USER MOD reduce.3.24.130724 H: found=0, std=0, add=1589, rem=0, adj=66 USER MOD reduce.3.24.130724 removed 1590 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 81 ASN :FLIP amide:sc= 0.323 F(o=0.079,f=0.63) USER MOD Set 1.2: B 85 GLN :FLIP amide:sc= 0.306 F(o=0.079,f=0.63) USER MOD Set 2.1: B 71 THR OG1 : rot 138:sc= 1.22 USER MOD Set 2.2: B 75 HIS : no HE2:sc= -0.191 K(o=1,f=-6.3!) USER MOD Set 3.1: B 57 SER OG : rot 43:sc= 0.198 USER MOD Set 3.2: B 59 HIS : +bothHN:sc= -0.39 K(o=1.6,f=-9.4!) USER MOD Set 3.3: B 105 TYR OH : rot -160:sc= 1.82 USER MOD Set 4.1: B 39 LYS NZ :NH3+ -160:sc= 0.403! (180deg=-2.14!) USER MOD Set 4.2: B 91 SER OG : rot -95:sc= 1.42 USER MOD Set 5.1: B 34 TYR OH : rot 110:sc= 1.07 USER MOD Set 5.2: B 61 SER OG : rot -139:sc= 0.281 USER MOD Set 5.3: B 64 HIS : +bothHN:sc= -0.741! C(o=0.61!,f=-11!) USER MOD Set 6.1: B 19 SER OG : rot 180:sc= 0 USER MOD Set 6.2: B 99 ASN : amide:sc= -1.01! C(o=-1!,f=-6!) USER MOD Set 7.1: A 226 ASN : amide:sc= 1.11 K(o=0.3,f=-1.1) USER MOD Set 7.2: A 258 THR OG1 : rot -70:sc= 0.797 USER MOD Set 7.3: A 263 HIS : no HE2:sc= -1.61! C(o=0.3!,f=-11!) USER MOD Set 8.1: A 211 GLN : amide:sc= -2.18! K(o=-1.6!,f=-3.6) USER MOD Set 8.2: A 236 HIS : no HD1:sc= 0.883 K(o=-1.6,f=-12!) USER MOD Set 8.3: A 237 MET CE :methyl 163:sc= -0.281 (180deg=0) USER MOD Set 9.1: A 206 THR OG1 : rot 180:sc= 1.02 USER MOD Set 9.2: A 209 GLN : amide:sc= 1.1 X(o=2.1,f=2.3) USER MOD Set10.1: A 203 ASN : amide:sc= 0.982 K(o=0.72,f=-1.7!) USER MOD Set10.2: A 210 ASN : amide:sc= -0.258 K(o=0.72,f=-1.7) USER MOD Single : A 214 ASN : amide:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 217 LYS NZ :NH3+ -178:sc= 0.907 (180deg=0.858) USER MOD Single : A 219 CYS SG : rot -148:sc= -2.14! USER MOD Single : A 228 GLN : amide:sc= -0.32 K(o=-0.32,f=-2!) USER MOD Single : A 231 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 232 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 233 GLN : amide:sc= -0.143 X(o=-0.14,f=-0.15) USER MOD Single : A 235 LYS NZ :NH3+ 179:sc= 1.26 (180deg=1.2) USER MOD Single : A 238 SER OG : rot 180:sc= 0 USER MOD Single : A 240 SER OG : rot 180:sc= 0.0588 USER MOD Single : A 241 SER OG : rot -170:sc= 0.0682 USER MOD Single : A 243 LYS NZ :NH3+ -154:sc= 0.817 (180deg=0.333) USER MOD Single : A 244 GLN :FLIP amide:sc=-4.9e-05 F(o=-1.1,f=-4.9e-05) USER MOD Single : A 250 SER OG : rot 59:sc= 1.25 USER MOD Single : A 251 ASN : amide:sc= 1.52 K(o=1.5,f=-3.2!) USER MOD Single : A 254 HIS : +bothHN:sc= 0.408 K(o=0.41,f=-7.1!) USER MOD Single : A 256 TYR OH : rot 30:sc= -0.106 USER MOD Single : A 257 SER OG : rot 143:sc= 1.08 USER MOD Single : A 265 LYS NZ :NH3+ 143:sc= 0.906 (180deg=0.217) USER MOD Single : A 266 SER OG : rot -118:sc= 1.06 USER MOD Single : A 267 THR OG1 : rot 140:sc= -1.03 USER MOD Single : B 1 GLY N :NH3+ 176:sc= 0.842 (180deg=0.718) USER MOD Single : B 2 SER OG : rot 62:sc= 0.138 USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 LYS NZ :NH3+ -153:sc= -0.0948 (180deg=-0.487) USER MOD Single : B 12 SER OG : rot 180:sc= 0.112 USER MOD Single : B 16 SER OG : rot 180:sc= 0.0519 USER MOD Single : B 20 HIS :FLIP no HE2:sc= -0.0319 F(o=-0.9,f=-0.032) USER MOD Single : B 24 SER OG : rot 180:sc= 0 USER MOD Single : B 25 ASN : amide:sc= 0 K(o=0,f=-2.4) USER MOD Single : B 27 THR OG1 : rot -164:sc= 0.101 USER MOD Single : B 30 CYS SG : rot -143:sc= -1.49 USER MOD Single : B 35 THR OG1 : rot 180:sc= 0 USER MOD Single : B 36 THR OG1 : rot 180:sc= 0.123 USER MOD Single : B 37 LYS NZ :NH3+ 166:sc= 1.07 (180deg=0.581) USER MOD Single : B 44 TYR OH : rot 97:sc= 1.2 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 LYS NZ :NH3+ -160:sc= -0.0632 (180deg=-0.486) USER MOD Single : B 48 MET CE :methyl -172:sc= 0 (180deg=-0.109) USER MOD Single : B 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 TYR OH : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD Single : B 54 THR OG1 : rot 180:sc= -0.0293 USER MOD Single : B 60 ASN : amide:sc= -1.22 K(o=-1.2,f=-4.6!) USER MOD Single : B 62 TYR OH : rot -133:sc= 1.22 USER MOD Single : B 63 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : B 65 ASN : amide:sc= -1.31 X(o=-1.3,f=-1.1) USER MOD Single : B 73 HIS : no HD1:sc= -0.106 X(o=-0.11,f=-0.011) USER MOD Single : B 78 SER OG : rot -29:sc= 0.229 USER MOD Single : B 82 ASN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : B 83 TYR OH : rot -15:sc= -1.02 USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 88 CYS SG : rot -3:sc= 0.111 USER MOD Single : B 89 THR OG1 : rot 180:sc= 0.0714 USER MOD Single : B 95 CYS SG : rot 160:sc= -1.16 USER MOD Single : B 96 LYS NZ :NH3+ -169:sc= 1.31 (180deg=1.02) USER MOD Single : B 100 LYS NZ :NH3+ -160:sc= -0.0431 (180deg=-0.326) USER MOD Single : B 102 TYR OH : rot 180:sc= 0 USER MOD Single : B 104 MET CE :methyl -115:sc= -1.15 (180deg=-4.13!) USER MOD Single : B 106 SER OG : rot 73:sc= 1.24 USER MOD Single : B 109 THR OG1 : rot -77:sc= 1.26 USER MOD Single : B 114 SER OG : rot 180:sc= 0 USER MOD Single : B 119 SER OG : rot 161:sc= -0.319 USER MOD Single : B 125 LYS NZ :NH3+ 178:sc= 1.24 (180deg=1.2) USER MOD Single : B 127 HIS : no HE2:sc= -2.02 K(o=-2,f=-3.8!) USER MOD Single : B 130 ASN : amide:sc= 0.875 K(o=0.87,f=-3!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 202 12.444 -15.970 -13.020 1.00 0.00 N ATOM 2 CA ALA A 202 12.952 -16.192 -11.647 1.00 0.00 C ATOM 3 C ALA A 202 13.324 -14.868 -10.992 1.00 0.00 C ATOM 4 O ALA A 202 12.888 -14.571 -9.880 1.00 0.00 O ATOM 5 CB ALA A 202 14.148 -17.129 -11.669 1.00 0.00 C ATOM 0 HA ALA A 202 12.160 -16.655 -11.058 1.00 0.00 H new ATOM 0 HB1 ALA A 202 14.509 -17.282 -10.652 1.00 0.00 H new ATOM 0 HB2 ALA A 202 13.852 -18.087 -12.097 1.00 0.00 H new ATOM 0 HB3 ALA A 202 14.942 -16.691 -12.274 1.00 0.00 H new ATOM 11 N ASN A 203 14.122 -14.071 -11.689 1.00 0.00 N ATOM 12 CA ASN A 203 14.549 -12.777 -11.178 1.00 0.00 C ATOM 13 C ASN A 203 14.180 -11.673 -12.161 1.00 0.00 C ATOM 14 O ASN A 203 14.831 -11.499 -13.192 1.00 0.00 O ATOM 15 CB ASN A 203 16.058 -12.768 -10.920 1.00 0.00 C ATOM 16 CG ASN A 203 16.557 -11.426 -10.412 1.00 0.00 C ATOM 17 OD1 ASN A 203 15.848 -10.704 -9.706 1.00 0.00 O ATOM 18 ND2 ASN A 203 17.782 -11.082 -10.771 1.00 0.00 N ATOM 0 H ASN A 203 14.488 -14.300 -12.613 1.00 0.00 H new ATOM 0 HA ASN A 203 14.036 -12.596 -10.234 1.00 0.00 H new ATOM 0 HB2 ASN A 203 16.303 -13.541 -10.192 1.00 0.00 H new ATOM 0 HB3 ASN A 203 16.582 -13.021 -11.842 1.00 0.00 H new ATOM 0 HD21 ASN A 203 18.173 -10.191 -10.463 1.00 0.00 H new ATOM 0 HD22 ASN A 203 18.337 -11.707 -11.356 1.00 0.00 H new ATOM 25 N GLY A 204 13.118 -10.946 -11.850 1.00 0.00 N ATOM 26 CA GLY A 204 12.679 -9.865 -12.708 1.00 0.00 C ATOM 27 C GLY A 204 13.444 -8.585 -12.449 1.00 0.00 C ATOM 28 O GLY A 204 13.356 -7.632 -13.225 1.00 0.00 O ATOM 0 H GLY A 204 12.550 -11.086 -11.015 1.00 0.00 H new ATOM 0 HA2 GLY A 204 12.804 -10.157 -13.751 1.00 0.00 H new ATOM 0 HA3 GLY A 204 11.615 -9.688 -12.552 1.00 0.00 H new ATOM 32 N LEU A 205 14.197 -8.563 -11.360 1.00 0.00 N ATOM 33 CA LEU A 205 14.980 -7.393 -10.992 1.00 0.00 C ATOM 34 C LEU A 205 16.313 -7.395 -11.727 1.00 0.00 C ATOM 35 O LEU A 205 16.740 -8.421 -12.258 1.00 0.00 O ATOM 36 CB LEU A 205 15.221 -7.368 -9.480 1.00 0.00 C ATOM 37 CG LEU A 205 13.962 -7.237 -8.620 1.00 0.00 C ATOM 38 CD1 LEU A 205 14.276 -7.553 -7.166 1.00 0.00 C ATOM 39 CD2 LEU A 205 13.375 -5.841 -8.747 1.00 0.00 C ATOM 0 H LEU A 205 14.283 -9.346 -10.712 1.00 0.00 H new ATOM 0 HA LEU A 205 14.421 -6.502 -11.276 1.00 0.00 H new ATOM 0 HB2 LEU A 205 15.741 -8.283 -9.196 1.00 0.00 H new ATOM 0 HB3 LEU A 205 15.887 -6.537 -9.248 1.00 0.00 H new ATOM 0 HG LEU A 205 13.224 -7.955 -8.977 1.00 0.00 H new ATOM 0 HD11 LEU A 205 13.370 -7.455 -6.568 1.00 0.00 H new ATOM 0 HD12 LEU A 205 14.653 -8.573 -7.089 1.00 0.00 H new ATOM 0 HD13 LEU A 205 15.030 -6.858 -6.797 1.00 0.00 H new ATOM 0 HD21 LEU A 205 12.480 -5.765 -8.129 1.00 0.00 H new ATOM 0 HD22 LEU A 205 14.109 -5.106 -8.415 1.00 0.00 H new ATOM 0 HD23 LEU A 205 13.114 -5.649 -9.788 1.00 0.00 H new ATOM 51 N THR A 206 16.964 -6.249 -11.764 1.00 0.00 N ATOM 52 CA THR A 206 18.249 -6.138 -12.424 1.00 0.00 C ATOM 53 C THR A 206 19.364 -6.358 -11.415 1.00 0.00 C ATOM 54 O THR A 206 19.138 -6.238 -10.210 1.00 0.00 O ATOM 55 CB THR A 206 18.415 -4.763 -13.095 1.00 0.00 C ATOM 56 OG1 THR A 206 18.095 -3.717 -12.166 1.00 0.00 O ATOM 57 CG2 THR A 206 17.519 -4.656 -14.317 1.00 0.00 C ATOM 0 H THR A 206 16.625 -5.383 -11.345 1.00 0.00 H new ATOM 0 HA THR A 206 18.301 -6.901 -13.200 1.00 0.00 H new ATOM 0 HB THR A 206 19.453 -4.657 -13.410 1.00 0.00 H new ATOM 0 HG1 THR A 206 18.205 -2.847 -12.603 1.00 0.00 H new ATOM 0 HG21 THR A 206 17.649 -3.677 -14.779 1.00 0.00 H new ATOM 0 HG22 THR A 206 17.786 -5.434 -15.033 1.00 0.00 H new ATOM 0 HG23 THR A 206 16.478 -4.780 -14.017 1.00 0.00 H new ATOM 65 N VAL A 207 20.555 -6.684 -11.900 1.00 0.00 N ATOM 66 CA VAL A 207 21.702 -6.918 -11.028 1.00 0.00 C ATOM 67 C VAL A 207 21.933 -5.724 -10.108 1.00 0.00 C ATOM 68 O VAL A 207 22.197 -5.890 -8.919 1.00 0.00 O ATOM 69 CB VAL A 207 22.981 -7.195 -11.840 1.00 0.00 C ATOM 70 CG1 VAL A 207 24.155 -7.479 -10.915 1.00 0.00 C ATOM 71 CG2 VAL A 207 22.758 -8.355 -12.797 1.00 0.00 C ATOM 0 H VAL A 207 20.754 -6.793 -12.895 1.00 0.00 H new ATOM 0 HA VAL A 207 21.476 -7.799 -10.427 1.00 0.00 H new ATOM 0 HB VAL A 207 23.218 -6.306 -12.424 1.00 0.00 H new ATOM 0 HG11 VAL A 207 25.048 -7.672 -11.509 1.00 0.00 H new ATOM 0 HG12 VAL A 207 24.327 -6.617 -10.271 1.00 0.00 H new ATOM 0 HG13 VAL A 207 23.932 -8.352 -10.301 1.00 0.00 H new ATOM 0 HG21 VAL A 207 23.670 -8.539 -13.364 1.00 0.00 H new ATOM 0 HG22 VAL A 207 22.496 -9.249 -12.231 1.00 0.00 H new ATOM 0 HG23 VAL A 207 21.947 -8.110 -13.483 1.00 0.00 H new ATOM 81 N ALA A 208 21.812 -4.525 -10.666 1.00 0.00 N ATOM 82 CA ALA A 208 21.988 -3.301 -9.897 1.00 0.00 C ATOM 83 C ALA A 208 20.988 -3.240 -8.743 1.00 0.00 C ATOM 84 O ALA A 208 21.345 -2.905 -7.614 1.00 0.00 O ATOM 85 CB ALA A 208 21.834 -2.087 -10.801 1.00 0.00 C ATOM 0 H ALA A 208 21.592 -4.375 -11.651 1.00 0.00 H new ATOM 0 HA ALA A 208 22.993 -3.298 -9.476 1.00 0.00 H new ATOM 0 HB1 ALA A 208 21.968 -1.178 -10.215 1.00 0.00 H new ATOM 0 HB2 ALA A 208 22.585 -2.124 -11.590 1.00 0.00 H new ATOM 0 HB3 ALA A 208 20.839 -2.089 -11.246 1.00 0.00 H new ATOM 91 N GLN A 209 19.734 -3.583 -9.038 1.00 0.00 N ATOM 92 CA GLN A 209 18.675 -3.582 -8.031 1.00 0.00 C ATOM 93 C GLN A 209 18.908 -4.691 -7.015 1.00 0.00 C ATOM 94 O GLN A 209 18.636 -4.524 -5.826 1.00 0.00 O ATOM 95 CB GLN A 209 17.305 -3.759 -8.689 1.00 0.00 C ATOM 96 CG GLN A 209 16.817 -2.522 -9.421 1.00 0.00 C ATOM 97 CD GLN A 209 15.473 -2.738 -10.083 1.00 0.00 C ATOM 98 OE1 GLN A 209 14.427 -2.512 -9.480 1.00 0.00 O ATOM 99 NE2 GLN A 209 15.493 -3.173 -11.334 1.00 0.00 N ATOM 0 H GLN A 209 19.427 -3.866 -9.969 1.00 0.00 H new ATOM 0 HA GLN A 209 18.695 -2.621 -7.517 1.00 0.00 H new ATOM 0 HB2 GLN A 209 17.354 -4.591 -9.392 1.00 0.00 H new ATOM 0 HB3 GLN A 209 16.577 -4.029 -7.925 1.00 0.00 H new ATOM 0 HG2 GLN A 209 16.744 -1.692 -8.718 1.00 0.00 H new ATOM 0 HG3 GLN A 209 17.550 -2.237 -10.176 1.00 0.00 H new ATOM 0 HE21 GLN A 209 16.384 -3.348 -11.799 1.00 0.00 H new ATOM 0 HE22 GLN A 209 14.618 -3.332 -11.833 1.00 0.00 H new ATOM 108 N ASN A 210 19.412 -5.823 -7.496 1.00 0.00 N ATOM 109 CA ASN A 210 19.703 -6.965 -6.636 1.00 0.00 C ATOM 110 C ASN A 210 20.737 -6.576 -5.592 1.00 0.00 C ATOM 111 O ASN A 210 20.633 -6.968 -4.431 1.00 0.00 O ATOM 112 CB ASN A 210 20.216 -8.152 -7.457 1.00 0.00 C ATOM 113 CG ASN A 210 19.122 -8.856 -8.240 1.00 0.00 C ATOM 114 OD1 ASN A 210 19.340 -9.291 -9.369 1.00 0.00 O ATOM 115 ND2 ASN A 210 17.944 -8.987 -7.647 1.00 0.00 N ATOM 0 H ASN A 210 19.628 -5.974 -8.481 1.00 0.00 H new ATOM 0 HA ASN A 210 18.780 -7.264 -6.140 1.00 0.00 H new ATOM 0 HB2 ASN A 210 20.982 -7.802 -8.149 1.00 0.00 H new ATOM 0 HB3 ASN A 210 20.694 -8.868 -6.789 1.00 0.00 H new ATOM 0 HD21 ASN A 210 17.181 -9.462 -8.129 1.00 0.00 H new ATOM 0 HD22 ASN A 210 17.801 -8.613 -6.709 1.00 0.00 H new ATOM 122 N GLN A 211 21.731 -5.798 -6.017 1.00 0.00 N ATOM 123 CA GLN A 211 22.783 -5.331 -5.118 1.00 0.00 C ATOM 124 C GLN A 211 22.174 -4.516 -3.986 1.00 0.00 C ATOM 125 O GLN A 211 22.449 -4.758 -2.812 1.00 0.00 O ATOM 126 CB GLN A 211 23.798 -4.470 -5.876 1.00 0.00 C ATOM 127 CG GLN A 211 24.546 -5.212 -6.973 1.00 0.00 C ATOM 128 CD GLN A 211 25.261 -4.274 -7.932 1.00 0.00 C ATOM 129 OE1 GLN A 211 25.669 -3.172 -7.559 1.00 0.00 O ATOM 130 NE2 GLN A 211 25.419 -4.705 -9.174 1.00 0.00 N ATOM 0 H GLN A 211 21.829 -5.478 -6.980 1.00 0.00 H new ATOM 0 HA GLN A 211 23.295 -6.201 -4.708 1.00 0.00 H new ATOM 0 HB2 GLN A 211 23.279 -3.619 -6.317 1.00 0.00 H new ATOM 0 HB3 GLN A 211 24.521 -4.069 -5.165 1.00 0.00 H new ATOM 0 HG2 GLN A 211 25.273 -5.886 -6.520 1.00 0.00 H new ATOM 0 HG3 GLN A 211 23.844 -5.831 -7.532 1.00 0.00 H new ATOM 0 HE21 GLN A 211 25.067 -5.624 -9.444 1.00 0.00 H new ATOM 0 HE22 GLN A 211 25.893 -4.118 -9.861 1.00 0.00 H new ATOM 139 N VAL A 212 21.332 -3.559 -4.360 1.00 0.00 N ATOM 140 CA VAL A 212 20.665 -2.692 -3.397 1.00 0.00 C ATOM 141 C VAL A 212 19.795 -3.507 -2.443 1.00 0.00 C ATOM 142 O VAL A 212 19.898 -3.371 -1.224 1.00 0.00 O ATOM 143 CB VAL A 212 19.787 -1.636 -4.109 1.00 0.00 C ATOM 144 CG1 VAL A 212 19.111 -0.715 -3.103 1.00 0.00 C ATOM 145 CG2 VAL A 212 20.613 -0.829 -5.099 1.00 0.00 C ATOM 0 H VAL A 212 21.094 -3.363 -5.332 1.00 0.00 H new ATOM 0 HA VAL A 212 21.443 -2.182 -2.829 1.00 0.00 H new ATOM 0 HB VAL A 212 19.008 -2.165 -4.658 1.00 0.00 H new ATOM 0 HG11 VAL A 212 18.501 0.017 -3.632 1.00 0.00 H new ATOM 0 HG12 VAL A 212 18.478 -1.304 -2.439 1.00 0.00 H new ATOM 0 HG13 VAL A 212 19.870 -0.198 -2.516 1.00 0.00 H new ATOM 0 HG21 VAL A 212 19.976 -0.092 -5.589 1.00 0.00 H new ATOM 0 HG22 VAL A 212 21.418 -0.319 -4.570 1.00 0.00 H new ATOM 0 HG23 VAL A 212 21.037 -1.497 -5.848 1.00 0.00 H new ATOM 155 N LEU A 213 18.961 -4.371 -3.011 1.00 0.00 N ATOM 156 CA LEU A 213 18.060 -5.210 -2.227 1.00 0.00 C ATOM 157 C LEU A 213 18.831 -6.103 -1.257 1.00 0.00 C ATOM 158 O LEU A 213 18.461 -6.230 -0.086 1.00 0.00 O ATOM 159 CB LEU A 213 17.198 -6.069 -3.157 1.00 0.00 C ATOM 160 CG LEU A 213 16.059 -6.822 -2.472 1.00 0.00 C ATOM 161 CD1 LEU A 213 15.101 -5.845 -1.808 1.00 0.00 C ATOM 162 CD2 LEU A 213 15.322 -7.697 -3.472 1.00 0.00 C ATOM 0 H LEU A 213 18.890 -4.510 -4.019 1.00 0.00 H new ATOM 0 HA LEU A 213 17.417 -4.554 -1.641 1.00 0.00 H new ATOM 0 HB2 LEU A 213 16.776 -5.428 -3.931 1.00 0.00 H new ATOM 0 HB3 LEU A 213 17.841 -6.792 -3.658 1.00 0.00 H new ATOM 0 HG LEU A 213 16.484 -7.465 -1.701 1.00 0.00 H new ATOM 0 HD11 LEU A 213 14.295 -6.397 -1.325 1.00 0.00 H new ATOM 0 HD12 LEU A 213 15.638 -5.259 -1.062 1.00 0.00 H new ATOM 0 HD13 LEU A 213 14.682 -5.177 -2.561 1.00 0.00 H new ATOM 0 HD21 LEU A 213 14.514 -8.226 -2.967 1.00 0.00 H new ATOM 0 HD22 LEU A 213 14.908 -7.074 -4.265 1.00 0.00 H new ATOM 0 HD23 LEU A 213 16.015 -8.420 -3.903 1.00 0.00 H new ATOM 174 N ASN A 214 19.906 -6.709 -1.741 1.00 0.00 N ATOM 175 CA ASN A 214 20.715 -7.592 -0.912 1.00 0.00 C ATOM 176 C ASN A 214 21.405 -6.811 0.197 1.00 0.00 C ATOM 177 O ASN A 214 21.453 -7.260 1.338 1.00 0.00 O ATOM 178 CB ASN A 214 21.758 -8.330 -1.753 1.00 0.00 C ATOM 179 CG ASN A 214 22.544 -9.341 -0.937 1.00 0.00 C ATOM 180 OD1 ASN A 214 23.567 -9.015 -0.335 1.00 0.00 O ATOM 181 ND2 ASN A 214 22.074 -10.580 -0.917 1.00 0.00 N ATOM 0 H ASN A 214 20.238 -6.606 -2.700 1.00 0.00 H new ATOM 0 HA ASN A 214 20.047 -8.326 -0.462 1.00 0.00 H new ATOM 0 HB2 ASN A 214 21.261 -8.840 -2.579 1.00 0.00 H new ATOM 0 HB3 ASN A 214 22.446 -7.607 -2.192 1.00 0.00 H new ATOM 0 HD21 ASN A 214 22.564 -11.303 -0.390 1.00 0.00 H new ATOM 0 HD22 ASN A 214 21.223 -10.811 -1.429 1.00 0.00 H new ATOM 188 N LEU A 215 21.913 -5.632 -0.137 1.00 0.00 N ATOM 189 CA LEU A 215 22.603 -4.786 0.833 1.00 0.00 C ATOM 190 C LEU A 215 21.703 -4.452 2.021 1.00 0.00 C ATOM 191 O LEU A 215 22.151 -4.448 3.165 1.00 0.00 O ATOM 192 CB LEU A 215 23.081 -3.490 0.168 1.00 0.00 C ATOM 193 CG LEU A 215 24.598 -3.292 0.127 1.00 0.00 C ATOM 194 CD1 LEU A 215 25.186 -3.326 1.530 1.00 0.00 C ATOM 195 CD2 LEU A 215 25.250 -4.347 -0.752 1.00 0.00 C ATOM 0 H LEU A 215 21.861 -5.237 -1.076 1.00 0.00 H new ATOM 0 HA LEU A 215 23.465 -5.343 1.201 1.00 0.00 H new ATOM 0 HB2 LEU A 215 22.701 -3.464 -0.853 1.00 0.00 H new ATOM 0 HB3 LEU A 215 22.636 -2.646 0.695 1.00 0.00 H new ATOM 0 HG LEU A 215 24.802 -2.311 -0.303 1.00 0.00 H new ATOM 0 HD11 LEU A 215 26.265 -3.183 1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 215 24.744 -2.530 2.129 1.00 0.00 H new ATOM 0 HD13 LEU A 215 24.970 -4.290 1.992 1.00 0.00 H new ATOM 0 HD21 LEU A 215 26.329 -4.190 -0.769 1.00 0.00 H new ATOM 0 HD22 LEU A 215 25.034 -5.338 -0.353 1.00 0.00 H new ATOM 0 HD23 LEU A 215 24.856 -4.270 -1.765 1.00 0.00 H new ATOM 207 N ILE A 216 20.430 -4.199 1.747 1.00 0.00 N ATOM 208 CA ILE A 216 19.480 -3.847 2.795 1.00 0.00 C ATOM 209 C ILE A 216 19.150 -5.046 3.692 1.00 0.00 C ATOM 210 O ILE A 216 18.831 -4.878 4.869 1.00 0.00 O ATOM 211 CB ILE A 216 18.178 -3.266 2.196 1.00 0.00 C ATOM 212 CG1 ILE A 216 18.504 -2.118 1.237 1.00 0.00 C ATOM 213 CG2 ILE A 216 17.248 -2.775 3.298 1.00 0.00 C ATOM 214 CD1 ILE A 216 17.324 -1.656 0.410 1.00 0.00 C ATOM 0 H ILE A 216 20.031 -4.231 0.809 1.00 0.00 H new ATOM 0 HA ILE A 216 19.958 -3.084 3.409 1.00 0.00 H new ATOM 0 HB ILE A 216 17.672 -4.059 1.645 1.00 0.00 H new ATOM 0 HG12 ILE A 216 18.885 -1.274 1.812 1.00 0.00 H new ATOM 0 HG13 ILE A 216 19.304 -2.433 0.567 1.00 0.00 H new ATOM 0 HG21 ILE A 216 16.339 -2.371 2.853 1.00 0.00 H new ATOM 0 HG22 ILE A 216 16.992 -3.606 3.955 1.00 0.00 H new ATOM 0 HG23 ILE A 216 17.747 -1.997 3.875 1.00 0.00 H new ATOM 0 HD11 ILE A 216 17.635 -0.841 -0.244 1.00 0.00 H new ATOM 0 HD12 ILE A 216 16.956 -2.485 -0.194 1.00 0.00 H new ATOM 0 HD13 ILE A 216 16.530 -1.308 1.071 1.00 0.00 H new ATOM 226 N LYS A 217 19.236 -6.259 3.152 1.00 0.00 N ATOM 227 CA LYS A 217 18.926 -7.449 3.945 1.00 0.00 C ATOM 228 C LYS A 217 20.185 -8.050 4.569 1.00 0.00 C ATOM 229 O LYS A 217 20.115 -8.712 5.604 1.00 0.00 O ATOM 230 CB LYS A 217 18.177 -8.498 3.108 1.00 0.00 C ATOM 231 CG LYS A 217 19.008 -9.154 2.012 1.00 0.00 C ATOM 232 CD LYS A 217 19.312 -10.613 2.330 1.00 0.00 C ATOM 233 CE LYS A 217 18.045 -11.403 2.631 1.00 0.00 C ATOM 234 NZ LYS A 217 18.263 -12.870 2.535 1.00 0.00 N ATOM 0 H LYS A 217 19.512 -6.444 2.188 1.00 0.00 H new ATOM 0 HA LYS A 217 18.270 -7.135 4.757 1.00 0.00 H new ATOM 0 HB2 LYS A 217 17.803 -9.275 3.775 1.00 0.00 H new ATOM 0 HB3 LYS A 217 17.308 -8.025 2.651 1.00 0.00 H new ATOM 0 HG2 LYS A 217 18.473 -9.092 1.064 1.00 0.00 H new ATOM 0 HG3 LYS A 217 19.942 -8.607 1.887 1.00 0.00 H new ATOM 0 HD2 LYS A 217 19.832 -11.068 1.487 1.00 0.00 H new ATOM 0 HD3 LYS A 217 19.985 -10.666 3.186 1.00 0.00 H new ATOM 0 HE2 LYS A 217 17.693 -11.154 3.632 1.00 0.00 H new ATOM 0 HE3 LYS A 217 17.260 -11.107 1.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 217 17.367 -13.367 2.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 217 18.607 -13.108 1.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 217 18.968 -13.163 3.241 1.00 0.00 H new ATOM 248 N ALA A 218 21.332 -7.813 3.948 1.00 0.00 N ATOM 249 CA ALA A 218 22.596 -8.331 4.453 1.00 0.00 C ATOM 250 C ALA A 218 23.238 -7.344 5.417 1.00 0.00 C ATOM 251 O ALA A 218 24.331 -7.583 5.932 1.00 0.00 O ATOM 252 CB ALA A 218 23.543 -8.645 3.304 1.00 0.00 C ATOM 0 H ALA A 218 21.413 -7.264 3.092 1.00 0.00 H new ATOM 0 HA ALA A 218 22.392 -9.254 4.995 1.00 0.00 H new ATOM 0 HB1 ALA A 218 24.482 -9.031 3.701 1.00 0.00 H new ATOM 0 HB2 ALA A 218 23.090 -9.393 2.653 1.00 0.00 H new ATOM 0 HB3 ALA A 218 23.737 -7.737 2.733 1.00 0.00 H new ATOM 258 N CYS A 219 22.560 -6.232 5.648 1.00 0.00 N ATOM 259 CA CYS A 219 23.057 -5.210 6.553 1.00 0.00 C ATOM 260 C CYS A 219 22.831 -5.625 8.006 1.00 0.00 C ATOM 261 O CYS A 219 21.694 -5.839 8.430 1.00 0.00 O ATOM 262 CB CYS A 219 22.362 -3.875 6.278 1.00 0.00 C ATOM 263 SG CYS A 219 23.041 -2.473 7.197 1.00 0.00 S ATOM 0 H CYS A 219 21.661 -6.014 5.219 1.00 0.00 H new ATOM 0 HA CYS A 219 24.128 -5.094 6.385 1.00 0.00 H new ATOM 0 HB2 CYS A 219 22.426 -3.659 5.211 1.00 0.00 H new ATOM 0 HB3 CYS A 219 21.304 -3.974 6.520 1.00 0.00 H new ATOM 0 HG CYS A 219 22.093 -1.620 7.450 1.00 0.00 H new ATOM 269 N PRO A 220 23.913 -5.740 8.791 1.00 0.00 N ATOM 270 CA PRO A 220 23.835 -6.130 10.199 1.00 0.00 C ATOM 271 C PRO A 220 23.482 -4.957 11.115 1.00 0.00 C ATOM 272 O PRO A 220 23.965 -4.868 12.243 1.00 0.00 O ATOM 273 CB PRO A 220 25.248 -6.629 10.486 1.00 0.00 C ATOM 274 CG PRO A 220 26.124 -5.821 9.590 1.00 0.00 C ATOM 275 CD PRO A 220 25.307 -5.504 8.362 1.00 0.00 C ATOM 0 HA PRO A 220 23.053 -6.867 10.382 1.00 0.00 H new ATOM 0 HB2 PRO A 220 25.513 -6.486 11.533 1.00 0.00 H new ATOM 0 HB3 PRO A 220 25.342 -7.694 10.276 1.00 0.00 H new ATOM 0 HG2 PRO A 220 26.448 -4.906 10.087 1.00 0.00 H new ATOM 0 HG3 PRO A 220 27.024 -6.376 9.324 1.00 0.00 H new ATOM 0 HD2 PRO A 220 25.456 -4.474 8.038 1.00 0.00 H new ATOM 0 HD3 PRO A 220 25.581 -6.145 7.524 1.00 0.00 H new ATOM 283 N ARG A 221 22.637 -4.064 10.625 1.00 0.00 N ATOM 284 CA ARG A 221 22.219 -2.898 11.390 1.00 0.00 C ATOM 285 C ARG A 221 20.744 -3.013 11.753 1.00 0.00 C ATOM 286 O ARG A 221 19.912 -3.315 10.899 1.00 0.00 O ATOM 287 CB ARG A 221 22.459 -1.613 10.595 1.00 0.00 C ATOM 288 CG ARG A 221 23.926 -1.332 10.309 1.00 0.00 C ATOM 289 CD ARG A 221 24.397 -0.054 10.987 1.00 0.00 C ATOM 290 NE ARG A 221 23.464 1.056 10.790 1.00 0.00 N ATOM 291 CZ ARG A 221 23.578 1.976 9.830 1.00 0.00 C ATOM 292 NH1 ARG A 221 24.586 1.931 8.971 1.00 0.00 N ATOM 293 NH2 ARG A 221 22.683 2.951 9.742 1.00 0.00 N ATOM 0 H ARG A 221 22.224 -4.125 9.694 1.00 0.00 H new ATOM 0 HA ARG A 221 22.812 -2.857 12.303 1.00 0.00 H new ATOM 0 HB2 ARG A 221 21.920 -1.676 9.650 1.00 0.00 H new ATOM 0 HB3 ARG A 221 22.039 -0.772 11.146 1.00 0.00 H new ATOM 0 HG2 ARG A 221 24.531 -2.171 10.653 1.00 0.00 H new ATOM 0 HG3 ARG A 221 24.078 -1.250 9.233 1.00 0.00 H new ATOM 0 HD2 ARG A 221 24.521 -0.236 12.054 1.00 0.00 H new ATOM 0 HD3 ARG A 221 25.376 0.223 10.595 1.00 0.00 H new ATOM 0 HE ARG A 221 22.673 1.132 11.430 1.00 0.00 H new ATOM 0 HH11 ARG A 221 25.282 1.189 9.040 1.00 0.00 H new ATOM 0 HH12 ARG A 221 24.665 2.638 8.240 1.00 0.00 H new ATOM 0 HH21 ARG A 221 21.911 2.996 10.407 1.00 0.00 H new ATOM 0 HH22 ARG A 221 22.767 3.656 9.010 1.00 0.00 H new ATOM 307 N PRO A 222 20.405 -2.782 13.029 1.00 0.00 N ATOM 308 CA PRO A 222 19.020 -2.858 13.517 1.00 0.00 C ATOM 309 C PRO A 222 18.085 -1.883 12.800 1.00 0.00 C ATOM 310 O PRO A 222 16.883 -2.129 12.688 1.00 0.00 O ATOM 311 CB PRO A 222 19.140 -2.484 15.000 1.00 0.00 C ATOM 312 CG PRO A 222 20.563 -2.752 15.350 1.00 0.00 C ATOM 313 CD PRO A 222 