM 0 HE1 MET B 104 9.454 -1.651 -4.041 1.00 0.88 H new ATOM 0 HE2 MET B 104 9.935 -3.159 -4.854 1.00 0.88 H new ATOM 0 HE3 MET B 104 9.739 -1.663 -5.798 1.00 0.88 H new ATOM 2781 N TYR B 105 6.344 -7.927 -4.835 1.00 0.50 N ATOM 2782 CA TYR B 105 6.843 -8.882 -3.855 1.00 0.50 C ATOM 2783 C TYR B 105 7.417 -10.101 -4.568 1.00 0.42 C ATOM 2784 O TYR B 105 8.437 -10.649 -4.151 1.00 0.44 O ATOM 2785 CB TYR B 105 5.747 -9.315 -2.873 1.00 0.57 C ATOM 2786 CG TYR B 105 6.249 -10.289 -1.827 1.00 0.56 C ATOM 2787 CD1 TYR B 105 7.085 -9.863 -0.802 1.00 0.59 C ATOM 2788 CD2 TYR B 105 5.912 -11.637 -1.881 1.00 0.59 C ATOM 2789 CE1 TYR B 105 7.569 -10.751 0.142 1.00 0.64 C ATOM 2790 CE2 TYR B 105 6.398 -12.531 -0.945 1.00 0.63 C ATOM 2791 CZ TYR B 105 7.224 -12.083 0.065 1.00 0.64 C ATOM 2792 OH TYR B 105 7.722 -12.976 0.991 1.00 0.73 O ATOM 0 H TYR B 105 5.339 -7.758 -4.796 1.00 0.50 H new ATOM 0 HA TYR B 105 7.627 -8.391 -3.279 1.00 0.50 H new ATOM 0 HB2 TYR B 105 5.341 -8.434 -2.377 1.00 0.57 H new ATOM 0 HB3 TYR B 105 4.929 -9.774 -3.428 1.00 0.57 H new ATOM 0 HD1 TYR B 105 7.362 -8.821 -0.741 1.00 0.59 H new ATOM 0 HD2 TYR B 105 5.261 -11.991 -2.666 1.00 0.59 H new ATOM 0 HE1 TYR B 105 8.214 -10.402 0.935 1.00 0.64 H new ATOM 0 HE2 TYR B 105 6.132 -13.576 -1.004 1.00 0.63 H new ATOM 0 HH TYR B 105 7.858 -12.518 1.847 1.00 0.73 H new ATOM 2802 N SER B 106 6.766 -10.509 -5.654 1.00 0.46 N ATOM 2803 CA SER B 106 7.222 -11.653 -6.436 1.00 0.45 C ATOM 2804 C SER B 106 8.561 -11.338 -7.103 1.00 0.40 C ATOM 2805 O SER B 106 9.375 -12.228 -7.340 1.00 0.43 O ATOM 2806 CB SER B 106 6.175 -12.037 -7.486 1.00 0.52 C ATOM 2807 OG SER B 106 4.927 -12.334 -6.876 1.00 1.24 O ATOM 0 H SER B 106 5.921 -10.064 -6.012 1.00 0.46 H new ATOM 0 HA SER B 106 7.360 -12.501 -5.765 1.00 0.45 H new ATOM 0 HB2 SER B 106 6.051 -11.220 -8.197 1.00 0.52 H new ATOM 0 HB3 SER B 106 6.522 -12.902 -8.052 1.00 0.52 H new ATOM 0 HG SER B 106 4.500 -11.502 -6.583 1.00 1.24 H new ATOM 2813 N ALA B 107 8.785 -10.061 -7.395 1.00 0.43 N ATOM 2814 CA ALA B 107 10.032 -9.626 -8.003 1.00 0.44 C ATOM 2815 C ALA B 107 11.111 -9.496 -6.933 1.00 0.45 C ATOM 2816 O ALA B 107 12.291 -9.717 -7.192 1.00 0.56 O ATOM 2817 CB ALA B 107 9.842 -8.307 -8.736 1.00 0.49 C ATOM 0 H ALA B 107 8.117 -9.310 -7.219 1.00 0.43 H new ATOM 0 HA ALA B 107 10.346 -10.373 -8.732 1.00 0.44 H new ATOM 0 HB1 ALA B 107 10.787 -8.000 -9.183 1.00 0.49 H new ATOM 0 HB2 ALA B 107 9.093 -8.430 -9.519 1.00 0.49 H new ATOM 0 HB3 ALA B 107 9.509 -7.544 -8.032 1.00 0.49 H new ATOM 2823 N LEU B 108 10.679 -9.157 -5.722 1.00 0.42 N ATOM 2824 CA LEU B 108 11.583 -8.996 -4.588 1.00 0.48 C ATOM 2825 C LEU B 108 11.968 -10.346 -3.992 1.00 0.49 C ATOM 2826 O LEU B 108 12.663 -10.413 -2.978 1.00 0.58 O ATOM 2827 CB LEU B 108 10.933 -8.122 -3.515 1.00 0.54 C ATOM 2828 CG LEU B 108 10.994 -6.619 -3.779 1.00 0.60 C ATOM 2829 CD1 LEU B 108 10.156 -5.867 -2.761 1.00 0.74 C ATOM 2830 CD2 LEU B 108 12.435 -6.133 -3.746 1.00 0.67 C ATOM 0 H LEU B 108 9.698 -8.987 -5.500 1.00 0.42 H new ATOM 0 HA LEU B 108 12.490 -8.511 -4.949 1.00 0.48 H new ATOM 0 HB2 LEU B 108 9.888 -8.415 -3.414 1.00 0.54 H new ATOM 0 HB3 LEU B 108 11.416 -8.327 -2.560 1.00 0.54 H new ATOM 0 HG LEU B 108 10.587 -6.425 -4.771 1.00 0.60 H new ATOM 0 HD11 LEU B 108 10.211 -4.797 -2.964 1.00 0.74 H new ATOM 0 HD12 LEU B 108 9.119 -6.197 -2.828 1.00 0.74 H new ATOM 0 HD13 LEU B 108 10.536 -6.066 -1.759 1.00 0.74 H new ATOM 0 HD21 LEU B 108 12.462 -5.060 -3.936 1.00 0.67 H new ATOM 0 HD22 LEU B 108 12.866 -6.339 -2.766 1.00 0.67 H new ATOM 0 HD23 LEU B 108 13.011 -6.651 -4.512 1.00 0.67 H new ATOM 2842 N THR B 109 11.495 -11.412 -4.609 1.00 0.45 N ATOM 2843 CA THR B 109 11.799 -12.758 -4.159 1.00 0.50 C ATOM 2844 C THR B 109 12.424 -13.545 -5.305 1.00 0.51 C ATOM 2845 O THR B 109 12.163 -14.737 -5.487 1.00 0.58 O ATOM 2846 CB THR B 109 10.533 -13.476 -3.651 1.00 0.52 C ATOM 2847 OG1 THR B 109 9.412 -13.142 -4.477 1.00 0.55 O ATOM 2848 CG2 THR B 109 10.227 -13.093 -2.210 1.00 0.55 C ATOM 0 H THR B 109 10.893 -11.371 -5.431 1.00 0.45 H new ATOM 0 HA THR B 109 12.503 -12.696 -3.329 1.00 0.50 H new ATOM 0 HB THR B 109 10.717 -14.549 -3.697 1.00 0.52 H new ATOM 0 HG1 THR B 109 9.109 -12.234 -4.266 1.00 0.55 H new ATOM 0 HG21 THR B 109 9.329 -13.614 -1.878 1.00 0.55 H new ATOM 0 HG22 THR B 109 11.066 -13.373 -1.573 1.00 0.55 H new ATOM 0 HG23 THR B 109 10.067 -12.017 -2.146 1.00 0.55 H new ATOM 2856 N ARG B 110 13.252 -12.855 -6.080 1.00 0.47 N ATOM 2857 CA ARG B 110 13.909 -13.459 -7.228 1.00 0.52 C ATOM 2858 C ARG B 110 15.411 -13.594 -6.997 1.00 0.52 C ATOM 2859 O ARG B 110 15.873 -13.591 -5.857 1.00 0.55 O ATOM 2860 CB ARG B 110 13.624 -12.639 -8.488 1.00 0.55 C ATOM 2861 CG ARG B 110 12.145 -12.589 -8.840 1.00 1.21 C ATOM 2862 CD ARG B 110 11.915 -12.151 -10.276 1.00 1.48 C ATOM 2863 NE ARG B 110 12.550 -13.058 -11.229 1.00 1.91 N ATOM 2864 CZ ARG B 110 12.097 -14.278 -11.524 1.00 2.40 C ATOM 2865 NH1 ARG B 110 10.992 -14.745 -10.949 1.00 3.00 N ATOM 2866 NH2 ARG B 110 12.754 -15.027 -12.396 1.00 2.94 N ATOM 0 H ARG B 110 13.484 -11.873 -5.932 1.00 0.47 H new ATOM 0 HA ARG B 110 13.506 -14.463 -7.365 1.00 0.52 H new ATOM 0 HB2 ARG B 110 13.993 -11.623 -8.345 1.00 0.55 H new ATOM 0 HB3 ARG B 110 14.177 -13.065 -9.325 1.00 0.55 H new ATOM 0 HG2 ARG B 110 11.703 -13.573 -8.686 1.00 1.21 H new ATOM 0 HG3 ARG B 110 11.635 -11.901 -8.165 1.00 1.21 H new ATOM 0 HD2 ARG B 110 10.844 -12.106 -10.475 1.00 1.48 H new ATOM 0 HD3 ARG B 110 12.308 -11.144 -10.416 1.00 1.48 H new ATOM 0 HE ARG B 110 13.396 -12.737 -11.700 1.00 1.91 H new ATOM 0 HH11 ARG B 110 10.484 -14.169 -10.277 1.00 3.00 H new ATOM 0 HH12 ARG B 110 10.652 -15.679 -11.180 1.00 3.00 H new ATOM 0 HH21 ARG B 110 13.601 -14.671 -12.838 1.00 2.94 H new ATOM 0 HH22 ARG B 110 12.413 -15.960 -12.626 1.00 2.94 H new ATOM 2880 N ASP B 111 16.166 -13.698 -8.082 1.00 0.53 N ATOM 2881 CA ASP B 111 17.615 -13.865 -7.999 1.00 0.59 C ATOM 2882 C ASP B 111 18.331 -12.628 -7.436 1.00 0.64 C ATOM 2883 O ASP B 111 19.064 -12.743 -6.452 1.00 0.65 O ATOM 2884 CB ASP B 111 18.194 -14.229 -9.369 1.00 0.67 C ATOM 2885 CG ASP B 111 19.675 -14.533 -9.301 1.00 1.37 C ATOM 2886 OD1 ASP B 111 20.039 -15.594 -8.751 1.00 2.16 O ATOM 2887 OD2 ASP B 111 20.480 -13.718 -9.795 1.00 2.04 O ATOM 0 H ASP B 111 15.800 -13.670 -9.034 1.00 0.53 H new ATOM 0 HA ASP B 111 17.792 -14.681 -7.299 1.00 0.59 H new ATOM 0 HB2 ASP B 111 17.665 -15.095 -9.767 1.00 0.67 H new ATOM 0 HB3 ASP B 111 18.025 -13.406 -10.063 1.00 0.67 H new ATOM 2892 N PRO B 112 18.144 -11.428 -8.031 1.00 0.71 N ATOM 2893 CA PRO B 112 18.818 -10.212 -7.559 1.00 0.74 C ATOM 2894 C PRO B 112 18.276 -9.706 -6.225 1.00 0.66 C ATOM 2895 O PRO B 112 19.029 -9.227 -5.380 1.00 0.68 O ATOM 2896 CB PRO B 112 18.539 -9.183 -8.668 1.00 0.87 C ATOM 2897 CG PRO B 112 17.989 -9.969 -9.813 1.00 0.90 C ATOM 2898 CD PRO B 112 17.293 -11.141 -9.196 1.00 0.80 C ATOM 0 HA PRO B 112 19.877 -10.395 -7.380 1.00 0.74 H new ATOM 0 HB2 PRO B 112 17.828 -8.428 -8.333 1.00 0.87 H new ATOM 0 HB3 PRO B 112 19.450 -8.658 -8.954 1.00 0.87 H new ATOM 0 HG2 PRO B 112 17.298 -9.369 -10.405 1.00 0.90 H new ATOM 0 HG3 PRO B 112 18.784 -10.294 -10.484 1.00 0.90 H new ATOM 0 HD2 PRO B 112 16.271 -10.900 -8.904 1.00 0.80 H new ATOM 0 HD3 PRO B 112 17.238 -11.988 -9.879 1.00 0.80 H new ATOM 2906 N PHE B 113 16.973 -9.828 -6.037 1.00 0.60 N ATOM 2907 CA PHE B 113 16.337 -9.356 -4.819 1.00 0.54 C ATOM 2908 C PHE B 113 16.124 -10.499 -3.835 1.00 0.50 C ATOM 2909 O PHE B 113 15.265 -11.356 -4.035 1.00 0.55 O ATOM 2910 CB PHE B 113 15.009 -8.679 -5.156 1.00 0.55 C ATOM 2911 CG PHE B 113 15.130 -7.647 -6.243 1.00 0.56 C ATOM 2912 CD1 PHE B 113 15.557 -6.362 -5.952 1.00 0.62 C ATOM 2913 CD2 PHE B 113 14.824 -7.965 -7.557 1.00 0.82 C ATOM 2914 CE1 PHE B 113 15.674 -5.414 -6.948 1.00 0.65 C ATOM 2915 CE2 PHE B 113 14.938 -7.020 -8.558 1.00 0.84 C ATOM 2916 CZ PHE B 113 15.364 -5.744 -8.254 1.00 0.62 C ATOM 0 H PHE B 113 16.335 -10.250 -6.712 1.00 0.60 H new ATOM 0 HA PHE B 113 16.994 -8.628 -4.344 1.00 0.54 H new ATOM 0 HB2 PHE B 113 14.289 -9.438 -5.463 1.00 0.55 H new ATOM 0 HB3 PHE B 113 14.611 -8.207 -4.258 1.00 0.55 H new ATOM 0 HD1 PHE B 113 15.801 -6.099 -4.933 1.00 0.62 H new ATOM 0 HD2 PHE B 113 14.493 -8.963 -7.801 1.00 0.82 H new ATOM 0 HE1 PHE B 113 16.007 -4.415 -6.707 1.00 0.65 H new ATOM 0 HE2 PHE B 113 14.694 -7.280 -9.577 1.00 0.84 H new ATOM 0 HZ PHE B 113 15.455 -5.004 -9.035 1.00 0.62 H new ATOM 2926 N SER B 114 16.926 -10.505 -2.781 1.00 0.47 N ATOM 2927 CA SER B 114 16.851 -11.535 -1.755 1.00 0.48 C ATOM 2928 C SER B 114 15.881 -11.140 -0.638 1.00 0.45 C ATOM 2929 O SER B 114 15.471 -9.979 -0.534 1.00 0.70 O ATOM 2930 CB SER B 114 18.247 -11.782 -1.186 1.00 0.54 C ATOM 2931 OG SER B 114 19.209 -11.842 -2.229 1.00 1.23 O ATOM 0 H SER B 114 17.644 -9.800 -2.613 1.00 0.47 H new ATOM 0 HA SER