USER MOD reduce.3.24.130724 H: found=0, std=0, add=1450, rem=0, adj=62 USER MOD reduce.3.24.130724 removed 1453 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 13 MET CE :methyl -138:sc= -5.26 (180deg=-11!) USER MOD Set 1.2: B 72 HIS : no HD1:sc= -9.19! C(o=-14!,f=-16!) USER MOD Set 2.1: B 55 HIS : no HE2:sc= -4.36 K(o=-4.7,f=-12!) USER MOD Set 2.2: B 88 SER OG : rot 172:sc= -0.349 USER MOD Set 3.1: B 36 LYS NZ :NH3+ -174:sc= 0.744 (180deg=0) USER MOD Set 3.2: C 7 GLN :FLIP amide:sc= -0.292 F(o=-4.2,f=0.45) USER MOD Set 4.1: B 27 GLN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD Set 4.2: B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: B 14 SER OG : rot 180:sc= 0 USER MOD Set 5.2: B 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 53 THR OG1 : rot -140:sc= -0.5 USER MOD Set 6.2: A 55 HIS : no HE2:sc= -3.33! C(o=-3.9!,f=-4.4!) USER MOD Set 6.3: A 88 SER OG : rot 116:sc= -0.0861 USER MOD Set 7.1: A 70 THR OG1 : rot -45:sc= 0.0957 USER MOD Set 7.2: C 1 MET N :NH3+ -130:sc= -1.49 (180deg=-4.36!) USER MOD Set 8.1: A 67 THR OG1 : rot -130:sc= -0.456 USER MOD Set 8.2: B 43 LYS NZ :NH3+ -104:sc= 0.923 (180deg=-1.43!) USER MOD Set 9.1: A 65 TYR OH : rot 180:sc= 0 USER MOD Set 9.2: B 44 LYS NZ :NH3+ -166:sc= -0.037 (180deg=-0.241) USER MOD Set10.1: A 27 GLN :FLIP amide:sc= -0.395 F(o=-4.2,f=-2.1) USER MOD Set10.2: A 31 LYS NZ :NH3+ -121:sc= -1.75 (180deg=-4.32!) USER MOD Set11.1: A 14 SER OG : rot 180:sc= 0 USER MOD Set11.2: A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -168:sc= -0.0361 (180deg=-0.238) USER MOD Single : A 10 ASN :FLIP amide:sc= -0.211 F(o=-1.5,f=-0.21) USER MOD Single : A 13 MET CE :methyl -138:sc= -4.72! (180deg=-8.79!) USER MOD Single : A 18 GLN :FLIP amide:sc= -1.52 F(o=-2.4!,f=-1.5) USER MOD Single : A 19 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.16) USER MOD Single : A 21 SER OG : rot -94:sc= -1.85! USER MOD Single : A 24 CYS SG : rot -27:sc= -1.75 USER MOD Single : A 26 THR OG1 : rot 68:sc= 0.495 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN :FLIP amide:sc= 0.0907 F(o=-1.6,f=0.091) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HE2:sc= -11.5! C(o=-12!,f=-11!) USER MOD Single : A 43 LYS NZ :NH3+ 176:sc= -1.8 (180deg=-1.9) USER MOD Single : A 44 LYS NZ :NH3+ -105:sc= -2.44! (180deg=-5.47!) USER MOD Single : A 48 LYS NZ :NH3+ 169:sc= -0.0161 (180deg=-0.189) USER MOD Single : A 49 LYS NZ :NH3+ -164:sc= -0.0521 (180deg=-0.303) USER MOD Single : A 50 TYR OH : rot 108:sc= 0.214 USER MOD Single : A 51 ASN : amide:sc= -1.81 K(o=-1.8,f=-7.3!) USER MOD Single : A 56 CYS SG : rot 44:sc= -0.496 USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0.096) USER MOD Single : A 64 SER OG : rot 180:sc= -1.23 USER MOD Single : A 68 HIS : no HE2:sc= -5.71 K(o=-5.7,f=-7.5!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HE2:sc= -3.61! C(o=-3.6!,f=-12!) USER MOD Single : A 75 TYR OH : rot -173:sc= -6.37! USER MOD Single : A 77 TYR OH : rot 130:sc= -0.218 USER MOD Single : A 80 GLN : amide:sc=-0.000559 X(o=-0.00056,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 146:sc= 0.0172 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ -119:sc= -1.38 (180deg=-2.08) USER MOD Single : B 10 ASN :FLIP amide:sc= -0.625 F(o=-1.2,f=-0.62) USER MOD Single : B 18 GLN :FLIP amide:sc= -1.63 F(o=-3.2!,f=-1.6) USER MOD Single : B 19 GLN :FLIP amide:sc= -0.851 F(o=-2.1,f=-0.85) USER MOD Single : B 21 SER OG : rot -29:sc= 0.516 USER MOD Single : B 24 CYS SG : rot 180:sc= -0.997 USER MOD Single : B 26 THR OG1 : rot 71:sc= 0.435 USER MOD Single : B 32 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 ASN : amide:sc= -0.658 X(o=-0.66,f=-0.59) USER MOD Single : B 41 HIS : no HD1:sc= -8.95! C(o=-9!,f=-8.8!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 TYR OH : rot -99:sc= 0.209 USER MOD Single : B 51 ASN : amide:sc= -1.74 X(o=-1.7,f=-1.3) USER MOD Single : B 53 THR OG1 : rot -100:sc= -0.778 USER MOD Single : B 56 CYS SG : rot 176:sc= -6.67! USER MOD Single : B 61 ASN : amide:sc= 0 X(o=0,f=0.064) USER MOD Single : B 64 SER OG : rot 180:sc= -0.992 USER MOD Single : B 65 TYR OH : rot 180:sc=-0.00976 USER MOD Single : B 67 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HE2:sc= -3 K(o=-3,f=-5.7!) USER MOD Single : B 70 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 75 TYR OH : rot 114:sc= -8.25! USER MOD Single : B 77 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 GLN : amide:sc= -0.0414 X(o=-0.041,f=0) USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 2 LYS NZ :NH3+ 169:sc= -0.016 (180deg=-0.19) USER MOD Single : C 4 THR OG1 : rot 122:sc= 0.593 USER MOD Single : D 4 THR OG1 : rot 104:sc= 0.541! USER MOD Single : D 7 GLN : amide:sc= -1.19 K(o=-1.2,f=-5.5!) USER MOD ----------------------------------------------------------------- ATOM 89 N ALA A 6 -13.567 -5.435 -13.170 1.00 0.00 N ATOM 90 CA ALA A 6 -12.485 -5.673 -12.222 1.00 0.00 C ATOM 91 C ALA A 6 -12.564 -7.083 -11.641 1.00 0.00 C ATOM 92 O ALA A 6 -13.609 -7.501 -11.145 1.00 0.00 O ATOM 93 CB ALA A 6 -12.523 -4.637 -11.107 1.00 0.00 C ATOM 0 HA ALA A 6 -11.539 -5.581 -12.756 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -11.710 -4.827 -10.406 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -12.410 -3.640 -11.533 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -13.476 -4.702 -10.582 1.00 0.00 H new ATOM 99 N VAL A 7 -11.457 -7.817 -11.710 1.00 0.00 N ATOM 100 CA VAL A 7 -11.416 -9.173 -11.197 1.00 0.00 C ATOM 101 C VAL A 7 -11.082 -9.215 -9.711 1.00 0.00 C ATOM 102 O VAL A 7 -10.190 -8.509 -9.241 1.00 0.00 O ATOM 103 CB VAL A 7 -10.394 -10.025 -11.957 1.00 0.00 C ATOM 104 CG1 VAL A 7 -10.791 -10.162 -13.419 1.00 0.00 C ATOM 105 CG2 VAL A 7 -8.997 -9.434 -11.828 1.00 0.00 C ATOM 0 H VAL A 7 -10.580 -7.491 -12.117 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.416 -9.582 -11.343 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.382 -11.021 -11.514 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.053 -10.770 -13.941 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -11.768 -10.640 -13.487 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -10.837 -9.174 -13.878 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.287 -10.055 -12.375 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -8.989 -8.425 -12.240 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -8.713 -9.399 -10.776 1.00 0.00 H new ATOM 115 N ILE A 8 -11.797 -10.064 -8.985 1.00 0.00 N ATOM 116 CA ILE A 8 -11.582 -10.226 -7.550 1.00 0.00 C ATOM 117 C ILE A 8 -10.420 -11.178 -7.280 1.00 0.00 C ATOM 118 O ILE A 8 -10.149 -12.082 -8.070 1.00 0.00 O ATOM 119 CB ILE A 8 -12.856 -10.743 -6.840 1.00 0.00 C ATOM 120 CG1 ILE A 8 -13.957 -9.681 -6.872 1.00 0.00 C ATOM 121 CG2 ILE A 8 -12.551 -11.139 -5.400 1.00 0.00 C ATOM 122 CD1 ILE A 8 -14.381 -9.276 -8.267 1.00 0.00 C ATOM 0 H ILE A 8 -12.535 -10.655 -9.367 1.00 0.00 H new ATOM 0 HA ILE A 8 -11.339 -9.243 -7.147 1.00 0.00 H new ATOM 0 HB ILE A 8 -13.205 -11.626 -7.375 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -14.827 -10.058 -6.334 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -13.610 -8.797 -6.338 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -13.461 -11.499 -4.921 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -11.800 -11.928 -5.391 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -12.174 -10.273 -4.857 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -15.164 -8.520 -8.204 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.525 -8.867 -8.803 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -14.760 -10.148 -8.800 1.00 0.00 H new ATOM 134 N LYS A 9 -9.732 -10.964 -6.162 1.00 0.00 N ATOM 135 CA LYS A 9 -8.596 -11.801 -5.794 1.00 0.00 C ATOM 136 C LYS A 9 -8.562 -12.065 -4.291 1.00 0.00 C ATOM 137 O LYS A 9 -8.321 -13.191 -3.858 1.00 0.00 O ATOM 138 CB LYS A 9 -7.288 -11.138 -6.232 1.00 0.00 C ATOM 139 CG LYS A 9 -7.170 -10.960 -7.736 1.00 0.00 C ATOM 140 CD LYS A 9 -7.164 -12.296 -8.459 1.00 0.00 C ATOM 141 CE LYS A 9 -5.977 -13.149 -8.044 1.00 0.00 C ATOM 142 NZ LYS A 9 -4.681 -12.476 -8.338 1.00 0.00 N ATOM 0 H LYS A 9 -9.941 -10.220 -5.497 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.708 -12.757 -6.305 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -7.206 -10.163 -5.752 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.450 -11.739 -5.879 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.001 -10.354 -8.097 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.254 -10.416 -7.968 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.090 -12.830 -8.246 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.134 -12.128 -9.536 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -6.040 -13.365 -6.978 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -6.017 -14.105 -8.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -3.904 -13.159 -8.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.692 -12.111 -9.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -4.541 -11.688 -7.674 1.00 0.00 H new ATOM 156 N ASN A 10 -8.792 -11.023 -3.498 1.00 0.00 N ATOM 157 CA ASN A 10 -8.774 -11.156 -2.046 1.00 0.00 C ATOM 158 C ASN A 10 -10.067 -10.627 -1.427 1.00 0.00 C ATOM 159 O ASN A 10 -10.039 -9.816 -0.501 1.00 0.00 O ATOM 160 CB ASN A 10 -7.570 -10.410 -1.469 1.00 0.00 C ATOM 161 CG ASN A 10 -7.317 -10.744 -0.013 1.00 0.00 C ATOM 162 OD1 ASN A 10 -6.147 -11.306 0.265 1.00 0.00 O flip ATOM 163 ND2 ASN A 10 -8.160 -10.504 0.852 1.00 0.00 N flip ATOM 0 H ASN A 10 -8.992 -10.081 -3.835 1.00 0.00 H new ATOM 0 HA ASN A 10 -8.692 -12.215 -1.802 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -6.683 -10.654 -2.053 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -7.731 -9.337 -1.568 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -9.047 -10.071 0.594 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -7.972 -10.738 1.827 1.00 0.00 H new ATOM 170 N ALA A 11 -11.200 -11.092 -1.944 1.00 0.00 N ATOM 171 CA ALA A 11 -12.501 -10.666 -1.436 1.00 0.00 C ATOM 172 C ALA A 11 -12.654 -11.037 0.036 1.00 0.00 C ATOM 173 O ALA A 11 -12.236 -12.116 0.458 1.00 0.00 O ATOM 174 CB ALA A 11 -13.619 -11.284 -2.261 1.00 0.00 C ATOM 0 H ALA A 11 -11.245 -11.762 -2.712 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.565 -9.581 -1.522 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -14.583 -10.957 -1.870 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -13.522 -10.968 -3.300 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.554 -12.371 -2.205 1.00 0.00 H new ATOM 180 N ASP A 12 -13.248 -10.140 0.816 1.00 0.00 N ATOM 181 CA ASP A 12 -13.444 -10.382 2.241 1.00 0.00 C ATOM 182 C ASP A 12 -14.305 -9.292 2.875 1.00 0.00 C ATOM 183 O ASP A 12 -13.894 -8.645 3.838 1.00 0.00 O ATOM 184 CB ASP A 12 -12.090 -10.463 2.952 1.00 0.00 C ATOM 185 CG ASP A 12 -12.227 -10.737 4.438 1.00 0.00 C ATOM 186 OD1 ASP A 12 -13.373 -10.870 4.916 1.00 0.00 O ATOM 187 OD2 ASP A 12 -11.186 -10.818 5.124 1.00 0.00 O ATOM 0 H ASP A 12 -13.601 -9.241 0.487 1.00 0.00 H new ATOM 0 HA ASP A 12 -13.966 -11.332 2.353 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -11.490 -11.250 2.495 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -11.551 -9.527 2.807 1.00 0.00 H new ATOM 192 N MET A 13 -15.504 -9.093 2.332 1.00 0.00 N ATOM 193 CA MET A 13 -16.414 -8.081 2.856 1.00 0.00 C ATOM 194 C MET A 13 -17.785 -8.170 2.190 1.00 0.00 C ATOM 195 O MET A 13 -17.980 -8.929 1.241 1.00 0.00 O ATOM 196 CB MET A 13 -15.821 -6.684 2.663 1.00 0.00 C ATOM 197 CG MET A 13 -15.587 -6.310 1.209 1.00 0.00 C ATOM 198 SD MET A 13 -14.686 -4.758 1.033 1.00 0.00 S ATOM 199 CE MET A 13 -15.694 -3.663 2.028 1.00 0.00 C ATOM 0 H MET A 13 -15.865 -9.616 1.534 1.00 0.00 H new ATOM 0 HA MET A 13 -16.545 -8.267 3.922 1.00 0.00 H new ATOM 0 HB2 MET A 13 -16.490 -5.951 3.113 1.00 0.00 H new ATOM 0 HB3 MET A 13 -14.874 -6.624 3.200 1.00 0.00 H new ATOM 0 HG2 MET A 13 -15.030 -7.108 0.717 1.00 0.00 H new ATOM 0 HG3 MET A 13 -16.547 -6.229 0.699 1.00 0.00 H new ATOM 0 HE1 MET A 13 -15.804 -2.706 1.518 1.00 0.00 H new ATOM 0 HE2 MET A 13 -16.677 -4.109 2.178 1.00 0.00 H new ATOM 0 HE3 MET A 13 -15.216 -3.507 2.995 1.00 0.00 H new ATOM 209 N SER A 14 -18.733 -7.394 2.708 1.00 0.00 N ATOM 210 CA SER A 14 -20.099 -7.378 2.186 1.00 0.00 C ATOM 211 C SER A 14 -20.120 -7.248 0.665 1.00 0.00 C ATOM 212 O SER A 14 -19.302 -6.541 0.079 1.00 0.00 O ATOM 213 CB SER A 14 -20.890 -6.233 2.817 1.00 0.00 C ATOM 214 OG SER A 14 -20.962 -6.375 4.225 1.00 0.00 O ATOM 0 H SER A 14 -18.580 -6.763 3.495 1.00 0.00 H new ATOM 0 HA SER A 14 -20.564 -8.329 2.447 1.00 0.00 H new ATOM 0 HB2 SER A 14 -20.419 -5.282 2.568 1.00 0.00 H new ATOM 0 HB3 SER A 14 -21.896 -6.209 2.399 1.00 0.00 H new ATOM 0 HG SER A 14 -21.472 -5.629 4.603 1.00 0.00 H new ATOM 220 N GLU A 15 -21.064 -7.945 0.036 1.00 0.00 N ATOM 221 CA GLU A 15 -21.205 -7.922 -1.415 1.00 0.00 C ATOM 222 C GLU A 15 -21.400 -6.504 -1.936 1.00 0.00 C ATOM 223 O GLU A 15 -20.777 -6.100 -2.917 1.00 0.00 O ATOM 224 CB GLU A 15 -22.383 -8.799 -1.843 1.00 0.00 C ATOM 225 CG GLU A 15 -22.237 -10.255 -1.431 1.00 0.00 C ATOM 226 CD GLU A 15 -23.415 -11.105 -1.863 1.00 0.00 C ATOM 227 OE1 GLU A 15 -24.552 -10.806 -1.439 1.00 0.00 O ATOM 228 OE2 GLU A 15 -23.203 -12.069 -2.629 1.00 0.00 O ATOM 0 H GLU A 15 -21.745 -8.535 0.513 1.00 0.00 H new ATOM 0 HA GLU A 15 -20.283 -8.315 -1.844 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -23.300 -8.398 -1.411 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -22.491 -8.745 -2.926 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -21.323 -10.661 -1.864 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -22.130 -10.313 -0.348 1.00 0.00 H new ATOM 235 N GLU A 16 -22.271 -5.753 -1.280 1.00 0.00 N ATOM 236 CA GLU A 16 -22.551 -4.382 -1.687 1.00 0.00 C ATOM 237 C GLU A 16 -21.300 -3.513 -1.602 1.00 0.00 C ATOM 238 O GLU A 16 -21.029 -2.714 -2.498 1.00 0.00 O ATOM 239 CB GLU A 16 -23.661 -3.786 -0.820 1.00 0.00 C ATOM 240 CG GLU A 16 -23.320 -3.747 0.662 1.00 0.00 C ATOM 241 CD GLU A 16 -24.435 -3.154 1.501 1.00 0.00 C ATOM 242 OE1 GLU A 16 -24.795 -1.981 1.266 1.00 0.00 O ATOM 243 OE2 GLU A 16 -24.949 -3.862 2.392 1.00 0.00 O ATOM 0 H GLU A 16 -22.796 -6.068 -0.464 1.00 0.00 H new ATOM 0 HA GLU A 16 -22.881 -4.403 -2.726 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -23.874 -2.773 -1.162 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -24.572 -4.368 -0.960 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -23.108 -4.758 1.009 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -22.411 -3.163 0.807 1.00 0.00 H new ATOM 250 N MET A 17 -20.544 -3.668 -0.521 1.00 0.00 N ATOM 251 CA MET A 17 -19.330 -2.886 -0.328 1.00 0.00 C ATOM 252 C MET A 17 -18.343 -3.106 -1.466 1.00 0.00 C ATOM 253 O MET A 17 -17.847 -2.151 -2.062 1.00 0.00 O ATOM 254 CB MET A 17 -18.677 -3.237 1.009 1.00 0.00 C ATOM 255 CG MET A 17 -19.533 -2.890 2.216 1.00 0.00 C ATOM 256 SD MET A 17 -18.760 -3.359 3.775 1.00 0.00 S ATOM 257 CE MET A 17 -19.989 -2.790 4.947 1.00 0.00 C ATOM 0 H MET A 17 -20.749 -4.325 0.232 1.00 0.00 H new ATOM 0 HA MET A 17 -19.610 -1.833 -0.322 1.00 0.00 H new ATOM 0 HB2 MET A 17 -18.456 -4.304 1.026 1.00 0.00 H new ATOM 0 HB3 MET A 17 -17.725 -2.713 1.087 1.00 0.00 H new ATOM 0 HG2 MET A 17 -19.730 -1.818 2.221 1.00 0.00 H new ATOM 0 HG3 MET A 17 -20.497 -3.390 2.128 1.00 0.00 H new ATOM 0 HE1 MET A 17 -19.654 -3.010 5.961 1.00 0.00 H new ATOM 0 HE2 MET A 17 -20.128 -1.715 4.836 1.00 0.00 H new ATOM 0 HE3 MET A 17 -20.934 -3.299 4.759 1.00 0.00 H new ATOM 267 N GLN A 18 -18.060 -4.367 -1.767 1.00 0.00 N ATOM 268 CA GLN A 18 -17.129 -4.696 -2.841 1.00 0.00 C ATOM 269 C GLN A 18 -17.587 -4.111 -4.174 1.00 0.00 C ATOM 270 O GLN A 18 -16.770 -3.640 -4.964 1.00 0.00 O ATOM 271 CB GLN A 18 -16.938 -6.210 -2.955 1.00 0.00 C ATOM 272 CG GLN A 18 -18.230 -7.004 -2.960 1.00 0.00 C ATOM 273 CD GLN A 18 -17.980 -8.497 -2.957 1.00 0.00 C ATOM 274 OE1 GLN A 18 -18.221 -9.130 -1.816 1.00 0.00 O flip ATOM 275 NE2 GLN A 18 -17.552 -9.070 -3.958 1.00 0.00 N flip ATOM 0 H GLN A 18 -18.458 -5.174 -1.287 1.00 0.00 H new ATOM 0 HA GLN A 18 -16.168 -4.246 -2.591 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -16.388 -6.427 -3.871 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -16.320 -6.550 -2.124 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -18.824 -6.734 -2.087 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -18.816 -6.737 -3.839 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -17.381 -8.542 -4.814 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -17.368 -10.073 -3.932 1.00 0.00 H new ATOM 284 N GLN A 19 -18.892 -4.131 -4.417 1.00 0.00 N ATOM 285 CA GLN A 19 -19.436 -3.586 -5.656 1.00 0.00 C ATOM 286 C GLN A 19 -19.216 -2.079 -5.722 1.00 0.00 C ATOM 287 O GLN A 19 -18.814 -1.544 -6.756 1.00 0.00 O ATOM 288 CB GLN A 19 -20.928 -3.906 -5.776 1.00 0.00 C ATOM 289 CG GLN A 19 -21.222 -5.389 -5.932 1.00 0.00 C ATOM 290 CD GLN A 19 -20.614 -5.973 -7.192 1.00 0.00 C ATOM 291 OE1 GLN A 19 -20.929 -5.547 -8.303 1.00 0.00 O ATOM 292 NE2 GLN A 19 -19.736 -6.956 -7.025 1.00 0.00 N ATOM 0 H GLN A 19 -19.589 -4.515 -3.779 1.00 0.00 H new ATOM 0 HA GLN A 19 -18.911 -4.051 -6.490 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -21.443 -3.533 -4.891 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -21.338 -3.371 -6.632 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -20.837 -5.925 -5.065 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -22.301 -5.542 -5.949 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -19.504 -7.278 -6.086 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -19.294 -7.388 -7.836 1.00 0.00 H new ATOM 301 N ASP A 20 -19.478 -1.400 -4.612 1.00 0.00 N ATOM 302 CA ASP A 20 -19.303 0.048 -4.540 1.00 0.00 C ATOM 303 C ASP A 20 -17.846 0.429 -4.739 1.00 0.00 C ATOM 304 O ASP A 20 -17.542 1.439 -5.368 1.00 0.00 O ATOM 305 CB ASP A 20 -19.812 0.584 -3.201 1.00 0.00 C ATOM 306 CG ASP A 20 -21.289 0.314 -2.992 1.00 0.00 C ATOM 307 OD1 ASP A 20 -22.101 0.777 -3.822 1.00 0.00 O ATOM 308 OD2 ASP A 20 -21.636 -0.361 -1.999 1.00 0.00 O ATOM 0 H ASP A 20 -19.813 -1.828 -3.748 1.00 0.00 H new ATOM 0 HA ASP A 20 -19.888 0.498 -5.342 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -19.244 0.127 -2.391 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -19.631 1.658 -3.151 1.00 0.00 H new ATOM 313 N SER A 21 -16.945 -0.385 -4.206 1.00 0.00 N ATOM 314 CA SER A 21 -15.520 -0.122 -4.347 1.00 0.00 C ATOM 315 C SER A 21 -15.109 -0.261 -5.807 1.00 0.00 C ATOM 316 O SER A 21 -14.398 0.586 -6.348 1.00 0.00 O ATOM 317 CB SER A 21 -14.707 -1.082 -3.475 1.00 0.00 C ATOM 318 OG SER A 21 -13.317 -0.838 -3.610 1.00 0.00 O ATOM 0 H SER A 21 -17.173 -1.226 -3.676 1.00 0.00 H new ATOM 0 HA SER A 21 -15.319 0.897 -4.016 1.00 0.00 H new ATOM 0 HB2 SER A 21 -15.000 -0.968 -2.431 1.00 0.00 H new ATOM 0 HB3 SER A 21 -14.928 -2.111 -3.757 1.00 0.00 H new ATOM 0 HG SER A 21 -12.945 -1.435 -4.292 1.00 0.00 H new ATOM 324 N VAL A 22 -15.577 -1.332 -6.440 1.00 0.00 N ATOM 325 CA VAL A 22 -15.275 -1.582 -7.842 1.00 0.00 C ATOM 326 C VAL A 22 -15.845 -0.475 -8.719 1.00 0.00 C ATOM 327 O VAL A 22 -15.151 0.079 -9.572 1.00 0.00 O ATOM 328 CB VAL A 22 -15.842 -2.942 -8.297 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.512 -3.206 -9.758 1.00 0.00 C ATOM 330 CG2 VAL A 22 -15.311 -4.062 -7.414 1.00 0.00 C ATOM 0 H VAL A 22 -16.167 -2.040 -6.003 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.190 -1.601 -7.947 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.927 -2.910 -8.198 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.923 -4.171 -10.055 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.946 -2.421 -10.377 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.430 -3.216 -9.891 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -15.721 -5.015 -7.749 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.223 -4.092 -7.479 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -15.608 -3.882 -6.381 1.00 0.00 H new ATOM 340 N GLU A 23 -17.111 -0.148 -8.492 1.00 0.00 N ATOM 341 CA GLU A 23 -17.772 0.904 -9.251 1.00 0.00 C ATOM 342 C GLU A 23 -17.130 2.252 -8.950 1.00 0.00 C ATOM 343 O GLU A 23 -16.912 3.064 -9.849 1.00 0.00 O ATOM 344 CB GLU A 23 -19.266 0.947 -8.923 1.00 0.00 C ATOM 345 CG GLU A 23 -20.011 -0.317 -9.316 1.00 0.00 C ATOM 346 CD GLU A 23 -21.487 -0.255 -8.973 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.812 -0.102 -7.777 1.00 0.00 O ATOM 348 OE2 GLU A 23 -22.317 -0.360 -9.900 1.00 0.00 O ATOM 0 H GLU A 23 -17.699 -0.596 -7.789 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.657 0.687 -10.313 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -19.390 1.114 -7.853 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.717 1.798 -9.433 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.897 -0.483 -10.387 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.560 -1.172 -8.812 1.00 0.00 H new ATOM 355 N CYS A 24 -16.824 2.476 -7.677 1.00 0.00 N ATOM 356 CA CYS A 24 -16.198 3.721 -7.248 1.00 0.00 C ATOM 357 C CYS A 24 -14.823 3.886 -7.888 1.00 0.00 C ATOM 358 O CYS A 24 -14.416 4.997 -8.229 1.00 0.00 O ATOM 359 CB CYS A 24 -16.073 3.758 -5.725 1.00 0.00 C ATOM 360 SG CYS A 24 -15.338 5.282 -5.084 1.00 0.00 S ATOM 0 H CYS A 24 -16.999 1.811 -6.924 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.832 4.547 -7.571 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -17.063 3.632 -5.286 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -15.469 2.911 -5.400 1.00 0.00 H new ATOM 0 HG CYS A 24 -14.561 5.802 -5.987 1.00 0.00 H new ATOM 366 N ALA A 25 -14.116 2.773 -8.061 1.00 0.00 N ATOM 367 CA ALA A 25 -12.798 2.799 -8.671 1.00 0.00 C ATOM 368 C ALA A 25 -12.921 3.183 -10.132 1.00 0.00 C ATOM 369 O ALA A 25 -12.095 3.921 -10.670 1.00 0.00 O ATOM 370 CB ALA A 25 -12.116 1.448 -8.526 1.00 0.00 C ATOM 0 H ALA A 25 -14.437 1.844 -7.786 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.184 3.541 -8.161 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.130 1.487 -8.989 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -12.011 1.205 -7.469 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.717 0.682 -9.016 1.00 0.00 H new ATOM 376 N THR A 26 -13.971 2.677 -10.767 1.00 0.00 N ATOM 377 CA THR A 26 -14.221 2.964 -12.165 1.00 0.00 C ATOM 378 C THR A 26 -14.411 4.461 -12.372 1.00 0.00 C ATOM 379 O THR A 26 -13.866 5.049 -13.306 1.00 0.00 O ATOM 380 CB THR A 26 -15.454 2.204 -12.652 1.00 0.00 C ATOM 381 OG1 THR A 26 -15.287 0.810 -12.469 1.00 0.00 O ATOM 382 CG2 THR A 26 -15.766 2.442 -14.115 1.00 0.00 C ATOM 0 H THR A 26 -14.661 2.065 -10.331 1.00 0.00 H new ATOM 0 HA THR A 26 -13.358 2.637 -12.745 1.00 0.00 H new ATOM 0 HB THR A 26 -16.283 2.585 -12.055 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.277 0.605 -11.511 1.00 0.00 H new ATOM 0 HG21 THR A 26 -16.653 1.873 -14.395 1.00 0.00 H new ATOM 0 HG22 THR A 26 -15.949 3.504 -14.280 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.921 2.121 -14.724 1.00 0.00 H new ATOM 390 N GLN A 27 -15.183 5.070 -11.480 1.00 0.00 N ATOM 391 CA GLN A 27 -15.448 6.501 -11.544 1.00 0.00 C ATOM 392 C GLN A 27 -14.148 7.285 -11.443 1.00 0.00 C ATOM 393 O GLN A 27 -13.919 8.232 -12.195 1.00 0.00 O ATOM 394 CB GLN A 27 -16.388 6.917 -10.410 1.00 0.00 C ATOM 395 CG GLN A 27 -17.739 6.214 -10.446 1.00 0.00 C ATOM 396 CD GLN A 27 -18.577 6.547 -11.675 1.00 0.00 C ATOM 397 OE1 GLN A 27 -18.145 7.526 -12.469 1.00 0.00 O flip ATOM 398 NE2 GLN A 27 -19.621 5.935 -11.900 1.00 0.00 N flip ATOM 0 H GLN A 27 -15.638 4.593 -10.702 1.00 0.00 H new ATOM 0 HA GLN A 27 -15.922 6.720 -12.501 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -15.905 6.709 -9.455 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -16.547 7.994 -10.459 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -17.578 5.137 -10.410 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -18.301 6.483 -9.552 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -19.922 5.191 -11.271 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -20.185 6.172 -12.716 1.00 0.00 H new ATOM 407 N ALA A 28 -13.297 6.878 -10.508 1.00 0.00 N ATOM 408 CA ALA A 28 -12.014 7.535 -10.306 1.00 0.00 C ATOM 409 C ALA A 28 -11.206 7.551 -11.598 1.00 0.00 C ATOM 410 O ALA A 28 -10.585 8.557 -11.943 1.00 0.00 O ATOM 411 CB ALA A 28 -11.234 6.842 -9.202 1.00 0.00 C ATOM 0 H ALA A 28 -13.474 6.095 -9.878 1.00 0.00 H new ATOM 0 HA ALA A 28 -12.201 8.567 -10.007 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.277 7.344 -9.062 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.804 6.882 -8.274 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.061 5.802 -9.477 1.00 0.00 H new ATOM 417 N LEU A 29 -11.221 6.429 -12.309 1.00 0.00 N ATOM 418 CA LEU A 29 -10.491 6.314 -13.566 1.00 0.00 C ATOM 419 C LEU A 29 -10.985 7.334 -14.583 1.00 0.00 C ATOM 420 O LEU A 29 -10.196 8.058 -15.189 1.00 0.00 O ATOM 421 CB LEU A 29 -10.632 4.902 -14.132 1.00 0.00 C ATOM 422 CG LEU A 29 -9.801 3.845 -13.412 1.00 0.00 C ATOM 423 CD1 LEU A 29 -10.260 2.447 -13.798 1.00 0.00 C ATOM 424 CD2 LEU A 29 -8.326 4.027 -13.733 1.00 0.00 C ATOM 0 H LEU A 29 -11.730 5.588 -12.037 1.00 0.00 H new ATOM 0 HA LEU A 29 -9.439 6.515 -13.364 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -11.682 4.611 -14.090 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -10.346 4.916 -15.184 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.943 3.967 -12.338 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.655 1.708 -13.274 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -11.307 2.319 -13.524 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -10.148 2.311 -14.874 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -7.744 3.266 -13.213 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -8.173 3.929 -14.808 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -8.002 5.016 -13.409 1.00 0.00 H new ATOM 436 N GLU A 30 -12.295 7.381 -14.767 1.00 0.00 N ATOM 437 CA GLU A 30 -12.905 8.309 -15.713 1.00 0.00 C ATOM 438 C GLU A 30 -12.725 9.756 -15.263 1.00 0.00 C ATOM 439 O GLU A 30 -12.640 10.666 -16.087 1.00 0.00 O ATOM 440 CB GLU A 30 -14.393 7.995 -15.879 1.00 0.00 C ATOM 441 CG GLU A 30 -14.667 6.592 -16.397 1.00 0.00 C ATOM 442 CD GLU A 30 -16.148 6.308 -16.552 1.00 0.00 C ATOM 443 OE1 GLU A 30 -16.813 7.024 -17.328 1.00 0.00 O ATOM 444 OE2 GLU A 30 -16.642 5.366 -15.897 1.00 0.00 O ATOM 0 H GLU A 30 -12.960 6.786 -14.273 1.00 0.00 H new ATOM 0 HA GLU A 30 -12.403 8.186 -16.673 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.892 8.122 -14.918 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.834 8.719 -16.565 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.173 6.461 -17.360 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -14.231 5.864 -15.713 1.00 0.00 H new ATOM 451 N LYS A 31 -12.682 9.959 -13.952 1.00 0.00 N ATOM 452 CA LYS A 31 -12.527 11.293 -13.390 1.00 0.00 C ATOM 453 C LYS A 31 -11.079 11.759 -13.437 1.00 0.00 C ATOM 454 O LYS A 31 -10.814 12.954 -13.580 1.00 0.00 O ATOM 455 CB LYS A 31 -13.046 11.333 -11.952 1.00 0.00 C ATOM 456 CG LYS A 31 -14.557 11.214 -11.850 1.00 0.00 C ATOM 457 CD LYS A 31 -15.026 11.286 -10.407 1.00 0.00 C ATOM 458 CE LYS A 31 -16.541 11.373 -10.313 1.00 0.00 C ATOM 459 NZ LYS A 31 -17.214 10.206 -10.948 1.00 0.00 N ATOM 0 H LYS A 31 -12.752 9.215 -13.258 1.00 0.00 H new ATOM 0 HA LYS A 31 -13.118 11.975 -14.001 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -12.587 10.523 -11.386 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -12.731 12.267 -11.486 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -15.025 12.012 -12.426 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -14.879 10.271 -12.292 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -14.678 10.406 -9.867 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -14.581 12.155 -9.922 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -16.835 11.433 -9.265 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -16.881 12.291 -10.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -17.843 10.538 -11.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -16.497 9.567 -11.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -17.772 9.696 -10.234 1.00 0.00 H new ATOM 473 N TYR A 32 -10.139 10.828 -13.307 1.00 0.00 N ATOM 474 CA TYR A 32 -8.729 11.195 -13.330 1.00 0.00 C ATOM 475 C TYR A 32 -7.886 10.194 -14.116 1.00 0.00 C ATOM 476 O TYR A 32 -7.026 10.585 -14.906 1.00 0.00 O ATOM 477 CB TYR A 32 -8.185 11.314 -11.906 1.00 0.00 C ATOM 478 CG TYR A 32 -9.047 12.150 -10.985 1.00 0.00 C ATOM 479 CD1 TYR A 32 -10.278 11.681 -10.540 1.00 0.00 C ATOM 480 CD2 TYR A 32 -8.625 13.400 -10.552 1.00 0.00 C ATOM 481 CE1 TYR A 32 -11.064 12.437 -9.690 1.00 0.00 C ATOM 482 CE2 TYR A 32 -9.407 14.163 -9.704 1.00 0.00 C ATOM 483 CZ TYR A 32 -10.624 13.677 -9.276 1.00 0.00 C ATOM 484 OH TYR A 32 -11.403 14.433 -8.430 1.00 0.00 O ATOM 0 H TYR A 32 -10.323 9.832 -13.187 1.00 0.00 H new ATOM 0 HA TYR A 32 -8.660 12.160 -13.833 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -8.082 10.315 -11.483 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -7.186 11.748 -11.945 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -10.626 10.711 -10.863 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -7.671 13.783 -10.883 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -12.017 12.059 -9.352 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -9.066 15.135 -9.379 1.00 0.00 H new ATOM 0 HH TYR A 32 -10.948 15.278 -8.234 1.00 0.00 H new ATOM 494 N ASN A 33 -8.123 8.907 -13.888 1.00 0.00 N ATOM 495 CA ASN A 33 -7.370 7.857 -14.571 1.00 0.00 C ATOM 496 C ASN A 33 -5.923 7.825 -14.077 1.00 0.00 C ATOM 497 O ASN A 33 -4.982 7.884 -14.868 1.00 0.00 O ATOM 498 CB ASN A 33 -7.400 8.066 -16.091 1.00 0.00 C ATOM 499 CG ASN A 33 -6.852 6.877 -16.857 1.00 0.00 C ATOM 500 OD1 ASN A 33 -7.688 6.279 -17.695 1.00 0.00 O flip ATOM 501 ND2 ASN A 33 -5.691 6.498 -16.697 1.00 0.00 N flip ATOM 0 H ASN A 33 -8.829 8.564 -13.237 1.00 0.00 H new ATOM 0 HA ASN A 33 -7.842 6.901 -14.342 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -8.426 8.255 -16.407 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -6.820 8.954 -16.343 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -5.081 6.987 -16.042 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -5.340 5.695 -17.220 1.00 0.00 H new ATOM 508 N ILE A 34 -5.754 7.735 -12.760 1.00 0.00 N ATOM 509 CA ILE A 34 -4.423 7.695 -12.161 1.00 0.00 C ATOM 510 C ILE A 34 -4.410 6.796 -10.927 1.00 0.00 C ATOM 511 O ILE A 34 -5.223 6.956 -10.019 1.00 0.00 O ATOM 512 CB ILE A 34 -3.942 9.108 -11.766 1.00 0.00 C ATOM 513 CG1 ILE A 34 -3.942 10.031 -12.986 1.00 0.00 C ATOM 514 CG2 ILE A 34 -2.553 9.047 -11.147 1.00 0.00 C ATOM 515 CD1 ILE A 34 -2.991 9.592 -14.080 1.00 0.00 C ATOM 0 H ILE A 34 -6.521 7.688 -12.089 1.00 0.00 H new ATOM 0 HA ILE A 34 -3.744 7.289 -12.911 1.00 0.00 H new ATOM 0 HB ILE A 34 -4.631 9.512 -11.024 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -4.952 10.081 -13.393 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -3.676 11.039 -12.668 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -2.231 10.052 -10.875 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -2.579 8.421 -10.255 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -1.852 8.624 -11.867 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -3.045 10.294 -14.912 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -1.973 9.569 -13.690 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.269 8.597 -14.426 1.00 0.00 H new ATOM 527 N GLU A 35 -3.478 5.847 -10.903 1.00 0.00 N ATOM 528 CA GLU A 35 -3.357 4.910 -9.788 1.00 0.00 C ATOM 529 C GLU A 35 -3.375 5.633 -8.443 1.00 0.00 C ATOM 530 O GLU A 35 -4.125 5.265 -7.538 1.00 0.00 O ATOM 531 CB GLU A 35 -2.065 4.101 -9.924 1.00 0.00 C ATOM 532 CG GLU A 35 -1.976 3.315 -11.224 1.00 0.00 C ATOM 533 CD GLU A 35 -0.658 2.579 -11.371 1.00 0.00 C ATOM 534 OE1 GLU A 35 0.186 2.676 -10.456 1.00 0.00 O ATOM 535 OE2 GLU A 35 -0.470 1.903 -12.406 1.00 0.00 O ATOM 0 H GLU A 35 -2.793 5.706 -11.645 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.215 4.239 -9.821 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -1.213 4.778 -9.859 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -1.988 3.410 -9.085 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.795 2.598 -11.267 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -2.104 3.996 -12.066 1.00 0.00 H new ATOM 542 N LYS A 36 -2.542 6.658 -8.317 1.00 0.00 N ATOM 543 CA LYS A 36 -2.458 7.430 -7.081 1.00 0.00 C ATOM 544 C LYS A 36 -3.783 8.120 -6.762 1.00 0.00 C ATOM 545 O LYS A 36 -4.349 7.936 -5.684 1.00 0.00 O ATOM 546 CB LYS A 36 -1.357 8.485 -7.197 1.00 0.00 C ATOM 547 CG LYS A 36 -1.207 9.346 -5.953 1.00 0.00 C ATOM 548 CD LYS A 36 -0.304 10.541 -6.201 1.00 0.00 C ATOM 549 CE LYS A 36 -0.885 11.472 -7.254 1.00 0.00 C ATOM 550 NZ LYS A 36 -0.036 12.677 -7.459 1.00 0.00 N ATOM 0 H LYS A 36 -1.914 6.975 -9.055 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.226 6.736 -6.273 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -0.409 7.988 -7.401 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.570 9.128 -8.051 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.189 9.693 -5.630 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.799 8.744 -5.141 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.160 11.089 -5.270 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.678 10.195 -6.522 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.987 10.935 -8.197 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.886 11.780 -6.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.466 13.286 -8.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 0.041 13.204 -6.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 0.912 12.385 -7.771 1.00 0.00 H new ATOM 564 N ASP A 37 -4.256 8.931 -7.702 1.00 0.00 N ATOM 565 CA ASP A 37 -5.502 9.675 -7.528 1.00 0.00 C ATOM 566 C ASP A 37 -6.676 8.756 -7.198 1.00 0.00 C ATOM 567 O ASP A 37 -7.464 9.046 -6.298 1.00 0.00 O ATOM 568 CB ASP A 37 -5.811 10.482 -8.790 1.00 0.00 C ATOM 569 CG ASP A 37 -4.681 11.419 -9.173 1.00 0.00 C ATOM 570 OD1 ASP A 37 -3.659 11.444 -8.453 1.00 0.00 O ATOM 571 OD2 ASP A 37 -4.818 12.129 -10.190 1.00 0.00 O ATOM 0 H ASP A 37 -3.794 9.092 -8.597 1.00 0.00 H new ATOM 0 HA ASP A 37 -5.365 10.351 -6.684 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.007 9.798 -9.616 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -6.721 11.061 -8.633 1.00 0.00 H new ATOM 576 N ILE A 38 -6.796 7.652 -7.930 1.00 0.00 N ATOM 577 CA ILE A 38 -7.884 6.701 -7.709 1.00 0.00 C ATOM 578 C ILE A 38 -7.994 6.313 -6.237 1.00 0.00 C ATOM 579 O ILE A 38 -9.092 6.241 -5.685 1.00 0.00 O ATOM 580 CB ILE A 38 -7.700 5.426 -8.565 1.00 0.00 C ATOM 581 CG1 ILE A 38 -7.840 5.760 -10.051 1.00 0.00 C ATOM 582 CG2 ILE A 38 -8.710 4.355 -8.168 1.00 0.00 C ATOM 583 CD1 ILE A 38 -7.437 4.622 -10.962 1.00 0.00 C ATOM 0 H ILE A 38 -6.155 7.393 -8.680 1.00 0.00 H new ATOM 0 HA ILE A 38 -8.805 7.199 -8.011 1.00 0.00 H new ATOM 0 HB ILE A 38 -6.699 5.036 -8.384 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -8.875 6.033 -10.259 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -7.228 6.633 -10.279 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -8.561 3.468 -8.784 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -8.572 4.096 -7.118 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -9.721 4.735 -8.318 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.561 4.927 -12.001 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.394 4.363 -10.781 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -8.066 3.755 -10.761 1.00 0.00 H new ATOM 595 N ALA A 39 -6.853 6.062 -5.611 1.00 0.00 N ATOM 596 CA ALA A 39 -6.826 5.678 -4.206 1.00 0.00 C ATOM 597 C ALA A 39 -7.387 6.781 -3.312 1.00 0.00 C ATOM 598 O ALA A 39 -8.043 6.504 -2.308 1.00 0.00 O ATOM 599 CB ALA A 39 -5.409 5.326 -3.783 1.00 0.00 C ATOM 0 H ALA A 39 -5.935 6.117 -6.052 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.461 4.800 -4.089 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.404 5.041 -2.731 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.045 4.494 -4.386 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.761 6.190 -3.928 1.00 0.00 H new ATOM 605 N ALA A 40 -7.118 8.030 -3.677 1.00 0.00 N ATOM 606 CA ALA A 40 -7.587 9.172 -2.899 1.00 0.00 C ATOM 607 C ALA A 40 -9.107 9.319 -2.950 1.00 0.00 C ATOM 608 O ALA A 40 -9.751 9.556 -1.927 1.00 0.00 O ATOM 609 CB ALA A 40 -6.920 10.448 -3.390 1.00 0.00 C ATOM 0 H ALA A 40 -6.578 8.278 -4.506 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.312 8.994 -1.859 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.277 11.294 -2.803 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.839 10.359 -3.279 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.165 10.606 -4.440 1.00 0.00 H new ATOM 615 N HIS A 41 -9.672 9.203 -4.147 1.00 0.00 N ATOM 616 CA HIS A 41 -11.115 9.348 -4.334 1.00 0.00 C ATOM 617 C HIS A 41 -11.894 8.260 -3.599 1.00 0.00 C ATOM 618 O HIS A 41 -12.825 8.548 -2.849 1.00 0.00 O ATOM 619 CB HIS A 41 -11.460 9.298 -5.821 1.00 0.00 C ATOM 620 CG HIS A 41 -10.522 10.088 -6.673 1.00 0.00 C ATOM 621 ND1 HIS A 41 -10.199 11.405 -6.424 1.00 0.00 N ATOM 622 CD2 HIS A 41 -9.821 9.732 -7.773 1.00 0.00 C ATOM 623 CE1 HIS A 41 -9.338 11.824 -7.332 1.00 0.00 C ATOM 624 NE2 HIS A 41 -9.091 10.826 -8.159 1.00 0.00 N ATOM 0 H HIS A 41 -9.154 9.009 -5.004 1.00 0.00 H new ATOM 0 HA HIS A 41 -11.402 10.314 -3.917 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -11.454 8.260 -6.153 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -12.473 9.673 -5.964 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -10.568 11.968 -5.657 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -9.834 8.767 -8.257 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -8.909 12.814 -7.388 1.00 0.00 H new ATOM 633 N ILE A 42 -11.518 7.008 -3.839 1.00 0.00 N ATOM 634 CA ILE A 42 -12.191 5.869 -3.225 1.00 0.00 C ATOM 635 C ILE A 42 -12.053 5.873 -1.702 1.00 0.00 C ATOM 636 O ILE A 42 -13.037 5.713 -0.983 1.00 0.00 O ATOM 637 CB ILE A 42 -11.638 4.538 -3.774 1.00 0.00 C ATOM 638 CG1 ILE A 42 -11.760 4.499 -5.297 1.00 0.00 C ATOM 639 CG2 ILE A 42 -12.372 3.357 -3.152 1.00 0.00 C ATOM 640 CD1 ILE A 42 -11.226 3.225 -5.913 1.00 0.00 C ATOM 0 H ILE A 42 -10.747 6.756 -4.457 1.00 0.00 H new ATOM 0 HA ILE A 42 -13.247 5.961 -3.479 1.00 0.00 H new ATOM 0 HB ILE A 42 -10.583 4.467 -3.508 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -12.808 4.615 -5.573 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -11.224 5.349 -5.718 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -11.968 2.427 -3.551 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -12.240 3.375 -2.070 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.434 3.423 -3.389 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -11.345 3.267 -6.996 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -10.169 3.117 -5.668 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -11.778 2.371 -5.520 1.00 0.00 H new ATOM 652 N LYS A 43 -10.832 6.037 -1.215 1.00 0.00 N ATOM 653 CA LYS A 43 -10.578 6.034 0.221 1.00 0.00 C ATOM 654 C LYS A 43 -11.415 7.085 0.945 1.00 0.00 C ATOM 655 O LYS A 43 -12.175 6.762 1.858 1.00 0.00 O ATOM 656 CB LYS A 43 -9.085 6.258 0.491 1.00 0.00 C ATOM 657 CG LYS A 43 -8.718 6.291 1.969 1.00 0.00 C ATOM 658 CD LYS A 43 -8.833 7.691 2.559 1.00 0.00 C ATOM 659 CE LYS A 43 -7.781 8.630 1.992 1.00 0.00 C ATOM 660 NZ LYS A 43 -6.401 8.203 2.355 1.00 0.00 N ATOM 0 H LYS A 43 -10.001 6.174 -1.791 1.00 0.00 H new ATOM 0 HA LYS A 43 -10.870 5.059 0.611 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.516 5.466 0.004 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.781 7.198 0.031 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.370 5.612 2.519 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.698 5.927 2.097 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -9.826 8.091 2.354 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -8.728 7.639 3.643 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -7.875 8.668 0.907 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -7.958 9.640 2.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -5.711 8.830 1.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -6.281 8.256 3.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -6.246 7.225 2.038 1.00 0.00 H new ATOM 674 N LYS A 44 -11.266 8.340 0.542 1.00 0.00 N ATOM 675 CA LYS A 44 -12.000 9.438 1.165 1.00 0.00 C ATOM 676 C LYS A 44 -13.511 9.266 1.023 1.00 0.00 C ATOM 677 O LYS A 44 -14.264 9.512 1.967 1.00 0.00 O ATOM 678 CB LYS A 44 -11.569 10.769 0.545 1.00 0.00 C ATOM 679 CG LYS A 44 -10.080 11.044 0.666 1.00 0.00 C ATOM 680 CD LYS A 44 -9.694 12.342 -0.023 1.00 0.00 C ATOM 681 CE LYS A 44 -8.198 12.599 0.071 1.00 0.00 C ATOM 682 NZ LYS A 44 -7.405 11.502 -0.548 1.00 0.00 N ATOM 0 H LYS A 44 -10.643 8.625 -0.214 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.764 9.432 2.229 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.846 10.776 -0.509 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.119 11.578 1.025 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -9.803 11.094 1.719 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -9.520 10.218 0.228 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -9.992 12.302 -1.071 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.236 13.171 0.431 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -7.960 13.541 -0.422 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.913 12.706 1.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -6.980 10.916 0.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -8.028 10.913 -1.