USER MOD reduce.3.24.130724 H: found=0, std=0, add=979, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 981 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: A 38 ASN : amide:sc= -2.9 X(o=1.9,f=2) USER MOD Set 1.2: A 41 CYS SG : rot -16:sc= 0.891 USER MOD Set 1.3: A 66 CYS SG : rot -74:sc= 3.04 USER MOD Set 1.4: A 69 SER OG : rot -128:sc= 1.05 USER MOD Set 1.5: A 128 CYS SG : rot 133:sc= -0.136 USER MOD Set 2.1: A 24 ASN : amide:sc= -4.84! C(o=-4.2!,f=-1.6!) USER MOD Set 2.2: A 74 SER OG : rot -172:sc= 0.65 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0545 USER MOD Single : A 11 TYR OH : rot 54:sc= 0.798 USER MOD Single : A 13 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 16 MET CE :methyl -163:sc= -0.0714 (180deg=-0.528) USER MOD Single : A 18 HIS : no HD1:sc= -0.043 X(o=-0.043,f=-0.063) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ -171:sc= -0.0268 (180deg=-0.169) USER MOD Single : A 21 ASN : amide:sc= 0.782 K(o=0.78,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 169:sc=-0.00246 (180deg=-0.0915) USER MOD Single : A 29 ASN : amide:sc= -0.237 X(o=-0.24,f=-0.4) USER MOD Single : A 31 SER OG : rot -140:sc= -0.824 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.134 X(o=-0.13,f=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -90:sc= 0.583 USER MOD Single : A 49 MET CE :methyl -121:sc= -0.962 (180deg=-5!) USER MOD Single : A 50 LYS NZ :NH3+ 157:sc= 1.21 (180deg=1.08) USER MOD Single : A 60 LYS NZ :NH3+ 155:sc= 0.979 (180deg=-0.0863) USER MOD Single : A 67 SER OG : rot 180:sc= 0.0213 USER MOD Single : A 70 MET CE :methyl 158:sc= -0.494 (180deg=-1.66!) USER MOD Single : A 72 SER OG : rot 79:sc= -0.0512 USER MOD Single : A 75 MET CE :methyl 150:sc= -0.869 (180deg=-3.25!) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 85:sc= 1.23 USER MOD Single : A 78 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 81 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0154) USER MOD Single : A 83 LYS NZ :NH3+ -171:sc= -0.037 (180deg=-0.202) USER MOD Single : A 87 THR OG1 : rot -136:sc= 1.34 USER MOD Single : A 90 SER OG : rot 70:sc= 1.2 USER MOD Single : A 91 MET CE :methyl -161:sc= -0.134 (180deg=-0.679) USER MOD Single : A 92 SER OG : rot 43:sc= 0.503 USER MOD Single : A 93 LYS NZ :NH3+ -154:sc= 1.16 (180deg=0.691) USER MOD Single : A 96 SER OG : rot 23:sc= 1.13 USER MOD Single : A 117 GLN : amide:sc= -2.1 K(o=-2.1,f=-4.1!) USER MOD Single : A 120 SER OG : rot -16:sc= 0.27 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0.00667 USER MOD Single : A 134 LYS NZ :NH3+ 160:sc= 1.24 (180deg=0.804) USER MOD Single : A 138 LYS NZ :NH3+ 160:sc= 1.26 (180deg=0.404) USER MOD Single : A 142 LYS NZ :NH3+ -170:sc= 1.66 (180deg=1.51) USER MOD ----------------------------------------------------------------- ATOM 89 N LEU A 7 -8.987 -7.457 13.272 1.00 0.00 N ATOM 90 CA LEU A 7 -8.651 -7.482 11.851 1.00 0.00 C ATOM 91 C LEU A 7 -9.920 -7.552 11.009 1.00 0.00 C ATOM 92 O LEU A 7 -10.054 -6.841 10.011 1.00 0.00 O ATOM 93 CB LEU A 7 -7.740 -8.670 11.527 1.00 0.00 C ATOM 94 CG LEU A 7 -7.366 -8.820 10.050 1.00 0.00 C ATOM 95 CD1 LEU A 7 -6.591 -7.605 9.565 1.00 0.00 C ATOM 96 CD2 LEU A 7 -6.561 -10.088 9.824 1.00 0.00 C ATOM 0 HA LEU A 7 -8.116 -6.563 11.612 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.824 -8.574 12.110 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -8.232 -9.585 11.856 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.288 -8.892 9.474 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.335 -7.733 8.513 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -7.204 -6.711 9.684 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.677 -7.499 10.150 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.306 -10.174 8.768 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -5.646 -10.049 10.416 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.152 -10.953 10.126 1.00 0.00 H new ATOM 108 N ASP A 8 -10.853 -8.398 11.434 1.00 0.00 N ATOM 109 CA ASP A 8 -12.128 -8.581 10.738 1.00 0.00 C ATOM 110 C ASP A 8 -12.860 -7.254 10.569 1.00 0.00 C ATOM 111 O ASP A 8 -13.333 -6.925 9.481 1.00 0.00 O ATOM 112 CB ASP A 8 -13.006 -9.561 11.519 1.00 0.00 C ATOM 113 CG ASP A 8 -14.378 -9.743 10.901 1.00 0.00 C ATOM 114 OD1 ASP A 8 -14.491 -10.487 9.904 1.00 0.00 O ATOM 115 OD2 ASP A 8 -15.352 -9.155 11.419 1.00 0.00 O ATOM 0 H ASP A 8 -10.750 -8.976 12.268 1.00 0.00 H new ATOM 0 HA ASP A 8 -11.921 -8.983 9.746 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -12.505 -10.528 11.571 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -13.118 -9.204 12.543 1.00 0.00 H new ATOM 120 N THR A 9 -12.922 -6.492 11.652 1.00 0.00 N ATOM 121 CA THR A 9 -13.593 -5.200 11.661 1.00 0.00 C ATOM 122 C THR A 9 -12.979 -4.246 10.633 1.00 0.00 C ATOM 123 O THR A 9 -13.678 -3.434 10.019 1.00 0.00 O ATOM 124 CB THR A 9 -13.495 -4.573 13.063 1.00 0.00 C ATOM 125 OG1 THR A 9 -13.584 -5.610 14.053 1.00 0.00 O ATOM 126 CG2 THR A 9 -14.605 -3.555 13.287 1.00 0.00 C ATOM 0 H THR A 9 -12.509 -6.752 12.548 1.00 0.00 H new ATOM 0 HA THR A 9 -14.638 -5.362 11.397 1.00 0.00 H new ATOM 0 HB THR A 9 -12.538 -4.057 13.147 1.00 0.00 H new ATOM 0 HG1 THR A 9 -13.520 -5.215 14.947 1.00 0.00 H new ATOM 0 HG21 THR A 9 -14.511 -3.128 14.286 1.00 0.00 H new ATOM 0 HG22 THR A 9 -14.526 -2.761 12.544 1.00 0.00 H new ATOM 0 HG23 THR A 9 -15.574 -4.046 13.192 1.00 0.00 H new ATOM 134 N LEU A 10 -11.674 -4.369 10.432 1.00 0.00 N ATOM 135 CA LEU A 10 -10.959 -3.490 9.522 1.00 0.00 C ATOM 136 C LEU A 10 -11.248 -3.874 8.080 1.00 0.00 C ATOM 137 O LEU A 10 -11.621 -3.031 7.276 1.00 0.00 O ATOM 138 CB LEU A 10 -9.456 -3.542 9.802 1.00 0.00 C ATOM 139 CG LEU A 10 -9.045 -3.114 11.213 1.00 0.00 C ATOM 140 CD1 LEU A 10 -7.548 -3.271 11.401 1.00 0.00 C ATOM 141 CD2 LEU A 10 -9.464 -1.677 11.480 1.00 0.00 C ATOM 0 H LEU A 10 -11.090 -5.070 10.888 1.00 0.00 H new ATOM 0 HA LEU A 10 -11.303 -2.468 9.682 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -9.105 -4.560 9.631 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -8.945 -2.903 9.082 1.00 0.00 H new ATOM 0 HG LEU A 10 -9.554 -3.760 11.928 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -7.274 -2.962 12.410 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -7.270 -4.315 11.253 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.023 -2.649 10.676 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -9.163 -1.392 12.488 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -8.983 -1.018 10.757 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -10.547 -1.590 11.386 1.00 0.00 H new ATOM 153 N TYR A 11 -11.098 -5.158 7.771 1.00 0.00 N ATOM 154 CA TYR A 11 -11.383 -5.677 6.438 1.00 0.00 C ATOM 155 C TYR A 11 -12.797 -5.331 6.015 1.00 0.00 C ATOM 156 O TYR A 11 -13.026 -4.944 4.876 1.00 0.00 O ATOM 157 CB TYR A 11 -11.211 -7.196 6.377 1.00 0.00 C ATOM 158 CG TYR A 11 -9.787 -7.663 6.194 1.00 0.00 C ATOM 159 CD1 TYR A 11 -8.910 -6.982 5.357 1.00 0.00 C ATOM 160 CD2 TYR A 11 -9.327 -8.797 6.844 1.00 0.00 C ATOM 161 CE1 TYR A 11 -7.609 -7.418 5.181 1.00 0.00 C ATOM 162 CE2 TYR A 11 -8.030 -9.242 6.671 1.00 0.00 C ATOM 163 CZ TYR A 11 -7.174 -8.550 5.839 1.00 0.00 C ATOM 164 OH TYR A 11 -5.882 -8.995 5.662 1.00 0.00 O ATOM 0 H TYR A 11 -10.777 -5.864 8.433 1.00 0.00 H new ATOM 0 HA TYR A 11 -10.670 -5.210 5.759 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -11.606 -7.630 7.296 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -11.814 -7.584 5.556 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -9.250 -6.099 4.836 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -9.993 -9.342 7.497 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -6.938 -6.875 4.532 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -7.688 -10.128 7.185 1.00 0.00 H new ATOM 0 HH TYR A 11 -5.256 -8.266 5.853 1.00 0.00 H new ATOM 174 N ARG A 12 -13.735 -5.475 6.949 1.00 0.00 N ATOM 175 CA ARG A 12 -15.132 -5.130 6.710 1.00 0.00 C ATOM 176 C ARG A 12 -15.229 -3.714 6.148 1.00 0.00 C ATOM 177 O ARG A 12 -15.925 -3.462 5.169 1.00 0.00 O ATOM 178 CB ARG A 12 -15.913 -5.233 8.021 1.00 0.00 C ATOM 179 CG ARG A 12 -17.418 -5.327 7.849 1.00 0.00 C ATOM 180 CD ARG A 12 -18.115 -5.418 9.198 1.00 0.00 C ATOM 181 NE ARG A 12 -19.476 -5.931 9.085 1.00 0.00 N ATOM 182 CZ ARG A 12 -20.356 -5.936 10.083 1.00 0.00 C ATOM 183 NH1 ARG A 12 -20.061 -5.358 11.246 1.00 0.00 N ATOM 184 NH2 ARG A 12 -21.540 -6.510 9.917 1.00 0.00 N ATOM 0 H ARG A 12 -13.549 -5.832 7.886 1.00 0.00 H new ATOM 0 HA ARG A 12 -15.558 -5.823 5.985 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -15.567 -6.110 8.568 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -15.684 -4.363 8.636 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -17.781 -4.454 7.306 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -17.665 -6.202 7.248 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -17.539 -6.065 9.859 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -18.138 -4.431 9.660 1.00 0.00 H new ATOM 0 HE ARG A 12 -19.771 -6.309 8.185 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -19.155 -4.907 11.376 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -20.741 -5.366 12.006 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -21.775 -6.947 9.026 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -22.216 -6.515 10.681 1.00 0.00 H new ATOM 198 N GLN A 13 -14.488 -2.806 6.768 1.00 0.00 N ATOM 199 CA GLN A 13 -14.438 -1.418 6.336 1.00 0.00 C ATOM 200 C GLN A 13 -13.627 -1.286 5.048 1.00 0.00 C ATOM 201 O GLN A 13 -14.035 -0.580 4.121 1.00 0.00 O ATOM 202 CB GLN A 13 -13.837 -0.546 7.445 1.00 0.00 C ATOM 203 CG GLN A 13 -13.725 0.925 7.085 1.00 0.00 C ATOM 204 CD GLN A 13 -13.176 1.755 8.228 1.00 0.00 C ATOM 205 OE1 GLN A 13 -12.407 1.268 9.056 1.00 0.00 O ATOM 206 NE2 GLN A 13 -13.570 3.017 8.283 1.00 0.00 N ATOM 0 H GLN A 13 -13.907 -3.010 7.581 1.00 0.00 H new ATOM 0 HA GLN A 13 -15.453 -1.076 6.134 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -14.449 -0.644 8.341 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -12.846 -0.925 7.693 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -13.078 1.036 6.215 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -14.707 1.304 6.803 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -14.209 3.383 7.577 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -13.235 3.624 9.031 1.00 0.00 H new ATOM 215 N VAL A 14 -12.494 -1.989 4.982 1.00 0.00 N ATOM 216 CA VAL A 14 -11.611 -1.907 3.818 1.00 0.00 C ATOM 217 C VAL A 14 -12.337 -2.315 2.537 1.00 0.00 C ATOM 218 O VAL A 14 -12.288 -1.605 1.529 1.00 0.00 O ATOM 219 CB VAL A 14 -10.348 -2.787 3.993 1.00 0.00 C ATOM 220 CG1 VAL A 14 -9.508 -2.789 2.726 1.00 0.00 C ATOM 221 CG2 VAL A 14 -9.517 -2.306 5.171 1.00 0.00 C ATOM 0 H VAL A 14 -12.168 -2.618 5.716 1.00 0.00 H new ATOM 0 HA VAL A 14 -11.303 -0.865 3.736 1.00 0.00 H new ATOM 0 HB VAL A 14 -10.676 -3.807 4.191 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -8.627 -3.414 2.874 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -10.098 -3.184 1.899 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -9.196 -1.771 2.495 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -8.635 -2.938 5.276 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -9.207 -1.275 5.001 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.112 -2.360 6.082 1.00 0.00 H new ATOM 231 N ILE A 15 -13.028 -3.447 2.577 1.00 0.00 N ATOM 232 CA ILE A 15 -13.703 -3.949 1.392 1.00 0.00 C ATOM 233 C ILE A 15 -14.956 -3.139 1.073 1.00 0.00 C ATOM 234 O ILE A 15 -15.423 -3.143 -0.065 1.00 0.00 O ATOM 235 CB ILE A 15 -14.039 -5.462 1.491 1.00 0.00 C ATOM 236 CG1 ILE A 15 -14.857 -5.804 2.745 1.00 0.00 C ATOM 237 CG2 ILE A 15 -12.759 -6.283 1.467 1.00 0.00 C ATOM 238 CD1 ILE A 15 -16.349 -5.613 2.592 1.00 0.00 C ATOM 0 H ILE A 15 -13.134 -4.028 3.409 1.00 0.00 H new ATOM 0 HA ILE A 15 -12.999 -3.829 0.569 1.00 0.00 H new ATOM 0 HB ILE A 15 -14.655 -5.710 0.627 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -14.662 -6.841 3.019 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -14.507 -5.185 3.571 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -13.005 -7.343 1.537 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -12.224 -6.095 0.536 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -12.130 -6.000 2.311 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -16.847 -5.878 3.525 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -16.560 -4.571 2.351 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -16.717 -6.252 1.790 1.00 0.00 H new ATOM 250 N MET A 16 -15.497 -2.435 2.068 1.00 0.00 N ATOM 251 CA MET A 16 -16.657 -1.580 1.834 1.00 0.00 C ATOM 252 C MET A 16 -16.268 -0.321 1.069 1.00 0.00 C ATOM 253 O MET A 16 -16.964 0.081 0.132 1.00 0.00 O ATOM 254 CB MET A 16 -17.350 -1.206 3.146 1.00 0.00 C ATOM 255 CG MET A 16 -18.259 -2.300 3.687 1.00 0.00 C ATOM 256 SD MET A 16 -19.593 -2.730 2.550 1.00 0.00 S ATOM 257 CE MET A 16 -20.455 -1.162 2.426 1.00 0.00 C ATOM 0 H MET A 16 -15.156 -2.440 3.029 1.00 0.00 H new ATOM 0 HA MET A 16 -17.360 -2.151 1.227 1.00 0.00 H new ATOM 0 HB2 MET A 16 -16.592 -0.972 3.894 1.00 0.00 H new ATOM 0 HB3 MET A 16 -17.937 -0.300 2.992 1.00 0.00 H new ATOM 0 HG2 MET A 16 -17.665 -3.190 3.895 1.00 0.00 H new ATOM 0 HG3 MET A 16 -18.687 -1.974 4.635 1.00 0.00 H new ATOM 0 HE1 MET A 16 -21.452 -1.326 2.016 1.00 0.00 H new ATOM 0 HE2 MET A 16 -20.539 -0.714 3.416 1.00 0.00 H new ATOM 0 HE3 MET A 16 -19.899 -0.492 1.770 1.00 0.00 H new ATOM 267 N ASP A 17 -15.151 0.294 1.452 1.00 0.00 N ATOM 268 CA ASP A 17 -14.679 1.498 0.767 1.00 0.00 C ATOM 269 C ASP A 17 -14.304 1.169 -0.671 1.00 0.00 C ATOM 270 O ASP A 17 -14.588 1.935 -1.594 1.00 0.00 O ATOM 271 CB ASP A 17 -13.474 2.112 1.488 1.00 0.00 C ATOM 272 CG ASP A 17 -13.054 3.442 0.882 1.00 0.00 C ATOM 273 OD1 ASP A 17 -13.683 4.470 1.214 1.00 0.00 O ATOM 274 OD2 ASP A 17 -12.102 3.470 0.075 1.00 0.00 O ATOM 0 H ASP A 17 -14.561 -0.016 2.224 1.00 0.00 H new ATOM 0 HA ASP A 17 -15.490 2.227 0.774 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -13.718 2.256 2.541 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -12.636 1.416 1.447 1.00 0.00 H new ATOM 279 N HIS A 18 -13.691 0.007 -0.858 1.00 0.00 N ATOM 280 CA HIS A 18 -13.275 -0.427 -2.182 1.00 0.00 C ATOM 281 C HIS A 18 -14.478 -0.922 -2.987 1.00 0.00 C ATOM 282 O HIS A 18 -14.424 -1.006 -4.210 1.00 0.00 O ATOM 283 CB HIS A 18 -12.207 -1.517 -2.081 1.00 0.00 C ATOM 284 CG HIS A 18 -11.481 -1.756 -3.371 1.00 0.00 C ATOM 285 ND1 HIS A 18 -11.539 -2.944 -4.066 1.00 0.00 N ATOM 286 CD2 