B 114 16.473 -12.451 -2.208 1.00 0.48 H new ATOM 0 HB2 SER B 114 18.508 -10.985 -0.489 1.00 0.54 H new ATOM 0 HB3 SER B 114 18.256 -12.715 -0.622 1.00 0.54 H new ATOM 0 HG SER B 114 20.097 -11.999 -1.846 1.00 1.23 H new ATOM 2937 N VAL B 115 15.519 -12.113 0.193 1.00 0.48 N ATOM 2938 CA VAL B 115 14.596 -11.889 1.300 1.00 0.44 C ATOM 2939 C VAL B 115 15.337 -11.912 2.633 1.00 0.46 C ATOM 2940 O VAL B 115 16.299 -12.662 2.801 1.00 0.68 O ATOM 2941 CB VAL B 115 13.485 -12.964 1.327 1.00 0.47 C ATOM 2942 CG1 VAL B 115 12.333 -12.538 2.227 1.00 0.49 C ATOM 2943 CG2 VAL B 115 12.986 -13.265 -0.078 1.00 0.49 C ATOM 0 H VAL B 115 15.855 -13.073 0.119 1.00 0.48 H new ATOM 0 HA VAL B 115 14.142 -10.909 1.150 1.00 0.44 H new ATOM 0 HB VAL B 115 13.915 -13.877 1.738 1.00 0.47 H new ATOM 0 HG11 VAL B 115 11.566 -13.312 2.227 1.00 0.49 H new ATOM 0 HG12 VAL B 115 12.700 -12.390 3.243 1.00 0.49 H new ATOM 0 HG13 VAL B 115 11.907 -11.606 1.856 1.00 0.49 H new ATOM 0 HG21 VAL B 115 12.205 -14.024 -0.032 1.00 0.49 H new ATOM 0 HG22 VAL B 115 12.582 -12.356 -0.523 1.00 0.49 H new ATOM 0 HG23 VAL B 115 13.813 -13.631 -0.687 1.00 0.49 H new ATOM 2953 N ILE B 116 14.897 -11.086 3.576 1.00 0.39 N ATOM 2954 CA ILE B 116 15.525 -11.031 4.888 1.00 0.43 C ATOM 2955 C ILE B 116 14.495 -11.242 5.996 1.00 0.45 C ATOM 2956 O ILE B 116 14.388 -12.330 6.563 1.00 0.54 O ATOM 2957 CB ILE B 116 16.248 -9.687 5.123 1.00 0.44 C ATOM 2958 CG1 ILE B 116 16.994 -9.242 3.863 1.00 0.55 C ATOM 2959 CG2 ILE B 116 17.217 -9.815 6.289 1.00 0.55 C ATOM 2960 CD1 ILE B 116 17.429 -7.794 3.894 1.00 0.97 C ATOM 0 H ILE B 116 14.110 -10.448 3.456 1.00 0.39 H new ATOM 0 HA ILE B 116 16.262 -11.834 4.915 1.00 0.43 H new ATOM 0 HB ILE B 116 15.500 -8.931 5.361 1.00 0.44 H new ATOM 0 HG12 ILE B 116 17.872 -9.873 3.729 1.00 0.55 H new ATOM 0 HG13 ILE B 116 16.352 -9.401 2.996 1.00 0.55 H new ATOM 0 HG21 ILE B 116 17.723 -8.863 6.448 1.00 0.55 H new ATOM 0 HG22 ILE B 116 16.668 -10.089 7.190 1.00 0.55 H new ATOM 0 HG23 ILE B 116 17.955 -10.585 6.066 1.00 0.55 H new ATOM 0 HD11 ILE B 116 17.951 -7.551 2.968 1.00 0.97 H new ATOM 0 HD12 ILE B 116 16.553 -7.153 3.996 1.00 0.97 H new ATOM 0 HD13 ILE B 116 18.097 -7.633 4.740 1.00 0.97 H new ATOM 2972 N GLU B 117 13.727 -10.201 6.294 1.00 0.42 N ATOM 2973 CA GLU B 117 12.716 -10.273 7.343 1.00 0.50 C ATOM 2974 C GLU B 117 11.349 -9.870 6.806 1.00 0.43 C ATOM 2975 O GLU B 117 11.256 -9.033 5.903 1.00 0.68 O ATOM 2976 CB GLU B 117 13.096 -9.357 8.513 1.00 0.64 C ATOM 2977 CG GLU B 117 14.539 -9.500 8.967 1.00 1.27 C ATOM 2978 CD GLU B 117 14.887 -8.572 10.111 1.00 1.60 C ATOM 2979 OE1 GLU B 117 15.249 -7.407 9.850 1.00 2.31 O ATOM 2980 OE2 GLU B 117 14.811 -9.002 11.279 1.00 1.94 O ATOM 0 H GLU B 117 13.785 -9.297 5.825 1.00 0.42 H new ATOM 0 HA GLU B 117 12.667 -11.304 7.693 1.00 0.50 H new ATOM 0 HB2 GLU B 117 12.918 -8.321 8.223 1.00 0.64 H new ATOM 0 HB3 GLU B 117 12.438 -9.569 9.356 1.00 0.64 H new ATOM 0 HG2 