21.349 -2.447 14.109 1.00 0.00 C ATOM 0 HA PRO A 222 18.588 -3.843 13.342 1.00 0.00 H new ATOM 0 HB2 PRO A 222 18.883 -1.438 15.165 1.00 0.00 H new ATOM 0 HB3 PRO A 222 18.464 -3.079 15.613 1.00 0.00 H new ATOM 0 HG2 PRO A 222 20.886 -2.127 16.182 1.00 0.00 H new ATOM 0 HG3 PRO A 222 20.702 -3.788 15.657 1.00 0.00 H new ATOM 0 HD2 PRO A 222 21.652 -1.401 14.070 1.00 0.00 H new ATOM 0 HD3 PRO A 222 22.259 -3.045 14.050 1.00 0.00 H new ATOM 321 N GLU A 223 18.640 -0.785 12.305 1.00 0.00 N ATOM 322 CA GLU A 223 17.842 0.219 11.611 1.00 0.00 C ATOM 323 C GLU A 223 17.723 -0.110 10.128 1.00 0.00 C ATOM 324 O GLU A 223 17.161 0.668 9.356 1.00 0.00 O ATOM 325 CB GLU A 223 18.453 1.612 11.776 1.00 0.00 C ATOM 326 CG GLU A 223 19.372 1.751 12.975 1.00 0.00 C ATOM 327 CD GLU A 223 20.825 1.671 12.578 1.00 0.00 C ATOM 328 OE1 GLU A 223 21.372 2.689 12.111 1.00 0.00 O ATOM 329 OE2 GLU A 223 21.421 0.583 12.712 1.00 0.00 O ATOM 0 H GLU A 223 19.634 -0.567 12.370 1.00 0.00 H new ATOM 0 HA GLU A 223 16.847 0.212 12.057 1.00 0.00 H new ATOM 0 HB2 GLU A 223 19.012 1.860 10.874 1.00 0.00 H new ATOM 0 HB3 GLU A 223 17.648 2.341 11.863 1.00 0.00 H new ATOM 0 HG2 GLU A 223 19.182 2.703 13.470 1.00 0.00 H new ATOM 0 HG3 GLU A 223 19.149 0.966 13.697 1.00 0.00 H new ATOM 336 N GLY A 224 18.240 -1.265 9.736 1.00 0.00 N ATOM 337 CA GLY A 224 18.188 -1.663 8.348 1.00 0.00 C ATOM 338 C GLY A 224 19.266 -0.979 7.542 1.00 0.00 C ATOM 339 O GLY A 224 20.454 -1.124 7.835 1.00 0.00 O ATOM 0 H GLY A 224 18.695 -1.934 10.357 1.00 0.00 H new ATOM 0 HA2 GLY A 224 18.305 -2.744 8.273 1.00 0.00 H new ATOM 0 HA3 GLY A 224 17.210 -1.418 7.933 1.00 0.00 H new ATOM 343 N LEU A 225 18.861 -0.219 6.540 1.00 0.00 N ATOM 344 CA LEU A 225 19.806 0.494 5.705 1.00 0.00 C ATOM 345 C LEU A 225 19.200 1.809 5.238 1.00 0.00 C ATOM 346 O LEU A 225 18.317 1.836 4.382 1.00 0.00 O ATOM 347 CB LEU A 225 20.235 -0.361 4.510 1.00 0.00 C ATOM 348 CG LEU A 225 21.543 0.072 3.838 1.00 0.00 C ATOM 349 CD1 LEU A 225 22.658 0.212 4.865 1.00 0.00 C ATOM 350 CD2 LEU A 225 21.945 -0.922 2.763 1.00 0.00 C ATOM 0 H LEU A 225 17.883 -0.081 6.286 1.00 0.00 H new ATOM 0 HA LEU A 225 20.696 0.709 6.296 1.00 0.00 H new ATOM 0 HB2 LEU A 225 20.339 -1.394 4.841 1.00 0.00 H new ATOM 0 HB3 LEU A 225 19.439 -0.343 3.766 1.00 0.00 H new ATOM 0 HG LEU A 225 21.378 1.044 3.372 1.00 0.00 H new ATOM 0 HD11 LEU A 225 23.576 0.520 4.365 1.00 0.00 H new ATOM 0 HD12 LEU A 225 22.379 0.962 5.605 1.00 0.00 H new ATOM 0 HD13 LEU A 225 22.818 -0.745 5.361 1.00 0.00 H new ATOM 0 HD21 LEU A 225 22.876 -0.598 2.297 1.00 0.00 H new ATOM 0 HD22 LEU A 225 22.087 -1.905 3.211 1.00 0.00 H new ATOM 0 HD23 LEU A 225 21.161 -0.978 2.007 1.00 0.00 H new ATOM 362 N ASN A 226 19.670 2.893 5.833 1.00 0.00 N ATOM 363 CA ASN A 226 19.192 4.226 5.499 1.00 0.00 C ATOM 364 C ASN A 226 19.563 4.588 4.067 1.00 0.00 C ATOM 365 O ASN A 226 20.508 4.034 3.508 1.00 0.00 O ATOM 366 CB ASN A 226 19.789 5.251 6.465 1.00 0.00 C ATOM 367 CG ASN A 226 18.835 5.648 7.574 1.00 0.00 C ATOM 368 OD1 ASN A 226 18.741 4.982 8.606 1.00 0.00 O ATOM 369 ND2 ASN A 226 18.130 6.745 7.373 1.00 0.00 N ATOM 0 H ASN A 226 20.389 2.875 6.556 1.00 0.00 H new ATOM 0 HA ASN A 226 18.106 4.236 5.588 1.00 0.00 H new ATOM 0 HB2 ASN A 226 20.698 4.840 6.905 1.00 0.00 H new ATOM 0 HB3 ASN A 226 20.079 6.141 5.907 1.00 0.00 H new ATOM 0 HD21 ASN A 226 17.478 7.070 8.087 1.00 0.00 H new ATOM 0 HD22 ASN A 226 18.237 7.268 6.504 1.00 0.00 H new ATOM 376 N PHE A 227 18.824 5.520 3.479 1.00 0.00 N ATOM 377 CA PHE A 227 19.087 5.955 2.114 1.00 0.00 C ATOM 378 C PHE A 227 20.482 6.560 2.028 1.00 0.00 C ATOM 379 O PHE A 227 21.220 6.320 1.069 1.00 0.00 O ATOM 380 CB PHE A 227 18.030 6.967 1.662 1.00 0.00 C ATOM 381 CG PHE A 227 17.928 7.122 0.170 1.00 0.00 C ATOM 382 CD1 PHE A 227 17.092 6.299 -0.568 1.00 0.00 C ATOM 383 CD2 PHE A 227 18.662 8.093 -0.493 1.00 0.00 C ATOM 384 CE1 PHE A 227 16.990 6.442 -1.938 1.00 0.00 C ATOM 385 CE2 PHE A 227 18.564 8.238 -1.863 1.00 0.00 C ATOM 386 CZ PHE A 227 17.728 7.412 -2.586 1.00 0.00 C ATOM 0 H PHE A 227 18.037 5.989 3.927 1.00 0.00 H new ATOM 0 HA PHE A 227 19.036 5.093 1.449 1.00 0.00 H new ATOM 0 HB2 PHE A 227 17.059 6.661 2.052 1.00 0.00 H new ATOM 0 HB3 PHE A 227 18.259 7.937 2.103 1.00 0.00 H new ATOM 0 HD1 PHE A 227 16.514 5.537 -0.066 1.00 0.00 H new ATOM 0 HD2 PHE A 227 19.317 8.743 0.068 1.00 0.00 H new ATOM 0 HE1 PHE A 227 16.334 5.796 -2.502 1.00 0.00 H new ATOM 0 HE2 PHE A 227 19.142 8.998 -2.368 1.00 0.00 H new ATOM 0 HZ PHE A 227 17.651 7.524 -3.657 1.00 0.00 H new ATOM 396 N GLN A 228 20.846 7.336 3.044 1.00 0.00 N ATOM 397 CA GLN A 228 22.166 7.947 3.090 1.00 0.00 C ATOM 398 C GLN A 228 23.230 6.864 3.281 1.00 0.00 C ATOM 399 O GLN A 228 24.366 7.003 2.830 1.00 0.00 O ATOM 400 CB GLN A 228 22.236 8.996 4.213 1.00 0.00 C ATOM 401 CG GLN A 228 22.388 8.414 5.615 1.00 0.00 C ATOM 402 CD GLN A 228 23.841 8.270 6.030 1.00 0.00 C ATOM 403 OE1 GLN A 228 24.692 9.066 5.638 1.00 0.00 O ATOM 404 NE2 GLN A 228 24.140 7.243 6.810 1.00 0.00 N ATOM 0 H GLN A 228 20.248 7.555 3.841 1.00 0.00 H new ATOM 0 HA GLN A 228 22.357 8.458 2.146 1.00 0.00 H new ATOM 0 HB2 GLN A 228 23.075 9.663 4.018 1.00 0.00 H new ATOM 0 HB3 GLN A 228 21.332 9.604 4.182 1.00 0.00 H new ATOM 0 HG2 GLN A 228 21.871 9.055 6.329 1.00 0.00 H new ATOM 0 HG3 GLN A 228 21.904 7.438 5.654 1.00 0.00 H new ATOM 0 HE21 GLN A 228 23.406 6.604 7.115 1.00 0.00 H new ATOM 0 HE22 GLN A 228 25.104 7.091 7.106 1.00 0.00 H new ATOM 413 N ASP A 229 22.840 5.776 3.941 1.00 0.00 N ATOM 414 CA ASP A 229 23.744 4.659 4.194 1.00 0.00 C ATOM 415 C ASP A 229 23.941 3.850 2.921 1.00 0.00 C ATOM 416 O ASP A 229 25.037 3.364 2.638 1.00 0.00 O ATOM 417 CB ASP A 229 23.185 3.755 5.300 1.00 0.00 C ATOM 418 CG ASP A 229 23.751 4.067 6.671 1.00 0.00 C ATOM 419 OD1 ASP A 229 24.919 3.708 6.931 1.00 0.00 O ATOM 420 OD2 ASP A 229 23.024 4.656 7.504 1.00 0.00 O ATOM 0 H ASP A 229 21.899 5.645 4.312 1.00 0.00 H new ATOM 0 HA ASP A 229 24.705 5.059 4.519 1.00 0.00 H new ATOM 0 HB2 ASP A 229 22.100 3.858 5.330 1.00 0.00 H new ATOM 0 HB3 ASP A 229 23.400 2.715 5.054 1.00 0.00 H new ATOM 425 N LEU A 230 22.863 3.718 2.157 1.00 0.00 N ATOM 426 CA LEU A 230 22.878 2.983 0.898 1.00 0.00 C ATOM 427 C LEU A 230 23.911 3.560 -0.062 1.00 0.00 C ATOM 428 O LEU A 230 24.765 2.839 -0.575 1.00 0.00 O ATOM 429 CB LEU A 230 21.494 3.029 0.245 1.00 0.00 C ATOM 430 CG LEU A 230 20.586 1.841 0.556 1.00 0.00 C ATOM 431 CD1 LEU A 230 19.133 2.197 0.284 1.00 0.00 C ATOM 432 CD2 LEU A 230 20.999 0.631 -0.269 1.00 0.00 C ATOM 0 H LEU A 230 21.954 4.117 2.393 1.00 0.00 H new ATOM 0 HA LEU A 230 23.146 1.949 1.117 1.00 0.00 H new ATOM 0 HB2 LEU A 230 20.991 3.943 0.562 1.00 0.00 H new ATOM 0 HB3 LEU A 230 21.622 3.094 -0.835 1.00 0.00 H new ATOM 0 HG LEU A 230 20.688 1.593 1.613 1.00 0.00 H new ATOM 0 HD11 LEU A 230 18.500 1.339 0.511 1.00 0.00 H new ATOM 0 HD12 LEU A 230 18.841 3.039 0.911 1.00 0.00 H new ATOM 0 HD13 LEU A 230 19.015 2.468 -0.765 1.00 0.00 H new ATOM 0 HD21 LEU A 230 20.343 -0.208 -0.037 1.00 0.00 H new ATOM 0 HD22 LEU A 230 20.921 0.870 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 230 22.029 0.363 -0.032 1.00 0.00 H new ATOM 444 N LYS A 231 23.836 4.868 -0.280 1.00 0.00 N ATOM 445 CA LYS A 231 24.755 5.551 -1.186 1.00 0.00 C ATOM 446 C LYS A 231 26.177 5.565 -0.626 1.00 0.00 C ATOM 447 O LYS A 231 27.143 5.730 -1.370 1.00 0.00 O ATOM 448 CB LYS A 231 24.285 6.984 -1.447 1.00 0.00 C ATOM 449 CG LYS A 231 24.286 7.856 -0.204 1.00 0.00 C ATOM 450 CD LYS A 231 23.963 9.301 -0.531 1.00 0.00 C ATOM 451 CE LYS A 231 24.307 10.215 0.632 1.00 0.00 C ATOM 452 NZ LYS A 231 23.927 11.624 0.361 1.00 0.00 N ATOM 0 H LYS A 231 23.147 5.479 0.159 1.00 0.00 H new ATOM 0 HA LYS A 231 24.762 5.001 -2.127 1.00 0.00 H new ATOM 0 HB2 LYS A 231 24.929 7.438 -2.200 1.00 0.00 H new ATOM 0 HB3 LYS A 231 23.278 6.958 -1.862 1.00 0.00 H new ATOM 0 HG2 LYS A 231 23.557 7.473 0.510 1.00 0.00 H new ATOM 0 HG3 LYS A 231 25.262 7.802 0.278 1.00 0.00 H new ATOM 0 HD2 LYS A 231 24.518 9.610 -1.417 1.00 0.00 H new ATOM 0 HD3 LYS A 231 22.904 9.395 -0.770 1.00 0.00 H new ATOM 0 HE2 LYS A 231 23.796 9.868 1.530 1.00 0.00 H new ATOM 0 HE3 LYS A 231 25.377 10.160 0.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 24.179 12.215 1.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 24.434 11.964 -0.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 22.902 11.681 0.195 1.00 0.00 H new ATOM 466 N ASN A 232 26.297 5.396 0.688 1.00 0.00 N ATOM 467 CA ASN A 232 27.601 5.384 1.337 1.00 0.00 C ATOM 468 C ASN A 232 28.315 4.073 1.032 1.00 0.00 C ATOM 469 O ASN A 232 29.528 4.039 0.827 1.00 0.00 O ATOM 470 CB ASN A 232 27.457 5.562 2.852 1.00 0.00 C ATOM 471 CG ASN A 232 28.696 6.163 3.491 1.00 0.00 C ATOM 472 OD1 ASN A 232 29.801 6.069 2.954 1.00 0.00 O ATOM 473 ND2 ASN A 232 28.524 6.773 4.651 1.00 0.00 N ATOM 0 H ASN A 232 25.508 5.266 1.321 1.00 0.00 H new ATOM 0 HA ASN A 232 28.189 6.216 0.949 1.00 0.00 H new ATOM 0 HB2 ASN A 232 26.599 6.202 3.059 1.00 0.00 H new ATOM 0 HB3 ASN A 232 27.250 4.595 3.309 1.00 0.00 H new ATOM 0 HD21 ASN A 232 29.322 7.186 5.133 1.00 0.00 H new ATOM 0 HD22 ASN A 232 27.593 6.830 5.064 1.00 0.00 H new ATOM 480 N GLN A 233 27.552 2.992 1.003 1.00 0.00 N ATOM 481 CA GLN A 233 28.106 1.678 0.707 1.00 0.00 C ATOM 482 C GLN A 233 28.208 1.479 -0.800 1.00 0.00 C ATOM 483 O GLN A 233 29.225 1.009 -1.317 1.00 0.00 O ATOM 484 CB GLN A 233 27.235 0.581 1.322 1.00 0.00 C ATOM 485 CG GLN A 233 27.128 0.663 2.836 1.00 0.00 C ATOM 486 CD GLN A 233 28.481 0.723 3.514 1.00 0.00 C ATOM 487 OE1 GLN A 233 29.002 1.803 3.798 1.00 0.00 O ATOM 488 NE2 GLN A 233 29.063 -0.434 3.774 1.00 0.00 N ATOM 0 H GLN A 233 26.548 2.997 1.181 1.00 0.00 H new ATOM 0 HA GLN A 233 29.104 1.616 1.141 1.00 0.00 H new ATOM 0 HB2 GLN A 233 26.235 0.640 0.892 1.00 0.00 H new ATOM 0 HB3 GLN A 233 27.643 -0.392 1.048 1.00 0.00 H new ATOM 0 HG2 GLN A 233 26.550 1.546 3.108 1.00 0.00 H new ATOM 0 HG3 GLN A 233 26.579 -0.203 3.205 1.00 0.00 H new ATOM 0 HE21 GLN A 233 28.598 -1.307 3.523 1.00 0.00 H new ATOM 0 HE22 GLN A 233 29.977 -0.455 4.226 1.00 0.00 H new ATOM 497 N LEU A 234 27.155 1.862 -1.500 1.00 0.00 N ATOM 498 CA LEU A 234 27.104 1.732 -2.945 1.00 0.00 C ATOM 499 C LEU A 234 27.551 3.028 -3.612 1.00 0.00 C ATOM 500 O LEU A 234 26.768 3.704 -4.278 1.00 0.00 O ATOM 501 CB LEU A 234 25.689 1.357 -3.396 1.00 0.00 C ATOM 502 CG LEU A 234 25.078 0.151 -2.677 1.00 0.00 C ATOM 503 CD1 LEU A 234 23.625 -0.033 -3.082 1.00 0.00 C ATOM 504 CD2 LEU A 234 25.875 -1.111 -2.971 1.00 0.00 C ATOM 0 H LEU A 234 26.316 2.269 -1.086 1.00 0.00 H new ATOM 0 HA LEU A 234 27.786 0.937 -3.247 1.00 0.00 H new ATOM 0 HB2 LEU A 234 25.037 2.218 -3.248 1.00 0.00 H new ATOM 0 HB3 LEU A 234 25.708 1.152 -4.466 1.00 0.00 H new ATOM 0 HG LEU A 234 25.116 0.339 -1.604 1.00 0.00 H new ATOM 0 HD11 LEU A 234 23.208 -0.895 -2.561 1.00 0.00 H new ATOM 0 HD12 LEU A 234 23.058 0.860 -2.818 1.00 0.00 H new ATOM 0 HD13 LEU A 234 23.565 -0.196 -4.158 1.00 0.00 H new ATOM 0 HD21 LEU A 234 25.424 -1.956 -2.450 1.00 0.00 H new ATOM 0 HD22 LEU A 234 25.871 -1.302 -4.044 1.00 0.00 H new ATOM 0 HD23 LEU A 234 26.902 -0.981 -2.629 1.00 0.00 H new ATOM 516 N LYS A 235 28.829 3.352 -3.436 1.00 0.00 N ATOM 517 CA LYS A 235 29.415 4.566 -4.008 1.00 0.00 C ATOM 518 C LYS A 235 29.460 4.477 -5.530 1.00 0.00 C ATOM 519 O LYS A 235 29.688 5.469 -6.218 1.00 0.00 O ATOM 520 CB LYS A 235 30.836 4.787 -3.479 1.00 0.00 C ATOM 521 CG LYS A 235 31.017 4.451 -2.008 1.00 0.00 C ATOM 522 CD LYS A 235 32.466 4.620 -1.585 1.00 0.00 C ATOM 523 CE LYS A 235 32.786 3.817 -0.332 1.00 0.00 C ATOM 524 NZ LYS A 235 32.207 4.424 0.893 1.00 0.00 N ATOM 0 H LYS A 235 29.485 2.787 -2.897 1.00 0.00 H new ATOM 0 HA LYS A 235 28.786 5.406 -3.712 1.00 0.00 H new ATOM 0 HB2 LYS A 235 31.527 4.182 -4.065 1.00 0.00 H new ATOM 0 HB3 LYS A 235 31.112 5.830 -3.638 1.00 0.00 H new ATOM 0 HG2 LYS A 235 30.380 5.096 -1.403 1.00 0.00 H new ATOM 0 HG3 LYS A 235 30.698 3.425 -1.824 1.00 0.00 H new ATOM 0 HD2 LYS A 235 33.121 4.304 -2.397 1.00 0.00 H new ATOM 0 HD3 LYS A 235 32.671 5.675 -1.403 1.00 0.00 H new ATOM 0 HE2 LYS A 235 32.404 2.802 -0.447 1.00 0.00 H new ATOM 0 HE3 LYS A 235 33.867 3.740 -0.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 235 32.438 3.832 1.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 235 32.603 5.376 1.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 235 31.174 4.490 0.793 1.00 0.00 H new ATOM 538 N HIS A 236 29.251 3.273 -6.048 1.00 0.00 N ATOM 539 CA HIS A 236 29.260 3.044 -7.487 1.00 0.00 C ATOM 540 C HIS A 236 27.878 3.306 -8.083 1.00 0.00 C ATOM 541 O HIS A 236 27.591 2.919 -9.214 1.00 0.00 O ATOM 542 CB HIS A 236 29.732 1.613 -7.802 1.00 0.00 C ATOM 543 CG HIS A 236 28.801 0.525 -7.345 1.00 0.00 C ATOM 544 ND1 HIS A 236 28.811 0.005 -6.067 1.00 0.00 N ATOM 545 CD2 HIS A 236 27.838 -0.151 -8.013 1.00 0.00 C ATOM 546 CE1 HIS A 236 27.895 -0.941 -5.973 1.00 0.00 C ATOM 547 NE2 HIS A 236 27.290 -1.056 -7.139 1.00 0.00 N ATOM 0 H HIS A 236 29.073 2.438 -5.491 1.00 0.00 H new ATOM 0 HA HIS A 236 29.962 3.742 -7.943 1.00 0.00 H new ATOM 0 HB2 HIS A 236 29.874 1.521 -8.879 1.00 0.00 H new ATOM 0 HB3 HIS A 236 30.706 1.457 -7.338 1.00 0.00 H new ATOM 0 HD2 HIS A 236 27.553 -0.005 -9.044 1.00 0.00 H new ATOM 0 HE1 HIS A 236 27.678 -1.523 -5.090 1.00 0.00 H new ATOM 0 HE2 HIS A 236 26.538 -1.710 -7.356 1.00 0.00 H new ATOM 556 N MET A 237 27.026 3.958 -7.309 1.00 0.00 N ATOM 557 CA MET A 237 25.679 4.286 -7.751 1.00 0.00 C ATOM 558 C MET A 237 25.353 5.726 -7.385 1.00 0.00 C ATOM 559 O MET A 237 25.824 6.234 -6.368 1.00 0.00 O ATOM 560 CB MET A 237 24.651 3.351 -7.107 1.00 0.00 C ATOM 561 CG MET A 237 24.726 1.914 -7.594 1.00 0.00 C ATOM 562 SD MET A 237 24.279 1.737 -9.331 1.00 0.00 S ATOM 563 CE MET A 237 24.527 -0.023 -9.557 1.00 0.00 C ATOM 0 H MET A 237 27.245 4.273 -6.364 1.00 0.00 H new ATOM 0 HA MET A 237 25.634 4.162 -8.833 1.00 0.00 H new ATOM 0 HB2 MET A 237 24.791 3.364 -6.026 1.00 0.00 H new ATOM 0 HB3 MET A 237 23.651 3.738 -7.304 1.00 0.00 H new ATOM 0 HG2 MET A 237 25.738 1.538 -7.444 1.00 0.00 H new ATOM 0 HG3 MET A 237 24.063 1.296 -6.989 1.00 0.00 H new ATOM 0 HE1 MET A 237 24.018 -0.349 -10.465 1.00 0.00 H new ATOM 0 HE2 MET A 237 25.593 -0.232 -9.644 1.00 0.00 H new ATOM 0 HE3 MET A 237 24.120 -0.561 -8.700 1.00 0.00 H new ATOM 573 N SER A 238 24.568 6.384 -8.220 1.00 0.00 N ATOM 574 CA SER A 238 24.179 7.759 -7.965 1.00 0.00 C ATOM 575 C SER A 238 22.869 7.791 -7.180 1.00 0.00 C ATOM 576 O SER A 238 22.144 6.795 -7.148 1.00 0.00 O ATOM 577 CB SER A 238 24.020 8.512 -9.287 1.00 0.00 C ATOM 578 OG SER A 238 25.049 8.164 -10.201 1.00 0.00 O ATOM 0 H SER A 238 24.188 5.988 -9.080 1.00 0.00 H new ATOM 0 HA SER A 238 24.956 8.245 -7.376 1.00 0.00 H new ATOM 0 HB2 SER A 238 23.048 8.283 -9.725 1.00 0.00 H new ATOM 0 HB3 SER A 238 24.042 9.586 -9.102 1.00 0.00 H new ATOM 0 HG SER A 238 24.923 8.658 -11.038 1.00 0.00 H new ATOM 584 N VAL A 239 22.577 8.924 -6.545 1.00 0.00 N ATOM 585 CA VAL A 239 21.344 9.084 -5.772 1.00 0.00 C ATOM 586 C VAL A 239 20.127 8.709 -6.610 1.00 0.00 C ATOM 587 O VAL A 239 19.233 8.002 -6.145 1.00 0.00 O ATOM 588 CB VAL A 239 21.183 10.532 -5.259 1.00 0.00 C ATOM 589 CG1 VAL A 239 19.831 10.736 -4.586 1.00 0.00 C ATOM 590 CG2 VAL A 239 22.310 10.881 -4.303 1.00 0.00 C ATOM 0 H VAL A 239 23.178 9.748 -6.550 1.00 0.00 H new ATOM 0 HA VAL A 239 21.413 8.415 -4.915 1.00 0.00 H new ATOM 0 HB VAL A 239 21.230 11.200 -6.119 1.00 0.00 H new ATOM 0 HG11 VAL A 239 19.750 11.765 -4.236 1.00 0.00 H new ATOM 0 HG12 VAL A 239 19.034 10.532 -5.301 1.00 0.00 H new ATOM 0 HG13 VAL A 239 19.740 10.057 -3.738 1.00 0.00 H new ATOM 0 HG21 VAL A 239 22.184 11.904 -3.950 1.00 0.00 H new ATOM 0 HG22 VAL A 239 22.291 10.199 -3.453 1.00 0.00 H new ATOM 0 HG23 VAL A 239 23.266 10.791 -4.819 1.00 0.00 H new ATOM 600 N SER A 240 20.112 9.175 -7.852 1.00 0.00 N ATOM 601 CA SER A 240 19.021 8.889 -8.767 1.00 0.00 C ATOM 602 C SER A 240 18.894 7.382 -9.000 1.00 0.00 C ATOM 603 O SER A 240 17.800 6.827 -8.929 1.00 0.00 O ATOM 604 CB SER A 240 19.264 9.621 -10.083 1.00 0.00 C ATOM 605 OG SER A 240 19.924 10.854 -9.843 1.00 0.00 O ATOM 0 H SER A 240 20.850 9.757 -8.249 1.00 0.00 H new ATOM 0 HA SER A 240 18.085 9.238 -8.331 1.00 0.00 H new ATOM 0 HB2 SER A 240 19.866 9.001 -10.747 1.00 0.00 H new ATOM 0 HB3 SER A 240 18.315 9.800 -10.588 1.00 0.00 H new ATOM 0 HG SER A 240 20.076 11.315 -10.694 1.00 0.00 H new ATOM 611 N SER A 241 20.026 6.727 -9.246 1.00 0.00 N ATOM 612 CA SER A 241 20.055 5.288 -9.480 1.00 0.00 C ATOM 613 C SER A 241 19.552 4.536 -8.250 1.00 0.00 C ATOM 614 O SER A 241 18.755 3.599 -8.360 1.00 0.00 O ATOM 615 CB SER A 241 21.479 4.856 -9.823 1.00 0.00 C ATOM 616 OG SER A 241 22.183 5.919 -10.448 1.00 0.00 O ATOM 0 H SER A 241 20.941 7.175 -9.288 1.00 0.00 H new ATOM 0 HA SER A 241 19.397 5.050 -10.316 1.00 0.00 H new ATOM 0 HB2 SER A 241 22.001 4.549 -8.916 1.00 0.00 H new ATOM 0 HB3 SER A 241 21.454 3.990 -10.484 1.00 0.00 H new ATOM 0 HG SER A 241 23.033 5.584 -10.803 1.00 0.00 H new ATOM 622 N ILE A 242 20.018 4.964 -7.079 1.00 0.00 N ATOM 623 CA ILE A 242 19.608 4.356 -5.821 1.00 0.00 C ATOM 624 C ILE A 242 18.107 4.544 -5.628 1.00 0.00 C ATOM 625 O ILE A 242 17.388 3.605 -5.283 1.00 0.00 O ATOM 626 CB ILE A 242 20.372 4.966 -4.619 1.00 0.00 C ATOM 627 CG1 ILE A 242 21.867 4.640 -4.714 1.00 0.00 C ATOM 628 CG2 ILE A 242 19.802 4.461 -3.297 1.00 0.00 C ATOM 629 CD1 ILE A 242 22.177 3.162 -4.600 1.00 0.00 C ATOM 0 H ILE A 242 20.682 5.732 -6.978 1.00 0.00 H new ATOM 0 HA ILE A 242 19.846 3.293 -5.865 1.00 0.00 H new ATOM 0 HB ILE A 242 20.247 6.048 -4.652 1.00 0.00 H new ATOM 0 HG12 ILE A 242 22.251 5.010 -5.665 1.00 0.00 H new ATOM 0 HG13 ILE A 242 22.397 5.175 -3.926 1.00 0.00 H new ATOM 0 HG21 ILE A 242 20.356 4.904 -2.469 1.00 0.00 H new ATOM 0 HG22 ILE A 242 18.752 4.742 -3.223 1.00 0.00 H new ATOM 0 HG23 ILE A 242 19.891 3.376 -3.253 1.00 0.00 H new ATOM 0 HD11 ILE A 242 23.254 3.009 -4.676 1.00 0.00 H new ATOM 0 HD12 ILE A 242 21.825 2.789 -3.638 1.00 0.00 H new ATOM 0 HD13 ILE A 242 21.676 2.622 -5.404 1.00 0.00 H new ATOM 641 N LYS A 243 17.639 5.761 -5.890 1.00 0.00 N ATOM 642 CA LYS A 243 16.226 6.079 -5.753 1.00 0.00 C ATOM 643 C LYS A 243 15.390 5.225 -6.696 1.00 0.00 C ATOM 644 O LYS A 243 14.352 4.719 -6.302 1.00 0.00 O ATOM 645 CB LYS A 243 15.964 7.564 -6.019 1.00 0.00 C ATOM 646 CG LYS A 243 14.511 7.977 -5.816 1.00 0.00 C ATOM 647 CD LYS A 243 14.086 7.864 -4.356 1.00 0.00 C ATOM 648 CE LYS A 243 13.031 6.781 -4.153 1.00 0.00 C ATOM 649 NZ LYS A 243 11.736 7.119 -4.806 1.00 0.00 N ATOM 0 H LYS A 243 18.219 6.541 -6.198 1.00 0.00 H new ATOM 0 HA LYS A 243 15.935 5.859 -4.726 1.00 0.00 H new ATOM 0 HB2 LYS A 243 16.597 8.159 -5.360 1.00 0.00 H new ATOM 0 HB3 LYS A 243 16.259 7.798 -7.042 1.00 0.00 H new ATOM 0 HG2 LYS A 243 14.375 9.004 -6.155 1.00 0.00 H new ATOM 0 HG3 LYS A 243 13.866 7.350 -6.431 1.00 0.00 H new ATOM 0 HD2 LYS A 243 14.958 7.642 -3.740 1.00 0.00 H new ATOM 0 HD3 LYS A 243 13.692 8.822 -4.017 1.00 0.00 H new ATOM 0 HE2 LYS A 243 13.401 5.837 -4.554 1.00 0.00 H new ATOM 0 HE3 LYS A 243 12.868 6.632 -3.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 10.961 6.633 -4.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 11.584 8.147 -4.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 11.758 6.813 -5.800 1.00 0.00 H new ATOM 663 N GLN A 244 15.855 5.067 -7.933 1.00 0.00 N ATOM 664 CA GLN A 244 15.144 4.262 -8.927 1.00 0.00 C ATOM 665 C GLN A 244 14.908 2.847 -8.408 1.00 0.00 C ATOM 666 O GLN A 244 13.783 2.341 -8.443 1.00 0.00 O ATOM 667 CB GLN A 244 15.929 4.198 -10.241 1.00 0.00 C ATOM 668 CG GLN A 244 15.921 5.496 -11.032 1.00 0.00 C ATOM 669 CD GLN A 244 16.699 5.391 -12.331 1.00 0.00 C ATOM 670 OE1 GLN A 244 16.689 4.214 -12.939 1.00 0.00 O flip ATOM 671 NE2 GLN A 244 17.300 6.363 -12.791 1.00 0.00 N flip ATOM 0 H GLN A 244 16.721 5.485 -8.272 1.00 0.00 H new ATOM 0 HA GLN A 244 14.182 4.740 -9.111 1.00 0.00 H new ATOM 0 HB2 GLN A 244 16.961 3.925 -10.022 1.00 0.00 H new ATOM 0 HB3 GLN A 244 15.514 3.404 -10.862 1.00 0.00 H new ATOM 0 HG2 GLN A 244 14.891 5.778 -11.251 1.00 0.00 H new ATOM 0 HG3 GLN A 244 16.346 6.292 -10.421 1.00 0.00 H new ATOM 0 HE21 GLN A 244 17.285 7.254 -12.294 1.00 0.00 H new ATOM 0 HE22 GLN A 244 17.813 6.277 -13.669 1.00 0.00 H new ATOM 680 N ALA A 245 15.972 2.223 -7.917 1.00 0.00 N ATOM 681 CA ALA A 245 15.890 0.870 -7.385 1.00 0.00 C ATOM 682 C ALA A 245 14.984 0.822 -6.162 1.00 0.00 C ATOM 683 O ALA A 245 14.048 0.027 -6.103 1.00 0.00 O ATOM 684 CB ALA A 245 17.278 0.357 -7.036 1.00 0.00 C ATOM 0 H ALA A 245 16.904 2.635 -7.877 1.00 0.00 H new ATOM 0 HA ALA A 245 15.460 0.226 -8.152 1.00 0.00 H new ATOM 0 HB1 ALA A 245 17.203 -0.655 -6.639 1.00 0.00 H new ATOM 0 HB2 ALA A 245 17.899 0.351 -7.932 1.00 0.00 H new ATOM 0 HB3 ALA A 245 17.729 1.008 -6.287 1.00 0.00 H new ATOM 690 N VAL A 246 15.257 1.695 -5.198 1.00 0.00 N ATOM 691 CA VAL A 246 14.472 1.764 -3.970 1.00 0.00 C ATOM 692 C VAL A 246 13.002 2.048 -4.280 1.00 0.00 C ATOM 693 O VAL A 246 12.108 1.480 -3.656 1.00 0.00 O ATOM 694 CB VAL A 246 15.024 2.847 -3.013 1.00 0.00 C ATOM 695 CG1 VAL A 246 14.086 3.077 -1.839 1.00 0.00 C ATOM 696 CG2 VAL A 246 16.410 2.460 -2.518 1.00 0.00 C ATOM 0 H VAL A 246 16.021 2.369 -5.244 1.00 0.00 H new ATOM 0 HA VAL A 246 14.549 0.795 -3.478 1.00 0.00 H new ATOM 0 HB VAL A 246 15.097 3.781 -3.570 1.00 0.00 H new ATOM 0 HG11 VAL A 246 14.502 3.843 -1.185 1.00 0.00 H new ATOM 0 HG12 VAL A 246 13.114 3.404 -2.208 1.00 0.00 H new ATOM 0 HG13 VAL A 246 13.968 2.149 -1.280 1.00 0.00 H new ATOM 0 HG21 VAL A 246 16.785 3.232 -1.846 1.00 0.00 H new ATOM 0 HG22 VAL A 246 16.354 1.511 -1.985 1.00 0.00 H new ATOM 0 HG23 VAL A 246 17.085 2.360 -3.368 1.00 0.00 H new ATOM 706 N ASP A 247 12.768 2.914 -5.257 1.00 0.00 N ATOM 707 CA ASP A 247 11.416 3.282 -5.667 1.00 0.00 C ATOM 708 C ASP A 247 10.662 2.062 -6.170 1.00 0.00 C ATOM 709 O ASP A 247 9.548 1.780 -5.727 1.00 0.00 O ATOM 710 CB ASP A 247 11.466 4.347 -6.767 1.00 0.00 C ATOM 711 CG ASP A 247 10.103 4.904 -7.113 1.00 0.00 C ATOM 712 OD1 ASP A 247 9.634 5.813 -6.398 1.00 0.00 O ATOM 713 OD2 ASP A 247 9.512 4.451 -8.115 1.00 0.00 O ATOM 0 H ASP A 247 13.505 3.380 -5.786 1.00 0.00 H new ATOM 0 HA ASP A 247 10.894 3.688 -4.800 1.00 0.00 H new ATOM 0 HB2 ASP A 247 12.115 5.162 -6.447 1.00 0.00 H new ATOM 0 HB3 ASP A 247 11.914 3.916 -7.662 1.00 0.00 H new ATOM 718 N PHE A 248 11.288 1.324 -7.079 1.00 0.00 N ATOM 719 CA PHE A 248 10.672 0.131 -7.638 1.00 0.00 C ATOM 720 C PHE A 248 10.499 -0.928 -6.555 1.00 0.00 C ATOM 721 O PHE A 248 9.473 -1.602 -6.493 1.00 0.00 O ATOM 722 CB PHE A 248 11.508 -0.425 -8.793 1.00 0.00 C ATOM 723 CG PHE A 248 10.807 -1.504 -9.568 1.00 0.00 C ATOM 724 CD1 PHE A 248 9.716 -1.202 -10.364 1.00 0.00 C ATOM 725 CD2 PHE A 