HIS A 18 -10.678 -0.939 -4.094 1.00 0.00 C ATOM 287 CE1 HIS A 18 -10.802 -2.849 -5.158 1.00 0.00 C ATOM 288 NE2 HIS A 18 -10.268 -1.640 -5.199 1.00 0.00 N ATOM 0 H HIS A 18 -13.472 -0.650 -0.109 1.00 0.00 H new ATOM 0 HA HIS A 18 -12.842 0.427 -2.703 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -11.486 -1.240 -1.312 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -12.676 -2.447 -1.758 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -10.410 0.077 -3.846 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -10.660 -3.627 -5.893 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -9.653 -1.287 -5.932 1.00 0.00 H new ATOM 297 N TYR A 19 -15.562 -1.256 -2.302 1.00 0.00 N ATOM 298 CA TYR A 19 -16.796 -1.629 -2.985 1.00 0.00 C ATOM 299 C TYR A 19 -17.432 -0.394 -3.610 1.00 0.00 C ATOM 300 O TYR A 19 -17.958 -0.441 -4.724 1.00 0.00 O ATOM 301 CB TYR A 19 -17.775 -2.295 -2.013 1.00 0.00 C ATOM 302 CG TYR A 19 -19.102 -2.669 -2.639 1.00 0.00 C ATOM 303 CD1 TYR A 19 -19.234 -3.822 -3.404 1.00 0.00 C ATOM 304 CD2 TYR A 19 -20.221 -1.866 -2.468 1.00 0.00 C ATOM 305 CE1 TYR A 19 -20.444 -4.163 -3.980 1.00 0.00 C ATOM 306 CE2 TYR A 19 -21.435 -2.198 -3.041 1.00 0.00 C ATOM 307 CZ TYR A 19 -21.542 -3.348 -3.796 1.00 0.00 C ATOM 308 OH TYR A 19 -22.753 -3.681 -4.368 1.00 0.00 O ATOM 0 H TYR A 19 -15.615 -1.277 -1.284 1.00 0.00 H new ATOM 0 HA TYR A 19 -16.557 -2.346 -3.771 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -17.311 -3.193 -1.604 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -17.956 -1.620 -1.176 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -18.377 -4.462 -3.551 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -20.142 -0.966 -1.877 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -20.529 -5.063 -4.571 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -22.295 -1.560 -2.898 1.00 0.00 H new ATOM 0 HH TYR A 19 -23.421 -3.001 -4.139 1.00 0.00 H new ATOM 318 N LYS A 20 -17.371 0.715 -2.882 1.00 0.00 N ATOM 319 CA LYS A 20 -17.884 1.984 -3.375 1.00 0.00 C ATOM 320 C LYS A 20 -16.979 2.546 -4.462 1.00 0.00 C ATOM 321 O LYS A 20 -17.394 3.387 -5.260 1.00 0.00 O ATOM 322 CB LYS A 20 -18.022 2.990 -2.232 1.00 0.00 C ATOM 323 CG LYS A 20 -19.104 2.631 -1.226 1.00 0.00 C ATOM 324 CD LYS A 20 -20.477 2.558 -1.882 1.00 0.00 C ATOM 325 CE LYS A 20 -20.880 3.887 -2.511 1.00 0.00 C ATOM 326 NZ LYS A 20 -20.911 4.992 -1.515 1.00 0.00 N ATOM 0 H LYS A 20 -16.970 0.759 -1.945 1.00 0.00 H new ATOM 0 HA LYS A 20 -18.870 1.806 -3.803 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -17.067 3.068 -1.712 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -18.239 3.973 -2.650 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -18.869 1.672 -0.765 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -19.120 3.373 -0.428 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -20.473 1.781 -2.647 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -21.219 2.269 -1.138 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -20.180 4.137 -3.308 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -21.863 3.786 -2.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -21.334 5.838 -1.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -21.479 4.703 -0.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -19.942 5.209 -1.207 1.00 0.00 H new ATOM 340 N ASN A 21 -15.746 2.070 -4.490 1.00 0.00 N ATOM 341 CA ASN A 21 -14.794 2.473 -5.514 1.00 0.00 C ATOM 342 C ASN A 21 -14.346 1.258 -6.316 1.00 0.00 C ATOM 343 O ASN A 21 -13.277 0.698 -6.067 1.00 0.00 O ATOM 344 CB ASN A 21 -13.580 3.172 -4.891 1.00 0.00 C ATOM 345 CG ASN A 21 -13.936 4.497 -4.247 1.00 0.00 C ATOM 346 OD1 ASN A 21 -13.962 5.532 -4.911 1.00 0.00 O ATOM 347 ND2 ASN A 21 -14.204 4.479 -2.948 1.00 0.00 N ATOM 0 H ASN A 21 -15.378 1.401 -3.813 1.00 0.00 H new ATOM 0 HA ASN A 21 -15.287 3.180 -6.181 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -13.133 2.517 -4.143 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -12.826 3.338 -5.661 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -14.442 5.345 -2.464 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -14.172 3.599 -2.433 1.00 0.00 H new ATOM 354 N PRO A 22 -15.161 0.835 -7.297 1.00 0.00 N ATOM 355 CA PRO A 22 -14.927 -0.401 -8.046 1.00 0.00 C ATOM 356 C PRO A 22 -13.885 -0.238 -9.146 1.00 0.00 C ATOM 357 O PRO A 22 -13.819 -1.041 -10.079 1.00 0.00 O ATOM 358 CB PRO A 22 -16.298 -0.695 -8.648 1.00 0.00 C ATOM 359 CG PRO A 22 -16.910 0.647 -8.858 1.00 0.00 C ATOM 360 CD PRO A 22 -16.374 1.534 -7.763 1.00 0.00 C ATOM 0 HA PRO A 22 -14.534 -1.196 -7.412 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -16.210 -1.242 -9.587 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -16.903 -1.306 -7.978 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -16.651 1.043 -9.840 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -17.998 0.589 -8.814 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -16.141 2.531 -8.136 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -17.098 1.656 -6.958 1.00 0.00 H new ATOM 368 N ARG A 23 -13.057 0.787 -9.023 1.00 0.00 N ATOM 369 CA ARG A 23 -12.013 1.032 -9.996 1.00 0.00 C ATOM 370 C ARG A 23 -10.741 0.370 -9.523 1.00 0.00 C ATOM 371 O ARG A 23 -10.005 0.916 -8.707 1.00 0.00 O ATOM 372 CB ARG A 23 -11.791 2.531 -10.240 1.00 0.00 C ATOM 373 CG ARG A 23 -12.844 3.169 -11.136 1.00 0.00 C ATOM 374 CD ARG A 23 -14.171 3.349 -10.415 1.00 0.00 C ATOM 375 NE ARG A 23 -15.265 3.621 -11.346 1.00 0.00 N ATOM 376 CZ ARG A 23 -15.724 4.843 -11.629 1.00 0.00 C ATOM 377 NH1 ARG A 23 -15.183 5.913 -11.060 1.00 0.00 N ATOM 378 NH2 ARG A 23 -16.727 4.991 -12.484 1.00 0.00 N ATOM 0 H ARG A 23 -13.090 1.461 -8.258 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.320 0.606 -10.951 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -11.781 3.048 -9.281 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -10.809 2.675 -10.690 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -12.486 4.138 -11.484 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -12.993 2.548 -12.020 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -14.397 2.450 -9.842 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -14.088 4.169 -9.702 1.00 0.00 H new ATOM 0 HE ARG A 23 -15.706 2.826 -11.809 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -14.411 5.805 -10.402 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -15.539 6.843 -11.281 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -17.147 4.172 -12.924 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -17.079 5.924 -12.701 1.00 0.00 H new ATOM 392 N ASN A 24 -10.517 -0.832 -10.008 1.00 0.00 N ATOM 393 CA ASN A 24 -9.367 -1.613 -9.602 1.00 0.00 C ATOM 394 C ASN A 24 -8.497 -1.880 -10.817 1.00 0.00 C ATOM 395 O ASN A 24 -7.744 -2.855 -10.870 1.00 0.00 O ATOM 396 CB ASN A 24 -9.824 -2.924 -8.963 1.00 0.00 C ATOM 397 CG ASN A 24 -8.822 -3.465 -7.965 1.00 0.00 C ATOM 398 OD1 ASN A 24 -8.116 -2.707 -7.298 1.00 0.00 O ATOM 399 ND2 ASN A 24 -8.771 -4.777 -7.834 1.00 0.00 N ATOM 0 H ASN A 24 -11.120 -1.293 -10.689 1.00 0.00 H new ATOM 0 HA ASN A 24 -8.787 -1.061 -8.862 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -10.780 -2.767 -8.464 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -9.990 -3.666 -9.744 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -8.130 -5.198 -7.161 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -9.373 -5.370 -8.405 1.00 0.00 H new ATOM 406 N LYS A 25 -8.631 -0.998 -11.802 1.00 0.00 N ATOM 407 CA LYS A 25 -7.844 -1.059 -13.022 1.00 0.00 C ATOM 408 C LYS A 25 -7.370 0.330 -13.432 1.00 0.00 C ATOM 409 O LYS A 25 -8.171 1.212 -13.750 1.00 0.00 O ATOM 410 CB LYS A 25 -8.646 -1.688 -14.163 1.00 0.00 C ATOM 411 CG LYS A 25 -8.717 -3.202 -14.089 1.00 0.00 C ATOM 412 CD LYS A 25 -9.505 -3.783 -15.248 1.00 0.00 C ATOM 413 CE LYS A 25 -9.348 -5.293 -15.323 1.00 0.00 C ATOM 414 NZ LYS A 25 -9.739 -5.964 -14.052 1.00 0.00 N ATOM 0 H LYS A 25 -9.290 -0.220 -11.774 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.974 -1.684 -12.820 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.658 -1.284 -14.151 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.198 -1.399 -15.114 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.708 -3.614 -14.092 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.180 -3.499 -13.148 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.559 -3.530 -15.136 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.167 -3.334 -16.182 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.959 -5.680 -16.139 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -8.312 -5.538 -15.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.795 -6.991 -14.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.029 -5.761 -13.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.666 -5.609 -13.743 1.00 0.00 H new ATOM 428 N GLY A 26 -6.067 0.521 -13.387 1.00 0.00 N ATOM 429 CA GLY A 26 -5.465 1.742 -13.866 1.00 0.00 C ATOM 430 C GLY A 26 -4.015 1.512 -14.219 1.00 0.00 C ATOM 431 O GLY A 26 -3.284 0.894 -13.443 1.00 0.00 O ATOM 0 H GLY A 26 -5.403 -0.161 -13.020 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -6.006 2.103 -14.741 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.541 2.516 -13.103 1.00 0.00 H new ATOM 435 N VAL A 27 -3.591 1.990 -15.376 1.00 0.00 N ATOM 436 CA VAL A 27 -2.237 1.742 -15.831 1.00 0.00 C ATOM 437 C VAL A 27 -1.582 3.011 -16.373 1.00 0.00 C ATOM 438 O VAL A 27 -1.903 3.496 -17.462 1.00 0.00 O ATOM 439 CB VAL A 27 -2.194 0.610 -16.886 1.00 0.00 C ATOM 440 CG1 VAL A 27 -3.149 0.887 -18.039 1.00 0.00 C ATOM 441 CG2 VAL A 27 -0.775 0.403 -17.397 1.00 0.00 C ATOM 0 H VAL A 27 -4.161 2.548 -16.012 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.664 1.417 -14.963 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.522 -0.309 -16.400 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.093 0.073 -18.761 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -4.167 0.965 -17.658 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.871 1.822 -18.525 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.768 -0.397 -18.137 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.415 1.324 -17.855 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.124 0.133 -16.565 1.00 0.00 H new ATOM 451 N LEU A 28 -0.676 3.558 -15.584 1.00 0.00 N ATOM 452 CA LEU A 28 0.110 4.703 -16.000 1.00 0.00 C ATOM 453 C LEU A 28 1.577 4.290 -16.072 1.00 0.00 C ATOM 454 O LEU A 28 2.367 4.563 -15.168 1.00 0.00 O ATOM 455 CB LEU A 28 -0.097 5.861 -15.020 1.00 0.00 C ATOM 456 CG LEU A 28 0.111 7.263 -15.595 1.00 0.00 C ATOM 457 CD1 LEU A 28 -0.459 8.296 -14.641 1.00 0.00 C ATOM 458 CD2 LEU A 28 1.584 7.539 -15.845 1.00 0.00 C ATOM 0 H LEU A 28 -0.466 3.224 -14.644 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.208 5.044 -16.985 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.110 5.799 -14.621 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.585 5.728 -14.180 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.410 7.325 -16.551 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.309 9.294 -15.053 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.525 8.116 -14.505 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.048 8.221 -13.679 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.702 8.543 -16.254 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.133 7.463 -14.906 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.975 6.810 -16.555 1.00 0.00 H new ATOM 470 N ASN A 29 1.926 3.619 -17.158 1.00 0.00 N ATOM 471 CA ASN A 29 3.237 2.988 -17.298 1.00 0.00 C ATOM 472 C ASN A 29 4.286 4.006 -17.753 1.00 0.00 C ATOM 473 O ASN A 29 5.426 3.661 -18.054 1.00 0.00 O ATOM 474 CB ASN A 29 3.134 1.838 -18.311 1.00 0.00 C ATOM 475 CG ASN A 29 4.249 0.815 -18.176 1.00 0.00 C ATOM 476 OD1 ASN A 29 4.130 -0.148 -17.421 1.00 0.00 O ATOM 477 ND2 ASN A 29 5.326 0.999 -18.920 1.00 0.00 N ATOM 0 H ASN A 29 1.315 3.494 -17.965 1.00 0.00 H new ATOM 0 HA ASN A 29 3.550 2.597 -16.330 1.00 0.00 H new ATOM 0 HB2 ASN A 29 2.174 1.337 -18.185 1.00 0.00 H new ATOM 0 HB3 ASN A 29 3.149 2.250 -19.320 1.00 0.00 H new ATOM 0 HD21 ASN A 29 6.094 0.329 -18.879 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.389 1.810 -19.535 1.00 0.00 H new ATOM 484 N ASP A 30 3.899 5.270 -17.766 1.00 0.00 N ATOM 485 CA ASP A 30 4.744 6.321 -18.310 1.00 0.00 C ATOM 486 C ASP A 30 5.587 6.991 -17.227 1.00 0.00 C ATOM 487 O ASP A 30 6.302 7.953 -17.496 1.00 0.00 O ATOM 488 CB ASP A 30 3.886 7.357 -19.040 1.00 0.00 C ATOM 489 CG ASP A 30 3.173 6.770 -20.245 1.00 0.00 C ATOM 490 OD1 ASP A 30 3.752 6.792 -21.352 1.00 0.00 O ATOM 491 OD2 ASP A 30 2.033 6.283 -20.094 1.00 0.00 O ATOM 0 H ASP A 30 3.002 5.595 -17.405 1.00 0.00 H new ATOM 0 HA ASP A 30 5.433 5.862 -19.019 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.149 7.767 -18.349 1.00 0.00 H new ATOM 0 HB3 ASP A 30 4.517 8.186 -19.362 1.00 0.00 H new ATOM 496 N SER A 31 5.497 6.494 -16.000 1.00 0.00 N ATOM 497 CA SER A 31 6.330 7.002 -14.917 1.00 0.00 C ATOM 498 C SER A 31 6.724 5.871 -13.966 1.00 0.00 C ATOM 499 O SER A 31 7.578 5.050 -14.298 1.00 0.00 O ATOM 500 CB SER A 31 5.614 8.131 -14.169 1.00 0.00 C ATOM 501 OG SER A 31 5.309 9.204 -15.044 1.00 0.00 O ATOM 0 H SER A 31 4.860 5.744 -15.731 1.00 0.00 H new ATOM 0 HA SER A 31 7.244 7.413 -15.346 1.00 0.00 H new ATOM 0 HB2 SER A 31 4.696 7.751 -13.720 1.00 0.00 H new ATOM 0 HB3 SER A 31 6.243 8.489 -13.354 1.00 0.00 H new ATOM 0 HG SER A 31 5.465 10.055 -14.584 1.00 0.00 H new ATOM 507 N ILE A 32 6.097 5.808 -12.798 1.00 0.00 N ATOM 508 CA ILE A 32 6.395 4.748 -11.848 1.00 0.00 C ATOM 509 C ILE A 32 5.598 3.500 -12.185 1.00 0.00 C ATOM 510 O ILE A 32 4.380 3.560 -12.343 1.00 0.00 O ATOM 511 CB ILE A 32 6.077 5.155 -10.396 1.00 0.00 C ATOM 512 CG1 ILE A 32 6.845 6.415 -10.006 1.00 0.00 C ATOM 513 CG2 ILE A 32 6.412 4.016 -9.442 1.00 0.00 C ATOM 514 CD1 ILE A 32 6.538 6.888 -8.603 1.00 0.00 C ATOM 0 H ILE A 32 5.387 6.472 -12.489 1.00 0.00 H new ATOM 0 HA ILE A 32 7.465 4.552 -11.925 1.00 0.00 H new ATOM 0 HB ILE A 32 5.010 5.369 -10.327 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.914 6.222 -10.092 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.607 7.211 -10.711 1.00 0.00 H new ATOM 0 HG21 ILE A 32 6.182 4.318 -8.420 1.00 0.00 H new ATOM 0 HG22 ILE A 32 5.821 3.138 -9.702 1.00 0.00 H new ATOM 0 HG23 ILE A 32 7.472 3.776 -9.520 1.00 0.00 H new ATOM 0 HD11 ILE A 32 7.116 7.787 -8.388 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.474 7.111 -8.519 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.802 