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -6.652 11.909 -1.139 1.00 0.00 H new ATOM 696 N GLU A 45 -13.948 8.860 -0.163 1.00 0.00 N ATOM 697 CA GLU A 45 -15.372 8.676 -0.433 1.00 0.00 C ATOM 698 C GLU A 45 -16.032 7.760 0.597 1.00 0.00 C ATOM 699 O GLU A 45 -17.073 8.101 1.162 1.00 0.00 O ATOM 700 CB GLU A 45 -15.565 8.102 -1.839 1.00 0.00 C ATOM 701 CG GLU A 45 -17.017 8.041 -2.283 1.00 0.00 C ATOM 702 CD GLU A 45 -17.642 9.416 -2.431 1.00 0.00 C ATOM 703 OE1 GLU A 45 -16.950 10.418 -2.154 1.00 0.00 O ATOM 704 OE2 GLU A 45 -18.824 9.491 -2.824 1.00 0.00 O ATOM 0 H GLU A 45 -13.339 8.652 -0.954 1.00 0.00 H new ATOM 0 HA GLU A 45 -15.852 9.652 -0.364 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.003 8.709 -2.549 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.142 7.098 -1.873 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.080 7.513 -3.235 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.590 7.462 -1.559 1.00 0.00 H new ATOM 711 N PHE A 46 -15.434 6.597 0.840 1.00 0.00 N ATOM 712 CA PHE A 46 -15.989 5.649 1.803 1.00 0.00 C ATOM 713 C PHE A 46 -15.858 6.158 3.233 1.00 0.00 C ATOM 714 O PHE A 46 -16.792 6.035 4.026 1.00 0.00 O ATOM 715 CB PHE A 46 -15.341 4.276 1.653 1.00 0.00 C ATOM 716 CG PHE A 46 -15.790 3.538 0.420 1.00 0.00 C ATOM 717 CD1 PHE A 46 -15.503 4.025 -0.843 1.00 0.00 C ATOM 718 CD2 PHE A 46 -16.503 2.356 0.530 1.00 0.00 C ATOM 719 CE1 PHE A 46 -15.917 3.347 -1.973 1.00 0.00 C ATOM 720 CE2 PHE A 46 -16.920 1.673 -0.597 1.00 0.00 C ATOM 721 CZ PHE A 46 -16.626 2.169 -1.850 1.00 0.00 C ATOM 0 H PHE A 46 -14.573 6.290 0.388 1.00 0.00 H new ATOM 0 HA PHE A 46 -17.053 5.550 1.587 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -14.258 4.394 1.623 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -15.572 3.675 2.532 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -14.949 4.946 -0.946 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -16.736 1.963 1.509 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -15.686 3.739 -2.953 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -17.475 0.752 -0.497 1.00 0.00 H new ATOM 0 HZ PHE A 46 -16.950 1.637 -2.732 1.00 0.00 H new ATOM 731 N ASP A 47 -14.714 6.750 3.562 1.00 0.00 N ATOM 732 CA ASP A 47 -14.508 7.291 4.903 1.00 0.00 C ATOM 733 C ASP A 47 -15.658 8.223 5.269 1.00 0.00 C ATOM 734 O ASP A 47 -16.043 8.335 6.432 1.00 0.00 O ATOM 735 CB ASP A 47 -13.183 8.055 4.990 1.00 0.00 C ATOM 736 CG ASP A 47 -11.970 7.158 4.846 1.00 0.00 C ATOM 737 OD1 ASP A 47 -11.823 6.225 5.659 1.00 0.00 O ATOM 738 OD2 ASP A 47 -11.162 7.398 3.928 1.00 0.00 O ATOM 0 H ASP A 47 -13.924 6.867 2.928 1.00 0.00 H new ATOM 0 HA ASP A 47 -14.474 6.457 5.604 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -13.158 8.818 4.212 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.132 8.575 5.947 1.00 0.00 H new ATOM 743 N LYS A 48 -16.185 8.899 4.257 1.00 0.00 N ATOM 744 CA LYS A 48 -17.283 9.839 4.437 1.00 0.00 C ATOM 745 C LYS A 48 -18.623 9.118 4.599 1.00 0.00 C ATOM 746 O LYS A 48 -19.425 9.457 5.468 1.00 0.00 O ATOM 747 CB LYS A 48 -17.345 10.773 3.227 1.00 0.00 C ATOM 748 CG LYS A 48 -17.875 12.159 3.542 1.00 0.00 C ATOM 749 CD LYS A 48 -19.222 12.102 4.238 1.00 0.00 C ATOM 750 CE LYS A 48 -19.695 13.487 4.638 1.00 0.00 C ATOM 751 NZ LYS A 48 -19.851 14.384 3.460 1.00 0.00 N ATOM 0 H LYS A 48 -15.865 8.812 3.292 1.00 0.00 H new ATOM 0 HA LYS A 48 -17.100 10.409 5.348 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -16.346 10.866 2.801 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -17.976 10.319 2.463 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -17.161 12.686 4.175 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -17.967 12.732 2.619 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -19.956 11.642 3.577 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -19.150 11.470 5.123 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -20.647 13.408 5.162 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -18.982 13.926 5.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -20.348 15.251 3.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -18.913 14.631 3.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -20.401 13.898 2.724 1.00 0.00 H new ATOM 765 N LYS A 49 -18.869 8.142 3.733 1.00 0.00 N ATOM 766 CA LYS A 49 -20.126 7.392 3.750 1.00 0.00 C ATOM 767 C LYS A 49 -20.143 6.266 4.777 1.00 0.00 C ATOM 768 O LYS A 49 -20.992 6.238 5.669 1.00 0.00 O ATOM 769 CB LYS A 49 -20.403 6.814 2.360 1.00 0.00 C ATOM 770 CG LYS A 49 -20.542 7.870 1.279 1.00 0.00 C ATOM 771 CD LYS A 49 -20.890 7.250 -0.064 1.00 0.00 C ATOM 772 CE LYS A 49 -21.096 8.312 -1.131 1.00 0.00 C ATOM 773 NZ LYS A 49 -22.224 9.223 -0.797 1.00 0.00 N ATOM 0 H LYS A 49 -18.215 7.849 3.007 1.00 0.00 H new ATOM 0 HA LYS A 49 -20.905 8.098 4.037 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -19.594 6.135 2.091 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -21.317 6.222 2.398 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -21.316 8.583 1.563 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -19.610 8.428 1.192 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -20.092 6.574 -0.371 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -21.795 6.651 0.034 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -20.181 8.894 -1.246 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -21.290 7.831 -2.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -22.509 9.749 -1.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -23.030 8.665 -0.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -21.923 9.892 -0.060 1.00 0.00 H new ATOM 787 N TYR A 50 -19.228 5.324 4.626 1.00 0.00 N ATOM 788 CA TYR A 50 -19.158 4.168 5.515 1.00 0.00 C ATOM 789 C TYR A 50 -18.437 4.480 6.822 1.00 0.00 C ATOM 790 O TYR A 50 -18.566 3.731 7.790 1.00 0.00 O ATOM 791 CB TYR A 50 -18.487 2.998 4.797 1.00 0.00 C ATOM 792 CG TYR A 50 -19.272 2.509 3.600 1.00 0.00 C ATOM 793 CD1 TYR A 50 -19.531 3.352 2.527 1.00 0.00 C ATOM 794 CD2 TYR A 50 -19.768 1.213 3.551 1.00 0.00 C ATOM 795 CE1 TYR A 50 -20.260 2.919 1.439 1.00 0.00 C ATOM 796 CE2 TYR A 50 -20.495 0.770 2.462 1.00 0.00 C ATOM 797 CZ TYR A 50 -20.740 1.627 1.410 1.00 0.00 C ATOM 798 OH TYR A 50 -21.465 1.192 0.324 1.00 0.00 O ATOM 0 H TYR A 50 -18.518 5.334 3.894 1.00 0.00 H new ATOM 0 HA TYR A 50 -20.180 3.895 5.777 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -17.492 3.301 4.472 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -18.356 2.175 5.499 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -19.155 4.364 2.545 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -19.583 0.541 4.376 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -20.454 3.589 0.614 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -20.869 -0.243 2.435 1.00 0.00 H new ATOM 0 HH TYR A 50 -20.926 0.562 -0.199 1.00 0.00 H new ATOM 808 N ASN A 51 -17.674 5.572 6.839 1.00 0.00 N ATOM 809 CA ASN A 51 -16.915 5.989 8.021 1.00 0.00 C ATOM 810 C ASN A 51 -15.524 5.368 7.998 1.00 0.00 C ATOM 811 O ASN A 51 -15.350 4.232 7.559 1.00 0.00 O ATOM 812 CB ASN A 51 -17.630 5.625 9.330 1.00 0.00 C ATOM 813 CG ASN A 51 -19.027 6.214 9.412 1.00 0.00 C ATOM 814 OD1 ASN A 51 -19.889 5.921 8.584 1.00 0.00 O ATOM 815 ND2 ASN A 51 -19.257 7.049 10.419 1.00 0.00 N ATOM 0 H ASN A 51 -17.564 6.192 6.037 1.00 0.00 H new ATOM 0 HA ASN A 51 -16.832 7.075 7.985 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -17.691 4.540 9.418 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -17.039 5.980 10.174 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -20.177 7.475 10.528 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -18.513 7.264 11.083 1.00 0.00 H new ATOM 822 N PRO A 52 -14.510 6.116 8.454 1.00 0.00 N ATOM 823 CA PRO A 52 -13.127 5.641 8.462 1.00 0.00 C ATOM 824 C PRO A 52 -12.930 4.382 9.310 1.00 0.00 C ATOM 825 O PRO A 52 -13.819 3.996 10.067 1.00 0.00 O ATOM 826 CB PRO A 52 -12.336 6.817 9.053 1.00 0.00 C ATOM 827 CG PRO A 52 -13.348 7.656 9.752 1.00 0.00 C ATOM 828 CD PRO A 52 -14.623 7.487 8.978 1.00 0.00 C ATOM 0 HA PRO A 52 -12.803 5.354 7.462 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.569 6.468 9.744 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -11.828 7.382 8.272 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -13.473 7.337 10.787 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -13.040 8.701 9.776 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -15.500 7.605 9.614 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -14.709 8.220 8.176 1.00 0.00 H new ATOM 836 N THR A 53 -11.760 3.738 9.177 1.00 0.00 N ATOM 837 CA THR A 53 -10.704 4.198 8.278 1.00 0.00 C ATOM 838 C THR A 53 -10.492 3.223 7.130 1.00 0.00 C ATOM 839 O THR A 53 -10.386 2.016 7.344 1.00 0.00 O ATOM 840 CB THR A 53 -9.401 4.373 9.058 1.00 0.00 C ATOM 841 OG1 THR A 53 -8.381 4.893 8.222 1.00 0.00 O ATOM 842 CG2 THR A 53 -8.888 3.085 9.667 1.00 0.00 C ATOM 0 H THR A 53 -11.525 2.888 9.690 1.00 0.00 H new ATOM 0 HA THR A 53 -11.010 5.155 7.856 1.00 0.00 H new ATOM 0 HB THR A 53 -9.639 5.065 9.865 1.00 0.00 H new ATOM 0 HG1 THR A 53 -7.531 4.450 8.428 1.00 0.00 H new ATOM 0 HG21 THR A 53 -7.961 3.281 10.206 1.00 0.00 H new ATOM 0 HG22 THR A 53 -9.632 2.687 10.357 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.701 2.358 8.877 1.00 0.00 H new ATOM 850 N TRP A 54 -10.433 3.753 5.909 1.00 0.00 N ATOM 851 CA TRP A 54 -10.237 2.923 4.726 1.00 0.00 C ATOM 852 C TRP A 54 -8.835 3.072 4.157 1.00 0.00 C ATOM 853 O TRP A 54 -8.343 4.183 3.956 1.00 0.00 O ATOM 854 CB TRP A 54 -11.260 3.270 3.650 1.00 0.00 C ATOM 855 CG TRP A 54 -12.664 2.999 4.072 1.00 0.00 C ATOM 856 CD1 TRP A 54 -13.346 3.617 5.075 1.00 0.00 C ATOM 857 CD2 TRP A 54 -13.551 2.024 3.519 1.00 0.00 C ATOM 858 NE1 TRP A 54 -14.613 3.105 5.168 1.00 0.00 N ATOM 859 CE2 TRP A 54 -14.763 2.120 4.226 1.00 0.00 C ATOM 860 CE3 TRP A 54 -13.441 1.083 2.490 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -15.855 1.308 3.938 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -14.526 0.276 2.207 1.00 0.00 C ATOM 863 CH2 TRP A 54 -15.720 0.393 2.928 1.00 0.00 C ATOM 0 H TRP A 54 -10.518 4.751 5.716 1.00 0.00 H new ATOM 0 HA TRP A 54 -10.372 1.887 5.037 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -11.162 4.324 3.389 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -11.040 2.697 2.749 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -12.946 4.397 5.706 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -15.328 3.407 5.830 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -12.524 0.989 1.927 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -16.778 1.396 4.492 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -14.452 -0.457 1.417 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -16.551 -0.251 2.683 1.00 0.00 H new ATOM 874 N HIS A 55 -8.211 1.937 3.877 1.00 0.00 N ATOM 875 CA HIS A 55 -6.874 1.917 3.306 1.00 0.00 C ATOM 876 C HIS A 55 -6.967 1.486 1.846 1.00 0.00 C ATOM 877 O HIS A 55 -7.692 0.546 1.523 1.00 0.00 O ATOM 878 CB HIS A 55 -5.989 0.960 4.101 1.00 0.00 C ATOM 879 CG HIS A 55 -6.222 1.040 5.579 1.00 0.00 C ATOM 880 ND1 HIS A 55 -6.097 2.209 6.301 1.00 0.00 N ATOM 881 CD2 HIS A 55 -6.587 0.090 6.469 1.00 0.00 C ATOM 882 CE1 HIS A 55 -6.374 1.972 7.570 1.00 0.00 C ATOM 883 NE2 HIS A 55 -6.675 0.693 7.699 1.00 0.00 N ATOM 0 H HIS A 55 -8.613 1.013 4.037 1.00 0.00 H new ATOM 0 HA HIS A 55 -6.429 2.911 3.355 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -6.172 -0.060 3.764 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -4.943 1.182 3.891 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -5.832 3.115 5.915 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.775 -0.951 6.252 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -6.357 2.701 8.367 1.00 0.00 H new ATOM 892 N CYS A 56 -6.264 2.182 0.959 1.00 0.00 N ATOM 893 CA CYS A 56 -6.329 1.854 -0.461 1.00 0.00 C ATOM 894 C CYS A 56 -4.963 1.923 -1.137 1.00 0.00 C ATOM 895 O CYS A 56 -4.082 2.677 -0.727 1.00 0.00 O ATOM 896 CB CYS A 56 -7.305 2.795 -1.171 1.00 0.00 C ATOM 897 SG CYS A 56 -7.512 2.456 -2.933 1.00 0.00 S ATOM 0 H CYS A 56 -5.652 2.964 1.192 1.00 0.00 H new ATOM 0 HA CYS A 56 -6.680 0.825 -0.538 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -8.277 2.727 -0.683 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -6.957 3.821 -1.048 1.00 0.00 H new ATOM 0 HG CYS A 56 -7.632 1.175 -3.117 1.00 0.00 H new ATOM 903 N ILE A 57 -4.814 1.122 -2.189 1.00 0.00 N ATOM 904 CA ILE A 57 -3.582 1.060 -2.962 1.00 0.00 C ATOM 905 C ILE A 57 -3.902 0.697 -4.411 1.00 0.00 C ATOM 906 O ILE A 57 -4.825 -0.075 -4.670 1.00 0.00 O ATOM 907 CB ILE A 57 -2.603 0.020 -2.378 1.00 0.00 C ATOM 908 CG1 ILE A 57 -2.310 0.333 -0.910 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.312 -0.014 -3.184 1.00 0.00 C ATOM 910 CD1 ILE A 57 -1.353 -0.644 -0.261 1.00 0.00 C ATOM 0 H ILE A 57 -5.546 0.498 -2.528 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.107 2.040 -2.918 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.069 -0.964 -2.438 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.895 1.338 -0.837 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -3.247 0.335 -0.353 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.635 -0.754 -2.756 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -1.535 -0.281 -4.217 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -0.840 0.968 -3.157 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -1.192 -0.359 0.779 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -1.775 -1.648 -0.301 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -0.402 -0.629 -0.793 1.00 0.00 H new ATOM 922 N VAL A 58 -3.149 1.257 -5.351 1.00 0.00 N ATOM 923 CA VAL A 58 -3.383 0.983 -6.764 1.00 0.00 C ATOM 924 C VAL A 58 -2.079 1.001 -7.549 1.00 0.00 C ATOM 925 O VAL A 58 -1.298 1.945 -7.456 1.00 0.00 O ATOM 926 CB VAL A 58 -4.357 2.009 -7.376 1.00 0.00 C ATOM 927 CG1 VAL A 58 -4.641 1.687 -8.837 1.00 0.00 C ATOM 928 CG2 VAL A 58 -5.647 2.064 -6.575 1.00 0.00 C ATOM 0 H VAL A 58 -2.378 1.898 -5.163 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.826 -0.011 -6.829 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.886 2.991 -7.335 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -5.331 2.426 -9.245 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.709 1.709 -9.402 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.087 0.695 -8.911 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -6.322 2.794 -7.022 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.120 1.082 -6.579 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -5.426 2.356 -5.548 1.00 0.00 H new ATOM 938 N GLY A 59 -1.855 -0.053 -8.323 1.00 0.00 N ATOM 939 CA GLY A 59 -0.646 -0.149 -9.117 1.00 0.00 C ATOM 940 C GLY A 59 -0.590 -1.432 -9.921 1.00 0.00 C ATOM 941 O GLY A 59 -1.567 -1.806 -10.571 1.00 0.00 O ATOM 0 H GLY A 59 -2.491 -0.845 -8.415 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.589 0.704 -9.793 1.00 0.00 H new ATOM 0 HA3 GLY A 59 0.223 -0.095 -8.461 1.00 0.00 H new ATOM 945 N ARG A 60 0.551 -2.112 -9.877 1.00 0.00 N ATOM 946 CA ARG A 60 0.718 -3.367 -10.611 1.00 0.00 C ATOM 947 C ARG A 60 2.102 -3.972 -10.386 1.00 0.00 C ATOM 948 O ARG A 60 2.685 -4.557 -11.298 1.00 0.00 O ATOM 949 CB ARG A 60 0.496 -3.134 -12.107 1.00 0.00 C ATOM 950 CG ARG A 60 1.435 -2.097 -12.704 1.00 0.00 C ATOM 951 CD ARG A 60 1.178 -1.899 -14.189 1.00 0.00 C ATOM 952 NE ARG A 60 2.064 -0.892 -14.768 1.00 0.00 N ATOM 953 CZ ARG A 60 2.037 -0.530 -16.048 1.00 0.00 C ATOM 954 NH1 ARG A 60 1.174 -1.089 -16.886 1.00 0.00 N ATOM 955 NH2 ARG A 60 2.878 0.396 -16.493 1.00 0.00 N ATOM 0 H ARG A 60 1.371 -1.820 -9.345 1.00 0.00 H new ATOM 0 HA ARG A 60 -0.024 -4.071 -10.234 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.625 -4.078 -12.637 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -0.534 -2.816 -12.268 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.309 -1.148 -12.183 1.00 0.00 H new ATOM 0 HG3 ARG A 60 2.468 -2.410 -12.551 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.316 -2.846 -14.710 1.00 0.00 H new ATOM 0 HD3 ARG A 60 0.141 -1.600 -14.341 1.00 0.00 H new ATOM 0 HE ARG A 60 2.743 -0.440 -14.155 1.00 0.00 H new ATOM 0 HH11 ARG A 60 0.526 -1.801 -16.550 1.00 0.00 H new ATOM 0 HH12 ARG A 60 1.159 -0.807 -17.866 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.544 0.829 -15.854 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.858 0.674 -17.474 1.00 0.00 H new ATOM 969 N ASN A 61 2.616 -3.833 -9.165 1.00 0.00 N ATOM 970 CA ASN A 61 3.927 -4.362 -8.806 1.00 0.00 C ATOM 971 C ASN A 61 4.335 -3.870 -7.422 1.00 0.00 C ATOM 972 O ASN A 61 5.119 -2.928 -7.301 1.00 0.00 O ATOM 973 CB ASN A 61 4.976 -3.929 -9.829 1.00 0.00 C ATOM 974 CG ASN A 61 6.239 -4.749 -9.729 1.00 0.00 C ATOM 975 OD1 ASN A 61 7.066 -4.549 -8.840 1.00 0.00 O ATOM 976 ND2 ASN A 61 6.366 -5.706 -10.631 1.00 0.00 N ATOM 0 H ASN A 61 2.138 -3.353 -8.402 1.00 0.00 H new ATOM 0 HA ASN A 61 3.865 -5.450 -8.797 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.562 -4.022 -10.833 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.215 -2.876 -9.679 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.179 -6.321 -10.611 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.651 -5.829 -11.348 1.00 0.00 H new ATOM 983 N PHE A 62 3.792 -4.487 -6.376 1.00 0.00 N ATOM 984 CA PHE A 62 4.115 -4.064 -5.018 1.00 0.00 C ATOM 985 C PHE A 62 3.652 -5.070 -3.970 1.00 0.00 C ATOM 986 O PHE A 62 2.510 -5.531 -3.990 1.00 0.00 O ATOM 987 CB PHE A 62 3.460 -2.708 -4.746 1.00 0.00 C ATOM 988 CG PHE A 62 1.960 -2.776 -4.610 1.00 0.00 C ATOM 989 CD1 PHE A 62 1.378 -3.176 -3.417 1.00 0.00 C ATOM 990 CD2 PHE A 62 1.134 -2.455 -5.677 1.00 0.00 C ATOM 991 CE1 PHE A 62 0.005 -3.251 -3.290 1.00 0.00 C ATOM 992 CE2 PHE A 62 -0.240 -2.526 -5.555 1.00 0.00 C ATOM 993 CZ PHE A 62 -0.806 -2.926 -4.360 1.00 0.00 C ATOM 0 H PHE A 62 3.138 -5.267 -6.440 1.00 0.00 H new ATOM 0 HA PHE A 62 5.200 -3.991 -4.943 1.00 0.00 H new ATOM 0 HB2 PHE A 62 3.880 -2.288 -3.832 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.712 -2.024 -5.556 1.00 0.00 H new ATOM 0 HD1 PHE A 62 2.006 -3.432 -2.577 1.00 0.00 H new ATOM 0 HD2 PHE A 62 1.571 -2.146 -6.615 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.435 -3.564 -2.354 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -0.871 -2.269 -6.393 1.00 0.00 H new ATOM 0 HZ PHE A 62 -1.880 -2.984 -4.263 1.00 0.00 H new ATOM 1003 N GLY A 63 4.540 -5.372 -3.032 1.00 0.00 N ATOM 1004 CA GLY A 63 4.202 -6.279 -1.951 1.00 0.00 C ATOM 1005 C GLY A 63 3.484 -5.532 -0.848 1.00 0.00 C ATOM 1006 O GLY A 63 3.913 -4.444 -0.465 1.00 0.00 O ATOM 0 H GLY A 63 5.491 -5.004 -3.000 1.00 0.00 H new ATOM 0 HA2 GLY A 63 3.570 -7.084 -2.326 1.00 0.00 H new ATOM 0 HA3 GLY A 63 5.107 -6.741 -1.558 1.00 0.00 H new ATOM 1010 N SER A 64 2.378 -6.075 -0.348 1.00 0.00 N ATOM 1011 CA SER A 64 1.621 -5.380 0.690 1.00 0.00 C ATOM 1012 C SER A 64 1.340 -6.251 1.910 1.00 0.00 C ATOM 1013 O SER A 64 1.085 -7.452 1.800 1.00 0.00 O ATOM 1014 CB SER A 64 0.301 -4.860 0.120 1.00 0.00 C ATOM 1015 OG SER A 64 -0.441 -4.163 1.107 1.00 0.00 O ATOM 0 H SER A 64 1.992 -6.974 -0.636 1.00 0.00 H new ATOM 0 HA SER A 64 2.243 -4.549 1.023 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.501 -4.199 -0.724 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.288 -5.694 -0.261 1.00 0.00 H new ATOM 0 HG SER A 64 -1.280 -3.839 0.717 1.00 0.00 H new ATOM 1021 N TYR A 65 1.369 -5.606 3.076 1.00 0.00 N ATOM 1022 CA TYR A 65 1.098 -6.264 4.346 1.00 0.00 C ATOM 1023 C TYR A 65 0.474 -5.242 5.297 1.00 0.00 C ATOM 1024 O TYR A 65 1.048 -4.181 5.545 1.00 0.00 O ATOM 1025 CB TYR A 65 2.389 -6.846 4.934 1.00 0.00 C ATOM 1026 CG TYR A 65 2.175 -7.886 6.019 1.00 0.00 C ATOM 1027 CD1 TYR A 65 0.901 -8.211 6.468 1.00 0.00 C ATOM 1028 CD2 TYR A 65 3.255 -8.550 6.589 1.00 0.00 C ATOM 1029 CE1 TYR A 65 0.710 -9.163 7.450 1.00 0.00 C ATOM 1030 CE2 TYR A 65 3.071 -9.507 7.569 1.00 0.00 C ATOM 1031 CZ TYR A 65 1.797 -9.808 7.996 1.00 0.00 C ATOM 1032 OH TYR A 65 1.609 -10.759 8.973 1.00 0.00 O ATOM 0 H TYR A 65 1.582 -4.612 3.163 1.00 0.00 H new ATOM 0 HA TYR A 65 0.405 -7.092 4.197 1.00 0.00 H new ATOM 0 HB2 TYR A 65 2.970 -7.295 4.128 1.00 0.00 H new ATOM 0 HB3 TYR A 65 2.987 -6.031 5.343 1.00 0.00 H new ATOM 0 HD1 TYR A 65 0.045 -7.710 6.041 1.00 0.00 H new ATOM 0 HD2 TYR A 65 4.256 -8.314 6.260 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -0.288 -9.401 7.788 1.00 0.00 H new ATOM 0 HE2 TYR A 65 3.922 -10.016 7.998 1.00 0.00 H new ATOM 0 HH TYR A 65 2.477 -11.119 9.251 1.00 0.00 H new ATOM 1042 N VAL A 66 -0.728 -5.541 5.781 1.00 0.00 N ATOM 1043 CA VAL A 66 -1.460 -4.624 6.651 1.00 0.00 C ATOM 1044 C VAL A 66 -2.429 -5.376 7.566 1.00 0.00 C ATOM 1045 O VAL A 66 -2.682 -6.560 7.368 1.00 0.00 O ATOM 1046 CB VAL A 66 -2.275 -3.634 5.793 1.00 0.00 C ATOM 1047 CG1 VAL A 66 -2.894 -2.541 6.646 1.00 0.00 C ATOM 1048 CG2 VAL A 66 -1.411 -3.033 4.695 1.00 0.00 C ATOM 0 H VAL A 66 -1.218 -6.414 5.585 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.729 -4.096 7.264 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.087 -4.192 5.326 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.461 -1.861 6.011 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.560 -2.989 7.384 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.106 -1.988 7.157 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.006 -2.338 4.103 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.571 -2.501 5.143 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.035 -3.828 4.052 1.00 0.00 H new ATOM 1058 N THR A 67 -2.977 -4.678 8.560 1.00 0.00 N ATOM 1059 CA THR A 67 -3.935 -5.280 9.485 1.00 0.00 C ATOM 1060 C THR A 67 -5.268 -4.543 9.410 1.00 0.00 C ATOM 1061 O THR A 67 -5.303 -3.328 9.217 1.00 0.00 O ATOM 1062 CB THR A 67 -3.394 -5.258 10.917 1.00 0.00 C ATOM 1063 OG1 THR A 67 -2.175 -5.975 11.002 1.00 0.00 O ATOM 1064 CG2 THR A 67 -4.349 -5.858 11.927 1.00 0.00 C ATOM 0 H THR A 67 -2.774 -3.696 8.745 1.00 0.00 H new ATOM 0 HA THR A 67 -4.089 -6.320 9.196 1.00 0.00 H new ATOM 0 HB THR A 67 -3.252 -4.204 11.156 1.00 0.00 H new ATOM 0 HG1 THR A 67 -2.220 -6.610 11.748 1.00 0.00 H new ATOM 0 HG21 THR A 67 -3.904 -5.811 12.921 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.284 -5.298 11.921 1.00 0.00 H new ATOM 0 HG23 THR A 67 -4.547 -6.898 11.667 1.00 0.00 H new ATOM 1072 N HIS A 68 -6.367 -5.286 9.526 1.00 0.00 N ATOM 1073 CA HIS A 68 -7.694 -4.692 9.426 1.00 0.00 C ATOM 1074 C HIS A 68 -8.769 -5.623 9.979 1.00 0.00 C ATOM 1075 O HIS A 68 -8.616 -6.844 9.970 1.00 0.00 O ATOM 1076 CB HIS A 68 -7.979 -4.400 7.961 1.00 0.00 C ATOM 1077 CG HIS A 68 -7.918 -5.638 7.129 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -8.941 -6.556 7.081 1.00 0.00 N ATOM 1079 CD2 HIS A 68 -6.919 -6.149 6.372 1.00 0.00 C ATOM 1080 CE1 HIS A 68 -8.578 -7.578 6.331 1.00 0.00 C ATOM 1081 NE2 HIS A 68 -7.355 -7.357 5.887 1.00 0.00 N ATOM 0 H HIS A 68 -6.363 -6.293 9.688 1.00 0.00 H new ATOM 0 HA HIS A 68 -7.715 -3.776 10.016 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -8.965 -3.946 7.866 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -7.256 -3.674 7.587 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -9.841 -6.461 7.552 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -5.959 -5.692 6.185 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -9.180 -8.449 6.116 1.00 0.00 H new ATOM 1090 N GLU A 69 -9.859 -5.031 10.451 1.00 0.00 N ATOM 1091 CA GLU A 69 -10.977 -5.792 10.999 1.00 0.00 C ATOM 1092 C GLU A 69 -11.541 -6.762 9.960 1.00 0.00 C ATOM 1093 O GLU A 69 -11.683 -6.416 8.788 1.00 0.00 O ATOM 1094 CB GLU A 69 -12.070 -4.831 11.471 1.00 0.00 C ATOM 1095 CG GLU A 69 -13.306 -5.524 12.014 1.00 0.00 C ATOM 1096 CD GLU A 69 -13.002 -6.415 13.203 1.00 0.00 C ATOM 1097 OE1 GLU A 69 -12.504 -5.895 14.223 1.00 0.00 O ATOM 1098 OE2 GLU A 69 -13.264 -7.633 13.113 1.00 0.00 O ATOM 0 H GLU A 69 -9.994 -4.020 10.466 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.617 -6.377 11.846 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -11.660 -4.182 12.245 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -12.361 -4.190 10.639 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -14.040 -4.773 12.306 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.759 -6.122 11.223 1.00 0.00 H new ATOM 1105 N THR A 70 -11.859 -7.980 10.398 1.00 0.00 N ATOM 1106 CA THR A 70 -12.407 -8.998 9.504 1.00 0.00 C ATOM 1107 C THR A 70 -13.697 -8.519 8.847 1.00 0.00 C ATOM 1108 O THR A 70 -14.457 -7.752 9.438 1.00 0.00 O ATOM 1109 CB THR A 70 -12.663 -10.300 10.259 1.00 0.00 C ATOM 1110 OG1 THR A 70 -13.526 -10.080 11.361 1.00 0.00 O ATOM 1111 CG2 THR A 70 -11.402 -10.949 10.782 1.00 0.00 C ATOM 0 H THR A 70 -11.747 -8.285 11.365 1.00 0.00 H new ATOM 0 HA THR A 70 -11.669 -9.180 8.723 1.00 0.00 H new ATOM 0 HB THR A 70 -13.118 -10.970 9.530 1.00 0.00 H new ATOM 0 HG1 THR A 70 -13.244 -9.273 11.841 1.00 0.00 H new ATOM 0 HG21 THR A 70 -11.657 -11.869 11.308 1.00 0.00 H new ATOM 0 HG22 THR A 70 -10.739 -11.180 9.948 1.00 0.00 H new ATOM 0 HG23 THR A 70 -10.899 -10.267 11.468 1.00 0.00 H new ATOM 1119 N LYS A 71 -13.933 -8.973 7.619 1.00 0.00 N ATOM 1120 CA LYS A 71 -15.124 -8.589 6.865 1.00 0.00 C ATOM 1121 C LYS A 71 -15.065 -7.112 6.506 1.00 0.00 C ATOM 1122 O LYS A 71 -16.084 -6.418 6.493 1.00 0.00 O ATOM 1123 CB LYS A 71 -16.398 -8.881 7.665 1.00 0.00 C ATOM 1124 CG LYS A 71 -16.550 -10.335 8.094 1.00 0.00 C ATOM 1125 CD LYS A 71 -17.118 -11.217 6.987 1.00 0.00 C ATOM 1126 CE LYS A 71 -16.197 -11.295 5.780 1.00 0.00 C ATOM 1127 NZ LYS A 71 -16.645 -12.327 4.803 1.00 0.00 N ATOM 0 H LYS A 71 -13.311 -9.611 7.122 1.00 0.00 H new ATOM 0 HA LYS A 71 -15.150 -9.180 5.949 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -16.408 -8.249 8.553 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.263 -8.599 7.064 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -15.578 -10.723 8.400 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.203 -10.386 8.965 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -17.288 -12.221 7.377 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -18.087 -10.827 6.677 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -16.160 -10.323 5.289 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -15.184 -11.524 6.