248 11.232 -2.820 -9.493 1.00 0.00 C ATOM 726 CE1 PHE A 248 9.062 -2.192 -11.072 1.00 0.00 C ATOM 727 CE2 PHE A 248 10.581 -3.814 -10.198 1.00 0.00 C ATOM 728 CZ PHE A 248 9.495 -3.500 -10.989 1.00 0.00 C ATOM 0 H PHE A 248 12.218 1.531 -7.442 1.00 0.00 H new ATOM 0 HA PHE A 248 9.691 0.403 -8.027 1.00 0.00 H new ATOM 0 HB2 PHE A 248 11.767 0.389 -9.470 1.00 0.00 H new ATOM 0 HB3 PHE A 248 12.444 -0.821 -8.398 1.00 0.00 H new ATOM 0 HD1 PHE A 248 9.372 -0.181 -10.433 1.00 0.00 H new ATOM 0 HD2 PHE A 248 12.082 -3.072 -8.876 1.00 0.00 H new ATOM 0 HE1 PHE A 248 8.212 -1.942 -11.690 1.00 0.00 H new ATOM 0 HE2 PHE A 248 10.922 -4.836 -10.130 1.00 0.00 H new ATOM 0 HZ PHE A 248 8.985 -4.275 -11.542 1.00 0.00 H new ATOM 738 N LEU A 249 11.500 -1.056 -5.688 1.00 0.00 N ATOM 739 CA LEU A 249 11.449 -2.026 -4.602 1.00 0.00 C ATOM 740 C LEU A 249 10.334 -1.676 -3.619 1.00 0.00 C ATOM 741 O LEU A 249 9.741 -2.560 -2.996 1.00 0.00 O ATOM 742 CB LEU A 249 12.792 -2.090 -3.870 1.00 0.00 C ATOM 743 CG LEU A 249 13.949 -2.690 -4.673 1.00 0.00 C ATOM 744 CD1 LEU A 249 15.255 -2.560 -3.902 1.00 0.00 C ATOM 745 CD2 LEU A 249 13.669 -4.147 -5.006 1.00 0.00 C ATOM 0 H LEU A 249 12.355 -0.500 -5.718 1.00 0.00 H new ATOM 0 HA LEU A 249 11.240 -3.005 -5.034 1.00 0.00 H new ATOM 0 HB2 LEU A 249 13.069 -1.081 -3.565 1.00 0.00 H new ATOM 0 HB3 LEU A 249 12.663 -2.674 -2.959 1.00 0.00 H new ATOM 0 HG LEU A 249 14.043 -2.137 -5.607 1.00 0.00 H new ATOM 0 HD11 LEU A 249 16.067 -2.991 -4.487 1.00 0.00 H new ATOM 0 HD12 LEU A 249 15.463 -1.507 -3.714 1.00 0.00 H new ATOM 0 HD13 LEU A 249 15.171 -3.089 -2.952 1.00 0.00 H new ATOM 0 HD21 LEU A 249 14.502 -4.556 -5.577 1.00 0.00 H new ATOM 0 HD22 LEU A 249 13.548 -4.714 -4.083 1.00 0.00 H new ATOM 0 HD23 LEU A 249 12.756 -4.216 -5.597 1.00 0.00 H new ATOM 757 N SER A 250 10.053 -0.385 -3.486 1.00 0.00 N ATOM 758 CA SER A 250 9.001 0.083 -2.598 1.00 0.00 C ATOM 759 C SER A 250 7.632 -0.165 -3.223 1.00 0.00 C ATOM 760 O SER A 250 6.669 -0.484 -2.525 1.00 0.00 O ATOM 761 CB SER A 250 9.183 1.568 -2.289 1.00 0.00 C ATOM 762 OG SER A 250 10.414 1.798 -1.625 1.00 0.00 O ATOM 0 H SER A 250 10.543 0.358 -3.985 1.00 0.00 H new ATOM 0 HA SER A 250 9.064 -0.474 -1.663 1.00 0.00 H new ATOM 0 HB2 SER A 250 9.151 2.143 -3.214 1.00 0.00 H new ATOM 0 HB3 SER A 250 8.359 1.918 -1.668 1.00 0.00 H new ATOM 0 HG SER A 250 11.153 1.483 -2.187 1.00 0.00 H new ATOM 768 N ASN A 251 7.548 -0.012 -4.539 1.00 0.00 N ATOM 769 CA ASN A 251 6.297 -0.248 -5.244 1.00 0.00 C ATOM 770 C ASN A 251 6.020 -1.743 -5.297 1.00 0.00 C ATOM 771 O ASN A 251 4.886 -2.186 -5.133 1.00 0.00 O ATOM 772 CB ASN A 251 6.347 0.326 -6.660 1.00 0.00 C ATOM 773 CG ASN A 251 4.986 0.311 -7.327 1.00 0.00 C ATOM 774 OD1 ASN A 251 4.626 -0.646 -8.016 1.00 0.00 O ATOM 775 ND2 ASN A 251 4.220 1.369 -7.126 1.00 0.00 N ATOM 0 H ASN A 251 8.326 0.272 -5.135 1.00 0.00 H new ATOM 0 HA ASN A 251 5.494 0.255 -4.705 1.00 0.00 H new ATOM 0 HB2 ASN A 251 6.722 1.349 -6.624 1.00 0.00 H new ATOM 0 HB3 ASN A 251 7.051 -0.250 -7.260 1.00 0.00 H new ATOM 0 HD21 ASN A 251 3.293 1.415 -7.548 1.00 0.00 H new ATOM 0 HD22 ASN A 251 4.556 2.140 -6.549 1.00 0.00 H new ATOM 782 N GLU A 252 7.081 -2.507 -5.528 1.00 0.00 N ATOM 783 CA GLU A 252 6.999 -3.960 -5.588 1.00 0.00 C ATOM 784 C GLU A 252 6.632 -4.530 -4.223 1.00 0.00 C ATOM 785 O GLU A 252 5.813 -5.442 -4.116 1.00 0.00 O ATOM 786 CB GLU A 252 8.340 -4.531 -6.045 1.00 0.00 C ATOM 787 CG GLU A 252 8.373 -4.933 -7.507 1.00 0.00 C ATOM 788 CD GLU A 252 7.894 -6.349 -7.723 1.00 0.00 C ATOM 789 OE1 GLU A 252 8.667 -7.288 -7.426 1.00 0.00 O ATOM 790 OE2 GLU A 252 6.752 -6.527 -8.192 1.00 0.00 O ATOM 0 H GLU A 252 8.020 -2.137 -5.679 1.00 0.00 H new ATOM 0 HA GLU A 252 6.223 -4.239 -6.301 1.00 0.00 H new ATOM 0 HB2 GLU A 252 9.119 -3.790 -5.865 1.00 0.00 H new ATOM 0 HB3 GLU A 252 8.580 -5.401 -5.434 1.00 0.00 H new ATOM 0 HG2 GLU A 252 7.750 -4.249 -8.084 1.00 0.00 H new ATOM 0 HG3 GLU A 252 9.390 -4.834 -7.886 1.00 0.00 H new ATOM 797 N GLY A 253 7.247 -3.983 -3.182 1.00 0.00 N ATOM 798 CA GLY A 253 6.969 -4.440 -1.839 1.00 0.00 C ATOM 799 C GLY A 253 8.077 -5.290 -1.264 1.00 0.00 C ATOM 800 O GLY A 253 7.820 -6.244 -0.535 1.00 0.00 O ATOM 0 H GLY A 253 7.933 -3.231 -3.246 1.00 0.00 H new ATOM 0 HA2 GLY A 253 6.808 -3.577 -1.193 1.00 0.00 H new ATOM 0 HA3 GLY A 253 6.042 -5.014 -1.841 1.00 0.00 H new ATOM 804 N HIS A 254 9.313 -4.944 -1.575 1.00 0.00 N ATOM 805 CA HIS A 254 10.450 -5.702 -1.074 1.00 0.00 C ATOM 806 C HIS A 254 11.087 -4.990 0.121 1.00 0.00 C ATOM 807 O HIS A 254 11.708 -5.624 0.978 1.00 0.00 O ATOM 808 CB HIS A 254 11.468 -5.947 -2.194 1.00 0.00 C ATOM 809 CG HIS A 254 10.918 -6.763 -3.335 1.00 0.00 C ATOM 810 ND1 HIS A 254 10.490 -8.069 -3.202 1.00 0.00 N ATOM 811 CD2 HIS A 254 10.706 -6.439 -4.632 1.00 0.00 C ATOM 812 CE1 HIS A 254 10.044 -8.507 -4.366 1.00 0.00 C ATOM 813 NE2 HIS A 254 10.161 -7.538 -5.253 1.00 0.00 N ATOM 0 H HIS A 254 9.556 -4.150 -2.167 1.00 0.00 H new ATOM 0 HA HIS A 254 10.098 -6.674 -0.729 1.00 0.00 H new ATOM 0 HB2 HIS A 254 11.813 -4.987 -2.577 1.00 0.00 H new ATOM 0 HB3 HIS A 254 12.338 -6.456 -1.779 1.00 0.00 H new ATOM 0 HD1 HIS A 254 10.514 -8.612 -2.339 1.00 0.00 H new ATOM 0 HD2 HIS A 254 10.925 -5.489 -5.096 1.00 0.00 H new ATOM 0 HE1 HIS A 254 9.650 -9.494 -4.559 1.00 0.00 H new ATOM 0 HE2 HIS A 254 9.892 -7.594 -6.235 1.00 0.00 H new ATOM 822 N ILE A 255 10.915 -3.673 0.178 1.00 0.00 N ATOM 823 CA ILE A 255 11.440 -2.861 1.273 1.00 0.00 C ATOM 824 C ILE A 255 10.395 -1.827 1.674 1.00 0.00 C ATOM 825 O ILE A 255 9.441 -1.595 0.929 1.00 0.00 O ATOM 826 CB ILE A 255 12.757 -2.138 0.905 1.00 0.00 C ATOM 827 CG1 ILE A 255 12.583 -1.317 -0.375 1.00 0.00 C ATOM 828 CG2 ILE A 255 13.893 -3.142 0.755 1.00 0.00 C ATOM 829 CD1 ILE A 255 13.773 -0.438 -0.697 1.00 0.00 C ATOM 0 H ILE A 255 10.410 -3.139 -0.530 1.00 0.00 H new ATOM 0 HA ILE A 255 11.661 -3.535 2.100 1.00 0.00 H new ATOM 0 HB ILE A 255 13.012 -1.453 1.714 1.00 0.00 H new ATOM 0 HG12 ILE A 255 12.406 -1.995 -1.210 1.00 0.00 H new ATOM 0 HG13 ILE A 255 11.696 -0.692 -0.278 1.00 0.00 H new ATOM 0 HG21 ILE A 255 14.812 -2.616 0.496 1.00 0.00 H new ATOM 0 HG22 ILE A 255 14.033 -3.676 1.695 1.00 0.00 H new ATOM 0 HG23 ILE A 255 13.648 -3.854 -0.033 1.00 0.00 H new ATOM 0 HD11 ILE A 255 13.579 0.114 -1.617 1.00 0.00 H new ATOM 0 HD12 ILE A 255 13.938 0.264 0.120 1.00 0.00 H new ATOM 0 HD13 ILE A 255 14.659 -1.059 -0.827 1.00 0.00 H new ATOM 841 N TYR A 256 10.552 -1.210 2.836 1.00 0.00 N ATOM 842 CA TYR A 256 9.583 -0.217 3.288 1.00 0.00 C ATOM 843 C TYR A 256 10.210 0.806 4.226 1.00 0.00 C ATOM 844 O TYR A 256 11.250 0.553 4.841 1.00 0.00 O ATOM 845 CB TYR A 256 8.406 -0.907 3.995 1.00 0.00 C ATOM 846 CG TYR A 256 8.672 -1.272 5.445 1.00 0.00 C ATOM 847 CD1 TYR A 256 9.493 -2.342 5.780 1.00 0.00 C ATOM 848 CD2 TYR A 256 8.096 -0.543 6.479 1.00 0.00 C ATOM 849 CE1 TYR A 256 9.731 -2.675 7.101 1.00 0.00 C ATOM 850 CE2 TYR A 256 8.329 -0.870 7.802 1.00 0.00 C ATOM 851 CZ TYR A 256 9.147 -1.935 8.108 1.00 0.00 C ATOM 852 OH TYR A 256 9.379 -2.264 9.424 1.00 0.00 O ATOM 0 H TYR A 256 11.329 -1.374 3.476 1.00 0.00 H new ATOM 0 HA TYR A 256 9.226 0.311 2.404 1.00 0.00 H new ATOM 0 HB2 TYR A 256 7.537 -0.251 3.952 1.00 0.00 H new ATOM 0 HB3 TYR A 256 8.149 -1.813 3.446 1.00 0.00 H new ATOM 0 HD1 TYR A 256 9.953 -2.924 4.995 1.00 0.00 H new ATOM 0 HD2 TYR A 256 7.455 0.294 6.245 1.00 0.00 H new ATOM 0 HE1 TYR A 256 10.371 -3.511 7.343 1.00 0.00 H new ATOM 0 HE2 TYR A 256 7.872 -0.293 8.592 1.00 0.00 H new ATOM 0 HH TYR A 256 10.268 -2.667 9.509 1.00 0.00 H new ATOM 862 N SER A 257 9.571 1.963 4.315 1.00 0.00 N ATOM 863 CA SER A 257 10.013 3.026 5.194 1.00 0.00 C ATOM 864 C SER A 257 9.443 2.780 6.586 1.00 0.00 C ATOM 865 O SER A 257 8.229 2.687 6.756 1.00 0.00 O ATOM 866 CB SER A 257 9.543 4.374 4.645 1.00 0.00 C ATOM 867 OG SER A 257 8.484 4.197 3.713 1.00 0.00 O ATOM 0 H SER A 257 8.733 2.188 3.779 1.00 0.00 H new ATOM 0 HA SER A 257 11.101 3.041 5.252 1.00 0.00 H new ATOM 0 HB2 SER A 257 9.209 5.010 5.465 1.00 0.00 H new ATOM 0 HB3 SER A 257 10.376 4.886 4.163 1.00 0.00 H new ATOM 0 HG SER A 257 7.834 4.923 3.815 1.00 0.00 H new ATOM 873 N THR A 258 10.316 2.647 7.572 1.00 0.00 N ATOM 874 CA THR A 258 9.886 2.380 8.937 1.00 0.00 C ATOM 875 C THR A 258 9.242 3.606 9.581 1.00 0.00 C ATOM 876 O THR A 258 8.020 3.700 9.672 1.00 0.00 O ATOM 877 CB THR A 258 11.075 1.916 9.789 1.00 0.00 C ATOM 878 OG1 THR A 258 12.159 1.539 8.926 1.00 0.00 O ATOM 879 CG2 THR A 258 10.683 0.741 10.671 1.00 0.00 C ATOM 0 H THR A 258 11.327 2.719 7.453 1.00 0.00 H new ATOM 0 HA THR A 258 9.137 1.590 8.892 1.00 0.00 H new ATOM 0 HB THR A 258 11.386 2.737 10.435 1.00 0.00 H new ATOM 0 HG1 THR A 258 11.930 0.711 8.455 1.00 0.00 H new ATOM 0 HG21 THR A 258 11.542 0.430 11.265 1.00 0.00 H new ATOM 0 HG22 THR A 258 9.871 1.039 11.335 1.00 0.00 H new ATOM 0 HG23 THR A 258 10.354 -0.089 10.046 1.00 0.00 H new ATOM 887 N VAL A 259 10.071 4.542 10.021 1.00 0.00 N ATOM 888 CA VAL A 259 9.584 5.758 10.662 1.00 0.00 C ATOM 889 C VAL A 259 10.247 6.981 10.049 1.00 0.00 C ATOM 890 O VAL A 259 10.387 8.021 10.694 1.00 0.00 O ATOM 891 CB VAL A 259 9.849 5.745 12.186 1.00 0.00 C ATOM 892 CG1 VAL A 259 8.870 4.818 12.896 1.00 0.00 C ATOM 893 CG2 VAL A 259 11.286 5.337 12.482 1.00 0.00 C ATOM 0 H VAL A 259 11.087 4.483 9.946 1.00 0.00 H new ATOM 0 HA VAL A 259 8.507 5.801 10.499 1.00 0.00 H new ATOM 0 HB VAL A 259 9.698 6.756 12.564 1.00 0.00 H new ATOM 0 HG11 VAL A 259 9.074 4.824 13.967 1.00 0.00 H new ATOM 0 HG12 VAL A 259 7.851 5.161 12.719 1.00 0.00 H new ATOM 0 HG13 VAL A 259 8.984 3.805 12.511 1.00 0.00 H new ATOM 0 HG21 VAL A 259 11.449 5.335 13.560 1.00 0.00 H new ATOM 0 HG22 VAL A 259 11.470 4.339 12.085 1.00 0.00 H new ATOM 0 HG23 VAL A 259 11.969 6.045 12.013 1.00 0.00 H new ATOM 903 N ASP A 260 10.647 6.847 8.792 1.00 0.00 N ATOM 904 CA ASP A 260 11.312 7.926 8.076 1.00 0.00 C ATOM 905 C ASP A 260 11.452 7.560 6.605 1.00 0.00 C ATOM 906 O ASP A 260 11.547 6.379 6.270 1.00 0.00 O ATOM 907 CB ASP A 260 12.695 8.180 8.682 1.00 0.00 C ATOM 908 CG ASP A 260 13.255 9.534 8.316 1.00 0.00 C ATOM 909 OD1 ASP A 260 13.711 9.701 7.171 1.00 0.00 O ATOM 910 OD2 ASP A 260 13.234 10.439 9.177 1.00 0.00 O ATOM 0 H ASP A 260 10.521 5.996 8.244 1.00 0.00 H new ATOM 0 HA ASP A 260 10.714 8.833 8.163 1.00 0.00 H new ATOM 0 HB2 ASP A 260 12.631 8.100 9.767 1.00 0.00 H new ATOM 0 HB3 ASP A 260 13.382 7.404 8.345 1.00 0.00 H new ATOM 915 N ASP A 261 11.479 8.566 5.736 1.00 0.00 N ATOM 916 CA ASP A 261 11.607 8.335 4.298 1.00 0.00 C ATOM 917 C ASP A 261 13.015 7.871 3.950 1.00 0.00 C ATOM 918 O ASP A 261 13.223 7.189 2.949 1.00 0.00 O ATOM 919 CB ASP A 261 11.262 9.602 3.504 1.00 0.00 C ATOM 920 CG ASP A 261 12.322 10.685 3.618 1.00 0.00 C ATOM 921 OD1 ASP A 261 12.238 11.507 4.556 1.00 0.00 O ATOM 922 OD2 ASP A 261 13.243 10.725 2.775 1.00 0.00 O ATOM 0 H ASP A 261 11.414 9.549 6.001 1.00 0.00 H new ATOM 0 HA ASP A 261 10.901 7.552 4.024 1.00 0.00 H new ATOM 0 HB2 ASP A 261 11.130 9.341 2.454 1.00 0.00 H new ATOM 0 HB3 ASP A 261 10.309 9.996 3.857 1.00 0.00 H new ATOM 927 N ASP A 262 13.978 8.240 4.783 1.00 0.00 N ATOM 928 CA ASP A 262 15.369 7.852 4.572 1.00 0.00 C ATOM 929 C ASP A 262 15.657 6.547 5.306 1.00 0.00 C ATOM 930 O ASP A 262 16.621 5.846 5.009 1.00 0.00 O ATOM 931 CB ASP A 262 16.305 8.959 5.079 1.00 0.00 C ATOM 932 CG ASP A 262 17.725 8.839 4.549 1.00 0.00 C ATOM 933 OD1 ASP A 262 18.557 8.160 5.193 1.00 0.00 O ATOM 934 OD2 ASP A 262 18.025 9.446 3.502 1.00 0.00 O ATOM 0 H ASP A 262 13.822 8.810 5.615 1.00 0.00 H new ATOM 0 HA ASP A 262 15.542 7.706 3.506 1.00 0.00 H new ATOM 0 HB2 ASP A 262 15.898 9.928 4.791 1.00 0.00 H new ATOM 0 HB3 ASP A 262 16.328 8.934 6.168 1.00 0.00 H new ATOM 939 N HIS A 263 14.792 6.217 6.254 1.00 0.00 N ATOM 940 CA HIS A 263 14.946 5.010 7.060 1.00 0.00 C ATOM 941 C HIS A 263 14.250 3.819 6.406 1.00 0.00 C ATOM 942 O HIS A 263 13.111 3.489 6.747 1.00 0.00 O ATOM 943 CB HIS A 263 14.373 5.245 8.460 1.00 0.00 C ATOM 944 CG HIS A 263 14.864 4.286 9.499 1.00 0.00 C ATOM 945 ND1 HIS A 263 14.356 3.013 9.659 1.00 0.00 N ATOM 946 CD2 HIS A 263 15.801 4.437 10.461 1.00 0.00 C ATOM 947 CE1 HIS A 263 14.959 2.430 10.677 1.00 0.00 C ATOM 948 NE2 HIS A 263 15.839 3.271 11.181 1.00 0.00 N ATOM 0 H HIS A 263 13.969 6.772 6.487 1.00 0.00 H new ATOM 0 HA HIS A 263 16.009 4.782 7.135 1.00 0.00 H new ATOM 0 HB2 HIS A 263 14.619 6.259 8.774 1.00 0.00 H new ATOM 0 HB3 HIS A 263 13.286 5.182 8.410 1.00 0.00 H new ATOM 0 HD1 HIS A 263 13.629 2.590 9.082 1.00 0.00 H new ATOM 0 HD2 HIS A 263 16.408 5.314 10.631 1.00 0.00 H new ATOM 0 HE1 HIS A 263 14.764 1.431 11.037 1.00 0.00 H new ATOM 957 N PHE A 264 14.937 3.178 5.474 1.00 0.00 N ATOM 958 CA PHE A 264 14.382 2.026 4.777 1.00 0.00 C ATOM 959 C PHE A 264 14.853 0.724 5.412 1.00 0.00 C ATOM 960 O PHE A 264 15.992 0.614 5.868 1.00 0.00 O ATOM 961 CB PHE A 264 14.770 2.052 3.297 1.00 0.00 C ATOM 962 CG PHE A 264 13.777 2.770 2.431 1.00 0.00 C ATOM 963 CD1 PHE A 264 12.588 2.157 2.071 1.00 0.00 C ATOM 964 CD2 PHE A 264 14.029 4.055 1.981 1.00 0.00 C ATOM 965 CE1 PHE A 264 11.668 2.811 1.276 1.00 0.00 C ATOM 966 CE2 PHE A 264 13.112 4.715 1.185 1.00 0.00 C ATOM 967 CZ PHE A 264 11.930 4.093 0.833 1.00 0.00 C ATOM 0 H PHE A 264 15.880 3.435 5.182 1.00 0.00 H new ATOM 0 HA PHE A 264 13.296 2.080 4.859 1.00 0.00 H new ATOM 0 HB2 PHE A 264 15.744 2.531 3.193 1.00 0.00 H new ATOM 0 HB3 PHE A 264 14.878 1.028 2.940 1.00 0.00 H new ATOM 0 HD1 PHE A 264 12.378 1.155 2.416 1.00 0.00 H new ATOM 0 HD2 PHE A 264 14.951 4.546 2.255 1.00 0.00 H new ATOM 0 HE1 PHE A 264 10.745 2.321 1.001 1.00 0.00 H new ATOM 0 HE2 PHE A 264 13.320 5.717 0.838 1.00 0.00 H new ATOM 0 HZ PHE A 264 11.212 4.608 0.212 1.00 0.00 H new ATOM 977 N LYS A 265 13.960 -0.255 5.457 1.00 0.00 N ATOM 978 CA LYS A 265 14.278 -1.557 6.023 1.00 0.00 C ATOM 979 C LYS A 265 13.800 -2.668 5.098 1.00 0.00 C ATOM 980 O LYS A 265 12.830 -2.497 4.355 1.00 0.00 O ATOM 981 CB LYS A 265 13.649 -1.715 7.410 1.00 0.00 C ATOM 982 CG LYS A 265 14.334 -0.887 8.486 1.00 0.00 C ATOM 983 CD LYS A 265 13.973 -1.367 9.882 1.00 0.00 C ATOM 984 CE LYS A 265 14.615 -2.707 10.200 1.00 0.00 C ATOM 985 NZ LYS A 265 14.394 -3.104 11.614 1.00 0.00 N ATOM 0 H LYS A 265 13.006 -0.171 5.106 1.00 0.00 H new ATOM 0 HA LYS A 265 15.361 -1.628 6.127 1.00 0.00 H new ATOM 0 HB2 LYS A 265 12.598 -1.430 7.358 1.00 0.00 H new ATOM 0 HB3 LYS A 265 13.681 -2.766 7.697 1.00 0.00 H new ATOM 0 HG2 LYS A 265 15.414 -0.939 8.352 1.00 0.00 H new ATOM 0 HG3 LYS A 265 14.049 0.159 8.376 1.00 0.00 H new ATOM 0 HD2 LYS A 265 14.293 -0.627 10.615 1.00 0.00 H new ATOM 0 HD3 LYS A 265 12.890 -1.453 9.968 1.00 0.00 H new ATOM 0 HE2 LYS A 265 14.206 -3.472 9.540 1.00 0.00 H new ATOM 0 HE3 LYS A 265 15.685 -2.653 10.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 14.247 -4.132 11.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 15.225 -2.843 12.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 13.554 -2.615 11.985 1.00 0.00 H new ATOM 999 N SER A 266 14.486 -3.798 5.146 1.00 0.00 N ATOM 1000 CA SER A 266 14.148 -4.939 4.313 1.00 0.00 C ATOM 1001 C SER A 266 12.908 -5.647 4.850 1.00 0.00 C ATOM 1002 O SER A 266 12.697 -5.712 6.061 1.00 0.00 O ATOM 1003 CB SER A 266 15.333 -5.905 4.268 1.00 0.00 C ATOM 1004 OG SER A 266 16.208 -5.679 5.365 1.00 0.00 O ATOM 0 H SER A 266 15.287 -3.949 5.759 1.00 0.00 H new ATOM 0 HA SER A 266 13.929 -4.590 3.304 1.00 0.00 H new ATOM 0 HB2 SER A 266 14.971 -6.933 4.291 1.00 0.00 H new ATOM 0 HB3 SER A 266 15.876 -5.779 3.331 1.00 0.00 H new ATOM 0 HG SER A 266 17.088 -5.406 5.031 1.00 0.00 H new ATOM 1010 N THR A 267 12.074 -6.147 3.951 1.00 0.00 N ATOM 1011 CA THR A 267 10.865 -6.854 4.347 1.00 0.00 C ATOM 1012 C THR A 267 10.691 -8.127 3.524 1.00 0.00 C ATOM 1013 O THR A 267 10.530 -9.219 4.071 1.00 0.00 O ATOM 1014 CB THR A 267 9.623 -5.963 4.174 1.00 0.00 C ATOM 1015 OG1 THR A 267 10.026 -4.620 3.873 1.00 0.00 O ATOM 1016 CG2 THR A 267 8.767 -5.970 5.430 1.00 0.00 C ATOM 0 H THR A 267 12.212 -6.077 2.943 1.00 0.00 H new ATOM 0 HA THR A 267 10.968 -7.117 5.400 1.00 0.00 H new ATOM 0 HB THR A 267 9.030 -6.361 3.351 1.00 0.00 H new ATOM 0 HG1 THR A 267 9.429 -4.244 3.192 1.00 0.00 H new ATOM 0 HG21 THR A 267 7.896 -5.332 5.280 1.00 0.00 H new ATOM 0 HG22 THR A 267 8.439 -6.988 5.641 1.00 0.00 H new ATOM 0 HG23 THR A 267 9.351 -5.595 6.270 1.00 0.00 H new ATOM 1024 N ASP A 268 10.731 -7.978 2.208 1.00 0.00 N ATOM 1025 CA ASP A 268 10.587 -9.107 1.299 1.00 0.00 C ATOM 1026 C ASP A 268 11.810 -9.200 0.401 1.00 0.00 C ATOM 1027 O ASP A 268 11.810 -8.708 -0.729 1.00 0.00 O ATOM 1028 CB ASP A 268 9.314 -8.971 0.456 1.00 0.00 C ATOM 1029 CG ASP A 268 9.153 -10.091 -0.558 1.00 0.00 C ATOM 1030 OD1 ASP A 268 9.380 -11.266 -0.200 1.00 0.00 O ATOM 1031 OD2 ASP A 268 8.779 -9.801 -1.715 1.00 0.00 O ATOM 0 H ASP A 268 10.863 -7.080 1.743 1.00 0.00 H new ATOM 0 HA ASP A 268 10.504 -10.021 1.887 1.00 0.00 H new ATOM 0 HB2 ASP A 268 8.447 -8.958 1.116 1.00 0.00 H new ATOM 0 HB3 ASP A 268 9.331 -8.015 -0.066 1.00 0.00 H new ATOM 1036 N ALA A 269 12.860 -9.804 0.928 1.00 0.00 N ATOM 1037 CA ALA A 269 14.103 -9.962 0.193 1.00 0.00 C ATOM 1038 C ALA A 269 14.834 -11.210 0.654 1.00 0.00 C ATOM 1039 O ALA A 269 14.860 -11.511 1.848 1.00 0.00 O ATOM 1040 CB ALA A 269 14.985 -8.738 0.382 1.00 0.00 C ATOM 0 H ALA A 269 12.876 -10.196 1.870 1.00 0.00 H new ATOM 0 HA ALA A 269 13.869 -10.066 -0.867 1.00 0.00 H new ATOM 0 HB1 ALA A 269 15.913 -8.869 -0.174 1.00 0.00 H new ATOM 0 HB2 ALA A 269 14.464 -7.854 0.015 1.00 0.00 H new ATOM 0 HB3 ALA A 269 15.211 -8.612 1.441 1.00 0.00 H new ATOM 1046 N GLU A 270 15.429 -11.928 -0.286 1.00 0.00 N ATOM 1047 CA GLU A 270 16.158 -13.139 0.031 1.00 0.00 C ATOM 1048 C GLU A 270 17.456 -13.208 -0.757 1.00 0.00 C ATOM 1049 O GLU A 270 17.404 -13.460 -1.977 1.00 0.00 O ATOM 1050 CB GLU A 270 15.296 -14.373 -0.239 1.00 0.00 C ATOM 1051 CG GLU A 270 14.549 -14.857 0.993 1.00 0.00 C ATOM 1052 CD GLU A 270 15.483 -15.177 2.144 1.00 0.00 C ATOM 1053 OE1 GLU A 270 15.948 -16.332 2.234 1.00 0.00 O ATOM 1054 OE2 GLU A 270 15.764 -14.272 2.963 1.00 0.00 O ATOM 1055 OXT GLU A 270 18.525 -13.016 -0.145 1.00 0.00 O ATOM 0 H GLU A 270 15.419 -11.689 -1.278 1.00 0.00 H new ATOM 0 HA GLU A 270 16.405 -13.120 1.092 1.00 0.00 H new ATOM 0 HB2 GLU A 270 14.577 -14.142 -1.025 1.00 0.00 H new ATOM 0 HB3 GLU A 270 15.930 -15.177 -0.612 1.00 0.00 H new ATOM 0 HG2 GLU A 270 13.837 -14.093 1.307 1.00 0.00 H new ATOM 0 HG3 GLU A 270 13.971 -15.746 0.739 1.00 0.00 H new TER 1062 GLU A 270 ATOM 1063 N GLY B 1 -31.222 -0.524 -12.275 1.00 8.94 N ATOM 1064 CA GLY B 1 -32.473 -1.309 -12.179 1.00 8.40 C ATOM 1065 C GLY B 1 -33.490 -0.634 -11.291 1.00 7.55 C ATOM 1066 O GLY B 1 -33.625 0.589 -11.312 1.00 7.60 O ATOM 0 H1 GLY B 1 -30.524 -1.051 -12.837 1.00 8.94 H new ATOM 0 H2 GLY B 1 -31.419 0.388 -12.734 1.00 8.94 H new ATOM 0 H3 GLY B 1 -30.843 -0.357 -11.321 1.00 8.94 H new ATOM 0 HA2 GLY B 1 -32.894 -1.446 -13.175 1.00 8.40 H new ATOM 0 HA3 GLY B 1 -32.250 -2.302 -11.788 1.00 8.40 H new ATOM 1072 N SER B 2 -34.200 -1.422 -10.503 1.00 7.04 N ATOM 1073 CA SER B 2 -35.213 -0.892 -9.607 1.00 6.48 C ATOM 1074 C SER B 2 -34.582 -0.396 -8.310 1.00 5.66 C ATOM 1075 O SER B 2 -34.830 0.730 -7.876 1.00 5.79 O ATOM 1076 CB SER B 2 -36.257 -1.969 -9.315 1.00 6.90 C ATOM 1077 OG SER B 2 -35.749 -3.259 -9.624 1.00 7.32 O ATOM 0 H SER B 2 -34.093 -2.436 -10.465 1.00 7.04 H new ATOM 0 HA SER B 2 -35.700 -0.045 -10.090 1.00 6.48 H new ATOM 0 HB2 SER B 2 -36.544 -1.928 -8.264 1.00 6.90 H new ATOM 0 HB3 SER B 2 -37.157 -1.778 -9.899 1.00 6.90 H new ATOM 0 HG SER B 2 -34.970 -3.448 -9.060 1.00 7.32 H new ATOM 1083 N LYS B 3 -33.744 -1.230 -7.710 1.00 5.14 N ATOM 1084 CA LYS B 3 -33.082 -0.886 -6.459 1.00 4.55 C ATOM 1085 C LYS B 3 -31.689 -0.323 -6.711 1.00 3.66 C ATOM 1086 O LYS B 3 -31.417 0.240 -7.773 1.00 3.27 O ATOM 1087 CB LYS B 3 -32.999 -2.118 -5.554 1.00 4.95 C ATOM 1088 CG LYS B 3 -34.351 -2.571 -5.039 1.00 5.83 C ATOM 1089 CD LYS B 3 -34.233 -3.760 -4.104 1.00 6.50 C ATOM 1090 CE LYS B 3 -35.565 -4.061 -3.436 1.00 7.34 C ATOM 1091 NZ LYS B 3 -35.535 -5.330 -2.666 1.00 8.03 N ATOM 0 H LYS B 3 -33.506 -2.154 -8.071 1.00 5.14 H new ATOM 0 HA LYS B 3 -33.672 -0.116 -5.962 1.00 4.55 H new ATOM 0 HB2 LYS B 3 -32.535 -2.936 -6.105 1.00 4.95 H new ATOM 0 HB3 LYS B 3 -32.350 -1.896 -4.707 1.00 4.95 H new ATOM 0 HG2 LYS B 3 -34.835 -1.746 -4.517 1.00 5.83 H new ATOM 0 HG3 LYS B 3 -34.990 -2.834 -5.882 1.00 5.83 H new ATOM 0 HD2 LYS B 3 -33.896 -4.634 -4.662 1.00 6.50 H new ATOM 0 HD3 LYS B 3 -33.479 -3.556 -3.344 1.00 6.50 H new ATOM 0 HE2 LYS B 3 -35.828 -3.240 -2.769 1.00 7.34 H new ATOM 0 HE3 LYS B 3 -36.345 -4.118 -4.195 1.00 7.34 H new ATOM 0 HZ1 LYS B 3 -36.465 -5.493 -2.229 1.00 8.03 H new ATOM 0 HZ2 LYS B 3 -35.310 -6.119 -3.305 1.00 8.03 H new ATOM 0 HZ3 LYS B 3 -34.809 -5.268 -1.924 1.00 8.03 H new ATOM 1105 N VAL B 4 -30.815 -0.459 -5.724 1.00 3.57 N ATOM 1106 CA VAL B 4 -29.452 0.032 -5.838 1.00 2.95 C ATOM 1107 C VAL B 4 -28.557 -1.014 -6.504 1.00 2.17 C ATOM 1108 O VAL B 4 -28.660 -2.210 -6.219 1.00 2.29 O ATOM 1109 CB VAL B 4 -28.878 0.422 -4.451 1.00 3.19 C ATOM 1110 CG1 VAL B 4 -28.811 -0.783 -3.521 1.00 3.17 C ATOM 1111 CG2 VAL B 4 -27.508 1.066 -4.590 1.00 3.40 C ATOM 0 H VAL B 4 -31.028 -0.907 -4.833 1.00 3.57 H new ATOM 0 HA VAL B 4 -29.472 0.926 -6.461 1.00 2.95 H new ATOM 0 HB VAL B 4 -29.556 1.152 -4.008 1.00 3.19 H new ATOM 0 HG11 VAL B 4 -28.404 -0.477 -2.557 1.00 3.17 H new ATOM 0 HG12 VAL B 4 -29.812 -1.190 -3.380 1.00 3.17 H new ATOM 0 HG13 VAL B 4 -28.168 -1.546 -3.960 1.00 3.17 H new ATOM 0 HG21 VAL B 4 -27.128 1.330 -3.603 1.00 3.40 H new ATOM 0 HG22 VAL B 4 -26.823 0.365 -5.067 1.00 3.40 H new ATOM 0 HG23 VAL B 4 -27.589 1.966 -5.200 1.00 3.40 H new ATOM 1121 N GLU B 5 -27.706 -0.564 -7.414 1.00 1.82 N ATOM 1122 CA GLU B 5 -26.793 -1.459 -8.107 1.00 1.42 C ATOM 1123 C GLU B 5 -25.576 -1.745 -7.236 1.00 1.13 C ATOM 1124 O GLU B 5 -24.963 -0.826 -6.687 1.00 1.27 O ATOM 1125 CB GLU B 5 -26.353 -0.863 -9.448 1.00 1.82 C ATOM 1126 CG GLU B 5 -27.295 -1.178 -10.599 1.00 2.28 C ATOM 1127 CD GLU B 5 -28.575 -0.377 -10.544 1.00 2.98 C ATOM 1128 OE1 GLU B 5 -28.538 0.831 -10.847 1.00 3.52 O ATOM 1129 OE2 GLU B 5 -29.630 -0.950 -10.208 1.00 3.44 O ATOM 0 H GLU B 5 -27.629 0.415 -7.689 1.00 1.82 H new ATOM 0 HA GLU B 5 -27.317 -2.394 -8.305 1.00 1.42 H new ATOM 0 HB2 GLU B 5 -26.270 0.219 -9.344 1.00 1.82 H new ATOM 0 HB3 GLU B 5 -25.359 -1.237 -9.692 1.00 1.82 H new ATOM 0 HG2 GLU B 5 -26.787 -0.979 -11.543 1.00 2.28 H new ATOM 0 HG3 GLU B 5 -27.536 -2.241 -10.585 1.00 2.28 H new ATOM 1136 N ASP B 6 -25.244 -3.017 -7.102 1.00 0.96 N ATOM 1137 CA ASP B 6 -24.102 -3.432 -6.300 1.00 0.89 C ATOM 1138 C ASP B 6 -22.980 -3.924 -7.210 1.00 0.78 C ATOM 1139 O ASP B 6 -23.017 -5.055 -7.697 1.00 0.84 