6.107 -7.890 1.00 0.00 H new ATOM 526 N VAL A 33 6.288 2.380 -12.288 1.00 0.00 N ATOM 527 CA VAL A 33 5.646 1.117 -12.620 1.00 0.00 C ATOM 528 C VAL A 33 6.032 0.044 -11.613 1.00 0.00 C ATOM 529 O VAL A 33 7.134 -0.498 -11.668 1.00 0.00 O ATOM 530 CB VAL A 33 6.026 0.631 -14.035 1.00 0.00 C ATOM 531 CG1 VAL A 33 5.211 -0.597 -14.415 1.00 0.00 C ATOM 532 CG2 VAL A 33 5.844 1.740 -15.061 1.00 0.00 C ATOM 0 H VAL A 33 7.296 2.317 -12.147 1.00 0.00 H new ATOM 0 HA VAL A 33 4.570 1.291 -12.590 1.00 0.00 H new ATOM 0 HB VAL A 33 7.080 0.354 -14.027 1.00 0.00 H new ATOM 0 HG11 VAL A 33 5.493 -0.925 -15.416 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.406 -1.398 -13.702 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.150 -0.348 -14.400 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.119 1.370 -16.049 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.802 2.060 -15.070 1.00 0.00 H new ATOM 0 HG23 VAL A 33 6.481 2.585 -14.800 1.00 0.00 H new ATOM 542 N VAL A 34 5.140 -0.235 -10.677 1.00 0.00 N ATOM 543 CA VAL A 34 5.379 -1.270 -9.686 1.00 0.00 C ATOM 544 C VAL A 34 4.350 -2.383 -9.829 1.00 0.00 C ATOM 545 O VAL A 34 3.149 -2.140 -9.726 1.00 0.00 O ATOM 546 CB VAL A 34 5.327 -0.710 -8.248 1.00 0.00 C ATOM 547 CG1 VAL A 34 5.621 -1.802 -7.229 1.00 0.00 C ATOM 548 CG2 VAL A 34 6.302 0.446 -8.091 1.00 0.00 C ATOM 0 H VAL A 34 4.243 0.241 -10.583 1.00 0.00 H new ATOM 0 HA VAL A 34 6.380 -1.664 -9.864 1.00 0.00 H new ATOM 0 HB VAL A 34 4.319 -0.339 -8.064 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.578 -1.383 -6.224 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.880 -2.596 -7.323 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.615 -2.210 -7.410 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.252 0.828 -7.071 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.314 0.099 -8.299 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.040 1.241 -8.790 1.00 0.00 H new ATOM 558 N ASP A 35 4.818 -3.592 -10.088 1.00 0.00 N ATOM 559 CA ASP A 35 3.925 -4.734 -10.227 1.00 0.00 C ATOM 560 C ASP A 35 4.354 -5.853 -9.288 1.00 0.00 C ATOM 561 O ASP A 35 5.544 -6.034 -9.024 1.00 0.00 O ATOM 562 CB ASP A 35 3.892 -5.235 -11.679 1.00 0.00 C ATOM 563 CG ASP A 35 5.195 -5.875 -12.120 1.00 0.00 C ATOM 564 OD1 ASP A 35 6.106 -5.143 -12.569 1.00 0.00 O ATOM 565 OD2 ASP A 35 5.312 -7.115 -12.031 1.00 0.00 O ATOM 0 H ASP A 35 5.807 -3.810 -10.206 1.00 0.00 H new ATOM 0 HA ASP A 35 2.918 -4.415 -9.959 1.00 0.00 H new ATOM 0 HB2 ASP A 35 3.084 -5.958 -11.789 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.663 -4.399 -12.340 1.00 0.00 H new ATOM 570 N MET A 36 3.378 -6.585 -8.772 1.00 0.00 N ATOM 571 CA MET A 36 3.624 -7.673 -7.851 1.00 0.00 C ATOM 572 C MET A 36 2.726 -8.839 -8.203 1.00 0.00 C ATOM 573 O MET A 36 1.510 -8.687 -8.344 1.00 0.00 O ATOM 574 CB MET A 36 3.376 -7.242 -6.402 1.00 0.00 C ATOM 575 CG MET A 36 4.391 -6.244 -5.873 1.00 0.00 C ATOM 576 SD MET A 36 6.062 -6.920 -5.805 1.00 0.00 S ATOM 577 CE MET A 36 6.971 -5.479 -5.253 1.00 0.00 C ATOM 0 H MET A 36 2.391 -6.437 -8.984 1.00 0.00 H new ATOM 0 HA MET A 36 4.669 -7.970 -7.937 1.00 0.00 H new ATOM 0 HB2 MET A 36 2.380 -6.805 -6.329 1.00 0.00 H new ATOM 0 HB3 MET A 36 3.384 -8.126 -5.764 1.00 0.00 H new ATOM 0 HG2 MET A 36 4.388 -5.358 -6.507 1.00 0.00 H new ATOM 0 HG3 MET A 36 4.093 -5.923 -4.875 1.00 0.00 H new ATOM 0 HE1 MET A 36 8.028 -5.729 -5.160 1.00 0.00 H new ATOM 0 HE2 MET A 36 6.851 -4.674 -5.978 1.00 0.00 H new ATOM 0 HE3 MET A 36 6.588 -5.156 -4.285 1.00 0.00 H new ATOM 587 N ASN A 37 3.343 -9.982 -8.383 1.00 0.00 N ATOM 588 CA ASN A 37 2.634 -11.209 -8.720 1.00 0.00 C ATOM 589 C ASN A 37 2.514 -12.101 -7.490 1.00 0.00 C ATOM 590 O ASN A 37 3.473 -12.254 -6.730 1.00 0.00 O ATOM 591 CB ASN A 37 3.373 -11.965 -9.833 1.00 0.00 C ATOM 592 CG ASN A 37 3.500 -11.167 -11.125 1.00 0.00 C ATOM 593 OD1 ASN A 37 4.506 -11.265 -11.830 1.00 0.00 O ATOM 594 ND2 ASN A 37 2.476 -10.397 -11.465 1.00 0.00 N ATOM 0 H ASN A 37 4.353 -10.096 -8.301 1.00 0.00 H new ATOM 0 HA ASN A 37 1.637 -10.945 -9.071 1.00 0.00 H new ATOM 0 HB2 ASN A 37 4.369 -12.233 -9.481 1.00 0.00 H new ATOM 0 HB3 ASN A 37 2.847 -12.897 -10.040 1.00 0.00 H new ATOM 0 HD21 ASN A 37 2.506 -9.863 -12.333 1.00 0.00 H new ATOM 0 HD22 ASN A 37 1.658 -10.339 -10.858 1.00 0.00 H new ATOM 601 N ASN A 38 1.335 -12.667 -7.281 1.00 0.00 N ATOM 602 CA ASN A 38 1.114 -13.606 -6.193 1.00 0.00 C ATOM 603 C ASN A 38 0.373 -14.811 -6.761 1.00 0.00 C ATOM 604 O ASN A 38 -0.845 -14.775 -6.895 1.00 0.00 O ATOM 605 CB ASN A 38 0.323 -12.909 -5.071 1.00 0.00 C ATOM 606 CG ASN A 38 0.093 -13.750 -3.822 1.00 0.00 C ATOM 607 OD1 ASN A 38 -0.916 -13.568 -3.119 1.00 0.00 O ATOM 608 ND2 ASN A 38 1.022 -14.638 -3.507 1.00 0.00 N ATOM 0 H ASN A 38 0.511 -12.490 -7.856 1.00 0.00 H new ATOM 0 HA ASN A 38 2.054 -13.947 -5.758 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.853 -12.000 -4.785 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -0.645 -12.603 -5.467 1.00 0.00 H new ATOM 0 HD21 ASN A 38 0.924 -15.201 -2.662 1.00 0.00 H new ATOM 0 HD22 ASN A 38 1.837 -14.759 -4.109 1.00 0.00 H new ATOM 615 N PRO A 39 1.124 -15.890 -7.080 1.00 0.00 N ATOM 616 CA PRO A 39 0.710 -17.001 -7.945 1.00 0.00 C ATOM 617 C PRO A 39 -0.796 -17.120 -8.197 1.00 0.00 C ATOM 618 O PRO A 39 -1.288 -16.692 -9.241 1.00 0.00 O ATOM 619 CB PRO A 39 1.253 -18.196 -7.171 1.00 0.00 C ATOM 620 CG PRO A 39 2.516 -17.687 -6.531 1.00 0.00 C ATOM 621 CD PRO A 39 2.467 -16.168 -6.563 1.00 0.00 C ATOM 0 HA PRO A 39 1.086 -16.887 -8.962 1.00 0.00 H new ATOM 0 HB2 PRO A 39 0.540 -18.541 -6.422 1.00 0.00 H new ATOM 0 HB3 PRO A 39 1.455 -19.039 -7.832 1.00 0.00 H new ATOM 0 HG2 PRO A 39 2.597 -18.046 -5.505 1.00 0.00 H new ATOM 0 HG3 PRO A 39 3.392 -18.053 -7.067 1.00 0.00 H new ATOM 0 HD2 PRO A 39 2.614 -15.739 -5.572 1.00 0.00 H new ATOM 0 HD3 PRO A 39 3.241 -15.753 -7.208 1.00 0.00 H new ATOM 629 N THR A 40 -1.526 -17.688 -7.246 1.00 0.00 N ATOM 630 CA THR A 40 -2.967 -17.847 -7.386 1.00 0.00 C ATOM 631 C THR A 40 -3.707 -17.056 -6.319 1.00 0.00 C ATOM 632 O THR A 40 -4.885 -17.290 -6.056 1.00 0.00 O ATOM 633 CB THR A 40 -3.365 -19.330 -7.282 1.00 0.00 C ATOM 634 OG1 THR A 40 -2.676 -19.940 -6.178 1.00 0.00 O ATOM 635 CG2 THR A 40 -3.033 -20.067 -8.567 1.00 0.00 C ATOM 0 H THR A 40 -1.144 -18.046 -6.370 1.00 0.00 H new ATOM 0 HA THR A 40 -3.244 -17.467 -8.369 1.00 0.00 H new ATOM 0 HB THR A 40 -4.441 -19.390 -7.118 1.00 0.00 H new ATOM 0 HG1 THR A 40 -2.933 -20.884 -6.113 1.00 0.00 H new ATOM 0 HG21 THR A 40 -3.323 -21.113 -8.471 1.00 0.00 H new ATOM 0 HG22 THR A 40 -3.576 -19.614 -9.397 1.00 0.00 H new ATOM 0 HG23 THR A 40 -1.962 -20.003 -8.757 1.00 0.00 H new ATOM 643 N CYS A 41 -3.012 -16.107 -5.713 1.00 0.00 N ATOM 644 CA CYS A 41 -3.565 -15.360 -4.597 1.00 0.00 C ATOM 645 C CYS A 41 -3.350 -13.854 -4.792 1.00 0.00 C ATOM 646 O CYS A 41 -3.475 -13.061 -3.843 1.00 0.00 O ATOM 647 CB CYS A 41 -2.921 -15.848 -3.288 1.00 0.00 C ATOM 648 SG CYS A 41 -3.460 -14.975 -1.791 1.00 0.00 S ATOM 0 H CYS A 41 -2.064 -15.836 -5.976 1.00 0.00 H new ATOM 0 HA CYS A 41 -4.640 -15.532 -4.546 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -3.138 -16.909 -3.168 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -1.839 -15.752 -3.376 1.00 0.00 H new ATOM 0 HG CYS A 41 -4.053 -13.867 -2.124 1.00 0.00 H new ATOM 654 N GLY A 42 -3.011 -13.461 -6.005 1.00 0.00 N ATOM 655 CA GLY A 42 -2.772 -12.066 -6.301 1.00 0.00 C ATOM 656 C GLY A 42 -2.040 -11.893 -7.610 1.00 0.00 C ATOM 657 O GLY A 42 -0.976 -11.283 -7.645 1.00 0.00 O ATOM 0 H GLY A 42 -2.896 -14.090 -6.800 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -3.723 -11.534 -6.342 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.190 -11.617 -5.496 1.00 0.00 H new ATOM 661 N ASP A 43 -2.630 -12.474 -8.656 1.00 0.00 N ATOM 662 CA ASP A 43 -2.133 -12.430 -10.041 1.00 0.00 C ATOM 663 C ASP A 43 -1.178 -11.276 -10.301 1.00 0.00 C ATOM 664 O ASP A 43 0.023 -11.487 -10.471 1.00 0.00 O ATOM 665 CB ASP A 43 -3.305 -12.313 -11.022 1.00 0.00 C ATOM 666 CG ASP A 43 -4.187 -13.542 -11.062 1.00 0.00 C ATOM 667 OD1 ASP A 43 -4.793 -13.888 -10.026 1.00 0.00 O ATOM 668 OD2 ASP A 43 -4.296 -14.158 -12.143 1.00 0.00 O ATOM 0 H ASP A 43 -3.495 -13.006 -8.564 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.585 -13.360 -10.191 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -3.912 -11.450 -10.749 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -2.914 -12.124 -12.022 1.00 0.00 H new ATOM 673 N ARG A 44 -1.698 -10.057 -10.328 1.00 0.00 N ATOM 674 CA ARG A 44 -0.870 -8.912 -10.650 1.00 0.00 C ATOM 675 C ARG A 44 -1.492 -7.623 -10.162 1.00 0.00 C ATOM 676 O ARG A 44 -2.605 -7.271 -10.544 1.00 0.00 O ATOM 677 CB ARG A 44 -0.609 -8.845 -12.163 1.00 0.00 C ATOM 678 CG ARG A 44 -1.866 -8.916 -13.017 1.00 0.00 C ATOM 679 CD ARG A 44 -1.527 -8.962 -14.498 1.00 0.00 C ATOM 680 NE ARG A 44 -2.715 -9.127 -15.334 1.00 0.00 N ATOM 681 CZ ARG A 44 -2.828 -10.040 -16.295 1.00 0.00 C ATOM 682 NH1 ARG A 44 -1.829 -10.878 -16.546 1.00 0.00 N ATOM 683 NH2 ARG A 44 -3.945 -10.115 -17.008 1.00 0.00 N ATOM 0 H ARG A 44 -2.676 -9.840 -10.133 1.00 0.00 H new ATOM 0 HA ARG A 44 0.083 -9.036 -10.135 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -0.082 -7.918 -12.389 1.00 0.00 H new ATOM 0 HB3 ARG A 44 0.053 -9.664 -12.443 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -2.442 -9.801 -12.746 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -2.496 -8.050 -12.813 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -1.012 -8.043 -14.779 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -0.837 -9.784 -14.685 1.00 0.00 H new ATOM 0 HE ARG A 44 -3.506 -8.504 -15.170 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -0.969 -10.824 -16.001 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -1.922 -11.576 -17.284 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -4.715 -9.473 -16.819 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -4.033 -10.814 -17.745 1.00 0.00 H new ATOM 697 N ILE A 45 -0.782 -6.941 -9.285 1.00 0.00 N ATOM 698 CA ILE A 45 -1.165 -5.603 -8.881 1.00 0.00 C ATOM 699 C ILE A 45 -0.251 -4.590 -9.557 1.00 0.00 C ATOM 700 O ILE A 45 0.928 -4.474 -9.228 1.00 0.00 O ATOM 701 CB ILE A 45 -1.141 -5.422 -7.341 1.00 0.00 C ATOM 702 CG1 ILE A 45 -1.380 -3.952 -6.968 1.00 0.00 C ATOM 703 CG2 ILE A 45 0.166 -5.928 -6.746 1.00 0.00 C ATOM 704 CD1 ILE A 45 -1.371 -3.690 -5.474 1.00 0.00 C ATOM 0 H ILE A 45 0.065 -7.292 -8.838 1.00 0.00 H new ATOM 0 HA ILE A 45 -2.195 -5.438 -9.197 1.00 0.00 H new ATOM 0 HB ILE A 45 -1.949 -6.020 -6.919 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -0.613 -3.338 -7.440 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -2.339 -3.634 -7.377 1.00 0.00 H new ATOM 0 HG21 ILE A 45 0.152 -5.787 -5.665 1.00 0.00 H new ATOM 0 HG22 ILE A 45 0.283 -6.988 -6.973 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.000 -5.372 -7.174 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -1.546 -2.630 -5.289 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.156 -4.276 -4.997 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.404 -3.975 -5.060 1.00 0.00 H new ATOM 716 N ARG A 46 -0.788 -3.899 -10.544 1.00 0.00 N ATOM 717 CA ARG A 46 -0.023 -2.915 -11.279 1.00 0.00 C ATOM 718 C ARG A 46 -0.285 -1.527 -10.716 1.00 0.00 C ATOM 719 O ARG A 46 -1.331 -0.928 -10.965 1.00 0.00 O ATOM 720 CB ARG A 46 -0.350 -2.976 -12.774 1.00 0.00 C ATOM 721 CG ARG A 46 -0.087 -4.342 -13.385 1.00 0.00 C ATOM 722 CD ARG A 46 -0.043 -4.290 -14.903 1.00 0.00 C ATOM 723 NE ARG A 46 -1.309 -3.865 -15.494 1.00 0.00 N ATOM 724 CZ ARG A 46 -1.408 -3.261 -16.676 1.00 0.00 C ATOM 725 NH1 ARG A 46 -0.322 -3.064 -17.414 1.00 0.00 N ATOM 726 NH2 ARG A 46 -2.596 -2.884 -17.134 1.00 0.00 N ATOM 0 H ARG A 46 -1.754 -4.003 -10.855 1.00 0.00 H new ATOM 0 HA ARG A 46 1.038 -3.139 -11.165 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.398 -2.714 -12.922 1.00 0.00 H new ATOM 0 HB3 ARG A 46 0.243 -2.228 -13.301 1.00 0.00 H new ATOM 0 HG2 ARG A 46 0.859 -4.731 -13.008 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -0.866 -5.036 -13.069 1.00 0.00 H new ATOM 0 HD2 ARG A 46 0.746 -3.606 -15.215 1.00 0.00 H new ATOM 0 HD3 ARG A 46 0.219 -5.276 -15.288 1.00 0.00 H new ATOM 0 HE ARG A 46 -2.167 -4.041 -14.971 1.00 0.00 H new ATOM 0 HH11 ARG A 46 0.588 -3.376 -17.075 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -0.398 -2.601 -18.320 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -3.435 -3.057 -16.580 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -2.670 -2.421 -18.040 1.00 0.00 H new ATOM 740 N LEU A 47 0.670 -1.042 -9.940 1.00 0.00 N ATOM 741 CA LEU A 47 0.576 0.244 -9.290 1.00 0.00 C ATOM 742 C LEU A 47 1.457 1.215 -10.051 1.00 0.00 C ATOM 743 O LEU A 47 2.688 1.165 -9.970 1.00 0.00 O ATOM 744 CB LEU A 47 1.027 0.126 -7.827 1.00 0.00 C ATOM 745 CG LEU A 47 0.317 1.050 -6.834 1.00 0.00 C ATOM 746 CD1 LEU A 47 0.874 0.847 -5.435 1.00 0.00 C ATOM 747 CD2 LEU A 47 0.450 2.504 -7.251 1.00 0.00 C ATOM 0 H LEU A 47 1.539 -1.539 -9.745 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.454 0.602 -9.291 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.881 -0.905 -7.504 1.00 0.00 H new ATOM 0 HB3 LEU A 47 2.097 0.326 -7.779 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.743 0.795 -6.831 1.00 0.00 H new ATOM 0 HD11 LEU A 47 0.360 1.510 -4.739 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.722 -0.188 -5.129 1.00 0.00 H new ATOM 0 HD13 LEU A 47 1.940 1.073 -5.432 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -0.063 3.138 -6.528 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.505 2.777 -7.288 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.004 2.642 -8.236 1.00 0.00 H new ATOM 759 N THR A 48 0.825 2.071 -10.815 1.00 0.00 N ATOM 760 CA THR A 48 1.531 2.967 -11.688 1.00 0.00 C ATOM 761 C THR A 48 1.268 4.404 -11.277 1.00 0.00 C ATOM 762 O THR A 48 0.124 4.842 -11.215 1.00 0.00 O ATOM 763 CB THR A 48 1.111 2.718 -13.138 1.00 0.00 C ATOM 764 OG1 THR A 48 -0.294 2.427 -13.189 1.00 0.00 O ATOM 765 CG2 THR A 48 1.895 1.561 -13.740 1.00 0.00 C ATOM 0 H THR A 48 -0.190 2.164 -10.847 1.00 0.00 H new ATOM 0 HA THR A 48 2.603 2.784 -11.609 1.00 0.00 H new ATOM 0 HB THR A 48 1.323 3.616 -13.718 1.00 0.00 H new ATOM 0 HG1 THR A 48 -0.431 1.461 -13.100 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.578 1.404 -14.771 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.960 1.793 -13.719 1.00 0.00 H new ATOM 0 HG23 THR A 48 1.710 0.656 -13.162 1.00 0.00 H new ATOM 773 N MET A 49 2.329 5.125 -10.969 1.00 0.00 N ATOM 774 CA MET A 49 2.198 6.434 -10.356 1.00 0.00 C ATOM 775 C MET A 49 2.910 7.499 -11.168 1.00 0.00 C ATOM 776 O MET A 49 4.027 7.296 -11.639 1.00 0.00 O ATOM 777 CB MET A 49 2.753 6.397 -8.930 1.00 0.00 C ATOM 778 CG MET A 49 1.901 5.581 -7.977 1.00 0.00 C ATOM 779 SD MET A 49 2.710 5.267 -6.397 1.00 0.00 S ATOM 780 CE MET A 49 3.959 4.083 -6.891 1.00 0.00 C ATOM 0 H MET A 49 3.291 4.827 -11.133 1.00 0.00 H new ATOM 0 HA MET A 49 1.139 6.691 -10.326 1.00 0.00 H new ATOM 0 HB2 MET A 49 3.761 5.983 -8.950 1.00 0.00 H new ATOM 0 HB3 MET A 49 2.834 7.416 -8.552 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.962 6.105 -7.800 1.00 0.00 H new ATOM 0 HG3 MET A 49 1.652 4.629 -8.446 1.00 0.00 H new ATOM 0 HE1 MET A 49 3.822 3.156 -6.335 1.00 0.00 H new ATOM 0 HE2 MET A 49 3.868 3.882 -7.959 1.00 0.00 H new ATOM 0 HE3 MET A 49 4.949 4.489 -6.681 1.00 0.00 H new ATOM 790 N LYS A 50 2.259 8.637 -11.332 1.00 0.00 N ATOM 791 CA LYS A 50 2.850 9.748 -12.044 1.00 0.00 C ATOM 792 C LYS A 50 3.175 10.847 -11.052 1.00 0.00 C ATOM 793 O LYS A 50 2.350 11.711 -10.770 1.00 0.00 O ATOM 794 CB LYS A 50 1.899 10.272 -13.127 1.00 0.00 C ATOM 795 CG LYS A 50 2.599 10.874 -14.341 1.00 0.00 C ATOM 796 CD LYS A 50 3.409 12.117 -13.998 1.00 0.00 C ATOM 797 CE LYS A 50 4.140 12.650 -15.219 1.00 0.00 C ATOM 798 NZ LYS A 50 4.931 13.875 -14.922 1.00 0.00 N ATOM 0 H LYS A 50 1.318 8.813 -10.979 1.00 0.00 H new ATOM 0 HA LYS A 50 3.762 9.414 -12.538 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.260 9.454 -13.460 1.00 0.00 H new ATOM 0 HB3 LYS A 50 1.247 11.027 -12.687 1.00 0.00 H new ATOM 0 HG2 LYS A 50 3.258 10.127 -14.782 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.854 11.128 -15.095 1.00 0.00 H new ATOM 0 HD2 LYS A 50 2.748 12.887 -13.602 1.00 0.00 H new ATOM 0 HD3 LYS A 50 4.129 11.881 -13.214 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.805 11.878 -15.606 1.00 0.00 H new ATOM 0 HE3 LYS A 50 3.416 12.870 -16.