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -15.990 -12.348 3.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -16.656 -13.259 5.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -17.602 -12.095 4.467 1.00 0.00 H new ATOM 1141 N HIS A 72 -13.861 -6.641 6.210 1.00 0.00 N ATOM 1142 CA HIS A 72 -13.643 -5.247 5.842 1.00 0.00 C ATOM 1143 C HIS A 72 -12.405 -5.120 4.962 1.00 0.00 C ATOM 1144 O HIS A 72 -11.537 -4.282 5.209 1.00 0.00 O ATOM 1145 CB HIS A 72 -13.480 -4.370 7.091 1.00 0.00 C ATOM 1146 CG HIS A 72 -14.689 -4.328 7.978 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -15.121 -5.406 8.721 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -15.561 -3.326 8.238 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -16.206 -5.069 9.396 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -16.493 -3.812 9.120 1.00 0.00 N ATOM 0 H HIS A 72 -13.014 -7.209 6.218 1.00 0.00 H new ATOM 0 HA HIS A 72 -14.516 -4.905 5.287 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -12.632 -4.736 7.670 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -13.238 -3.354 6.778 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -14.673 -6.322 8.746 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -15.529 -2.328 7.827 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -16.763 -5.713 10.060 1.00 0.00 H new ATOM 1159 N PHE A 73 -12.323 -5.963 3.936 1.00 0.00 N ATOM 1160 CA PHE A 73 -11.183 -5.943 3.029 1.00 0.00 C ATOM 1161 C PHE A 73 -11.541 -6.538 1.672 1.00 0.00 C ATOM 1162 O PHE A 73 -12.351 -7.461 1.576 1.00 0.00 O ATOM 1163 CB PHE A 73 -10.004 -6.702 3.649 1.00 0.00 C ATOM 1164 CG PHE A 73 -8.772 -6.727 2.787 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -8.744 -7.458 1.608 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -7.644 -6.012 3.153 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -7.614 -7.475 0.813 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -6.510 -6.026 2.361 1.00 0.00 C ATOM 1169 CZ PHE A 73 -6.496 -6.758 1.191 1.00 0.00 C ATOM 0 H PHE A 73 -13.029 -6.665 3.714 1.00 0.00 H new ATOM 0 HA PHE A 73 -10.896 -4.903 2.871 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -9.755 -6.246 4.607 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -10.312 -7.727 3.854 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -9.616 -8.020 1.308 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -7.650 -5.437 4.067 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.605 -8.048 -0.102 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.636 -5.465 2.658 1.00 0.00 H new ATOM 0 HZ PHE A 73 -5.611 -6.770 0.572 1.00 0.00 H new ATOM 1179 N ILE A 74 -10.925 -5.998 0.623 1.00 0.00 N ATOM 1180 CA ILE A 74 -11.168 -6.463 -0.736 1.00 0.00 C ATOM 1181 C ILE A 74 -10.029 -6.060 -1.671 1.00 0.00 C ATOM 1182 O ILE A 74 -9.485 -4.962 -1.569 1.00 0.00 O ATOM 1183 CB ILE A 74 -12.493 -5.909 -1.295 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -12.711 -6.392 -2.732 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -12.497 -4.389 -1.235 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -13.999 -5.898 -3.346 1.00 0.00 C ATOM 0 H ILE A 74 -10.252 -5.235 0.691 1.00 0.00 H new ATOM 0 HA ILE A 74 -11.229 -7.550 -0.688 1.00 0.00 H new ATOM 0 HB ILE A 74 -13.313 -6.281 -0.680 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -11.874 -6.062 -3.348 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -12.706 -7.482 -2.745 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -13.439 -4.012 -1.633 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -12.385 -4.065 -0.200 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -11.670 -3.999 -1.829 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -14.087 -6.279 -4.363 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -14.843 -6.250 -2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -13.998 -4.808 -3.366 1.00 0.00 H new ATOM 1198 N TYR A 75 -9.688 -6.961 -2.586 1.00 0.00 N ATOM 1199 CA TYR A 75 -8.626 -6.716 -3.554 1.00 0.00 C ATOM 1200 C TYR A 75 -9.088 -7.164 -4.936 1.00 0.00 C ATOM 1201 O TYR A 75 -9.688 -8.231 -5.076 1.00 0.00 O ATOM 1202 CB TYR A 75 -7.358 -7.470 -3.147 1.00 0.00 C ATOM 1203 CG TYR A 75 -6.120 -7.052 -3.910 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -6.037 -7.209 -5.289 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -5.032 -6.501 -3.245 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -4.903 -6.825 -5.981 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -3.897 -6.116 -3.931 1.00 0.00 C ATOM 1208 CZ TYR A 75 -3.836 -6.280 -5.298 1.00 0.00 C ATOM 1209 OH TYR A 75 -2.707 -5.899 -5.983 1.00 0.00 O ATOM 0 H TYR A 75 -10.135 -7.873 -2.677 1.00 0.00 H new ATOM 0 HA TYR A 75 -8.399 -5.650 -3.580 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -7.184 -7.318 -2.082 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.520 -8.538 -3.295 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -6.870 -7.637 -5.827 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -5.074 -6.372 -2.174 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -4.853 -6.951 -7.052 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.061 -5.688 -3.398 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.010 -5.639 -5.345 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.831 -6.349 -5.954 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.258 -6.689 -7.308 1.00 0.00 C ATOM 1221 C PHE A 76 -8.575 -5.819 -8.360 1.00 0.00 C ATOM 1222 O PHE A 76 -8.396 -4.615 -8.173 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.780 -6.548 -7.419 1.00 0.00 C ATOM 1224 CG PHE A 76 -11.287 -5.164 -7.121 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -11.029 -4.113 -7.988 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -12.019 -4.912 -5.971 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -11.493 -2.840 -7.715 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -12.486 -3.641 -5.694 1.00 0.00 C ATOM 1229 CZ PHE A 76 -12.222 -2.604 -6.567 1.00 0.00 C ATOM 0 H PHE A 76 -8.336 -5.461 -5.871 1.00 0.00 H new ATOM 0 HA PHE A 76 -8.966 -7.722 -7.499 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.089 -6.828 -8.426 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.251 -7.252 -6.734 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.459 -4.291 -8.888 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -12.227 -5.718 -5.283 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -11.285 -2.031 -8.399 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -13.057 -3.459 -4.796 1.00 0.00 H new ATOM 0 HZ PHE A 76 -12.585 -1.610 -6.352 1.00 0.00 H new ATOM 1239 N TYR A 77 -8.209 -6.443 -9.479 1.00 0.00 N ATOM 1240 CA TYR A 77 -7.565 -5.739 -10.582 1.00 0.00 C ATOM 1241 C TYR A 77 -8.616 -5.072 -11.465 1.00 0.00 C ATOM 1242 O TYR A 77 -9.765 -5.513 -11.509 1.00 0.00 O ATOM 1243 CB TYR A 77 -6.717 -6.701 -11.416 1.00 0.00 C ATOM 1244 CG TYR A 77 -5.523 -7.264 -10.677 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -5.688 -8.059 -9.548 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -4.230 -7.002 -11.110 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -4.597 -8.575 -8.873 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -3.134 -7.514 -10.442 1.00 0.00 C ATOM 1249 CZ TYR A 77 -3.323 -8.298 -9.324 1.00 0.00 C ATOM 1250 OH TYR A 77 -2.235 -8.811 -8.656 1.00 0.00 O ATOM 0 H TYR A 77 -8.349 -7.440 -9.644 1.00 0.00 H new ATOM 0 HA TYR A 77 -6.911 -4.973 -10.165 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.346 -7.526 -11.752 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -6.368 -6.182 -12.308 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.684 -8.277 -9.193 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.078 -6.387 -11.985 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -4.741 -9.191 -7.998 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -2.135 -7.301 -10.794 1.00 0.00 H new ATOM 0 HH TYR A 77 -1.634 -9.246 -9.296 1.00 0.00 H new ATOM 1260 N LEU A 78 -8.225 -4.011 -12.165 1.00 0.00 N ATOM 1261 CA LEU A 78 -9.155 -3.300 -13.037 1.00 0.00 C ATOM 1262 C LEU A 78 -8.421 -2.440 -14.063 1.00 0.00 C ATOM 1263 O LEU A 78 -7.444 -1.763 -13.742 1.00 0.00 O ATOM 1264 CB LEU A 78 -10.094 -2.423 -12.204 1.00 0.00 C ATOM 1265 CG LEU A 78 -11.115 -1.620 -13.010 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -11.989 -2.548 -13.841 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -11.968 -0.766 -12.085 1.00 0.00 C ATOM 0 H LEU A 78 -7.280 -3.627 -12.147 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.736 -4.047 -13.577 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.630 -3.059 -11.499 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -9.492 -1.730 -11.616 1.00 0.00 H new ATOM 0 HG LEU A 78 -10.576 -0.959 -13.689 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -12.710 -1.958 -14.408 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.364 -3.117 -14.529 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -12.520 -3.234 -13.182 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.690 -0.201 -12.674 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.498 -1.409 -11.382 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -11.329 -0.076 -11.535 1.00 0.00 H new ATOM 1279 N GLY A 79 -8.905 -2.484 -15.304 1.00 0.00 N ATOM 1280 CA GLY A 79 -8.305 -1.721 -16.381 1.00 0.00 C ATOM 1281 C GLY A 79 -6.924 -2.224 -16.728 1.00 0.00 C ATOM 1282 O GLY A 79 -6.705 -2.769 -17.809 1.00 0.00 O ATOM 0 H GLY A 79 -9.712 -3.043 -15.582 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.943 -1.775 -17.263 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.247 -0.671 -16.093 1.00 0.00 H new ATOM 1286 N GLN A 80 -5.999 -2.058 -15.795 1.00 0.00 N ATOM 1287 CA GLN A 80 -4.633 -2.513 -15.982 1.00 0.00 C ATOM 1288 C GLN A 80 -3.797 -2.183 -14.749 1.00 0.00 C ATOM 1289 O GLN A 80 -2.621 -1.841 -14.853 1.00 0.00 O ATOM 1290 CB GLN A 80 -4.016 -1.869 -17.229 1.00 0.00 C ATOM 1291 CG GLN A 80 -2.659 -2.440 -17.611 1.00 0.00 C ATOM 1292 CD GLN A 80 -2.101 -1.817 -18.876 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -1.883 -0.609 -18.943 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -1.869 -2.645 -19.890 1.00 0.00 N ATOM 0 H GLN A 80 -6.173 -1.609 -14.896 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.644 -3.594 -16.123 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -4.701 -1.995 -18.067 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -3.913 -0.797 -17.059 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -1.958 -2.281 -16.792 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -2.748 -3.518 -17.749 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -2.065 -3.641 -19.790 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -1.495 -2.284 -20.768 1.00 0.00 H new ATOM 1303 N VAL A 81 -4.422 -2.289 -13.579 1.00 0.00 N ATOM 1304 CA VAL A 81 -3.746 -2.002 -12.320 1.00 0.00 C ATOM 1305 C VAL A 81 -4.470 -2.660 -11.151 1.00 0.00 C ATOM 1306 O VAL A 81 -5.694 -2.594 -11.050 1.00 0.00 O ATOM 1307 CB VAL A 81 -3.655 -0.484 -12.059 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -2.816 0.198 -13.127 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -5.046 0.132 -11.989 1.00 0.00 C ATOM 0 H VAL A 81 -5.397 -2.572 -13.478 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.738 -2.409 -12.403 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.165 -0.332 -11.097 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.766 1.267 -12.922 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.809 -0.220 -13.121 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.270 0.037 -14.105 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.961 1.203 -11.804 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.565 -0.033 -12.933 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.609 -0.332 -11.179 1.00 0.00 H new ATOM 1319 N ALA A 82 -3.705 -3.294 -10.270 1.00 0.00 N ATOM 1320 CA ALA A 82 -4.276 -3.964 -9.110 1.00 0.00 C ATOM 1321 C ALA A 82 -4.816 -2.951 -8.106 1.00 0.00 C ATOM 1322 O ALA A 82 -4.084 -2.082 -7.630 1.00 0.00 O ATOM 1323 CB ALA A 82 -3.235 -4.857 -8.452 1.00 0.00 C ATOM 0 H ALA A 82 -2.689 -3.358 -10.337 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.107 -4.582 -9.449 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -3.675 -5.352 -7.586 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -2.896 -5.608 -9.166 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -2.387 -4.252 -8.132 1.00 0.00 H new ATOM 1329 N ILE A 83 -6.101 -3.067 -7.788 1.00 0.00 N ATOM 1330 CA ILE A 83 -6.738 -2.163 -6.839 1.00 0.00 C ATOM 1331 C ILE A 83 -6.869 -2.814 -5.466 1.00 0.00 C ATOM 1332 O ILE A 83 -7.122 -4.014 -5.359 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.130 -1.719 -7.332 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -8.017 -1.072 -8.714 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.765 -0.752 -6.341 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.348 -0.629 -9.284 1.00 0.00 C ATOM 0 H ILE A 83 -6.721 -3.779 -8.174 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.099 -1.284 -6.757 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.769 -2.598 -7.409 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -7.353 -0.210 -8.650 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.554 -1.780 -9.401 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.747 -0.450 -6.706 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.873 -1.241 -5.373 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.131 0.128 -6.234 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -9.192 -0.179 -10.265 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -10.008 -1.491 -9.381 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.804 0.103 -8.617 1.00 0.00 H new ATOM 1348 N LEU A 84 -6.692 -2.016 -4.420 1.00 0.00 N ATOM 1349 CA LEU A 84 -6.789 -2.511 -3.054 1.00 0.00 C ATOM 1350 C LEU A 84 -7.626 -1.574 -2.191 1.00 0.00 C ATOM 1351 O LEU A 84 -7.524 -0.354 -2.305 1.00 0.00 O ATOM 1352 CB LEU A 84 -5.394 -2.668 -2.447 1.00 0.00 C ATOM 1353 CG LEU A 84 -5.368 -3.125 -0.987 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -6.037 -4.484 -0.839 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -3.937 -3.171 -0.468 1.00 0.00 C ATOM 0 H LEU A 84 -6.480 -1.021 -4.493 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.280 -3.484 -3.083 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.833 -3.385 -3.046 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.873 -1.714 -2.522 1.00 0.00 H new ATOM 0 HG LEU A 84 -5.926 -2.403 -0.391 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.008 -4.792 0.206 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -7.074 -4.417 -1.169 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -5.509 -5.218 -1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.937 -3.498 0.572 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.355 -3.870 -1.068 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.493 -2.178 -0.536 1.00 0.00 H new ATOM 1367 N LEU A 85 -8.453 -2.153 -1.328 1.00 0.00 N ATOM 1368 CA LEU A 85 -9.307 -1.368 -0.445 1.00 0.00 C ATOM 1369 C LEU A 85 -9.738 -2.194 0.761 1.00 0.00 C ATOM 1370 O LEU A 85 -10.096 -3.365 0.629 1.00 0.00 O ATOM 1371 CB LEU A 85 -10.537 -0.863 -1.198 1.00 0.00 C ATOM 1372 CG LEU A 85 -11.478 0.022 -0.377 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -10.752 1.271 0.100 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -12.705 0.395 -1.194 1.00 0.00 C ATOM 0 H LEU A 85 -8.550 -3.163 -1.221 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.733 -0.510 -0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -10.205 -0.302 -2.072 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.098 -1.722 -1.565 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.806 -0.540 0.498 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -11.435 1.889 0.682 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -9.904 0.984 0.721 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.396 1.836 -0.761 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.363 1.024 -0.595 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -12.396 0.939 -2.087 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.236 -0.511 -1.487 1.00 0.00 H new ATOM 1386 N PHE A 86 -9.696 -1.579 1.937 1.00 0.00 N ATOM 1387 CA PHE A 86 -10.076 -2.255 3.170 1.00 0.00 C ATOM 1388 C PHE A 86 -10.068 -1.285 4.345 1.00 0.00 C ATOM 1389 O PHE A 86 -9.082 -0.583 4.574 1.00 0.00 O ATOM 1390 CB PHE A 86 -9.123 -3.420 3.449 1.00 0.00 C ATOM 1391 CG PHE A 86 -7.681 -3.014 3.592 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -6.975 -2.511 2.510 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -7.035 -3.138 4.810 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -5.649 -2.142 2.642 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -5.711 -2.770 4.947 1.00 0.00 C ATOM 1396 CZ PHE A 86 -5.017 -2.271 3.862 1.00 0.00 C ATOM 0 H PHE A 86 -9.402 -0.610 2.062 1.00 0.00 H new ATOM 0 HA PHE A 86 -11.088 -2.642 3.048 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -9.440 -3.924 4.362 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -9.206 -4.145 2.640 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -7.466 -2.406 1.554 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -7.572 -3.527 5.662 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -5.109 -1.753 1.791 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -5.218 -2.872 5.903 1.00 0.00 H new ATOM 0 HZ PHE A 86 -3.982 -1.982 3.968 1.00 0.00 H new ATOM 1406 N LYS A 87 -11.172 -1.242 5.085 1.00 0.00 N ATOM 1407 CA LYS A 87 -11.279 -0.346 6.230 1.00 0.00 C ATOM 1408 C LYS A 87 -10.939 -1.051 7.533 1.00 0.00 C ATOM 1409 O LYS A 87 -10.789 -2.272 7.579 1.00 0.00 O ATOM 1410 CB LYS A 87 -12.675 0.266 6.331 1.00 0.00 C ATOM 1411 CG LYS A 87 -13.783 -0.748 6.565 1.00 0.00 C ATOM 1412 CD LYS A 87 -15.092 -0.060 6.924 1.00 0.00 C ATOM 1413 CE LYS A 87 -15.019 0.596 8.294 1.00 0.00 C ATOM 1414 NZ LYS A 87 -16.303 1.253 8.665 1.00 0.00 N ATOM 0 H LYS A 87 -11.999 -1.813 4.913 1.00 0.00 H new ATOM 0 HA LYS A 87 -10.554 0.451 6.068 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.684 0.992 7.144 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -12.887 0.814 5.413 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.921 -1.353 5.669 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.494 -1.427 7.367 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.327 0.692 6.171 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.903 -0.788 6.911 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -14.766 -0.155 9.043 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.218 1.335 8.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -16.450 1.174 9.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -16.269 2.257 8.