O ATOM 1140 CB ASP B 6 -24.525 -4.536 -5.327 1.00 1.13 C ATOM 1141 CG ASP B 6 -23.710 -4.542 -4.048 1.00 1.65 C ATOM 1142 OD1 ASP B 6 -23.920 -3.644 -3.198 1.00 2.18 O ATOM 1143 OD2 ASP B 6 -22.886 -5.460 -3.871 1.00 2.32 O ATOM 0 H ASP B 6 -25.751 -3.786 -7.540 1.00 0.96 H new ATOM 0 HA ASP B 6 -23.737 -2.581 -5.726 1.00 0.89 H new ATOM 0 HB2 ASP B 6 -25.579 -4.410 -5.079 1.00 1.13 H new ATOM 0 HB3 ASP B 6 -24.426 -5.504 -5.819 1.00 1.13 H new ATOM 1148 N PRO B 7 -21.976 -3.068 -7.472 1.00 0.75 N ATOM 1149 CA PRO B 7 -20.843 -3.408 -8.341 1.00 0.68 C ATOM 1150 C PRO B 7 -20.031 -4.592 -7.823 1.00 0.65 C ATOM 1151 O PRO B 7 -20.036 -4.894 -6.629 1.00 0.80 O ATOM 1152 CB PRO B 7 -19.989 -2.136 -8.349 1.00 0.84 C ATOM 1153 CG PRO B 7 -20.413 -1.376 -7.140 1.00 0.99 C ATOM 1154 CD PRO B 7 -21.864 -1.705 -6.937 1.00 0.91 C ATOM 0 HA PRO B 7 -21.182 -3.714 -9.331 1.00 0.68 H new ATOM 0 HB2 PRO B 7 -18.926 -2.375 -8.312 1.00 0.84 H new ATOM 0 HB3 PRO B 7 -20.154 -1.556 -9.257 1.00 0.84 H new ATOM 0 HG2 PRO B 7 -19.822 -1.663 -6.271 1.00 0.99 H new ATOM 0 HG3 PRO B 7 -20.271 -0.305 -7.282 1.00 0.99 H new ATOM 0 HD2 PRO B 7 -22.144 -1.661 -5.884 1.00 0.91 H new ATOM 0 HD3 PRO B 7 -22.513 -1.009 -7.468 1.00 0.91 H new ATOM 1162 N LYS B 8 -19.330 -5.257 -8.732 1.00 0.64 N ATOM 1163 CA LYS B 8 -18.518 -6.416 -8.378 1.00 0.78 C ATOM 1164 C LYS B 8 -17.042 -6.040 -8.315 1.00 0.64 C ATOM 1165 O LYS B 8 -16.190 -6.869 -7.997 1.00 0.78 O ATOM 1166 CB LYS B 8 -18.728 -7.547 -9.393 1.00 1.04 C ATOM 1167 CG LYS B 8 -20.001 -8.359 -9.176 1.00 1.99 C ATOM 1168 CD LYS B 8 -21.253 -7.518 -9.384 1.00 2.65 C ATOM 1169 CE LYS B 8 -22.334 -8.287 -10.120 1.00 3.31 C ATOM 1170 NZ LYS B 8 -21.916 -8.643 -11.501 1.00 3.93 N ATOM 0 H LYS B 8 -19.307 -5.014 -9.722 1.00 0.64 H new ATOM 0 HA LYS B 8 -18.831 -6.763 -7.393 1.00 0.78 H new ATOM 0 HB2 LYS B 8 -18.750 -7.120 -10.396 1.00 1.04 H new ATOM 0 HB3 LYS B 8 -17.871 -8.219 -9.352 1.00 1.04 H new ATOM 0 HG2 LYS B 8 -20.014 -9.205 -9.863 1.00 1.99 H new ATOM 0 HG3 LYS B 8 -20.003 -8.769 -8.166 1.00 1.99 H new ATOM 0 HD2 LYS B 8 -21.635 -7.190 -8.417 1.00 2.65 H new ATOM 0 HD3 LYS B 8 -20.998 -6.620 -9.947 1.00 2.65 H new ATOM 0 HE2 LYS B 8 -22.574 -9.195 -9.567 1.00 3.31 H new ATOM 0 HE3 LYS B 8 -23.244 -7.688 -10.159 1.00 3.31 H new ATOM 0 HZ1 LYS B 8 -22.757 -8.736 -12.105 1.00 3.93 H new ATOM 0 HZ2 LYS B 8 -21.299 -7.897 -11.880 1.00 3.93 H new ATOM 0 HZ3 LYS B 8 -21.399 -9.545 -11.486 1.00 3.93 H new ATOM 1184 N ASP B 9 -16.749 -4.786 -8.626 1.00 0.46 N ATOM 1185 CA ASP B 9 -15.382 -4.285 -8.600 1.00 0.41 C ATOM 1186 C ASP B 9 -15.386 -2.777 -8.409 1.00 0.33 C ATOM 1187 O ASP B 9 -16.445 -2.173 -8.213 1.00 0.36 O ATOM 1188 CB ASP B 9 -14.645 -4.647 -9.891 1.00 0.51 C ATOM 1189 CG ASP B 9 -13.202 -5.038 -9.638 1.00 1.60 C ATOM 1190 OD1 ASP B 9 -12.375 -4.147 -9.355 1.00 2.44 O ATOM 1191 OD2 ASP B 9 -12.889 -6.245 -9.717 1.00 2.29 O ATOM 0 H ASP B 9 -17.444 -4.092 -8.901 1.00 0.46 H new ATOM 0 HA ASP B 9 -14.860 -4.752 -7.765 1.00 0.41 H new ATOM 0 HB2 ASP B 9 -15.162 -5.471 -10.383 1.00 0.51 H new ATOM 0 HB3 ASP B 9 -14.675 -3.798 -10.574 1.00 0.51 H new ATOM 1196 N PHE B 10 -14.212 -2.175 -8.478 1.00 0.42 N ATOM 1197 CA PHE B 10 -14.073 -0.735 -8.308 1.00 0.42 C ATOM 1198 C PHE B 10 -14.410 -0.006 -9.608 1.00 0.46 C ATOM 1199 O PHE B 10 -14.444 -0.619 -10.676 1.00 0.52 O ATOM 1200 CB PHE B 10 -12.641 -0.391 -7.883 1.00 0.42 C ATOM 1201 CG PHE B 10 -12.279 -0.848 -6.498 1.00 0.37 C ATOM 1202 CD1 PHE B 10 -11.960 -2.174 -6.250 1.00 0.78 C ATOM 1203 CD2 PHE B 10 -12.240 0.053 -5.447 1.00 1.33 C ATOM 1204 CE1 PHE B 10 -11.614 -2.591 -4.981 1.00 0.60 C ATOM 1205 CE2 PHE B 10 -11.896 -0.360 -4.175 1.00 1.63 C ATOM 1206 CZ PHE B 10 -11.581 -1.684 -3.943 1.00 0.89 C ATOM 0 H PHE B 10 -13.333 -2.663 -8.652 1.00 0.42 H new ATOM 0 HA PHE B 10 -14.768 -0.412 -7.532 1.00 0.42 H new ATOM 0 HB2 PHE B 10 -11.946 -0.839 -8.594 1.00 0.42 H new ATOM 0 HB3 PHE B 10 -12.506 0.689 -7.943 1.00 0.42 H new ATOM 0 HD1 PHE B 10 -11.983 -2.889 -7.059 1.00 0.78 H new ATOM 0 HD2 PHE B 10 -12.481 1.091 -5.624 1.00 1.33 H new ATOM 0 HE1 PHE B 10 -11.369 -3.627 -4.801 1.00 0.60 H new ATOM 0 HE2 PHE B 10 -11.873 0.352 -3.363 1.00 1.63 H new ATOM 0 HZ PHE B 10 -11.309 -2.009 -2.950 1.00 0.89 H new ATOM 1216 N PRO B 11 -14.706 1.303 -9.536 1.00 0.49 N ATOM 1217 CA PRO B 11 -15.004 2.101 -10.726 1.00 0.57 C ATOM 1218 C PRO B 11 -13.738 2.385 -11.533 1.00 0.54 C ATOM 1219 O PRO B 11 -12.629 2.345 -10.992 1.00 0.50 O ATOM 1220 CB PRO B 11 -15.587 3.393 -10.150 1.00 0.65 C ATOM 1221 CG PRO B 11 -14.988 3.506 -8.792 1.00 0.61 C ATOM 1222 CD PRO B 11 -14.802 2.098 -8.297 1.00 0.51 C ATOM 0 HA PRO B 11 -15.682 1.596 -11.414 1.00 0.57 H new ATOM 0 HB2 PRO B 11 -15.331 4.253 -10.769 1.00 0.65 H new ATOM 0 HB3 PRO B 11 -16.675 3.349 -10.100 1.00 0.65 H new ATOM 0 HG2 PRO B 11 -14.035 4.034 -8.829 1.00 0.61 H new ATOM 0 HG3 PRO B 11 -15.640 4.070 -8.125 1.00 0.61 H new ATOM 0 HD2 PRO B 11 -13.902 2.003 -7.689 1.00 0.51 H new ATOM 0 HD3 PRO B 11 -15.640 1.777 -7.679 1.00 0.51 H new ATOM 1230 N SER B 12 -13.911 2.678 -12.817 1.00 0.65 N ATOM 1231 CA SER B 12 -12.796 2.959 -13.722 1.00 0.65 C ATOM 1232 C SER B 12 -11.851 4.022 -13.160 1.00 0.62 C ATOM 1233 O SER B 12 -10.639 3.954 -13.358 1.00 0.61 O ATOM 1234 CB SER B 12 -13.355 3.413 -15.066 1.00 0.76 C ATOM 1235 OG SER B 12 -14.635 2.840 -15.291 1.00 1.24 O ATOM 0 H SER B 12 -14.827 2.728 -13.263 1.00 0.65 H new ATOM 0 HA SER B 12 -12.213 2.045 -13.841 1.00 0.65 H new ATOM 0 HB2 SER B 12 -13.428 4.500 -15.088 1.00 0.76 H new ATOM 0 HB3 SER B 12 -12.674 3.123 -15.866 1.00 0.76 H new ATOM 0 HG SER B 12 -14.981 3.142 -16.157 1.00 1.24 H new ATOM 1241 N GLU B 13 -12.421 4.987 -12.448 1.00 0.65 N ATOM 1242 CA GLU B 13 -11.662 6.078 -11.846 1.00 0.65 C ATOM 1243 C GLU B 13 -10.579 5.567 -10.893 1.00 0.61 C ATOM 1244 O GLU B 13 -9.568 6.230 -10.683 1.00 0.77 O ATOM 1245 CB GLU B 13 -12.604 7.011 -11.080 1.00 0.74 C ATOM 1246 CG GLU B 13 -13.729 7.590 -11.925 1.00 1.07 C ATOM 1247 CD GLU B 13 -14.991 6.746 -11.896 1.00 1.37 C ATOM 1248 OE1 GLU B 13 -15.000 5.663 -12.519 1.00 2.06 O ATOM 1249 OE2 GLU B 13 -15.985 7.172 -11.270 1.00 1.85 O ATOM 0 H GLU B 13 -13.424 5.036 -12.271 1.00 0.65 H new ATOM 0 HA GLU B 13 -11.173 6.617 -12.657 1.00 0.65 H new ATOM 0 HB2 GLU B 13 -13.038 6.464 -10.243 1.00 0.74 H new ATOM 0 HB3 GLU B 13 -12.022 7.831 -10.658 1.00 0.74 H new ATOM 0 HG2 GLU B 13 -13.962 8.594 -11.570 1.00 1.07 H new ATOM 0 HG3 GLU B 13 -13.388 7.688 -12.956 1.00 1.07 H new ATOM 1256 N LEU B 14 -10.794 4.389 -10.317 1.00 0.55 N ATOM 1257 CA LEU B 14 -9.835 3.822 -9.372 1.00 0.54 C ATOM 1258 C LEU B 14 -9.129 2.593 -9.937 1.00 0.49 C ATOM 1259 O LEU B 14 -8.021 2.263 -9.514 1.00 0.53 O ATOM 1260 CB LEU B 14 -10.543 3.452 -8.069 1.00 0.61 C ATOM 1261 CG LEU B 14 -11.291 4.599 -7.386 1.00 0.70 C ATOM 1262 CD1 LEU B 14 -12.052 4.086 -6.176 1.00 1.36 C ATOM 1263 CD2 LEU B 14 -10.324 5.705 -6.981 1.00 1.39 C ATOM 0 H LEU B 14 -11.617 3.811 -10.485 1.00 0.55 H new ATOM 0 HA LEU B 14 -9.077 4.582 -9.182 1.00 0.54 H new ATOM 0 HB2 LEU B 14 -11.251 2.649 -8.274 1.00 0.61 H new ATOM 0 HB3 LEU B 14 -9.804 3.056 -7.373 1.00 0.61 H new ATOM 0 HG LEU B 14 -12.007 5.015 -8.095 1.00 0.70 H new ATOM 0 HD11 LEU B 14 -12.579 4.913 -5.700 1.00 1.36 H new ATOM 0 HD12 LEU B 14 -12.772 3.331 -6.492 1.00 1.36 H new ATOM 0 HD13 LEU B 14 -11.352 3.646 -5.466 1.00 1.36 H new ATOM 0 HD21 LEU B 14 -10.875 6.511 -6.497 1.00 1.39 H new ATOM 0 HD22 LEU B 14 -9.583 5.305 -6.288 1.00 1.39 H new ATOM 0 HD23 LEU B 14 -9.821 6.091 -7.867 1.00 1.39 H new ATOM 1275 N LEU B 15 -9.762 1.934 -10.900 1.00 0.48 N ATOM 1276 CA LEU B 15 -9.204 0.726 -11.511 1.00 0.49 C ATOM 1277 C LEU B 15 -7.808 0.964 -12.085 1.00 0.56 C ATOM 1278 O LEU B 15 -6.951 0.079 -12.035 1.00 0.70 O ATOM 1279 CB LEU B 15 -10.127 0.214 -12.618 1.00 0.53 C ATOM 1280 CG LEU B 15 -11.442 -0.400 -12.144 1.00 0.51 C ATOM 1281 CD1 LEU B 15 -12.291 -0.818 -13.336 1.00 0.66 C ATOM 1282 CD2 LEU B 15 -11.179 -1.593 -11.238 1.00 0.56 C ATOM 0 H LEU B 15 -10.667 2.215 -11.279 1.00 0.48 H new ATOM 0 HA LEU B 15 -9.122 -0.021 -10.722 1.00 0.49 H new ATOM 0 HB2 LEU B 15 -10.354 1.042 -13.290 1.00 0.53 H new ATOM 0 HB3 LEU B 15 -9.587 -0.532 -13.202 1.00 0.53 H new ATOM 0 HG LEU B 15 -11.987 0.352 -11.574 1.00 0.51 H new ATOM 0 HD11 LEU B 15 -13.225 -1.254 -12.982 1.00 0.66 H new ATOM 0 HD12 LEU B 15 -12.508 0.055 -13.952 1.00 0.66 H new ATOM 0 HD13 LEU B 15 -11.748 -1.554 -13.929 1.00 0.66 H new ATOM 0 HD21 LEU B 15 -12.128 -2.017 -10.910 1.00 0.56 H new ATOM 0 HD22 LEU B 15 -10.614 -2.348 -11.785 1.00 0.56 H new ATOM 0 HD23 LEU B 15 -10.606 -1.270 -10.369 1.00 0.56 H new ATOM 1294 N SER B 16 -7.582 2.160 -12.612 1.00 0.57 N ATOM 1295 CA SER B 16 -6.301 2.518 -13.210 1.00 0.67 C ATOM 1296 C SER B 16 -5.154 2.493 -12.197 1.00 0.67 C ATOM 1297 O SER B 16 -3.988 2.364 -12.574 1.00 0.90 O ATOM 1298 CB SER B 16 -6.402 3.910 -13.832 1.00 0.75 C ATOM 1299 OG SER B 16 -7.730 4.178 -14.250 1.00 1.42 O ATOM 0 H SER B 16 -8.277 2.906 -12.638 1.00 0.57 H new ATOM 0 HA SER B 16 -6.077 1.773 -13.973 1.00 0.67 H new ATOM 0 HB2 SER B 16 -6.085 4.661 -13.108 1.00 0.75 H new ATOM 0 HB3 SER B 16 -5.726 3.983 -14.684 1.00 0.75 H new ATOM 0 HG SER B 16 -7.774 5.074 -14.644 1.00 1.42 H new ATOM 1305 N PHE B 17 -5.476 2.608 -10.916 1.00 0.58 N ATOM 1306 CA PHE B 17 -4.452 2.622 -9.881 1.00 0.63 C ATOM 1307 C PHE B 17 -4.404 1.301 -9.126 1.00 0.58 C ATOM 1308 O PHE B 17 -3.557 1.107 -8.255 1.00 0.74 O ATOM 1309 CB PHE B 17 -4.710 3.768 -8.904 1.00 0.77 C ATOM 1310 CG PHE B 17 -5.020 5.073 -9.580 1.00 0.58 C ATOM 1311 CD1 PHE B 17 -4.072 5.702 -10.373 1.00 0.50 C ATOM 1312 CD2 PHE B 17 -6.260 5.670 -9.423 1.00 0.67 C ATOM 1313 CE1 PHE B 17 -4.358 6.902 -10.995 1.00 0.49 C ATOM 1314 CE2 PHE B 17 -6.549 6.869 -10.042 1.00 0.58 C ATOM 1315 CZ PHE B 17 -5.597 7.485 -10.828 1.00 0.46 C ATOM 0 H PHE B 17 -6.432 2.692 -10.570 1.00 0.58 H new ATOM 0 HA PHE B 17 -3.488 2.768 -10.368 1.00 0.63 H new ATOM 0 HB2 PHE B 17 -5.541 3.499 -8.252 1.00 0.77 H new ATOM 0 HB3 PHE B 17 -3.834 3.896 -8.268 1.00 0.77 H new ATOM 0 HD1 PHE B 17 -3.100 5.249 -10.506 1.00 0.50 H new ATOM 0 HD2 PHE B 17 -7.009 5.192 -8.809 1.00 0.67 H new ATOM 0 HE1 PHE B 17 -3.613 7.383 -11.611 1.00 0.49 H new ATOM 0 HE2 PHE B 17 -7.519 7.325 -9.911 1.00 0.58 H new ATOM 0 HZ PHE B 17 -5.822 8.424 -11.313 1.00 0.46 H new ATOM 1325 N LEU B 18 -5.298 0.391 -9.471 1.00 0.48 N ATOM 1326 CA LEU B 18 -5.352 -0.903 -8.807 1.00 0.50 C ATOM 1327 C LEU B 18 -4.513 -1.932 -9.546 1.00 0.53 C ATOM 1328 O LEU B 18 -4.314 -1.834 -10.755 1.00 0.76 O ATOM 1329 CB LEU B 18 -6.794 -1.395 -8.714 1.00 0.49 C ATOM 1330 CG LEU B 18 -7.697 -0.574 -7.798 1.00 0.66 C ATOM 1331 CD1 LEU B 18 -9.143 -0.985 -7.988 1.00 1.27 C ATOM 1332 CD2 LEU B 18 -7.282 -0.738 -6.343 1.00 1.18 C ATOM 0 H LEU B 18 -5.995 0.522 -10.204 1.00 0.48 H new ATOM 0 HA LEU B 18 -4.947 -0.777 -7.803 1.00 0.50 H new ATOM 0 HB2 LEU B 18 -7.226 -1.401 -9.715 1.00 0.49 H new ATOM 0 HB3 LEU B 18 -6.788 -2.427 -8.364 1.00 0.49 H new ATOM 0 HG LEU B 18 -7.594 0.478 -8.062 1.00 0.66 H new ATOM 0 HD11 LEU B 18 -9.779 -0.393 -7.330 1.00 1.27 H new ATOM 0 HD12 LEU B 18 -9.436 -0.816 -9.024 1.00 1.27 H new ATOM 0 HD13 LEU B 18 -9.255 -2.042 -7.747 1.00 1.27 H new ATOM 0 HD21 LEU B 18 -7.939 -0.144 -5.708 1.00 1.18 H new ATOM 0 HD22 LEU B 18 -7.356 -1.788 -6.060 1.00 1.18 H new ATOM 0 HD23 LEU B 18 -6.253 -0.400 -6.218 1.00 1.18 H new ATOM 1344 N SER B 19 -4.028 -2.922 -8.814 1.00 0.56 N ATOM 1345 CA SER B 19 -3.222 -3.981 -9.400 1.00 0.60 C ATOM 1346 C SER B 19 -4.115 -4.962 -10.155 1.00 0.68 C ATOM 1347 O SER B 19 -3.632 -5.743 -10.976 1.00 1.40 O ATOM 1348 CB SER B 19 -2.431 -4.709 -8.309 1.00 0.76 C ATOM 1349 OG SER B 19 -1.340 -5.431 -8.856 1.00 1.58 O ATOM 0 H SER B 19 -4.179 -3.014 -7.809 1.00 0.56 H new ATOM 0 HA SER B 19 -2.516 -3.539 -10.103 1.00 0.60 H new ATOM 0 HB2 SER B 19 -2.063 -3.986 -7.581 1.00 0.76 H new ATOM 0 HB3 SER B 19 -3.090 -5.393 -7.774 1.00 0.76 H new ATOM 0 HG SER B 19 -0.853 -5.884 -8.136 1.00 1.58 H new ATOM 1355 N HIS B 20 -5.420 -4.899 -9.862 1.00 0.64 N ATOM 1356 CA HIS B 20 -6.436 -5.759 -10.487 1.00 0.65 C ATOM 1357 C HIS B 20 -6.319 -7.204 -10.011 1.00 0.71 C ATOM 1358 O HIS B 20 -7.279 -7.769 -9.490 1.00 1.24 O ATOM 1359 CB HIS B 20 -6.361 -5.706 -12.018 1.00 0.73 C ATOM 1360 CG HIS B 20 -6.919 -4.450 -12.611 1.00 0.72 C ATOM 1361 ND1 HIS B 20 -6.306 -3.422 -13.243 1.00 0.67 N flip ATOM 1362 CD2 HIS B 20 -8.264 -4.147 -12.611 1.00 0.91 C flip ATOM 1363 CE1 HIS B 20 -7.280 -2.531 -13.610 1.00 0.72 C flip ATOM 1364 NE2 HIS B 20 -8.451 -2.992 -13.218 1.00 0.88 N flip ATOM 0 H HIS B 20 -5.804 -4.245 -9.180 1.00 0.64 H new ATOM 0 HA HIS B 20 -7.406 -5.370 -10.177 1.00 0.65 H new ATOM 0 HB2 HIS B 20 -5.320 -5.809 -12.324 1.00 0.73 H new ATOM 0 HB3 HIS B 20 -6.900 -6.560 -12.428 1.00 0.73 H new ATOM 0 HD1 HIS B 20 -5.305 -3.328 -13.414 1.00 0.67 H new ATOM 0 HD2 HIS B 20 -9.042 -4.760 -12.181 1.00 0.91 H new ATOM 0 HE1 HIS B 20 -7.115 -1.602 -14.135 1.00 0.72 H new ATOM 1373 N ALA B 21 -5.145 -7.792 -10.199 1.00 0.70 N ATOM 1374 CA ALA B 21 -4.895 -9.165 -9.795 1.00 0.74 C ATOM 1375 C ALA B 21 -4.850 -9.288 -8.278 1.00 0.73 C ATOM 1376 O ALA B 21 -4.314 -8.418 -7.588 1.00 0.98 O ATOM 1377 CB ALA B 21 -3.592 -9.662 -10.403 1.00 0.83 C ATOM 0 H ALA B 21 -4.345 -7.332 -10.633 1.00 0.70 H new ATOM 0 HA ALA B 21 -5.715 -9.783 -10.161 1.00 0.74 H new ATOM 0 HB1 ALA B 21 -3.415 -10.692 -10.093 1.00 0.83 H new ATOM 0 HB2 ALA B 21 -3.657 -9.616 -11.490 1.00 0.83 H new ATOM 0 HB3 ALA B 21 -2.769 -9.034 -10.062 1.00 0.83 H new ATOM 1383 N VAL B 22 -5.420 -10.367 -7.768 1.00 0.72 N ATOM 1384 CA VAL B 22 -5.448 -10.614 -6.337 1.00 0.78 C ATOM 1385 C VAL B 22 -4.499 -11.751 -5.983 1.00 0.74 C ATOM 1386 O VAL B 22 -3.780 -11.696 -4.983 1.00 0.83 O ATOM 1387 CB VAL B 22 -6.876 -10.956 -5.856 1.00 0.99 C ATOM 1388 CG1 VAL B 22 -6.876 -11.372 -4.394 1.00 1.14 C ATOM 1389 CG2 VAL B 22 -7.805 -9.769 -6.069 1.00 1.16 C ATOM 0 H VAL B 22 -5.872 -11.090 -8.328 1.00 0.72 H new ATOM 0 HA VAL B 22 -5.126 -9.703 -5.833 1.00 0.78 H new ATOM 0 HB VAL B 22 -7.239 -11.797 -6.446 1.00 0.99 H new ATOM 0 HG11 VAL B 22 -7.894 -11.607 -4.083 1.00 1.14 H new ATOM 0 HG12 VAL B 22 -6.245 -12.252 -4.266 1.00 1.14 H new ATOM 0 HG13 VAL B 22 -6.489 -10.556 -3.784 1.00 1.14 H new ATOM 0 HG21 VAL B 22 -8.807 -10.025 -5.725 1.00 1.16 H new ATOM 0 HG22 VAL B 22 -7.436 -8.912 -5.505 1.00 1.16 H new ATOM 0 HG23 VAL B 22 -7.838 -9.518 -7.129 1.00 1.16 H new ATOM 1399 N PHE B 23 -4.481 -12.773 -6.824 1.00 0.79 N ATOM 1400 CA PHE B 23 -3.627 -13.928 -6.603 1.00 0.84 C ATOM 1401 C PHE B 23 -2.355 -13.814 -7.431 1.00 0.90 C ATOM 1402 O PHE B 23 -2.173 -14.520 -8.426 1.00 1.43 O ATOM 1403 CB PHE B 23 -4.379 -15.217 -6.939 1.00 0.96 C ATOM 1404 CG PHE B 23 -5.634 -15.393 -6.131 1.00 1.14 C ATOM 1405 CD1 PHE B 23 -5.581 -15.923 -4.853 1.00 1.29 C ATOM 1406 CD2 PHE B 23 -6.865 -15.021 -6.647 1.00 2.06 C ATOM 1407 CE1 PHE B 23 -6.731 -16.080 -4.106 1.00 1.49 C ATOM 1408 CE2 PHE B 23 -8.019 -15.177 -5.902 1.00 2.41 C ATOM 1409 CZ PHE B 23 -7.951 -15.707 -4.630 1.00 1.85 C ATOM 0 H PHE B 23 -5.050 -12.825 -7.669 1.00 0.79 H new ATOM 0 HA PHE B 23 -3.347 -13.959 -5.550 1.00 0.84 H new ATOM 0 HB2 PHE B 23 -4.633 -15.217 -7.999 1.00 0.96 H new ATOM 0 HB3 PHE B 23 -3.721 -16.070 -6.769 1.00 0.96 H new ATOM 0 HD1 PHE B 23 -4.629 -16.217 -4.436 1.00 1.29 H new ATOM 0 HD2 PHE B 23 -6.924 -14.605 -7.642 1.00 2.06 H new ATOM 0 HE1 PHE B 23 -6.675 -16.495 -3.111 1.00 1.49 H new ATOM 0 HE2 PHE B 23 -8.973 -14.884 -6.315 1.00 2.41 H new ATOM 0 HZ PHE B 23 -8.851 -15.830 -4.046 1.00 1.85 H new ATOM 1419 N SER B 24 -1.489 -12.900 -7.026 1.00 0.72 N ATOM 1420 CA SER B 24 -0.227 -12.673 -7.709 1.00 0.75 C ATOM 1421 C SER B 24 0.828 -12.208 -6.714 1.00 0.71 C ATOM 1422 O SER B 24 0.495 -11.734 -5.623 1.00 0.80 O ATOM 1423 CB SER B 24 -0.399 -11.642 -8.826 1.00 0.80 C ATOM 1424 OG SER B 24 -1.205 -12.162 -9.873 1.00 1.50 O ATOM 0 H SER B 24 -1.640 -12.297 -6.218 1.00 0.72 H new ATOM 0 HA SER B 24 0.102 -13.611 -8.157 1.00 0.75 H new ATOM 0 HB2 SER B 24 -0.856 -10.737 -8.425 1.00 0.80 H new ATOM 0 HB3 SER B 24 0.577 -11.359 -9.219 1.00 0.80 H new ATOM 0 HG SER B 24 -1.304 -11.486 -10.576 1.00 1.50 H new ATOM 1430 N ASN B 25 2.092 -12.342 -7.092 1.00 0.75 N ATOM 1431 CA ASN B 25 3.192 -11.948 -6.227 1.00 0.77 C ATOM 1432 C ASN B 25 3.385 -10.439 -6.249 1.00 0.72 C ATOM 1433 O ASN B 25 4.152 -9.907 -7.051 1.00 1.24 O ATOM 1434 CB ASN B 25 4.491 -12.648 -6.637 1.00 0.97 C ATOM 1435 CG ASN B 25 5.613 -12.401 -5.646 1.00 1.64 C ATOM 1436 OD1 ASN B 25 5.375 -12.245 -4.447 1.00 2.39 O ATOM 1437 ND2 ASN B 25 6.843 -12.361 -6.140 1.00 2.29 N ATOM 0 H ASN B 25 2.380 -12.721 -7.994 1.00 0.75 H new ATOM 0 HA ASN B 25 2.939 -12.253 -5.212 1.00 0.77 H new ATOM 0 HB2 ASN B 25 4.313 -13.720 -6.722 1.00 0.97 H new ATOM 0 HB3 ASN B 25 4.795 -12.297 -7.623 1.00 0.97 H new ATOM 0 HD21 ASN B 25 7.636 -12.196 -5.520 1.00 2.29 H new ATOM 0 HD22 ASN B 25 6.996 -12.495 -7.140 1.00 2.29 H new ATOM 1444 N ARG B 26 2.647 -9.758 -5.389 1.00 0.92 N ATOM 1445 CA ARG B 26 2.727 -8.312 -5.270 1.00 0.91 C ATOM 1446 C ARG B 26 2.604 -7.927 -3.804 1.00 0.76 C ATOM 1447 O ARG B 26 1.510 -7.941 -3.235 1.00 0.90 O ATOM 1448 CB ARG B 26 1.634 -7.628 -6.102 1.00 1.08 C ATOM 1449 CG ARG B 26 1.912 -7.627 -7.600 1.00 1.58 C ATOM 1450 CD ARG B 26 3.088 -6.723 -7.953 1.00 2.12 C ATOM 1451 NE ARG B 26 2.703 -5.311 -7.987 1.00 2.63 N ATOM 1452 CZ ARG B 26 3.573 -4.298 -8.012 1.00 3.06 C ATOM 1453 NH1 ARG B 26 4.880 -4.529 -8.013 1.00 3.46 N ATOM 1454 NH2 ARG B 26 3.129 -3.048 -8.047 1.00 3.65 N ATOM 0 H ARG B 26 1.976 -10.191 -4.754 1.00 0.92 H new ATOM 0 HA ARG B 26 3.689 -7.976 -5.656 1.00 0.91 H new ATOM 0 HB2 ARG B 26 0.684 -8.129 -5.919 1.00 1.08 H new ATOM 0 HB3 ARG B 26 1.522 -6.598 -5.762 1.00 1.08 H new ATOM 0 HG2 ARG B 26 2.122 -8.644 -7.932 1.00 1.58 H new ATOM 0 HG3 ARG B 26 1.023 -7.294 -8.135 1.00 1.58 H new ATOM 0 HD2 ARG B 26 3.885 -6.864 -7.223 1.00 2.12 H new ATOM 0 HD3 ARG B 26 3.489 -7.013 -8.924 1.00 2.12 H new ATOM 0 HE ARG B 26 1.708 -5.087 -7.992 1.00 2.63 H new ATOM 0 HH11 ARG B 26 5.229 -5.487 -7.995 1.00 3.46 H new ATOM 0 HH12 ARG B 26 5.536 -3.748 -8.032 1.00 3.46 H new ATOM 0 HH21 ARG B 26 2.126 -2.863 -8.055 1.00 3.65 H new ATOM 0 HH22 ARG B 26 3.791 -2.272 -8.066 1.00 3.65 H new ATOM 1468 N THR B 27 3.732 -7.611 -3.193 1.00 0.62 N ATOM 1469 CA THR B 27 3.777 -7.237 -1.790 1.00 0.52 C ATOM 1470 C THR B 27 3.437 -5.758 -1.602 1.00 0.50 C ATOM 1471 O THR B 27 4.191 -4.995 -0.992 1.00 0.70 O ATOM 1472 CB THR B 27 5.172 -7.536 -1.219 1.00 0.59 C ATOM 1473 OG1 THR B 27 5.987 -8.137 -2.236 1.00 0.73 O ATOM 1474 CG2 THR B 27 5.086 -8.473 -0.027 1.00 0.78 C ATOM 0 H THR B 27 4.642 -7.606 -3.654 1.00 0.62 H new ATOM 0 HA THR B 27 3.032 -7.824 -1.253 1.00 0.52 H new ATOM 0 HB THR B 27 5.615 -6.596 -0.889 1.00 0.59 H new ATOM 0 HG1 THR B 27 6.770 -8.557 -1.822 1.00 0.73 H new ATOM 0 HG21 THR B 27 6.088 -8.667 0.356 1.00 0.78 H new ATOM 0 HG22 THR B 27 4.481 -8.013 0.754 1.00 0.78 H new ATOM 0 HG23 THR B 27 4.627 -9.413 -0.335 1.00 0.78 H new ATOM 1482 N LEU B 28 2.281 -5.373 -2.122 1.00 0.50 N ATOM 1483 CA LEU B 28 1.812 -3.998 -2.050 1.00 0.55 C ATOM 1484 C LEU B 28 1.625 -3.543 -0.606 1.00 0.49 C ATOM 1485 O LEU B 28 1.383 -4.351 0.292 1.00 0.64 O ATOM 1486 CB LEU B 28 0.505 -3.856 -2.829 1.00 0.77 C ATOM 1487 CG LEU B 28 0.608 -4.194 -4.318 1.00 0.63 C ATOM 1488 CD1 LEU B 28 -0.768 -4.220 -4.959 1.00 1.28 C ATOM 1489 CD2 LEU B 28 1.509 -3.195 -5.028 1.00 1.33 C ATOM 0 H LEU B 28 1.642 -6.005 -2.605 1.00 0.50 H new ATOM 0 HA LEU B 28 2.571 -3.357 -2.498 1.00 0.55 H new ATOM 0 HB2 LEU B 28 -0.245 -4.503 -2.375 1.00 0.77 H new ATOM 0 HB3 LEU B 28 0.146 -2.832 -2.727 1.00 0.77 H new ATOM 0 HG LEU B 28 1.048 -5.187 -4.415 1.00 0.63 H new ATOM 0 HD11 LEU B 28 -0.672 -4.462 -6.017 1.00 1.28 H new ATOM 0 HD12 LEU B 28 -1.384 -4.974 -4.469 1.00 1.28 H new ATOM 0 HD13 LEU B 28 -1.238 -3.242 -4.852 1.00 1.28 H new ATOM 0 HD21 LEU B 28 1.572 -3.449 -6.086 1.00 1.33 H new ATOM 0 HD22 LEU B 28 1.096 -2.192 -4.920 1.00 1.33 H new ATOM 0 HD23 LEU B 28 2.506 -3.227 -4.588 1.00 1.33 H new ATOM 1501 N ALA B 29 1.747 -2.241 -0.389 1.00 0.47 N ATOM 1502 CA ALA B 29 1.606 -1.677 0.944 1.00 0.45 C ATOM 1503 C ALA B 29 0.227 -1.066 1.145 1.00 0.45 C ATOM 1504 O ALA B 29 -0.245 -0.936 2.273 1.00 0.62 O ATOM 1505 CB ALA B 29 2.686 -0.636 1.189 1.00 0.56 C ATOM 0 H ALA B 29 1.943 -1.556 -1.119 1.00 0.47 H new ATOM 0 HA ALA B 29 1.720 -2.486 1.666 1.00 0.45 H new ATOM 0 HB1 ALA B 29 2.570 -0.221 2.190 1.00 0.56 H new ATOM 0 HB2 ALA B 29 3.667 -1.102 1.101 1.00 0.56 H new ATOM 0 HB3 ALA B 29 2.596 0.162 0.452 1.00 0.56 H new ATOM 1511 N CYS B 30 -0.420 -0.699 0.053 1.00 0.40 N ATOM 1512 CA CYS B 30 -1.740 -0.098 0.126 1.00 0.41 C ATOM 1513 C CYS B 30 -2.783 -0.984 -0.536 1.00 0.37 C ATOM 1514 O CYS B 30 -2.573 -1.503 -1.635 1.00 0.42 O ATOM 1515 CB CYS B 30 -1.737 1.291 -0.515 1.00 0.55 C ATOM 1516 SG CYS B 30 -1.196 2.607 0.602 1.00 0.75 S ATOM 0 H CYS B 30 -0.054 -0.806 -0.893 1.00 0.40 H new ATOM 0 HA CYS B 30 -2.002 0.005 1.179 1.00 0.41 H new ATOM 0 HB2 CYS B 30 -1.085 1.277 -1.388 1.00 0.55 H new ATOM 0 HB3 CYS B 30 -2.742 1.519 -0.871 1.00 0.55 H new ATOM 0 HG CYS B 30 -1.889 3.683 0.373 1.00 0.75 H new ATOM 1522 N PHE B 31 -3.902 -1.159 0.148 1.00 0.35 N ATOM 1523 CA PHE B 31 -4.993 -1.973 -0.354 1.00 0.40 C ATOM 1524 C PHE B 31 -6.300 -1.215 -0.205 1.00 0.37 C ATOM 1525 O PHE B 31 -6.456 -0.414 0.720 1.00 0.42 O ATOM 1526 CB PHE B 31 -5.074 -3.304 0.399 1.00 0.51 C ATOM 1527 CG PHE B 31 -3.867 -4.179 0.216 1.00 0.50 C ATOM 1528 CD1 PHE B 31 -2.780 -4.071 1.070 1.00 1.15 C ATOM 1529 CD2 PHE B 31 -3.820 -5.106 -0.810 1.00 1.12 C ATOM 1530 CE1 PHE B 31 -1.670 -4.872 0.901 1.00 1.26 C ATOM 1531 CE2 PHE B 31 -2.712 -5.910 -0.984 1.00 1.04 C ATOM 1532 CZ PHE B 31 -1.635 -5.793 -0.128 1.00 0.60 C ATOM 0 H PHE B 31 -4.078 -0.742 1.062 1.00 0.35 H new ATOM 0 HA PHE B 31 -4.811 -2.188 -1.407 1.00 0.40 H new ATOM 0 HB2 PHE B 31 -5.207 -3.102 1.462 1.00 0.51 H new ATOM 0 HB3 PHE B 31 -5.958 -3.846 0.065 1.00 0.51 H new ATOM 0 HD1 PHE B 31 -2.803 -3.352 1.876 1.00 1.15 H new ATOM 0 HD2 PHE B 31 -4.660 -5.201 -1.482 1.00 1.12 H new ATOM 0 HE1 PHE B 31 -0.829 -4.779 1.572 1.00 1.26 H new ATOM 0 HE2 PHE B 31 -2.687 -6.630 -1.789 1.00 1.04 H new ATOM 0 HZ PHE B 31 -0.766 -6.421 -0.263 1.00 0.60 H new ATOM 1542 N ALA B 32 -7.224 -1.456 -1.116 1.00 0.41 N ATOM 1543 CA ALA B 32 -8.514 -0.796 -1.078 1.00 0.45 C ATOM 1544 C ALA B 32 -9.630 -1.821 -0.952 1.00 0.43 C ATOM 1545 O ALA B 32 -9.622 -2.854 -1.628 1.00 0.47 O ATOM 1546 CB ALA B 32 -8.712 0.061 -2.318 1.00 0.54 C ATOM 0 H ALA B 32 -7.104 -2.106 -1.893 1.00 0.41 H new ATOM 0 HA ALA B 32 -8.544 -0.145 -0.204 1.00 0.45 H new ATOM 0 HB1 ALA B 32 -9.686 0.548 -2.272 