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.690 13.978 -15.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.309 14.708 -14.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 5.348 13.797 -13.973 1.00 0.00 H new ATOM 812 N LEU A 51 4.351 10.771 -10.472 1.00 0.00 N ATOM 813 CA LEU A 51 4.804 11.798 -9.559 1.00 0.00 C ATOM 814 C LEU A 51 5.277 13.008 -10.353 1.00 0.00 C ATOM 815 O LEU A 51 6.234 12.927 -11.123 1.00 0.00 O ATOM 816 CB LEU A 51 5.903 11.262 -8.627 1.00 0.00 C ATOM 817 CG LEU A 51 7.291 11.030 -9.227 1.00 0.00 C ATOM 818 CD1 LEU A 51 8.261 10.648 -8.125 1.00 0.00 C ATOM 819 CD2 LEU A 51 7.257 9.948 -10.293 1.00 0.00 C ATOM 0 H LEU A 51 5.013 10.008 -10.616 1.00 0.00 H new ATOM 0 HA LEU A 51 3.974 12.105 -8.923 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.009 11.960 -7.796 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.556 10.318 -8.208 1.00 0.00 H new ATOM 0 HG LEU A 51 7.621 11.954 -9.701 1.00 0.00 H new ATOM 0 HD11 LEU A 51 9.250 10.483 -8.552 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.313 11.452 -7.391 1.00 0.00 H new ATOM 0 HD13 LEU A 51 7.918 9.734 -7.639 1.00 0.00 H new ATOM 0 HD21 LEU A 51 8.258 9.807 -10.700 1.00 0.00 H new ATOM 0 HD22 LEU A 51 6.909 9.014 -9.852 1.00 0.00 H new ATOM 0 HD23 LEU A 51 6.579 10.246 -11.093 1.00 0.00 H new ATOM 831 N ASP A 52 4.579 14.119 -10.200 1.00 0.00 N ATOM 832 CA ASP A 52 4.873 15.301 -10.994 1.00 0.00 C ATOM 833 C ASP A 52 5.386 16.417 -10.100 1.00 0.00 C ATOM 834 O ASP A 52 4.715 17.431 -9.897 1.00 0.00 O ATOM 835 CB ASP A 52 3.624 15.760 -11.745 1.00 0.00 C ATOM 836 CG ASP A 52 3.962 16.456 -13.045 1.00 0.00 C ATOM 837 OD1 ASP A 52 4.690 17.465 -13.021 1.00 0.00 O ATOM 838 OD2 ASP A 52 3.517 15.973 -14.108 1.00 0.00 O ATOM 0 H ASP A 52 3.810 14.229 -9.539 1.00 0.00 H new ATOM 0 HA ASP A 52 5.645 15.050 -11.722 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.989 14.898 -11.951 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.049 16.436 -11.112 1.00 0.00 H new ATOM 843 N GLY A 53 6.557 16.197 -9.530 1.00 0.00 N ATOM 844 CA GLY A 53 7.155 17.180 -8.658 1.00 0.00 C ATOM 845 C GLY A 53 7.904 16.524 -7.522 1.00 0.00 C ATOM 846 O GLY A 53 9.004 16.004 -7.706 1.00 0.00 O ATOM 0 H GLY A 53 7.108 15.348 -9.657 1.00 0.00 H new ATOM 0 HA2 GLY A 53 7.837 17.810 -9.230 1.00 0.00 H new ATOM 0 HA3 GLY A 53 6.380 17.832 -8.256 1.00 0.00 H new ATOM 850 N ASP A 54 7.285 16.536 -6.352 1.00 0.00 N ATOM 851 CA ASP A 54 7.842 15.893 -5.165 1.00 0.00 C ATOM 852 C ASP A 54 6.782 14.997 -4.538 1.00 0.00 C ATOM 853 O ASP A 54 6.987 14.405 -3.476 1.00 0.00 O ATOM 854 CB ASP A 54 8.297 16.940 -4.137 1.00 0.00 C ATOM 855 CG ASP A 54 9.303 17.930 -4.693 1.00 0.00 C ATOM 856 OD1 ASP A 54 10.515 17.626 -4.693 1.00 0.00 O ATOM 857 OD2 ASP A 54 8.886 19.035 -5.112 1.00 0.00 O ATOM 0 H ASP A 54 6.385 16.989 -6.195 1.00 0.00 H new ATOM 0 HA ASP A 54 8.708 15.302 -5.462 1.00 0.00 H new ATOM 0 HB2 ASP A 54 7.425 17.484 -3.773 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.736 16.430 -3.279 1.00 0.00 H new ATOM 862 N ILE A 55 5.645 14.901 -5.217 1.00 0.00 N ATOM 863 CA ILE A 55 4.502 14.189 -4.718 1.00 0.00 C ATOM 864 C ILE A 55 4.270 12.928 -5.517 1.00 0.00 C ATOM 865 O ILE A 55 5.130 12.468 -6.248 1.00 0.00 O ATOM 866 CB ILE A 55 3.225 15.065 -4.796 1.00 0.00 C ATOM 867 CG1 ILE A 55 3.158 15.857 -6.117 1.00 0.00 C ATOM 868 CG2 ILE A 55 3.157 16.016 -3.618 1.00 0.00 C ATOM 869 CD1 ILE A 55 2.917 15.022 -7.360 1.00 0.00 C ATOM 0 H ILE A 55 5.502 15.322 -6.135 1.00 0.00 H new ATOM 0 HA ILE A 55 4.705 13.935 -3.678 1.00 0.00 H new ATOM 0 HB ILE A 55 2.368 14.393 -4.762 1.00 0.00 H new ATOM 0 HG12 ILE A 55 2.363 16.599 -6.037 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.093 16.404 -6.242 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.254 16.622 -3.691 1.00 0.00 H new ATOM 0 HG22 ILE A 55 3.137 15.445 -2.690 1.00 0.00 H new ATOM 0 HG23 ILE A 55 4.032 16.666 -3.625 1.00 0.00 H new ATOM 0 HD11 ILE A 55 2.887 15.672 -8.235 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.724 14.298 -7.474 1.00 0.00 H new ATOM 0 HD13 ILE A 55 1.967 14.496 -7.266 1.00 0.00 H new ATOM 881 N VAL A 56 3.091 12.407 -5.351 1.00 0.00 N ATOM 882 CA VAL A 56 2.561 11.321 -6.153 1.00 0.00 C ATOM 883 C VAL A 56 1.215 11.768 -6.702 1.00 0.00 C ATOM 884 O VAL A 56 0.239 11.818 -5.964 1.00 0.00 O ATOM 885 CB VAL A 56 2.357 10.032 -5.329 1.00 0.00 C ATOM 886 CG1 VAL A 56 1.958 8.875 -6.233 1.00 0.00 C ATOM 887 CG2 VAL A 56 3.602 9.695 -4.527 1.00 0.00 C ATOM 0 H VAL A 56 2.443 12.730 -4.633 1.00 0.00 H new ATOM 0 HA VAL A 56 3.273 11.094 -6.946 1.00 0.00 H new ATOM 0 HB VAL A 56 1.545 10.205 -4.623 1.00 0.00 H new ATOM 0 HG11 VAL A 56 1.819 7.976 -5.633 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.027 9.117 -6.745 1.00 0.00 H new ATOM 0 HG13 VAL A 56 2.742 8.702 -6.970 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.431 8.783 -3.956 1.00 0.00 H new ATOM 0 HG22 VAL A 56 4.442 9.546 -5.205 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.827 10.514 -3.844 1.00 0.00 H new ATOM 897 N GLU A 57 1.156 12.123 -7.978 1.00 0.00 N ATOM 898 CA GLU A 57 -0.053 12.729 -8.514 1.00 0.00 C ATOM 899 C GLU A 57 -1.083 11.670 -8.861 1.00 0.00 C ATOM 900 O GLU A 57 -2.092 11.528 -8.176 1.00 0.00 O ATOM 901 CB GLU A 57 0.255 13.599 -9.735 1.00 0.00 C ATOM 902 CG GLU A 57 -0.977 14.267 -10.327 1.00 0.00 C ATOM 903 CD GLU A 57 -0.646 15.216 -11.454 1.00 0.00 C ATOM 904 OE1 GLU A 57 -0.570 14.768 -12.616 1.00 0.00 O ATOM 905 OE2 GLU A 57 -0.476 16.421 -11.185 1.00 0.00 O ATOM 0 H GLU A 57 1.915 12.005 -8.649 1.00 0.00 H new ATOM 0 HA GLU A 57 -0.470 13.372 -7.739 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.975 14.367 -9.452 1.00 0.00 H new ATOM 0 HB3 GLU A 57 0.729 12.984 -10.500 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -1.659 13.500 -10.693 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -1.501 14.812 -9.542 1.00 0.00 H new ATOM 912 N ASP A 58 -0.834 10.913 -9.910 1.00 0.00 N ATOM 913 CA ASP A 58 -1.801 9.915 -10.328 1.00 0.00 C ATOM 914 C ASP A 58 -1.278 8.520 -10.050 1.00 0.00 C ATOM 915 O ASP A 58 -0.388 8.026 -10.737 1.00 0.00 O ATOM 916 CB ASP A 58 -2.157 10.073 -11.806 1.00 0.00 C ATOM 917 CG ASP A 58 -3.360 9.235 -12.203 1.00 0.00 C ATOM 918 OD1 ASP A 58 -4.243 9.003 -11.347 1.00 0.00 O ATOM 919 OD2 ASP A 58 -3.446 8.832 -13.379 1.00 0.00 O ATOM 0 H ASP A 58 0.011 10.966 -10.479 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.712 10.066 -9.748 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -2.362 11.122 -12.018 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.300 9.787 -12.416 1.00 0.00 H new ATOM 924 N ALA A 59 -1.812 7.914 -9.004 1.00 0.00 N ATOM 925 CA ALA A 59 -1.457 6.562 -8.625 1.00 0.00 C ATOM 926 C ALA A 59 -2.556 5.616 -9.068 1.00 0.00 C ATOM 927 O ALA A 59 -3.679 5.686 -8.570 1.00 0.00 O ATOM 928 CB ALA A 59 -1.247 6.477 -7.122 1.00 0.00 C ATOM 0 H ALA A 59 -2.505 8.348 -8.394 1.00 0.00 H new ATOM 0 HA ALA A 59 -0.525 6.278 -9.113 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -0.981 5.456 -6.849 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.444 7.153 -6.828 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -2.166 6.762 -6.610 1.00 0.00 H new ATOM 934 N LYS A 60 -2.244 4.745 -10.014 1.00 0.00 N ATOM 935 CA LYS A 60 -3.251 3.891 -10.600 1.00 0.00 C ATOM 936 C LYS A 60 -2.989 2.453 -10.196 1.00 0.00 C ATOM 937 O LYS A 60 -1.863 1.968 -10.294 1.00 0.00 O ATOM 938 CB LYS A 60 -3.256 4.036 -12.121 1.00 0.00 C ATOM 939 CG LYS A 60 -3.098 5.473 -12.601 1.00 0.00 C ATOM 940 CD LYS A 60 -3.709 5.676 -13.975 1.00 0.00 C ATOM 941 CE LYS A 60 -5.218 5.806 -13.884 1.00 0.00 C ATOM 942 NZ LYS A 60 -5.626 7.077 -13.225 1.00 0.00 N ATOM 0 H LYS A 60 -1.304 4.615 -10.388 1.00 0.00 H new ATOM 0 HA LYS A 60 -4.233 4.188 -10.233 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -2.449 3.433 -12.537 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -4.190 3.632 -12.512 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -3.571 6.149 -11.889 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -2.040 5.732 -12.631 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -3.290 6.571 -14.435 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -3.451 4.836 -14.620 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -5.647 5.762 -14.885 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -5.622 4.961 -13.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -6.581 7.340 -13.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -5.625 6.949 -12.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -4.957 7.831 -13.481 1.00 0.00 H new ATOM 956 N PHE A 61 -4.028 1.781 -9.742 1.00 0.00 N ATOM 957 CA PHE A 61 -3.882 0.460 -9.169 1.00 0.00 C ATOM 958 C PHE A 61 -4.744 -0.560 -9.897 1.00 0.00 C ATOM 959 O PHE A 61 -5.958 -0.605 -9.727 1.00 0.00 O ATOM 960 CB PHE A 61 -4.224 0.502 -7.672 1.00 0.00 C ATOM 961 CG PHE A 61 -5.329 1.469 -7.324 1.00 0.00 C ATOM 962 CD1 PHE A 61 -6.659 1.109 -7.454 1.00 0.00 C ATOM 963 CD2 PHE A 61 -5.028 2.742 -6.864 1.00 0.00 C ATOM 964 CE1 PHE A 61 -7.668 1.998 -7.135 1.00 0.00 C ATOM 965 CE2 PHE A 61 -6.032 3.635 -6.544 1.00 0.00 C ATOM 966 CZ PHE A 61 -7.356 3.263 -6.680 1.00 0.00 C ATOM 0 H PHE A 61 -4.986 2.131 -9.759 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.845 0.146 -9.285 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.514 -0.497 -7.347 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -3.329 0.772 -7.112 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -6.912 0.121 -7.809 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -3.995 3.039 -6.755 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -8.701 1.703 -7.242 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -5.782 4.624 -6.188 1.00 0.00 H new ATOM 0 HZ PHE A 61 -8.143 3.959 -6.431 1.00 0.00 H new ATOM 976 N GLU A 62 -4.109 -1.356 -10.739 1.00 0.00 N ATOM 977 CA GLU A 62 -4.792 -2.450 -11.401 1.00 0.00 C ATOM 978 C GLU A 62 -4.388 -3.766 -10.759 1.00 0.00 C ATOM 979 O GLU A 62 -3.361 -4.344 -11.107 1.00 0.00 O ATOM 980 CB GLU A 62 -4.466 -2.488 -12.891 1.00 0.00 C ATOM 981 CG GLU A 62 -5.242 -3.557 -13.638 1.00 0.00 C ATOM 982 CD GLU A 62 -4.662 -3.853 -14.999 1.00 0.00 C ATOM 983 OE1 GLU A 62 -5.030 -3.169 -15.971 1.00 0.00 O ATOM 984 OE2 GLU A 62 -3.824 -4.769 -15.099 1.00 0.00 O ATOM 0 H GLU A 62 -3.122 -1.264 -10.980 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.865 -2.296 -11.291 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.683 -1.514 -13.330 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.398 -2.664 -13.020 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.254 -4.472 -13.046 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.278 -3.237 -13.751 1.00 0.00 H new ATOM 991 N GLY A 63 -5.180 -4.223 -9.811 1.00 0.00 N ATOM 992 CA GLY A 63 -4.838 -5.432 -9.100 1.00 0.00 C ATOM 993 C GLY A 63 -5.768 -6.579 -9.414 1.00 0.00 C ATOM 994 O GLY A 63 -6.989 -6.426 -9.381 1.00 0.00 O ATOM 0 H GLY A 63 -6.052 -3.781 -9.520 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.817 -5.719 -9.351 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -4.860 -5.236 -8.028 1.00 0.00 H new ATOM 998 N GLU A 64 -5.195 -7.722 -9.745 1.00 0.00 N ATOM 999 CA GLU A 64 -5.961 -8.942 -9.885 1.00 0.00 C ATOM 1000 C GLU A 64 -5.467 -9.929 -8.844 1.00 0.00 C ATOM 1001 O GLU A 64 -4.262 -10.091 -8.672 1.00 0.00 O ATOM 1002 CB GLU A 64 -5.826 -9.516 -11.301 1.00 0.00 C ATOM 1003 CG GLU A 64 -6.412 -8.614 -12.380 1.00 0.00 C ATOM 1004 CD GLU A 64 -6.337 -9.219 -13.770 1.00 0.00 C ATOM 1005 OE1 GLU A 64 -6.123 -10.444 -13.883 1.00 0.00 O ATOM 1006 OE2 GLU A 64 -6.501 -8.468 -14.759 1.00 0.00 O ATOM 0 H GLU A 64 -4.196 -7.828 -9.922 1.00 0.00 H new ATOM 0 HA GLU A 64 -7.020 -8.738 -9.727 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -4.771 -9.688 -11.516 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -6.322 -10.486 -11.340 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.453 -8.400 -12.140 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -5.882 -7.662 -12.376 1.00 0.00 H new ATOM 1013 N GLY A 65 -6.382 -10.545 -8.117 1.00 0.00 N ATOM 1014 CA GLY A 65 -5.981 -11.428 -7.049 1.00 0.00 C ATOM 1015 C GLY A 65 -7.096 -11.682 -6.060 1.00 0.00 C ATOM 1016 O GLY A 65 -8.225 -11.957 -6.451 1.00 0.00 O ATOM 0 H GLY A 65 -7.389 -10.450 -8.247 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.651 -12.377 -7.471 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.127 -10.997 -6.526 1.00 0.00 H new ATOM 1020 N CYS A 66 -6.784 -11.562 -4.774 1.00 0.00 N ATOM 1021 CA CYS A 66 -7.739 -11.900 -3.736 