GLU B 117 14.719 -10.531 9.273 1.00 1.27 H new ATOM 0 HG3 GLU B 117 15.202 -9.297 8.126 1.00 1.27 H new ATOM 2987 N GLU B 118 10.301 -10.481 7.352 1.00 0.43 N ATOM 2988 CA GLU B 118 8.927 -10.180 6.962 1.00 0.36 C ATOM 2989 C GLU B 118 7.987 -10.421 8.143 1.00 0.42 C ATOM 2990 O GLU B 118 8.203 -11.340 8.935 1.00 0.66 O ATOM 2991 CB GLU B 118 8.492 -11.006 5.744 1.00 0.35 C ATOM 2992 CG GLU B 118 8.616 -12.512 5.919 1.00 0.79 C ATOM 2993 CD GLU B 118 8.124 -13.284 4.707 1.00 1.47 C ATOM 2994 OE1 GLU B 118 7.930 -12.667 3.636 1.00 2.20 O ATOM 2995 OE2 GLU B 118 7.943 -14.521 4.818 1.00 2.15 O ATOM 0 H GLU B 118 10.380 -11.196 8.075 1.00 0.43 H new ATOM 0 HA GLU B 118 8.877 -9.130 6.675 1.00 0.36 H new ATOM 0 HB2 GLU B 118 7.455 -10.765 5.511 1.00 0.35 H new ATOM 0 HB3 GLU B 118 9.090 -10.703 4.885 1.00 0.35 H new ATOM 0 HG2 GLU B 118 9.659 -12.767 6.109 1.00 0.79 H new ATOM 0 HG3 GLU B 118 8.047 -12.820 6.797 1.00 0.79 H new ATOM 3002 N SER B 119 6.960 -9.587 8.267 1.00 0.43 N ATOM 3003 CA SER B 119 6.006 -9.703 9.366 1.00 0.51 C ATOM 3004 C SER B 119 5.062 -10.887 9.177 1.00 0.52 C ATOM 3005 O SER B 119 4.681 -11.549 10.142 1.00 0.66 O ATOM 3006 CB SER B 119 5.203 -8.410 9.496 1.00 0.63 C ATOM 3007 OG SER B 119 4.649 -8.025 8.246 1.00 1.45 O ATOM 0 H SER B 119 6.766 -8.823 7.620 1.00 0.43 H new ATOM 0 HA SER B 119 6.573 -9.876 10.281 1.00 0.51 H new ATOM 0 HB2 SER B 119 4.404 -8.546 10.225 1.00 0.63 H new ATOM 0 HB3 SER B 119 5.846 -7.615 9.873 1.00 0.63 H new ATOM 0 HG SER B 119 4.018 -8.711 7.942 1.00 1.45 H new ATOM 3013 N LEU B 120 4.680 -11.145 7.937 1.00 0.54 N ATOM 3014 CA LEU B 120 3.778 -12.244 7.633 1.00 0.64 C ATOM 3015 C LEU B 120 4.546 -13.404 7.026 1.00 0.73 C ATOM 3016 O LEU B 120 5.124 -13.276 5.949 1.00 0.81 O ATOM 3017 CB LEU B 120 2.673 -11.788 6.679 1.00 0.67 C ATOM 3018 CG LEU B 120 1.668 -10.805 7.277 1.00 0.86 C ATOM 3019 CD1 LEU B 120 0.709 -10.306 6.211 1.00 1.56 C ATOM 3020 CD2 LEU B 120 0.906 -11.456 8.418 1.00 1.66 C ATOM 0 H LEU B 120 4.981 -10.608 7.124 1.00 0.54 H new ATOM 0 HA LEU B 120 3.317 -12.575 8.563 1.00 0.64 H new ATOM 0 HB2 LEU B 120 3.135 -11.326 5.806 1.00 0.67 H new ATOM 0 HB3 LEU B 120 2.133 -12.667 6.326 1.00 0.67 H new ATOM 0 HG LEU B 120 2.216 -9.949 7.671 1.00 0.86 H new ATOM 0 HD11 LEU B 120 0.001 -9.607 6.657 1.00 1.56 H new ATOM 0 HD12 LEU B 120 1.270 -9.802 5.424 1.00 1.56 H new ATOM 0 HD13 LEU B 120 0.166 -11.150 5.786 1.00 1.56 H new ATOM 0 HD21 LEU B 120 0.194 -10.743 8.834 1.00 1.66 H new ATOM 0 HD22 LEU B 120 0.370 -12.329 8.046 1.00 1.66 H new ATOM 0 HD23 LEU B 120 1.606 -11.764 9.194 1.00 1.66 H new ATOM 3032 N PRO B 121 4.569 -14.545 7.724 1.00 0.91 N ATOM 3033 CA PRO B 121 5.268 -15.744 7.260 1.00 1.11 C ATOM 3034 C PRO B 121 4.689 -16.268 5.951 1.00 1.06 C ATOM 3035 O PRO B 121 3.604 -16.851 5.928 1.00 1.51 O ATOM 3036 CB PRO B 121 5.043 -16.756 8.390 1.00 1.36 C ATOM 3037 CG PRO B 121 3.848 -16.254 9.124 1.00 1.34 C ATOM 3038 CD PRO B 121 