1.00 0.54 H new ATOM 0 HB2 ALA B 32 -7.929 0.818 -2.366 1.00 0.54 H new ATOM 0 HB3 ALA B 32 -8.663 -0.568 -3.207 1.00 0.54 H new ATOM 1552 N ILE B 33 -10.570 -1.550 -0.063 1.00 0.44 N ATOM 1553 CA ILE B 33 -11.696 -2.442 0.150 1.00 0.45 C ATOM 1554 C ILE B 33 -13.014 -1.713 -0.092 1.00 0.46 C ATOM 1555 O ILE B 33 -13.442 -0.891 0.720 1.00 0.79 O ATOM 1556 CB ILE B 33 -11.704 -3.038 1.577 1.00 0.50 C ATOM 1557 CG1 ILE B 33 -10.355 -3.690 1.900 1.00 0.56 C ATOM 1558 CG2 ILE B 33 -12.831 -4.053 1.715 1.00 0.61 C ATOM 1559 CD1 ILE B 33 -10.282 -4.271 3.296 1.00 1.04 C ATOM 0 H ILE B 33 -10.575 -0.716 0.525 1.00 0.44 H new ATOM 0 HA ILE B 33 -11.588 -3.259 -0.564 1.00 0.45 H new ATOM 0 HB ILE B 33 -11.870 -2.229 2.288 1.00 0.50 H new ATOM 0 HG12 ILE B 33 -10.160 -4.481 1.176 1.00 0.56 H new ATOM 0 HG13 ILE B 33 -9.565 -2.948 1.782 1.00 0.56 H new ATOM 0 HG21 ILE B 33 -12.827 -4.466 2.724 1.00 0.61 H new ATOM 0 HG22 ILE B 33 -13.787 -3.563 1.527 1.00 0.61 H new ATOM 0 HG23 ILE B 33 -12.687 -4.857 0.993 1.00 0.61 H new ATOM 0 HD11 ILE B 33 -9.299 -4.715 3.454 1.00 1.04 H new ATOM 0 HD12 ILE B 33 -10.445 -3.480 4.028 1.00 1.04 H new ATOM 0 HD13 ILE B 33 -11.049 -5.036 3.412 1.00 1.04 H new ATOM 1571 N TYR B 34 -13.640 -2.001 -1.221 1.00 0.31 N ATOM 1572 CA TYR B 34 -14.916 -1.397 -1.560 1.00 0.32 C ATOM 1573 C TYR B 34 -16.026 -2.205 -0.903 1.00 0.32 C ATOM 1574 O TYR B 34 -16.288 -3.342 -1.295 1.00 0.37 O ATOM 1575 CB TYR B 34 -15.098 -1.356 -3.083 1.00 0.36 C ATOM 1576 CG TYR B 34 -16.338 -0.617 -3.535 1.00 0.35 C ATOM 1577 CD1 TYR B 34 -16.310 0.752 -3.769 1.00 1.42 C ATOM 1578 CD2 TYR B 34 -17.534 -1.290 -3.727 1.00 1.05 C ATOM 1579 CE1 TYR B 34 -17.444 1.429 -4.177 1.00 1.46 C ATOM 1580 CE2 TYR B 34 -18.669 -0.624 -4.137 1.00 1.02 C ATOM 1581 CZ TYR B 34 -18.621 0.735 -4.361 1.00 0.43 C ATOM 1582 OH TYR B 34 -19.762 1.402 -4.757 1.00 0.50 O ATOM 0 H TYR B 34 -13.283 -2.652 -1.920 1.00 0.31 H new ATOM 0 HA TYR B 34 -14.951 -0.371 -1.195 1.00 0.32 H new ATOM 0 HB2 TYR B 34 -14.223 -0.884 -3.531 1.00 0.36 H new ATOM 0 HB3 TYR B 34 -15.138 -2.377 -3.461 1.00 0.36 H new ATOM 0 HD1 TYR B 34 -15.387 1.296 -3.630 1.00 1.42 H new ATOM 0 HD2 TYR B 34 -17.578 -2.355 -3.552 1.00 1.05 H new ATOM 0 HE1 TYR B 34 -17.408 2.494 -4.350 1.00 1.46 H new ATOM 0 HE2 TYR B 34 -19.592 -1.165 -4.282 1.00 1.02 H new ATOM 0 HH TYR B 34 -19.983 1.153 -5.679 1.00 0.50 H new ATOM 1592 N THR B 35 -16.661 -1.631 0.108 1.00 0.35 N ATOM 1593 CA THR B 35 -17.714 -2.327 0.830 1.00 0.40 C ATOM 1594 C THR B 35 -18.748 -1.353 1.388 1.00 0.31 C ATOM 1595 O THR B 35 -18.917 -0.246 0.878 1.00 0.36 O ATOM 1596 CB THR B 35 -17.120 -3.144 1.993 1.00 0.55 C ATOM 1597 OG1 THR B 35 -16.004 -2.446 2.557 1.00 0.95 O ATOM 1598 CG2 THR B 35 -16.675 -4.519 1.529 1.00 0.34 C ATOM 0 H THR B 35 -16.466 -0.688 0.446 1.00 0.35 H new ATOM 0 HA THR B 35 -18.205 -2.993 0.121 1.00 0.40 H new ATOM 0 HB THR B 35 -17.897 -3.271 2.747 1.00 0.55 H new ATOM 0 HG1 THR B 35 -15.631 -2.969 3.297 1.00 0.95 H new ATOM 0 HG21 THR B 35 -16.260 -5.071 2.372 1.00 0.34 H new ATOM 0 HG22 THR B 35 -17.530 -5.061 1.125 1.00 0.34 H new ATOM 0 HG23 THR B 35 -15.914 -4.413 0.755 1.00 0.34 H new ATOM 1606 N THR B 36 -19.448 -1.780 2.427 1.00 0.32 N ATOM 1607 CA THR B 36 -20.450 -0.956 3.071 1.00 0.33 C ATOM 1608 C THR B 36 -19.795 -0.071 4.129 1.00 0.28 C ATOM 1609 O THR B 36 -18.717 -0.399 4.628 1.00 0.29 O ATOM 1610 CB THR B 36 -21.524 -1.842 3.723 1.00 0.43 C ATOM 1611 OG1 THR B 36 -20.999 -3.164 3.919 1.00 0.73 O ATOM 1612 CG2 THR B 36 -22.769 -1.916 2.853 1.00 0.66 C ATOM 0 H THR B 36 -19.336 -2.704 2.844 1.00 0.32 H new ATOM 0 HA THR B 36 -20.922 -0.324 2.319 1.00 0.33 H new ATOM 0 HB THR B 36 -21.798 -1.403 4.682 1.00 0.43 H new ATOM 0 HG1 THR B 36 -21.683 -3.729 4.336 1.00 0.73 H new ATOM 0 HG21 THR B 36 -23.514 -2.549 3.336 1.00 0.66 H new ATOM 0 HG22 THR B 36 -23.177 -0.915 2.716 1.00 0.66 H new ATOM 0 HG23 THR B 36 -22.510 -2.338 1.882 1.00 0.66 H new ATOM 1620 N LYS B 37 -20.439 1.038 4.473 1.00 0.33 N ATOM 1621 CA LYS B 37 -19.893 1.958 5.469 1.00 0.38 C ATOM 1622 C LYS B 37 -19.699 1.260 6.812 1.00 0.36 C ATOM 1623 O LYS B 37 -18.671 1.434 7.467 1.00 0.40 O ATOM 1624 CB LYS B 37 -20.801 3.180 5.635 1.00 0.50 C ATOM 1625 CG LYS B 37 -22.230 2.949 5.178 1.00 0.63 C ATOM 1626 CD LYS B 37 -23.145 4.078 5.613 1.00 0.91 C ATOM 1627 CE LYS B 37 -24.556 3.881 5.088 1.00 1.37 C ATOM 1628 NZ LYS B 37 -25.061 2.505 5.343 1.00 1.92 N ATOM 0 H LYS B 37 -21.336 1.323 4.080 1.00 0.33 H new ATOM 0 HA LYS B 37 -18.919 2.293 5.113 1.00 0.38 H new ATOM 0 HB2 LYS B 37 -20.808 3.475 6.684 1.00 0.50 H new ATOM 0 HB3 LYS B 37 -20.380 4.013 5.072 1.00 0.50 H new ATOM 0 HG2 LYS B 37 -22.255 2.858 4.092 1.00 0.63 H new ATOM 0 HG3 LYS B 37 -22.595 2.006 5.586 1.00 0.63 H new ATOM 0 HD2 LYS B 37 -23.165 4.134 6.701 1.00 0.91 H new ATOM 0 HD3 LYS B 37 -22.750 5.028 5.252 1.00 0.91 H new ATOM 0 HE2 LYS B 37 -25.222 4.604 5.559 1.00 1.37 H new ATOM 0 HE3 LYS B 37 -24.575 4.081 4.017 1.00 1.37 H new ATOM 0 HZ1 LYS B 37 -26.089 2.479 5.190 1.00 1.92 H new ATOM 0 HZ2 LYS B 37 -24.597 1.839 4.693 1.00 1.92 H new ATOM 0 HZ3 LYS B 37 -24.850 2.234 6.325 1.00 1.92 H new ATOM 1642 N GLU B 38 -20.680 0.452 7.198 1.00 0.36 N ATOM 1643 CA GLU B 38 -20.635 -0.282 8.457 1.00 0.40 C ATOM 1644 C GLU B 38 -19.458 -1.249 8.475 1.00 0.38 C ATOM 1645 O GLU B 38 -18.765 -1.388 9.486 1.00 0.51 O ATOM 1646 CB GLU B 38 -21.938 -1.061 8.672 1.00 0.46 C ATOM 1647 CG GLU B 38 -23.169 -0.181 8.847 1.00 1.24 C ATOM 1648 CD GLU B 38 -23.605 0.500 7.563 1.00 1.81 C ATOM 1649 OE1 GLU B 38 -23.246 0.015 6.468 1.00 2.37 O ATOM 1650 OE2 GLU B 38 -24.297 1.534 7.647 1.00 2.44 O ATOM 0 H GLU B 38 -21.525 0.288 6.650 1.00 0.36 H new ATOM 0 HA GLU B 38 -20.513 0.442 9.263 1.00 0.40 H new ATOM 0 HB2 GLU B 38 -22.097 -1.724 7.821 1.00 0.46 H new ATOM 0 HB3 GLU B 38 -21.829 -1.694 9.553 1.00 0.46 H new ATOM 0 HG2 GLU B 38 -23.991 -0.789 9.226 1.00 1.24 H new ATOM 0 HG3 GLU B 38 -22.961 0.578 9.601 1.00 1.24 H new ATOM 1657 N LYS B 39 -19.236 -1.903 7.344 1.00 0.31 N ATOM 1658 CA LYS B 39 -18.155 -2.867 7.206 1.00 0.33 C ATOM 1659 C LYS B 39 -16.798 -2.173 7.251 1.00 0.30 C ATOM 1660 O LYS B 39 -15.891 -2.606 7.966 1.00 0.34 O ATOM 1661 CB LYS B 39 -18.309 -3.624 5.891 1.00 0.38 C ATOM 1662 CG LYS B 39 -17.496 -4.900 5.822 1.00 1.10 C ATOM 1663 CD LYS B 39 -17.827 -5.678 4.567 1.00 1.24 C ATOM 1664 CE LYS B 39 -17.375 -7.120 4.664 1.00 1.66 C ATOM 1665 NZ LYS B 39 -18.286 -8.021 3.912 1.00 2.36 N ATOM 0 H LYS B 39 -19.797 -1.781 6.501 1.00 0.31 H new ATOM 0 HA LYS B 39 -18.207 -3.568 8.039 1.00 0.33 H new ATOM 0 HB2 LYS B 39 -19.361 -3.866 5.743 1.00 0.38 H new ATOM 0 HB3 LYS B 39 -18.014 -2.971 5.070 1.00 0.38 H new ATOM 0 HG2 LYS B 39 -16.433 -4.661 5.838 1.00 1.10 H new ATOM 0 HG3 LYS B 39 -17.698 -5.514 6.700 1.00 1.10 H new ATOM 0 HD2 LYS B 39 -18.902 -5.645 4.392 1.00 1.24 H new ATOM 0 HD3 LYS B 39 -17.350 -5.204 3.709 1.00 1.24 H new ATOM 0 HE2 LYS B 39 -16.362 -7.213 4.272 1.00 1.66 H new ATOM 0 HE3 LYS B 39 -17.341 -7.424 5.710 1.00 1.66 H new ATOM 0 HZ1 LYS B 39 -18.172 -8.996 4.256 1.00 2.36 H new ATOM 0 HZ2 LYS B 39 -19.270 -7.717 4.054 1.00 2.36 H new ATOM 0 HZ3 LYS B 39 -18.054 -7.982 2.899 1.00 2.36 H new ATOM 1679 N ALA B 40 -16.673 -1.090 6.495 1.00 0.27 N ATOM 1680 CA ALA B 40 -15.433 -0.328 6.446 1.00 0.29 C ATOM 1681 C ALA B 40 -15.104 0.261 7.813 1.00 0.28 C ATOM 1682 O ALA B 40 -13.939 0.424 8.165 1.00 0.35 O ATOM 1683 CB ALA B 40 -15.528 0.770 5.397 1.00 0.35 C ATOM 0 H ALA B 40 -17.418 -0.719 5.906 1.00 0.27 H new ATOM 0 HA ALA B 40 -14.625 -1.005 6.167 1.00 0.29 H new ATOM 0 HB1 ALA B 40 -14.594 1.331 5.372 1.00 0.35 H new ATOM 0 HB2 ALA B 40 -15.710 0.324 4.419 1.00 0.35 H new ATOM 0 HB3 ALA B 40 -16.348 1.442 5.647 1.00 0.35 H new ATOM 1689 N ALA B 41 -16.141 0.581 8.578 1.00 0.32 N ATOM 1690 CA ALA B 41 -15.964 1.136 9.914 1.00 0.34 C ATOM 1691 C ALA B 41 -15.430 0.077 10.873 1.00 0.33 C ATOM 1692 O ALA B 41 -14.662 0.379 11.784 1.00 0.40 O ATOM 1693 CB ALA B 41 -17.274 1.708 10.430 1.00 0.41 C ATOM 0 H ALA B 41 -17.114 0.465 8.295 1.00 0.32 H new ATOM 0 HA ALA B 41 -15.233 1.942 9.854 1.00 0.34 H new ATOM 0 HB1 ALA B 41 -17.124 2.118 11.429 1.00 0.41 H new ATOM 0 HB2 ALA B 41 -17.615 2.498 9.761 1.00 0.41 H new ATOM 0 HB3 ALA B 41 -18.025 0.919 10.471 1.00 0.41 H new ATOM 1699 N LEU B 42 -15.839 -1.166 10.655 1.00 0.33 N ATOM 1700 CA LEU B 42 -15.401 -2.275 11.493 1.00 0.37 C ATOM 1701 C LEU B 42 -13.957 -2.647 11.173 1.00 0.35 C ATOM 1702 O LEU B 42 -13.124 -2.793 12.068 1.00 0.48 O ATOM 1703 CB LEU B 42 -16.306 -3.492 11.286 1.00 0.46 C ATOM 1704 CG LEU B 42 -17.748 -3.329 11.774 1.00 1.00 C ATOM 1705 CD1 LEU B 42 -18.604 -4.483 11.280 1.00 1.73 C ATOM 1706 CD2 LEU B 42 -17.790 -3.244 13.293 1.00 1.53 C ATOM 0 H LEU B 42 -16.475 -1.432 9.903 1.00 0.33 H new ATOM 0 HA LEU B 42 -15.463 -1.960 12.535 1.00 0.37 H new ATOM 0 HB2 LEU B 42 -16.325 -3.733 10.223 1.00 0.46 H new ATOM 0 HB3 LEU B 42 -15.861 -4.345 11.798 1.00 0.46 H new ATOM 0 HG LEU B 42 -18.150 -2.401 11.368 1.00 1.00 H new ATOM 0 HD11 LEU B 42 -19.627 -4.355 11.634 1.00 1.73 H new ATOM 0 HD12 LEU B 42 -18.597 -4.501 10.190 1.00 1.73 H new ATOM 0 HD13 LEU B 42 -18.203 -5.422 11.661 1.00 1.73 H new ATOM 0 HD21 LEU B 42 -18.823 -3.128 13.623 1.00 1.53 H new ATOM 0 HD22 LEU B 42 -17.373 -4.156 13.720 1.00 1.53 H new ATOM 0 HD23 LEU B 42 -17.205 -2.387 13.626 1.00 1.53 H new ATOM 1718 N LEU B 43 -13.665 -2.777 9.883 1.00 0.36 N ATOM 1719 CA LEU B 43 -12.327 -3.137 9.427 1.00 0.38 C ATOM 1720 C LEU B 43 -11.343 -1.995 9.659 1.00 0.36 C ATOM 1721 O LEU B 43 -10.131 -2.205 9.659 1.00 0.45 O ATOM 1722 CB LEU B 43 -12.355 -3.517 7.943 1.00 0.47 C ATOM 1723 CG LEU B 43 -12.970 -4.883 7.630 1.00 0.55 C ATOM 1724 CD1 LEU B 43 -13.212 -5.027 6.137 1.00 1.07 C ATOM 1725 CD2 LEU B 43 -12.066 -5.998 8.132 1.00 0.76 C ATOM 0 H LEU B 43 -14.341 -2.638 9.132 1.00 0.36 H new ATOM 0 HA LEU B 43 -11.993 -3.997 10.007 1.00 0.38 H new ATOM 0 HB2 LEU B 43 -12.911 -2.753 7.400 1.00 0.47 H new ATOM 0 HB3 LEU B 43 -11.334 -3.500 7.561 1.00 0.47 H new ATOM 0 HG LEU B 43 -13.929 -4.957 8.143 1.00 0.55 H new ATOM 0 HD11 LEU B 43 -13.650 -6.004 5.932 1.00 1.07 H new ATOM 0 HD12 LEU B 43 -13.895 -4.246 5.802 1.00 1.07 H new ATOM 0 HD13 LEU B 43 -12.266 -4.934 5.604 1.00 1.07 H new ATOM 0 HD21 LEU B 43 -12.517 -6.963 7.902 1.00 0.76 H new ATOM 0 HD22 LEU B 43 -11.094 -5.926 7.644 1.00 0.76 H new ATOM 0 HD23 LEU B 43 -11.938 -5.905 9.210 1.00 0.76 H new ATOM 1737 N TYR B 44 -11.881 -0.794 9.857 1.00 0.41 N ATOM 1738 CA TYR B 44 -11.077 0.400 10.098 1.00 0.45 C ATOM 1739 C TYR B 44 -10.121 0.184 11.268 1.00 0.43 C ATOM 1740 O TYR B 44 -8.910 0.352 11.136 1.00 0.45 O ATOM 1741 CB TYR B 44 -11.997 1.591 10.389 1.00 0.56 C ATOM 1742 CG TYR B 44 -11.367 2.945 10.152 1.00 0.50 C ATOM 1743 CD1 TYR B 44 -10.545 3.531 11.108 1.00 1.13 C ATOM 1744 CD2 TYR B 44 -11.596 3.639 8.970 1.00 1.29 C ATOM 1745 CE1 TYR B 44 -9.977 4.772 10.895 1.00 1.14 C ATOM 1746 CE2 TYR B 44 -11.029 4.879 8.751 1.00 1.28 C ATOM 1747 CZ TYR B 44 -10.219 5.438 9.714 1.00 0.47 C ATOM 1748 OH TYR B 44 -9.653 6.671 9.494 1.00 0.50 O ATOM 0 H TYR B 44 -12.886 -0.622 9.855 1.00 0.41 H new ATOM 0 HA TYR B 44 -10.485 0.606 9.206 1.00 0.45 H new ATOM 0 HB2 TYR B 44 -12.888 1.506 9.767 1.00 0.56 H new ATOM 0 HB3 TYR B 44 -12.326 1.534 11.427 1.00 0.56 H new ATOM 0 HD1 TYR B 44 -10.347 3.008 12.032 1.00 1.13 H new ATOM 0 HD2 TYR B 44 -12.227 3.202 8.211 1.00 1.29 H new ATOM 0 HE1 TYR B 44 -9.347 5.218 11.650 1.00 1.14 H new ATOM 0 HE2 TYR B 44 -11.220 5.408 7.829 1.00 1.28 H new ATOM 0 HH TYR B 44 -8.837 6.566 8.961 1.00 0.50 H new ATOM 1758 N LYS B 45 -10.671 -0.201 12.411 1.00 0.49 N ATOM 1759 CA LYS B 45 -9.861 -0.430 13.598 1.00 0.55 C ATOM 1760 C LYS B 45 -9.272 -1.834 13.600 1.00 0.46 C ATOM 1761 O LYS B 45 -8.226 -2.078 14.204 1.00 0.60 O ATOM 1762 CB LYS B 45 -10.690 -0.199 14.860 1.00 0.68 C ATOM 1763 CG LYS B 45 -10.990 1.265 15.122 1.00 1.22 C ATOM 1764 CD LYS B 45 -11.403 1.495 16.562 1.00 1.68 C ATOM 1765 CE LYS B 45 -11.637 2.968 16.837 1.00 2.21 C ATOM 1766 NZ LYS B 45 -12.068 3.211 18.235 1.00 2.83 N ATOM 0 H LYS B 45 -11.670 -0.361 12.541 1.00 0.49 H new ATOM 0 HA LYS B 45 -9.035 0.281 13.584 1.00 0.55 H new ATOM 0 HB2 LYS B 45 -11.629 -0.745 14.774 1.00 0.68 H new ATOM 0 HB3 LYS B 45 -10.158 -0.613 15.717 1.00 0.68 H new ATOM 0 HG2 LYS B 45 -10.109 1.865 14.894 1.00 1.22 H new ATOM 0 HG3 LYS B 45 -11.785 1.600 14.456 1.00 1.22 H new ATOM 0 HD2 LYS B 45 -12.312 0.933 16.776 1.00 1.68 H new ATOM 0 HD3 LYS B 45 -10.629 1.116 17.230 1.00 1.68 H new ATOM 0 HE2 LYS B 45 -10.721 3.524 16.638 1.00 2.21 H new ATOM 0 HE3 LYS B 45 -12.395 3.349 16.153 1.00 2.21 H new ATOM 0 HZ1 LYS B 45 -12.217 4.230 18.380 1.00 2.83 H new ATOM 0 HZ2 LYS B 45 -12.956 2.702 18.418 1.00 2.83 H new ATOM 0 HZ3 LYS B 45 -11.334 2.872 18.889 1.00 2.83 H new ATOM 1780 N LYS B 46 -9.944 -2.751 12.914 1.00 0.33 N ATOM 1781 CA LYS B 46 -9.486 -4.133 12.831 1.00 0.36 C ATOM 1782 C LYS B 46 -8.130 -4.215 12.140 1.00 0.37 C ATOM 1783 O LYS B 46 -7.154 -4.675 12.727 1.00 0.51 O ATOM 1784 CB LYS B 46 -10.496 -4.995 12.070 1.00 0.43 C ATOM 1785 CG LYS B 46 -11.632 -5.514 12.932 1.00 0.89 C ATOM 1786 CD LYS B 46 -12.538 -6.440 12.139 1.00 1.20 C ATOM 1787 CE LYS B 46 -13.557 -7.127 13.034 1.00 1.37 C ATOM 1788 NZ LYS B 46 -12.905 -7.950 14.088 1.00 2.09 N ATOM 0 H LYS B 46 -10.809 -2.562 12.407 1.00 0.33 H new ATOM 0 HA LYS B 46 -9.390 -4.510 13.849 1.00 0.36 H new ATOM 0 HB2 LYS B 46 -10.913 -4.411 11.250 1.00 0.43 H new ATOM 0 HB3 LYS B 46 -9.974 -5.842 11.625 1.00 0.43 H new ATOM 0 HG2 LYS B 46 -11.226 -6.046 13.793 1.00 0.89 H new ATOM 0 HG3 LYS B 46 -12.212 -4.676 13.319 1.00 0.89 H new ATOM 0 HD2 LYS B 46 -13.056 -5.870 11.367 1.00 1.20 H new ATOM 0 HD3 LYS B 46 -11.935 -7.192 11.630 1.00 1.20 H new ATOM 0 HE2 LYS B 46 -14.194 -6.376 13.502 1.00 1.37 H new ATOM 0 HE3 LYS B 46 -14.204 -7.760 12.427 1.00 1.37 H new ATOM 0 HZ1 LYS B 46 -13.583 -8.651 14.450 1.00 2.09 H new ATOM 0 HZ2 LYS B 46 -12.081 -8.441 13.685 1.00 2.09 H new ATOM 0 HZ3 LYS B 46 -12.594 -7.334 14.866 1.00 2.09 H new ATOM 1802 N ILE B 47 -8.074 -3.741 10.900 1.00 0.35 N ATOM 1803 CA ILE B 47 -6.846 -3.776 10.114 1.00 0.40 C ATOM 1804 C ILE B 47 -5.784 -2.861 10.719 1.00 0.36 C ATOM 1805 O ILE B 47 -4.586 -3.154 10.641 1.00 0.40 O ATOM 1806 CB ILE B 47 -7.115 -3.370 8.648 1.00 0.50 C ATOM 1807 CG1 ILE B 47 -8.136 -4.323 8.025 1.00 0.71 C ATOM 1808 CG2 ILE B 47 -5.825 -3.365 7.835 1.00 0.48 C ATOM 1809 CD1 ILE B 47 -8.638 -3.876 6.671 1.00 0.44 C ATOM 0 H ILE B 47 -8.870 -3.326 10.415 1.00 0.35 H new ATOM 0 HA ILE B 47 -6.475 -4.801 10.130 1.00 0.40 H new ATOM 0 HB ILE B 47 -7.519 -2.358 8.638 1.00 0.50 H new ATOM 0 HG12 ILE B 47 -7.685 -5.311 7.928 1.00 0.71 H new ATOM 0 HG13 ILE B 47 -8.984 -4.425 8.702 1.00 0.71 H new ATOM 0 HG21 ILE B 47 -6.044 -3.076 6.807 1.00 0.48 H new ATOM 0 HG22 ILE B 47 -5.123 -2.654 8.271 1.00 0.48 H new ATOM 0 HG23 ILE B 47 -5.385 -4.362 7.845 1.00 0.48 H new ATOM 0 HD11 ILE B 47 -9.358 -4.601 6.292 1.00 0.44 H new ATOM 0 HD12 ILE B 47 -9.119 -2.902 6.764 1.00 0.44 H new ATOM 0 HD13 ILE B 47 -7.800 -3.802 5.978 1.00 0.44 H new ATOM 1821 N MET B 48 -6.242 -1.780 11.349 1.00 0.38 N ATOM 1822 CA MET B 48 -5.358 -0.797 11.976 1.00 0.45 C ATOM 1823 C MET B 48 -4.318 -1.467 12.873 1.00 0.49 C ATOM 1824 O MET B 48 -3.115 -1.293 12.681 1.00 0.80 O ATOM 1825 CB MET B 48 -6.185 0.200 12.793 1.00 0.53 C ATOM 1826 CG MET B 48 -5.354 1.182 13.605 1.00 0.93 C ATOM 1827 SD MET B 48 -6.363 2.178 14.722 1.00 1.51 S ATOM 1828 CE MET B 48 -7.236 3.223 13.557 1.00 1.44 C ATOM 0 H MET B 48 -7.234 -1.561 11.439 1.00 0.38 H new ATOM 0 HA MET B 48 -4.827 -0.271 11.183 1.00 0.45 H new ATOM 0 HB2 MET B 48 -6.830 0.760 12.116 1.00 0.53 H new ATOM 0 HB3 MET B 48 -6.836 -0.354 13.469 1.00 0.53 H new ATOM 0 HG2 MET B 48 -4.610 0.633 14.183 1.00 0.93 H new ATOM 0 HG3 MET B 48 -4.809 1.840 12.928 1.00 0.93 H new ATOM 0 HE1 MET B 48 -7.791 3.988 14.100 1.00 1.44 H new ATOM 0 HE2 MET B 48 -6.519 3.700 12.888 1.00 1.44 H new ATOM 0 HE3 MET B 48 -7.929 2.617 12.973 1.00 1.44 H new ATOM 1838 N GLU B 49 -4.791 -2.247 13.835 1.00 0.55 N ATOM 1839 CA GLU B 49 -3.906 -2.934 14.769 1.00 0.61 C ATOM 1840 C GLU B 49 -3.465 -4.291 14.218 1.00 0.57 C ATOM 1841 O GLU B 49 -2.437 -4.834 14.624 1.00 0.69 O ATOM 1842 CB GLU B 49 -4.615 -3.123 16.115 1.00 0.80 C ATOM 1843 CG GLU B 49 -3.688 -3.550 17.242 1.00 1.22 C ATOM 1844 CD GLU B 49 -4.375 -4.435 18.257 1.00 1.91 C ATOM 1845 OE1 GLU B 49 -4.949 -3.902 19.230 1.00 2.64 O ATOM 1846 OE2 GLU B 49 -4.345 -5.672 18.087 1.00 2.43 O ATOM 0 H GLU B 49 -5.784 -2.421 13.990 1.00 0.55 H new ATOM 0 HA GLU B 49 -3.017 -2.320 14.909 1.00 0.61 H new ATOM 0 HB2 GLU B 49 -5.103 -2.189 16.393 1.00 0.80 H new ATOM 0 HB3 GLU B 49 -5.400 -3.870 16.000 1.00 0.80 H new ATOM 0 HG2 GLU B 49 -2.833 -4.080 16.823 1.00 1.22 H new ATOM 0 HG3 GLU B 49 -3.299 -2.664 17.743 1.00 1.22 H new ATOM 1853 N LYS B 50 -4.240 -4.827 13.284 1.00 0.62 N ATOM 1854 CA LYS B 50 -3.950 -6.131 12.690 1.00 0.65 C ATOM 1855 C LYS B 50 -2.579 -6.168 12.026 1.00 0.54 C ATOM 1856 O LYS B 50 -1.771 -7.053 12.305 1.00 0.58 O ATOM 1857 CB LYS B 50 -5.023 -6.495 11.662 1.00 0.77 C ATOM 1858 CG LYS B 50 -5.271 -7.990 11.533 1.00 0.90 C ATOM 1859 CD LYS B 50 -5.736 -8.595 12.849 1.00 1.17 C ATOM 1860 CE LYS B 50 -7.010 -7.932 13.354 1.00 0.89 C ATOM 1861 NZ LYS B 50 -7.340 -8.342 14.744 1.00 1.33 N ATOM 0 H LYS B 50 -5.079 -4.378 12.918 1.00 0.62 H new ATOM 0 HA LYS B 50 -3.950 -6.859 13.501 1.00 0.65 H new ATOM 0 HB2 LYS B 50 -5.957 -6.004 11.937 1.00 0.77 H new ATOM 0 HB3 LYS B 50 -4.729 -6.100 10.689 1.00 0.77 H new ATOM 0 HG2 LYS B 50 -6.022 -8.170 10.764 1.00 0.90 H new ATOM 0 HG3 LYS B 50 -4.356 -8.485 11.207 1.00 0.90 H new ATOM 0 HD2 LYS B 50 -5.909 -9.663 12.718 1.00 1.17 H new ATOM 0 HD3 LYS B 50 -4.950 -8.489 13.596 1.00 1.17 H new ATOM 0 HE2 LYS B 50 -6.895 -6.849 13.314 1.00 0.89 H new ATOM 0 HE3 LYS B 50 -7.838 -8.190 12.694 1.00 0.89 H new ATOM 0 HZ1 LYS B 50 -8.214 -7.867 15.048 1.00 1.33 H new ATOM 0 HZ2 LYS B 50 -7.475 -9.373 14.779 1.00 1.33 H new ATOM 0 HZ3 LYS B 50 -6.562 -8.073 15.379 1.00 1.33 H new ATOM 1875 N TYR B 51 -2.316 -5.210 11.150 1.00 0.50 N ATOM 1876 CA TYR B 51 -1.044 -5.170 10.441 1.00 0.44 C ATOM 1877 C TYR B 51 -0.275 -3.895 10.751 1.00 0.42 C ATOM 1878 O TYR B 51 0.675 -3.552 10.041 1.00 0.49 O ATOM 1879 CB TYR B 51 -1.280 -5.293 8.935 1.00 0.48 C ATOM 1880 CG TYR B 51 -2.015 -6.554 8.539 1.00 0.45 C ATOM 1881 CD1 TYR B 51 -1.428 -7.801 8.702 1.00 0.53 C ATOM 1882 CD2 TYR B 51 -3.297 -6.495 8.008 1.00 0.47 C ATOM 1883 CE1 TYR B 51 -2.096 -8.956 8.344 1.00 0.54 C ATOM 1884 CE2 TYR B 51 -3.973 -7.646 7.648 1.00 0.47 C ATOM 1885 CZ TYR B 51 -3.368 -8.873 7.818 1.00 0.47 C ATOM 1886 OH TYR B 51 -4.035 -10.021 7.458 1.00 0.52 O ATOM 0 H TYR B 51 -2.960 -4.455 10.914 1.00 0.50 H new ATOM 0 HA TYR B 51 -0.442 -6.013 10.780 1.00 0.44 H new ATOM 0 HB2 TYR B 51 -1.849 -4.428 8.593 1.00 0.48 H new ATOM 0 HB3 TYR B 51 -0.319 -5.266 8.422 1.00 0.48 H new ATOM 0 HD1 TYR B 51 -0.433 -7.870 9.116 1.00 0.53 H new ATOM 0 HD2 TYR B 51 -3.773 -5.535 7.874 1.00 0.47 H new ATOM 0 HE1 TYR B 51 -1.625 -9.919 8.475 1.00 0.54 H new ATOM 0 HE2 TYR B 51 -4.969 -7.584 7.236 1.00 0.47 H new ATOM 0 HH TYR B 51 -4.919 -9.789 7.106 1.00 0.52 H new ATOM 1896 N SER B 52 -0.681 -3.215 11.821 1.00 0.44 N ATOM 1897 CA SER B 52 -0.043 -1.972 12.247 1.00 0.47 C ATOM 1898 C SER B 52 0.026 -0.968 11.096 1.00 0.40 C ATOM 1899 O SER B 52 1.104 -0.674 10.575 1.00 0.48 O ATOM 1900 CB SER B 52 1.358 -2.256 12.797 1.00 0.58 C ATOM 1901 OG SER B 52 1.306 -3.191 13.865 1.00 1.27 O ATOM 0 H SER B 52 -1.457 -3.508 12.414 1.00 0.44 H new ATOM 0 HA SER B 52 -0.648 -1.533 13.040 1.00 0.47 H new ATOM 0 HB2 SER B 52 1.994 -2.643 12.001 1.00 0.58 H new ATOM 0 HB3 SER B 52 1.812 -1.327 13.144 1.00 0.58 H new ATOM 0 HG SER B 52 2.212 -3.358 14.198 1.00 1.27 H new ATOM 1907 N VAL B 53 -1.131 -0.457 10.695 1.00 0.33 N ATOM 1908 CA VAL B 53 -1.198 0.500 9.601 1.00 0.38 C ATOM 1909 C VAL B 53 -0.720 1.876 10.047 1.00 0.45 C ATOM 1910 O VAL B 53 -0.943 2.290 11.185 1.00 1.11 O ATOM 1911 CB VAL B 53 -2.628 0.622 9.015 1.00 0.45 C ATOM 1912 CG1 VAL B 53 -3.172 -0.741 8.623 1.00 0.69 C ATOM 1913 CG2 VAL B 53 -3.568 1.310 9.992 1.00 0.56 C ATOM 0 H VAL B 53 -2.033 -0.689 11.110 1.00 0.33 H new ATOM 0 HA VAL B 53 -0.539 0.120 8.820 1.00 0.38 H new ATOM 0 HB VAL B 53 -2.565 1.238 8.118 1.00 0.45 H new ATOM 0 HG11 VAL B 53 -4.176 -0.628 8.215 1.00 0.69 H new ATOM 0 HG12 VAL B 53 -2.523 -1.189 7.871 1.00 0.69 H new ATOM 0 HG13 VAL B 53 -3.208 -1.385 9.502 1.00 0.69 H new ATOM 0 HG21 VAL B 53 -4.563 1.380 9.552 1.00 0.56 H new ATOM 0 HG22 VAL B 53 -3.620 0.733 10.915 1.00 0.56 H new ATOM 0 HG23 VAL B 53 -3.196 2.311 10.211 1.00 0.56 H new ATOM 1923 N THR B 54 -0.028 2.563 9.155 1.00 0.52 N ATOM 1924 CA THR B 54 0.452 3.902 9.440 1.00 0.45 C ATOM 1925 C THR B 54 -0.623 4.906 9.047 1.00 0.40 C ATOM 1926 O THR B 54 -0.625 6.058 9.485 1.00 0.50 O ATOM 1927 CB THR B 54 1.746 4.208 8.663 1.00 0.53 C ATOM 1928 OG1 THR B 54 2.525 3.012 8.522 1.00 0.89 O ATOM 1929 CG2 THR B 54 2.571 5.273 9.371 1.00 0.72 C ATOM 0 H THR B 54 0.214 2.215 8.227 1.00 0.52 H new ATOM 0 HA THR B 54 0.671 3.974 10.505 1.00 0.45 H new ATOM 0 HB THR B 54 1.469 4.584 7.678 1.00 0.53 H new ATOM 0 HG1 THR B 54 3.346 3.213 8.026 1.00 0.89 H new ATOM 0 HG21 THR B 54 3.479 5.469 8.800 1.00 0.72 H new ATOM 0 HG22 THR B 54 1.988 6.190 9.452 1.00 0.72 H new ATOM 0 HG23 THR B 54 2.838 4.923 10.368 1.00 0.72 H new ATOM 1937 N PHE B 55 -1.550 4.434 8.225 1.00 0.49 N ATOM 1938 CA PHE B 55 -2.638 5.254 7.741 1.00 0.46 C ATOM 1939 C PHE B 55 -3.827 4.386 7.348 1.00 0.39 C ATOM 1940 O PHE B 55 -3.662 3.297 6.800 1.00 0.45 O ATOM 1941 CB PHE B 55 -2.164 6.090 6.542 1.00 0.55 C ATOM 1942 CG PHE B 55 -3.223 6.345 5.503 1.00 0.43 C ATOM 1943 CD1 PHE B 55 -4.147 7.364 5.667 1.00 1.35 C ATOM 1944 CD2 PHE B 55 -3.294 5.557 4.364 1.00 1.16 C ATOM 1945 CE1 PHE B 55 -5.118 7.594 4.716 1.00 1.33 C ATOM 1946 CE2 PHE B 55 -4.263 5.783 3.411 1.00 1.16 C ATOM 1947 CZ PHE B 55 -5.177 6.801 3.587 1.00 0.35 C ATOM 0 H PHE B 55 -1.564 3.475 7.879 1.00 0.49 H new ATOM 0 HA PHE B 55 -2.956 5.926 8.538 1.00 0.46 H new ATOM 0 HB2 PHE B 55 -1.792 7.048 6.907 1.00 0.55 H new ATOM 0 HB3 PHE B 55 -1.324 5.581 6.069 1.00 0.55 H new ATOM 0 HD1 PHE B 55 -4.106 7.985 6.550 1.00 1.35 H new ATOM 0 HD2 PHE B 55 -2.582 4.757 4.222 1.00 1.16 H new ATOM 0 HE1 PHE B 55 -5.831 8.393 4.854 1.00 1.33 H new ATOM 0 HE2 PHE B 55 -4.307 5.164 2.527 1.00 1.16 H new ATOM 0 HZ PHE B 55 -5.939 6.978 2.842 1.00 0.35 H new ATOM 1957 N ILE B 56 -5.012 4.862 7.676 1.00 0.40 N ATOM 1958 CA ILE B 56 -6.249 4.190 7.333 1.00 0.44 C ATOM 1959 C ILE B 56 -7.337 5.246 7.189 1.00 0.40 C ATOM 1960 O ILE B 56 -7.431 6.159 8.013 1.00 0.47 O ATOM 1961 CB ILE B 