1.00 0.00 C ATOM 1022 C CYS A 66 -8.396 -10.639 -3.206 1.00 0.00 C ATOM 1023 O CYS A 66 -7.810 -9.552 -3.271 1.00 0.00 O ATOM 1024 CB CYS A 66 -7.057 -12.687 -2.609 1.00 0.00 C ATOM 1025 SG CYS A 66 -5.460 -12.011 -2.088 1.00 0.00 S ATOM 0 H CYS A 66 -5.881 -11.235 -4.431 1.00 0.00 H new ATOM 0 HA CYS A 66 -8.514 -12.538 -4.162 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -7.724 -12.717 -1.747 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -6.913 -13.717 -2.936 1.00 0.00 H new ATOM 0 HG CYS A 66 -4.562 -12.273 -2.991 1.00 0.00 H new ATOM 1031 N SER A 67 -9.589 -10.804 -2.654 1.00 0.00 N ATOM 1032 CA SER A 67 -10.465 -9.692 -2.309 1.00 0.00 C ATOM 1033 C SER A 67 -9.786 -8.684 -1.386 1.00 0.00 C ATOM 1034 O SER A 67 -9.989 -7.481 -1.518 1.00 0.00 O ATOM 1035 CB SER A 67 -11.733 -10.234 -1.646 1.00 0.00 C ATOM 1036 OG SER A 67 -12.225 -11.359 -2.354 1.00 0.00 O ATOM 0 H SER A 67 -9.980 -11.719 -2.431 1.00 0.00 H new ATOM 0 HA SER A 67 -10.715 -9.166 -3.231 1.00 0.00 H new ATOM 0 HB2 SER A 67 -11.520 -10.512 -0.614 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.495 -9.455 -1.615 1.00 0.00 H new ATOM 0 HG SER A 67 -13.035 -11.693 -1.915 1.00 0.00 H new ATOM 1042 N ILE A 68 -8.957 -9.174 -0.475 1.00 0.00 N ATOM 1043 CA ILE A 68 -8.373 -8.318 0.549 1.00 0.00 C ATOM 1044 C ILE A 68 -7.152 -7.549 0.039 1.00 0.00 C ATOM 1045 O ILE A 68 -6.959 -6.387 0.387 1.00 0.00 O ATOM 1046 CB ILE A 68 -8.022 -9.123 1.829 1.00 0.00 C ATOM 1047 CG1 ILE A 68 -7.260 -10.414 1.503 1.00 0.00 C ATOM 1048 CG2 ILE A 68 -9.290 -9.445 2.604 1.00 0.00 C ATOM 1049 CD1 ILE A 68 -5.768 -10.222 1.339 1.00 0.00 C ATOM 0 H ILE A 68 -8.675 -10.153 -0.423 1.00 0.00 H new ATOM 0 HA ILE A 68 -9.134 -7.581 0.807 1.00 0.00 H new ATOM 0 HB ILE A 68 -7.368 -8.502 2.441 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -7.438 -11.139 2.297 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -7.664 -10.841 0.585 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -9.035 -10.010 3.501 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -9.788 -8.518 2.889 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -9.958 -10.038 1.979 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.301 -11.180 1.110 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -5.579 -9.522 0.525 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -5.348 -9.825 2.264 1.00 0.00 H new ATOM 1061 N SER A 69 -6.358 -8.174 -0.825 1.00 0.00 N ATOM 1062 CA SER A 69 -5.109 -7.567 -1.267 1.00 0.00 C ATOM 1063 C SER A 69 -5.379 -6.428 -2.237 1.00 0.00 C ATOM 1064 O SER A 69 -4.732 -5.386 -2.185 1.00 0.00 O ATOM 1065 CB SER A 69 -4.199 -8.614 -1.912 1.00 0.00 C ATOM 1066 OG SER A 69 -4.878 -9.320 -2.940 1.00 0.00 O ATOM 0 H SER A 69 -6.555 -9.090 -1.229 1.00 0.00 H new ATOM 0 HA SER A 69 -4.601 -7.160 -0.393 1.00 0.00 H new ATOM 0 HB2 SER A 69 -3.315 -8.127 -2.324 1.00 0.00 H new ATOM 0 HB3 SER A 69 -3.852 -9.315 -1.153 1.00 0.00 H new ATOM 0 HG SER A 69 -4.790 -10.284 -2.788 1.00 0.00 H new ATOM 1072 N MET A 70 -6.353 -6.632 -3.110 1.00 0.00 N ATOM 1073 CA MET A 70 -6.707 -5.614 -4.088 1.00 0.00 C ATOM 1074 C MET A 70 -7.628 -4.572 -3.464 1.00 0.00 C ATOM 1075 O MET A 70 -7.942 -3.556 -4.076 1.00 0.00 O ATOM 1076 CB MET A 70 -7.360 -6.250 -5.319 1.00 0.00 C ATOM 1077 CG MET A 70 -8.651 -7.000 -5.032 1.00 0.00 C ATOM 1078 SD MET A 70 -9.328 -7.772 -6.512 1.00 0.00 S ATOM 1079 CE MET A 70 -10.753 -8.624 -5.838 1.00 0.00 C ATOM 0 H MET A 70 -6.909 -7.486 -3.162 1.00 0.00 H new ATOM 0 HA MET A 70 -5.794 -5.114 -4.410 1.00 0.00 H new ATOM 0 HB2 MET A 70 -7.564 -5.468 -6.051 1.00 0.00 H new ATOM 0 HB3 MET A 70 -6.649 -6.938 -5.777 1.00 0.00 H new ATOM 0 HG2 MET A 70 -8.466 -7.764 -4.277 1.00 0.00 H new ATOM 0 HG3 MET A 70 -9.385 -6.311 -4.615 1.00 0.00 H new ATOM 0 HE1 MET A 70 -11.474 -8.812 -6.633 1.00 0.00 H new ATOM 0 HE2 MET A 70 -10.438 -9.572 -5.403 1.00 0.00 H new ATOM 0 HE3 MET A 70 -11.215 -8.007 -5.068 1.00 0.00 H new ATOM 1089 N ALA A 71 -8.076 -4.843 -2.247 1.00 0.00 N ATOM 1090 CA ALA A 71 -8.858 -3.879 -1.490 1.00 0.00 C ATOM 1091 C ALA A 71 -7.942 -2.938 -0.717 1.00 0.00 C ATOM 1092 O ALA A 71 -7.980 -1.721 -0.913 1.00 0.00 O ATOM 1093 CB ALA A 71 -9.817 -4.587 -0.543 1.00 0.00 C ATOM 0 H ALA A 71 -7.910 -5.725 -1.762 1.00 0.00 H new ATOM 0 HA ALA A 71 -9.446 -3.289 -2.193 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -10.392 -3.847 0.013 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -10.496 -5.217 -1.117 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.250 -5.205 0.154 1.00 0.00 H new ATOM 1099 N SER A 72 -7.100 -3.516 0.134 1.00 0.00 N ATOM 1100 CA SER A 72 -6.254 -2.743 1.036 1.00 0.00 C ATOM 1101 C SER A 72 -5.250 -1.888 0.269 1.00 0.00 C ATOM 1102 O SER A 72 -5.193 -0.669 0.451 1.00 0.00 O ATOM 1103 CB SER A 72 -5.519 -3.687 1.989 1.00 0.00 C ATOM 1104 OG SER A 72 -6.438 -4.446 2.760 1.00 0.00 O ATOM 0 H SER A 72 -6.985 -4.526 0.218 1.00 0.00 H new ATOM 0 HA SER A 72 -6.894 -2.071 1.607 1.00 0.00 H new ATOM 0 HB2 SER A 72 -4.876 -4.357 1.419 1.00 0.00 H new ATOM 0 HB3 SER A 72 -4.872 -3.111 2.651 1.00 0.00 H new ATOM 0 HG SER A 72 -6.789 -5.183 2.218 1.00 0.00 H new ATOM 1110 N ALA A 73 -4.488 -2.527 -0.612 1.00 0.00 N ATOM 1111 CA ALA A 73 -3.430 -1.846 -1.346 1.00 0.00 C ATOM 1112 C ALA A 73 -3.980 -0.680 -2.155 1.00 0.00 C ATOM 1113 O ALA A 73 -3.443 0.426 -2.099 1.00 0.00 O ATOM 1114 CB ALA A 73 -2.693 -2.820 -2.250 1.00 0.00 C ATOM 0 H ALA A 73 -4.584 -3.518 -0.835 1.00 0.00 H new ATOM 0 HA ALA A 73 -2.725 -1.445 -0.618 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -1.907 -2.292 -2.790 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.250 -3.612 -1.647 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.393 -3.255 -2.963 1.00 0.00 H new ATOM 1120 N SER A 74 -5.060 -0.919 -2.891 1.00 0.00 N ATOM 1121 CA SER A 74 -5.669 0.118 -3.703 1.00 0.00 C ATOM 1122 C SER A 74 -6.190 1.257 -2.826 1.00 0.00 C ATOM 1123 O SER A 74 -6.128 2.428 -3.208 1.00 0.00 O ATOM 1124 CB SER A 74 -6.795 -0.489 -4.536 1.00 0.00 C ATOM 1125 OG SER A 74 -6.315 -1.593 -5.287 1.00 0.00 O ATOM 0 H SER A 74 -5.529 -1.824 -2.939 1.00 0.00 H new ATOM 0 HA SER A 74 -4.918 0.537 -4.373 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.606 -0.811 -3.883 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.206 0.265 -5.208 1.00 0.00 H new ATOM 0 HG SER A 74 -7.008 -1.889 -5.913 1.00 0.00 H new ATOM 1131 N MET A 75 -6.667 0.916 -1.633 1.00 0.00 N ATOM 1132 CA MET A 75 -7.184 1.912 -0.705 1.00 0.00 C ATOM 1133 C MET A 75 -6.045 2.778 -0.179 1.00 0.00 C ATOM 1134 O MET A 75 -6.132 4.005 -0.181 1.00 0.00 O ATOM 1135 CB MET A 75 -7.917 1.242 0.463 1.00 0.00 C ATOM 1136 CG MET A 75 -8.552 2.226 1.434 1.00 0.00 C ATOM 1137 SD MET A 75 -9.324 1.410 2.847 1.00 0.00 S ATOM 1138 CE MET A 75 -7.894 0.641 3.607 1.00 0.00 C ATOM 0 H MET A 75 -6.706 -0.043 -1.287 1.00 0.00 H new ATOM 0 HA MET A 75 -7.895 2.542 -1.240 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.692 0.587 0.066 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.214 0.611 1.007 1.00 0.00 H new ATOM 0 HG2 MET A 75 -7.791 2.920 1.791 1.00 0.00 H new ATOM 0 HG3 MET A 75 -9.301 2.818 0.908 1.00 0.00 H new ATOM 0 HE1 MET A 75 -8.049 0.568 4.683 1.00 0.00 H new ATOM 0 HE2 MET A 75 -7.754 -0.357 3.192 1.00 0.00 H new ATOM 0 HE3 MET A 75 -7.008 1.244 3.408 1.00 0.00 H new ATOM 1148 N MET A 76 -4.964 2.131 0.244 1.00 0.00 N ATOM 1149 CA MET A 76 -3.804 2.851 0.759 1.00 0.00 C ATOM 1150 C MET A 76 -3.123 3.652 -0.349 1.00 0.00 C ATOM 1151 O MET A 76 -2.531 4.701 -0.098 1.00 0.00 O ATOM 1152 CB MET A 76 -2.813 1.882 1.400 1.00 0.00 C ATOM 1153 CG MET A 76 -2.588 2.139 2.882 1.00 0.00 C ATOM 1154 SD MET A 76 -1.919 3.782 3.214 1.00 0.00 S ATOM 1155 CE MET A 76 -1.855 3.762 5.004 1.00 0.00 C ATOM 0 H MET A 76 -4.866 1.116 0.241 1.00 0.00 H new ATOM 0 HA MET A 76 -4.151 3.549 1.521 1.00 0.00 H new ATOM 0 HB2 MET A 76 -3.175 0.863 1.267 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.859 1.952 0.878 1.00 0.00 H new ATOM 0 HG2 MET A 76 -3.532 2.022 3.414 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.905 1.387 3.277 1.00 0.00 H new ATOM 0 HE1 MET A 76 -1.461 4.712 5.365 1.00 0.00 H new ATOM 0 HE2 MET A 76 -2.858 3.610 5.402 1.00 0.00 H new ATOM 0 HE3 MET A 76 -1.206 2.951 5.336 1.00 0.00 H new ATOM 1165 N THR A 77 -3.222 3.165 -1.579 1.00 0.00 N ATOM 1166 CA THR A 77 -2.685 3.881 -2.732 1.00 0.00 C ATOM 1167 C THR A 77 -3.452 5.188 -2.962 1.00 0.00 C ATOM 1168 O THR A 77 -2.917 6.152 -3.507 1.00 0.00 O ATOM 1169 CB THR A 77 -2.746 3.009 -4.004 1.00 0.00 C ATOM 1170 OG1 THR A 77 -2.016 1.797 -3.798 1.00 0.00 O ATOM 1171 CG2 THR A 77 -2.165 3.738 -5.202 1.00 0.00 C ATOM 0 H THR A 77 -3.669 2.277 -1.805 1.00 0.00 H new ATOM 0 HA THR A 77 -1.642 4.114 -2.520 1.00 0.00 H new ATOM 0 HB THR A 77 -3.794 2.787 -4.205 1.00 0.00 H new ATOM 0 HG1 THR A 77 -2.595 1.136 -3.363 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.223 3.097 -6.081 1.00 0.00 H new ATOM 0 HG22 THR A 77 -2.731 4.652 -5.381 1.00 0.00 H new ATOM 0 HG23 THR A 77 -1.123 3.990 -5.005 1.00 0.00 H new ATOM 1179 N GLN A 78 -4.698 5.223 -2.507 1.00 0.00 N ATOM 1180 CA GLN A 78 -5.522 6.422 -2.621 1.00 0.00 C ATOM 1181 C GLN A 78 -5.037 7.453 -1.624 1.00 0.00 C ATOM 1182 O GLN A 78 -5.065 8.655 -1.883 1.00 0.00 O ATOM 1183 CB GLN A 78 -6.996 6.109 -2.368 1.00 0.00 C ATOM 1184 CG GLN A 78 -7.600 5.161 -3.385 1.00 0.00 C ATOM 1185 CD GLN A 78 -9.056 4.853 -3.097 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -9.784 5.682 -2.552 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -9.490 3.657 -3.458 1.00 0.00 N ATOM 0 H GLN A 78 -5.161 4.435 -2.055 1.00 0.00 H new ATOM 0 HA GLN A 78 -5.432 6.810 -3.635 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -7.101 5.676 -1.373 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -7.562 7.040 -2.371 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -7.514 5.598 -4.380 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -7.030 4.232 -3.394 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -8.854 2.998 -3.908 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -10.460 3.394 -3.287 1.00 0.00 H new ATOM 1196 N ALA A 79 -4.585 6.964 -0.482 1.00 0.00 N ATOM 1197 CA ALA A 79 -3.967 7.813 0.514 1.00 0.00 C ATOM 1198 C ALA A 79 -2.624 8.312 0.000 1.00 0.00 C ATOM 1199 O ALA A 79 -2.227 9.443 0.272 1.00 0.00 O ATOM 1200 CB ALA A 79 -3.794 7.065 1.825 1.00 0.00 C ATOM 0 H ALA A 79 -4.636 5.979 -0.224 1.00 0.00 H new ATOM 0 HA ALA A 79 -4.616 8.669 0.700 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.328 7.721 2.560 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -4.769 6.744 2.192 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -3.161 6.192 1.665 1.00 0.00 H new ATOM 1206 N ILE A 80 -1.947 7.467 -0.776 1.00 0.00 N ATOM 1207 CA ILE A 80 -0.646 7.822 -1.347 1.00 0.00 C ATOM 1208 C ILE A 80 -0.811 8.852 -2.463 1.00 0.00 C ATOM 1209 O ILE A 80 0.047 9.710 -2.668 1.00 0.00 O ATOM 1210 CB ILE A 80 0.110 6.563 -1.858 1.00 0.00 C ATOM 1211 CG1 ILE A 80 1.004 6.008 -0.749 1.00 0.00 C ATOM 1212 CG2 ILE A 80 0.933 6.854 -3.110 1.00 0.00 C ATOM 1213 CD1 ILE A 80 2.047 6.995 -0.267 1.00 0.00 C ATOM 0 H ILE A 80 -2.276 6.534 -1.024 1.00 0.00 H new ATOM 0 HA ILE A 80 -0.043 8.268 -0.556 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.636 5.817 -2.132 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.381 5.708 0.094 1.00 0.00 H new ATOM 0 HG13 ILE A 80 1.504 5.110 -1.111 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.443 5.945 -3.430 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.274 7.200 -3.906 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.671 7.625 -2.889 1.00 0.00 H new ATOM 0 HD11 ILE A 80 2.646 6.536 0.519 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.693 7.276 -1.098 1.00 0.00 H new ATOM 0 HD13 ILE A 80 1.553 7.884 0.125 1.00 0.00 H new ATOM 1225 N LYS A 81 -1.949 8.784 -3.139 1.00 0.00 N ATOM 1226 CA LYS A 81 -2.278 9.694 -4.232 1.00 0.00 C ATOM 1227 C LYS A 81 -2.304 11.154 -3.760 1.00 0.00 C ATOM 1228 O LYS A 81 -2.280 12.082 -4.570 1.00 0.00 O ATOM 1229 CB LYS A 81 -3.631 9.301 -4.829 1.00 0.00 C ATOM 1230 CG LYS A 81 -3.911 9.919 -6.186 1.00 0.00 C ATOM 1231 CD LYS A 81 -5.223 9.420 -6.763 1.00 0.00 C ATOM 1232 CE LYS A 81 -5.409 9.874 -8.203 1.00 0.00 C ATOM 1233 NZ LYS A 81 -5.503 11.354 -8.324 1.00 0.00 N ATOM 0 H LYS A 81 -2.675 8.094 -2.946 1.00 0.00 H new ATOM 0 HA LYS A 81 -1.504 9.612 -4.995 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -3.675 8.216 -4.920 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -4.421 9.595 -4.138 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -3.942 11.005 -6.093 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -3.097 9.681 -6.871 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -5.251 8.331 -6.717 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.051 9.786 -6.156 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -4.574 9.515 -8.805 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.313 9.421 -8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -5.680 11.611 -9.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.284 11.702 -7.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -4.611 11.785 -8.009 1.00 0.00 H new ATOM 1247 N GLY A 82 -2.390 11.350 -2.449 1.00 0.00 N ATOM 1248 CA GLY A 82 -2.414 12.690 -1.896 1.00 0.00 C ATOM 1249 C GLY A 82 -1.263 12.948 -0.940 1.00 0.00 C ATOM 1250 O GLY A 82 -1.403 13.710 0.019 1.00 0.00 O ATOM 0 H GLY A 82 -2.444 10.602 -1.758 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -2.376 13.415 -2.709 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -3.358 12.846 -1.373 1.00 0.00 H new ATOM 1254 N LYS A 83 -0.127 12.304 -1.185 1.00 0.00 N ATOM 1255 CA LYS A 83 1.051 12.494 -0.345 1.00 0.00 C ATOM 1256 C LYS A 83 2.299 12.713 -1.197 1.00 0.00 C ATOM 1257 O LYS A 83 2.215 12.803 -2.424 1.00 0.00 O ATOM 1258 CB LYS A 83 1.240 11.303 0.603 1.00 0.00 C ATOM 1259 CG LYS A 83 0.062 11.099 1.546 1.00 0.00 C ATOM 1260 CD LYS A 83 0.335 10.026 2.589 1.00 0.00 C ATOM 1261 CE LYS A 83 -0.896 9.759 3.445 1.00 0.00 C ATOM 1262 NZ LYS A 83 -1.402 10.995 4.105 1.00 0.00 N ATOM 0 H LYS A 83 0.003 11.648 -1.955 1.00 0.00 H new ATOM 0 HA LYS A 83 0.895 13.388 0.259 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.388 10.398 0.015 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.146 11.453 1.190 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.166 12.040 2.047 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -0.820 10.824 0.968 1.00 0.00 H new ATOM 0 HD2 LYS A 83 0.643 9.105 2.094 1.00 0.00 H new ATOM 0 HD3 LYS A 83 1.163 10.338 3.226 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.683 9.333 2.823 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.654 9.017 4.