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -17.088 0.787 8.166 1.00 0.00 H new ATOM 1428 N SER A 88 -10.819 -0.260 8.593 1.00 0.00 N ATOM 1429 CA SER A 88 -10.496 -0.786 9.912 1.00 0.00 C ATOM 1430 C SER A 88 -11.145 0.060 11.002 1.00 0.00 C ATOM 1431 O SER A 88 -11.073 1.288 10.977 1.00 0.00 O ATOM 1432 CB SER A 88 -8.982 -0.811 10.114 1.00 0.00 C ATOM 1433 OG SER A 88 -8.352 -1.640 9.154 1.00 0.00 O ATOM 0 H SER A 88 -10.941 0.752 8.563 1.00 0.00 H new ATOM 0 HA SER A 88 -10.884 -1.802 9.978 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.586 0.202 10.040 1.00 0.00 H new ATOM 0 HB3 SER A 88 -8.752 -1.171 11.117 1.00 0.00 H new ATOM 0 HG SER A 88 -7.771 -1.096 8.583 1.00 0.00 H new ATOM 1536 N ALA B 6 19.684 2.989 2.993 1.00 0.00 N ATOM 1537 CA ALA B 6 18.308 3.367 2.676 1.00 0.00 C ATOM 1538 C ALA B 6 18.104 4.871 2.824 1.00 0.00 C ATOM 1539 O ALA B 6 18.415 5.446 3.867 1.00 0.00 O ATOM 1540 CB ALA B 6 17.337 2.623 3.578 1.00 0.00 C ATOM 0 HA ALA B 6 18.115 3.095 1.638 1.00 0.00 H new ATOM 0 HB1 ALA B 6 16.316 2.914 3.331 1.00 0.00 H new ATOM 0 HB2 ALA B 6 17.454 1.549 3.431 1.00 0.00 H new ATOM 0 HB3 ALA B 6 17.544 2.872 4.619 1.00 0.00 H new ATOM 1546 N VAL B 7 17.581 5.509 1.780 1.00 0.00 N ATOM 1547 CA VAL B 7 17.341 6.937 1.810 1.00 0.00 C ATOM 1548 C VAL B 7 15.934 7.259 2.294 1.00 0.00 C ATOM 1549 O VAL B 7 14.964 6.617 1.893 1.00 0.00 O ATOM 1550 CB VAL B 7 17.551 7.572 0.433 1.00 0.00 C ATOM 1551 CG1 VAL B 7 19.012 7.488 0.019 1.00 0.00 C ATOM 1552 CG2 VAL B 7 16.658 6.915 -0.606 1.00 0.00 C ATOM 0 H VAL B 7 17.318 5.054 0.906 1.00 0.00 H new ATOM 0 HA VAL B 7 18.064 7.355 2.511 1.00 0.00 H new ATOM 0 HB VAL B 7 17.276 8.625 0.499 1.00 0.00 H new ATOM 0 HG11 VAL B 7 19.139 7.945 -0.962 1.00 0.00 H new ATOM 0 HG12 VAL B 7 19.628 8.016 0.747 1.00 0.00 H new ATOM 0 HG13 VAL B 7 19.318 6.443 -0.025 1.00 0.00 H new ATOM 0 HG21 VAL B 7 16.824 7.382 -1.577 1.00 0.00 H new ATOM 0 HG22 VAL B 7 16.894 5.853 -0.669 1.00 0.00 H new ATOM 0 HG23 VAL B 7 15.614 7.038 -0.318 1.00 0.00 H new ATOM 1562 N ILE B 8 15.835 8.263 3.153 1.00 0.00 N ATOM 1563 CA ILE B 8 14.548 8.681 3.699 1.00 0.00 C ATOM 1564 C ILE B 8 13.825 9.628 2.744 1.00 0.00 C ATOM 1565 O ILE B 8 14.394 10.620 2.284 1.00 0.00 O ATOM 1566 CB ILE B 8 14.712 9.360 5.079 1.00 0.00 C ATOM 1567 CG1 ILE B 8 15.226 8.358 6.117 1.00 0.00 C ATOM 1568 CG2 ILE B 8 13.394 9.964 5.543 1.00 0.00 C ATOM 1569 CD1 ILE B 8 16.588 7.784 5.795 1.00 0.00 C ATOM 0 H ILE B 8 16.631 8.805 3.489 1.00 0.00 H new ATOM 0 HA ILE B 8 13.948 7.780 3.824 1.00 0.00 H new ATOM 0 HB ILE B 8 15.444 10.161 4.975 1.00 0.00 H new ATOM 0 HG12 ILE B 8 15.270 8.848 7.090 1.00 0.00 H new ATOM 0 HG13 ILE B 8 14.510 7.541 6.204 1.00 0.00 H new ATOM 0 HG21 ILE B 8 13.533 10.436 6.516 1.00 0.00 H new ATOM 0 HG22 ILE B 8 13.062 10.710 4.821 1.00 0.00 H new ATOM 0 HG23 ILE B 8 12.643 9.179 5.625 1.00 0.00 H new ATOM 0 HD11 ILE B 8 16.882 7.084 6.577 1.00 0.00 H new ATOM 0 HD12 ILE B 8 16.546 7.263 4.838 1.00 0.00 H new ATOM 0 HD13 ILE B 8 17.319 8.591 5.738 1.00 0.00 H new ATOM 1581 N LYS B 9 12.566 9.312 2.448 1.00 0.00 N ATOM 1582 CA LYS B 9 11.761 10.130 1.548 1.00 0.00 C ATOM 1583 C LYS B 9 11.062 11.259 2.303 1.00 0.00 C ATOM 1584 O LYS B 9 10.997 12.390 1.822 1.00 0.00 O ATOM 1585 CB LYS B 9 10.718 9.267 0.830 1.00 0.00 C ATOM 1586 CG LYS B 9 11.304 8.131 0.000 1.00 0.00 C ATOM 1587 CD LYS B 9 11.738 8.587 -1.389 1.00 0.00 C ATOM 1588 CE LYS B 9 12.920 9.542 -1.342 1.00 0.00 C ATOM 1589 NZ LYS B 9 14.072 8.965 -0.593 1.00 0.00 N ATOM 0 H LYS B 9 12.082 8.494 2.819 1.00 0.00 H new ATOM 0 HA LYS B 9 12.433 10.571 0.812 1.00 0.00 H new ATOM 0 HB2 LYS B 9 10.040 8.846 1.572 1.00 0.00 H new ATOM 0 HB3 LYS B 9 10.121 9.906 0.179 1.00 0.00 H new ATOM 0 HG2 LYS B 9 12.161 7.707 0.524 1.00 0.00 H new ATOM 0 HG3 LYS B 9 10.564 7.337 -0.097 1.00 0.00 H new ATOM 0 HD2 LYS B 9 12.002 7.716 -1.989 1.00 0.00 H new ATOM 0 HD3 LYS B 9 10.900 9.075 -1.887 1.00 0.00 H new ATOM 0 HE2 LYS B 9 13.232 9.783 -2.358 1.00 0.00 H new ATOM 0 HE3 LYS B 9 12.613 10.476 -0.872 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 14.288 9.565 0.228 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 13.830 8.007 -0.268 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 14.903 8.919 -1.216 1.00 0.00 H new ATOM 1603 N ASN B 10 10.528 10.945 3.483 1.00 0.00 N ATOM 1604 CA ASN B 10 9.823 11.941 4.286 1.00 0.00 C ATOM 1605 C ASN B 10 9.494 11.402 5.678 1.00 0.00 C ATOM 1606 O ASN B 10 8.326 11.266 6.042 1.00 0.00 O ATOM 1607 CB ASN B 10 8.537 12.376 3.576 1.00 0.00 C ATOM 1608 CG ASN B 10 7.772 13.429 4.353 1.00 0.00 C ATOM 1609 OD1 ASN B 10 6.533 13.112 4.717 1.00 0.00 O flip ATOM 1610 ND2 ASN B 10 8.286 14.515 4.625 1.00 0.00 N flip ATOM 0 H ASN B 10 10.570 10.016 3.901 1.00 0.00 H new ATOM 0 HA ASN B 10 10.480 12.803 4.404 1.00 0.00 H new ATOM 0 HB2 ASN B 10 8.785 12.766 2.589 1.00 0.00 H new ATOM 0 HB3 ASN B 10 7.898 11.506 3.423 1.00 0.00 H new ATOM 0 HD21 ASN B 10 9.240 14.717 4.326 1.00 0.00 H new ATOM 0 HD22 ASN B 10 7.758 15.212 5.149 1.00 0.00 H new ATOM 1617 N ALA B 11 10.532 11.104 6.452 1.00 0.00 N ATOM 1618 CA ALA B 11 10.357 10.586 7.807 1.00 0.00 C ATOM 1619 C ALA B 11 9.466 11.507 8.636 1.00 0.00 C ATOM 1620 O ALA B 11 9.495 12.726 8.470 1.00 0.00 O ATOM 1621 CB ALA B 11 11.708 10.408 8.481 1.00 0.00 C ATOM 0 H ALA B 11 11.505 11.212 6.165 1.00 0.00 H new ATOM 0 HA ALA B 11 9.867 9.615 7.739 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.563 10.022 9.490 1.00 0.00 H new ATOM 0 HB2 ALA B 11 12.312 9.705 7.906 1.00 0.00 H new ATOM 0 HB3 ALA B 11 12.219 11.369 8.531 1.00 0.00 H new ATOM 1627 N ASP B 12 8.668 10.915 9.522 1.00 0.00 N ATOM 1628 CA ASP B 12 7.764 11.687 10.369 1.00 0.00 C ATOM 1629 C ASP B 12 7.400 10.923 11.639 1.00 0.00 C ATOM 1630 O ASP B 12 6.233 10.615 11.881 1.00 0.00 O ATOM 1631 CB ASP B 12 6.497 12.054 9.595 1.00 0.00 C ATOM 1632 CG ASP B 12 6.782 12.952 8.408 1.00 0.00 C ATOM 1633 OD1 ASP B 12 7.312 14.063 8.620 1.00 0.00 O ATOM 1634 OD2 ASP B 12 6.477 12.544 7.268 1.00 0.00 O ATOM 0 H ASP B 12 8.629 9.907 9.671 1.00 0.00 H new ATOM 0 HA ASP B 12 8.282 12.600 10.663 1.00 0.00 H new ATOM 0 HB2 ASP B 12 6.010 11.143 9.248 1.00 0.00 H new ATOM 0 HB3 ASP B 12 5.798 12.554 10.265 1.00 0.00 H new ATOM 1639 N MET B 13 8.411 10.624 12.451 1.00 0.00 N ATOM 1640 CA MET B 13 8.198 9.901 13.700 1.00 0.00 C ATOM 1641 C MET B 13 9.485 9.833 14.518 1.00 0.00 C ATOM 1642 O MET B 13 10.493 10.441 14.159 1.00 0.00 O ATOM 1643 CB MET B 13 7.680 8.492 13.410 1.00 0.00 C ATOM 1644 CG MET B 13 8.605 7.673 12.528 1.00 0.00 C ATOM 1645 SD MET B 13 7.914 6.061 12.106 1.00 0.00 S ATOM 1646 CE MET B 13 7.649 5.371 13.737 1.00 0.00 C ATOM 0 H MET B 13 9.383 10.871 12.266 1.00 0.00 H new ATOM 0 HA MET B 13 7.453 10.440 14.285 1.00 0.00 H new ATOM 0 HB2 MET B 13 7.533 7.967 14.354 1.00 0.00 H new ATOM 0 HB3 MET B 13 6.704 8.565 12.930 1.00 0.00 H new ATOM 0 HG2 MET B 13 8.812 8.227 11.612 1.00 0.00 H new ATOM 0 HG3 MET B 13 9.558 7.533 13.038 1.00 0.00 H new ATOM 0 HE1 MET B 13 7.952 4.324 13.743 1.00 0.00 H new ATOM 0 HE2 MET B 13 8.241 5.924 14.467 1.00 0.00 H new ATOM 0 HE3 MET B 13 6.593 5.445 13.996 1.00 0.00 H new ATOM 1656 N SER B 14 9.441 9.092 15.621 1.00 0.00 N ATOM 1657 CA SER B 14 10.600 8.946 16.498 1.00 0.00 C ATOM 1658 C SER B 14 11.828 8.473 15.722 1.00 0.00 C ATOM 1659 O SER B 14 11.735 7.583 14.878 1.00 0.00 O ATOM 1660 CB SER B 14 10.289 7.963 17.628 1.00 0.00 C ATOM 1661 OG SER B 14 9.196 8.413 18.410 1.00 0.00 O ATOM 0 H SER B 14 8.614 8.582 15.930 1.00 0.00 H new ATOM 0 HA SER B 14 10.822 9.925 16.923 1.00 0.00 H new ATOM 0 HB2 SER B 14 10.061 6.983 17.209 1.00 0.00 H new ATOM 0 HB3 SER B 14 11.168 7.842 18.261 1.00 0.00 H new ATOM 0 HG SER B 14 9.016 7.766 19.124 1.00 0.00 H new ATOM 1667 N GLU B 15 12.976 9.078 16.019 1.00 0.00 N ATOM 1668 CA GLU B 15 14.229 8.727 15.356 1.00 0.00 C ATOM 1669 C GLU B 15 14.540 7.244 15.505 1.00 0.00 C ATOM 1670 O GLU B 15 14.927 6.583 14.543 1.00 0.00 O ATOM 1671 CB GLU B 15 15.380 9.559 15.925 1.00 0.00 C ATOM 1672 CG GLU B 15 15.592 9.363 17.418 1.00 0.00 C ATOM 1673 CD GLU B 15 16.728 10.211 17.959 1.00 0.00 C ATOM 1674 OE1 GLU B 15 16.647 11.453 17.848 1.00 0.00 O ATOM 1675 OE2 GLU B 15 17.697 9.632 18.495 1.00 0.00 O ATOM 0 H GLU B 15 13.064 9.816 16.717 1.00 0.00 H new ATOM 0 HA GLU B 15 14.116 8.945 14.294 1.00 0.00 H new ATOM 0 HB2 GLU B 15 16.299 9.301 15.399 1.00 0.00 H new ATOM 0 HB3 GLU B 15 15.186 10.614 15.729 1.00 0.00 H new ATOM 0 HG2 GLU B 15 14.673 9.612 17.948 1.00 0.00 H new ATOM 0 HG3 GLU B 15 15.800 8.312 17.617 1.00 0.00 H new ATOM 1682 N GLU B 16 14.370 6.731 16.715 1.00 0.00 N ATOM 1683 CA GLU B 16 14.636 5.326 16.996 1.00 0.00 C ATOM 1684 C GLU B 16 13.797 4.412 16.114 1.00 0.00 C ATOM 1685 O GLU B 16 14.304 3.444 15.550 1.00 0.00 O ATOM 1686 CB GLU B 16 14.370 5.019 18.471 1.00 0.00 C ATOM 1687 CG GLU B 16 12.940 5.300 18.904 1.00 0.00 C ATOM 1688 CD GLU B 16 12.706 5.000 20.372 1.00 0.00 C ATOM 1689 OE1 GLU B 16 12.896 3.834 20.777 1.00 0.00 O ATOM 1690 OE2 GLU B 16 12.335 5.931 21.117 1.00 0.00 O ATOM 0 H GLU B 16 14.048 7.268 17.520 1.00 0.00 H new ATOM 0 HA GLU B 16 15.686 5.137 16.774 1.00 0.00 H new ATOM 0 HB2 GLU B 16 14.599 3.971 18.662 1.00 0.00 H new ATOM 0 HB3 GLU B 16 15.049 5.611 19.085 1.00 0.00 H new ATOM 0 HG2 GLU B 16 12.704 6.346 18.709 1.00 0.00 H new ATOM 0 HG3 GLU B 16 12.257 4.701 18.301 1.00 0.00 H new ATOM 1697 N MET B 17 12.514 4.718 16.001 1.00 0.00 N ATOM 1698 CA MET B 17 11.614 3.911 15.190 1.00 0.00 C ATOM 1699 C MET B 17 12.026 3.927 13.723 1.00 0.00 C ATOM 1700 O MET B 17 12.077 2.882 13.074 1.00 0.00 O ATOM 1701 CB MET B 17 10.174 4.403 15.343 1.00 0.00 C ATOM 1702 CG MET B 17 9.670 4.362 16.776 1.00 0.00 C ATOM 1703 SD MET B 17 7.981 4.972 16.940 1.00 0.00 S ATOM 1704 CE MET B 17 7.723 4.785 18.704 1.00 0.00 C ATOM 0 H MET B 17 12.073 5.516 16.458 1.00 0.00 H new ATOM 0 HA MET B 17 11.675 2.882 15.545 1.00 0.00 H new ATOM 0 HB2 MET B 17 10.106 5.425 14.971 1.00 0.00 H new ATOM 0 HB3 MET B 17 9.521 3.793 14.719 1.00 0.00 H new ATOM 0 HG2 MET B 17 9.719 3.337 17.144 1.00 0.00 H new ATOM 0 HG3 MET B 17 10.330 4.959 17.406 1.00 0.00 H new ATOM 0 HE1 MET B 17 6.719 5.122 18.963 1.00 0.00 H new ATOM 0 HE2 MET B 17 7.836 3.736 18.979 1.00 0.00 H new ATOM 0 HE3 MET B 17 8.457 5.383 19.244 1.00 0.00 H new ATOM 1714 N GLN B 18 12.317 5.112 13.204 1.00 0.00 N ATOM 1715 CA GLN B 18 12.720 5.243 11.810 1.00 0.00 C ATOM 1716 C GLN B 18 14.071 4.585 11.552 1.00 0.00 C ATOM 1717 O GLN B 18 14.272 3.968 10.506 1.00 0.00 O ATOM 1718 CB GLN B 18 12.746 6.710 11.387 1.00 0.00 C ATOM 1719 CG GLN B 18 13.593 7.598 12.279 1.00 0.00 C ATOM 1720 CD GLN B 18 13.490 9.058 11.894 1.00 0.00 C ATOM 1721 OE1 GLN B 18 12.806 9.836 12.721 1.00 0.00 O flip ATOM 1722 NE2 GLN B 18 13.999 9.475 10.852 1.00 0.00 N flip ATOM 0 H GLN B 18 12.282 5.990 13.722 1.00 0.00 H new ATOM 0 HA GLN B 18 11.978 4.722 11.205 1.00 0.00 H new ATOM 0 HB2 GLN B 18 13.121 6.776 10.366 1.00 0.00 H new ATOM 0 HB3 GLN B 18 11.725 7.092 11.377 1.00 0.00 H new ATOM 0 HG2 GLN B 18 13.279 7.474 13.316 1.00 0.00 H new ATOM 0 HG3 GLN B 18 14.634 7.281 12.221 1.00 0.00 H new ATOM 0 HE21 GLN B 18 14.517 8.838 10.247 1.00 0.00 H new ATOM 0 HE22 GLN B 18 13.903 10.457 10.595 1.00 0.00 H new ATOM 1731 N GLN B 19 14.993 4.707 12.500 1.00 0.00 N ATOM 1732 CA GLN B 19 16.309 4.102 12.335 1.00 0.00 C ATOM 1733 C GLN B 19 16.225 2.588 12.496 1.00 0.00 C ATOM 1734 O GLN B 19 16.922 1.843 11.806 1.00 0.00 O ATOM 1735 CB GLN B 19 17.318 4.696 13.321 1.00 0.00 C ATOM 1736 CG GLN B 19 17.010 4.404 14.777 1.00 0.00 C ATOM 1737 CD GLN B 19 18.099 4.909 15.707 1.00 0.00 C ATOM 1738 OE1 GLN B 19 17.812 5.982 16.434 1.00 0.00 O flip ATOM 1739 NE2 GLN B 19 19.196 4.352 15.752 1.00 0.00 N flip ATOM 0 H GLN B 19 14.858 5.210 13.377 1.00 0.00 H new ATOM 0 HA GLN B 19 16.658 4.324 11.327 1.00 0.00 H new ATOM 0 HB2 GLN B 19 18.310 4.309 13.086 1.00 0.00 H new ATOM 0 HB3 GLN B 19 17.356 5.776 13.179 1.00 0.00 H new ATOM 0 HG2 GLN B 19 16.061 4.868 15.046 1.00 0.00 H new ATOM 0 HG3 GLN B 19 16.889 3.329 14.912 1.00 0.00 H new ATOM 0 HE21 GLN B 19 19.374 3.529 15.176 1.00 0.00 H new ATOM 0 HE22 GLN B 19 19.927 4.713 16.365 1.00 0.00 H new ATOM 1748 N ASP B 20 15.360 2.135 13.401 1.00 0.00 N ATOM 1749 CA ASP B 20 15.183 0.705 13.635 1.00 0.00 C ATOM 1750 C ASP B 20 14.497 0.047 12.448 1.00 0.00 C ATOM 1751 O ASP B 20 14.810 -1.087 12.094 1.00 0.00 O ATOM 1752 CB ASP B 20 14.379 0.460 14.914 1.00 0.00 C ATOM 1753 CG ASP B 20 15.109 0.933 16.158 1.00 0.00 C ATOM 1754 OD1 ASP B 20 16.238 1.449 16.025 1.00 0.00 O ATOM 1755 OD2 ASP B 20 14.550 0.785 17.265 1.00 0.00 O ATOM 0 H ASP B 20 14.774 2.735 13.981 1.00 0.00 H new ATOM 0 HA ASP B 20 16.170 0.259 13.756 1.00 0.00 H new ATOM 0 HB2 ASP B 20 13.421 0.974 14.841 1.00 0.00 H new ATOM 0 HB3 ASP B 20 14.163 -0.605 15.006 1.00 0.00 H new ATOM 1760 N SER B 21 13.564 0.761 11.830 1.00 0.00 N ATOM 1761 CA SER B 21 12.854 0.236 10.674 1.00 0.00 C ATOM 1762 C SER B 21 13.806 0.097 9.495 1.00 0.00 C ATOM 1763 O SER B 21 13.782 -0.903 8.776 1.00 0.00 O ATOM 1764 CB SER B 21 11.679 1.143 10.301 1.00 0.00 C ATOM 1765 OG SER B 21 12.127 2.440 9.945 1.00 0.00 O ATOM 0 H SER B 21 13.283 1.701 12.110 1.00 0.00 H new ATOM 0 HA SER B 21 12.459 -0.747 10.929 1.00 0.00 H new ATOM 0 HB2 SER B 21 11.127 0.705 9.469 1.00 0.00 H new ATOM 0 HB3 SER B 21 10.988 1.212 11.141 1.00 0.00 H new ATOM 0 HG SER B 21 12.962 2.639 10.418 1.00 0.00 H new ATOM 1771 N VAL B 22 14.652 1.104 9.310 1.00 0.00 N ATOM 1772 CA VAL B 22 15.625 1.093 8.228 1.00 0.00 C ATOM 1773 C VAL B 22 16.616 -0.048 8.417 1.00 0.00 C ATOM 1774 O VAL B 22 16.871 -0.822 7.495 1.00 0.00 O ATOM 1775 CB VAL B 22 16.392 2.428 8.150 1.00 0.00 C ATOM 1776 CG1 VAL B 22 17.381 2.417 6.997 1.00 0.00 C ATOM 1777 CG2 VAL B 22 15.420 3.592 8.017 1.00 0.00 C ATOM 0 H VAL B 22 14.682 1.938 9.896 1.00 0.00 H new ATOM 0 HA VAL B 22 15.078 0.951 7.296 1.00 0.00 H new ATOM 0 HB VAL B 22 16.955 2.554 9.075 1.00 0.00 H new ATOM 0 HG11 VAL B 22 17.910 3.369 6.962 1.00 0.00 H new ATOM 0 HG12 VAL B 22 18.098 1.609 7.140 1.00 0.00 H new ATOM 0 HG13 VAL B 22 16.846 2.265 6.060 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.977 4.527 7.963 1.00 0.00 H new ATOM 0 HG22 VAL B 22 14.828 3.470 7.110 1.00 0.00 H new ATOM 0 HG23 VAL B 22 14.758 3.614 8.882 1.00 0.00 H new ATOM 1787 N GLU B 23 17.159 -0.150 9.622 1.00 0.00 N ATOM 1788 CA GLU B 23 18.109 -1.198 9.945 1.00 0.00 C ATOM 1789 C GLU B 23 17.419 -2.554 9.900 1.00 0.00 C ATOM 1790 O GLU B 23 17.958 -3.525 9.366 1.00 0.00 O ATOM 1791 CB GLU B 23 18.706 -0.948 11.330 1.00 0.00 C ATOM 1792 CG GLU B 23 19.891 -1.836 11.662 1.00 0.00 C ATOM 1793 CD GLU B 23 19.522 -3.302 11.773 1.00 0.00 C ATOM 1794 OE1 GLU B 23 18.682 -3.639 12.633 1.00 0.00 O ATOM 1795 OE2 GLU B 23 20.073 -4.114 10.999 1.00 0.00 O ATOM 0 H GLU B 23 16.955 0.485 10.394 1.00 0.00 H new ATOM 0 HA GLU B 23 18.915 -1.192 9.211 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.017 0.095 11.397 1.00 0.00 H new ATOM 0 HB3 GLU B 23 17.931 -1.099 12.081 1.00 0.00 H new ATOM 0 HG2 GLU B 23 20.654 -1.717 10.893 1.00 0.00 H new ATOM 0 HG3 GLU B 23 20.332 -1.506 12.602 1.00 0.00 H new ATOM 1802 N CYS B 24 16.218 -2.605 10.462 1.00 0.00 N ATOM 1803 CA CYS B 24 15.434 -3.834 10.490 1.00 0.00 C ATOM 1804 C CYS B 24 15.038 -4.259 9.080 1.00 0.00 C ATOM 1805 O CYS B 24 15.009 -5.450 8.761 1.00 0.00 O ATOM 1806 CB CYS B 24 14.182 -3.646 11.350 1.00 0.00 C ATOM 1807 SG CYS B 24 13.143 -5.122 11.476 1.00 0.00 S ATOM 0 H CYS B 24 15.764 -1.807 10.906 1.00 0.00 H new ATOM 0 HA CYS B 24 16.051 -4.619 10.926 1.00 0.00 H new ATOM 0 HB2 CYS B 24 14.485 -3.342 12.352 1.00 0.00 H new ATOM 0 HB3 CYS B 24 13.588 -2.831 10.935 1.00 0.00 H new ATOM 0 HG CYS B 24 12.112 -4.864 12.224 1.00 0.00 H new ATOM 1813 N ALA B 25 14.753 -3.278 8.230 1.00 0.00 N ATOM 1814 CA ALA B 25 14.377 -3.556 6.858 1.00 0.00 C ATOM 1815 C ALA B 25 15.570 -4.125 6.120 1.00 0.00 C ATOM 1816 O ALA B 25 15.464 -5.121 5.407 1.00 0.00 O ATOM 1817 CB ALA B 25 13.877 -2.293 6.173 1.00 0.00 C ATOM 0 H ALA B 25 14.777 -2.287 8.471 1.00 0.00 H new ATOM 0 HA ALA B 25 13.566 -4.285 6.848 1.00 0.00 H new ATOM 0 HB1 ALA B 25 13.600 -2.523 5.144 1.00 0.00 H new ATOM 0 HB2 ALA B 25 13.007 -1.910 6.706 1.00 0.00 H new ATOM 0 HB3 ALA B 25 14.665 -1.540 6.177 1.00 0.00 H new ATOM 1823 N THR B 26 16.718 -3.486 6.318 1.00 0.00 N ATOM 1824 CA THR B 26 17.947 -3.928 5.687 1.00 0.00 C ATOM 1825 C THR B 26 18.206 -5.393 6.010 1.00 0.00 C ATOM 1826 O THR B 26 18.594 -6.178 5.144 1.00 0.00 O ATOM 1827 CB THR B 26 19.123 -3.068 6.148 1.00 0.00 C ATOM 1828 OG1 THR B 26 18.902 -1.704 5.835 1.00 0.00 O ATOM 1829 CG2 THR B 26 20.442 -3.474 5.530 1.00 0.00 C ATOM 0 H THR B 26 16.819 -2.662 6.910 1.00 0.00 H new ATOM 0 HA THR B 26 17.842 -3.820 4.607 1.00 0.00 H new ATOM 0 HB THR B 26 19.185 -3.220 7.226 1.00 0.00 H new ATOM 0 HG1 THR B 26 18.196 -1.346 6.413 1.00 0.00 H new ATOM 0 HG21 THR B 26 21.233 -2.822 5.901 1.00 0.00 H new ATOM 0 HG22 THR B 26 20.667 -4.506 5.798 1.00 0.00 H new ATOM 0 HG23 THR B 26 20.378 -3.386 4.445 1.00 0.00 H new ATOM 1837 N GLN B 27 17.969 -5.752 7.265 1.00 0.00 N ATOM 1838 CA GLN B 27 18.154 -7.117 7.720 1.00 0.00 C ATOM 1839 C GLN B 27 17.258 -8.057 6.927 1.00 0.00 C ATOM 1840 O GLN B 27 17.680 -9.133 6.508 1.00 0.00 O ATOM 1841 CB GLN B 27 17.826 -7.223 9.207 1.00 0.00 C ATOM 1842 CG GLN B 27 18.116 -8.589 9.796 1.00 0.00 C ATOM 1843 CD GLN B 27 17.807 -8.664 11.278 1.00 0.00 C ATOM 1844 OE1 GLN B 27 16.882 -9.545 11.645 1.00 0.00 O flip ATOM 1845 NE2 GLN B 27 18.389 -7.940 12.084 1.00 0.00 N flip ATOM 0 H GLN B 27 17.646 -5.109 7.988 1.00 0.00 H new ATOM 0 HA GLN B 27 19.195 -7.401 7.564 1.00 0.00 H new ATOM 0 HB2 GLN B 27 18.399 -6.473 9.751 1.00 0.00 H new ATOM 0 HB3 GLN B 27 16.772 -6.989 9.356 1.00 0.00 H new ATOM 0 HG2 GLN B 27 17.528 -9.340 9.268 1.00 0.00 H new ATOM 0 HG3 GLN B 27 19.166 -8.834 9.635 1.00 0.00 H new ATOM 0 HE21 GLN B 27 19.093 -7.277 11.759 1.00 0.00 H new ATOM 0 HE22 GLN B 27 18.168 -8.002 13.078 1.00 0.00 H new ATOM 1854 N ALA B 28 16.016 -7.634 6.725 1.00 0.00 N ATOM 1855 CA ALA B 28 15.053 -8.431 5.980 1.00 0.00 C ATOM 1856 C ALA B 28 15.584 -8.785 4.594 1.00 0.00 C ATOM 1857 O ALA B 28 15.473 -9.929 4.153 1.00 0.00 O ATOM 1858 CB ALA B 28 13.730 -7.693 5.866 1.00 0.00 C ATOM 0 H ALA B 28 15.654 -6.744 7.067 1.00 0.00 H new ATOM 0 HA ALA B 28 14.892 -9.360 6.527 1.00 0.00 H new ATOM 0 HB1 ALA B 28 13.021 -8.302 5.306 1.00 0.00 H new ATOM 0 HB2 ALA B 28 13.334 -7.499 6.863 1.00 0.00 H new ATOM 0 HB3 ALA B 28 13.885 -6.747 5.347 1.00 0.00 H new ATOM 1864 N LEU B 29 16.161 -7.801 3.908 1.00 0.00 N ATOM 1865 CA LEU B 29 16.702 -8.028 2.573 1.00 0.00 C ATOM 1866 C LEU B 29 17.814 -9.072 2.594 1.00 0.00 C ATOM 1867 O LEU B 29 17.828 -9.994 1.781 1.00 0.00 O ATOM 1868 CB LEU B 29 17.234 -6.730 1.961 1.00 0.00 C ATOM 1869 CG LEU B 29 16.170 -5.715 1.539 1.00 0.00 C ATOM 1870 CD1 LEU B 29 15.482 -5.117 2.753 1.00 0.00 C ATOM 1871 CD2 LEU B 29 16.788 -4.621 0.682 1.00 0.00 C ATOM 0 H LEU B 29 16.265 -6.846 4.252 1.00 0.00 H new ATOM 0 HA LEU B 29 15.882 -8.399 1.958 1.00 0.00 H new ATOM 0 HB2 LEU B 29 17.899 -6.255 2.682 1.00 0.00 H new ATOM 0 HB3 LEU B 29 17.838 -6.981 1.089 1.00 0.00 H new ATOM 0 HG LEU B 29 15.419 -6.236 0.946 1.00 0.00 H new ATOM 0 HD11 LEU B 29 14.730 -4.398 2.428 1.00 0.00 H new ATOM 0 HD12 LEU B 29 15.002 -5.910 3.327 1.00 0.00 H new ATOM 0 HD13 LEU B 29 16.219 -4.613 3.378 1.00 0.00 H new ATOM 0 HD21 LEU B 29 16.017 -3.908 0.391 1.00 0.00 H new ATOM 0 HD22 LEU B 29 17.562 -4.106 1.251 1.00 0.00 H new ATOM 0 HD23 LEU B 29 17.229 -5.064 -0.211 1.00 0.00 H new ATOM 1883 N GLU B 30 18.749 -8.916 3.520 1.00 0.00 N ATOM 1884 CA GLU B 30 19.873 -9.841 3.634 1.00 0.00 C ATOM 1885 C GLU B 30 19.418 -11.224 4.096 1.00 0.00 C ATOM 1886 O GLU B 30 20.023 -12.236 3.739 1.00 0.00 O ATOM 1887 CB GLU B 30 20.927 -9.290 4.596 1.00 0.00 C ATOM 1888 CG GLU B 30 20.394 -9.016 5.991 1.00 0.00 C ATOM 1889 CD GLU B 30 21.467 -8.517 6.941 1.00 0.00 C ATOM 1890 OE1 GLU B 30 22.628 -8.373 6.502 1.00 0.00 O ATOM 1891 OE2 GLU B 30 21.147 -8.272 8.122 1.00 0.00 O ATOM 0 H GLU B 30 18.754 -8.159 4.204 1.00 0.00 H new ATOM 0 HA GLU B 30 20.313 -9.944 2.642 1.00 0.00 H new ATOM 0 HB2 GLU B 30 21.751 -10.000 4.664 1.00 0.00 H new ATOM 0 HB3 GLU B 30 21.335 -8.367 4.184 1.00 0.00 H new ATOM 0 HG2 GLU B 30 19.595 -8.277 5.931 1.00 0.00 H new ATOM 0 HG3 GLU B 30 19.954 -9.929 6.393 1.00 0.00 H new ATOM 1898 N LYS B 31 18.360 -11.263 4.896 1.00 0.00 N ATOM 1899 CA LYS B 31 17.838 -12.519 5.412 1.00 0.00 C ATOM 1900 C LYS B 31 16.988 -13.243 4.377 1.00 0.00 C ATOM 1901 O LYS B 31 16.866 -14.467 4.417 1.00 0.00 O ATOM 1902 CB LYS B 31 17.015 -12.285 6.681 1.00 0.00 C ATOM 1903 CG LYS B 31 17.848 -11.858 7.879 1.00 0.00 C ATOM 1904 CD LYS B 31 16.987 -11.689 9.121 1.00 0.00 C ATOM 1905 CE LYS B 31 16.289 -12.985 9.500 1.00 0.00 C ATOM 1906 NZ LYS B 31 15.475 -12.835 10.738 1.00 0.00 N ATOM 0 H LYS B 31 17.846 -10.436 5.201 1.00 0.00 H new ATOM 0 HA LYS B 31 18.696 -13.148 5.651 1.00 0.00 H new ATOM 0 HB2 LYS B 31 16.264 -11.521 6.481 1.00 0.00 H new ATOM 0 HB3 LYS B 31 16.479 -13.201 6.930 1.00 0.00 H new ATOM 0 HG2 LYS B 31 18.622 -12.601 8.069 1.00 0.00 H new ATOM 0 HG3 LYS B 31 18.355 -10.919 7.656 1.00 0.00 H new ATOM 0 HD2 LYS B 31 17.608 -11.353 9.952 1.00 0.00 H new ATOM 0 HD3 LYS B 31 16.243 -10.912 8.945 1.00 0.00 H new ATOM 0 HE2 LYS B 31 15.647 -13.305 8.680 1.00 0.00 H new ATOM 0 HE3 LYS B 31 17.032 -13.768 9.647 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 15.015 -13.740 10.963 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 16.092 -12.554 11.527 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 14.749 -12.105 10.590 1.00 0.00 H new ATOM 1920 N TYR B 32 16.378 -12.492 3.465 1.00 0.00 N ATOM 1921 CA TYR B 32 15.526 -13.105 2.457 1.00 0.00 C ATOM 1922 C TYR B 32 15.576 -12.364 1.123 1.00 0.00 C ATOM 1923 O TYR B 32 15.638 -12.989 0.064 1.00 0.00 O ATOM 1924 CB TYR B 32 14.088 -13.156 2.967 1.00 0.00 C ATOM 1925 CG TYR B 32 13.950 -13.819 4.319 1.00 0.00 C ATOM 1926 CD1 TYR B 32 14.122 -15.189 4.469 1.00 0.00 C ATOM 1927 CD2 TYR B 32 13.655 -13.070 5.450 1.00 0.00 C ATOM 1928 CE1 TYR B 32 13.998 -15.792 5.705 1.00 0.00 C ATOM 1929 CE2 TYR B 32 13.528 -13.662 6.690 1.00 0.00 C ATOM 1930 CZ TYR B 32 13.700 -15.025 6.814 1.00 0.00 C ATOM 1931 OH TYR B 32 13.575 -15.622 8.047 1.00 0.00 O ATOM 0 H TYR B 32 16.456 -11.477 3.404 1.00 0.00 H new ATOM 0 HA TYR B 32 15.900 -14.113 2.280 1.00 0.00 H new ATOM 0 HB2 TYR B 32 13.696 -12.141 3.028 1.00 0.00 H new ATOM 0 HB3 TYR B 32 13.473 -13.692 2.244 1.00 0.00 H new ATOM 0 HD1 TYR B 32 14.357 -15.793 3.605 1.00 0.00 H new ATOM 0 HD2 TYR B 32 13.522 -12.002 5.358 1.00 0.00 H new ATOM 0 HE1 TYR B 32 14.133 -16.859 5.804 1.00 0.00 H new ATOM 0 HE2 TYR B 32 13.296 -13.062 7.558 1.00 0.00 H new ATOM 0 HH TYR B 32 13.365 -14.941 8.720 1.00 0.00 H new ATOM 1941 N ASN B 33 15.540 -11.036 1.176 1.00 0.00 N ATOM 1942 CA ASN B 33 15.573 -10.217 -0.034 1.00 0.00 C ATOM 1943 C ASN B 33 14.268 -10.342 -0.818 1.00 0.00 C ATOM 1944 O ASN B 33 14.275 -10.602 -2.021 1.00 0.00 O ATOM 1945 CB ASN B 33 16.759 -10.608 -0.925 1.00 0.00 C ATOM 1946 CG ASN B 33 16.869 -9.730 -2.157 1.00 0.00 C ATOM 1947 OD1 ASN B 33 17.034 -8.514 -2.054 1.00 0.00 O ATOM 1948 ND2 ASN B 33 16.779 -10.344 -3.330 1.00 0.00 N ATOM 0 H ASN B 33 15.488 -10.503 2.044 1.00 0.00 H new ATOM 0 HA ASN B 33 15.693 -9.178 0.274 1.00 0.00 H new ATOM 0 HB2 ASN B 33 17.682 -10.538 -0.349 1.00 0.00 H new ATOM 0 HB3 ASN B 33 16.652 -11.649 -1.232 1.00 0.00 H new ATOM 0 HD21 ASN B 33 16.847 -9.806 -4.194 1.00 0.00 H new ATOM 0 HD22 ASN B 33 16.642 -11.354 -3.368 1.00 0.00 H new ATOM 1955 N ILE B 34 13.147 -10.143 -0.129 1.00 0.00 N ATOM 1956 CA ILE B 34 11.834 -10.223 -0.763 1.00 0.00 C ATOM 1957 C ILE B 34 10.960 -9.048 -0.335 1.00 0.00 C ATOM 1958 O ILE B 34 10.787 -8.789 0.854 1.00 0.00 O ATOM 1959 CB ILE B 34 11.119 -11.544 -0.417 1.00 0.00 C ATOM 1960 CG1 ILE B 34 11.995 -12.739 -0.805 1.00 0.00 C ATOM 1961 CG2 ILE B 34 9.772 -11.623 -1.125 1.00 0.00 C ATOM 1962 CD1 ILE B 34 11.366 -14.078 -0.492 1.00 0.00 C ATOM 0 H ILE B 34 13.122 -9.925 0.867 1.00 0.00 H new ATOM 0 HA ILE B 34 11.992 -10.186 -1.841 1.00 0.00 H new ATOM 0 HB ILE B 34 10.946 -11.572 0.659 1.00 0.00 H new ATOM 0 HG12 ILE B 34 12.211 -12.689 -1.872 1.00 0.00 H new ATOM 0 HG13 ILE B 34 12.949 -12.664 -0.283 1.00 0.00 H new ATOM 0 HG21 ILE B 34 9.281 -12.562 -0.869 1.00 0.00 H new ATOM 0 HG22 ILE B 34 9.146 -10.789 -0.810 1.00 0.00 H new ATOM 0 HG23 ILE B 34 9.924 -11.575 -2.203 1.00 0.00 H new ATOM 0 HD11 ILE B 34 12.043 -14.877 -0.794 1.00 0.00 H new ATOM 0 HD12 ILE B 34 11.175 -14.149 0.579 1.00 0.00 H new ATOM 0 HD13 ILE B 34 10.426 -14.174 -1.035 1.00 0.00 H new ATOM 1974 N GLU B 35 10.422 -8.332 -1.315 1.00 0.00 N ATOM 1975 CA GLU B 35 9.579 -7.167 -1.052 1.00 0.00 C ATOM 1976 C GLU B 35 8.464 -7.481 -0.053 1.00 0.00 C ATOM 1977 O GLU B 35 8.237 -6.726 0.891 1.00 0.00 O ATOM 1978 CB GLU B 35 8.980 -6.654 -2.363 1.00 0.00 C ATOM 1979 CG GLU B 35 10.026 -6.312 -3.413 1.00 0.00 C ATOM 1980 CD GLU B 35 9.415 -5.844 -4.720 1.00 0.00 C ATOM 1981 OE1 GLU B 35 8.604 -6.597 -5.298 1.00 0.00 O ATOM 1982 OE2 GLU B 35 9.757 -4.731 -5.170 1.00 0.00 O ATOM 0 H GLU B 35 10.554 -8.538 -2.305 1.00 0.00 H new ATOM 0 HA GLU B 35 10.208 -6.395 -0.608 1.00 0.00 H new ATOM 0 HB2 GLU B 35 8.305 -7.410 -2.766 1.00 0.00 H new ATOM 0 HB3 GLU B 35 8.380 -5.768 -2.157 1.00 0.00 H new ATOM 0 HG2 GLU B 35 10.683 -5.534 -3.025 1.00 0.00 H new ATOM 0 HG3 GLU B 35 10.646 -7.188 -3.600 1.00 0.00 H new ATOM 1989 N LYS B 36 7.767 -8.587 -0.275 1.00 0.00 N ATOM 1990 CA LYS B 36 6.668 -8.989 0.602 1.00 0.00 C ATOM 1991 C LYS B 36 7.160 -9.342 2.005 1.00 0.00 C ATOM 1992 O LYS B 36 6.680 -8.797 2.999 1.00 0.00 O ATOM 1993 CB LYS B 36 5.941 -10.196 0.005 1.00 0.00 C ATOM 1994 CG LYS B 36 4.764 -10.674 0.839 1.00 0.00 C ATOM 1995 CD LYS B 36 4.273 -12.036 0.381 1.00 0.00 C ATOM 1996 CE LYS B 36 5.321 -13.115 0.606 1.00 0.00 C ATOM 1997 NZ LYS B 36 4.822 -14.467 0.225 1.00 0.00 N ATOM 0 H LYS B 36 7.940 -9.223 -1.053 1.00 0.00 H new ATOM 0 HA LYS B 36 5.987 -8.142 0.684 1.00 0.00 H new ATOM 0 HB2 LYS B 36 5.587 -9.938 -0.993 1.00 0.00 H new ATOM 0 HB3 LYS B 36 6.650 -11.016 -0.110 1.00 0.00 H new ATOM 0 HG2 LYS B 36 5.057 -10.726 1.888 1.00 0.00 H new ATOM 0 HG3 LYS B 36 3.951 -9.951 0.770 1.00 0.00 H new ATOM 0 HD2 LYS B 36 3.362 -12.295 0.920 1.00 0.00 H new ATOM 0 HD3 LYS B 36 4.016 -11.993 -0.677 1.00 0.00 H new ATOM 0 HE2 LYS B 36 6.213 -12.881 0.025 1.00 0.00 H new ATOM 0 HE3 LYS B 36 5.616 -13.120 1.655 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 5.528 -15.184 0.488 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 3.929 -14.661 0.722 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 4.660 -14.501 -0.802 1.00 0.00 H new ATOM 2011 N ASP B 37 8.100 -10.277 2.073 1.00 0.00 N ATOM 2012 CA ASP B 37 8.648 -10.741 3.346 1.00 0.00 C ATOM 2013 C ASP B 37 9.178 -9.593 4.207 1.00 0.00 C ATOM 2014 O ASP B 37 8.926 -9.549 5.411 1.00 0.00 O ATOM 2015 CB ASP B 37 9.762 -11.758 3.098 1.00 0.00 C ATOM 2016 CG ASP B 37 9.281 -12.955 2.300 1.00 0.00 C ATOM 2017 OD1 ASP B 37 8.802 -12.758 1.163 1.00 0.00 O ATOM 2018 OD2 ASP B 37 9.386 -14.090 2.810 1.00 0.00 O ATOM 0 H ASP B 37 8.503 -10.734 1.255 1.00 0.00 H new ATOM 0 HA ASP B 37 7.831 -11.211 3.895 1.00 0.00 H new ATOM 0 HB2 ASP B 37 10.581 -11.274 2.565 1.00 0.00 H new ATOM 0 HB3 ASP B 37 10.160 -12.098 4.054 1.00 0.00 H new ATOM 2023 N ILE B 38 9.918 -8.672 3.594 1.00 0.00 N ATOM 2024 CA ILE B 38 10.485 -7.536 4.325 1.00 0.00 C ATOM 2025 C ILE B 38 9.442 -6.874 5.223 1.00 0.00 C ATOM 2026 O ILE B 38 9.694 -6.618 6.403 1.00 0.00 O ATOM 2027 CB ILE B 38 11.070 -6.483 3.356 1.00 0.00 C ATOM 2028 CG1 ILE B 38 12.293 -7.047 2.631 1.00 0.00 C ATOM 2029 CG2 ILE B 38 11.443 -5.206 4.099 1.00 0.00 C ATOM 2030 CD1 ILE B 38 12.758 -6.189 1.476 1.00 0.00 C ATOM 0 H ILE B 38 10.139 -8.687 2.598 1.00 0.00 H new ATOM 0 HA ILE B 38 11.287 -7.930 4.949 1.00 0.00 H new ATOM 0 HB ILE B 38 10.304 -6.239 2.620 1.00 0.00 H new ATOM 0 HG12 ILE B 38 13.110 -7.156 3.344 1.00 0.00 H new ATOM 0 HG13 ILE B 38 12.058 -8.045 2.261 1.00 0.00 H new ATOM 0 HG21 ILE B 38 11.852 -4.482 3.395 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.555 -4.789 4.574 1.00 0.00 H new ATOM 0 HG23 ILE B 38 12.189 -5.433 4.861 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.628 -6.649 1.008 1.00 0.00 H new ATOM 0 HD12 ILE B 38 11.956 -6.100 0.743 1.00 0.00 H new ATOM 0 HD13 ILE B 38 13.025 -5.198 1.843 1.00 0.00 H new ATOM 2042 N ALA B 39 8.274 -6.603 4.660 1.00 0.00 N ATOM 2043 CA ALA B 39 7.196 -5.973 5.408 1.00 0.00 C ATOM 2044 C ALA B 39 6.783 -6.825 6.605 1.00 0.00 C ATOM 2045 O ALA B 39 6.461 -6.299 7.670 1.00 0.00 O ATOM 2046 CB ALA B 39 6.005 -5.718 4.498 1.00 0.00 C ATOM 0 H ALA B 39 8.048 -6.810 3.687 1.00 0.00 H new ATOM 0 HA ALA B 39 7.559 -5.018 5.788 1.00 0.00 H new ATOM 0 HB1 ALA B 39 5.205 -5.247 5.069 1.00 0.00 H new ATOM 0 HB2 ALA B 39 6.305 -5.060 3.682 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.650 -6.664 4.090 1.00 0.00 H new ATOM 2052 N ALA B 40 6.779 -8.142 6.420 1.00 0.00 N ATOM 2053 CA ALA B 40 6.386 -9.062 7.481 1.00 0.00 C ATOM 2054 C ALA B 40 7.332 -8.999 8.678 1.00 0.00 C ATOM 2055 O ALA B 40 6.888 -8.894 9.822 1.00 0.00 O ATOM 2056 CB ALA B 40 6.311 -10.484 6.946 1.00 0.00 C ATOM 0 H ALA B 40 7.043 -8.595 5.545 1.00 0.00 H new ATOM 0 HA ALA B 40 5.400 -8.754 7.828 1.00 0.00 H new ATOM 0 HB1 ALA B 40 6.017 -11.160 7.749 1.00 0.00 H new ATOM 0 HB2 ALA B 40 5.575 -10.532 6.143 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.287 -10.780 6.562 1.00 0.00 H new ATOM 2062 N HIS B 41 8.631 -9.069 8.414 1.00 0.00 N ATOM 2063 CA HIS B 41 9.627 -9.029 9.481 1.00 0.00 C ATOM 2064 C HIS B 41 9.487 -7.750 10.300 1.00 0.00 C ATOM 2065 O HIS B 41 9.402 -7.790 11.528 1.00 0.00 O ATOM 2066 CB HIS B 41 11.029 -9.128 8.891 1.00 0.00 C ATOM 2067 CG HIS B 41 11.152 -10.223 7.885 1.00 0.00 C ATOM 2068 ND1 HIS B 41 10.780 -11.525 8.142 1.00 0.00 N ATOM 2069 CD2 HIS B 41 11.577 -10.198 6.604 1.00 0.00 C ATOM 2070 CE1 HIS B 41 10.971 -12.255 7.059 1.00 0.00 C ATOM 2071 NE2 HIS B 41 11.452 -11.472 6.110 1.00 0.00 N ATOM 0 H HIS B 41 9.020 -9.153 7.475 1.00 0.00 H new ATOM 0 HA HIS B 41 9.461 -9.879 10.143 1.00 0.00 H new ATOM 0 HB2 HIS B 41 11.290 -8.179 8.423 1.00 0.00 H new ATOM 0 HB3 HIS B 41 11.746 -9.295 9.694 1.00 0.00 H new ATOM 0 HD2 HIS B 41 11.946 -9.336 6.068 1.00 0.00 H new ATOM 0 HE1 HIS B 41 10.769 -13.312 6.965 1.00 0.00 H new ATOM 0 HE2 HIS B 41 11.692 -11.767 5.163 1.00 0.00 H new ATOM 2080 N ILE B 42 9.453 -6.618 9.606 1.00 0.00 N ATOM 2081 CA ILE B 42 9.312 -5.323 10.262 1.00 0.00 C ATOM 2082 C ILE B 42 7.931 -5.191 10.902 1.00 0.00 C ATOM 2083 O ILE B 42 7.777 -4.564 11.949 1.00 0.00 O ATOM 2084 CB ILE B 42 9.534 -4.165 9.264 1.00 0.00 C ATOM 2085 CG1 ILE B 42 10.938 -4.247 8.663 1.00 0.00 C ATOM 2086 CG2 ILE B 42 9.324 -2.817 9.943 1.00 0.00 C ATOM 2087 CD1 ILE B 42 11.236 -3.141 7.674 1.00 0.00 C ATOM 0 H ILE B 42 9.521 -6.571 8.589 1.00 0.00 H new ATOM 0 HA ILE B 42 10.074 -5.263 11.039 1.00 0.00 H new ATOM 0 HB ILE B 42 8.803 -4.258 8.461 1.00 0.00 H new ATOM 0 HG12 ILE B 42 11.672 -4.211 9.468 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.056 -5.210 8.166 1.00 0.00 H new ATOM 0 HG21 ILE B 42 9.486 -2.017 9.221 1.00 0.00 H new ATOM 0 HG22 ILE B 42 8.306 -2.758 10.328 1.00 0.00 H new ATOM 0 HG23 ILE B 42 10.030 -2.711 10.767 1.00 0.00 H new ATOM 0 HD11 ILE B 42 12.248 -3.261 7.288 1.00 0.00 H new ATOM 0 HD12 ILE B 42 10.525 -3.189 6.849 1.00 0.00 H new ATOM 0 HD13 ILE B 42 11.150 -2.175 8.172 1.00 0.00 H new ATOM 2099 N LYS B 43 6.931 -5.786 10.261 1.00 0.00 N ATOM 2100 CA LYS B 43 5.558 -5.738 10.755 1.00 0.00 C ATOM 2101 C LYS B 43 5.449 -6.310 12.167 1.00 0.00 C ATOM 2102 O LYS B 43 5.182 -5.585 13.123 1.00 0.00 O ATOM 2103 CB LYS B 43 4.643 -6.521 9.807 1.00 0.00 C ATOM 2104 CG LYS B 43 3.196 -6.620 10.267 1.00 0.00 C ATOM 2105 CD LYS B 43 2.519 -5.262 10.306 1.00 0.00 C ATOM 2106 CE LYS B 43 1.027 -5.390 10.573 1.00 0.00 C ATOM 2107 NZ LYS B 43 0.743 -6.120 11.841 1.00 0.00 N ATOM 0 H LYS B 43 7.046 -6.310 9.393 1.00 0.00 H new ATOM 0 HA LYS B 43 5.249 -4.694 10.792 1.00 0.00 H new ATOM 0 HB2 LYS B 43 4.668 -6.048 8.825 1.00 0.00 H new ATOM 0 HB3 LYS B 43 5.042 -7.528 9.686 1.00 0.00 H new ATOM 0 HG2 LYS B 43 2.646 -7.280 9.596 1.00 0.00 H new ATOM 0 HG3 LYS B 43 3.161 -7.072 11.258 1.00 0.00 H new ATOM 0 HD2 LYS B 43 2.977 -4.648 11.082 1.00 0.00 H new ATOM 0 HD3 LYS B 43 2.677 -4.748 9.358 1.00 0.00 H new ATOM 0 HE2 LYS B 43 0.581 -4.396 10.620 1.00 0.00 H new ATOM 0 HE3 LYS B 43 0.554 -5.912 9.741 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 0.429 -7.087 11.622 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 1.606 -6.159 12.420 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 -0.005 -5.624 12.367 1.00 0.00 H new ATOM 2121 N LYS B 44 5.646 -7.619 12.286 1.00 0.00 N ATOM 2122 CA LYS B 44 5.552 -8.299 13.575 1.00 0.00 C ATOM 2123 C LYS B 44 6.530 -7.732 14.601 1.00 0.00 C ATOM 2124 O LYS B 44 6.172 -7.531 15.761 1.00 0.00 O ATOM 2125 CB LYS B 44 5.800 -9.798 13.396 1.00 0.00 C ATOM 2126 CG LYS B 44 4.818 -10.468 12.449 1.00 0.00 C ATOM 2127 CD LYS B 44 5.113 -11.952 12.302 1.00 0.00 C ATOM 2128 CE LYS B 44 4.134 -12.621 11.349 1.00 0.00 C ATOM 2129 NZ LYS B 44 2.727 -12.493 11.818 1.00 0.00 N ATOM 0 H LYS B 44 5.872 -8.233 11.503 1.00 0.00 H new ATOM 0 HA LYS B 44 4.544 -8.133 13.956 1.00 0.00 H new ATOM 0 HB2 LYS B 44 6.813 -9.948 13.022 1.00 0.00 H new ATOM 0 HB3 LYS B 44 5.744 -10.286 14.369 1.00 0.00 H new ATOM 0 HG2 LYS B 44 3.802 -10.333 12.820 1.00 0.00 H new ATOM 0 HG3 LYS B 44 4.867 -9.987 11.472 1.00 0.00 H new ATOM 0 HD2 LYS B 44 6.130 -12.088 11.935 1.00 0.00 H new ATOM 0 HD3 LYS B 44 5.059 -12.434 13.278 1.00 0.00 H new ATOM 0 HE2 LYS B 44 4.229 -12.175 10.359 1.00 0.00 H new ATOM 0 HE3 LYS B 44 4.389 -13.676 11.249 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 2.122 -13.150 11.285 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 2.677 -12.721 12.832 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.398 -11.518 11.666 1.00 0.00 H new ATOM 2143 N GLU B 45 7.766 -7.489 14.178 1.00 0.00 N ATOM 2144 CA GLU B 45 8.788 -6.964 15.079 1.00 0.00 C ATOM 2145 C GLU B 45 8.316 -5.696 15.790 1.00 0.00 C ATOM 2146 O GLU B 45 8.453 -5.574 17.008 1.00 0.00 O ATOM 2147 CB GLU B 45 10.076 -6.675 14.304 1.00 0.00 C ATOM 2148 CG GLU B 45 11.198 -6.118 15.165 1.00 0.00 C ATOM 2149 CD GLU B 45 11.615 -7.071 16.270 1.00 0.00 C ATOM 2150 OE1 GLU B 45 10.763 -7.401 17.122 1.00 0.00 O ATOM 2151 OE2 GLU B 45 12.793 -7.484 16.283 1.00 0.00 O ATOM 0 H GLU B 45 8.084 -7.646 13.222 1.00 0.00 H new ATOM 0 HA GLU B 45 8.981 -7.723 15.837 1.00 0.00 H new ATOM 0 HB2 GLU B 45 10.417 -7.595 13.829 1.00 0.00 H new ATOM 0 HB3 GLU B 45 9.857 -5.966 13.505 1.00 0.00 H new ATOM 0 HG2 GLU B 45 12.060 -5.899 14.535 1.00 0.00 H new ATOM 0 HG3 GLU B 45 10.878 -5.174 15.606 1.00 0.00 H new ATOM 2158 N PHE B 46 7.771 -4.755 15.030 1.00 0.00 N ATOM 2159 CA PHE B 46 7.294 -3.497 15.598 1.00 0.00 C ATOM 2160 C PHE B 46 5.977 -3.672 16.349 1.00 0.00 C ATOM 2161 O PHE B 46 5.799 -3.122 17.435 1.00 0.00 O ATOM 2162 CB PHE B 46 7.149 -2.441 14.501 1.00 0.00 C ATOM 2163 CG PHE B 46 8.468 -1.914 14.012 1.00 0.00 C ATOM 2164 CD1 PHE B 46 9.427 -2.771 13.498 1.00 0.00 C ATOM 2165 CD2 PHE B 46 8.752 -0.558 14.075 1.00 0.00 C ATOM 2166 CE1 PHE B 46 10.644 -2.287 13.055 1.00 0.00 C ATOM 2167 CE2 PHE B 46 9.964 -0.070 13.634 1.00 0.00 C ATOM 2168 CZ PHE B 46 10.912 -0.934 13.123 1.00 0.00 C ATOM 0 H PHE B 46 7.648 -4.837 14.021 1.00 0.00 H new ATOM 0 HA PHE B 46 8.037 -3.161 16.321 1.00 0.00 H new ATOM 0 HB2 PHE B 46 6.602 -2.871 13.661 1.00 0.00 H new ATOM 0 HB3 PHE B 46 6.551 -1.612 14.880 1.00 0.00 H new ATOM 0 HD1 PHE B 46 9.222 -3.830 13.443 1.00 0.00 H new ATOM 0 HD2 PHE B 46 8.015 0.124 14.474 1.00 0.00 H new ATOM 0 HE1 PHE B 46 11.384 -2.966 12.657 1.00 0.00 H new ATOM 0 HE2 PHE B 46 10.172 0.988 13.688 1.00 0.00 H new ATOM 0 HZ PHE B 46 11.861 -0.552 12.777 1.00 0.00 H new ATOM 2178 N ASP B 47 5.059 -4.435 15.772 1.00 0.00 N ATOM 2179 CA ASP B 47 3.763 -4.672 16.406 1.00 0.00 C ATOM 2180 C ASP B 47 3.937 -5.295 17.786 1.00 0.00 C ATOM 2181 O ASP B 47 3.226 -4.954 18.729 1.00 0.00 O ATOM 2182 CB ASP B 47 2.892 -5.578 15.533 1.00 0.00 C ATOM 2183 CG ASP B 47 2.490 -4.921 14.228 1.00 0.00 C ATOM 2184 OD1 ASP B 47 1.847 -3.851 14.275 1.00 0.00 O ATOM 2185 OD2 ASP B 47 2.812 -5.478 13.160 1.00 0.00 O ATOM 0 H ASP B 47 5.183 -4.899 14.872 1.00 0.00 H new ATOM 0 HA ASP B 47 3.267 -3.708 16.519 1.00 0.00 H new ATOM 0 HB2 ASP B 47 3.433 -6.500 15.319 1.00 0.00 H new ATOM 0 HB3 ASP B 47 1.995 -5.856 16.087 1.00 0.00 H new ATOM 2190 N LYS B 48 4.882 -6.216 17.892 1.00 0.00 N ATOM 2191 CA LYS B 48 5.156 -6.901 19.146 1.00 0.00 C ATOM 2192 C LYS B 48 5.894 -6.000 20.137 1.00 0.00 C ATOM 2193 O LYS B 48 5.611 -6.016 21.335 1.00 0.00 O ATOM 2194 CB LYS B 48 5.976 -8.161 18.867 1.00 0.00 C ATOM 2195 CG LYS B 48 6.427 -8.889 20.118 1.00 0.00 C ATOM 2196 CD LYS B 48 5.245 -9.320 20.973 1.00 0.00 C ATOM 2197 CE LYS B 48 4.322 -10.259 20.215 1.00 0.00 C ATOM 2198 NZ LYS B 48 3.161 -10.687 21.043 1.00 0.00 N ATOM 0 H LYS B 48 5.477 -6.508 17.117 1.00 0.00 H new ATOM 0 HA LYS B 48 4.203 -7.172 19.601 1.00 0.00 H new ATOM 0 HB2 LYS B 48 5.382 -8.841 18.256 1.00 0.00 H new ATOM 0 HB3 LYS B 48 6.853 -7.889 18.280 1.00 0.00 H new ATOM 0 HG2 LYS B 48 7.013 -9.765 19.839 1.00 0.00 H new ATOM 0 HG3 LYS B 48 7.081 -8.241 20.701 1.00 0.00 H new ATOM 0 HD2 LYS B 48 5.608 -9.814 21.874 1.00 0.00 H new ATOM 0 HD3 LYS B 48 4.687 -8.440 21.294 1.00 0.00 H new ATOM 0 HE2 LYS B 48 3.962 -9.764 19.313 1.00 0.00 H new ATOM 0 HE3 LYS B 48 4.882 -11.137 19.894 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 2.556 -11.326 20.489 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 3.503 -11.182 21.891 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 2.611 -9.852 21.328 1.00 0.00 H new ATOM 2212 N LYS B 49 6.853 -5.237 19.632 1.00 0.00 N ATOM 2213 CA LYS B 49 7.655 -4.349 20.472 1.00 0.00 C ATOM 2214 C LYS B 49 6.925 -3.063 20.840 1.00 0.00 C ATOM 2215 O LYS B 49 6.581 -2.836 22.001 1.00 0.00 O ATOM 2216 CB LYS B 49 8.958 -3.991 19.756 1.00 0.00 C ATOM 2217 CG LYS B 49 9.897 -5.169 19.568 1.00 0.00 C ATOM 2218 CD LYS B 49 10.325 -5.747 20.904 1.00 0.00 C ATOM 2219 CE LYS B 49 11.362 -6.844 20.727 1.00 0.00 C ATOM 2220 NZ LYS B 49 11.777 -7.430 22.031 1.00 0.00 N ATOM 0 H LYS B 49 7.098 -5.213 18.642 1.00 0.00 H new ATOM 0 HA LYS B 49 7.857 -4.891 21.396 1.00 0.00 H new ATOM 0 HB2 LYS B 49 8.721 -3.568 18.780 1.00 0.00 H new ATOM 0 HB3 LYS B 49 9.472 -3.215 20.323 1.00 0.00 H new ATOM 0 HG2 LYS B 49 9.404 -5.940 18.976 1.00 0.00 H new ATOM 0 HG3 LYS B 49 10.776 -4.851 19.008 1.00 0.00 H new ATOM 0 HD2 LYS B 49 10.735 -4.955 21.530 1.00 0.00 H new ATOM 0 HD3 LYS B 49 9.455 -6.147 21.425 1.00 0.00 H new ATOM 0 HE2 LYS B 49 10.955 -7.629 20.089 1.00 0.00 H new ATOM 0 HE3 LYS B 49 12.236 -6.439 20.216 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 12.485 -8.174 21.868 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 12.188 -6.686 22.631 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 10.948 -7.839 22.507 1.00 0.00 H new ATOM 2234 N TYR B 50 6.742 -2.207 19.849 1.00 0.00 N ATOM 2235 CA TYR B 50 6.108 -0.908 20.050 1.00 0.00 C ATOM 2236 C TYR B 50 4.586 -0.993 20.141 1.00 0.00 C ATOM 2237 O TYR B 50 3.940 -0.031 20.549 1.00 0.00 O ATOM 2238 CB TYR B 50 6.534 0.039 18.931 1.00 0.00 C ATOM 2239 CG TYR B 50 8.016 -0.040 18.646 1.00 0.00 C ATOM 2240 CD1 TYR B 50 8.935 -0.070 19.688 1.00 0.00 C ATOM 2241 CD2 TYR B 50 8.498 -0.100 17.345 1.00 0.00 C ATOM 2242 CE1 TYR B 50 10.290 -0.157 19.443 1.00 0.00 C ATOM 2243 CE2 TYR B 50 9.854 -0.186 17.091 1.00 0.00 C ATOM 2244 CZ TYR B 50 10.746 -0.215 18.143 1.00 0.00 C ATOM 2245 OH TYR B 50 12.096 -0.303 17.895 1.00 0.00 O ATOM 0 H TYR B 50 7.026 -2.388 18.886 1.00 0.00 H new ATOM 0 HA TYR B 50 6.444 -0.522 21.012 1.00 0.00 H new ATOM 0 HB2 TYR B 50 5.979 -0.201 18.024 1.00 0.00 H new ATOM 0 HB3 TYR B 50 6.273 1.061 19.204 1.00 0.00 H new ATOM 0 HD1 TYR B 50 8.582 -0.024 20.708 1.00 0.00 H new ATOM 0 HD2 TYR B 50 7.803 -0.079 16.519 1.00 0.00 H new ATOM 0 HE1 TYR B 50 10.990 -0.180 20.265 1.00 0.00 H new ATOM 0 HE2 TYR B 50 10.214 -0.230 16.074 1.00 0.00 H new ATOM 0 HH TYR B 50 12.445 0.584 17.666 1.00 0.00 H new ATOM 2255 N ASN B 51 4.023 -2.140 19.754 1.00 0.00 N ATOM 2256 CA ASN B 51 2.573 -2.362 19.785 1.00 0.00 C ATOM 2257 C ASN B 51 1.950 -2.009 18.439 1.00 0.00 C ATOM 2258 O ASN B 51 2.376 -1.063 17.776 1.00 0.00 O ATOM 2259 CB ASN B 51 1.891 -1.560 20.900 1.00 0.00 C ATOM 2260 CG ASN B 51 2.529 -1.798 22.255 1.00 0.00 C ATOM 2261 OD1 ASN B 51 2.570 -2.925 22.748 1.00 0.00 O ATOM 2262 ND2 ASN B 51 3.030 -0.731 22.867 1.00 0.00 N ATOM 0 H ASN B 51 4.556 -2.939 19.411 1.00 0.00 H new ATOM 0 HA ASN B 51 2.415 -3.421 19.992 1.00 0.00 H new ATOM 0 HB2 ASN B 51 1.938 -0.498 20.661 1.00 0.00 H new ATOM 0 HB3 ASN B 51 0.836 -1.830 20.945 1.00 0.00 H new ATOM 0 HD21 ASN B 51 3.470 -0.828 23.782 1.00 0.00 H new ATOM 0 HD22 ASN B 51 2.975 0.185 22.422 1.00 0.00 H new ATOM 2269 N PRO B 52 0.937 -2.779 18.009 1.00 0.00 N ATOM 2270 CA PRO B 52 0.266 -2.554 16.727 1.00 0.00 C ATOM 2271 C PRO B 52 -0.478 -1.218 16.665 1.00 0.00 C ATOM 2272 O PRO B 52 -0.603 -0.526 17.675 1.00 0.00 O ATOM 2273 CB PRO B 52 -0.722 -3.724 16.627 1.00 0.00 C ATOM 2274 CG PRO B 52 -0.930 -4.172 18.030 1.00 0.00 C ATOM 2275 CD PRO B 52 0.374 -3.934 18.733 1.00 0.00 C ATOM 0 HA PRO B 52 0.982 -2.508 15.906 1.00 0.00 H new ATOM 0 HB2 PRO B 52 -1.660 -3.410 16.169 1.00 0.00 H new ATOM 0 HB3 PRO B 52 -0.320 -4.529 16.011 1.00 0.00 H new ATOM 0 HG2 PRO B 52 -1.737 -3.613 18.503 1.00 0.00 H new ATOM 0 HG3 PRO B 52 -1.208 -5.225 18.067 1.00 0.00 H new ATOM 0 HD2 PRO B 52 0.228 -3.715 19.791 1.00 0.00 H new ATOM 0 HD3 PRO B 52 1.028 -4.804 18.675 1.00 0.00 H new ATOM 2283 N THR B 53 -0.969 -0.848 15.471 1.00 0.00 N ATOM 2284 CA THR B 53 -0.822 -1.667 14.272 1.00 0.00 C ATOM 2285 C THR B 53 -0.006 -0.945 13.207 1.00 0.00 C ATOM 2286 O THR B 53 -0.422 0.085 12.678 1.00 0.00 O ATOM 2287 CB THR B 53 -2.200 -2.024 13.722 1.00 0.00 C ATOM 2288 OG1 THR B 53 -2.091 -2.925 12.635 1.00 0.00 O ATOM 2289 CG2 THR B 53 -2.987 -0.823 13.247 1.00 0.00 C ATOM 0 H THR B 53 -1.475 0.024 15.317 1.00 0.00 H new ATOM 0 HA THR B 53 -0.289 -2.579 14.543 1.00 0.00 H new ATOM 0 HB THR B 53 -2.733 -2.478 14.558 1.00 0.00 H new ATOM 0 HG1 THR B 53 -2.179 -2.433 11.792 1.00 0.00 H new ATOM 0 HG21 THR B 53 -3.956 -1.149 12.869 1.00 0.00 H new ATOM 0 HG22 THR B 53 -3.135 -0.133 14.078 1.00 0.00 H new ATOM 0 HG23 THR B 53 -2.438 -0.320 12.451 1.00 0.00 H new ATOM 2297 N TRP B 54 1.162 -1.496 12.899 1.00 0.00 N ATOM 2298 CA TRP B 54 2.046 -0.909 11.903 1.00 0.00 C ATOM 2299 C TRP B 54 1.742 -1.420 10.505 1.00 0.00 C ATOM 2300 O TRP B 54 1.836 -2.615 10.231 1.00 0.00 O ATOM 2301 CB TRP B 54 3.500 -1.207 12.245 1.00 0.00 C ATOM 2302 CG TRP B 54 3.888 -0.721 13.601 1.00 0.00 C ATOM 2303 CD1 TRP B 54 3.369 -1.130 14.793 1.00 0.00 C ATOM 2304 CD2 TRP B 54 4.867 0.275 13.904 1.00 0.00 C ATOM 2305 NE1 TRP B 54 3.974 -0.460 15.824 1.00 0.00 N ATOM 2306 CE2 TRP B 54 4.899 0.410 15.305 1.00 0.00 C ATOM 2307 CE3 TRP B 54 5.723 1.062 13.129 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 5.755 1.301 15.946 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 6.571 1.947 13.767 1.00 0.00 C ATOM 2310 CH2 TRP B 54 6.583 2.059 15.164 1.00 0.00 C ATOM 0 H TRP B 54 1.518 -2.351 13.327 1.00 0.00 H new ATOM 0 HA TRP B 54 1.877 0.168 11.916 1.00 0.00 H new ATOM 0 HB2 TRP B 54 3.669 -2.282 12.188 1.00 0.00 H new ATOM 0 HB3 TRP B 54 4.146 -0.743 11.500 1.00 0.00 H new ATOM 0 HD1 TRP B 54 2.594 -1.873 14.908 1.00 0.00 H new ATOM 0 HE1 TRP B 54 3.770 -0.587 16.815 1.00 0.00 H new ATOM 0 HE3 TRP B 54 5.722 0.980 12.052 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 5.765 1.391 17.022 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 7.236 2.563 13.179 1.00 0.00 H new ATOM 0 HH2 TRP B 54 7.260 2.758 15.633 1.00 0.00 H new ATOM 2321 N