56 -6.644 3.115 8.376 1.00 0.55 C ATOM 1962 CG1 ILE B 56 -7.955 2.434 7.974 1.00 0.68 C ATOM 1963 CG2 ILE B 56 -6.749 3.712 9.774 1.00 0.58 C ATOM 1964 CD1 ILE B 56 -7.920 0.928 8.111 1.00 0.85 C ATOM 0 H ILE B 56 -5.144 5.732 8.192 1.00 0.40 H new ATOM 0 HA ILE B 56 -6.116 3.656 6.392 1.00 0.44 H new ATOM 0 HB ILE B 56 -5.856 2.362 8.398 1.00 0.55 H new ATOM 0 HG12 ILE B 56 -8.763 2.828 8.590 1.00 0.68 H new ATOM 0 HG13 ILE B 56 -8.187 2.691 6.941 1.00 0.68 H new ATOM 0 HG21 ILE B 56 -7.028 2.932 10.483 1.00 0.58 H new ATOM 0 HG22 ILE B 56 -5.787 4.137 10.061 1.00 0.58 H new ATOM 0 HG23 ILE B 56 -7.507 4.495 9.779 1.00 0.58 H new ATOM 0 HD11 ILE B 56 -8.882 0.513 7.809 1.00 0.85 H new ATOM 0 HD12 ILE B 56 -7.134 0.523 7.474 1.00 0.85 H new ATOM 0 HD13 ILE B 56 -7.719 0.662 9.149 1.00 0.85 H new ATOM 1976 N SER B 57 -8.125 5.158 6.132 1.00 0.38 N ATOM 1977 CA SER B 57 -9.166 6.141 5.895 1.00 0.36 C ATOM 1978 C SER B 57 -10.405 5.526 5.257 1.00 0.38 C ATOM 1979 O SER B 57 -10.332 4.514 4.555 1.00 0.67 O ATOM 1980 CB SER B 57 -8.625 7.256 4.995 1.00 0.36 C ATOM 1981 OG SER B 57 -9.590 8.274 4.786 1.00 1.33 O ATOM 0 H SER B 57 -8.065 4.421 5.429 1.00 0.38 H new ATOM 0 HA SER B 57 -9.461 6.546 6.863 1.00 0.36 H new ATOM 0 HB2 SER B 57 -7.732 7.688 5.447 1.00 0.36 H new ATOM 0 HB3 SER B 57 -8.325 6.836 4.035 1.00 0.36 H new ATOM 0 HG SER B 57 -10.037 8.480 5.634 1.00 1.33 H new ATOM 1987 N ARG B 58 -11.538 6.160 5.515 1.00 0.32 N ATOM 1988 CA ARG B 58 -12.816 5.742 4.969 1.00 0.34 C ATOM 1989 C ARG B 58 -13.294 6.817 3.999 1.00 0.31 C ATOM 1990 O ARG B 58 -13.386 7.990 4.367 1.00 0.40 O ATOM 1991 CB ARG B 58 -13.825 5.543 6.102 1.00 0.41 C ATOM 1992 CG ARG B 58 -14.931 4.551 5.783 1.00 1.07 C ATOM 1993 CD ARG B 58 -15.668 4.125 7.044 1.00 0.92 C ATOM 1994 NE ARG B 58 -16.585 5.159 7.526 1.00 1.26 N ATOM 1995 CZ ARG B 58 -16.322 5.995 8.533 1.00 1.41 C ATOM 1996 NH1 ARG B 58 -15.168 5.932 9.184 1.00 1.79 N ATOM 1997 NH2 ARG B 58 -17.224 6.897 8.892 1.00 2.18 N ATOM 0 H ARG B 58 -11.595 6.984 6.113 1.00 0.32 H new ATOM 0 HA ARG B 58 -12.715 4.794 4.441 1.00 0.34 H new ATOM 0 HB2 ARG B 58 -13.294 5.204 6.991 1.00 0.41 H new ATOM 0 HB3 ARG B 58 -14.275 6.505 6.346 1.00 0.41 H new ATOM 0 HG2 ARG B 58 -15.634 5.000 5.081 1.00 1.07 H new ATOM 0 HG3 ARG B 58 -14.507 3.675 5.293 1.00 1.07 H new ATOM 0 HD2 ARG B 58 -16.227 3.211 6.844 1.00 0.92 H new ATOM 0 HD3 ARG B 58 -14.944 3.892 7.825 1.00 0.92 H new ATOM 0 HE ARG B 58 -17.488 5.247 7.060 1.00 1.26 H new ATOM 0 HH11 ARG B 58 -14.469 5.239 8.917 1.00 1.79 H new ATOM 0 HH12 ARG B 58 -14.980 6.577 9.952 1.00 1.79 H new ATOM 0 HH21 ARG B 58 -18.116 6.951 8.399 1.00 2.18 H new ATOM 0 HH22 ARG B 58 -17.027 7.537 9.661 1.00 2.18 H new ATOM 2011 N HIS B 59 -13.560 6.439 2.759 1.00 0.28 N ATOM 2012 CA HIS B 59 -13.992 7.406 1.757 1.00 0.29 C ATOM 2013 C HIS B 59 -15.340 7.037 1.159 1.00 0.30 C ATOM 2014 O HIS B 59 -15.731 5.869 1.154 1.00 0.37 O ATOM 2015 CB HIS B 59 -12.949 7.516 0.640 1.00 0.34 C ATOM 2016 CG HIS B 59 -11.686 8.201 1.059 1.00 0.34 C ATOM 2017 ND1 HIS B 59 -11.276 9.408 0.545 1.00 0.43 N ATOM 2018 CD2 HIS B 59 -10.744 7.842 1.961 1.00 0.47 C ATOM 2019 CE1 HIS B 59 -10.138 9.761 1.112 1.00 0.45 C ATOM 2020 NE2 HIS B 59 -9.793 8.829 1.976 1.00 0.48 N ATOM 0 H HIS B 59 -13.486 5.479 2.422 1.00 0.28 H new ATOM 0 HA HIS B 59 -14.096 8.368 2.259 1.00 0.29 H new ATOM 0 HB2 HIS B 59 -12.707 6.515 0.282 1.00 0.34 H new ATOM 0 HB3 HIS B 59 -13.385 8.059 -0.199 1.00 0.34 H new ATOM 0 HD1 HIS B 59 -11.774 9.947 -0.164 1.00 0.43 H new ATOM 0 HD2 HIS B 59 -10.742 6.943 2.559 1.00 0.47 H new ATOM 0 HE1 HIS B 59 -9.583 10.663 0.903 1.00 0.45 H new ATOM 0 HE2 HIS B 59 -8.957 8.840 2.560 1.00 0.48 H new ATOM 2029 N ASN B 60 -16.041 8.041 0.651 1.00 0.32 N ATOM 2030 CA ASN B 60 -17.342 7.838 0.032 1.00 0.34 C ATOM 2031 C ASN B 60 -17.162 7.680 -1.467 1.00 0.38 C ATOM 2032 O ASN B 60 -16.268 8.289 -2.048 1.00 0.47 O ATOM 2033 CB ASN B 60 -18.280 9.025 0.296 1.00 0.39 C ATOM 2034 CG ASN B 60 -18.213 9.543 1.717 1.00 0.75 C ATOM 2035 OD1 ASN B 60 -17.391 10.400 2.037 1.00 1.75 O ATOM 2036 ND2 ASN B 60 -19.084 9.038 2.575 1.00 0.96 N ATOM 0 H ASN B 60 -15.727 9.011 0.656 1.00 0.32 H new ATOM 0 HA ASN B 60 -17.788 6.942 0.464 1.00 0.34 H new ATOM 0 HB2 ASN B 60 -18.030 9.835 -0.390 1.00 0.39 H new ATOM 0 HB3 ASN B 60 -19.304 8.725 0.075 1.00 0.39 H new ATOM 0 HD21 ASN B 60 -19.090 9.358 3.543 1.00 0.96 H new ATOM 0 HD22 ASN B 60 -19.749 8.328 2.268 1.00 0.96 H new ATOM 2043 N SER B 61 -17.990 6.862 -2.088 1.00 0.45 N ATOM 2044 CA SER B 61 -17.907 6.660 -3.523 1.00 0.52 C ATOM 2045 C SER B 61 -19.186 7.154 -4.187 1.00 0.54 C ATOM 2046 O SER B 61 -19.275 8.303 -4.616 1.00 0.70 O ATOM 2047 CB SER B 61 -17.672 5.183 -3.839 1.00 0.58 C ATOM 2048 OG SER B 61 -18.464 4.352 -3.003 1.00 1.14 O ATOM 0 H SER B 61 -18.725 6.328 -1.624 1.00 0.45 H new ATOM 0 HA SER B 61 -17.065 7.230 -3.915 1.00 0.52 H new ATOM 0 HB2 SER B 61 -17.912 4.988 -4.884 1.00 0.58 H new ATOM 0 HB3 SER B 61 -16.618 4.942 -3.704 1.00 0.58 H new ATOM 0 HG SER B 61 -17.935 3.579 -2.715 1.00 1.14 H new ATOM 2054 N TYR B 62 -20.176 6.277 -4.250 1.00 0.58 N ATOM 2055 CA TYR B 62 -21.461 6.608 -4.840 1.00 0.65 C ATOM 2056 C TYR B 62 -22.580 5.967 -4.034 1.00 0.69 C ATOM 2057 O TYR B 62 -23.433 6.655 -3.476 1.00 0.81 O ATOM 2058 CB TYR B 62 -21.541 6.133 -6.292 1.00 0.78 C ATOM 2059 CG TYR B 62 -20.507 6.753 -7.205 1.00 0.73 C ATOM 2060 CD1 TYR B 62 -20.685 8.029 -7.723 1.00 1.20 C ATOM 2061 CD2 TYR B 62 -19.356 6.057 -7.553 1.00 0.98 C ATOM 2062 CE1 TYR B 62 -19.746 8.594 -8.560 1.00 1.37 C ATOM 2063 CE2 TYR B 62 -18.412 6.617 -8.392 1.00 1.13 C ATOM 2064 CZ TYR B 62 -18.613 7.886 -8.892 1.00 1.14 C ATOM 2065 OH TYR B 62 -17.681 8.450 -9.729 1.00 1.45 O ATOM 0 H TYR B 62 -20.111 5.323 -3.896 1.00 0.58 H new ATOM 0 HA TYR B 62 -21.570 7.692 -4.825 1.00 0.65 H new ATOM 0 HB2 TYR B 62 -21.426 5.049 -6.315 1.00 0.78 H new ATOM 0 HB3 TYR B 62 -22.534 6.357 -6.682 1.00 0.78 H new ATOM 0 HD1 TYR B 62 -21.573 8.588 -7.466 1.00 1.20 H new ATOM 0 HD2 TYR B 62 -19.197 5.063 -7.162 1.00 0.98 H new ATOM 0 HE1 TYR B 62 -19.899 9.588 -8.954 1.00 1.37 H new ATOM 0 HE2 TYR B 62 -17.522 6.064 -8.655 1.00 1.13 H new ATOM 0 HH TYR B 62 -17.421 7.800 -10.414 1.00 1.45 H new ATOM 2075 N ASN B 63 -22.563 4.639 -3.963 1.00 0.72 N ATOM 2076 CA ASN B 63 -23.593 3.902 -3.235 1.00 0.85 C ATOM 2077 C ASN B 63 -23.002 3.066 -2.105 1.00 0.68 C ATOM 2078 O ASN B 63 -23.724 2.349 -1.416 1.00 0.66 O ATOM 2079 CB ASN B 63 -24.363 2.996 -4.201 1.00 1.09 C ATOM 2080 CG ASN B 63 -25.298 3.775 -5.103 1.00 1.44 C ATOM 2081 OD1 ASN B 63 -26.059 4.622 -4.641 1.00 2.15 O ATOM 2082 ND2 ASN B 63 -25.243 3.505 -6.399 1.00 1.55 N ATOM 0 H ASN B 63 -21.851 4.053 -4.398 1.00 0.72 H new ATOM 0 HA ASN B 63 -24.270 4.631 -2.790 1.00 0.85 H new ATOM 0 HB2 ASN B 63 -23.655 2.437 -4.813 1.00 1.09 H new ATOM 0 HB3 ASN B 63 -24.937 2.266 -3.630 1.00 1.09 H new ATOM 0 HD21 ASN B 63 -25.846 4.008 -7.051 1.00 1.55 H new ATOM 0 HD22 ASN B 63 -24.598 2.795 -6.745 1.00 1.55 H new ATOM 2089 N HIS B 64 -21.689 3.147 -1.915 1.00 0.65 N ATOM 2090 CA HIS B 64 -21.022 2.377 -0.867 1.00 0.50 C ATOM 2091 C HIS B 64 -19.864 3.175 -0.274 1.00 0.48 C ATOM 2092 O HIS B 64 -19.770 4.386 -0.475 1.00 0.59 O ATOM 2093 CB HIS B 64 -20.498 1.045 -1.414 1.00 0.48 C ATOM 2094 CG HIS B 64 -21.545 0.175 -2.048 1.00 0.49 C ATOM 2095 ND1 HIS B 64 -21.755 0.136 -3.404 1.00 0.99 N ATOM 2096 CD2 HIS B 64 -22.433 -0.696 -1.508 1.00 0.83 C ATOM 2097 CE1 HIS B 64 -22.720 -0.718 -3.676 1.00 0.84 C ATOM 2098 NE2 HIS B 64 -23.152 -1.241 -2.545 1.00 0.61 N ATOM 0 H HIS B 64 -21.067 3.735 -2.469 1.00 0.65 H new ATOM 0 HA HIS B 64 -21.755 2.172 -0.087 1.00 0.50 H new ATOM 0 HB2 HIS B 64 -19.720 1.250 -2.150 1.00 0.48 H new ATOM 0 HB3 HIS B 64 -20.029 0.492 -0.600 1.00 0.48 H new ATOM 0 HD1 HIS B 64 -21.242 0.684 -4.095 1.00 0.99 H new ATOM 0 HD2 HIS B 64 -22.553 -0.920 -0.458 1.00 0.83 H new ATOM 0 HE1 HIS B 64 -23.095 -0.951 -4.661 1.00 0.84 H new ATOM 0 HE2 HIS B 64 -23.895 -1.934 -2.455 1.00 0.61 H new ATOM 2107 N ASN B 65 -18.981 2.496 0.450 1.00 0.39 N ATOM 2108 CA ASN B 65 -17.828 3.144 1.069 1.00 0.37 C ATOM 2109 C ASN B 65 -16.544 2.447 0.643 1.00 0.35 C ATOM 2110 O ASN B 65 -16.548 1.253 0.343 1.00 0.40 O ATOM 2111 CB ASN B 65 -17.944 3.121 2.597 1.00 0.38 C ATOM 2112 CG ASN B 65 -18.526 4.400 3.178 1.00 0.51 C ATOM 2113 OD1 ASN B 65 -18.215 4.775 4.308 1.00 1.38 O ATOM 2114 ND2 ASN B 65 -19.377 5.072 2.418 1.00 1.05 N ATOM 0 H ASN B 65 -19.041 1.493 0.624 1.00 0.39 H new ATOM 0 HA ASN B 65 -17.804 4.182 0.737 1.00 0.37 H new ATOM 0 HB2 ASN B 65 -18.569 2.279 2.894 1.00 0.38 H new ATOM 0 HB3 ASN B 65 -16.956 2.952 3.026 1.00 0.38 H new ATOM 0 HD21 ASN B 65 -19.800 5.933 2.764 1.00 1.05 H new ATOM 0 HD22 ASN B 65 -19.610 4.728 1.486 1.00 1.05 H new ATOM 2121 N ILE B 66 -15.453 3.193 0.604 1.00 0.37 N ATOM 2122 CA ILE B 66 -14.167 2.638 0.211 1.00 0.40 C ATOM 2123 C ILE B 66 -13.162 2.752 1.348 1.00 0.36 C ATOM 2124 O ILE B 66 -12.890 3.852 1.838 1.00 0.57 O ATOM 2125 CB ILE B 66 -13.594 3.355 -1.032 1.00 0.50 C ATOM 2126 CG1 ILE B 66 -14.664 3.485 -2.118 1.00 0.72 C ATOM 2127 CG2 ILE B 66 -12.380 2.605 -1.568 1.00 0.60 C ATOM 2128 CD1 ILE B 66 -14.247 4.363 -3.278 1.00 0.65 C ATOM 0 H ILE B 66 -15.431 4.185 0.840 1.00 0.37 H new ATOM 0 HA ILE B 66 -14.335 1.589 -0.032 1.00 0.40 H new ATOM 0 HB ILE B 66 -13.279 4.356 -0.737 1.00 0.50 H new ATOM 0 HG12 ILE B 66 -14.910 2.492 -2.495 1.00 0.72 H new ATOM 0 HG13 ILE B 66 -15.573 3.891 -1.674 1.00 0.72 H new ATOM 0 HG21 ILE B 66 -11.989 3.124 -2.443 1.00 0.60 H new ATOM 0 HG22 ILE B 66 -11.610 2.562 -0.798 1.00 0.60 H new ATOM 0 HG23 ILE B 66 -12.672 1.592 -1.847 1.00 0.60 H new ATOM 0 HD11 ILE B 66 -15.055 4.409 -4.008 1.00 0.65 H new ATOM 0 HD12 ILE B 66 -14.029 5.367 -2.914 1.00 0.65 H new ATOM 0 HD13 ILE B 66 -13.356 3.946 -3.748 1.00 0.65 H new ATOM 2140 N LEU B 67 -12.630 1.619 1.777 1.00 0.41 N ATOM 2141 CA LEU B 67 -11.640 1.600 2.839 1.00 0.39 C ATOM 2142 C LEU B 67 -10.241 1.587 2.235 1.00 0.39 C ATOM 2143 O LEU B 67 -9.902 0.699 1.454 1.00 0.59 O ATOM 2144 CB LEU B 67 -11.837 0.380 3.745 1.00 0.43 C ATOM 2145 CG LEU B 67 -10.963 0.359 5.004 1.00 0.51 C ATOM 2146 CD1 LEU B 67 -11.353 1.488 5.945 1.00 0.80 C ATOM 2147 CD2 LEU B 67 -11.073 -0.984 5.709 1.00 0.52 C ATOM 0 H LEU B 67 -12.868 0.700 1.405 1.00 0.41 H new ATOM 0 HA LEU B 67 -11.762 2.497 3.447 1.00 0.39 H new ATOM 0 HB2 LEU B 67 -12.883 0.336 4.047 1.00 0.43 H new ATOM 0 HB3 LEU B 67 -11.634 -0.521 3.165 1.00 0.43 H new ATOM 0 HG LEU B 67 -9.926 0.505 4.703 1.00 0.51 H new ATOM 0 HD11 LEU B 67 -10.721 1.456 6.833 1.00 0.80 H new ATOM 0 HD12 LEU B 67 -11.221 2.445 5.440 1.00 0.80 H new ATOM 0 HD13 LEU B 67 -12.397 1.373 6.238 1.00 0.80 H new ATOM 0 HD21 LEU B 67 -10.446 -0.980 6.600 1.00 0.52 H new ATOM 0 HD22 LEU B 67 -12.110 -1.160 5.996 1.00 0.52 H new ATOM 0 HD23 LEU B 67 -10.743 -1.776 5.037 1.00 0.52 H new ATOM 2159 N PHE B 68 -9.445 2.580 2.588 1.00 0.37 N ATOM 2160 CA PHE B 68 -8.087 2.697 2.078 1.00 0.41 C ATOM 2161 C PHE B 68 -7.108 2.744 3.240 1.00 0.39 C ATOM 2162 O PHE B 68 -7.258 3.563 4.144 1.00 0.57 O ATOM 2163 CB PHE B 68 -7.956 3.962 1.225 1.00 0.58 C ATOM 2164 CG PHE B 68 -6.796 3.941 0.272 1.00 0.45 C ATOM 2165 CD1 PHE B 68 -6.871 3.230 -0.913 1.00 1.34 C ATOM 2166 CD2 PHE B 68 -5.634 4.640 0.557 1.00 1.35 C ATOM 2167 CE1 PHE B 68 -5.810 3.218 -1.797 1.00 1.59 C ATOM 2168 CE2 PHE B 68 -4.570 4.630 -0.323 1.00 1.72 C ATOM 2169 CZ PHE B 68 -4.658 3.917 -1.501 1.00 1.45 C ATOM 0 H PHE B 68 -9.717 3.324 3.231 1.00 0.37 H new ATOM 0 HA PHE B 68 -7.860 1.831 1.456 1.00 0.41 H new ATOM 0 HB2 PHE B 68 -8.876 4.102 0.658 1.00 0.58 H new ATOM 0 HB3 PHE B 68 -7.855 4.824 1.885 1.00 0.58 H new ATOM 0 HD1 PHE B 68 -7.769 2.679 -1.149 1.00 1.34 H new ATOM 0 HD2 PHE B 68 -5.560 5.199 1.478 1.00 1.35 H new ATOM 0 HE1 PHE B 68 -5.882 2.662 -2.720 1.00 1.59 H new ATOM 0 HE2 PHE B 68 -3.670 5.180 -0.090 1.00 1.72 H new ATOM 0 HZ PHE B 68 -3.827 3.906 -2.190 1.00 1.45 H new ATOM 2179 N PHE B 69 -6.116 1.867 3.230 1.00 0.41 N ATOM 2180 CA PHE B 69 -5.143 1.830 4.312 1.00 0.42 C ATOM 2181 C PHE B 69 -3.727 1.609 3.797 1.00 0.44 C ATOM 2182 O PHE B 69 -3.519 1.123 2.682 1.00 0.53 O ATOM 2183 CB PHE B 69 -5.508 0.743 5.331 1.00 0.39 C ATOM 2184 CG PHE B 69 -5.741 -0.620 4.736 1.00 0.39 C ATOM 2185 CD1 PHE B 69 -6.996 -0.981 4.272 1.00 0.48 C ATOM 2186 CD2 PHE B 69 -4.710 -1.542 4.653 1.00 0.36 C ATOM 2187 CE1 PHE B 69 -7.218 -2.234 3.734 1.00 0.51 C ATOM 2188 CE2 PHE B 69 -4.927 -2.796 4.115 1.00 0.39 C ATOM 2189 CZ PHE B 69 -6.181 -3.143 3.656 1.00 0.45 C ATOM 0 H PHE B 69 -5.964 1.178 2.493 1.00 0.41 H new ATOM 0 HA PHE B 69 -5.171 2.803 4.802 1.00 0.42 H new ATOM 0 HB2 PHE B 69 -4.709 0.671 6.068 1.00 0.39 H new ATOM 0 HB3 PHE B 69 -6.407 1.051 5.865 1.00 0.39 H new ATOM 0 HD1 PHE B 69 -7.810 -0.274 4.332 1.00 0.48 H new ATOM 0 HD2 PHE B 69 -3.727 -1.278 5.013 1.00 0.36 H new ATOM 0 HE1 PHE B 69 -8.201 -2.502 3.375 1.00 0.51 H new ATOM 0 HE2 PHE B 69 -4.115 -3.505 4.054 1.00 0.39 H new ATOM 0 HZ PHE B 69 -6.351 -4.124 3.237 1.00 0.45 H new ATOM 2199 N LEU B 70 -2.762 1.985 4.624 1.00 0.40 N ATOM 2200 CA LEU B 70 -1.353 1.835 4.306 1.00 0.41 C ATOM 2201 C LEU B 70 -0.689 0.915 5.323 1.00 0.37 C ATOM 2202 O LEU B 70 -0.578 1.252 6.505 1.00 0.38 O ATOM 2203 CB LEU B 70 -0.657 3.201 4.297 1.00 0.48 C ATOM 2204 CG LEU B 70 0.874 3.158 4.324 1.00 0.65 C ATOM 2205 CD1 LEU B 70 1.426 2.643 3.004 1.00 1.18 C ATOM 2206 CD2 LEU B 70 1.438 4.534 4.638 1.00 1.17 C ATOM 0 H LEU B 70 -2.937 2.404 5.537 1.00 0.40 H new ATOM 0 HA LEU B 70 -1.262 1.395 3.313 1.00 0.41 H new ATOM 0 HB2 LEU B 70 -0.973 3.745 3.407 1.00 0.48 H new ATOM 0 HB3 LEU B 70 -1.003 3.772 5.159 1.00 0.48 H new ATOM 0 HG LEU B 70 1.181 2.469 5.111 1.00 0.65 H new ATOM 0 HD11 LEU B 70 2.515 2.622 3.048 1.00 1.18 H new ATOM 0 HD12 LEU B 70 1.051 1.636 2.821 1.00 1.18 H new ATOM 0 HD13 LEU B 70 1.109 3.301 2.195 1.00 1.18 H new ATOM 0 HD21 LEU B 70 2.527 4.486 4.653 1.00 1.17 H new ATOM 0 HD22 LEU B 70 1.117 5.242 3.874 1.00 1.17 H new ATOM 0 HD23 LEU B 70 1.075 4.862 5.612 1.00 1.17 H new ATOM 2218 N THR B 71 -0.260 -0.245 4.860 1.00 0.39 N ATOM 2219 CA THR B 71 0.387 -1.220 5.719 1.00 0.38 C ATOM 2220 C THR B 71 1.882 -1.297 5.422 1.00 0.40 C ATOM 2221 O THR B 71 2.283 -1.741 4.346 1.00 0.52 O ATOM 2222 CB THR B 71 -0.237 -2.622 5.547 1.00 0.41 C ATOM 2223 OG1 THR B 71 -0.490 -2.897 4.159 1.00 0.51 O ATOM 2224 CG2 THR B 71 -1.536 -2.740 6.325 1.00 0.47 C ATOM 0 H THR B 71 -0.349 -0.536 3.887 1.00 0.39 H new ATOM 0 HA THR B 71 0.238 -0.892 6.748 1.00 0.38 H new ATOM 0 HB THR B 71 0.476 -3.349 5.936 1.00 0.41 H new ATOM 0 HG1 THR B 71 -0.229 -3.819 3.955 1.00 0.51 H new ATOM 0 HG21 THR B 71 -1.954 -3.737 6.186 1.00 0.47 H new ATOM 0 HG22 THR B 71 -1.342 -2.572 7.384 1.00 0.47 H new ATOM 0 HG23 THR B 71 -2.246 -1.996 5.964 1.00 0.47 H new ATOM 2232 N PRO B 72 2.728 -0.845 6.364 1.00 0.43 N ATOM 2233 CA PRO B 72 4.184 -0.887 6.198 1.00 0.48 C ATOM 2234 C PRO B 72 4.682 -2.325 6.130 1.00 0.47 C ATOM 2235 O PRO B 72 5.714 -2.620 5.525 1.00 0.86 O ATOM 2236 CB PRO B 72 4.716 -0.180 7.450 1.00 0.67 C ATOM 2237 CG PRO B 72 3.609 -0.272 8.445 1.00 0.74 C ATOM 2238 CD PRO B 72 2.334 -0.243 7.647 1.00 0.56 C ATOM 0 HA PRO B 72 4.517 -0.413 5.275 1.00 0.48 H new ATOM 0 HB2 PRO B 72 5.621 -0.662 7.821 1.00 0.67 H new ATOM 0 HB3 PRO B 72 4.971 0.858 7.238 1.00 0.67 H new ATOM 0 HG2 PRO B 72 3.684 -1.190 9.029 1.00 0.74 H new ATOM 0 HG3 PRO B 72 3.648 0.558 9.150 1.00 0.74 H new ATOM 0 HD2 PRO B 72 1.542 -0.813 8.133 1.00 0.56 H new ATOM 0 HD3 PRO B 72 1.963 0.774 7.518 1.00 0.56 H new ATOM 2246 N HIS B 73 3.927 -3.217 6.756 1.00 0.54 N ATOM 2247 CA HIS B 73 4.257 -4.630 6.766 1.00 0.51 C ATOM 2248 C HIS B 73 3.965 -5.223 5.392 1.00 0.51 C ATOM 2249 O HIS B 73 2.808 -5.387 5.017 1.00 1.28 O ATOM 2250 CB HIS B 73 3.450 -5.360 7.844 1.00 0.69 C ATOM 2251 CG HIS B 73 3.945 -5.122 9.243 1.00 0.83 C ATOM 2252 ND1 HIS B 73 4.600 -6.084 9.978 1.00 0.83 N ATOM 2253 CD2 HIS B 73 3.875 -4.027 10.043 1.00 1.78 C ATOM 2254 CE1 HIS B 73 4.908 -5.601 11.164 1.00 0.79 C ATOM 2255 NE2 HIS B 73 4.482 -4.355 11.231 1.00 1.64 N ATOM 0 H HIS B 73 3.076 -2.982 7.266 1.00 0.54 H new ATOM 0 HA HIS B 73 5.316 -4.751 6.995 1.00 0.51 H new ATOM 0 HB2 HIS B 73 2.408 -5.045 7.779 1.00 0.69 H new ATOM 0 HB3 HIS B 73 3.473 -6.430 7.638 1.00 0.69 H new ATOM 0 HD2 HIS B 73 3.427 -3.077 9.792 1.00 1.78 H new ATOM 0 HE1 HIS B 73 5.423 -6.135 11.949 1.00 0.79 H new ATOM 0 HE2 HIS B 73 4.586 -3.735 12.034 1.00 1.64 H new ATOM 2264 N ARG B 74 5.016 -5.521 4.642 1.00 0.70 N ATOM 2265 CA ARG B 74 4.869 -6.068 3.297 1.00 0.62 C ATOM 2266 C ARG B 74 4.183 -7.427 3.304 1.00 0.53 C ATOM 2267 O ARG B 74 4.595 -8.342 4.015 1.00 0.65 O ATOM 2268 CB ARG B 74 6.233 -6.177 2.619 1.00 0.81 C ATOM 2269 CG ARG B 74 6.887 -4.831 2.362 1.00 1.10 C ATOM 2270 CD ARG B 74 5.936 -3.875 1.664 1.00 1.33 C ATOM 2271 NE ARG B 74 6.563 -2.584 1.395 1.00 1.89 N ATOM 2272 CZ ARG B 74 6.244 -1.803 0.367 1.00 2.35 C ATOM 2273 NH1 ARG B 74 5.316 -2.192 -0.506 1.00 3.07 N ATOM 2274 NH2 ARG B 74 6.868 -0.644 0.196 1.00 2.72 N ATOM 0 H ARG B 74 5.983 -5.394 4.941 1.00 0.70 H new ATOM 0 HA ARG B 74 4.236 -5.381 2.735 1.00 0.62 H new ATOM 0 HB2 ARG B 74 6.893 -6.780 3.242 1.00 0.81 H new ATOM 0 HB3 ARG B 74 6.119 -6.704 1.672 1.00 0.81 H new ATOM 0 HG2 ARG B 74 7.212 -4.397 3.307 1.00 1.10 H new ATOM 0 HG3 ARG B 74 7.779 -4.969 1.751 1.00 1.10 H new ATOM 0 HD2 ARG B 74 5.599 -4.318 0.727 1.00 1.33 H new ATOM 0 HD3 ARG B 74 5.051 -3.727 2.283 1.00 1.33 H new ATOM 0 HE ARG B 74 7.290 -2.262 2.034 1.00 1.89 H new ATOM 0 HH11 ARG B 74 4.848 -3.091 -0.387 1.00 3.07 H new ATOM 0 HH12 ARG B 74 5.073 -1.591 -1.294 1.00 3.07 H new ATOM 0 HH21 ARG B 74 7.592 -0.353 0.853 1.00 2.72 H new ATOM 0 HH22 ARG B 74 6.624 -0.045 -0.592 1.00 2.72 H new ATOM 2288 N HIS B 75 3.128 -7.541 2.508 1.00 0.46 N ATOM 2289 CA HIS B 75 2.367 -8.779 2.387 1.00 0.45 C ATOM 2290 C HIS B 75 1.710 -8.848 1.014 1.00 0.47 C ATOM 2291 O HIS B 75 1.379 -7.816 0.432 1.00 0.86 O ATOM 2292 CB HIS B 75 1.308 -8.908 3.499 1.00 0.51 C ATOM 2293 CG HIS B 75 0.662 -7.618 3.913 1.00 0.56 C ATOM 2294 ND1 HIS B 75 0.397 -7.310 5.228 1.00 0.88 N ATOM 2295 CD2 HIS B 75 0.219 -6.563 3.188 1.00 0.67 C ATOM 2296 CE1 HIS B 75 -0.175 -6.125 5.295 1.00 1.09 C ATOM 2297 NE2 HIS B 75 -0.296 -5.645 4.072 1.00 0.97 N ATOM 0 H HIS B 75 2.775 -6.779 1.928 1.00 0.46 H new ATOM 0 HA HIS B 75 3.059 -9.614 2.499 1.00 0.45 H new ATOM 0 HB2 HIS B 75 0.531 -9.594 3.162 1.00 0.51 H new ATOM 0 HB3 HIS B 75 1.775 -9.360 4.374 1.00 0.51 H new ATOM 0 HD1 HIS B 75 0.610 -7.907 6.027 1.00 0.88 H new ATOM 0 HD2 HIS B 75 0.262 -6.462 2.114 1.00 0.67 H new ATOM 0 HE1 HIS B 75 -0.492 -5.629 6.200 1.00 1.09 H new ATOM 2306 N ARG B 76 1.542 -10.057 0.494 1.00 0.54 N ATOM 2307 CA ARG B 76 0.932 -10.242 -0.823 1.00 0.51 C ATOM 2308 C ARG B 76 -0.562 -9.923 -0.772 1.00 0.51 C ATOM 2309 O ARG B 76 -1.197 -10.051 0.278 1.00 0.47 O ATOM 2310 CB ARG B 76 1.128 -11.677 -1.337 1.00 0.56 C ATOM 2311 CG ARG B 76 2.354 -12.390 -0.779 1.00 1.06 C ATOM 2312 CD ARG B 76 3.649 -11.908 -1.420 1.00 0.95 C ATOM 2313 NE ARG B 76 4.821 -12.502 -0.772 1.00 1.45 N ATOM 2314 CZ ARG B 76 6.070 -12.056 -0.914 1.00 1.88 C ATOM 2315 NH1 ARG B 76 6.340 -11.072 -1.759 1.00 2.53 N ATOM 2316 NH2 ARG B 76 7.055 -12.613 -0.224 1.00 2.41 N ATOM 0 H ARG B 76 1.817 -10.922 0.959 1.00 0.54 H new ATOM 0 HA ARG B 76 1.428 -9.556 -1.509 1.00 0.51 H new ATOM 0 HB2 ARG B 76 0.241 -12.261 -1.091 1.00 0.56 H new ATOM 0 HB3 ARG B 76 1.202 -11.652 -2.424 1.00 0.56 H new ATOM 0 HG2 ARG B 76 2.404 -12.231 0.298 1.00 1.06 H new ATOM 0 HG3 ARG B 76 2.251 -13.463 -0.939 1.00 1.06 H new ATOM 0 HD2 ARG B 76 3.649 -12.163 -2.480 1.00 0.95 H new ATOM 0 HD3 ARG B 76 3.707 -10.822 -1.354 1.00 0.95 H new ATOM 0 HE ARG B 76 4.672 -13.312 -0.171 1.00 1.45 H new ATOM 0 HH11 ARG B 76 5.590 -10.650 -2.307 1.00 2.53 H new ATOM 0 HH12 ARG B 76 7.298 -10.737 -1.862 1.00 2.53 H new ATOM 0 HH21 ARG B 76 6.858 -13.383 0.416 1.00 2.41 H new ATOM 0 HH22 ARG B 76 8.010 -12.272 -0.333 1.00 2.41 H new ATOM 2330 N VAL B 77 -1.114 -9.515 -1.913 1.00 0.63 N ATOM 2331 CA VAL B 77 -2.536 -9.180 -2.017 1.00 0.73 C ATOM 2332 C VAL B 77 -3.412 -10.355 -1.584 1.00 0.64 C ATOM 2333 O VAL B 77 -4.423 -10.178 -0.898 1.00 0.65 O ATOM 2334 CB VAL B 77 -2.914 -8.783 -3.462 1.00 1.02 C ATOM 2335 CG1 VAL B 77 -4.330 -8.226 -3.516 1.00 1.06 C ATOM 2336 CG2 VAL B 77 -1.919 -7.778 -4.024 1.00 1.22 C ATOM 0 H VAL B 77 -0.596 -9.407 -2.785 1.00 0.63 H new ATOM 0 HA VAL B 77 -2.711 -8.333 -1.353 1.00 0.73 H new ATOM 0 HB VAL B 77 -2.877 -9.680 -4.080 1.00 1.02 H new ATOM 0 HG11 VAL B 77 -4.575 -7.953 -4.543 1.00 1.06 H new ATOM 0 HG12 VAL B 77 -5.032 -8.982 -3.164 1.00 1.06 H new ATOM 0 HG13 VAL B 77 -4.398 -7.343 -2.880 1.00 1.06 H new ATOM 0 HG21 VAL B 77 -2.205 -7.513 -5.042 1.00 1.22 H new ATOM 0 HG22 VAL B 77 -1.917 -6.882 -3.403 1.00 1.22 H new ATOM 0 HG23 VAL B 77 -0.922 -8.218 -4.030 1.00 1.22 H new ATOM 2346 N SER B 78 -2.998 -11.555 -1.972 1.00 0.62 N ATOM 2347 CA SER B 78 -3.725 -12.776 -1.650 1.00 0.67 C ATOM 2348 C SER B 78 -3.825 -12.994 -0.137 1.00 0.52 C ATOM 2349 O SER B 78 -4.779 -13.604 0.345 1.00 0.52 O ATOM 2350 CB SER B 78 -3.028 -13.962 -2.316 1.00 0.83 C ATOM 2351 OG SER B 78 -2.420 -13.557 -3.533 1.00 1.33 O ATOM 0 H SER B 78 -2.150 -11.709 -2.518 1.00 0.62 H new ATOM 0 HA SER B 78 -4.743 -12.684 -2.029 1.00 0.67 H new ATOM 0 HB2 SER B 78 -2.274 -14.373 -1.645 1.00 0.83 H new ATOM 0 HB3 SER B 78 -3.750 -14.755 -2.509 1.00 0.83 H new ATOM 0 HG SER B 78 -2.927 -12.813 -3.920 1.00 1.33 H new ATOM 2357 N ALA B 79 -2.850 -12.485 0.608 1.00 0.47 N ATOM 2358 CA ALA B 79 -2.845 -12.629 2.059 1.00 0.45 C ATOM 2359 C ALA B 79 -3.866 -11.690 2.695 1.00 0.40 C ATOM 2360 O ALA B 79 -4.502 -12.029 3.693 1.00 0.49 O ATOM 2361 CB ALA B 79 -1.451 -12.364 2.617 1.00 0.47 C ATOM 0 H ALA B 79 -2.054 -11.970 0.232 1.00 0.47 H new ATOM 0 HA ALA B 79 -3.124 -13.654 2.304 1.00 0.45 H new ATOM 0 HB1 ALA B 79 -1.466 -12.476 3.701 1.00 0.47 H new ATOM 0 HB2 ALA B 79 -0.746 -13.076 2.188 1.00 0.47 H new ATOM 0 HB3 ALA B 79 -1.143 -11.350 2.361 1.00 0.47 H new ATOM 2367 N ILE B 80 -4.029 -10.516 2.103 1.00 0.36 N ATOM 2368 CA ILE B 80 -4.972 -9.529 2.606 1.00 0.48 C ATOM 2369 C ILE B 80 -6.398 -9.908 2.226 1.00 0.43 C ATOM 2370 O ILE B 80 -7.308 -9.844 3.057 1.00 0.52 O ATOM 2371 CB ILE B 80 -4.640 -8.119 2.072 1.00 0.66 C ATOM 2372 CG1 ILE B 80 -3.284 -7.661 2.612 1.00 0.65 C ATOM 2373 CG2 ILE B 80 -5.726 -7.122 2.451 1.00 0.94 C ATOM 2374 CD1 ILE B 80 -3.195 -7.679 4.124 1.00 0.48 C ATOM 0 H ILE B 80 -3.518 -10.223 1.270 1.00 0.36 H new ATOM 0 HA ILE B 80 -4.888 -9.513 3.693 1.00 0.48 H new ATOM 0 HB ILE B 80 -4.592 -8.166 0.984 1.00 0.66 H new ATOM 0 HG12 ILE B 80 -2.504 -8.303 2.203 1.00 0.65 H new ATOM 0 HG13 ILE