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -2.141 10.744 4.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -0.619 11.471 4.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.800 11.634 3.387 1.00 0.00 H new ATOM 1276 N ASP A 84 3.455 12.794 -0.548 1.00 0.00 N ATOM 1277 CA ASP A 84 4.690 13.092 -1.215 1.00 0.00 C ATOM 1278 C ASP A 84 5.627 11.921 -1.026 1.00 0.00 C ATOM 1279 O ASP A 84 5.273 10.903 -0.429 1.00 0.00 O ATOM 1280 CB ASP A 84 5.356 14.354 -0.631 1.00 0.00 C ATOM 1281 CG ASP A 84 4.372 15.412 -0.165 1.00 0.00 C ATOM 1282 OD1 ASP A 84 3.763 15.229 0.910 1.00 0.00 O ATOM 1283 OD2 ASP A 84 4.228 16.448 -0.847 1.00 0.00 O ATOM 0 H ASP A 84 3.549 12.652 0.458 1.00 0.00 H new ATOM 0 HA ASP A 84 4.482 13.270 -2.270 1.00 0.00 H new ATOM 0 HB2 ASP A 84 5.987 14.064 0.209 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.011 14.789 -1.386 1.00 0.00 H new ATOM 1288 N ILE A 85 6.820 12.097 -1.514 1.00 0.00 N ATOM 1289 CA ILE A 85 7.877 11.102 -1.369 1.00 0.00 C ATOM 1290 C ILE A 85 8.603 11.302 -0.041 1.00 0.00 C ATOM 1291 O ILE A 85 8.807 10.355 0.715 1.00 0.00 O ATOM 1292 CB ILE A 85 8.880 11.145 -2.559 1.00 0.00 C ATOM 1293 CG1 ILE A 85 8.371 10.290 -3.726 1.00 0.00 C ATOM 1294 CG2 ILE A 85 10.270 10.675 -2.140 1.00 0.00 C ATOM 1295 CD1 ILE A 85 7.003 10.683 -4.239 1.00 0.00 C ATOM 0 H ILE A 85 7.102 12.932 -2.027 1.00 0.00 H new ATOM 0 HA ILE A 85 7.413 10.116 -1.376 1.00 0.00 H new ATOM 0 HB ILE A 85 8.956 12.183 -2.882 1.00 0.00 H new ATOM 0 HG12 ILE A 85 9.086 10.355 -4.547 1.00 0.00 H new ATOM 0 HG13 ILE A 85 8.341 9.247 -3.410 1.00 0.00 H new ATOM 0 HG21 ILE A 85 10.943 10.719 -2.997 1.00 0.00 H new ATOM 0 HG22 ILE A 85 10.649 11.321 -1.348 1.00 0.00 H new ATOM 0 HG23 ILE A 85 10.213 9.649 -1.776 1.00 0.00 H new ATOM 0 HD11 ILE A 85 6.721 10.027 -5.063 1.00 0.00 H new ATOM 0 HD12 ILE A 85 6.273 10.590 -3.435 1.00 0.00 H new ATOM 0 HD13 ILE A 85 7.028 11.715 -4.589 1.00 0.00 H new ATOM 1307 N GLU A 86 8.954 12.551 0.252 1.00 0.00 N ATOM 1308 CA GLU A 86 9.646 12.885 1.493 1.00 0.00 C ATOM 1309 C GLU A 86 8.808 12.476 2.699 1.00 0.00 C ATOM 1310 O GLU A 86 9.327 11.953 3.687 1.00 0.00 O ATOM 1311 CB GLU A 86 9.944 14.384 1.547 1.00 0.00 C ATOM 1312 CG GLU A 86 10.826 14.875 0.409 1.00 0.00 C ATOM 1313 CD GLU A 86 12.178 14.191 0.376 1.00 0.00 C ATOM 1314 OE1 GLU A 86 12.877 14.196 1.410 1.00 0.00 O ATOM 1315 OE2 GLU A 86 12.555 13.663 -0.692 1.00 0.00 O ATOM 0 H GLU A 86 8.770 13.350 -0.355 1.00 0.00 H new ATOM 0 HA GLU A 86 10.587 12.336 1.520 1.00 0.00 H new ATOM 0 HB2 GLU A 86 9.003 14.933 1.528 1.00 0.00 H new ATOM 0 HB3 GLU A 86 10.429 14.615 2.496 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.315 14.706 -0.539 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.971 15.951 0.506 1.00 0.00 H new ATOM 1322 N THR A 87 7.506 12.699 2.602 1.00 0.00 N ATOM 1323 CA THR A 87 6.592 12.336 3.667 1.00 0.00 C ATOM 1324 C THR A 87 6.390 10.823 3.723 1.00 0.00 C ATOM 1325 O THR A 87 6.231 10.253 4.799 1.00 0.00 O ATOM 1326 CB THR A 87 5.236 13.047 3.504 1.00 0.00 C ATOM 1327 OG1 THR A 87 4.811 12.986 2.136 1.00 0.00 O ATOM 1328 CG2 THR A 87 5.331 14.500 3.945 1.00 0.00 C ATOM 0 H THR A 87 7.060 13.131 1.793 1.00 0.00 H new ATOM 0 HA THR A 87 7.039 12.661 4.606 1.00 0.00 H new ATOM 0 HB THR A 87 4.506 12.538 4.134 1.00 0.00 H new ATOM 0 HG1 THR A 87 4.466 13.861 1.861 1.00 0.00 H new ATOM 0 HG21 THR A 87 4.361 14.982 3.821 1.00 0.00 H new ATOM 0 HG22 THR A 87 5.626 14.543 4.993 1.00 0.00 H new ATOM 0 HG23 THR A 87 6.074 15.017 3.337 1.00 0.00 H new ATOM 1336 N ALA A 88 6.425 10.167 2.566 1.00 0.00 N ATOM 1337 CA ALA A 88 6.312 8.712 2.513 1.00 0.00 C ATOM 1338 C ALA A 88 7.476 8.061 3.251 1.00 0.00 C ATOM 1339 O ALA A 88 7.285 7.143 4.055 1.00 0.00 O ATOM 1340 CB ALA A 88 6.262 8.230 1.073 1.00 0.00 C ATOM 0 H ALA A 88 6.530 10.617 1.657 1.00 0.00 H new ATOM 0 HA ALA A 88 5.383 8.422 3.004 1.00 0.00 H new ATOM 0 HB1 ALA A 88 6.178 7.143 1.056 1.00 0.00 H new ATOM 0 HB2 ALA A 88 5.399 8.669 0.572 1.00 0.00 H new ATOM 0 HB3 ALA A 88 7.173 8.532 0.557 1.00 0.00 H new ATOM 1346 N LEU A 89 8.680 8.553 2.988 1.00 0.00 N ATOM 1347 CA LEU A 89 9.882 8.060 3.658 1.00 0.00 C ATOM 1348 C LEU A 89 9.836 8.363 5.157 1.00 0.00 C ATOM 1349 O LEU A 89 10.492 7.700 5.959 1.00 0.00 O ATOM 1350 CB LEU A 89 11.144 8.669 3.030 1.00 0.00 C ATOM 1351 CG LEU A 89 11.685 7.961 1.774 1.00 0.00 C ATOM 1352 CD1 LEU A 89 12.163 6.560 2.113 1.00 0.00 C ATOM 1353 CD2 LEU A 89 10.638 7.902 0.670 1.00 0.00 C ATOM 0 H LEU A 89 8.853 9.297 2.312 1.00 0.00 H new ATOM 0 HA LEU A 89 9.917 6.978 3.528 1.00 0.00 H new ATOM 0 HB2 LEU A 89 10.933 9.707 2.774 1.00 0.00 H new ATOM 0 HB3 LEU A 89 11.931 8.680 3.784 1.00 0.00 H new ATOM 0 HG LEU A 89 12.529 8.546 1.408 1.00 0.00 H new ATOM 0 HD11 LEU A 89 12.541 6.077 1.212 1.00 0.00 H new ATOM 0 HD12 LEU A 89 12.959 6.617 2.856 1.00 0.00 H new ATOM 0 HD13 LEU A 89 11.332 5.979 2.515 1.00 0.00 H new ATOM 0 HD21 LEU A 89 11.055 7.396 -0.200 1.00 0.00 H new ATOM 0 HD22 LEU A 89 9.765 7.354 1.025 1.00 0.00 H new ATOM 0 HD23 LEU A 89 10.343 8.914 0.394 1.00 0.00 H new ATOM 1365 N SER A 90 9.043 9.356 5.529 1.00 0.00 N ATOM 1366 CA SER A 90 8.863 9.711 6.928 1.00 0.00 C ATOM 1367 C SER A 90 7.777 8.841 7.567 1.00 0.00 C ATOM 1368 O SER A 90 7.828 8.548 8.757 1.00 0.00 O ATOM 1369 CB SER A 90 8.506 11.193 7.046 1.00 0.00 C ATOM 1370 OG SER A 90 9.507 12.003 6.446 1.00 0.00 O ATOM 0 H SER A 90 8.511 9.933 4.877 1.00 0.00 H new ATOM 0 HA SER A 90 9.797 9.532 7.461 1.00 0.00 H new ATOM 0 HB2 SER A 90 7.545 11.379 6.566 1.00 0.00 H new ATOM 0 HB3 SER A 90 8.395 11.462 8.096 1.00 0.00 H new ATOM 0 HG SER A 90 9.480 11.889 5.473 1.00 0.00 H new ATOM 1376 N MET A 91 6.809 8.417 6.761 1.00 0.00 N ATOM 1377 CA MET A 91 5.746 7.526 7.227 1.00 0.00 C ATOM 1378 C MET A 91 6.303 6.140 7.531 1.00 0.00 C ATOM 1379 O MET A 91 5.758 5.401 8.344 1.00 0.00 O ATOM 1380 CB MET A 91 4.631 7.418 6.182 1.00 0.00 C ATOM 1381 CG MET A 91 3.821 8.693 6.003 1.00 0.00 C ATOM 1382 SD MET A 91 2.950 9.190 7.502 1.00 0.00 S ATOM 1383 CE MET A 91 1.917 7.753 7.791 1.00 0.00 C ATOM 0 H MET A 91 6.737 8.676 5.777 1.00 0.00 H new ATOM 0 HA MET A 91 5.330 7.949 8.141 1.00 0.00 H new ATOM 0 HB2 MET A 91 5.071 7.143 5.224 1.00 0.00 H new ATOM 0 HB3 MET A 91 3.958 6.610 6.467 1.00 0.00 H new ATOM 0 HG2 MET A 91 4.486 9.499 5.692 1.00 0.00 H new ATOM 0 HG3 MET A 91 3.098 8.548 5.200 1.00 0.00 H new ATOM 0 HE1 MET A 91 1.096 8.023 8.456 1.00 0.00 H new ATOM 0 HE2 MET A 91 1.514 7.398 6.843 1.00 0.00 H new ATOM 0 HE3 MET A 91 2.512 6.964 8.251 1.00 0.00 H new ATOM 1393 N SER A 92 7.393 5.792 6.869 1.00 0.00 N ATOM 1394 CA SER A 92 8.064 4.534 7.107 1.00 0.00 C ATOM 1395 C SER A 92 9.024 4.686 8.268 1.00 0.00 C ATOM 1396 O SER A 92 9.262 3.743 9.017 1.00 0.00 O ATOM 1397 CB SER A 92 8.787 4.080 5.851 1.00 0.00 C ATOM 1398 OG SER A 92 9.329 5.189 5.155 1.00 0.00 O ATOM 0 H SER A 92 7.833 6.373 6.155 1.00 0.00 H new ATOM 0 HA SER A 92 7.330 3.770 7.363 1.00 0.00 H new ATOM 0 HB2 SER A 92 9.584 3.386 6.116 1.00 0.00 H new ATOM 0 HB3 SER A 92 8.096 3.540 5.203 1.00 0.00 H new ATOM 0 HG SER A 92 9.743 5.806 5.794 1.00 0.00 H new ATOM 1404 N LYS A 93 9.569 5.890 8.416 1.00 0.00 N ATOM 1405 CA LYS A 93 10.283 6.235 9.634 1.00 0.00 C ATOM 1406 C LYS A 93 9.332 6.069 10.812 1.00 0.00 C ATOM 1407 O LYS A 93 9.669 5.436 11.812 1.00 0.00 O ATOM 1408 CB LYS A 93 10.813 7.669 9.592 1.00 0.00 C ATOM 1409 CG LYS A 93 11.508 8.080 10.879 1.00 0.00 C ATOM 1410 CD LYS A 93 11.824 9.564 10.908 1.00 0.00 C ATOM 1411 CE LYS A 93 12.395 9.979 12.257 1.00 0.00 C ATOM 1412 NZ LYS A 93 11.471 9.655 13.381 1.00 0.00 N ATOM 0 H LYS A 93 9.530 6.632 7.717 1.00 0.00 H new ATOM 0 HA LYS A 93 11.143 5.574 9.737 1.00 0.00 H new ATOM 0 HB2 LYS A 93 11.510 7.769 8.760 1.00 0.00 H new ATOM 0 HB3 LYS A 93 9.985 8.351 9.398 1.00 0.00 H new ATOM 0 HG2 LYS A 93 10.874 7.828 11.729 1.00 0.00 H new ATOM 0 HG3 LYS A 93 12.431 7.511 10.990 1.00 0.00 H new ATOM 0 HD2 LYS A 93 12.538 9.802 10.119 1.00 0.00 H new ATOM 0 HD3 LYS A 93 10.919 10.135 10.702 1.00 0.00 H new ATOM 0 HE2 LYS A 93 13.349 9.477 12.416 1.00 0.00 H new ATOM 0 HE3 LYS A 93 12.596 11.050 12.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 11.650 10.303 14.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 10.487 9.761 13.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 11.631 8.675 13.691 1.00 0.00 H new ATOM 1426 N ILE A 94 8.126 6.614 10.659 1.00 0.00 N ATOM 1427 CA ILE A 94 7.073 6.435 11.651 1.00 0.00 C ATOM 1428 C ILE A 94 6.797 4.953 11.844 1.00 0.00 C ATOM 1429 O ILE A 94 6.659 4.483 12.968 1.00 0.00 O ATOM 1430 CB ILE A 94 5.756 7.144 11.250 1.00 0.00 C ATOM 1431 CG1 ILE A 94 5.916 8.665 11.295 1.00 0.00 C ATOM 1432 CG2 ILE A 94 4.609 6.707 12.155 1.00 0.00 C ATOM 1433 CD1 ILE A 94 4.633 9.420 11.004 1.00 0.00 C ATOM 0 H ILE A 94 7.856 7.183 9.857 1.00 0.00 H new ATOM 0 HA ILE A 94 7.427 6.885 12.579 1.00 0.00 H new ATOM 0 HB ILE A 94 5.520 6.854 10.226 1.00 0.00 H new ATOM 0 HG12 ILE A 94 6.282 8.954 12.280 1.00 0.00 H new ATOM 0 HG13 ILE A 94 6.675 8.964 10.572 1.00 0.00 H new ATOM 0 HG21 ILE A 94 3.694 7.218 11.855 1.00 0.00 H new ATOM 0 HG22 ILE A 94 4.468 5.630 12.069 1.00 0.00 H new ATOM 0 HG23 ILE A 94 4.844 6.961 13.189 1.00 0.00 H new ATOM 0 HD11 ILE A 94 4.823 10.492 11.053 1.00 0.00 H new ATOM 0 HD12 ILE A 94 4.276 9.160 10.007 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.877 9.151 11.742 1.00 0.00 H new ATOM 1445 N PHE A 95 6.751 4.221 10.735 1.00 0.00 N ATOM 1446 CA PHE A 95 6.514 2.782 10.775 1.00 0.00 C ATOM 1447 C PHE A 95 7.544 2.085 11.669 1.00 0.00 C ATOM 1448 O PHE A 95 7.187 1.285 12.534 1.00 0.00 O ATOM 1449 CB PHE A 95 6.556 2.204 9.358 1.00 0.00 C ATOM 1450 CG PHE A 95 6.240 0.735 9.290 1.00 0.00 C ATOM 1451 CD1 PHE A 95 4.939 0.286 9.449 1.00 0.00 C ATOM 1452 CD2 PHE A 95 7.243 -0.192 9.061 1.00 0.00 C ATOM 1453 CE1 PHE A 95 4.645 -1.061 9.385 1.00 0.00 C ATOM 1454 CE2 PHE A 95 6.955 -1.542 8.994 1.00 0.00 C ATOM 1455 CZ PHE A 95 5.654 -1.976 9.157 1.00 0.00 C ATOM 0 H PHE A 95 6.875 4.601 9.797 1.00 0.00 H new ATOM 0 HA PHE A 95 5.525 2.606 11.198 1.00 0.00 H new ATOM 0 HB2 PHE A 95 5.847 2.748 8.733 1.00 0.00 H new ATOM 0 HB3 PHE A 95 7.547 2.372 8.937 1.00 0.00 H new ATOM 0 HD1 PHE A 95 4.146 0.998 9.625 1.00 0.00 H new ATOM 0 HD2 PHE A 95 8.262 0.144 8.933 1.00 0.00 H new ATOM 0 HE1 PHE A 95 3.627 -1.399 9.513 1.00 0.00 H new ATOM 0 HE2 PHE A 95 7.745 -2.256 8.815 1.00 0.00 H new ATOM 0 HZ PHE A 95 5.426 -3.030 9.106 1.00 0.00 H new ATOM 1465 N SER A 96 8.821 2.407 11.471 1.00 0.00 N ATOM 1466 CA SER A 96 9.889 1.812 12.262 1.00 0.00 C ATOM 1467 C SER A 96 9.868 2.312 13.711 1.00 0.00 C ATOM 1468 O SER A 96 10.135 1.549 14.636 1.00 0.00 O ATOM 1469 CB SER A 96 11.252 2.073 11.603 1.00 0.00 C ATOM 1470 OG SER A 96 11.357 3.403 11.118 1.00 0.00 O ATOM 0 H SER A 96 9.138 3.076 10.770 1.00 0.00 H new ATOM 0 HA SER A 96 9.722 0.735 12.294 1.00 0.00 H new ATOM 0 HB2 SER A 96 12.047 1.886 12.325 1.00 0.00 H new ATOM 0 HB3 SER A 96 11.398 1.373 10.780 1.00 0.00 H new ATOM 0 HG SER A 96 10.726 3.978 11.599 1.00 0.00 H new ATOM 1476 N ASP A 97 9.519 3.582 13.911 1.00 0.00 N ATOM 1477 CA ASP A 97 9.459 4.153 15.260 1.00 0.00 C ATOM 1478 C ASP A 97 8.250 3.623 16.023 1.00 0.00 C ATOM 1479 O ASP A 97 8.259 3.551 17.247 1.00 0.00 O ATOM 1480 CB ASP A 97 9.403 5.684 15.212 1.00 0.00 C ATOM 1481 CG ASP A 97 10.745 6.325 14.908 1.00 0.00 C ATOM 1482 OD1 ASP A 97 11.724 6.033 15.628 1.00 0.00 O ATOM 1483 OD2 ASP A 97 10.819 7.147 13.973 1.00 0.00 O ATOM 0 H ASP A 97 9.275 4.232 13.164 1.00 0.00 H new ATOM 0 HA ASP A 97 10.368 3.851 15.780 1.00 0.00 H new ATOM 0 HB2 ASP A 97 8.682 5.991 14.454 1.00 0.00 H new ATOM 0 HB3 ASP A 97 9.038 6.057 16.169 1.00 0.00 H new ATOM 1670 N LEU A 110 -3.545 4.478 10.378 1.00 0.00 N ATOM 1671 CA LEU A 110 -2.704 3.289 10.262 1.00 0.00 C ATOM 1672 C LEU A 110 -3.549 2.020 10.273 1.00 0.00 C ATOM 1673 O LEU A 110 -3.031 0.921 10.466 1.00 0.00 O ATOM 1674 CB LEU A 110 -1.694 3.231 11.412 1.00 0.00 C ATOM 1675 CG LEU A 110 -0.700 4.392 11.480 1.00 0.00 C ATOM 1676 CD1 LEU A 110 0.213 4.232 12.683 1.00 0.00 C ATOM 1677 CD2 LEU A 110 0.115 4.479 10.198 1.00 0.00 C ATOM 0 HA LEU A 110 -2.171 3.353 9.313 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -2.244 3.192 12.352 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -1.133 2.300 11.332 1.00 0.00 H new ATOM 0 HG LEU A 110 -1.260 5.321 11.589 1.00 0.00 H new ATOM 0 HD11 LEU A 110 0.916 5.065 12.720 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -0.385 4.221 13.594 1.00 0.00 H new ATOM 0 HD13 LEU A 110 0.764 3.295 12.599 1.00 0.00 H new ATOM 0 HD21 LEU A 110 0.815 5.311 10.268 1.00 0.00 H new ATOM 0 HD22 LEU A 110 0.668 3.551 10.055 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -0.554 4.638 9.352 1.00 0.00 H new ATOM 1689 N GLY A 111 -4.847 2.176 10.038 1.00 0.00 N ATOM 1690 CA GLY A 111 -5.764 1.049 10.131 1.00 0.00 C ATOM 1691 C GLY A 111 -5.495 -0.037 9.103 1.00 0.00 C ATOM 1692 O GLY A 111 -5.820 -1.200 9.327 1.00 0.00 O ATOM 0 H GLY A 111 -5.283 3.062 9.784 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -5.697 0.618 11.130 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -6.785 1.410 10.008 1.00 0.00 H new ATOM 1696 N ASP A 112 -4.877 0.339 7.993 1.00 0.00 N ATOM 1697 CA ASP A 112 -4.646 -0.592 6.889 1.00 0.00 C ATOM 1698 C ASP A 112 -3.454 -1.501 7.170 1.00 0.00 C ATOM 1699 O ASP A 112 -3.416 -2.644 6.722 1.00 0.00 O ATOM 1700 CB ASP A 112 -4.422 0.180 5.588 1.00 0.00 C ATOM 1701 CG ASP A 112 -4.219 -0.736 4.397 1.00 0.00 C ATOM 1702 OD1 ASP A 112 -5.224 -1.260 3.877 1.00 0.00 O ATOM 1703 OD2 ASP A 112 -3.057 -0.927 3.983 1.00 0.00 O ATOM 0 H ASP A 112 -4.525 1.282 7.829 1.00 0.00 H new ATOM 0 HA ASP A 112 -5.532 -1.219 6.787 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.278 0.828 5.402 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -3.551 0.826 5.698 1.00 0.00 H new ATOM 1708 N ILE A 113 -2.498 -1.005 7.948 1.00 0.00 N ATOM 1709 CA ILE A 113 -1.268 -1.746 8.207 1.00 0.00 C ATOM 1710 C ILE A 113 -1.555 -3.055 8.945 1.00 0.00 C ATOM 1711 O ILE A 113 -0.913 -4.075 8.688 1.00 0.00 O ATOM 1712 CB ILE A 113 -0.252 -0.903 9.007 1.00 0.00 C ATOM 1713 CG1 ILE A 113 0.024 0.418 8.285 1.00 0.00 C ATOM 1714 CG2 ILE A 113 1.045 -1.677 9.204 1.00 0.00 C ATOM 1715 CD1 ILE A 113 1.048 1.287 8.979 1.00 0.00 C