3.905 -14.760 9.019 1.00 1.08 C ATOM 0 HA PRO B 121 6.321 -15.551 7.055 1.00 1.11 H new ATOM 0 HB2 PRO B 121 4.872 -17.757 7.995 1.00 1.36 H new ATOM 0 HB3 PRO B 121 5.912 -16.816 9.045 1.00 1.36 H new ATOM 0 HG2 PRO B 121 2.928 -16.642 8.687 1.00 1.34 H new ATOM 0 HG3 PRO B 121 3.865 -16.574 10.166 1.00 1.34 H new ATOM 0 HD2 PRO B 121 2.910 -14.315 9.041 1.00 1.08 H new ATOM 0 HD3 PRO B 121 4.470 -14.319 9.840 1.00 1.08 H new ATOM 3046 N GLY B 122 5.405 -16.039 4.862 1.00 1.25 N ATOM 3047 CA GLY B 122 4.946 -16.491 3.567 1.00 1.38 C ATOM 3048 C GLY B 122 4.815 -15.350 2.581 1.00 1.19 C ATOM 3049 O GLY B 122 4.747 -15.569 1.369 1.00 1.48 O ATOM 0 H GLY B 122 6.298 -15.547 4.852 1.00 1.25 H new ATOM 0 HA2 GLY B 122 5.643 -17.232 3.174 1.00 1.38 H new ATOM 0 HA3 GLY B 122 3.982 -16.987 3.677 1.00 1.38 H new ATOM 3053 N GLY B 123 4.778 -14.131 3.103 1.00 1.02 N ATOM 3054 CA GLY B 123 4.661 -12.967 2.256 1.00 0.92 C ATOM 3055 C GLY B 123 3.264 -12.386 2.244 1.00 0.78 C ATOM 3056 O GLY B 123 2.674 -12.137 3.298 1.00 1.06 O ATOM 0 H GLY B 123 4.827 -13.930 4.102 1.00 1.02 H new ATOM 0 HA2 GLY B 123 5.363 -12.205 2.595 1.00 0.92 H new ATOM 0 HA3 GLY B 123 4.947 -13.234 1.239 1.00 0.92 H new ATOM 3060 N LEU B 124 2.734 -12.176 1.048 1.00 0.88 N ATOM 3061 CA LEU B 124 1.405 -11.604 0.886 1.00 0.97 C ATOM 3062 C LEU B 124 0.438 -12.620 0.301 1.00 1.06 C ATOM 3063 O LEU B 124 0.827 -13.476 -0.497 1.00 1.39 O ATOM 3064 CB LEU B 124 1.465 -10.376 -0.023 1.00 1.20 C ATOM 3065 CG LEU B 124 1.964 -9.098 0.645 1.00 1.13 C ATOM 3066 CD1 LEU B 124 2.157 -8.002 -0.391 1.00 1.26 C ATOM 3067 CD2 LEU B 124 0.985 -8.652 1.722 1.00 1.70 C ATOM 0 H LEU B 124 3.207 -12.394 0.171 1.00 0.88 H new ATOM 0 HA LEU B 124 1.046 -11.311 1.873 1.00 0.97 H new ATOM 0 HB2 LEU B 124 2.113 -10.602 -0.870 1.00 1.20 H new ATOM 0 HB3 LEU B 124 0.469 -10.192 -0.425 1.00 1.20 H new ATOM 0 HG LEU B 124 2.927 -9.299 1.115 1.00 1.13 H new ATOM 0 HD11 LEU B 124 2.513 -7.096 0.100 1.00 1.26 H new ATOM 0 HD12 LEU B 124 2.889 -8.326 -1.131 1.00 1.26 H new ATOM 0 HD13 LEU B 124 1.207 -7.797 -0.885 1.00 1.26 H new ATOM 0 HD21 LEU B 124 1.352 -7.739 2.192 1.00 1.70 H new ATOM 0 HD22 LEU B 124 0.011 -8.462 1.272 1.00 1.70 H new ATOM 0 HD23 LEU B 124 0.891 -9.435 2.475 1.00 1.70 H new ATOM 3079 N LYS B 125 -0.818 -12.528 0.708 1.00 1.00 N ATOM 3080 CA LYS B 125 -1.848 -13.420 0.214 1.00 1.16 C ATOM 3081 C LYS B 125 -3.113 -12.628 -0.085 1.00 1.54 C ATOM 3082 O LYS B 125 -3.167 -11.424 0.150 1.00 1.67 O ATOM 3083 CB LYS B 125 -2.136 -14.527 1.229 1.00 1.22 C ATOM 3084 CG LYS B 125 -1.062 -15.606 1.287 1.00 1.61 C ATOM 3085 CD LYS B 125 -1.429 -16.816 0.438 1.00 2.34 C ATOM 3086 CE LYS B 125 -1.228 -16.543 -1.044 1.00 2.64 C ATOM 3087 NZ LYS B 125 -2.280 -17.187 -1.868 1.00 3.74 N ATOM 0 H LYS B 125 -1.148 -11.839 1.384 1.00 1.00 H new ATOM 0 HA LYS B 125 -1.497 -13.889 -0.705 1.00 1.16 H new ATOM 0 HB2 LYS B 125 -2.243 -14.081 2.218 1.00 1.22 H new ATOM 0 