B 80 -3.084 -6.650 2.257 1.00 0.65 H new ATOM 0 HG21 ILE B 80 -5.467 -6.137 2.063 1.00 0.94 H new ATOM 0 HG22 ILE B 80 -6.677 -7.441 2.026 1.00 0.94 H new ATOM 0 HG23 ILE B 80 -5.812 -7.073 3.536 1.00 0.94 H new ATOM 0 HD11 ILE B 80 -2.206 -7.342 4.434 1.00 0.48 H new ATOM 0 HD12 ILE B 80 -3.952 -7.015 4.541 1.00 0.48 H new ATOM 0 HD13 ILE B 80 -3.363 -8.693 4.486 1.00 0.48 H new ATOM 2386 N ASN B 81 -6.579 -10.326 0.978 1.00 0.38 N ATOM 2387 CA ASN B 81 -7.896 -10.722 0.486 1.00 0.43 C ATOM 2388 C ASN B 81 -8.468 -11.856 1.327 1.00 0.45 C ATOM 2389 O ASN B 81 -9.657 -11.872 1.632 1.00 0.53 O ATOM 2390 CB ASN B 81 -7.816 -11.155 -0.983 1.00 0.47 C ATOM 2391 CG ASN B 81 -9.067 -11.886 -1.453 1.00 0.57 C ATOM 2392 OD1 ASN B 81 -8.993 -13.209 -1.528 1.00 1.19 O flip ATOM 2393 ND2 ASN B 81 -10.087 -11.269 -1.762 1.00 0.95 N flip ATOM 0 H ASN B 81 -5.832 -10.400 0.288 1.00 0.38 H new ATOM 0 HA ASN B 81 -8.557 -9.859 0.565 1.00 0.43 H new ATOM 0 HB2 ASN B 81 -7.658 -10.276 -1.608 1.00 0.47 H new ATOM 0 HB3 ASN B 81 -6.950 -11.802 -1.119 1.00 0.47 H new ATOM 0 HD21 ASN B 81 -10.109 -10.252 -1.692 1.00 0.95 H new ATOM 0 HD22 ASN B 81 -10.910 -11.775 -2.088 1.00 0.95 H new ATOM 2400 N ASN B 82 -7.606 -12.791 1.711 1.00 0.43 N ATOM 2401 CA ASN B 82 -8.014 -13.936 2.518 1.00 0.48 C ATOM 2402 C ASN B 82 -8.632 -13.476 3.836 1.00 0.44 C ATOM 2403 O ASN B 82 -9.686 -13.969 4.250 1.00 0.54 O ATOM 2404 CB ASN B 82 -6.810 -14.844 2.784 1.00 0.52 C ATOM 2405 CG ASN B 82 -7.185 -16.110 3.527 1.00 1.11 C ATOM 2406 OD1 ASN B 82 -7.174 -16.148 4.757 1.00 1.72 O ATOM 2407 ND2 ASN B 82 -7.512 -17.157 2.785 1.00 1.61 N ATOM 0 H ASN B 82 -6.614 -12.778 1.475 1.00 0.43 H new ATOM 0 HA ASN B 82 -8.768 -14.498 1.966 1.00 0.48 H new ATOM 0 HB2 ASN B 82 -6.344 -15.109 1.835 1.00 0.52 H new ATOM 0 HB3 ASN B 82 -6.067 -14.295 3.362 1.00 0.52 H new ATOM 0 HD21 ASN B 82 -7.768 -18.038 3.231 1.00 1.61 H new ATOM 0 HD22 ASN B 82 -7.508 -17.082 1.768 1.00 1.61 H new ATOM 2414 N TYR B 83 -7.982 -12.516 4.480 1.00 0.40 N ATOM 2415 CA TYR B 83 -8.463 -11.981 5.748 1.00 0.42 C ATOM 2416 C TYR B 83 -9.712 -11.126 5.542 1.00 0.37 C ATOM 2417 O TYR B 83 -10.677 -11.228 6.297 1.00 0.43 O ATOM 2418 CB TYR B 83 -7.364 -11.154 6.429 1.00 0.52 C ATOM 2419 CG TYR B 83 -7.845 -10.372 7.634 1.00 0.51 C ATOM 2420 CD1 TYR B 83 -8.256 -11.019 8.794 1.00 1.10 C ATOM 2421 CD2 TYR B 83 -7.892 -8.983 7.608 1.00 1.19 C ATOM 2422 CE1 TYR B 83 -8.703 -10.304 9.890 1.00 1.05 C ATOM 2423 CE2 TYR B 83 -8.335 -8.263 8.699 1.00 1.32 C ATOM 2424 CZ TYR B 83 -8.739 -8.927 9.837 1.00 0.69 C ATOM 2425 OH TYR B 83 -9.185 -8.210 10.922 1.00 0.84 O ATOM 0 H TYR B 83 -7.118 -12.090 4.145 1.00 0.40 H new ATOM 0 HA TYR B 83 -8.725 -12.821 6.392 1.00 0.42 H new ATOM 0 HB2 TYR B 83 -6.559 -11.821 6.738 1.00 0.52 H new ATOM 0 HB3 TYR B 83 -6.941 -10.460 5.702 1.00 0.52 H new ATOM 0 HD1 TYR B 83 -8.226 -12.098 8.840 1.00 1.10 H new ATOM 0 HD2 TYR B 83 -7.576 -8.458 6.719 1.00 1.19 H new ATOM 0 HE1 TYR B 83 -9.022 -10.822 10.783 1.00 1.05 H new ATOM 0 HE2 TYR B 83 -8.365 -7.184 8.661 1.00 1.32 H new ATOM 0 HH TYR B 83 -9.655 -8.809 11.539 1.00 0.84 H new ATOM 2435 N ALA B 84 -9.689 -10.288 4.515 1.00 0.38 N ATOM 2436 CA ALA B 84 -10.816 -9.414 4.214 1.00 0.42 C ATOM 2437 C ALA B 84 -12.064 -10.219 3.854 1.00 0.43 C ATOM 2438 O ALA B 84 -13.161 -9.937 4.339 1.00 0.46 O ATOM 2439 CB ALA B 84 -10.453 -8.466 3.081 1.00 0.53 C ATOM 0 H ALA B 84 -8.901 -10.194 3.874 1.00 0.38 H new ATOM 0 HA ALA B 84 -11.041 -8.833 5.108 1.00 0.42 H new ATOM 0 HB1 ALA B 84 -11.301 -7.817 2.864 1.00 0.53 H new ATOM 0 HB2 ALA B 84 -9.597 -7.858 3.375 1.00 0.53 H new ATOM 0 HB3 ALA B 84 -10.200 -9.042 2.191 1.00 0.53 H new ATOM 2445 N GLN B 85 -11.884 -11.241 3.025 1.00 0.54 N ATOM 2446 CA GLN B 85 -12.993 -12.082 2.588 1.00 0.62 C ATOM 2447 C GLN B 85 -13.559 -12.910 3.737 1.00 0.61 C ATOM 2448 O GLN B 85 -14.651 -13.469 3.624 1.00 0.70 O ATOM 2449 CB GLN B 85 -12.557 -13.002 1.451 1.00 0.76 C ATOM 2450 CG GLN B 85 -13.409 -12.855 0.203 1.00 1.12 C ATOM 2451 CD GLN B 85 -13.031 -13.843 -0.880 1.00 1.17 C ATOM 2452 OE1 GLN B 85 -12.122 -13.446 -1.757 1.00 1.77 O flip ATOM 2453 NE2 GLN B 85 -13.552 -14.956 -0.930 1.00 1.47 N flip ATOM 0 H GLN B 85 -10.978 -11.508 2.641 1.00 0.54 H new ATOM 0 HA GLN B 85 -13.780 -11.418 2.229 1.00 0.62 H new ATOM 0 HB2 GLN B 85 -11.517 -12.792 1.200 1.00 0.76 H new ATOM 0 HB3 GLN B 85 -12.599 -14.036 1.792 1.00 0.76 H new ATOM 0 HG2 GLN B 85 -14.458 -12.993 0.465 1.00 1.12 H new ATOM 0 HG3 GLN B 85 -13.308 -11.841 -0.184 1.00 1.12 H new ATOM 0 HE21 GLN B 85 -14.249 -15.225 -0.235 1.00 1.47 H new ATOM 0 HE22 GLN B 85 -13.287 -15.610 -1.666 1.00 1.47 H new ATOM 2462 N LYS B 86 -12.825 -12.988 4.839 1.00 0.62 N ATOM 2463 CA LYS B 86 -13.278 -13.738 6.005 1.00 0.68 C ATOM 2464 C LYS B 86 -14.508 -13.062 6.615 1.00 0.64 C ATOM 2465 O LYS B 86 -15.313 -13.696 7.302 1.00 0.76 O ATOM 2466 CB LYS B 86 -12.156 -13.842 7.042 1.00 0.74 C ATOM 2467 CG LYS B 86 -12.506 -14.714 8.234 1.00 1.15 C ATOM 2468 CD LYS B 86 -11.387 -14.729 9.260 1.00 1.51 C ATOM 2469 CE LYS B 86 -11.767 -15.549 10.481 1.00 2.02 C ATOM 2470 NZ LYS B 86 -10.631 -15.704 11.425 1.00 2.67 N ATOM 0 H LYS B 86 -11.914 -12.542 4.951 1.00 0.62 H new ATOM 0 HA LYS B 86 -13.550 -14.746 5.691 1.00 0.68 H new ATOM 0 HB2 LYS B 86 -11.264 -14.242 6.560 1.00 0.74 H new ATOM 0 HB3 LYS B 86 -11.906 -12.842 7.396 1.00 0.74 H new ATOM 0 HG2 LYS B 86 -13.422 -14.347 8.698 1.00 1.15 H new ATOM 0 HG3 LYS B 86 -12.705 -15.731 7.896 1.00 1.15 H new ATOM 0 HD2 LYS B 86 -10.484 -15.141 8.810 1.00 1.51 H new ATOM 0 HD3 LYS B 86 -11.155 -13.708 9.563 1.00 1.51 H new ATOM 0 HE2 LYS B 86 -12.601 -15.070 10.994 1.00 2.02 H new ATOM 0 HE3 LYS B 86 -12.111 -16.533 10.163 1.00 2.02 H new ATOM 0 HZ1 LYS B 86 -10.934 -16.270 12.243 1.00 2.67 H new ATOM 0 HZ2 LYS B 86 -9.844 -16.184 10.945 1.00 2.67 H new ATOM 0 HZ3 LYS B 86 -10.319 -14.766 11.749 1.00 2.67 H new ATOM 2484 N LEU B 87 -14.651 -11.771 6.342 1.00 0.61 N ATOM 2485 CA LEU B 87 -15.776 -10.996 6.848 1.00 0.66 C ATOM 2486 C LEU B 87 -16.815 -10.775 5.751 1.00 0.72 C ATOM 2487 O LEU B 87 -17.717 -9.948 5.886 1.00 0.87 O ATOM 2488 CB LEU B 87 -15.300 -9.645 7.394 1.00 0.69 C ATOM 2489 CG LEU B 87 -14.675 -9.684 8.792 1.00 0.69 C ATOM 2490 CD1 LEU B 87 -13.210 -10.088 8.716 1.00 0.75 C ATOM 2491 CD2 LEU B 87 -14.823 -8.334 9.475 1.00 0.77 C ATOM 0 H LEU B 87 -13.998 -11.237 5.770 1.00 0.61 H new ATOM 0 HA LEU B 87 -16.236 -11.561 7.659 1.00 0.66 H new ATOM 0 HB2 LEU B 87 -14.570 -9.229 6.700 1.00 0.69 H new ATOM 0 HB3 LEU B 87 -16.148 -8.961 7.413 1.00 0.69 H new ATOM 0 HG LEU B 87 -15.203 -10.432 9.384 1.00 0.69 H new ATOM 0 HD11 LEU B 87 -12.786 -10.109 9.720 1.00 0.75 H new ATOM 0 HD12 LEU B 87 -13.128 -11.078 8.267 1.00 0.75 H new ATOM 0 HD13 LEU B 87 -12.665 -9.367 8.107 1.00 0.75 H new ATOM 0 HD21 LEU B 87 -14.374 -8.377 10.467 1.00 0.77 H new ATOM 0 HD22 LEU B 87 -14.321 -7.569 8.882 1.00 0.77 H new ATOM 0 HD23 LEU B 87 -15.881 -8.086 9.566 1.00 0.77 H new ATOM 2503 N CYS B 88 -16.699 -11.532 4.668 1.00 0.73 N ATOM 2504 CA CYS B 88 -17.626 -11.418 3.547 1.00 0.83 C ATOM 2505 C CYS B 88 -18.865 -12.282 3.787 1.00 0.90 C ATOM 2506 O CYS B 88 -19.411 -12.883 2.863 1.00 1.14 O ATOM 2507 CB CYS B 88 -16.928 -11.827 2.245 1.00 0.89 C ATOM 2508 SG CYS B 88 -17.738 -11.225 0.748 1.00 1.71 S ATOM 0 H CYS B 88 -15.970 -12.234 4.541 1.00 0.73 H new ATOM 0 HA CYS B 88 -17.946 -10.380 3.460 1.00 0.83 H new ATOM 0 HB2 CYS B 88 -15.903 -11.456 2.264 1.00 0.89 H new ATOM 0 HB3 CYS B 88 -16.873 -12.915 2.202 1.00 0.89 H new ATOM 0 HG CYS B 88 -18.830 -10.596 1.068 1.00 1.71 H new ATOM 2514 N THR B 89 -19.305 -12.327 5.033 1.00 0.94 N ATOM 2515 CA THR B 89 -20.464 -13.113 5.416 1.00 1.06 C ATOM 2516 C THR B 89 -21.746 -12.283 5.377 1.00 1.12 C ATOM 2517 O THR B 89 -22.646 -12.537 4.575 1.00 1.75 O ATOM 2518 CB THR B 89 -20.268 -13.665 6.836 1.00 1.17 C ATOM 2519 OG1 THR B 89 -19.595 -12.676 7.632 1.00 1.74 O ATOM 2520 CG2 THR B 89 -19.452 -14.952 6.815 1.00 1.30 C ATOM 0 H THR B 89 -18.870 -11.821 5.805 1.00 0.94 H new ATOM 0 HA THR B 89 -20.562 -13.930 4.701 1.00 1.06 H new ATOM 0 HB THR B 89 -21.244 -13.891 7.264 1.00 1.17 H new ATOM 0 HG1 THR B 89 -19.467 -13.019 8.541 1.00 1.74 H new ATOM 0 HG21 THR B 89 -19.328 -15.321 7.833 1.00 1.30 H new ATOM 0 HG22 THR B 89 -19.971 -15.702 6.218 1.00 1.30 H new ATOM 0 HG23 THR B 89 -18.473 -14.755 6.379 1.00 1.30 H new ATOM 2528 N PHE B 90 -21.802 -11.271 6.232 1.00 0.82 N ATOM 2529 CA PHE B 90 -22.975 -10.407 6.342 1.00 0.84 C ATOM 2530 C PHE B 90 -23.039 -9.356 5.231 1.00 0.82 C ATOM 2531 O PHE B 90 -23.957 -8.538 5.204 1.00 1.55 O ATOM 2532 CB PHE B 90 -22.996 -9.717 7.716 1.00 0.93 C ATOM 2533 CG PHE B 90 -21.816 -8.814 7.977 1.00 0.90 C ATOM 2534 CD1 PHE B 90 -20.584 -9.342 8.331 1.00 1.35 C ATOM 2535 CD2 PHE B 90 -21.944 -7.437 7.871 1.00 1.07 C ATOM 2536 CE1 PHE B 90 -19.502 -8.515 8.572 1.00 1.51 C ATOM 2537 CE2 PHE B 90 -20.866 -6.606 8.111 1.00 1.20 C ATOM 2538 CZ PHE B 90 -19.644 -7.145 8.461 1.00 1.24 C ATOM 0 H PHE B 90 -21.042 -11.025 6.866 1.00 0.82 H new ATOM 0 HA PHE B 90 -23.852 -11.045 6.234 1.00 0.84 H new ATOM 0 HB2 PHE B 90 -23.912 -9.132 7.801 1.00 0.93 H new ATOM 0 HB3 PHE B 90 -23.032 -10.481 8.492 1.00 0.93 H new ATOM 0 HD1 PHE B 90 -20.468 -10.412 8.420 1.00 1.35 H new ATOM 0 HD2 PHE B 90 -22.897 -7.009 7.598 1.00 1.07 H new ATOM 0 HE1 PHE B 90 -18.548 -8.939 8.847 1.00 1.51 H new ATOM 0 HE2 PHE B 90 -20.979 -5.535 8.025 1.00 1.20 H new ATOM 0 HZ PHE B 90 -18.800 -6.497 8.648 1.00 1.24 H new ATOM 2548 N SER B 91 -22.078 -9.378 4.316 1.00 0.78 N ATOM 2549 CA SER B 91 -22.053 -8.411 3.224 1.00 0.66 C ATOM 2550 C SER B 91 -21.006 -8.785 2.183 1.00 0.58 C ATOM 2551 O SER B 91 -20.149 -9.635 2.438 1.00 0.67 O ATOM 2552 CB SER B 91 -21.754 -7.013 3.773 1.00 0.74 C ATOM 2553 OG SER B 91 -20.777 -7.075 4.802 1.00 1.42 O ATOM 0 H SER B 91 -21.310 -10.050 4.307 1.00 0.78 H new ATOM 0 HA SER B 91 -23.032 -8.416 2.745 1.00 0.66 H new ATOM 0 HB2 SER B 91 -21.401 -6.369 2.968 1.00 0.74 H new ATOM 0 HB3 SER B 91 -22.669 -6.566 4.161 1.00 0.74 H new ATOM 0 HG SER B 91 -21.222 -7.117 5.674 1.00 1.42 H new ATOM 2559 N PHE B 92 -21.076 -8.134 1.027 1.00 0.53 N ATOM 2560 CA PHE B 92 -20.127 -8.367 -0.058 1.00 0.48 C ATOM 2561 C PHE B 92 -18.770 -7.766 0.304 1.00 0.46 C ATOM 2562 O PHE B 92 -18.631 -7.130 1.356 1.00 0.50 O ATOM 2563 CB PHE B 92 -20.654 -7.749 -1.363 1.00 0.46 C ATOM 2564 CG PHE B 92 -20.523 -6.247 -1.430 1.00 0.39 C ATOM 2565 CD1 PHE B 92 -21.352 -5.427 -0.678 1.00 1.02 C ATOM 2566 CD2 PHE B 92 -19.568 -5.659 -2.244 1.00 1.13 C ATOM 2567 CE1 PHE B 92 -21.229 -4.053 -0.739 1.00 0.96 C ATOM 2568 CE2 PHE B 92 -19.443 -4.284 -2.309 1.00 1.19 C ATOM 2569 CZ PHE B 92 -20.273 -3.480 -1.555 1.00 0.45 C ATOM 0 H PHE B 92 -21.787 -7.434 0.815 1.00 0.53 H new ATOM 0 HA PHE B 92 -20.010 -9.441 -0.205 1.00 0.48 H new ATOM 0 HB2 PHE B 92 -20.116 -8.188 -2.203 1.00 0.46 H new ATOM 0 HB3 PHE B 92 -21.704 -8.017 -1.481 1.00 0.46 H new ATOM 0 HD1 PHE B 92 -22.102 -5.868 -0.038 1.00 1.02 H new ATOM 0 HD2 PHE B 92 -18.913 -6.283 -2.835 1.00 1.13 H new ATOM 0 HE1 PHE B 92 -21.881 -3.426 -0.148 1.00 0.96 H new ATOM 0 HE2 PHE B 92 -18.696 -3.839 -2.950 1.00 1.19 H new ATOM 0 HZ PHE B 92 -20.175 -2.405 -1.603 1.00 0.45 H new ATOM 2579 N LEU B 93 -17.771 -7.967 -0.546 1.00 0.44 N ATOM 2580 CA LEU B 93 -16.447 -7.424 -0.284 1.00 0.43 C ATOM 2581 C LEU B 93 -15.580 -7.416 -1.533 1.00 0.42 C ATOM 2582 O LEU B 93 -15.308 -8.461 -2.123 1.00 0.50 O ATOM 2583 CB LEU B 93 -15.748 -8.218 0.819 1.00 0.50 C ATOM 2584 CG LEU B 93 -14.372 -7.684 1.219 1.00 0.63 C ATOM 2585 CD1 LEU B 93 -14.302 -7.455 2.718 1.00 0.58 C ATOM 2586 CD2 LEU B 93 -13.279 -8.639 0.767 1.00 1.13 C ATOM 0 H LEU B 93 -17.852 -8.497 -1.414 1.00 0.44 H new ATOM 0 HA LEU B 93 -16.584 -6.393 0.041 1.00 0.43 H new ATOM 0 HB2 LEU B 93 -16.388 -8.229 1.701 1.00 0.50 H new ATOM 0 HB3 LEU B 93 -15.640 -9.252 0.491 1.00 0.50 H new ATOM 0 HG LEU B 93 -14.216 -6.726 0.722 1.00 0.63 H new ATOM 0 HD11 LEU B 93 -13.315 -7.075 2.982 1.00 0.58 H new ATOM 0 HD12 LEU B 93 -15.061 -6.729 3.011 1.00 0.58 H new ATOM 0 HD13 LEU B 93 -14.480 -8.396 3.239 1.00 0.58 H new ATOM 0 HD21 LEU B 93 -12.306 -8.244 1.060 1.00 1.13 H new ATOM 0 HD22 LEU B 93 -13.430 -9.612 1.234 1.00 1.13 H new ATOM 0 HD23 LEU B 93 -13.315 -8.747 -0.317 1.00 1.13 H new ATOM 2598 N ILE B 94 -15.150 -6.227 -1.928 1.00 0.42 N ATOM 2599 CA ILE B 94 -14.284 -6.071 -3.083 1.00 0.43 C ATOM 2600 C ILE B 94 -12.941 -5.512 -2.636 1.00 0.40 C ATOM 2601 O ILE B 94 -12.775 -4.300 -2.502 1.00 0.48 O ATOM 2602 CB ILE B 94 -14.894 -5.137 -4.147 1.00 0.50 C ATOM 2603 CG1 ILE B 94 -16.368 -5.471 -4.373 1.00 0.66 C ATOM 2604 CG2 ILE B 94 -14.114 -5.250 -5.451 1.00 0.65 C ATOM 2605 CD1 ILE B 94 -17.110 -4.421 -5.168 1.00 0.66 C ATOM 0 H ILE B 94 -15.389 -5.352 -1.461 1.00 0.42 H new ATOM 0 HA ILE B 94 -14.159 -7.054 -3.536 1.00 0.43 H new ATOM 0 HB ILE B 94 -14.829 -4.110 -3.789 1.00 0.50 H new ATOM 0 HG12 ILE B 94 -16.440 -6.427 -4.892 1.00 0.66 H new ATOM 0 HG13 ILE B 94 -16.856 -5.596 -3.406 1.00 0.66 H new ATOM 0 HG21 ILE B 94 -14.553 -4.586 -6.196 1.00 0.65 H new ATOM 0 HG22 ILE B 94 -13.076 -4.967 -5.279 1.00 0.65 H new ATOM 0 HG23 ILE B 94 -14.155 -6.278 -5.812 1.00 0.65 H new ATOM 0 HD11 ILE B 94 -18.150 -4.724 -5.290 1.00 0.66 H new ATOM 0 HD12 ILE B 94 -17.069 -3.468 -4.640 1.00 0.66 H new ATOM 0 HD13 ILE B 94 -16.647 -4.312 -6.149 1.00 0.66 H new ATOM 2617 N CYS B 95 -11.997 -6.399 -2.369 1.00 0.37 N ATOM 2618 CA CYS B 95 -10.673 -5.991 -1.931 1.00 0.39 C ATOM 2619 C CYS B 95 -9.667 -6.152 -3.065 1.00 0.41 C ATOM 2620 O CYS B 95 -9.634 -7.189 -3.731 1.00 0.60 O ATOM 2621 CB CYS B 95 -10.240 -6.815 -0.714 1.00 0.45 C ATOM 2622 SG CYS B 95 -8.668 -6.300 0.014 1.00 0.56 S ATOM 0 H CYS B 95 -12.123 -7.408 -2.448 1.00 0.37 H new ATOM 0 HA CYS B 95 -10.709 -4.940 -1.645 1.00 0.39 H new ATOM 0 HB2 CYS B 95 -11.017 -6.752 0.048 1.00 0.45 H new ATOM 0 HB3 CYS B 95 -10.165 -7.862 -1.007 1.00 0.45 H new ATOM 0 HG CYS B 95 -8.592 -6.737 1.236 1.00 0.56 H new ATOM 2628 N LYS B 96 -8.867 -5.119 -3.292 1.00 0.36 N ATOM 2629 CA LYS B 96 -7.859 -5.145 -4.340 1.00 0.40 C ATOM 2630 C LYS B 96 -6.611 -4.394 -3.900 1.00 0.41 C ATOM 2631 O LYS B 96 -6.682 -3.484 -3.071 1.00 0.70 O ATOM 2632 CB LYS B 96 -8.400 -4.520 -5.630 1.00 0.49 C ATOM 2633 CG LYS B 96 -8.576 -5.516 -6.765 1.00 0.88 C ATOM 2634 CD LYS B 96 -10.028 -5.930 -6.917 1.00 1.25 C ATOM 2635 CE LYS B 96 -10.174 -7.124 -7.843 1.00 1.61 C ATOM 2636 NZ LYS B 96 -11.575 -7.610 -7.892 1.00 2.13 N ATOM 0 H LYS B 96 -8.898 -4.249 -2.761 1.00 0.36 H new ATOM 0 HA LYS B 96 -7.603 -6.187 -4.530 1.00 0.40 H new ATOM 0 HB2 LYS B 96 -9.360 -4.049 -5.420 1.00 0.49 H new ATOM 0 HB3 LYS B 96 -7.721 -3.731 -5.953 1.00 0.49 H new ATOM 0 HG2 LYS B 96 -8.222 -5.075 -7.697 1.00 0.88 H new ATOM 0 HG3 LYS B 96 -7.962 -6.397 -6.577 1.00 0.88 H new ATOM 0 HD2 LYS B 96 -10.442 -6.175 -5.939 1.00 1.25 H new ATOM 0 HD3 LYS B 96 -10.607 -5.093 -7.307 1.00 1.25 H new ATOM 0 HE2 LYS B 96 -9.849 -6.849 -8.846 1.00 1.61 H new ATOM 0 HE3 LYS B 96 -9.521 -7.929 -7.506 1.00 1.61 H new ATOM 0 HZ1 LYS B 96 -11.607 -8.528 -8.379 1.00 2.13 H new ATOM 0 HZ2 LYS B 96 -11.939 -7.719 -6.924 1.00 2.13 H new ATOM 0 HZ3 LYS B 96 -12.163 -6.924 -8.407 1.00 2.13 H new ATOM 2650 N GLY B 97 -5.473 -4.787 -4.452 1.00 0.44 N ATOM 2651 CA GLY B 97 -4.225 -4.132 -4.127 1.00 0.43 C ATOM 2652 C GLY B 97 -4.033 -2.880 -4.953 1.00 0.41 C ATOM 2653 O GLY B 97 -4.422 -2.840 -6.123 1.00 0.53 O ATOM 0 H GLY B 97 -5.393 -5.552 -5.122 1.00 0.44 H new ATOM 0 HA2 GLY B 97 -4.210 -3.877 -3.067 1.00 0.43 H new ATOM 0 HA3 GLY B 97 -3.395 -4.817 -4.302 1.00 0.43 H new ATOM 2657 N VAL B 98 -3.438 -1.863 -4.356 1.00 0.35 N ATOM 2658 CA VAL B 98 -3.212 -0.602 -5.044 1.00 0.39 C ATOM 2659 C VAL B 98 -1.767 -0.485 -5.517 1.00 0.43 C ATOM 2660 O VAL B 98 -0.831 -0.747 -4.764 1.00 0.54 O ATOM 2661 CB VAL B 98 -3.552 0.595 -4.133 1.00 0.45 C ATOM 2662 CG1 VAL B 98 -3.520 1.899 -4.914 1.00 0.59 C ATOM 2663 CG2 VAL B 98 -4.908 0.396 -3.472 1.00 0.64 C ATOM 0 H VAL B 98 -3.101 -1.885 -3.393 1.00 0.35 H new ATOM 0 HA VAL B 98 -3.871 -0.586 -5.912 1.00 0.39 H new ATOM 0 HB VAL B 98 -2.794 0.652 -3.352 1.00 0.45 H new ATOM 0 HG11 VAL B 98 -3.763 2.728 -4.249 1.00 0.59 H new ATOM 0 HG12 VAL B 98 -2.524 2.049 -5.331 1.00 0.59 H new ATOM 0 HG13 VAL B 98 -4.250 1.857 -5.723 1.00 0.59 H new ATOM 0 HG21 VAL B 98 -5.130 1.251 -2.833 1.00 0.64 H new ATOM 0 HG22 VAL B 98 -5.677 0.307 -4.239 1.00 0.64 H new ATOM 0 HG23 VAL B 98 -4.889 -0.512 -2.869 1.00 0.64 H new ATOM 2673 N ASN B 99 -1.601 -0.097 -6.775 1.00 0.47 N ATOM 2674 CA ASN B 99 -0.277 0.065 -7.364 1.00 0.59 C ATOM 2675 C ASN B 99 0.230 1.478 -7.140 1.00 0.58 C ATOM 2676 O ASN B 99 1.428 1.705 -6.985 1.00 0.75 O ATOM 2677 CB ASN B 99 -0.315 -0.207 -8.868 1.00 0.75 C ATOM 2678 CG ASN B 99 -0.176 -1.672 -9.216 1.00 0.90 C ATOM 2679 OD1 ASN B 99 0.494 -2.437 -8.520 1.00 1.73 O ATOM 2680 ND2 ASN B 99 -0.808 -2.069 -10.306 1.00 1.12 N ATOM 0 H ASN B 99 -2.371 0.112 -7.410 1.00 0.47 H new ATOM 0 HA ASN B 99 0.390 -0.650 -6.883 1.00 0.59 H new ATOM 0 HB2 ASN B 99 -1.254 0.168 -9.274 1.00 0.75 H new ATOM 0 HB3 ASN B 99 0.487 0.351 -9.351 1.00 0.75 H new ATOM 0 HD21 ASN B 99 -0.752 -3.044 -10.601 1.00 1.12 H new ATOM 0 HD22 ASN B 99 -1.352 -1.401 -10.852 1.00 1.12 H new ATOM 2687 N LYS B 100 -0.694 2.429 -7.147 1.00 0.59 N ATOM 2688 CA LYS B 100 -0.350 3.828 -6.952 1.00 0.64 C ATOM 2689 C LYS B 100 -1.218 4.441 -5.867 1.00 0.54 C ATOM 2690 O LYS B 100 -2.323 4.918 -6.126 1.00 0.53 O ATOM 2691 CB LYS B 100 -0.492 4.604 -8.262 1.00 0.74 C ATOM 2692 CG LYS B 100 0.593 4.265 -9.265 1.00 1.19 C ATOM 2693 CD LYS B 100 0.765 5.357 -10.303 1.00 1.37 C ATOM 2694 CE LYS B 100 2.120 5.259 -10.975 1.00 1.82 C ATOM 2695 NZ LYS B 100 3.230 5.635 -10.053 1.00 2.39 N ATOM 0 H LYS B 100 -1.689 2.255 -7.286 1.00 0.59 H new ATOM 0 HA LYS B 100 0.691 3.887 -6.633 1.00 0.64 H new ATOM 0 HB2 LYS B 100 -1.466 4.391 -8.702 1.00 0.74 H new ATOM 0 HB3 LYS B 100 -0.464 5.673 -8.051 1.00 0.74 H new ATOM 0 HG2 LYS B 100 1.536 4.110 -8.741 1.00 1.19 H new ATOM 0 HG3 LYS B 100 0.347 3.327 -9.762 1.00 1.19 H new ATOM 0 HD2 LYS B 100 -0.023 5.279 -11.052 1.00 1.37 H new ATOM 0 HD3 LYS B 100 0.659 6.333 -9.830 1.00 1.37 H new ATOM 0 HE2 LYS B 100 2.275 4.241 -11.332 1.00 1.82 H new ATOM 0 HE3 LYS B 100 2.139 5.910 -11.849 1.00 1.82 H new ATOM 0 HZ1 LYS B 100 4.073 5.884 -10.608 1.00 2.39 H new ATOM 0 HZ2 LYS B 100 2.941 6.452 -9.477 1.00 2.39 H new ATOM 0 HZ3 LYS B 100 3.450 4.832 -9.430 1.00 2.39 H new ATOM 2709 N GLU B 101 -0.692 4.418 -4.657 1.00 0.63 N ATOM 2710 CA GLU B 101 -1.370 4.941 -3.479 1.00 0.66 C ATOM 2711 C GLU B 101 -1.633 6.438 -3.600 1.00 0.60 C ATOM 2712 O GLU B 101 -2.774 6.892 -3.483 1.00 0.65 O ATOM 2713 CB GLU B 101 -0.523 4.670 -2.228 1.00 0.86 C ATOM 2714 CG GLU B 101 0.846 4.055 -2.520 1.00 2.04 C ATOM 2715 CD GLU B 101 1.865 5.056 -3.054 1.00 2.82 C ATOM 2716 OE1 GLU B 101 1.636 5.625 -4.149 1.00 3.40 O ATOM 2717 OE2 GLU B 101 2.893 5.265 -2.389 1.00 3.42 O ATOM 0 H GLU B 101 0.231 4.031 -4.459 1.00 0.63 H new ATOM 0 HA GLU B 101 -2.331 4.434 -3.396 1.00 0.66 H new ATOM 0 HB2 GLU B 101 -0.381 5.607 -1.689 1.00 0.86 H new ATOM 0 HB3 GLU B 101 -1.075 4.003 -1.566 1.00 0.86 H new ATOM 0 HG2 GLU B 101 1.235 3.606 -1.606 1.00 2.04 H new ATOM 0 HG3 GLU B 101 0.726 3.250 -3.245 1.00 2.04 H new ATOM 2724 N TYR B 102 -0.571 7.190 -3.848 1.00 0.55 N ATOM 2725 CA TYR B 102 -0.656 8.639 -3.976 1.00 0.56 C ATOM 2726 C TYR B 102 -1.607 9.040 -5.102 1.00 0.48 C ATOM 2727 O TYR B 102 -2.420 9.955 -4.950 1.00 0.57 O ATOM 2728 CB TYR B 102 0.739 9.217 -4.233 1.00 0.66 C ATOM 2729 CG TYR B 102 0.805 10.727 -4.175 1.00 0.71 C ATOM 2730 CD1 TYR B 102 0.525 11.412 -2.999 1.00 0.89 C ATOM 2731 CD2 TYR B 102 1.152 11.466 -5.298 1.00 0.77 C ATOM 2732 CE1 TYR B 102 0.589 12.791 -2.945 1.00 1.00 C ATOM 2733 CE2 TYR B 102 1.220 12.845 -5.251 1.00 0.89 C ATOM 2734 CZ TYR B 102 0.937 13.503 -4.074 1.00 0.94 C ATOM 2735 OH TYR B 102 1.008 14.877 -4.022 1.00 1.09 O ATOM 0 H TYR B 102 0.371 6.816 -3.966 1.00 0.55 H new ATOM 0 HA TYR B 102 -1.051 9.043 -3.044 1.00 0.56 H new ATOM 0 HB2 TYR B 102 1.431 8.806 -3.498 1.00 0.66 H new ATOM 0 HB3 TYR B 102 1.082 8.887 -5.214 1.00 0.66 H new ATOM 0 HD1 TYR B 102 0.253 10.858 -2.113 1.00 0.89 H new ATOM 0 HD2 TYR B 102 1.372 10.954 -6.223 1.00 0.77 H new ATOM 0 HE1 TYR B 102 0.368 13.309 -2.023 1.00 1.00 H new ATOM 0 HE2 TYR B 102 1.494 13.405 -6.133 1.00 0.89 H new ATOM 0 HH TYR B 102 1.267 15.225 -4.901 1.00 1.09 H new ATOM 2745 N LEU B 103 -1.520 8.332 -6.218 1.00 0.51 N ATOM 2746 CA LEU B 103 -2.361 8.622 -7.371 1.00 0.49 C ATOM 2747 C LEU B 103 -3.822 8.279 -7.094 1.00 0.46 C ATOM 2748 O LEU B 103 -4.720 9.043 -7.448 1.00 0.53 O ATOM 2749 CB LEU B 103 -1.862 7.864 -8.604 1.00 0.56 C ATOM 2750 CG LEU B 103 -0.912 8.646 -9.518 1.00 0.62 C ATOM 2751 CD1 LEU B 103 -1.561 9.940 -9.982 1.00 1.05 C ATOM 2752 CD2 LEU B 103 0.407 8.931 -8.813 1.00 1.19 C ATOM 0 H LEU B 103 -0.876 7.552 -6.350 1.00 0.51 H new ATOM 0 HA LEU B 103 -2.298 9.692 -7.567 1.00 0.49 H new ATOM 0 HB2 LEU B 103 -1.355 6.958 -8.272 1.00 0.56 H new ATOM 0 HB3 LEU B 103 -2.726 7.549 -9.190 1.00 0.56 H new ATOM 0 HG LEU B 103 -0.702 8.032 -10.394 1.00 0.62 H new ATOM 0 HD11 LEU B 103 -0.871 10.481 -10.630 1.00 1.05 H new ATOM 0 HD12 LEU B 103 -2.473 9.712 -10.533 1.00 1.05 H new ATOM 0 HD13 LEU B 103 -1.804 10.556 -9.116 1.00 1.05 H new ATOM 0 HD21 LEU B 103 1.064 9.487 -9.482 1.00 1.19 H new ATOM 0 HD22 LEU B 103 0.220 9.521 -7.915 1.00 1.19 H new ATOM 0 HD23 LEU B 103 0.882 7.990 -8.536 1.00 1.19 H new ATOM 2764 N MET B 104 -4.061 7.142 -6.451 1.00 0.47 N ATOM 2765 CA MET B 104 -5.422 6.723 -6.140 1.00 0.47 C ATOM 2766 C MET B 104 -6.048 7.659 -5.114 1.00 0.44 C ATOM 2767 O MET B 104 -7.235 7.981 -5.194 1.00 0.52 O ATOM 2768 CB MET B 104 -5.449 5.284 -5.623 1.00 0.55 C ATOM 2769 CG MET B 104 -6.856 4.728 -5.462 1.00 0.59 C ATOM 2770 SD MET B 104 -6.874 2.945 -5.194 1.00 1.21 S ATOM 2771 CE MET B 104 -8.628 2.649 -4.991 1.00 0.88 C ATOM 0 H MET B 104 -3.335 6.498 -6.137 1.00 0.47 H new ATOM 0 HA MET B 104 -6.004 6.768 -7.060 1.00 0.47 H new ATOM 0 HB2 MET B 104 -4.891 4.648 -6.310 1.00 0.55 H new ATOM 0 HB3 MET B 104 -4.937 5.241 -4.662 1.00 0.55 H new ATOM 0 HG2 MET B 104 -7.344 5.222 -4.622 1.00 0.59 H new ATOM 0 HG3 MET B 104 -7.439 4.963 -6.352 1.00 0.59 H new ATOM 0 HE1 MET B 104 -8.823 2.303 -3.976 1.00 0.88 H new ATOM 0 HE2 MET B 104 -9.176 3.574 -5.171 1.00 0.88 H new ATOM 0 HE3 MET B 104 -8.954 1.890 -5.702 1.00 0.88 H new ATOM 2781 N TYR B 105 -5.246 8.112 -4.158 1.00 0.50 N ATOM 2782 CA TYR B 105 -5.741 9.012 -3.130 1.00 0.50 C ATOM 2783 C TYR B 105 -6.100 10.368 -3.727 1.00 0.42 C ATOM 2784 O TYR B 105 -6.955 11.075 -3.199 1.00 0.44 O ATOM 2785 CB TYR B 105 -4.726 9.179 -2.001 1.00 0.57 