ATOM 0 H ILE A 113 -2.550 -0.097 8.409 1.00 0.00 H new ATOM 0 HA ILE A 113 -0.829 -1.980 7.237 1.00 0.00 H new ATOM 0 HB ILE A 113 -0.677 -0.685 9.987 1.00 0.00 H new ATOM 0 HG12 ILE A 113 0.368 0.204 7.273 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -0.909 0.974 8.194 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.750 -1.068 9.770 1.00 0.00 H new ATOM 0 HG22 ILE A 113 0.840 -2.597 9.751 1.00 0.00 H new ATOM 0 HG23 ILE A 113 1.475 -1.921 8.232 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.191 2.205 8.410 1.00 0.00 H new ATOM 0 HD12 ILE A 113 0.697 1.532 9.982 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.994 0.751 9.047 1.00 0.00 H new ATOM 1727 N GLU A 114 -2.543 -3.034 9.836 1.00 0.00 N ATOM 1728 CA GLU A 114 -2.946 -4.242 10.558 1.00 0.00 C ATOM 1729 C GLU A 114 -3.424 -5.305 9.569 1.00 0.00 C ATOM 1730 O GLU A 114 -3.187 -6.502 9.753 1.00 0.00 O ATOM 1731 CB GLU A 114 -4.057 -3.920 11.565 1.00 0.00 C ATOM 1732 CG GLU A 114 -4.570 -5.127 12.343 1.00 0.00 C ATOM 1733 CD GLU A 114 -3.578 -5.655 13.364 1.00 0.00 C ATOM 1734 OE1 GLU A 114 -3.419 -5.017 14.424 1.00 0.00 O ATOM 1735 OE2 GLU A 114 -2.972 -6.722 13.123 1.00 0.00 O ATOM 0 H GLU A 114 -3.078 -2.199 10.076 1.00 0.00 H new ATOM 0 HA GLU A 114 -2.085 -4.626 11.105 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -3.686 -3.178 12.272 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -4.892 -3.464 11.033 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -5.494 -4.855 12.853 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -4.816 -5.924 11.641 1.00 0.00 H new ATOM 1742 N ALA A 115 -4.064 -4.854 8.497 1.00 0.00 N ATOM 1743 CA ALA A 115 -4.563 -5.749 7.467 1.00 0.00 C ATOM 1744 C ALA A 115 -3.413 -6.357 6.672 1.00 0.00 C ATOM 1745 O ALA A 115 -3.561 -7.407 6.045 1.00 0.00 O ATOM 1746 CB ALA A 115 -5.517 -5.011 6.540 1.00 0.00 C ATOM 0 H ALA A 115 -4.249 -3.867 8.320 1.00 0.00 H new ATOM 0 HA ALA A 115 -5.106 -6.559 7.954 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -5.882 -5.695 5.774 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -6.360 -4.628 7.115 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -4.994 -4.181 6.065 1.00 0.00 H new ATOM 1752 N LEU A 116 -2.260 -5.701 6.723 1.00 0.00 N ATOM 1753 CA LEU A 116 -1.083 -6.170 6.002 1.00 0.00 C ATOM 1754 C LEU A 116 -0.276 -7.102 6.888 1.00 0.00 C ATOM 1755 O LEU A 116 0.317 -8.073 6.421 1.00 0.00 O ATOM 1756 CB LEU A 116 -0.218 -4.990 5.557 1.00 0.00 C ATOM 1757 CG LEU A 116 -0.923 -3.973 4.660 1.00 0.00 C ATOM 1758 CD1 LEU A 116 0.016 -2.832 4.309 1.00 0.00 C ATOM 1759 CD2 LEU A 116 -1.447 -4.641 3.399 1.00 0.00 C ATOM 0 H LEU A 116 -2.115 -4.843 7.256 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.410 -6.711 5.114 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.151 -4.475 6.444 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.653 -5.377 5.027 1.00 0.00 H new ATOM 0 HG LEU A 116 -1.772 -3.564 5.208 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.503 -2.117 3.670 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.340 -2.333 5.222 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.886 -3.225 3.782 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -1.945 -3.899 2.775 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.616 -5.080 2.848 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -2.156 -5.423 3.669 1.00 0.00 H new ATOM 1771 N GLN A 117 -0.283 -6.799 8.176 1.00 0.00 N ATOM 1772 CA GLN A 117 0.390 -7.618 9.175 1.00 0.00 C ATOM 1773 C GLN A 117 -0.197 -9.023 9.215 1.00 0.00 C ATOM 1774 O GLN A 117 0.508 -9.991 9.501 1.00 0.00 O ATOM 1775 CB GLN A 117 0.258 -6.960 10.542 1.00 0.00 C ATOM 1776 CG GLN A 117 1.085 -5.694 10.688 1.00 0.00 C ATOM 1777 CD GLN A 117 0.555 -4.776 11.770 1.00 0.00 C ATOM 1778 OE1 GLN A 117 0.765 -3.567 11.734 1.00 0.00 O ATOM 1779 NE2 GLN A 117 -0.179 -5.338 12.713 1.00 0.00 N ATOM 0 H GLN A 117 -0.754 -5.980 8.560 1.00 0.00 H new ATOM 0 HA GLN A 117 1.443 -7.699 8.907 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -0.790 -6.722 10.722 1.00 0.00 H new ATOM 0 HB3 GLN A 117 0.560 -7.672 11.310 1.00 0.00 H new ATOM 0 HG2 GLN A 117 2.116 -5.962 10.917 1.00 0.00 H new ATOM 0 HG3 GLN A 117 1.098 -5.161 9.738 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -0.330 -6.347 12.708 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -0.595 -4.763 13.446 1.00 0.00 H new ATOM 1788 N GLY A 118 -1.485 -9.123 8.915 1.00 0.00 N ATOM 1789 CA GLY A 118 -2.158 -10.408 8.926 1.00 0.00 C ATOM 1790 C GLY A 118 -1.616 -11.362 7.882 1.00 0.00 C ATOM 1791 O GLY A 118 -1.444 -12.548 8.148 1.00 0.00 O ATOM 0 H GLY A 118 -2.079 -8.333 8.663 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -2.054 -10.859 9.913 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -3.224 -10.257 8.755 1.00 0.00 H new ATOM 1795 N VAL A 119 -1.351 -10.849 6.688 1.00 0.00 N ATOM 1796 CA VAL A 119 -0.844 -11.676 5.600 1.00 0.00 C ATOM 1797 C VAL A 119 0.681 -11.801 5.657 1.00 0.00 C ATOM 1798 O VAL A 119 1.256 -12.744 5.125 1.00 0.00 O ATOM 1799 CB VAL A 119 -1.272 -11.119 4.219 1.00 0.00 C ATOM 1800 CG1 VAL A 119 -2.788 -11.103 4.091 1.00 0.00 C ATOM 1801 CG2 VAL A 119 -0.710 -9.726 3.986 1.00 0.00 C ATOM 0 H VAL A 119 -1.478 -9.866 6.448 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.280 -12.667 5.726 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.863 -11.781 3.456 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.066 -10.708 3.114 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.173 -12.117 4.196 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -3.212 -10.472 4.872 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.029 -9.364 3.009 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.077 -9.052 4.760 1.00 0.00 H new ATOM 0 HG23 VAL A 119 0.379 -9.762 4.022 1.00 0.00 H new ATOM 1811 N SER A 120 1.307 -10.865 6.350 1.00 0.00 N ATOM 1812 CA SER A 120 2.764 -10.716 6.388 1.00 0.00 C ATOM 1813 C SER A 120 3.536 -11.989 6.795 1.00 0.00 C ATOM 1814 O SER A 120 4.750 -12.055 6.592 1.00 0.00 O ATOM 1815 CB SER A 120 3.129 -9.568 7.338 1.00 0.00 C ATOM 1816 OG SER A 120 4.524 -9.319 7.349 1.00 0.00 O ATOM 0 H SER A 120 0.815 -10.172 6.914 1.00 0.00 H new ATOM 0 HA SER A 120 3.070 -10.503 5.364 1.00 0.00 H new ATOM 0 HB2 SER A 120 2.601 -8.664 7.036 1.00 0.00 H new ATOM 0 HB3 SER A 120 2.795 -9.810 8.347 1.00 0.00 H new ATOM 0 HG SER A 120 4.996 -10.083 6.956 1.00 0.00 H new ATOM 1822 N LYS A 121 2.867 -12.993 7.363 1.00 0.00 N ATOM 1823 CA LYS A 121 3.590 -14.026 8.103 1.00 0.00 C ATOM 1824 C LYS A 121 3.195 -15.435 7.686 1.00 0.00 C ATOM 1825 O LYS A 121 3.962 -16.376 7.886 1.00 0.00 O ATOM 1826 CB LYS A 121 3.388 -13.860 9.612 1.00 0.00 C ATOM 1827 CG LYS A 121 4.064 -12.623 10.179 1.00 0.00 C ATOM 1828 CD LYS A 121 4.097 -12.652 11.698 1.00 0.00 C ATOM 1829 CE LYS A 121 4.957 -11.529 12.255 1.00 0.00 C ATOM 1830 NZ LYS A 121 5.198 -11.689 13.713 1.00 0.00 N ATOM 0 H LYS A 121 1.855 -13.112 7.327 1.00 0.00 H new ATOM 0 HA LYS A 121 4.644 -13.894 7.859 1.00 0.00 H new ATOM 0 HB2 LYS A 121 2.320 -13.811 9.825 1.00 0.00 H new ATOM 0 HB3 LYS A 121 3.775 -14.742 10.122 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.081 -12.554 9.793 1.00 0.00 H new ATOM 0 HG3 LYS A 121 3.535 -11.732 9.843 1.00 0.00 H new ATOM 0 HD2 LYS A 121 3.083 -12.563 12.087 1.00 0.00 H new ATOM 0 HD3 LYS A 121 4.486 -13.612 12.037 1.00 0.00 H new ATOM 0 HE2 LYS A 121 5.912 -11.507 11.729 1.00 0.00 H new ATOM 0 HE3 LYS A 121 4.469 -10.572 12.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 5.788 -10.904 14.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 4.289 -11.684 14.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 5.686 -12.591 13.887 1.00 0.00 H new ATOM 1844 N PHE A 122 2.007 -15.591 7.128 1.00 0.00 N ATOM 1845 CA PHE A 122 1.575 -16.896 6.656 1.00 0.00 C ATOM 1846 C PHE A 122 2.361 -17.281 5.417 1.00 0.00 C ATOM 1847 O PHE A 122 2.554 -16.458 4.525 1.00 0.00 O ATOM 1848 CB PHE A 122 0.078 -16.902 6.343 1.00 0.00 C ATOM 1849 CG PHE A 122 -0.786 -16.769 7.557 1.00 0.00 C ATOM 1850 CD1 PHE A 122 -0.863 -17.796 8.479 1.00 0.00 C ATOM 1851 CD2 PHE A 122 -1.518 -15.618 7.778 1.00 0.00 C ATOM 1852 CE1 PHE A 122 -1.655 -17.678 9.601 1.00 0.00 C ATOM 1853 CE2 PHE A 122 -2.314 -15.492 8.897 1.00 0.00 C ATOM 1854 CZ PHE A 122 -2.384 -16.524 9.812 1.00 0.00 C ATOM 0 H PHE A 122 1.331 -14.840 6.991 1.00 0.00 H new ATOM 0 HA PHE A 122 1.761 -17.623 7.447 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -0.145 -16.085 5.657 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -0.174 -17.829 5.827 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -0.296 -18.701 8.318 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -1.466 -14.808 7.066 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -1.705 -18.487 10.314 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.882 -14.587 9.058 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.007 -16.429 10.689 1.00 0.00 H new ATOM 1864 N PRO A 123 2.830 -18.534 5.345 1.00 0.00 N ATOM 1865 CA PRO A 123 3.587 -19.032 4.193 1.00 0.00 C ATOM 1866 C PRO A 123 2.821 -18.847 2.888 1.00 0.00 C ATOM 1867 O PRO A 123 3.409 -18.755 1.811 1.00 0.00 O ATOM 1868 CB PRO A 123 3.768 -20.522 4.496 1.00 0.00 C ATOM 1869 CG PRO A 123 3.641 -20.631 5.976 1.00 0.00 C ATOM 1870 CD PRO A 123 2.669 -19.563 6.390 1.00 0.00 C ATOM 0 HA PRO A 123 4.528 -18.497 4.060 1.00 0.00 H new ATOM 0 HB2 PRO A 123 3.013 -21.123 3.989 1.00 0.00 H new ATOM 0 HB3 PRO A 123 4.740 -20.879 4.156 1.00 0.00 H new ATOM 0 HG2 PRO A 123 3.281 -21.619 6.265 1.00 0.00 H new ATOM 0 HG3 PRO A 123 4.606 -20.489 6.462 1.00 0.00 H new ATOM 0 HD2 PRO A 123 1.648 -19.942 6.428 1.00 0.00 H new ATOM 0 HD3 PRO A 123 2.900 -19.170 7.380 1.00 0.00 H new ATOM 1878 N ALA A 124 1.503 -18.785 3.000 1.00 0.00 N ATOM 1879 CA ALA A 124 0.649 -18.596 1.843 1.00 0.00 C ATOM 1880 C ALA A 124 0.238 -17.137 1.655 1.00 0.00 C ATOM 1881 O ALA A 124 -0.423 -16.807 0.673 1.00 0.00 O ATOM 1882 CB ALA A 124 -0.586 -19.474 1.956 1.00 0.00 C ATOM 0 H ALA A 124 1.002 -18.863 3.885 1.00 0.00 H new ATOM 0 HA ALA A 124 1.227 -18.886 0.965 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -1.220 -19.324 1.082 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -0.285 -20.520 2.011 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -1.140 -19.208 2.856 1.00 0.00 H new ATOM 1888 N ARG A 125 0.622 -16.246 2.571 1.00 0.00 N ATOM 1889 CA ARG A 125 0.227 -14.861 2.444 1.00 0.00 C ATOM 1890 C ARG A 125 1.450 -13.964 2.424 1.00 0.00 C ATOM 1891 O ARG A 125 1.331 -12.752 2.295 1.00 0.00 O ATOM 1892 CB ARG A 125 -0.706 -14.460 3.584 1.00 0.00 C ATOM 1893 CG ARG A 125 -2.042 -15.179 3.575 1.00 0.00 C ATOM 1894 CD ARG A 125 -2.945 -14.679 4.690 1.00 0.00 C ATOM 1895 NE ARG A 125 -4.238 -15.356 4.689 1.00 0.00 N ATOM 1896 CZ ARG A 125 -5.239 -15.067 5.517 1.00 0.00 C ATOM 1897 NH1 ARG A 125 -5.116 -14.094 6.411 1.00 0.00 N ATOM 1898 NH2 ARG A 125 -6.369 -15.757 5.440 1.00 0.00 N ATOM 0 H ARG A 125 1.193 -16.461 3.388 1.00 0.00 H new ATOM 0 HA ARG A 125 -0.310 -14.742 1.503 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -0.207 -14.656 4.533 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -0.884 -13.386 3.533 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -2.532 -15.029 2.613 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -1.881 -16.251 3.687 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -2.455 -14.834 5.651 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -3.097 -13.605 4.580 1.00 0.00 H new ATOM 0 HE ARG A 125 -4.384 -16.101 4.008 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -4.249 -13.560 6.468 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -5.889 -13.880 7.041 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -6.466 -16.502 4.750 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -7.142 -15.542 6.071 1.00 0.00 H new ATOM 1912 N ILE A 126 2.627 -14.573 2.505 1.00 0.00 N ATOM 1913 CA ILE A 126 3.875 -13.822 2.580 1.00 0.00 C ATOM 1914 C ILE A 126 4.182 -13.197 1.227 1.00 0.00 C ATOM 1915 O ILE A 126 4.734 -12.104 1.135 1.00 0.00 O ATOM 1916 CB ILE A 126 5.055 -14.714 3.049 1.00 0.00 C ATOM 1917 CG1 ILE A 126 6.350 -13.899 3.128 1.00 0.00 C ATOM 1918 CG2 ILE A 126 5.230 -15.917 2.129 1.00 0.00 C ATOM 1919 CD1 ILE A 126 7.536 -14.686 3.645 1.00 0.00 C ATOM 0 H ILE A 126 2.744 -15.586 2.520 1.00 0.00 H new ATOM 0 HA ILE A 126 3.751 -13.033 3.322 1.00 0.00 H new ATOM 0 HB ILE A 126 4.822 -15.085 4.047 1.00 0.00 H new ATOM 0 HG12 ILE A 126 6.586 -13.513 2.137 1.00 0.00 H new ATOM 0 HG13 ILE A 126 6.187 -13.037 3.775 1.00 0.00 H new ATOM 0 HG21 ILE A 126 6.063 -16.525 2.480 1.00 0.00 H new ATOM 0 HG22 ILE A 126 4.318 -16.514 2.133 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.434 -15.573 1.115 1.00 0.00 H new ATOM 0 HD11 ILE A 126 8.415 -14.043 3.673 1.00 0.00 H new ATOM 0 HD12 ILE A 126 7.321 -15.050 4.650 1.00 0.00 H new ATOM 0 HD13 ILE A 126 7.726 -15.533 2.985 1.00 0.00 H new ATOM 1931 N LYS A 127 3.763 -13.884 0.175 1.00 0.00 N ATOM 1932 CA LYS A 127 3.896 -13.352 -1.178 1.00 0.00 C ATOM 1933 C LYS A 127 2.773 -12.359 -1.433 1.00 0.00 C ATOM 1934 O LYS A 127 2.849 -11.514 -2.319 1.00 0.00 O ATOM 1935 CB LYS A 127 3.863 -14.475 -2.222 1.00 0.00 C ATOM 1936 CG LYS A 127 5.234 -15.003 -2.622 1.00 0.00 C ATOM 1937 CD LYS A 127 5.980 -15.615 -1.450 1.00 0.00 C ATOM 1938 CE LYS A 127 7.323 -16.178 -1.888 1.00 0.00 C ATOM 1939 NZ LYS A 127 8.095 -16.735 -0.747 1.00 0.00 N ATOM 0 H LYS A 127 3.330 -14.806 0.228 1.00 0.00 H new ATOM 0 HA LYS A 127 4.859 -12.850 -1.267 1.00 0.00 H new ATOM 0 HB2 LYS A 127 3.269 -15.301 -1.831 1.00 0.00 H new ATOM 0 HB3 LYS A 127 3.353 -14.110 -3.114 1.00 0.00 H new ATOM 0 HG2 LYS A 127 5.118 -15.751 -3.407 1.00 0.00 H new ATOM 0 HG3 LYS A 127 5.826 -14.190 -3.042 1.00 0.00 H new ATOM 0 HD2 LYS A 127 6.133 -14.860 -0.679 1.00 0.00 H new ATOM 0 HD3 LYS A 127 5.378 -16.407 -1.006 1.00 0.00 H new ATOM 0 HE2 LYS A 127 7.163 -16.958 -2.632 1.00 0.00 H new ATOM 0 HE3 LYS A 127 7.905 -15.392 -2.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 9.003 -17.108 -1.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 8.271 -15.985 -0.