HB3 LYS B 125 -3.091 -14.992 0.984 1.00 1.22 H new ATOM 0 HG2 LYS B 125 -0.114 -15.194 0.942 1.00 1.61 H new ATOM 0 HG3 LYS B 125 -0.916 -15.918 2.321 1.00 1.61 H new ATOM 0 HD2 LYS B 125 -0.820 -17.669 0.737 1.00 2.34 H new ATOM 0 HD3 LYS B 125 -2.469 -17.087 0.621 1.00 2.34 H new ATOM 0 HE2 LYS B 125 -1.235 -15.467 -1.220 1.00 2.64 H new ATOM 0 HE3 LYS B 125 -0.249 -16.910 -1.352 1.00 2.64 H new ATOM 0 HZ1 LYS B 125 -2.335 -16.714 -2.792 1.00 3.74 H new ATOM 0 HZ2 LYS B 125 -2.046 -18.191 -2.007 1.00 3.74 H new ATOM 0 HZ3 LYS B 125 -3.197 -17.109 -1.383 1.00 3.74 H new ATOM 3101 N GLU B 126 -4.137 -13.308 -0.572 1.00 2.03 N ATOM 3102 CA GLU B 126 -5.393 -12.652 -0.917 1.00 2.51 C ATOM 3103 C GLU B 126 -6.291 -12.495 0.304 1.00 2.53 C ATOM 3104 O GLU B 126 -7.345 -11.872 0.227 1.00 2.94 O ATOM 3105 CB GLU B 126 -6.132 -13.425 -2.018 1.00 2.99 C ATOM 3106 CG GLU B 126 -6.400 -14.885 -1.683 1.00 3.68 C ATOM 3107 CD GLU B 126 -5.166 -15.751 -1.812 1.00 4.09 C ATOM 3108 OE1 GLU B 126 -4.838 -16.171 -2.935 1.00 4.50 O ATOM 3109 OE2 GLU B 126 -4.500 -16.004 -0.785 1.00 4.38 O ATOM 0 H GLU B 126 -4.126 -14.314 -0.739 1.00 2.03 H new ATOM 0 HA GLU B 126 -5.148 -11.658 -1.292 1.00 2.51 H new ATOM 0 HB2 GLU B 126 -7.082 -12.930 -2.219 1.00 2.99 H new ATOM 0 HB3 GLU B 126 -5.547 -13.376 -2.936 1.00 2.99 H new ATOM 0 HG2 GLU B 126 -6.783 -14.955 -0.665 1.00 3.68 H new ATOM 0 HG3 GLU B 126 -7.178 -15.268 -2.343 1.00 3.68 H new ATOM 3116 N HIS B 127 -5.872 -13.056 1.431 1.00 2.47 N ATOM 3117 CA HIS B 127 -6.659 -12.950 2.655 1.00 2.85 C ATOM 3118 C HIS B 127 -6.396 -11.618 3.347 1.00 2.69 C ATOM 3119 O HIS B 127 -7.123 -11.227 4.257 1.00 3.24 O ATOM 3120 CB HIS B 127 -6.385 -14.122 3.616 1.00 3.34 C ATOM 3121 CG HIS B 127 -4.966 -14.248 4.092 1.00 2.82 C ATOM 3122 ND1 HIS B 127 -4.169 -13.391 4.773 1.00 2.28 N flip ATOM 3123 CD2 HIS B 127 -4.212 -15.376 3.882 1.00 3.17 C flip ATOM 3124 CE1 HIS B 127 -2.960 -14.011 4.957 1.00 2.09 C flip ATOM 3125 NE2 HIS B 127 -3.016 -15.208 4.411 1.00 2.78 N flip ATOM 0 H HIS B 127 -5.003 -13.583 1.524 1.00 2.47 H new ATOM 0 HA HIS B 127 -7.711 -12.998 2.372 1.00 2.85 H new ATOM 0 HB2 HIS B 127 -7.034 -14.016 4.485 1.00 3.34 H new ATOM 0 HB3 HIS B 127 -6.667 -15.050 3.119 1.00 3.34 H new ATOM 0 HD2 HIS B 127 -4.546 -16.263 3.364 1.00 3.17 H new ATOM 0 HE1 HIS B 127 -2.105 -13.589 5.464 1.00 2.09 H new ATOM 0 HE2 HIS B 127 -2.259 -15.892 4.399 1.00 2.78 H new ATOM 3134 N ASP B 128 -5.354 -10.928 2.904 1.00 2.33 N ATOM 3135 CA ASP B 128 -4.990 -9.639 3.478 1.00 2.40 C ATOM 3136 C ASP B 128 -5.717 -8.518 2.750 1.00 2.02 C ATOM 3137 O ASP B 128 -6.041 -7.482 3.334 1.00 2.64 O ATOM 3138 CB ASP B 128 -3.475 -9.413 3.380 1.00 2.90 C ATOM 3139 CG ASP B 128 -2.664 -10.580 3.914 1.00 3.86 C ATOM 3140 OD1 ASP B 128 -2.500 -10.685 5.147 1.00 4.43 O ATOM 3141 OD2 ASP B 128 -2.195 -11.405 3.099 1.00 4.37 O ATOM 0 H ASP B 128 -4.745 -11.240 2.148 1.00 2.33 H new ATOM 0 HA ASP B 128 -5.281 -9.638 