C ATOM 2786 CG TYR B 105 -5.383 9.308 -0.645 1.00 0.56 C ATOM 2787 CD1 TYR B 105 -6.124 8.259 -0.121 1.00 0.59 C ATOM 2788 CD2 TYR B 105 -5.285 10.478 0.100 1.00 0.59 C ATOM 2789 CE1 TYR B 105 -6.742 8.365 1.106 1.00 0.64 C ATOM 2790 CE2 TYR B 105 -5.905 10.593 1.332 1.00 0.63 C ATOM 2791 CZ TYR B 105 -6.633 9.533 1.829 1.00 0.64 C ATOM 2792 OH TYR B 105 -7.264 9.634 3.051 1.00 0.73 O ATOM 0 H TYR B 105 -4.258 7.872 -4.075 1.00 0.50 H new ATOM 0 HA TYR B 105 -6.643 8.567 -2.709 1.00 0.50 H new ATOM 0 HB2 TYR B 105 -4.051 8.323 -1.994 1.00 0.57 H new ATOM 0 HB3 TYR B 105 -4.118 10.063 -2.192 1.00 0.57 H new ATOM 0 HD1 TYR B 105 -6.218 7.343 -0.685 1.00 0.59 H new ATOM 0 HD2 TYR B 105 -4.716 11.310 -0.289 1.00 0.59 H new ATOM 0 HE1 TYR B 105 -7.310 7.535 1.500 1.00 0.64 H new ATOM 0 HE2 TYR B 105 -5.819 11.507 1.900 1.00 0.63 H new ATOM 0 HH TYR B 105 -7.374 10.579 3.285 1.00 0.73 H new ATOM 2802 N SER B 106 -5.463 10.711 -4.842 1.00 0.46 N ATOM 2803 CA SER B 106 -5.731 11.974 -5.521 1.00 0.45 C ATOM 2804 C SER B 106 -7.082 11.917 -6.232 1.00 0.40 C ATOM 2805 O SER B 106 -7.610 12.934 -6.685 1.00 0.43 O ATOM 2806 CB SER B 106 -4.616 12.290 -6.518 1.00 0.52 C ATOM 2807 OG SER B 106 -3.357 12.349 -5.868 1.00 1.24 O ATOM 0 H SER B 106 -4.757 10.131 -5.295 1.00 0.46 H new ATOM 0 HA SER B 106 -5.764 12.769 -4.776 1.00 0.45 H new ATOM 0 HB2 SER B 106 -4.592 11.528 -7.297 1.00 0.52 H new ATOM 0 HB3 SER B 106 -4.821 13.241 -7.009 1.00 0.52 H new ATOM 0 HG SER B 106 -3.070 11.443 -5.628 1.00 1.24 H new ATOM 2813 N ALA B 107 -7.627 10.712 -6.338 1.00 0.43 N ATOM 2814 CA ALA B 107 -8.923 10.505 -6.961 1.00 0.44 C ATOM 2815 C ALA B 107 -9.984 10.313 -5.885 1.00 0.45 C ATOM 2816 O ALA B 107 -11.165 10.564 -6.106 1.00 0.56 O ATOM 2817 CB ALA B 107 -8.885 9.306 -7.899 1.00 0.49 C ATOM 0 H ALA B 107 -7.185 9.858 -5.997 1.00 0.43 H new ATOM 0 HA ALA B 107 -9.175 11.385 -7.553 1.00 0.44 H new ATOM 0 HB1 ALA B 107 -9.866 9.169 -8.355 1.00 0.49 H new ATOM 0 HB2 ALA B 107 -8.143 9.478 -8.679 1.00 0.49 H new ATOM 0 HB3 ALA B 107 -8.619 8.412 -7.336 1.00 0.49 H new ATOM 2823 N LEU B 108 -9.538 9.891 -4.706 1.00 0.42 N ATOM 2824 CA LEU B 108 -10.433 9.656 -3.577 1.00 0.48 C ATOM 2825 C LEU B 108 -10.651 10.932 -2.768 1.00 0.49 C ATOM 2826 O LEU B 108 -11.280 10.907 -1.711 1.00 0.58 O ATOM 2827 CB LEU B 108 -9.865 8.560 -2.671 1.00 0.54 C ATOM 2828 CG LEU B 108 -9.916 7.146 -3.250 1.00 0.60 C ATOM 2829 CD1 LEU B 108 -9.142 6.183 -2.365 1.00 0.74 C ATOM 2830 CD2 LEU B 108 -11.357 6.685 -3.405 1.00 0.67 C ATOM 0 H LEU B 108 -8.555 9.704 -4.507 1.00 0.42 H new ATOM 0 HA LEU B 108 -11.395 9.334 -3.975 1.00 0.48 H new ATOM 0 HB2 LEU B 108 -8.828 8.803 -2.439 1.00 0.54 H new ATOM 0 HB3 LEU B 108 -10.413 8.570 -1.729 1.00 0.54 H new ATOM 0 HG LEU B 108 -9.451 7.160 -4.236 1.00 0.60 H new ATOM 0 HD11 LEU B 108 -9.188 5.181 -2.791 1.00 0.74 H new ATOM 0 HD12 LEU B 108 -8.102 6.503 -2.302 1.00 0.74 H new ATOM 0 HD13 LEU B 108 -9.580 6.174 -1.367 1.00 0.74 H new ATOM 0 HD21 LEU B 108 -11.374 5.677 -3.818 1.00 0.67 H new ATOM 0 HD22 LEU B 108 -11.846 6.686 -2.431 1.00 0.67 H new ATOM 0 HD23 LEU B 108 -11.885 7.361 -4.077 1.00 0.67 H new ATOM 2842 N THR B 109 -10.116 12.038 -3.259 1.00 0.45 N ATOM 2843 CA THR B 109 -10.251 13.324 -2.593 1.00 0.50 C ATOM 2844 C THR B 109 -10.863 14.343 -3.547 1.00 0.51 C ATOM 2845 O THR B 109 -10.467 15.507 -3.575 1.00 0.58 O ATOM 2846 CB THR B 109 -8.880 13.834 -2.104 1.00 0.52 C ATOM 2847 OG1 THR B 109 -7.875 13.546 -3.087 1.00 0.55 O ATOM 2848 CG2 THR B 109 -8.496 13.189 -0.780 1.00 0.55 C ATOM 0 H THR B 109 -9.579 12.071 -4.125 1.00 0.45 H new ATOM 0 HA THR B 109 -10.904 13.194 -1.730 1.00 0.50 H new ATOM 0 HB THR B 109 -8.952 14.911 -1.955 1.00 0.52 H new ATOM 0 HG1 THR B 109 -7.630 12.599 -3.036 1.00 0.55 H new ATOM 0 HG21 THR B 109 -7.525 13.567 -0.459 1.00 0.55 H new ATOM 0 HG22 THR B 109 -9.246 13.430 -0.027 1.00 0.55 H new ATOM 0 HG23 THR B 109 -8.441 12.108 -0.905 1.00 0.55 H new ATOM 2856 N ARG B 110 -11.842 13.897 -4.323 1.00 0.47 N ATOM 2857 CA ARG B 110 -12.489 14.757 -5.303 1.00 0.52 C ATOM 2858 C ARG B 110 -13.971 14.933 -4.984 1.00 0.52 C ATOM 2859 O ARG B 110 -14.423 14.593 -3.892 1.00 0.55 O ATOM 2860 CB ARG B 110 -12.302 14.174 -6.706 1.00 0.55 C ATOM 2861 CG ARG B 110 -10.869 13.754 -6.991 1.00 1.21 C ATOM 2862 CD ARG B 110 -10.681 13.303 -8.428 1.00 1.48 C ATOM 2863 NE ARG B 110 -10.591 14.434 -9.344 1.00 1.91 N ATOM 2864 CZ ARG B 110 -9.455 15.067 -9.639 1.00 2.40 C ATOM 2865 NH1 ARG B 110 -8.310 14.691 -9.079 1.00 3.00 N ATOM 2866 NH2 ARG B 110 -9.467 16.084 -10.491 1.00 2.94 N ATOM 0 H ARG B 110 -12.205 12.944 -4.292 1.00 0.47 H new ATOM 0 HA ARG B 110 -12.024 15.742 -5.264 1.00 0.52 H new ATOM 0 HB2 ARG B 110 -12.958 13.311 -6.825 1.00 0.55 H new ATOM 0 HB3 ARG B 110 -12.611 14.914 -7.445 1.00 0.55 H new ATOM 0 HG2 ARG B 110 -10.199 14.588 -6.783 1.00 1.21 H new ATOM 0 HG3 ARG B 110 -10.588 12.944 -6.318 1.00 1.21 H new ATOM 0 HD2 ARG B 110 -9.776 12.701 -8.504 1.00 1.48 H new ATOM 0 HD3 ARG B 110 -11.514 12.664 -8.720 1.00 1.48 H new ATOM 0 HE ARG B 110 -11.450 14.761 -9.786 1.00 1.91 H new ATOM 0 HH11 ARG B 110 -8.296 13.914 -8.419 1.00 3.00 H new ATOM 0 HH12 ARG B 110 -7.445 15.180 -9.309 1.00 3.00 H new ATOM 0 HH21 ARG B 110 -10.344 16.380 -10.919 1.00 2.94 H new ATOM 0 HH22 ARG B 110 -8.599 16.569 -10.718 1.00 2.94 H new ATOM 2880 N ASP B 111 -14.719 15.480 -5.937 1.00 0.53 N ATOM 2881 CA ASP B 111 -16.154 15.709 -5.759 1.00 0.59 C ATOM 2882 C ASP B 111 -16.931 14.400 -5.563 1.00 0.64 C ATOM 2883 O ASP B 111 -17.666 14.267 -4.581 1.00 0.65 O ATOM 2884 CB ASP B 111 -16.726 16.499 -6.940 1.00 0.67 C ATOM 2885 CG ASP B 111 -18.202 16.798 -6.780 1.00 1.37 C ATOM 2886 OD1 ASP B 111 -18.550 17.671 -5.958 1.00 2.16 O ATOM 2887 OD2 ASP B 111 -19.021 16.171 -7.479 1.00 2.04 O ATOM 0 H ASP B 111 -14.357 15.775 -6.844 1.00 0.53 H new ATOM 0 HA ASP B 111 -16.274 16.296 -4.849 1.00 0.59 H new ATOM 0 HB2 ASP B 111 -16.179 17.436 -7.045 1.00 0.67 H new ATOM 0 HB3 ASP B 111 -16.571 15.934 -7.859 1.00 0.67 H new ATOM 2892 N PRO B 112 -16.803 13.412 -6.483 1.00 0.71 N ATOM 2893 CA PRO B 112 -17.511 12.133 -6.352 1.00 0.74 C ATOM 2894 C PRO B 112 -17.043 11.348 -5.130 1.00 0.66 C ATOM 2895 O PRO B 112 -17.835 11.010 -4.251 1.00 0.68 O ATOM 2896 CB PRO B 112 -17.157 11.372 -7.637 1.00 0.87 C ATOM 2897 CG PRO B 112 -16.623 12.400 -8.574 1.00 0.90 C ATOM 2898 CD PRO B 112 -15.988 13.452 -7.713 1.00 0.80 C ATOM 0 HA PRO B 112 -18.583 12.279 -6.220 1.00 0.74 H new ATOM 0 HB2 PRO B 112 -16.417 10.596 -7.442 1.00 0.87 H new ATOM 0 HB3 PRO B 112 -18.034 10.878 -8.055 1.00 0.87 H new ATOM 0 HG2 PRO B 112 -15.895 11.964 -9.258 1.00 0.90 H new ATOM 0 HG3 PRO B 112 -17.420 12.824 -9.184 1.00 0.90 H new ATOM 0 HD2 PRO B 112 -14.940 13.229 -7.510 1.00 0.80 H new ATOM 0 HD3 PRO B 112 -16.019 14.434 -8.186 1.00 0.80 H new ATOM 2906 N PHE B 113 -15.747 11.077 -5.075 1.00 0.60 N ATOM 2907 CA PHE B 113 -15.166 10.341 -3.965 1.00 0.54 C ATOM 2908 C PHE B 113 -14.793 11.306 -2.849 1.00 0.50 C ATOM 2909 O PHE B 113 -13.761 11.971 -2.911 1.00 0.55 O ATOM 2910 CB PHE B 113 -13.937 9.557 -4.428 1.00 0.55 C ATOM 2911 CG PHE B 113 -14.215 8.641 -5.588 1.00 0.56 C ATOM 2912 CD1 PHE B 113 -14.809 7.406 -5.384 1.00 0.62 C ATOM 2913 CD2 PHE B 113 -13.890 9.017 -6.882 1.00 0.82 C ATOM 2914 CE1 PHE B 113 -15.072 6.564 -6.448 1.00 0.65 C ATOM 2915 CE2 PHE B 113 -14.148 8.179 -7.948 1.00 0.84 C ATOM 2916 CZ PHE B 113 -14.742 6.952 -7.732 1.00 0.62 C ATOM 0 H PHE B 113 -15.076 11.358 -5.790 1.00 0.60 H new ATOM 0 HA PHE B 113 -15.901 9.630 -3.588 1.00 0.54 H new ATOM 0 HB2 PHE B 113 -13.152 10.259 -4.709 1.00 0.55 H new ATOM 0 HB3 PHE B 113 -13.555 8.969 -3.594 1.00 0.55 H new ATOM 0 HD1 PHE B 113 -15.069 7.098 -4.382 1.00 0.62 H new ATOM 0 HD2 PHE B 113 -13.429 9.978 -7.058 1.00 0.82 H new ATOM 0 HE1 PHE B 113 -15.535 5.604 -6.276 1.00 0.65 H new ATOM 0 HE2 PHE B 113 -13.885 8.483 -8.950 1.00 0.84 H new ATOM 0 HZ PHE B 113 -14.948 6.297 -8.565 1.00 0.62 H new ATOM 2926 N SER B 114 -15.647 11.383 -1.840 1.00 0.47 N ATOM 2927 CA SER B 114 -15.436 12.285 -0.718 1.00 0.48 C ATOM 2928 C SER B 114 -14.610 11.632 0.392 1.00 0.45 C ATOM 2929 O SER B 114 -14.352 10.424 0.370 1.00 0.70 O ATOM 2930 CB SER B 114 -16.791 12.736 -0.184 1.00 0.54 C ATOM 2931 OG SER B 114 -17.701 12.931 -1.255 1.00 1.23 O ATOM 0 H SER B 114 -16.500 10.827 -1.775 1.00 0.47 H new ATOM 0 HA SER B 114 -14.869 13.148 -1.068 1.00 0.48 H new ATOM 0 HB2 SER B 114 -17.185 11.989 0.506 1.00 0.54 H new ATOM 0 HB3 SER B 114 -16.678 13.662 0.379 1.00 0.54 H new ATOM 0 HG SER B 114 -18.568 13.219 -0.900 1.00 1.23 H new ATOM 2937 N VAL B 115 -14.195 12.443 1.360 1.00 0.48 N ATOM 2938 CA VAL B 115 -13.390 11.971 2.478 1.00 0.44 C ATOM 2939 C VAL B 115 -14.169 12.051 3.788 1.00 0.46 C ATOM 2940 O VAL B 115 -14.753 13.088 4.110 1.00 0.68 O ATOM 2941 CB VAL B 115 -12.099 12.807 2.629 1.00 0.47 C ATOM 2942 CG1 VAL B 115 -11.134 12.146 3.603 1.00 0.49 C ATOM 2943 CG2 VAL B 115 -11.435 13.033 1.280 1.00 0.49 C ATOM 0 H VAL B 115 -14.407 13.440 1.391 1.00 0.48 H new ATOM 0 HA VAL B 115 -13.132 10.934 2.265 1.00 0.44 H new ATOM 0 HB VAL B 115 -12.376 13.780 3.035 1.00 0.47 H new ATOM 0 HG11 VAL B 115 -10.233 12.754 3.692 1.00 0.49 H new ATOM 0 HG12 VAL B 115 -11.608 12.055 4.580 1.00 0.49 H new ATOM 0 HG13 VAL B 115 -10.868 11.155 3.235 1.00 0.49 H new ATOM 0 HG21 VAL B 115 -10.529 13.624 1.415 1.00 0.49 H new ATOM 0 HG22 VAL B 115 -11.178 12.072 0.835 1.00 0.49 H new ATOM 0 HG23 VAL B 115 -12.121 13.566 0.622 1.00 0.49 H new ATOM 2953 N ILE B 116 -14.189 10.958 4.538 1.00 0.39 N ATOM 2954 CA ILE B 116 -14.877 10.944 5.817 1.00 0.43 C ATOM 2955 C ILE B 116 -13.871 11.140 6.944 1.00 0.45 C ATOM 2956 O ILE B 116 -13.724 12.240 7.474 1.00 0.54 O ATOM 2957 CB ILE B 116 -15.653 9.632 6.059 1.00 0.44 C ATOM 2958 CG1 ILE B 116 -16.389 9.194 4.792 1.00 0.55 C ATOM 2959 CG2 ILE B 116 -16.637 9.810 7.209 1.00 0.55 C ATOM 2960 CD1 ILE B 116 -16.944 7.788 4.873 1.00 0.97 C ATOM 0 H ILE B 116 -13.740 10.078 4.284 1.00 0.39 H new ATOM 0 HA ILE B 116 -15.600 11.759 5.799 1.00 0.43 H new ATOM 0 HB ILE B 116 -14.938 8.853 6.323 1.00 0.44 H new ATOM 0 HG12 ILE B 116 -17.206 9.888 4.598 1.00 0.55 H new ATOM 0 HG13 ILE B 116 -15.707 9.259 3.944 1.00 0.55 H new ATOM 0 HG21 ILE B 116 -17.179 8.879 7.371 1.00 0.55 H new ATOM 0 HG22 ILE B 116 -16.093 10.076 8.115 1.00 0.55 H new ATOM 0 HG23 ILE B 116 -17.343 10.603 6.964 1.00 0.55 H new ATOM 0 HD11 ILE B 116 -17.453 7.543 3.941 1.00 0.97 H new ATOM 0 HD12 ILE B 116 -16.128 7.084 5.037 1.00 0.97 H new ATOM 0 HD13 ILE B 116 -17.651 7.723 5.700 1.00 0.97 H new ATOM 2972 N GLU B 117 -13.156 10.075 7.282 1.00 0.42 N ATOM 2973 CA GLU B 117 -12.169 10.122 8.352 1.00 0.50 C ATOM 2974 C GLU B 117 -10.881 9.432 7.923 1.00 0.43 C ATOM 2975 O GLU B 117 -10.914 8.472 7.150 1.00 0.68 O ATOM 2976 CB GLU B 117 -12.716 9.437 9.607 1.00 0.64 C ATOM 2977 CG GLU B 117 -14.078 9.949 10.044 1.00 1.27 C ATOM 2978 CD GLU B 117 -14.685 9.107 11.142 1.00 1.60 C ATOM 2979 OE1 GLU B 117 -14.981 7.919 10.893 1.00 2.31 O ATOM 2980 OE2 GLU B 117 -14.880 9.632 12.256 1.00 1.94 O ATOM 0 H GLU B 117 -13.242 9.165 6.829 1.00 0.42 H new ATOM 0 HA GLU B 117 -11.957 11.168 8.572 1.00 0.50 H new ATOM 0 HB2 GLU B 117 -12.784 8.365 9.423 1.00 0.64 H new ATOM 0 HB3 GLU B 117 -12.007 9.577 10.423 1.00 0.64 H new ATOM 0 HG2 GLU B 117 -13.982 10.978 10.390 1.00 1.27 H new ATOM 0 HG3 GLU B 117 -14.750 9.962 9.186 1.00 1.27 H new ATOM 2987 N GLU B 118 -9.755 9.945 8.403 1.00 0.43 N ATOM 2988 CA GLU B 118 -8.448 9.372 8.104 1.00 0.36 C ATOM 2989 C GLU B 118 -7.529 9.521 9.309 1.00 0.42 C ATOM 2990 O GLU B 118 -7.717 10.413 10.138 1.00 0.66 O ATOM 2991 CB GLU B 118 -7.815 10.023 6.868 1.00 0.35 C ATOM 2992 CG GLU B 118 -7.883 11.538 6.855 1.00 0.79 C ATOM 2993 CD GLU B 118 -7.142 12.133 5.675 1.00 1.47 C ATOM 2994 OE1 GLU B 118 -7.531 11.858 4.518 1.00 2.20 O ATOM 2995 OE2 GLU B 118 -6.163 12.877 5.897 1.00 2.15 O ATOM 0 H GLU B 118 -9.721 10.766 9.008 1.00 0.43 H new ATOM 0 HA GLU B 118 -8.587 8.314 7.884 1.00 0.36 H new ATOM 0 HB2 GLU B 118 -6.770 9.718 6.806 1.00 0.35 H new ATOM 0 HB3 GLU B 118 -8.312 9.641 5.976 1.00 0.35 H new ATOM 0 HG2 GLU B 118 -8.926 11.853 6.823 1.00 0.79 H new ATOM 0 HG3 GLU B 118 -7.460 11.927 7.781 1.00 0.79 H new ATOM 3002 N SER B 119 -6.541 8.647 9.412 1.00 0.43 N ATOM 3003 CA SER B 119 -5.604 8.687 10.528 1.00 0.51 C ATOM 3004 C SER B 119 -4.346 9.481 10.176 1.00 0.52 C ATOM 3005 O SER B 119 -3.298 9.309 10.796 1.00 0.66 O ATOM 3006 CB SER B 119 -5.227 7.267 10.954 1.00 0.63 C ATOM 3007 OG SER B 119 -4.650 6.546 9.879 1.00 1.45 O ATOM 0 H SER B 119 -6.365 7.901 8.739 1.00 0.43 H new ATOM 0 HA SER B 119 -6.098 9.192 11.358 1.00 0.51 H new ATOM 0 HB2 SER B 119 -4.524 7.309 11.786 1.00 0.63 H new ATOM 0 HB3 SER B 119 -6.114 6.744 11.312 1.00 0.63 H new ATOM 0 HG SER B 119 -4.150 5.780 10.230 1.00 1.45 H new ATOM 3013 N LEU B 120 -4.453 10.345 9.176 1.00 0.54 N ATOM 3014 CA LEU B 120 -3.330 11.172 8.753 1.00 0.64 C ATOM 3015 C LEU B 120 -3.734 12.639 8.774 1.00 0.73 C ATOM 3016 O LEU B 120 -4.914 12.958 8.657 1.00 0.81 O ATOM 3017 CB LEU B 120 -2.851 10.778 7.351 1.00 0.67 C ATOM 3018 CG LEU B 120 -1.911 9.569 7.296 1.00 0.86 C ATOM 3019 CD1 LEU B 120 -1.244 9.480 5.933 1.00 1.56 C ATOM 3020 CD2 LEU B 120 -0.863 9.644 8.399 1.00 1.66 C ATOM 0 H LEU B 120 -5.309 10.492 8.641 1.00 0.54 H new ATOM 0 HA LEU B 120 -2.506 11.013 9.448 1.00 0.64 H new ATOM 0 HB2 LEU B 120 -3.724 10.567 6.733 1.00 0.67 H new ATOM 0 HB3 LEU B 120 -2.343 11.633 6.905 1.00 0.67 H new ATOM 0 HG LEU B 120 -2.504 8.668 7.454 1.00 0.86 H new ATOM 0 HD11 LEU B 120 -0.579 8.616 5.909 1.00 1.56 H new ATOM 0 HD12 LEU B 120 -2.006 9.373 5.161 1.00 1.56 H new ATOM 0 HD13 LEU B 120 -0.668 10.387 5.750 1.00 1.56 H new ATOM 0 HD21 LEU B 120 -0.208 8.775 8.338 1.00 1.66 H new ATOM 0 HD22 LEU B 120 -0.272 10.552 8.279 1.00 1.66 H new ATOM 0 HD23 LEU B 120 -1.357 9.659 9.370 1.00 1.66 H new ATOM 3032 N PRO B 121 -2.766 13.551 8.933 1.00 0.91 N ATOM 3033 CA PRO B 121 -3.034 14.985 8.976 1.00 1.11 C ATOM 3034 C PRO B 121 -3.086 15.623 7.588 1.00 1.06 C ATOM 3035 O PRO B 121 -2.531 16.703 7.375 1.00 1.51 O ATOM 3036 CB PRO B 121 -1.843 15.516 9.769 1.00 1.36 C ATOM 3037 CG PRO B 121 -0.717 14.604 9.416 1.00 1.34 C ATOM 3038 CD PRO B 121 -1.330 13.260 9.104 1.00 1.08 C ATOM 0 HA PRO B 121 -4.006 15.212 9.413 1.00 1.11 H new ATOM 0 HB2 PRO B 121 -1.616 16.548 9.500 1.00 1.36 H new ATOM 0 HB3 PRO B 121 -2.043 15.502 10.840 1.00 1.36 H new ATOM 0 HG2 PRO B 121 -0.164 14.986 8.558 1.00 1.34 H new ATOM 0 HG3 PRO B 121 -0.010 14.525 10.241 1.00 1.34 H new ATOM 0 HD2 PRO B 121 -0.901 12.826 8.201 1.00 1.08 H new ATOM 0 HD3 PRO B 121 -1.161 12.548 9.911 1.00 1.08 H new ATOM 3046 N GLY B 122 -3.752 14.962 6.648 1.00 1.25 N ATOM 3047 CA GLY B 122 -3.856 15.505 5.308 1.00 1.38 C ATOM 3048 C GLY B 122 -3.488 14.511 4.225 1.00 1.19 C ATOM 3049 O GLY B 122 -2.676 14.818 3.350 1.00 1.48 O ATOM 0 H GLY B 122 -4.219 14.066 6.789 1.00 1.25 H new ATOM 0 HA2 GLY B 122 -4.876 15.850 5.142 1.00 1.38 H new ATOM 0 HA3 GLY B 122 -3.207 16.377 5.226 1.00 1.38 H new ATOM 3053 N GLY B 123 -4.083 13.326 4.282 1.00 1.02 N ATOM 3054 CA GLY B 123 -3.823 12.304 3.284 1.00 0.92 C ATOM 3055 C GLY B 123 -2.396 11.783 3.289 1.00 0.78 C ATOM 3056 O GLY B 123 -1.604 12.097 4.179 1.00 1.06 O ATOM 0 H GLY B 123 -4.746 13.052 5.007 1.00 1.02 H new ATOM 0 HA2 GLY B 123 -4.504 11.469 3.448 1.00 0.92 H new ATOM 0 HA3 GLY B 123 -4.047 12.709 2.297 1.00 0.92 H new ATOM 3060 N LEU B 124 -2.081 10.979 2.279 1.00 0.88 N ATOM 3061 CA LEU B 124 -0.754 10.393 2.138 1.00 0.97 C ATOM 3062 C LEU B 124 0.213 11.408 1.552 1.00 1.06 C ATOM 3063 O LEU B 124 -0.139 12.156 0.636 1.00 1.39 O ATOM 3064 CB LEU B 124 -0.815 9.159 1.236 1.00 1.20 C ATOM 3065 CG LEU B 124 -1.439 7.917 1.871 1.00 1.13 C ATOM 3066 CD1 LEU B 124 -1.759 6.879 0.807 1.00 1.26 C ATOM 3067 CD2 LEU B 124 -0.507 7.333 2.920 1.00 1.70 C ATOM 0 H LEU B 124 -2.734 10.717 1.540 1.00 0.88 H new ATOM 0 HA LEU B 124 -0.401 10.097 3.126 1.00 0.97 H new ATOM 0 HB2 LEU B 124 -1.381 9.412 0.340 1.00 1.20 H new ATOM 0 HB3 LEU B 124 0.197 8.913 0.915 1.00 1.20 H new ATOM 0 HG LEU B 124 -2.369 8.208 2.359 1.00 1.13 H new ATOM 0 HD11 LEU B 124 -2.203 6.001 1.277 1.00 1.26 H new ATOM 0 HD12 LEU B 124 -2.462 7.300 0.088 1.00 1.26 H new ATOM 0 HD13 LEU B 124 -0.842 6.591 0.293 1.00 1.26 H new ATOM 0 HD21 LEU B 124 -0.966 6.449 3.363 1.00 1.70 H new ATOM 0 HD22 LEU B 124 0.438 7.056 2.453 1.00 1.70 H new ATOM 0 HD23 LEU B 124 -0.324 8.075 3.697 1.00 1.70 H new ATOM 3079 N LYS B 125 1.429 11.425 2.070 1.00 1.00 N ATOM 3080 CA LYS B 125 2.443 12.356 1.607 1.00 1.16 C ATOM 3081 C LYS B 125 3.812 11.688 1.560 1.00 1.54 C ATOM 3082 O LYS B 125 3.929 10.470 1.697 1.00 1.67 O ATOM 3083 CB LYS B 125 2.498 13.581 2.527 1.00 1.22 C ATOM 3084 CG LYS B 125 1.312 14.524 2.384 1.00 1.61 C ATOM 3085 CD LYS B 125 1.724 15.849 1.766 1.00 2.34 C ATOM 3086 CE LYS B 125 1.958 15.720 0.271 1.00 2.64 C ATOM 3087 NZ LYS B 125 3.126 16.522 -0.180 1.00 3.74 N ATOM 0 H LYS B 125 1.739 10.801 2.815 1.00 1.00 H new ATOM 0 HA LYS B 125 2.175 12.674 0.599 1.00 1.16 H new ATOM 0 HB2 LYS B 125 2.555 13.242 3.561 1.00 1.22 H new ATOM 0 HB3 LYS B 125 3.414 14.134 2.322 1.00 1.22 H new ATOM 0 HG2 LYS B 125 0.546 14.056 1.766 1.00 1.61 H new ATOM 0 HG3 LYS B 125 0.867 14.701 3.363 1.00 1.61 H new ATOM 0 HD2 LYS B 125 0.950 16.594 1.951 1.00 2.34 H new ATOM 0 HD3 LYS B 125 2.633 16.209 2.247 1.00 2.34 H new ATOM 0 HE2 LYS B 125 2.118 14.672 0.018 1.00 2.64 H new ATOM 0 HE3 LYS B 125 1.066 16.045 -0.265 1.00 2.64 H new ATOM 0 HZ1 LYS B 125 3.272 16.380 -1.200 1.00 3.74 H new ATOM 0 HZ2 LYS B 125 2.948 17.529 0.007 1.00 3.74 H new ATOM 0 HZ3 LYS B 125 3.976 16.218 0.337 1.00 3.74 H new ATOM 3101 N GLU B 126 4.847 12.498 1.385 1.00 2.03 N ATOM 3102 CA GLU B 126 6.217 12.001 1.320 1.00 2.51 C ATOM 3103 C GLU B 126 6.725 11.576 2.700 1.00 2.53 C ATOM 3104 O GLU B 126 7.847 11.098 2.834 1.00 2.94 O ATOM 3105 CB GLU B 126 7.148 13.059 0.709 1.00 2.99 C ATOM 3106 CG GLU B 126 7.303 14.330 1.540 1.00 3.68 C ATOM 3107 CD GLU B 126 6.032 15.153 1.613 1.00 4.09 C ATOM 3108 OE1 GLU B 126 5.302 15.222 0.603 1.00 4.50 O ATOM 3109 OE2 GLU B 126 5.747 15.721 2.685 1.00 4.38 O ATOM 0 H GLU B 126 4.764 13.510 1.285 1.00 2.03 H new ATOM 0 HA GLU B 126 6.218 11.120 0.678 1.00 2.51 H new ATOM 0 HB2 GLU B 126 8.133 12.615 0.562 1.00 2.99 H new ATOM 0 HB3 GLU B 126 6.770 13.330 -0.277 1.00 2.99 H new ATOM 0 HG2 GLU B 126 7.613 14.061 2.550 1.00 3.68 H new ATOM 0 HG3 GLU B 126 8.100 14.940 1.114 1.00 3.68 H new ATOM 3116 N HIS B 127 5.898 11.760 3.725 1.00 2.47 N ATOM 3117 CA HIS B 127 6.276 11.367 5.078 1.00 2.85 C ATOM 3118 C HIS B 127 5.981 9.884 5.289 1.00 2.69 C ATOM 3119 O HIS B 127 6.417 9.286 6.270 1.00 3.24 O ATOM 3120 CB HIS B 127 5.553 12.222 6.140 1.00 3.34 C ATOM 3121 CG HIS B 127 4.079 11.943 6.288 1.00 2.82 C ATOM 3122 ND1 HIS B 127 3.105 12.770 5.784 1.00 2.28 N ATOM 3123 CD2 HIS B 127 3.423 10.918 6.883 1.00 3.17 C ATOM 3124 CE1 HIS B 127 1.916 12.264 6.054 1.00 2.09 C ATOM 3125 NE2 HIS B 127 2.076 11.135 6.721 1.00 2.78 N ATOM 0 H HIS B 127 4.970 12.175 3.646 1.00 2.47 H new ATOM 0 HA HIS B 127 7.346 11.539 5.196 1.00 2.85 H new ATOM 0 HB2 HIS B 127 6.036 12.062 7.104 1.00 3.34 H new ATOM 0 HB3 HIS B 127 5.685 13.274 5.888 1.00 3.34 H new ATOM 0 HD1 HIS B 127 3.274 13.640 5.279 1.00 2.28 H new ATOM 0 HD2 HIS B 127 3.877 10.081 7.393 1.00 3.17 H new ATOM 0 HE1 HIS B 127 0.968 12.701 5.775 1.00 2.09 H new ATOM 3134 N ASP B 128 5.221 9.310 4.363 1.00 2.33 N ATOM 3135 CA ASP B 128 4.853 7.901 4.429 1.00 2.40 C ATOM 3136 C ASP B 128 5.755 7.098 3.508 1.00 2.02 C ATOM 3137 O ASP B 128 6.512 6.229 3.945 1.00 2.64 O ATOM 3138 CB ASP B 128 3.390 7.697 4.011 1.00 2.90 C ATOM 3139 CG ASP B 128 2.446 8.700 4.643 1.00 3.86 C ATOM 3140 OD1 ASP B 128 2.224 9.776 4.042 1.00 4.37 O ATOM 3141 OD2 ASP B 128 1.932 8.427 5.746 1.00 4.43 O ATOM 0 H ASP B 128 4.846 9.803 3.553 1.00 2.33 H new ATOM 0 HA ASP B 128 4.972 7.561 5.458 1.00 2.40 H new ATOM 0 HB2 ASP B 128 3.315 7.770 2.926 1.00 2.90 H new ATOM 0 HB3 ASP B 128 3.077 6.690 4.285 1.00 2.90 H new ATOM 3146 N PHE B 129 5.676 7.415 2.228 1.00 1.68 N ATOM 3147 CA PHE B 129 6.473 6.745 1.215 1.00 2.25 C ATOM 3148 C PHE B 129 7.501 7.707 0.638 1.00 3.02 C ATOM 3149 O PHE B 129 7.328 8.923 0.713 1.00 3.53 O ATOM 3150 CB PHE B 129 5.577 6.198 0.099 1.00 2.25 C ATOM 3151 CG PHE B 129 4.465 7.130 -0.308 1.00 1.47 C ATOM 3152 CD1 PHE B 129 4.665 8.087 -1.291 1.00 1.53 C ATOM 3153 CD2 PHE B 129 3.219 7.044 0.293 1.00 1.89 C ATOM 3154 CE1 PHE B 129 3.644 8.939 -1.666 1.00 1.53 C ATOM 3155 CE2 PHE B 129 2.195 7.894 -0.078 1.00 2.06 C ATOM 3156 CZ PHE B 129 2.409 8.843 -1.058 1.00 1.68 C ATOM 0 H PHE B 129 5.060 8.141 1.862 1.00 1.68 H new ATOM 0 HA PHE B 129 6.993 5.908 1.681 1.00 2.25 H new ATOM 0 HB2 PHE B 129 6.193 5.981 -0.774 1.00 2.25 H new ATOM 0 HB3 PHE B 129 5.143 5.253 0.426 1.00 2.25 H new ATOM 0 HD1 PHE B 129 5.630 8.167 -1.769 1.00 1.53 H new ATOM 0 HD2 PHE B 129 3.047 6.304 1.060 1.00 1.89 H new ATOM 0 HE1 PHE B 129 3.812 9.679 -2.434 1.00 1.53 H new ATOM 0 HE2 PHE B 129 1.229 7.816 0.398 1.00 2.06 H new ATOM 0 HZ PHE B 129 1.610 9.510 -1.348 1.00 1.68 H new ATOM 3166 N ASN B 130 8.563 7.162 0.063 1.00 3.51 N ATOM 3167 CA ASN B 130 9.619 7.979 -0.525 1.00 4.35 C ATOM 3168 C ASN B 130 9.526 7.948 -2.047 1.00 4.87 C ATOM 3169 O ASN B 130 9.999 7.006 -2.688 1.00 5.30 O ATOM 3170 CB ASN B 130 10.993 7.475 -0.068 1.00 5.05 C ATOM 3171 CG ASN B 130 12.125 8.439 -0.393 1.00 5.54 C ATOM 3172 OD1 ASN B 130 12.101 9.139 -1.405 1.00 5.86 O ATOM 3173 ND2 ASN B 130 13.130 8.476 0.466 1.00 6.00 N ATOM 0 H ASN B 130 8.718 6.156 -0.010 1.00 3.51 H new ATOM 0 HA ASN B 130 9.493 9.008 -0.189 1.00 4.35 H new ATOM 0 HB2 ASN B 130 10.970 7.302 1.008 1.00 5.05 H new ATOM 0 HB3 ASN B 130 11.196 6.514 -0.541 1.00 5.05 H new ATOM 0 HD21 ASN B 130 13.920 9.100 0.300 1.00 6.00 H new ATOM 0 HD22 ASN B 130 13.115 7.881 1.294 1.00 6.00 H new ATOM 3180 N PRO B 131 8.890 8.965 -2.645 1.00 5.23 N ATOM 3181 CA PRO B 131 8.726 9.070 -4.078 1.00 6.09 C ATOM 3182 C PRO B 131 9.785 9.973 -4.709 1.00 6.67 C ATOM 3183 O PRO B 131 9.436 11.074 -5.174 1.00 6.77 O ATOM 3184 CB PRO B 131 7.331 9.695 -4.196 1.00 6.57 C ATOM 3185 CG PRO B 131 7.100 10.431 -2.901 1.00 6.19 C ATOM 3186 CD PRO B 131 8.253 10.100 -1.978 1.00 5.27 C ATOM 3187 OXT PRO B 131 10.968 9.581 -4.732 1.00 1.08 O ATOM 0 HA PRO B 131 8.833 8.116 -4.594 1.00 6.09 H new ATOM 0 HB2 PRO B 131 7.278 10.374 -5.047 1.00 6.57 H new ATOM 0 HB3 PRO B 131 6.571 8.929 -4.351 1.00 6.57 H new ATOM 0 HG2 PRO B 131 7.045 11.506 -3.075 1.00 6.19 H new ATOM 0 HG3 PRO B 131 6.152 10.131 -2.453 1.00 6.19 H new ATOM 0 HD2 PRO B 131 8.938 10.941 -1.869 1.00 5.27 H new ATOM 0 HD3 PRO B 131 7.908 9.839 -0.978 1.00 5.27 H new TER 3195 PRO B 131