HIS B 55 1.409 -0.496 9.616 1.00 0.00 N ATOM 2322 CA HIS B 55 1.127 -0.837 8.234 1.00 0.00 C ATOM 2323 C HIS B 55 2.426 -0.787 7.443 1.00 0.00 C ATOM 2324 O HIS B 55 3.243 0.113 7.655 1.00 0.00 O ATOM 2325 CB HIS B 55 0.105 0.138 7.653 1.00 0.00 C ATOM 2326 CG HIS B 55 -1.073 0.357 8.550 1.00 0.00 C ATOM 2327 ND1 HIS B 55 -1.833 -0.672 9.060 1.00 0.00 N ATOM 2328 CD2 HIS B 55 -1.628 1.498 9.020 1.00 0.00 C ATOM 2329 CE1 HIS B 55 -2.809 -0.175 9.797 1.00 0.00 C ATOM 2330 NE2 HIS B 55 -2.707 1.141 9.791 1.00 0.00 N ATOM 0 H HIS B 55 1.328 0.498 9.830 1.00 0.00 H new ATOM 0 HA HIS B 55 0.707 -1.841 8.176 1.00 0.00 H new ATOM 0 HB2 HIS B 55 0.592 1.094 7.462 1.00 0.00 H new ATOM 0 HB3 HIS B 55 -0.243 -0.240 6.692 1.00 0.00 H new ATOM 0 HD1 HIS B 55 -1.667 -1.665 8.894 1.00 0.00 H new ATOM 0 HD2 HIS B 55 -1.286 2.504 8.825 1.00 0.00 H new ATOM 0 HE1 HIS B 55 -3.563 -0.748 10.317 1.00 0.00 H new ATOM 2339 N CYS B 56 2.639 -1.753 6.555 1.00 0.00 N ATOM 2340 CA CYS B 56 3.876 -1.779 5.784 1.00 0.00 C ATOM 2341 C CYS B 56 3.660 -2.234 4.345 1.00 0.00 C ATOM 2342 O CYS B 56 2.845 -3.115 4.066 1.00 0.00 O ATOM 2343 CB CYS B 56 4.904 -2.679 6.471 1.00 0.00 C ATOM 2344 SG CYS B 56 4.316 -4.352 6.810 1.00 0.00 S ATOM 0 H CYS B 56 1.988 -2.512 6.354 1.00 0.00 H new ATOM 0 HA CYS B 56 4.250 -0.756 5.744 1.00 0.00 H new ATOM 0 HB2 CYS B 56 5.794 -2.739 5.844 1.00 0.00 H new ATOM 0 HB3 CYS B 56 5.206 -2.215 7.410 1.00 0.00 H new ATOM 0 HG CYS B 56 5.286 -5.060 7.308 1.00 0.00 H new ATOM 2350 N ILE B 57 4.414 -1.614 3.443 1.00 0.00 N ATOM 2351 CA ILE B 57 4.346 -1.919 2.021 1.00 0.00 C ATOM 2352 C ILE B 57 5.743 -1.831 1.407 1.00 0.00 C ATOM 2353 O ILE B 57 6.580 -1.058 1.874 1.00 0.00 O ATOM 2354 CB ILE B 57 3.410 -0.945 1.280 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.065 -0.839 2.003 1.00 0.00 C ATOM 2356 CG2 ILE B 57 3.204 -1.399 -0.156 1.00 0.00 C ATOM 2357 CD1 ILE B 57 1.290 -2.136 2.038 1.00 0.00 C ATOM 0 H ILE B 57 5.089 -0.886 3.679 1.00 0.00 H new ATOM 0 HA ILE B 57 3.949 -2.929 1.915 1.00 0.00 H new ATOM 0 HB ILE B 57 3.875 0.041 1.270 1.00 0.00 H new ATOM 0 HG12 ILE B 57 2.238 -0.501 3.025 1.00 0.00 H new ATOM 0 HG13 ILE B 57 1.459 -0.077 1.514 1.00 0.00 H new ATOM 0 HG21 ILE B 57 2.541 -0.701 -0.667 1.00 0.00 H new ATOM 0 HG22 ILE B 57 4.165 -1.428 -0.670 1.00 0.00 H new ATOM 0 HG23 ILE B 57 2.759 -2.394 -0.163 1.00 0.00 H new ATOM 0 HD11 ILE B 57 0.349 -1.983 2.566 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.085 -2.465 1.019 1.00 0.00 H new ATOM 0 HD13 ILE B 57 1.876 -2.896 2.554 1.00 0.00 H new ATOM 2369 N VAL B 58 6.002 -2.625 0.372 1.00 0.00 N ATOM 2370 CA VAL B 58 7.312 -2.619 -0.270 1.00 0.00 C ATOM 2371 C VAL B 58 7.215 -3.053 -1.727 1.00 0.00 C ATOM 2372 O VAL B 58 6.581 -4.057 -2.045 1.00 0.00 O ATOM 2373 CB VAL B 58 8.297 -3.549 0.471 1.00 0.00 C ATOM 2374 CG1 VAL B 58 9.678 -3.506 -0.171 1.00 0.00 C ATOM 2375 CG2 VAL B 58 8.375 -3.174 1.943 1.00 0.00 C ATOM 0 H VAL B 58 5.330 -3.274 -0.036 1.00 0.00 H new ATOM 0 HA VAL B 58 7.684 -1.595 -0.228 1.00 0.00 H new ATOM 0 HB VAL B 58 7.925 -4.570 0.394 1.00 0.00 H new ATOM 0 HG11 VAL B 58 10.352 -4.170 0.371 1.00 0.00 H new ATOM 0 HG12 VAL B 58 9.607 -3.830 -1.209 1.00 0.00 H new ATOM 0 HG13 VAL B 58 10.065 -2.488 -0.134 1.00 0.00 H new ATOM 0 HG21 VAL B 58 9.073 -3.839 2.451 1.00 0.00 H new ATOM 0 HG22 VAL B 58 8.719 -2.144 2.038 1.00 0.00 H new ATOM 0 HG23 VAL B 58 7.388 -3.270 2.396 1.00 0.00 H new ATOM 2385 N GLY B 59 7.853 -2.290 -2.607 1.00 0.00 N ATOM 2386 CA GLY B 59 7.828 -2.608 -4.022 1.00 0.00 C ATOM 2387 C GLY B 59 8.695 -1.671 -4.843 1.00 0.00 C ATOM 2388 O GLY B 59 9.827 -1.371 -4.465 1.00 0.00 O ATOM 0 H GLY B 59 8.388 -1.456 -2.365 1.00 0.00 H new ATOM 0 HA2 GLY B 59 8.168 -3.633 -4.167 1.00 0.00 H new ATOM 0 HA3 GLY B 59 6.801 -2.559 -4.384 1.00 0.00 H new ATOM 2392 N ARG B 60 8.162 -1.205 -5.969 1.00 0.00 N ATOM 2393 CA ARG B 60 8.897 -0.292 -6.844 1.00 0.00 C ATOM 2394 C ARG B 60 8.035 0.151 -8.024 1.00 0.00 C ATOM 2395 O ARG B 60 8.529 0.301 -9.140 1.00 0.00 O ATOM 2396 CB ARG B 60 10.173 -0.962 -7.355 1.00 0.00 C ATOM 2397 CG ARG B 60 9.914 -2.220 -8.169 1.00 0.00 C ATOM 2398 CD ARG B 60 11.208 -2.838 -8.672 1.00 0.00 C ATOM 2399 NE ARG B 60 10.969 -4.046 -9.459 1.00 0.00 N ATOM 2400 CZ ARG B 60 11.934 -4.768 -10.023 1.00 0.00 C ATOM 2401 NH1 ARG B 60 13.206 -4.407 -9.891 1.00 0.00 N ATOM 2402 NH2 ARG B 60 11.629 -5.853 -10.718 1.00 0.00 N ATOM 0 H ARG B 60 7.226 -1.443 -6.298 1.00 0.00 H new ATOM 0 HA ARG B 60 9.163 0.591 -6.262 1.00 0.00 H new ATOM 0 HB2 ARG B 60 10.727 -0.251 -7.967 1.00 0.00 H new ATOM 0 HB3 ARG B 60 10.807 -1.213 -6.505 1.00 0.00 H new ATOM 0 HG2 ARG B 60 9.377 -2.945 -7.558 1.00 0.00 H new ATOM 0 HG3 ARG B 60 9.272 -1.980 -9.016 1.00 0.00 H new ATOM 0 HD2 ARG B 60 11.745 -2.110 -9.280 1.00 0.00 H new ATOM 0 HD3 ARG B 60 11.848 -3.079 -7.823 1.00 0.00 H new ATOM 0 HE ARG B 60 10.005 -4.354 -9.583 1.00 0.00 H new ATOM 0 HH11 ARG B 60 13.446 -3.573 -9.355 1.00 0.00 H new ATOM 0 HH12 ARG B 60 13.942 -4.964 -10.325 1.00 0.00 H new ATOM 0 HH21 ARG B 60 10.654 -6.135 -10.821 1.00 0.00 H new ATOM 0 HH22 ARG B 60 12.369 -6.406 -11.150 1.00 0.00 H new ATOM 2416 N ASN B 61 6.746 0.362 -7.758 1.00 0.00 N ATOM 2417 CA ASN B 61 5.785 0.789 -8.770 1.00 0.00 C ATOM 2418 C ASN B 61 4.359 0.594 -8.259 1.00 0.00 C ATOM 2419 O ASN B 61 3.714 -0.407 -8.577 1.00 0.00 O ATOM 2420 CB ASN B 61 5.969 0.005 -10.067 1.00 0.00 C ATOM 2421 CG ASN B 61 5.150 0.582 -11.195 1.00 0.00 C ATOM 2422 OD1 ASN B 61 3.959 0.301 -11.332 1.00 0.00 O ATOM 2423 ND2 ASN B 61 5.787 1.432 -11.981 1.00 0.00 N ATOM 0 H ASN B 61 6.339 0.241 -6.830 1.00 0.00 H new ATOM 0 HA ASN B 61 5.960 1.846 -8.972 1.00 0.00 H new ATOM 0 HB2 ASN B 61 7.023 0.007 -10.346 1.00 0.00 H new ATOM 0 HB3 ASN B 61 5.684 -1.035 -9.906 1.00 0.00 H new ATOM 0 HD21 ASN B 61 5.290 1.890 -12.745 1.00 0.00 H new ATOM 0 HD22 ASN B 61 6.775 1.630 -11.824 1.00 0.00 H new ATOM 2430 N PHE B 62 3.866 1.539 -7.461 1.00 0.00 N ATOM 2431 CA PHE B 62 2.513 1.427 -6.917 1.00 0.00 C ATOM 2432 C PHE B 62 2.104 2.648 -6.100 1.00 0.00 C ATOM 2433 O PHE B 62 2.887 3.183 -5.316 1.00 0.00 O ATOM 2434 CB PHE B 62 2.406 0.186 -6.028 1.00 0.00 C ATOM 2435 CG PHE B 62 3.229 0.276 -4.772 1.00 0.00 C ATOM 2436 CD1 PHE B 62 4.606 0.160 -4.821 1.00 0.00 C ATOM 2437 CD2 PHE B 62 2.621 0.493 -3.545 1.00 0.00 C ATOM 2438 CE1 PHE B 62 5.367 0.256 -3.672 1.00 0.00 C ATOM 2439 CE2 PHE B 62 3.375 0.588 -2.390 1.00 0.00 C ATOM 2440 CZ PHE B 62 4.750 0.469 -2.454 1.00 0.00 C ATOM 0 H PHE B 62 4.373 2.378 -7.180 1.00 0.00 H new ATOM 0 HA PHE B 62 1.840 1.351 -7.771 1.00 0.00 H new ATOM 0 HB2 PHE B 62 1.361 0.031 -5.758 1.00 0.00 H new ATOM 0 HB3 PHE B 62 2.721 -0.688 -6.598 1.00 0.00 H new ATOM 0 HD1 PHE B 62 5.093 -0.008 -5.770 1.00 0.00 H new ATOM 0 HD2 PHE B 62 1.547 0.589 -3.491 1.00 0.00 H new ATOM 0 HE1 PHE B 62 6.442 0.165 -3.726 1.00 0.00 H new ATOM 0 HE2 PHE B 62 2.890 0.755 -1.440 1.00 0.00 H new ATOM 0 HZ PHE B 62 5.342 0.542 -1.553 1.00 0.00 H new ATOM 2450 N GLY B 63 0.851 3.047 -6.268 1.00 0.00 N ATOM 2451 CA GLY B 63 0.310 4.169 -5.518 1.00 0.00 C ATOM 2452 C GLY B 63 -0.390 3.693 -4.261 1.00 0.00 C ATOM 2453 O GLY B 63 -1.032 2.643 -4.277 1.00 0.00 O ATOM 0 H GLY B 63 0.193 2.612 -6.915 1.00 0.00 H new ATOM 0 HA2 GLY B 63 1.114 4.856 -5.253 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -0.391 4.724 -6.141 1.00 0.00 H new ATOM 2457 N SER B 64 -0.262 4.431 -3.160 1.00 0.00 N ATOM 2458 CA SER B 64 -0.892 4.005 -1.912 1.00 0.00 C ATOM 2459 C SER B 64 -1.414 5.172 -1.077 1.00 0.00 C ATOM 2460 O SER B 64 -0.824 6.255 -1.045 1.00 0.00 O ATOM 2461 CB SER B 64 0.094 3.183 -1.080 1.00 0.00 C ATOM 2462 OG SER B 64 -0.493 2.766 0.140 1.00 0.00 O ATOM 0 H SER B 64 0.259 5.306 -3.105 1.00 0.00 H new ATOM 0 HA SER B 64 -1.753 3.397 -2.190 1.00 0.00 H new ATOM 0 HB2 SER B 64 0.416 2.311 -1.649 1.00 0.00 H new ATOM 0 HB3 SER B 64 0.985 3.777 -0.875 1.00 0.00 H new ATOM 0 HG SER B 64 0.156 2.241 0.653 1.00 0.00 H new ATOM 2468 N TYR B 65 -2.524 4.912 -0.382 1.00 0.00 N ATOM 2469 CA TYR B 65 -3.161 5.890 0.493 1.00 0.00 C ATOM 2470 C TYR B 65 -3.639 5.216 1.775 1.00 0.00 C ATOM 2471 O TYR B 65 -4.192 4.117 1.738 1.00 0.00 O ATOM 2472 CB TYR B 65 -4.338 6.575 -0.203 1.00 0.00 C ATOM 2473 CG TYR B 65 -3.931 7.728 -1.088 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -3.193 7.520 -2.244 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -4.279 9.031 -0.755 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -2.817 8.578 -3.046 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -3.907 10.094 -1.552 1.00 0.00 C ATOM 2478 CZ TYR B 65 -3.175 9.864 -2.698 1.00 0.00 C ATOM 2479 OH TYR B 65 -2.802 10.920 -3.497 1.00 0.00 O ATOM 0 H TYR B 65 -3.005 4.013 -0.413 1.00 0.00 H new ATOM 0 HA TYR B 65 -2.421 6.651 0.739 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -4.872 5.839 -0.803 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -5.035 6.937 0.553 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -2.909 6.515 -2.520 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -4.850 9.215 0.143 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -2.244 8.400 -3.944 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -4.188 11.101 -1.280 1.00 0.00 H new ATOM 0 HH TYR B 65 -3.135 11.757 -3.110 1.00 0.00 H new ATOM 2489 N VAL B 66 -3.402 5.868 2.909 1.00 0.00 N ATOM 2490 CA VAL B 66 -3.783 5.319 4.211 1.00 0.00 C ATOM 2491 C VAL B 66 -3.897 6.428 5.249 1.00 0.00 C ATOM 2492 O VAL B 66 -3.303 7.479 5.092 1.00 0.00 O ATOM 2493 CB VAL B 66 -2.725 4.314 4.710 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -3.213 3.559 5.937 1.00 0.00 C ATOM 2495 CG2 VAL B 66 -2.325 3.346 3.605 1.00 0.00 C ATOM 0 H VAL B 66 -2.947 6.780 2.955 1.00 0.00 H new ATOM 0 HA VAL B 66 -4.744 4.821 4.084 1.00 0.00 H new ATOM 0 HB VAL B 66 -1.842 4.884 4.998 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -2.444 2.859 6.263 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -3.424 4.266 6.739 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -4.122 3.010 5.689 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -1.578 2.649 3.985 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -3.202 2.792 3.272 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -1.908 3.903 2.766 1.00 0.00 H new ATOM 2505 N THR B 67 -4.638 6.183 6.319 1.00 0.00 N ATOM 2506 CA THR B 67 -4.779 7.170 7.388 1.00 0.00 C ATOM 2507 C THR B 67 -3.953 6.734 8.593 1.00 0.00 C ATOM 2508 O THR B 67 -3.695 5.542 8.772 1.00 0.00 O ATOM 2509 CB THR B 67 -6.248 7.347 7.778 1.00 0.00 C ATOM 2510 OG1 THR B 67 -7.014 7.777 6.666 1.00 0.00 O ATOM 2511 CG2 THR B 67 -6.456 8.348 8.893 1.00 0.00 C ATOM 0 H THR B 67 -5.150 5.315 6.473 1.00 0.00 H new ATOM 0 HA THR B 67 -4.413 8.132 7.031 1.00 0.00 H new ATOM 0 HB THR B 67 -6.573 6.367 8.127 1.00 0.00 H new ATOM 0 HG1 THR B 67 -7.950 7.883 6.935 1.00 0.00 H new ATOM 0 HG21 THR B 67 -7.519 8.425 9.119 1.00 0.00 H new ATOM 0 HG22 THR B 67 -5.918 8.019 9.782 1.00 0.00 H new ATOM 0 HG23 THR B 67 -6.080 9.323 8.582 1.00 0.00 H new ATOM 2519 N HIS B 68 -3.502 7.691 9.398 1.00 0.00 N ATOM 2520 CA HIS B 68 -2.667 7.361 10.547 1.00 0.00 C ATOM 2521 C HIS B 68 -2.475 8.550 11.484 1.00 0.00 C ATOM 2522 O HIS B 68 -2.423 9.699 11.046 1.00 0.00 O ATOM 2523 CB HIS B 68 -1.313 6.888 10.037 1.00 0.00 C ATOM 2524 CG HIS B 68 -0.684 7.880 9.112 1.00 0.00 C ATOM 2525 ND1 HIS B 68 -0.095 9.046 9.551 1.00 0.00 N ATOM 2526 CD2 HIS B 68 -0.611 7.906 7.762 1.00 0.00 C ATOM 2527 CE1 HIS B 68 0.314 9.747 8.509 1.00 0.00 C ATOM 2528 NE2 HIS B 68 0.013 9.078 7.411 1.00 0.00 N ATOM 0 H HIS B 68 -3.697 8.685 9.279 1.00 0.00 H new ATOM 0 HA HIS B 68 -3.165 6.579 11.120 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -0.649 6.710 10.883 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -1.433 5.936 9.520 1.00 0.00 H new ATOM 0 HD1 HIS B 68 0.009 9.324 10.527 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -0.975 7.147 7.086 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.811 10.705 8.548 1.00 0.00 H new ATOM 2537 N GLU B 69 -2.359 8.255 12.775 1.00 0.00 N ATOM 2538 CA GLU B 69 -2.160 9.283 13.792 1.00 0.00 C ATOM 2539 C GLU B 69 -0.797 9.952 13.640 1.00 0.00 C ATOM 2540 O GLU B 69 0.129 9.379 13.067 1.00 0.00 O ATOM 2541 CB GLU B 69 -2.278 8.676 15.188 1.00 0.00 C ATOM 2542 CG GLU B 69 -1.224 7.622 15.475 1.00 0.00 C ATOM 2543 CD GLU B 69 -1.355 7.025 16.863 1.00 0.00 C ATOM 2544 OE1 GLU B 69 -2.422 6.449 17.161 1.00 0.00 O ATOM 2545 OE2 GLU B 69 -0.392 7.136 17.650 1.00 0.00 O ATOM 0 H GLU B 69 -2.400 7.305 13.144 1.00 0.00 H new ATOM 0 HA GLU B 69 -2.934 10.039 13.658 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -2.199 9.471 15.930 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -3.267 8.231 15.301 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -1.300 6.827 14.733 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -0.234 8.065 15.367 1.00 0.00 H new ATOM 2552 N THR B 70 -0.686 11.171 14.159 1.00 0.00 N ATOM 2553 CA THR B 70 0.560 11.929 14.090 1.00 0.00 C ATOM 2554 C THR B 70 1.693 11.218 14.828 1.00 0.00 C ATOM 2555 O THR B 70 1.456 10.399 15.715 1.00 0.00 O ATOM 2556 CB THR B 70 0.362 13.330 14.670 1.00 0.00 C ATOM 2557 OG1 THR B 70 -0.040 13.261 16.026 1.00 0.00 O ATOM 2558 CG2 THR B 70 -0.670 14.148 13.924 1.00 0.00 C ATOM 0 H THR B 70 -1.447 11.657 14.634 1.00 0.00 H new ATOM 0 HA THR B 70 0.839 12.008 13.039 1.00 0.00 H new ATOM 0 HB THR B 70 1.330 13.821 14.571 1.00 0.00 H new ATOM 0 HG1 THR B 70 -0.159 14.168 16.378 1.00 0.00 H new ATOM 0 HG21 THR B 70 -0.760 15.130 14.388 1.00 0.00 H new ATOM 0 HG22 THR B 70 -0.361 14.264 12.885 1.00 0.00 H new ATOM 0 HG23 THR B 70 -1.633 13.639 13.961 1.00 0.00 H new ATOM 2566 N LYS B 71 2.926 11.546 14.446 1.00 0.00 N ATOM 2567 CA LYS B 71 4.118 10.954 15.056 1.00 0.00 C ATOM 2568 C LYS B 71 4.212 9.465 14.751 1.00 0.00 C ATOM 2569 O LYS B 71 4.650 8.677 15.589 1.00 0.00 O ATOM 2570 CB LYS B 71 4.118 11.172 16.573 1.00 0.00 C ATOM 2571 CG LYS B 71 4.126 12.635 16.994 1.00 0.00 C ATOM 2572 CD LYS B 71 5.532 13.222 17.033 1.00 0.00 C ATOM 2573 CE LYS B 71 6.203 13.200 15.670 1.00 0.00 C ATOM 2574 NZ LYS B 71 7.495 13.938 15.675 1.00 0.00 N ATOM 0 H LYS B 71 3.128 12.224 13.711 1.00 0.00 H new ATOM 0 HA LYS B 71 4.987 11.452 14.625 1.00 0.00 H new ATOM 0 HB2 LYS B 71 3.239 10.688 16.998 1.00 0.00 H new ATOM 0 HB3 LYS B 71 4.991 10.678 17.000 1.00 0.00 H new ATOM 0 HG2 LYS B 71 3.513 13.213 16.302 1.00 0.00 H new ATOM 0 HG3 LYS B 71 3.669 12.729 17.979 1.00 0.00 H new ATOM 0 HD2 LYS B 71 5.485 14.249 17.396 1.00 0.00 H new ATOM 0 HD3 LYS B 71 6.138 12.660 17.743 1.00 0.00 H new ATOM 0 HE2 LYS B 71 6.376 12.167 15.367 1.00 0.00 H new ATOM 0 HE3 LYS B 71 5.536 13.641 14.930 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 7.921 13.899 14.727 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 7.327 14.930 15.939 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 8.142 13.501 16.363 1.00 0.00 H new ATOM 2588 N HIS B 72 3.810 9.093 13.541 1.00 0.00 N ATOM 2589 CA HIS B 72 3.854 7.701 13.108 1.00 0.00 C ATOM 2590 C HIS B 72 3.733 7.606 11.594 1.00 0.00 C ATOM 2591 O HIS B 72 2.718 7.152 11.065 1.00 0.00 O ATOM 2592 CB HIS B 72 2.746 6.888 13.786 1.00 0.00 C ATOM 2593 CG HIS B 72 2.978 6.669 15.248 1.00 0.00 C ATOM 2594 ND1 HIS B 72 4.079 5.996 15.740 1.00 0.00 N ATOM 2595 CD2 HIS B 72 2.256 7.045 16.330 1.00 0.00 C ATOM 2596 CE1 HIS B 72 4.021 5.969 17.060 1.00 0.00 C ATOM 2597 NE2 HIS B 72 2.926 6.598 17.442 1.00 0.00 N ATOM 0 H HIS B 72 3.448 9.739 12.840 1.00 0.00 H new ATOM 0 HA HIS B 72 4.816 7.283 13.403 1.00 0.00 H new ATOM 0 HB2 HIS B 72 1.794 7.401 13.650 1.00 0.00 H new ATOM 0 HB3 HIS B 72 2.660 5.921 13.291 1.00 0.00 H new ATOM 0 HD2 HIS B 72 1.326 7.594 16.320 1.00 0.00 H new ATOM 0 HE1 HIS B 72 4.747 5.510 17.715 1.00 0.00 H new ATOM 0 HE2 HIS B 72 2.626 6.731 18.408 1.00 0.00 H new ATOM 2606 N PHE B 73 4.779 8.046 10.902 1.00 0.00 N ATOM 2607 CA PHE B 73 4.810 8.025 9.446 1.00 0.00 C ATOM 2608 C PHE B 73 6.253 7.972 8.957 1.00 0.00 C ATOM 2609 O PHE B 73 7.079 8.795 9.350 1.00 0.00 O ATOM 2610 CB PHE B 73 4.096 9.271 8.898 1.00 0.00 C ATOM 2611 CG PHE B 73 4.256 9.496 7.415 1.00 0.00 C ATOM 2612 CD1 PHE B 73 5.494 9.807 6.867 1.00 0.00 C ATOM 2613 CD2 PHE B 73 3.162 9.408 6.571 1.00 0.00 C ATOM 2614 CE1 PHE B 73 5.633 10.021 5.508 1.00 0.00 C ATOM 2615 CE2 PHE B 73 3.297 9.621 5.212 1.00 0.00 C ATOM 2616 CZ PHE B 73 4.533 9.928 4.682 1.00 0.00 C ATOM 0 H PHE B 73 5.623 8.424 11.332 1.00 0.00 H new ATOM 0 HA PHE B 73 4.292 7.137 9.084 1.00 0.00 H new ATOM 0 HB2 PHE B 73 3.033 9.192 9.126 1.00 0.00 H new ATOM 0 HB3 PHE B 73 4.471 10.148 9.426 1.00 0.00 H new ATOM 0 HD1 PHE B 73 6.358 9.883 7.510 1.00 0.00 H new ATOM 0 HD2 PHE B 73 2.191 9.170 6.980 1.00 0.00 H new ATOM 0 HE1 PHE B 73 6.601 10.261 5.094 1.00 0.00 H new ATOM 0 HE2 PHE B 73 2.435 9.547 4.565 1.00 0.00 H new ATOM 0 HZ PHE B 73 4.639 10.095 3.620 1.00 0.00 H new ATOM 2626 N ILE B 74 6.556 7.003 8.097 1.00 0.00 N ATOM 2627 CA ILE B 74 7.905 6.866 7.569 1.00 0.00 C ATOM 2628 C ILE B 74 7.913 6.160 6.219 1.00 0.00 C ATOM 2629 O ILE B 74 7.100 5.274 5.956 1.00 0.00 O ATOM 2630 CB ILE B 74 8.822 6.101 8.545 1.00 0.00 C ATOM 2631 CG1 ILE B 74 10.251 6.042 7.999 1.00 0.00 C ATOM 2632 CG2 ILE B 74 8.287 4.699 8.793 1.00 0.00 C ATOM 2633 CD1 ILE B 74 11.219 5.348 8.927 1.00 0.00 C ATOM 0 H ILE B 74 5.891 6.309 7.755 1.00 0.00 H new ATOM 0 HA ILE B 74 8.288 7.878 7.441 1.00 0.00 H new ATOM 0 HB ILE B 74 8.837 6.635 9.495 1.00 0.00 H new ATOM 0 HG12 ILE B 74 10.244 5.525 7.040 1.00 0.00 H new ATOM 0 HG13 ILE B 74 10.603 7.057 7.812 1.00 0.00 H new ATOM 0 HG21 ILE B 74 8.947 4.175 9.484 1.00 0.00 H new ATOM 0 HG22 ILE B 74 7.287 4.762 9.223 1.00 0.00 H new ATOM 0 HG23 ILE B 74 8.243 4.154 7.850 1.00 0.00 H new ATOM 0 HD11 ILE B 74 12.212 5.342 8.478 1.00 0.00 H new ATOM 0 HD12 ILE B 74 11.254 5.878 9.879 1.00 0.00 H new ATOM 0 HD13 ILE B 74 10.890 4.322 9.095 1.00 0.00 H new ATOM 2645 N TYR B 75 8.847 6.570 5.371 1.00 0.00 N ATOM 2646 CA TYR B 75 8.995 6.002 4.039 1.00 0.00 C ATOM 2647 C TYR B 75 10.429 6.205 3.566 1.00 0.00 C ATOM 2648 O TYR B 75 11.001 7.277 3.763 1.00 0.00 O ATOM 2649 CB TYR B 75 8.014 6.673 3.074 1.00 0.00 C ATOM 2650 CG TYR B 75 7.838 5.934 1.768 1.00 0.00 C ATOM 2651 CD1 TYR B 75 8.913 5.702 0.923 1.00 0.00 C ATOM 2652 CD2 TYR B 75 6.589 5.460 1.385 1.00 0.00 C ATOM 2653 CE1 TYR B 75 8.750 5.021 -0.265 1.00 0.00 C ATOM 2654 CE2 TYR B 75 6.419 4.778 0.198 1.00 0.00 C ATOM 2655 CZ TYR B 75 7.502 4.561 -0.623 1.00 0.00 C ATOM 2656 OH TYR B 75 7.336 3.881 -1.806 1.00 0.00 O ATOM 0 H TYR B 75 9.522 7.304 5.587 1.00 0.00 H new ATOM 0 HA TYR B 75 8.774 4.935 4.068 1.00 0.00 H new ATOM 0 HB2 TYR B 75 7.044 6.764 3.562 1.00 0.00 H new ATOM 0 HB3 TYR B 75 8.361 7.685 2.864 1.00 0.00 H new ATOM 0 HD1 TYR B 75 9.893 6.060 1.200 1.00 0.00 H new ATOM 0 HD2 TYR B 75 5.737 5.628 2.027 1.00 0.00 H new ATOM 0 HE1 TYR B 75 9.597 4.849 -0.912 1.00 0.00 H new ATOM 0 HE2 TYR B 75 5.442 4.416 -0.085 1.00 0.00 H new ATOM 0 HH TYR B 75 7.086 2.953 -1.617 1.00 0.00 H new ATOM 2666 N PHE B 76 11.025 5.178 2.965 1.00 0.00 N ATOM 2667 CA PHE B 76 12.406 5.288 2.509 1.00 0.00 C ATOM 2668 C PHE B 76 12.795 4.170 1.543 1.00 0.00 C ATOM 2669 O PHE B 76 12.398 3.018 1.710 1.00 0.00 O ATOM 2670 CB PHE B 76 13.342 5.279 3.723 1.00 0.00 C ATOM 2671 CG PHE B 76 13.213 4.051 4.580 1.00 0.00 C ATOM 2672 CD1 PHE B 76 13.631 2.814 4.112 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.673 4.133 5.853 1.00 0.00 C ATOM 2674 CE1 PHE B 76 13.510 1.683 4.899 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.551 3.006 6.644 1.00 0.00 C ATOM 2676 CZ PHE B 76 12.970 1.780 6.166 1.00 0.00 C ATOM 0 H PHE B 76 10.583 4.277 2.785 1.00 0.00 H new ATOM 0 HA PHE B 76 12.500 6.227 1.964 1.00 0.00 H new ATOM 0 HB2 PHE B 76 14.372 5.362 3.376 1.00 0.00 H new ATOM 0 HB3 PHE B 76 13.139 6.159 4.333 1.00 0.00 H new ATOM 0 HD1 PHE B 76 14.056 2.733 3.122 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.343 5.089 6.232 1.00 0.00 H new ATOM 0 HE1 PHE B 76 13.838 0.725 4.523 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.128 3.084 7.635 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.875 0.898 6.782 1.00 0.00 H new ATOM 2686 N TYR B 77 13.596 4.531 0.540 1.00 0.00 N ATOM 2687 CA TYR B 77 14.078 3.570 -0.450 1.00 0.00 C ATOM 2688 C TYR B 77 15.234 2.762 0.128 1.00 0.00 C ATOM 2689 O TYR B 77 15.985 3.263 0.966 1.00 0.00 O ATOM 2690 CB TYR B 77 14.548 4.286 -1.722 1.00 0.00 C ATOM 2691 CG TYR B 77 13.447 4.935 -2.540 1.00 0.00 C ATOM 2692 CD1 TYR B 77 12.109 4.847 -2.167 1.00 0.00 C ATOM 2693 CD2 TYR B 77 13.756 5.635 -3.701 1.00 0.00 C ATOM 2694 CE1 TYR B 77 11.118 5.440 -2.927 1.00 0.00 C ATOM 2695 CE2 TYR B 77 12.769 6.228 -4.463 1.00 0.00 C ATOM 2696 CZ TYR B 77 11.453 6.128 -4.072 1.00 0.00 C ATOM 2697 OH TYR B 77 10.467 6.717 -4.831 1.00 0.00 O ATOM 0 H TYR B 77 13.925 5.485 0.392 1.00 0.00 H new ATOM 0 HA TYR B 77 13.254 2.904 -0.705 1.00 0.00 H new ATOM 0 HB2 TYR B 77 15.271 5.052 -1.443 1.00 0.00 H new ATOM 0 HB3 TYR B 77 15.072 3.567 -2.352 1.00 0.00 H new ATOM 0 HD1 TYR B 77 11.841 4.308 -1.271 1.00 0.00 H new ATOM 0 HD2 TYR B 77 14.787 5.716 -4.012 1.00 0.00 H new ATOM 0 HE1 TYR B 77 10.084 5.364 -2.624 1.00 0.00 H new ATOM 0 HE2 TYR B 77 13.028 6.768 -5.362 1.00 0.00 H new ATOM 0 HH TYR B 77 10.872 7.163 -5.604 1.00 0.00 H new ATOM 2707 N LEU B 78 15.383 1.519 -0.315 1.00 0.00 N ATOM 2708 CA LEU B 78 16.464 0.672 0.178 1.00 0.00 C ATOM 2709 C LEU B 78 16.789 -0.458 -0.793 1.00 0.00 C ATOM 2710 O LEU B 78 15.893 -1.137 -1.299 1.00 0.00 O ATOM 2711 CB LEU B 78 16.100 0.093 1.546 1.00 0.00 C ATOM 2712 CG LEU B 78 17.175 -0.794 2.175 1.00 0.00 C ATOM 2713 CD1 LEU B 78 18.514 -0.071 2.198 1.00 0.00 C ATOM 2714 CD2 LEU B 78 16.765 -1.208 3.580 1.00 0.00 C ATOM 0 H LEU B 78 14.777 1.078 -1.007 1.00 0.00 H