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 7.552 -17.503 -0.302 1.00 0.00 H new ATOM 1953 N CYS A 128 1.731 -12.468 -0.625 1.00 0.00 N ATOM 1954 CA CYS A 128 0.596 -11.574 -0.710 1.00 0.00 C ATOM 1955 C CYS A 128 0.883 -10.316 0.105 1.00 0.00 C ATOM 1956 O CYS A 128 0.244 -9.275 -0.074 1.00 0.00 O ATOM 1957 CB CYS A 128 -0.664 -12.278 -0.205 1.00 0.00 C ATOM 1958 SG CYS A 128 -2.209 -11.548 -0.796 1.00 0.00 S ATOM 0 H CYS A 128 1.651 -13.177 0.104 1.00 0.00 H new ATOM 0 HA CYS A 128 0.429 -11.288 -1.749 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -0.629 -13.324 -0.510 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -0.662 -12.264 0.885 1.00 0.00 H new ATOM 0 HG CYS A 128 -2.998 -12.489 -1.224 1.00 0.00 H new ATOM 1964 N ALA A 129 1.845 -10.438 1.015 1.00 0.00 N ATOM 1965 CA ALA A 129 2.329 -9.305 1.784 1.00 0.00 C ATOM 1966 C ALA A 129 3.214 -8.441 0.906 1.00 0.00 C ATOM 1967 O ALA A 129 3.063 -7.224 0.871 1.00 0.00 O ATOM 1968 CB ALA A 129 3.092 -9.776 3.013 1.00 0.00 C ATOM 0 H ALA A 129 2.306 -11.321 1.236 1.00 0.00 H new ATOM 0 HA ALA A 129 1.477 -8.716 2.124 1.00 0.00 H new ATOM 0 HB1 ALA A 129 3.446 -8.912 3.575 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.433 -10.374 3.643 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.944 -10.381 2.703 1.00 0.00 H new ATOM 1974 N THR A 130 4.126 -9.082 0.183 1.00 0.00 N ATOM 1975 CA THR A 130 4.955 -8.389 -0.791 1.00 0.00 C ATOM 1976 C THR A 130 4.066 -7.709 -1.833 1.00 0.00 C ATOM 1977 O THR A 130 4.347 -6.596 -2.278 1.00 0.00 O ATOM 1978 CB THR A 130 5.919 -9.371 -1.489 1.00 0.00 C ATOM 1979 OG1 THR A 130 6.601 -10.155 -0.501 1.00 0.00 O ATOM 1980 CG2 THR A 130 6.938 -8.628 -2.340 1.00 0.00 C ATOM 0 H THR A 130 4.309 -10.083 0.255 1.00 0.00 H new ATOM 0 HA THR A 130 5.547 -7.637 -0.269 1.00 0.00 H new ATOM 0 HB THR A 130 5.335 -10.019 -2.142 1.00 0.00 H new ATOM 0 HG1 THR A 130 7.212 -10.780 -0.944 1.00 0.00 H new ATOM 0 HG21 THR A 130 7.604 -9.345 -2.820 1.00 0.00 H new ATOM 0 HG22 THR A 130 6.420 -8.047 -3.103 1.00 0.00 H new ATOM 0 HG23 THR A 130 7.521 -7.958 -1.708 1.00 0.00 H new ATOM 1988 N LEU A 131 2.984 -8.398 -2.189 1.00 0.00 N ATOM 1989 CA LEU A 131 1.965 -7.865 -3.087 1.00 0.00 C ATOM 1990 C LEU A 131 1.472 -6.510 -2.589 1.00 0.00 C ATOM 1991 O LEU A 131 1.789 -5.478 -3.163 1.00 0.00 O ATOM 1992 CB LEU A 131 0.798 -8.871 -3.179 1.00 0.00 C ATOM 1993 CG LEU A 131 -0.317 -8.585 -4.204 1.00 0.00 C ATOM 1994 CD1 LEU A 131 -1.157 -9.833 -4.401 1.00 0.00 C ATOM 1995 CD2 LEU A 131 -1.227 -7.446 -3.757 1.00 0.00 C ATOM 0 H LEU A 131 2.790 -9.344 -1.861 1.00 0.00 H new ATOM 0 HA LEU A 131 2.393 -7.720 -4.079 1.00 0.00 H new ATOM 0 HB2 LEU A 131 1.218 -9.851 -3.405 1.00 0.00 H new ATOM 0 HB3 LEU A 131 0.337 -8.941 -2.194 1.00 0.00 H new ATOM 0 HG LEU A 131 0.164 -8.291 -5.137 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -1.945 -9.630 -5.126 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -0.526 -10.642 -4.768 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -1.604 -10.124 -3.451 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -1.998 -7.279 -4.510 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -1.696 -7.706 -2.808 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -0.638 -6.537 -3.633 1.00 0.00 H new ATOM 2007 N SER A 132 0.729 -6.523 -1.496 1.00 0.00 N ATOM 2008 CA SER A 132 0.054 -5.328 -1.023 1.00 0.00 C ATOM 2009 C SER A 132 1.044 -4.351 -0.392 1.00 0.00 C ATOM 2010 O SER A 132 1.211 -3.214 -0.849 1.00 0.00 O ATOM 2011 CB SER A 132 -1.011 -5.730 -0.005 1.00 0.00 C ATOM 2012 OG SER A 132 -1.628 -6.958 -0.372 1.00 0.00 O ATOM 0 H SER A 132 0.578 -7.350 -0.919 1.00 0.00 H new ATOM 0 HA SER A 132 -0.413 -4.826 -1.870 1.00 0.00 H new ATOM 0 HB2 SER A 132 -0.558 -5.827 0.982 1.00 0.00 H new ATOM 0 HB3 SER A 132 -1.766 -4.947 0.066 1.00 0.00 H new ATOM 0 HG SER A 132 -2.305 -7.196 0.295 1.00 0.00 H new ATOM 2018 N TRP A 133 1.733 -4.831 0.628 1.00 0.00 N ATOM 2019 CA TRP A 133 2.575 -3.989 1.453 1.00 0.00 C ATOM 2020 C TRP A 133 3.753 -3.445 0.661 1.00 0.00 C ATOM 2021 O TRP A 133 3.989 -2.240 0.656 1.00 0.00 O ATOM 2022 CB TRP A 133 3.066 -4.773 2.680 1.00 0.00 C ATOM 2023 CG TRP A 133 4.102 -4.052 3.494 1.00 0.00 C ATOM 2024 CD1 TRP A 133 3.898 -3.003 4.345 1.00 0.00 C ATOM 2025 CD2 TRP A 133 5.506 -4.336 3.537 1.00 0.00 C ATOM 2026 NE1 TRP A 133 5.090 -2.616 4.910 1.00 0.00 N ATOM 2027 CE2 TRP A 133 6.092 -3.420 4.432 1.00 0.00 C ATOM 2028 CE3 TRP A 133 6.324 -5.280 2.908 1.00 0.00 C ATOM 2029 CZ2 TRP A 133 7.458 -3.421 4.709 1.00 0.00 C ATOM 2030 CZ3 TRP A 133 7.679 -5.277 3.181 1.00 0.00 C ATOM 2031 CH2 TRP A 133 8.234 -4.353 4.076 1.00 0.00 C ATOM 0 H TRP A 133 1.724 -5.812 0.906 1.00 0.00 H new ATOM 0 HA TRP A 133 1.981 -3.140 1.791 1.00 0.00 H new ATOM 0 HB2 TRP A 133 2.212 -5.001 3.318 1.00 0.00 H new ATOM 0 HB3 TRP A 133 3.479 -5.726 2.348 1.00 0.00 H new ATOM 0 HD1 TRP A 133 2.941 -2.545 4.545 1.00 0.00 H new ATOM 0 HE1 TRP A 133 5.210 -1.854 5.577 1.00 0.00 H new ATOM 0 HE3 TRP A 133 5.904 -5.999 2.220 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 7.889 -2.711 5.399 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.320 -5.999 2.697 1.00 0.00 H new ATOM 0 HH2 TRP A 133 9.296 -4.377 4.270 1.00 0.00 H new ATOM 2042 N LYS A 134 4.472 -4.311 -0.042 1.00 0.00 N ATOM 2043 CA LYS A 134 5.730 -3.894 -0.639 1.00 0.00 C ATOM 2044 C LYS A 134 5.528 -3.200 -1.982 1.00 0.00 C ATOM 2045 O LYS A 134 6.392 -2.450 -2.417 1.00 0.00 O ATOM 2046 CB LYS A 134 6.707 -5.062 -0.766 1.00 0.00 C ATOM 2047 CG LYS A 134 8.153 -4.604 -0.862 1.00 0.00 C ATOM 2048 CD LYS A 134 9.131 -5.753 -0.697 1.00 0.00 C ATOM 2049 CE LYS A 134 10.558 -5.245 -0.555 1.00 0.00 C ATOM 2050 NZ LYS A 134 10.756 -4.462 0.696 1.00 0.00 N ATOM 0 H LYS A 134 4.213 -5.283 -0.209 1.00 0.00 H new ATOM 0 HA LYS A 134 6.170 -3.163 0.039 1.00 0.00 H new ATOM 0 HB2 LYS A 134 6.594 -5.721 0.095 1.00 0.00 H new ATOM 0 HB3 LYS A 134 6.455 -5.647 -1.650 1.00 0.00 H new ATOM 0 HG2 LYS A 134 8.317 -4.125 -1.827 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.346 -3.852 -0.096 1.00 0.00 H new ATOM 0 HD2 LYS A 134 8.862 -6.340 0.181 1.00 0.00 H new ATOM 0 HD3 LYS A 134 9.063 -6.418 -1.558 1.00 0.00 H new ATOM 0 HE2 LYS A 134 11.245 -6.091 -0.564 1.00 0.00 H new ATOM 0 HE3 LYS A 134 10.807 -4.622 -1.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 11.770 -4.426 0.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.397 -3.495 0.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 10.240 -4.917 1.476 1.00 0.00 H new ATOM 2064 N ALA A 135 4.396 -3.418 -2.643 1.00 0.00 N ATOM 2065 CA ALA A 135 4.101 -2.645 -3.848 1.00 0.00 C ATOM 2066 C ALA A 135 3.865 -1.191 -3.470 1.00 0.00 C ATOM 2067 O ALA A 135 4.160 -0.273 -4.233 1.00 0.00 O ATOM 2068 CB ALA A 135 2.896 -3.200 -4.586 1.00 0.00 C ATOM 0 H ALA A 135 3.686 -4.101 -2.378 1.00 0.00 H new ATOM 0 HA ALA A 135 4.956 -2.716 -4.520 1.00 0.00 H new ATOM 0 HB1 ALA A 135 2.707 -2.600 -5.476 1.00 0.00 H new ATOM 0 HB2 ALA A 135 3.092 -4.232 -4.878 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.023 -3.167 -3.934 1.00 0.00 H new ATOM 2074 N LEU A 136 3.358 -0.999 -2.266 1.00 0.00 N ATOM 2075 CA LEU A 136 3.084 0.330 -1.753 1.00 0.00 C ATOM 2076 C LEU A 136 4.342 0.882 -1.101 1.00 0.00 C ATOM 2077 O LEU A 136 4.687 2.060 -1.250 1.00 0.00 O ATOM 2078 CB LEU A 136 1.949 0.272 -0.733 1.00 0.00 C ATOM 2079 CG LEU A 136 1.418 1.627 -0.275 1.00 0.00 C ATOM 2080 CD1 LEU A 136 0.612 2.287 -1.385 1.00 0.00 C ATOM 2081 CD2 LEU A 136 0.581 1.466 0.984 1.00 0.00 C ATOM 0 H LEU A 136 3.126 -1.754 -1.621 1.00 0.00 H new ATOM 0 HA LEU A 136 2.783 0.982 -2.573 1.00 0.00 H new ATOM 0 HB2 LEU A 136 1.125 -0.297 -1.163 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.295 -0.279 0.141 1.00 0.00 H new ATOM 0 HG LEU A 136 2.264 2.274 -0.042 1.00 0.00 H new ATOM 0 HD11 LEU A 136 0.241 3.252 -1.041 1.00 0.00 H new ATOM 0 HD12 LEU A 136 1.247 2.433 -2.259 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -0.230 1.649 -1.652 1.00 0.00 H new ATOM 0 HD21 LEU A 136 0.208 2.440 1.300 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -0.261 0.804 0.779 1.00 0.00 H new ATOM 0 HD23 LEU A 136 1.195 1.038 1.777 1.00 0.00 H new ATOM 2093 N GLU A 137 5.023 0.001 -0.380 1.00 0.00 N ATOM 2094 CA GLU A 137 6.249 0.331 0.317 1.00 0.00 C ATOM 2095 C GLU A 137 7.322 0.718 -0.682 1.00 0.00 C ATOM 2096 O GLU A 137 7.953 1.767 -0.555 1.00 0.00 O ATOM 2097 CB GLU A 137 6.686 -0.868 1.179 1.00 0.00 C ATOM 2098 CG GLU A 137 7.965 -0.663 1.984 1.00 0.00 C ATOM 2099 CD GLU A 137 9.220 -0.978 1.191 1.00 0.00 C ATOM 2100 OE1 GLU A 137 9.452 -2.166 0.881 1.00 0.00 O ATOM 2101 OE2 GLU A 137 9.976 -0.041 0.877 1.00 0.00 O ATOM 0 H GLU A 137 4.733 -0.970 -0.264 1.00 0.00 H new ATOM 0 HA GLU A 137 6.084 1.184 0.976 1.00 0.00 H new ATOM 0 HB2 GLU A 137 5.878 -1.112 1.869 1.00 0.00 H new ATOM 0 HB3 GLU A 137 6.821 -1.732 0.528 1.00 0.00 H new ATOM 0 HG2 GLU A 137 8.009 0.370 2.329 1.00 0.00 H new ATOM 0 HG3 GLU A 137 7.934 -1.295 2.872 1.00 0.00 H new ATOM 2108 N LYS A 138 7.471 -0.091 -1.715 1.00 0.00 N ATOM 2109 CA LYS A 138 8.585 0.078 -2.641 1.00 0.00 C ATOM 2110 C LYS A 138 8.185 0.956 -3.822 1.00 0.00 C ATOM 2111 O LYS A 138 9.037 1.397 -4.590 1.00 0.00 O ATOM 2112 CB LYS A 138 9.074 -1.285 -3.141 1.00 0.00 C ATOM 2113 CG LYS A 138 10.546 -1.324 -3.547 1.00 0.00 C ATOM 2114 CD LYS A 138 11.474 -1.337 -2.335 1.00 0.00 C ATOM 2115 CE LYS A 138 11.659 0.045 -1.726 1.00 0.00 C ATOM 2116 NZ LYS A 138 12.278 -0.026 -0.374 1.00 0.00 N ATOM 0 H LYS A 138 6.844 -0.865 -1.936 1.00 0.00 H new ATOM 0 HA LYS A 138 9.397 0.571 -2.106 1.00 0.00 H new ATOM 0 HB2 LYS A 138 8.907 -2.025 -2.359 1.00 0.00 H new ATOM 0 HB3 LYS A 138 8.467 -1.582 -3.996 1.00 0.00 H new ATOM 0 HG2 LYS A 138 10.731 -2.210 -4.155 1.00 0.00 H new ATOM 0 HG3 LYS A 138 10.774 -0.458 -4.168 1.00 0.00 H new ATOM 0 HD2 LYS A 138 11.070 -2.012 -1.580 1.00 0.00 H new ATOM 0 HD3 LYS A 138 12.446 -1.733 -2.630 1.00 0.00 H new ATOM 0 HE2 LYS A 138 12.285 0.650 -2.381 1.00 0.00 H new ATOM 0 HE3 LYS A 138 10.693 0.545 -1.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 12.695 0.896 -0.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 11.551 -0.271 0.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 13.021 -0.753 -0.370 1.00 0.00 H new ATOM 2130 N GLY A 139 6.889 1.217 -3.945 1.00 0.00 N ATOM 2131 CA GLY A 139 6.379 2.004 -5.057 1.00 0.00 C ATOM 2132 C GLY A 139 6.974 3.397 -5.122 1.00 0.00 C ATOM 2133 O GLY A 139 7.525 3.797 -6.146 1.00 0.00 O ATOM 0 H GLY A 139 6.176 0.896 -3.290 1.00 0.00 H new ATOM 0 HA2 GLY A 139 6.589 1.482 -5.990 1.00 0.00 H new ATOM 0 HA3 GLY A 139 5.295 2.082 -4.972 1.00 0.00 H new ATOM 2137 N VAL A 140 6.864 4.135 -4.026 1.00 0.00 N ATOM 2138 CA VAL A 140 7.412 5.485 -3.948 1.00 0.00 C ATOM 2139 C VAL A 140 8.531 5.522 -2.927 1.00 0.00 C ATOM 2140 O VAL A 140 8.887 6.582 -2.411 1.00 0.00 O ATOM 2141 CB VAL A 140 6.333 6.518 -3.566 1.00 0.00 C ATOM 2142 CG1 VAL A 140 5.329 6.671 -4.693 1.00 0.00 C ATOM 2143 CG2 VAL A 140 5.629 6.117 -2.276 1.00 0.00 C ATOM 0 H VAL A 140 6.398 3.821 -3.174 1.00 0.00 H new ATOM 0 HA VAL A 140 7.795 5.747 -4.934 1.00 0.00 H new ATOM 0 HB VAL A 140 6.822 7.478 -3.400 1.00 0.00 H new ATOM 0 HG11 VAL A 140 4.573 7.403 -4.410 1.00 0.00 H new ATOM 0 HG12 VAL A 140 5.842 7.009 -5.594 1.00 0.00 H new ATOM 0 HG13 VAL A 140 4.850 5.711 -4.886 1.00 0.00 H new ATOM 0 HG21 VAL A 140 4.873 6.861 -2.028 1.00 0.00 H new ATOM 0 HG22 VAL A 140 5.152 5.146 -2.408 1.00 0.00 H new ATOM 0 HG23 VAL A 140 6.358 6.057 -1.468 1.00 0.00 H new ATOM 2153 N ALA A 141 9.073 4.334 -2.658 1.00 0.00 N ATOM 2154 CA ALA A 141 10.110 4.134 -1.652 1.00 0.00 C ATOM 2155 C ALA A 141 9.569 4.358 -0.241 1.00 0.00 C ATOM 2156 O ALA A 141 8.547 5.022 -0.044 1.00 0.00 O ATOM 2157 CB ALA A 141 11.322 5.023 -1.916 1.00 0.00 C ATOM 0 H ALA A 141 8.800 3.477 -3.138 1.00 0.00 H new ATOM 0 HA ALA A 141 10.435 3.096 -1.725 1.00 0.00 H new ATOM 0 HB1 ALA A 141 12.075 4.849 -1.148 1.00 0.00 H new ATOM 0 HB2 ALA A 141 11.740 4.787 -2.895 1.00 0.00 H new ATOM 0 HB3 ALA A 141 11.017 6.069 -1.894 1.00 0.00 H new ATOM 2163 N LYS A 142 10.242 3.738 0.717 1.00 0.00 N ATOM 2164 CA LYS A 142 9.964 3.887 2.138 1.00 0.00 C ATOM 2165 C LYS A 142 11.048 3.153 2.906 1.00 0.00 C ATOM 2166 O LYS A 142 11.617 2.200 2.371 1.00 0.00 O ATOM 2167 CB LYS A 142 8.572 3.356 2.502 1.00 0.00 C ATOM 2168 CG LYS A 142 7.542 4.467 2.645 1.00 0.00 C ATOM 2169 CD LYS A 142 6.136 3.935 2.839 1.00 0.00 C ATOM 2170 CE LYS A 142 5.658 3.185 1.613 1.00 0.00 C ATOM 2171 NZ LYS A 142 5.842 3.973 0.362 1.00 0.00 N ATOM 0 H LYS A 142 11.015 3.102 0.523 1.00 0.00 H new ATOM 0 HA LYS A 142 9.967 4.944 2.402 1.00 0.00 H new ATOM 0 HB2 LYS A 142 8.242 2.656 1.735 1.00 0.00 H new ATOM 0 HB3 LYS A 142 8.633 2.799 3.437 1.00 0.00 H new ATOM 0 HG2 LYS A 142 7.808 5.098 3.493 1.00 0.00 H new ATOM 0 HG3 LYS A 142 7.568 5.099 1.757 1.00 0.00 H new ATOM 0 HD2 LYS A 142 6.111 3.274 3.705 1.00 0.00 H new ATOM 0 HD3 LYS A 142 5.458 4.762 3.050 1.00 0.00 H new ATOM 0 HE2 LYS A 142 6.202 2.244 1.530 1.00 0.00 H new ATOM 0 HE3 LYS A 142 4.604 2.935 1.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 5.352 3.498 -0.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 5.447 4.926 0.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 6.856 4.045 0.143 1.00 0.00 H new ATOM 2185 N GLU A 143 11.346 3.605 4.130 1.00 0.00 N ATOM 2186 CA GLU A 143 12.482 3.079 4.895 1.00 0.00 C ATOM 2187 C GLU A 143 13.797 3.458 4.212 1.00 0.00 C ATOM 2188 O GLU A 143 14.056 3.070 3.069 1.00 0.00 O ATOM 2189 CB GLU A 143 12.387 1.552 5.051 1.00 0.00 C ATOM 2190 CG GLU A 143 13.597 0.920 5.723 1.00 0.00 C ATOM 2191 CD GLU A 143 13.558 -0.595 5.690 1.00 0.00 C ATOM 2192 OE1 GLU A 143 13.009 -1.200 6.637 1.00 0.00 O ATOM 2193 OE2 GLU A 143 14.083 -1.191 4.721 1.00 0.00 O ATOM 0 H GLU A 143 10.817 4.333 4.611 1.00 0.00 H new ATOM 0 HA GLU A 143 12.455 3.523 5.890 1.00 0.00 H new ATOM 0 HB2 GLU A 143 11.496 1.311 5.631 1.00 0.00 H new ATOM 0 HB3 GLU A 143 12.257 1.104 4.066 1.00 0.00 H new ATOM 0 HG2 GLU A 143 14.505 1.267 5.229 1.00 0.00 H new ATOM 0 HG3 GLU A 143 13.649 1.256 6.759 1.00 0.00 H new ATOM 2200 N GLU A 144 14.621 4.226 4.900 1.00 0.00 N ATOM 2201 CA GLU A 144 15.896 4.634 4.340 1.00 0.00 C ATOM 2202 C GLU A 144 16.888 3.474 4.448 1.00 0.00 C ATOM 2203 O GLU A 144 16.991 2.656 3.533 1.00 0.00 O ATOM 2204 CB GLU A 144 16.425 5.883 5.061 1.00 0.00 C ATOM 2205 CG GLU A 144 17.321 6.765 4.199 1.00 0.00 C ATOM 2206 CD GLU A 144 18.534 6.033 3.666 1.00 0.00 C ATOM 2207 OE1 GLU A 144 19.561 5.980 4.378 1.00 0.00 O ATOM 2208 OE2 GLU A 144 18.462 5.496 2.543 1.00 0.00 O ATOM 0 H GLU A 144 14.433 4.577 5.839 1.00 0.00 H new ATOM 0 HA GLU A 144 15.767 4.891 3.289 1.00 0.00 H new ATOM 0 HB2 GLU A 144 15.578 6.474 5.410 1.00 0.00 H new ATOM 0 HB3 GLU A 144 16.982 5.571 5.945 1.00 0.00 H new ATOM 0 HG2 GLU A 144 16.741 7.154 3.362 1.00 0.00 H new ATOM 0 HG3 GLU A 144 17.650 7.623 4.786 1.00 0.00 H new