4.528 1.00 2.40 H new ATOM 0 HB2 ASP B 128 -3.206 -9.238 2.338 1.00 2.90 H new ATOM 0 HB3 ASP B 128 -3.211 -8.512 3.933 1.00 2.90 H new ATOM 3146 N PHE B 129 -5.996 -8.743 1.475 1.00 1.68 N ATOM 3147 CA PHE B 129 -6.663 -7.745 0.654 1.00 2.25 C ATOM 3148 C PHE B 129 -8.075 -8.182 0.288 1.00 3.02 C ATOM 3149 O PHE B 129 -8.566 -9.212 0.757 1.00 3.53 O ATOM 3150 CB PHE B 129 -5.860 -7.486 -0.622 1.00 2.25 C ATOM 3151 CG PHE B 129 -4.393 -7.289 -0.377 1.00 1.47 C ATOM 3152 CD1 PHE B 129 -3.920 -6.112 0.181 1.00 1.89 C ATOM 3153 CD2 PHE B 129 -3.489 -8.285 -0.697 1.00 1.53 C ATOM 3154 CE1 PHE B 129 -2.571 -5.935 0.412 1.00 2.06 C ATOM 3155 CE2 PHE B 129 -2.139 -8.114 -0.470 1.00 1.53 C ATOM 3156 CZ PHE B 129 -1.680 -6.938 0.086 1.00 1.68 C ATOM 0 H PHE B 129 -5.770 -9.609 0.986 1.00 1.68 H new ATOM 0 HA PHE B 129 -6.727 -6.826 1.237 1.00 2.25 H new ATOM 0 HB2 PHE B 129 -5.997 -8.325 -1.304 1.00 2.25 H new ATOM 0 HB3 PHE B 129 -6.259 -6.602 -1.120 1.00 2.25 H new ATOM 0 HD1 PHE B 129 -4.614 -5.325 0.438 1.00 1.89 H new ATOM 0 HD2 PHE B 129 -3.844 -9.208 -1.130 1.00 1.53 H new ATOM 0 HE1 PHE B 129 -2.213 -5.014 0.847 1.00 2.06 H new ATOM 0 HE2 PHE B 129 -1.443 -8.899 -0.727 1.00 1.53 H new ATOM 0 HZ PHE B 129 -0.624 -6.802 0.266 1.00 1.68 H new ATOM 3166 N ASN B 130 -8.719 -7.375 -0.542 1.00 3.51 N ATOM 3167 CA ASN B 130 -10.067 -7.649 -1.008 1.00 4.35 C ATOM 3168 C ASN B 130 -10.053 -7.782 -2.525 1.00 4.87 C ATOM 3169 O ASN B 130 -9.596 -6.881 -3.233 1.00 5.30 O ATOM 3170 CB ASN B 130 -11.027 -6.536 -0.557 1.00 5.05 C ATOM 3171 CG ASN B 130 -12.085 -6.191 -1.594 1.00 5.54 C ATOM 3172 OD1 ASN B 130 -11.961 -5.202 -2.317 1.00 5.86 O ATOM 3173 ND2 ASN B 130 -13.133 -6.996 -1.674 1.00 6.00 N ATOM 0 H ASN B 130 -8.320 -6.512 -0.911 1.00 3.51 H new ATOM 0 HA ASN B 130 -10.422 -8.584 -0.575 1.00 4.35 H new ATOM 0 HB2 ASN B 130 -11.520 -6.844 0.365 1.00 5.05 H new ATOM 0 HB3 ASN B 130 -10.450 -5.641 -0.326 1.00 5.05 H new ATOM 0 HD21 ASN B 130 -13.872 -6.806 -2.351 1.00 6.00 H new ATOM 0 HD22 ASN B 130 -13.202 -7.806 -1.058 1.00 6.00 H new ATOM 3180 N PRO B 131 -10.502 -8.934 -3.038 1.00 5.23 N ATOM 3181 CA PRO B 131 -10.543 -9.209 -4.466 1.00 6.09 C ATOM 3182 C PRO B 131 -11.822 -8.689 -5.119 1.00 6.67 C ATOM 3183 O PRO B 131 -12.745 -9.496 -5.364 1.00 6.77 O ATOM 3184 CB PRO B 131 -10.480 -10.745 -4.533 1.00 6.57 C ATOM 3185 CG PRO B 131 -10.535 -11.236 -3.114 1.00 6.19 C ATOM 3186 CD PRO B 131 -10.990 -10.077 -2.273 1.00 5.27 C ATOM 3187 OXT PRO B 131 -11.904 -7.474 -5.391 1.00 1.08 O ATOM 0 HA PRO B 131 -9.734 -8.715 -5.004 1.00 6.09 H new ATOM 0 HB2 PRO B 131 -11.312 -11.143 -5.114 1.00 6.57 H new ATOM 0 HB3 PRO B 131 -9.564 -11.075 -5.022 1.00 6.57 H new ATOM 0 HG2 PRO B 131 -11.224 -12.075 -3.021 1.00 6.19 H new ATOM 0 HG3 PRO B 131 -9.557 -11.590 -2.789 1.00 6.19 H new ATOM 0 HD2 PRO B 131 -12.074 -10.058 -2.158 1.00 5.27 H new ATOM 0 HD3 PRO B 131 -10.563 -10.109 -1.270 1.00 5.27 H new TER 3195 PRO B 131