new ATOM 0 HA LEU B 78 17.352 1.297 0.271 1.00 0.00 H new ATOM 0 HB2 LEU B 78 15.884 0.916 2.227 1.00 0.00 H new ATOM 0 HB3 LEU B 78 15.183 -0.487 1.447 1.00 0.00 H new ATOM 0 HG LEU B 78 17.282 -1.694 1.569 1.00 0.00 H new ATOM 0 HD11 LEU B 78 19.268 -0.716 2.649 1.00 0.00 H new ATOM 0 HD12 LEU B 78 18.811 0.177 1.179 1.00 0.00 H new ATOM 0 HD13 LEU B 78 18.423 0.844 2.783 1.00 0.00 H new ATOM 0 HD21 LEU B 78 17.540 -1.839 4.014 1.00 0.00 H new ATOM 0 HD22 LEU B 78 16.632 -0.319 4.197 1.00 0.00 H new ATOM 0 HD23 LEU B 78 15.828 -1.763 3.537 1.00 0.00 H new ATOM 2726 N GLY B 79 18.084 -0.647 -1.045 1.00 0.00 N ATOM 2727 CA GLY B 79 18.539 -1.685 -1.950 1.00 0.00 C ATOM 2728 C GLY B 79 18.121 -1.412 -3.374 1.00 0.00 C ATOM 2729 O GLY B 79 18.957 -1.141 -4.236 1.00 0.00 O ATOM 0 H GLY B 79 18.832 -0.091 -0.631 1.00 0.00 H new ATOM 0 HA2 GLY B 79 19.625 -1.761 -1.899 1.00 0.00 H new ATOM 0 HA3 GLY B 79 18.137 -2.647 -1.631 1.00 0.00 H new ATOM 2733 N GLN B 80 16.820 -1.459 -3.609 1.00 0.00 N ATOM 2734 CA GLN B 80 16.266 -1.196 -4.925 1.00 0.00 C ATOM 2735 C GLN B 80 14.750 -1.349 -4.888 1.00 0.00 C ATOM 2736 O GLN B 80 14.140 -1.856 -5.827 1.00 0.00 O ATOM 2737 CB GLN B 80 16.872 -2.146 -5.967 1.00 0.00 C ATOM 2738 CG GLN B 80 16.475 -1.822 -7.401 1.00 0.00 C ATOM 2739 CD GLN B 80 17.160 -2.722 -8.410 1.00 0.00 C ATOM 2740 OE1 GLN B 80 18.387 -2.748 -8.504 1.00 0.00 O ATOM 2741 NE2 GLN B 80 16.370 -3.466 -9.174 1.00 0.00 N ATOM 0 H GLN B 80 16.123 -1.679 -2.898 1.00 0.00 H new ATOM 0 HA GLN B 80 16.514 -0.174 -5.211 1.00 0.00 H new ATOM 0 HB2 GLN B 80 17.958 -2.114 -5.885 1.00 0.00 H new ATOM 0 HB3 GLN B 80 16.565 -3.166 -5.737 1.00 0.00 H new ATOM 0 HG2 GLN B 80 15.395 -1.920 -7.506 1.00 0.00 H new ATOM 0 HG3 GLN B 80 16.724 -0.783 -7.618 1.00 0.00 H new ATOM 0 HE21 GLN B 80 15.357 -3.414 -9.063 1.00 0.00 H new ATOM 0 HE22 GLN B 80 16.775 -4.090 -9.872 1.00 0.00 H new ATOM 2750 N VAL B 81 14.150 -0.907 -3.786 1.00 0.00 N ATOM 2751 CA VAL B 81 12.706 -0.995 -3.609 1.00 0.00 C ATOM 2752 C VAL B 81 12.219 -0.007 -2.554 1.00 0.00 C ATOM 2753 O VAL B 81 12.847 0.159 -1.506 1.00 0.00 O ATOM 2754 CB VAL B 81 12.274 -2.416 -3.196 1.00 0.00 C ATOM 2755 CG1 VAL B 81 12.607 -3.423 -4.285 1.00 0.00 C ATOM 2756 CG2 VAL B 81 12.931 -2.812 -1.881 1.00 0.00 C ATOM 0 H VAL B 81 14.644 -0.483 -3.001 1.00 0.00 H new ATOM 0 HA VAL B 81 12.257 -0.750 -4.571 1.00 0.00 H new ATOM 0 HB VAL B 81 11.193 -2.415 -3.056 1.00 0.00 H new ATOM 0 HG11 VAL B 81 12.292 -4.418 -3.969 1.00 0.00 H new ATOM 0 HG12 VAL B 81 12.086 -3.152 -5.203 1.00 0.00 H new ATOM 0 HG13 VAL B 81 13.682 -3.423 -4.465 1.00 0.00 H new ATOM 0 HG21 VAL B 81 12.615 -3.818 -1.605 1.00 0.00 H new ATOM 0 HG22 VAL B 81 14.015 -2.791 -1.995 1.00 0.00 H new ATOM 0 HG23 VAL B 81 12.634 -2.111 -1.101 1.00 0.00 H new ATOM 2766 N ALA B 82 11.099 0.646 -2.842 1.00 0.00 N ATOM 2767 CA ALA B 82 10.519 1.617 -1.924 1.00 0.00 C ATOM 2768 C ALA B 82 9.912 0.924 -0.707 1.00 0.00 C ATOM 2769 O ALA B 82 9.253 -0.109 -0.832 1.00 0.00 O ATOM 2770 CB ALA B 82 9.466 2.448 -2.641 1.00 0.00 C ATOM 0 H ALA B 82 10.574 0.519 -3.707 1.00 0.00 H new ATOM 0 HA ALA B 82 11.313 2.276 -1.575 1.00 0.00 H new ATOM 0 HB1 ALA B 82 9.038 3.171 -1.947 1.00 0.00 H new ATOM 0 HB2 ALA B 82 9.926 2.976 -3.477 1.00 0.00 H new ATOM 0 HB3 ALA B 82 8.678 1.794 -3.014 1.00 0.00 H new ATOM 2776 N ILE B 83 10.140 1.498 0.473 1.00 0.00 N ATOM 2777 CA ILE B 83 9.617 0.931 1.712 1.00 0.00 C ATOM 2778 C ILE B 83 8.737 1.935 2.453 1.00 0.00 C ATOM 2779 O ILE B 83 9.033 3.130 2.486 1.00 0.00 O ATOM 2780 CB ILE B 83 10.758 0.475 2.645 1.00 0.00 C ATOM 2781 CG1 ILE B 83 11.655 -0.537 1.930 1.00 0.00 C ATOM 2782 CG2 ILE B 83 10.196 -0.124 3.926 1.00 0.00 C ATOM 2783 CD1 ILE B 83 12.810 -1.027 2.776 1.00 0.00 C ATOM 0 H ILE B 83 10.682 2.353 0.596 1.00 0.00 H new ATOM 0 HA ILE B 83 9.016 0.066 1.434 1.00 0.00 H new ATOM 0 HB ILE B 83 11.357 1.346 2.909 1.00 0.00 H new ATOM 0 HG12 ILE B 83 11.052 -1.392 1.624 1.00 0.00 H new ATOM 0 HG13 ILE B 83 12.049 -0.082 1.021 1.00 0.00 H new ATOM 0 HG21 ILE B 83 11.016 -0.439 4.571 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.594 0.623 4.444 1.00 0.00 H new ATOM 0 HG23 ILE B 83 9.574 -0.985 3.683 1.00 0.00 H new ATOM 0 HD11 ILE B 83 13.402 -1.741 2.204 1.00 0.00 H new ATOM 0 HD12 ILE B 83 13.436 -0.182 3.061 1.00 0.00 H new ATOM 0 HD13 ILE B 83 12.424 -1.511 3.673 1.00 0.00 H new ATOM 2795 N LEU B 84 7.656 1.438 3.047 1.00 0.00 N ATOM 2796 CA LEU B 84 6.729 2.285 3.790 1.00 0.00 C ATOM 2797 C LEU B 84 6.329 1.626 5.108 1.00 0.00 C ATOM 2798 O LEU B 84 6.105 0.416 5.162 1.00 0.00 O ATOM 2799 CB LEU B 84 5.482 2.576 2.953 1.00 0.00 C ATOM 2800 CG LEU B 84 4.381 3.359 3.674 1.00 0.00 C ATOM 2801 CD1 LEU B 84 4.902 4.708 4.148 1.00 0.00 C ATOM 2802 CD2 LEU B 84 3.173 3.537 2.766 1.00 0.00 C ATOM 0 H LEU B 84 7.400 0.451 3.028 1.00 0.00 H new ATOM 0 HA LEU B 84 7.234 3.225 4.011 1.00 0.00 H new ATOM 0 HB2 LEU B 84 5.781 3.134 2.066 1.00 0.00 H new ATOM 0 HB3 LEU B 84 5.066 1.629 2.608 1.00 0.00 H new ATOM 0 HG LEU B 84 4.071 2.789 4.550 1.00 0.00 H new ATOM 0 HD11 LEU B 84 4.104 5.248 4.657 1.00 0.00 H new ATOM 0 HD12 LEU B 84 5.734 4.556 4.836 1.00 0.00 H new ATOM 0 HD13 LEU B 84 5.242 5.288 3.290 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.400 4.095 3.294 1.00 0.00 H new ATOM 0 HD22 LEU B 84 3.468 4.084 1.871 1.00 0.00 H new ATOM 0 HD23 LEU B 84 2.784 2.559 2.482 1.00 0.00 H new ATOM 2814 N LEU B 85 6.243 2.429 6.166 1.00 0.00 N ATOM 2815 CA LEU B 85 5.873 1.921 7.483 1.00 0.00 C ATOM 2816 C LEU B 85 5.244 3.017 8.339 1.00 0.00 C ATOM 2817 O LEU B 85 5.666 4.177 8.299 1.00 0.00 O ATOM 2818 CB LEU B 85 7.095 1.344 8.200 1.00 0.00 C ATOM 2819 CG LEU B 85 6.803 0.720 9.565 1.00 0.00 C ATOM 2820 CD1 LEU B 85 5.900 -0.495 9.416 1.00 0.00 C ATOM 2821 CD2 LEU B 85 8.099 0.342 10.268 1.00 0.00 C ATOM 0 H LEU B 85 6.424 3.432 6.136 1.00 0.00 H new ATOM 0 HA LEU B 85 5.138 1.130 7.337 1.00 0.00 H new ATOM 0 HB2 LEU B 85 7.550 0.588 7.561 1.00 0.00 H new ATOM 0 HB3 LEU B 85 7.831 2.137 8.329 1.00 0.00 H new ATOM 0 HG LEU B 85 6.284 1.459 10.176 1.00 0.00 H new ATOM 0 HD11 LEU B 85 5.704 -0.925 10.398 1.00 0.00 H new ATOM 0 HD12 LEU B 85 4.958 -0.194 8.957 1.00 0.00 H new ATOM 0 HD13 LEU B 85 6.390 -1.237 8.786 1.00 0.00 H new ATOM 0 HD21 LEU B 85 7.871 -0.100 11.238 1.00 0.00 H new ATOM 0 HD22 LEU B 85 8.646 -0.378 9.660 1.00 0.00 H new ATOM 0 HD23 LEU B 85 8.709 1.234 10.411 1.00 0.00 H new ATOM 2833 N PHE B 86 4.224 2.641 9.108 1.00 0.00 N ATOM 2834 CA PHE B 86 3.526 3.586 9.976 1.00 0.00 C ATOM 2835 C PHE B 86 2.428 2.887 10.772 1.00 0.00 C ATOM 2836 O PHE B 86 1.591 2.186 10.205 1.00 0.00 O ATOM 2837 CB PHE B 86 2.925 4.725 9.147 1.00 0.00 C ATOM 2838 CG PHE B 86 1.923 4.265 8.125 1.00 0.00 C ATOM 2839 CD1 PHE B 86 2.304 3.456 7.065 1.00 0.00 C ATOM 2840 CD2 PHE B 86 0.596 4.644 8.227 1.00 0.00 C ATOM 2841 CE1 PHE B 86 1.381 3.036 6.128 1.00 0.00 C ATOM 2842 CE2 PHE B 86 -0.333 4.227 7.293 1.00 0.00 C ATOM 2843 CZ PHE B 86 0.061 3.421 6.243 1.00 0.00 C ATOM 0 H PHE B 86 3.863 1.688 9.147 1.00 0.00 H new ATOM 0 HA PHE B 86 4.251 3.999 10.677 1.00 0.00 H new ATOM 0 HB2 PHE B 86 2.445 5.437 9.818 1.00 0.00 H new ATOM 0 HB3 PHE B 86 3.730 5.257 8.640 1.00 0.00 H new ATOM 0 HD1 PHE B 86 3.336 3.151 6.971 1.00 0.00 H new ATOM 0 HD2 PHE B 86 0.283 5.273 9.047 1.00 0.00 H new ATOM 0 HE1 PHE B 86 1.692 2.407 5.307 1.00 0.00 H new ATOM 0 HE2 PHE B 86 -1.365 4.531 7.384 1.00 0.00 H new ATOM 0 HZ PHE B 86 -0.663 3.092 5.513 1.00 0.00 H new ATOM 2853 N LYS B 87 2.436 3.075 12.091 1.00 0.00 N ATOM 2854 CA LYS B 87 1.440 2.450 12.958 1.00 0.00 C ATOM 2855 C LYS B 87 0.120 3.216 12.944 1.00 0.00 C ATOM 2856 O LYS B 87 0.056 4.366 12.514 1.00 0.00 O ATOM 2857 CB LYS B 87 1.948 2.339 14.397 1.00 0.00 C ATOM 2858 CG LYS B 87 2.043 3.670 15.124 1.00 0.00 C ATOM 2859 CD LYS B 87 2.123 3.472 16.629 1.00 0.00 C ATOM 2860 CE LYS B 87 3.402 2.762 17.035 1.00 0.00 C ATOM 2861 NZ LYS B 87 3.520 2.635 18.513 1.00 0.00 N ATOM 0 H LYS B 87 3.119 3.653 12.581 1.00 0.00 H new ATOM 0 HA LYS B 87 1.266 1.449 12.563 1.00 0.00 H new ATOM 0 HB2 LYS B 87 1.285 1.678 14.955 1.00 0.00 H new ATOM 0 HB3 LYS B 87 2.932 1.870 14.389 1.00 0.00 H new ATOM 0 HG2 LYS B 87 2.923 4.213 14.779 1.00 0.00 H new ATOM 0 HG3 LYS B 87 1.175 4.282 14.881 1.00 0.00 H new ATOM 0 HD2 LYS B 87 2.071 4.440 17.127 1.00 0.00 H new ATOM 0 HD3 LYS B 87 1.263 2.893 16.966 1.00 0.00 H new ATOM 0 HE2 LYS B 87 3.427 1.771 16.582 1.00 0.00 H new ATOM 0 HE3 LYS B 87 4.261 3.311 16.648 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 4.406 2.145 18.750 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 3.522 3.582 18.944 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 2.714 2.090 18.880 1.00 0.00 H new ATOM 2875 N SER B 88 -0.927 2.558 13.433 1.00 0.00 N ATOM 2876 CA SER B 88 -2.252 3.162 13.496 1.00 0.00 C ATOM 2877 C SER B 88 -3.014 2.664 14.721 1.00 0.00 C ATOM 2878 O SER B 88 -3.031 1.469 15.013 1.00 0.00 O ATOM 2879 CB SER B 88 -3.041 2.835 12.231 1.00 0.00 C ATOM 2880 OG SER B 88 -2.393 3.351 11.080 1.00 0.00 O ATOM 0 H SER B 88 -0.882 1.604 13.792 1.00 0.00 H new ATOM 0 HA SER B 88 -2.131 4.242 13.574 1.00 0.00 H new ATOM 0 HB2 SER B 88 -3.152 1.755 12.137 1.00 0.00 H new ATOM 0 HB3 SER B 88 -4.045 3.253 12.306 1.00 0.00 H new ATOM 0 HG SER B 88 -2.844 3.020 10.275 1.00 0.00 H new ATOM 2886 N GLY B 89 -3.642 3.590 15.437 1.00 0.00 N ATOM 2887 CA GLY B 89 -4.396 3.225 16.621 1.00 0.00 C ATOM 2888 C GLY B 89 -3.536 2.554 17.673 1.00 0.00 C ATOM 2889 O GLY B 89 -2.335 2.890 17.762 1.00 0.00 O ATOM 2890 OXT GLY B 89 -4.060 1.692 18.410 1.00 0.00 O ATOM 0 H GLY B 89 -3.642 4.586 15.219 1.00 0.00 H new ATOM 0 HA2 GLY B 89 -4.853 4.118 17.046 1.00 0.00 H new ATOM 0 HA3 GLY B 89 -5.208 2.555 16.338 1.00 0.00 H new ATOM 2895 N MET C 1 -10.480 -9.477 13.649 1.00 0.00 N ATOM 2896 CA MET C 1 -9.297 -8.729 13.144 1.00 0.00 C ATOM 2897 C MET C 1 -8.287 -9.667 12.491 1.00 0.00 C ATOM 2898 O MET C 1 -8.039 -10.769 12.984 1.00 0.00 O ATOM 2899 CB MET C 1 -8.648 -7.989 14.315 1.00 0.00 C ATOM 2900 CG MET C 1 -9.578 -7.003 15.004 1.00 0.00 C ATOM 2901 SD MET C 1 -8.788 -6.156 16.387 1.00 0.00 S ATOM 2902 CE MET C 1 -10.129 -5.117 16.960 1.00 0.00 C ATOM 0 H1 MET C 1 -11.350 -9.019 13.311 1.00 0.00 H new ATOM 0 H2 MET C 1 -10.446 -10.456 13.301 1.00 0.00 H new ATOM 0 H3 MET C 1 -10.472 -9.479 14.689 1.00 0.00 H new ATOM 0 HA MET C 1 -9.624 -8.018 12.385 1.00 0.00 H new ATOM 0 HB2 MET C 1 -8.300 -8.718 15.046 1.00 0.00 H new ATOM 0 HB3 MET C 1 -7.769 -7.455 13.954 1.00 0.00 H new ATOM 0 HG2 MET C 1 -9.921 -6.265 14.279 1.00 0.00 H new ATOM 0 HG3 MET C 1 -10.461 -7.532 15.363 1.00 0.00 H new ATOM 0 HE1 MET C 1 -9.794 -4.530 17.815 1.00 0.00 H new ATOM 0 HE2 MET C 1 -10.438 -4.447 16.158 1.00 0.00 H new ATOM 0 HE3 MET C 1 -10.972 -5.741 17.256 1.00 0.00 H new ATOM 2914 N LYS C 2 -7.702 -9.225 11.381 1.00 0.00 N ATOM 2915 CA LYS C 2 -6.715 -10.026 10.668 1.00 0.00 C ATOM 2916 C LYS C 2 -5.932 -9.173 9.679 1.00 0.00 C ATOM 2917 O LYS C 2 -6.472 -8.251 9.067 1.00 0.00 O ATOM 2918 CB LYS C 2 -7.388 -11.213 9.966 1.00 0.00 C ATOM 2919 CG LYS C 2 -8.503 -10.831 9.000 1.00 0.00 C ATOM 2920 CD LYS C 2 -7.973 -10.422 7.632 1.00 0.00 C ATOM 2921 CE LYS C 2 -7.174 -11.540 6.979 1.00 0.00 C ATOM 2922 NZ LYS C 2 -7.974 -12.789 6.846 1.00 0.00 N ATOM 0 H LYS C 2 -7.895 -8.317 10.957 1.00 0.00 H new ATOM 0 HA LYS C 2 -6.006 -10.422 11.396 1.00 0.00 H new ATOM 0 HB2 LYS C 2 -6.629 -11.773 9.420 1.00 0.00 H new ATOM 0 HB3 LYS C 2 -7.795 -11.883 10.724 1.00 0.00 H new ATOM 0 HG2 LYS C 2 -9.185 -11.674 8.885 1.00 0.00 H new ATOM 0 HG3 LYS C 2 -9.081 -10.009 9.423 1.00 0.00 H new ATOM 0 HD2 LYS C 2 -8.807 -10.146 6.987 1.00 0.00 H new ATOM 0 HD3 LYS C 2 -7.344 -9.538 7.735 1.00 0.00 H new ATOM 0 HE2 LYS C 2 -6.837 -11.218 5.994 1.00 0.00 H new ATOM 0 HE3 LYS C 2 -6.281 -11.742 7.571 1.00 0.00 H new ATOM 0 HZ1 LYS C 2 -7.468 -13.462 6.236 1.00 0.00 H new ATOM 0 HZ2 LYS C 2 -8.116 -13.212 7.785 1.00 0.00 H new ATOM 0 HZ3 LYS C 2 -8.898 -12.566 6.423 1.00 0.00 H new ATOM 2936 N ASP C 3 -4.644 -9.471 9.555 1.00 0.00 N ATOM 2937 CA ASP C 3 -3.765 -8.723 8.669 1.00 0.00 C ATOM 2938 C ASP C 3 -3.778 -9.268 7.244 1.00 0.00 C ATOM 2939 O ASP C 3 -3.655 -10.473 7.022 1.00 0.00 O ATOM 2940 CB ASP C 3 -2.340 -8.731 9.222 1.00 0.00 C ATOM 2941 CG ASP C 3 -1.831 -10.134 9.490 1.00 0.00 C ATOM 2942 OD1 ASP C 3 -1.754 -10.930 8.532 1.00 0.00 O ATOM 2943 OD2 ASP C 3 -1.509 -10.436 10.658 1.00 0.00 O ATOM 0 H ASP C 3 -4.185 -10.229 10.060 1.00 0.00 H new ATOM 0 HA ASP C 3 -4.138 -7.700 8.626 1.00 0.00 H new ATOM 0 HB2 ASP C 3 -1.676 -8.236 8.514 1.00 0.00 H new ATOM 0 HB3 ASP C 3 -2.309 -8.154 10.146 1.00 0.00 H new ATOM 2948 N THR C 4 -3.910 -8.359 6.283 1.00 0.00 N ATOM 2949 CA THR C 4 -3.919 -8.718 4.873 1.00 0.00 C ATOM 2950 C THR C 4 -2.510 -9.060 4.405 1.00 0.00 C ATOM 2951 O THR C 4 -1.540 -8.442 4.840 1.00 0.00 O ATOM 2952 CB THR C 4 -4.471 -7.560 4.045 1.00 0.00 C ATOM 2953 OG1 THR C 4 -4.582 -7.930 2.683 1.00 0.00 O ATOM 2954 CG2 THR C 4 -3.612 -6.314 4.113 1.00 0.00 C ATOM 0 H THR C 4 -4.013 -7.360 6.460 1.00 0.00 H new ATOM 0 HA THR C 4 -4.556 -9.592 4.739 1.00 0.00 H new ATOM 0 HB THR C 4 -5.447 -7.334 4.475 1.00 0.00 H new ATOM 0 HG1 THR C 4 -5.512 -7.830 2.392 1.00 0.00 H new ATOM 0 HG21 THR C 4 -4.060 -5.529 3.503 1.00 0.00 H new ATOM 0 HG22 THR C 4 -3.543 -5.975 5.147 1.00 0.00 H new ATOM 0 HG23 THR C 4 -2.614 -6.539 3.738 1.00 0.00 H new ATOM 2962 N GLY C 5 -2.396 -10.040 3.516 1.00 0.00 N ATOM 2963 CA GLY C 5 -1.089 -10.423 3.015 1.00 0.00 C ATOM 2964 C GLY C 5 -1.123 -10.817 1.554 1.00 0.00 C ATOM 2965 O GLY C 5 -1.796 -11.778 1.179 1.00 0.00 O ATOM 0 H GLY C 5 -3.178 -10.573 3.136 1.00 0.00 H new ATOM 0 HA2 GLY C 5 -0.395 -9.594 3.149 1.00 0.00 H new ATOM 0 HA3 GLY C 5 -0.707 -11.257 3.604 1.00 0.00 H new ATOM 2969 N ILE C 6 -0.387 -10.075 0.730 1.00 0.00 N ATOM 2970 CA ILE C 6 -0.326 -10.344 -0.702 1.00 0.00 C ATOM 2971 C ILE C 6 0.870 -9.648 -1.343 1.00 0.00 C ATOM 2972 O ILE C 6 1.520 -8.807 -0.722 1.00 0.00 O ATOM 2973 CB ILE C 6 -1.616 -9.896 -1.428 1.00 0.00 C ATOM 2974 CG1 ILE C 6 -1.924 -8.424 -1.139 1.00 0.00 C ATOM 2975 CG2 ILE C 6 -2.793 -10.771 -1.027 1.00 0.00 C ATOM 2976 CD1 ILE C 6 -0.988 -7.457 -1.832 1.00 0.00 C ATOM 0 H ILE C 6 0.177 -9.280 1.032 1.00 0.00 H new ATOM 0 HA ILE C 6 -0.220 -11.424 -0.809 1.00 0.00 H new ATOM 0 HB ILE C 6 -1.452 -10.008 -2.500 1.00 0.00 H new ATOM 0 HG12 ILE C 6 -2.947 -8.209 -1.447 1.00 0.00 H new ATOM 0 HG13 ILE C 6 -1.874 -8.256 -0.063 1.00 0.00 H new ATOM 0 HG21 ILE C 6 -3.689 -10.437 -1.550 1.00 0.00 H new ATOM 0 HG22 ILE C 6 -2.583 -11.807 -1.292 1.00 0.00 H new ATOM 0 HG23 ILE C 6 -2.952 -10.697 0.049 1.00 0.00 H new ATOM 0 HD11 ILE C 6 -1.269 -6.435 -1.579 1.00 0.00 H new ATOM 0 HD12 ILE C 6 0.035 -7.644 -1.505 1.00 0.00 H new ATOM 0 HD13 ILE C 6 -1.055 -7.596 -2.911 1.00 0.00 H new ATOM 2988 N GLN C 7 1.152 -10.006 -2.589 1.00 0.00 N ATOM 2989 CA GLN C 7 2.267 -9.416 -3.318 1.00 0.00 C ATOM 2990 C GLN C 7 2.009 -9.448 -4.819 1.00 0.00 C ATOM 2991 O GLN C 7 1.646 -10.484 -5.376 1.00 0.00 O ATOM 2992 CB GLN C 7 3.565 -10.161 -2.999 1.00 0.00 C ATOM 2993 CG GLN C 7 3.552 -11.617 -3.435 1.00 0.00 C ATOM 2994 CD GLN C 7 4.860 -12.325 -3.145 1.00 0.00 C ATOM 2995 OE1 GLN C 7 4.793 -13.401 -2.370 1.00 0.00 O flip ATOM 2996 NE2 GLN C 7 5.920 -11.912 -3.615 1.00 0.00 N flip ATOM 0 H GLN C 7 0.624 -10.702 -3.116 1.00 0.00 H new ATOM 0 HA GLN C 7 2.365 -8.377 -3.003 1.00 0.00 H new ATOM 0 HB2 GLN C 7 4.396 -9.652 -3.487 1.00 0.00 H new ATOM 0 HB3 GLN C 7 3.747 -10.113 -1.925 1.00 0.00 H new ATOM 0 HG2 GLN C 7 2.741 -12.137 -2.926 1.00 0.00 H new ATOM 0 HG3 GLN C 7 3.344 -11.670 -4.504 1.00 0.00 H new ATOM 0 HE21 GLN C 7 5.926 -11.081 -4.206 1.00 0.00 H new ATOM 0 HE22 GLN C 7 6.792 -12.401 -3.413 1.00 0.00 H new ATOM 3005 N VAL C 8 2.199 -8.305 -5.467 1.00 0.00 N ATOM 3006 CA VAL C 8 1.988 -8.197 -6.903 1.00 0.00 C ATOM 3007 C VAL C 8 3.276 -7.798 -7.614 1.00 0.00 C ATOM 3008 O VAL C 8 4.006 -6.921 -7.151 1.00 0.00 O ATOM 3009 CB VAL C 8 0.888 -7.169 -7.234 1.00 0.00 C ATOM 3010 CG1 VAL C 8 0.641 -7.105 -8.734 1.00 0.00 C ATOM 3011 CG2 VAL C 8 -0.396 -7.506 -6.490 1.00 0.00 C ATOM 0 H VAL C 8 2.499 -7.439 -5.019 1.00 0.00 H new ATOM 0 HA VAL C 8 1.670 -9.179 -7.254 1.00 0.00 H new ATOM 0 HB VAL C 8 1.228 -6.186 -6.906 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -0.139 -6.373 -8.943 1.00 0.00 H new ATOM 0 HG12 VAL C 8 1.560 -6.812 -9.242 1.00 0.00 H new ATOM 0 HG13 VAL C 8 0.325 -8.085 -9.093 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -1.162 -6.770 -6.735 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -0.738 -8.498 -6.785 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -0.209 -7.491 -5.416 1.00 0.00 H new ATOM 3222 N ASP D 3 -3.720 11.405 6.141 1.00 0.00 N ATOM 3223 CA ASP D 3 -3.686 10.321 5.171 1.00 0.00 C ATOM 3224 C ASP D 3 -2.379 10.304 4.385 1.00 0.00 C ATOM 3225 O ASP D 3 -2.054 11.258 3.680 1.00 0.00 O ATOM 3226 CB ASP D 3 -4.871 10.439 4.208 1.00 0.00 C ATOM 3227 CG ASP D 3 -4.926 11.787 3.513 1.00 0.00 C ATOM 3228 OD1 ASP D 3 -4.075 12.649 3.815 1.00 0.00 O ATOM 3229 OD2 ASP D 3 -5.827 11.981 2.669 1.00 0.00 O ATOM 0 HA ASP D 3 -3.755 9.384 5.723 1.00 0.00 H new ATOM 0 HB2 ASP D 3 -4.805 9.650 3.458 1.00 0.00 H new ATOM 0 HB3 ASP D 3 -5.799 10.280 4.758 1.00 0.00 H new ATOM 3234 N THR D 4 -1.643 9.203 4.497 1.00 0.00 N ATOM 3235 CA THR D 4 -0.390 9.044 3.787 1.00 0.00 C ATOM 3236 C THR D 4 -0.660 8.895 2.296 1.00 0.00 C ATOM 3237 O THR D 4 -1.596 8.205 1.897 1.00 0.00 O ATOM 3238 CB THR D 4 0.345 7.810 4.311 1.00 0.00 C ATOM 3239 OG1 THR D 4 1.656 7.737 3.779 1.00 0.00 O ATOM 3240 CG2 THR D 4 -0.351 6.510 3.972 1.00 0.00 C ATOM 0 H THR D 4 -1.900 8.405 5.078 1.00 0.00 H new ATOM 0 HA THR D 4 0.232 9.925 3.949 1.00 0.00 H new ATOM 0 HB THR D 4 0.363 7.929 5.394 1.00 0.00 H new ATOM 0 HG1 THR D 4 2.302 8.009 4.464 1.00 0.00 H new ATOM 0 HG21 THR D 4 0.223 5.675 4.373 1.00 0.00 H new ATOM 0 HG22 THR D 4 -1.350 6.507 4.409 1.00 0.00 H new ATOM 0 HG23 THR D 4 -0.429 6.410 2.889 1.00 0.00 H new ATOM 3248 N GLY D 5 0.157 9.542 1.477 1.00 0.00 N ATOM 3249 CA GLY D 5 -0.025 9.456 0.041 1.00 0.00 C ATOM 3250 C GLY D 5 1.294 9.419 -0.696 1.00 0.00 C ATOM 3251 O GLY D 5 2.135 10.298 -0.515 1.00 0.00 O ATOM 0 H GLY D 5 0.939 10.123 1.779 1.00 0.00 H new ATOM 0 HA2 GLY D 5 -0.599 8.561 -0.199 1.00 0.00 H new ATOM 0 HA3 GLY D 5 -0.608 10.310 -0.302 1.00 0.00 H new ATOM 3255 N ILE D 6 1.478 8.394 -1.521 1.00 0.00 N ATOM 3256 CA ILE D 6 2.716 8.246 -2.278 1.00 0.00 C ATOM 3257 C ILE D 6 2.556 7.289 -3.451 1.00 0.00 C ATOM 3258 O ILE D 6 1.805 6.316 -3.383 1.00 0.00 O ATOM 3259 CB ILE D 6 3.866 7.743 -1.381 1.00 0.00 C ATOM 3260 CG1 ILE D 6 3.421 6.541 -0.543 1.00 0.00 C ATOM 3261 CG2 ILE D 6 4.378 8.858 -0.482 1.00 0.00 C ATOM 3262 CD1 ILE D 6 3.205 5.279 -1.350 1.00 0.00 C ATOM 0 H ILE D 6 0.791 7.658 -1.682 1.00 0.00 H new ATOM 0 HA ILE D 6 2.958 9.237 -2.661 1.00 0.00 H new ATOM 0 HB ILE D 6 4.681 7.423 -2.030 1.00 0.00 H new ATOM 0 HG12 ILE D 6 4.171 6.347 0.223 1.00 0.00 H new ATOM 0 HG13 ILE D 6 2.495 6.793 -0.026 1.00 0.00 H new ATOM 0 HG21 ILE D 6 5.188 8.480 0.141 1.00 0.00 H new ATOM 0 HG22 ILE D 6 4.746 9.680 -1.096 1.00 0.00 H new ATOM 0 HG23 ILE D 6 3.567 9.214 0.154 1.00 0.00 H new ATOM 0 HD11 ILE D 6 2.891 4.472 -0.687 1.00 0.00 H new ATOM 0 HD12 ILE D 6 2.433 5.454 -2.099 1.00 0.00 H new ATOM 0 HD13 ILE D 6 4.135 5.000 -1.846 1.00 0.00 H new ATOM 3274 N GLN D 7 3.281 7.569 -4.530 1.00 0.00 N ATOM 3275 CA GLN D 7 3.242 6.729 -5.717 1.00 0.00 C ATOM 3276 C GLN D 7 4.649 6.282 -6.092 1.00 0.00 C ATOM 3277 O GLN D 7 5.462 7.077 -6.562 1.00 0.00 O ATOM 3278 CB GLN D 7 2.591 7.473 -6.889 1.00 0.00 C ATOM 3279 CG GLN D 7 3.256 8.799 -7.227 1.00 0.00 C ATOM 3280 CD GLN D 7 2.665 9.451 -8.461 1.00 0.00 C ATOM 3281 OE1 GLN D 7 1.469 9.731 -8.518 1.00 0.00 O ATOM 3282 NE2 GLN D 7 3.506 9.694 -9.461 1.00 0.00 N ATOM 0 H GLN D 7 3.903 8.374 -4.604 1.00 0.00 H new ATOM 0 HA GLN D 7 2.640 5.848 -5.494 1.00 0.00 H new ATOM 0 HB2 GLN D 7 2.614 6.832 -7.770 1.00 0.00 H new ATOM 0 HB3 GLN D 7 1.542 7.654 -6.653 1.00 0.00 H new ATOM 0 HG2 GLN D 7 3.157 9.477 -6.380 1.00 0.00 H new ATOM 0 HG3 GLN D 7 4.323 8.637 -7.382 1.00 0.00 H new ATOM 0 HE21 GLN D 7 4.491 9.445 -9.371 1.00 0.00 H new ATOM 0 HE22 GLN D 7 3.166 10.129 -10.319 1.00 0.00 H new ATOM 3291 N VAL D 8 4.934 5.003 -5.875 1.00 0.00 N ATOM 3292 CA VAL D 8 6.247 4.460 -6.188 1.00 0.00 C ATOM 3293 C VAL D 8 6.437 4.345 -7.694 1.00 0.00 C ATOM 3294 O VAL D 8 5.571 3.825 -8.397 1.00 0.00 O ATOM 3295 CB VAL D 8 6.458 3.078 -5.544 1.00 0.00 C ATOM 3296 CG1 VAL D 8 7.892 2.612 -5.739 1.00 0.00 C ATOM 3297 CG2 VAL D 8 6.095 3.118 -4.067 1.00 0.00 C ATOM 0 H VAL D 8 4.276 4.327 -5.486 1.00 0.00 H new ATOM 0 HA VAL D 8 6.984 5.151 -5.779 1.00 0.00 H new ATOM 0 HB VAL D 8 5.800 2.362 -6.036 1.00 0.00 H new ATOM 0 HG11 VAL D 8 8.023 1.633 -5.277 1.00 0.00 H new ATOM 0 HG12 VAL D 8 8.110 2.542 -6.805 1.00 0.00 H new ATOM 0 HG13 VAL D 8 8.573 3.326 -5.275 1.00 0.00 H new ATOM 0 HG21 VAL D 8 6.250 2.133 -3.627 1.00 0.00 H new ATOM 0 HG22 VAL D 8 6.726 3.846 -3.557 1.00 0.00 H new ATOM 0 HG23 VAL D 8 5.049 3.404 -3.957 1.00 0.00 H new ATOM 3307 N ASP D 9 7.576 4.833 -8.175 1.00 0.00 N ATOM 3308 CA ASP D 9 7.897 4.793 -9.598 1.00 0.00 C ATOM 3309 C ASP D 9 9.394 4.986 -9.810 1.00 0.00 C ATOM 3310 O ASP D 9 9.816 5.798 -10.634 1.00 0.00 O ATOM 3311 CB ASP D 9 7.124 5.880 -10.355 1.00 0.00 C ATOM 3312 CG ASP D 9 5.621 5.703 -10.267 1.00 0.00 C ATOM 3313 OD1 ASP D 9 5.120 4.650 -10.715 1.00 0.00 O ATOM 3314 OD2 ASP D 9 4.944 6.617 -9.752 1.00 0.00 O ATOM 0 H ASP D 9 8.297 5.264 -7.596 1.00 0.00 H new ATOM 0 HA ASP D 9 7.605 3.817 -9.985 1.00 0.00 H new ATOM 0 HB2 ASP D 9 7.394 6.857 -9.954 1.00 0.00 H new ATOM 0 HB3 ASP D 9 7.425 5.871 -11.402 1.00 0.00 H new