USER MOD reduce.3.24.130724 H: found=0, std=0, add=1443, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1445 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 69 SER OG : rot 180:sc= 1.11 USER MOD Set 1.2: B 72 LYS NZ :NH3+ 173:sc= 3.54 (180deg=1.86) USER MOD Set 2.1: B 36 ASN : amide:sc= 0.985 K(o=2.8,f=-1.1) USER MOD Set 2.2: B 39 LYS NZ :NH3+ -146:sc= 1.24 (180deg=0.275) USER MOD Set 2.3: B 67 GLN : amide:sc= 0.538 K(o=2.8,f=-1.1) USER MOD Set 3.1: B 18 THR OG1 : rot 180:sc= 0.757 USER MOD Set 3.2: B 22 THR OG1 : rot 130:sc= 0.882 USER MOD Set 4.1: A 48 HIS : no HE2:sc= -1.96 K(o=-2,f=-14!) USER MOD Set 4.2: A 89 LYS NZ :NH3+ -147:sc= -0.0227 (180deg=-1.23) USER MOD Set 5.1: A 55 SER OG : rot -160:sc= 1.03 USER MOD Set 5.2: A 85 LYS NZ :NH3+ -164:sc= 1.19 (180deg=-0.0807) USER MOD Set 6.1: A 44 GLN : amide:sc= 0.78 K(o=0.85,f=-3.8) USER MOD Set 6.2: A 45 GLN : amide:sc= 0.0707 K(o=0.85,f=-3.8!) USER MOD Set 7.1: A 39 LYS NZ :NH3+ 170:sc= 0.592 (180deg=0) USER MOD Set 7.2: A 43 THR OG1 : rot 77:sc= 1.19 USER MOD Set 8.1: A 36 ASN : amide:sc= 0.64 X(o=0.24,f=0.71) USER MOD Set 8.2: A 67 GLN : amide:sc= -0.4 X(o=0.24,f=0.71) USER MOD Set 9.1: A 18 THR OG1 : rot 180:sc= 0.41 USER MOD Set 9.2: A 22 THR OG1 : rot 133:sc= 0.44 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 69:sc= 1.08 USER MOD Single : A 15 THR OG1 : rot 71:sc= 1.11 USER MOD Single : A 19 THR OG1 : rot 77:sc= 1.26 USER MOD Single : A 32 SER OG : rot 140:sc= 0.384 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -170:sc= -0.237 (180deg=-0.406) USER MOD Single : A 59 LYS NZ :NH3+ -160:sc= 0.259 (180deg=-1.08) USER MOD Single : A 60 MET CE :methyl 172:sc= 0 (180deg=-0.0867) USER MOD Single : A 61 LYS NZ :NH3+ -136:sc= 2.34 (180deg=2.22) USER MOD Single : A 62 SER OG : rot 88:sc= 1.19 USER MOD Single : A 66 ASN : amide:sc= -0.214 X(o=-0.21,f=-0.33) USER MOD Single : A 69 SER OG : rot 86:sc= 1.09 USER MOD Single : A 72 LYS NZ :NH3+ 153:sc= 0.656 (180deg=-2.33!) USER MOD Single : A 74 ASN : amide:sc= 1.03 K(o=1,f=-5.3!) USER MOD Single : A 76 TYR OH : rot 130:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ -134:sc= 1.04 (180deg=-2.65!) USER MOD Single : A 94 LYS NZ :NH3+ 151:sc= 2.33 (180deg=2.11) USER MOD Single : B 7 THR OG1 : rot 106:sc= 1.18 USER MOD Single : B 12 SER OG : rot 160:sc= -0.0188 USER MOD Single : B 15 THR OG1 : rot 83:sc= 1.23 USER MOD Single : B 19 THR OG1 : rot 84:sc= 1.24 USER MOD Single : B 30 LYS NZ :NH3+ 138:sc= 1.02 (180deg=-3.75!) USER MOD Single : B 32 SER OG : rot 78:sc= 0.213 USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 44 GLN : amide:sc= -0.0199 K(o=-0.02,f=-1.1) USER MOD Single : B 45 GLN : amide:sc= -0.421 K(o=-0.42,f=-2.4!) USER MOD Single : B 48 HIS : no HE2:sc= -3.35! C(o=-3.3!,f=-5!) USER MOD Single : B 51 LYS NZ :NH3+ -168:sc= 0.912 (180deg=0.765) USER MOD Single : B 55 SER OG : rot -154:sc= -1.04 USER MOD Single : B 59 LYS NZ :NH3+ -158:sc= 0.479 (180deg=-1.98!) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 SER OG : rot 85:sc= 0.757 USER MOD Single : B 66 ASN : amide:sc= -0.297 K(o=-0.3,f=-1.7!) USER MOD Single : B 74 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : B 76 TYR OH : rot 130:sc= 0 USER MOD Single : B 85 LYS NZ :NH3+ -164:sc= -0.206 (180deg=-0.607) USER MOD Single : B 89 LYS NZ :NH3+ 164:sc= 0.183! (180deg=-2.73!) USER MOD Single : B 90 LYS NZ :NH3+ -164:sc= 0.701 (180deg=0.615) USER MOD Single : B 91 LYS NZ :NH3+ -114:sc= 0.428 (180deg=-4.89!) USER MOD Single : B 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 4 -12.776 -13.645 8.877 1.00 1.94 N ATOM 41 CA GLU A 4 -13.636 -12.726 8.141 1.00 1.70 C ATOM 42 C GLU A 4 -13.665 -13.104 6.662 1.00 1.71 C ATOM 43 O GLU A 4 -12.642 -13.506 6.110 1.00 1.69 O ATOM 44 CB GLU A 4 -13.213 -11.253 8.333 1.00 1.38 C ATOM 45 CG GLU A 4 -11.704 -10.942 8.346 1.00 1.93 C ATOM 46 CD GLU A 4 -10.934 -11.712 9.408 1.00 3.57 C ATOM 47 OE1 GLU A 4 -11.192 -11.491 10.612 1.00 4.40 O ATOM 48 OE2 GLU A 4 -10.250 -12.678 9.009 1.00 4.63 O ATOM 0 HA GLU A 4 -14.644 -12.816 8.546 1.00 1.70 H new ATOM 0 HB2 GLU A 4 -13.671 -10.665 7.537 1.00 1.38 H new ATOM 0 HB3 GLU A 4 -13.637 -10.901 9.273 1.00 1.38 H new ATOM 0 HG2 GLU A 4 -11.285 -11.173 7.366 1.00 1.93 H new ATOM 0 HG3 GLU A 4 -11.563 -9.874 8.509 1.00 1.93 H new ATOM 55 N PRO A 5 -14.814 -12.951 5.986 1.00 1.90 N ATOM 56 CA PRO A 5 -14.906 -13.155 4.556 1.00 1.93 C ATOM 57 C PRO A 5 -14.350 -11.912 3.849 1.00 1.55 C ATOM 58 O PRO A 5 -15.088 -11.172 3.197 1.00 1.75 O ATOM 59 CB PRO A 5 -16.393 -13.403 4.302 1.00 2.47 C ATOM 60 CG PRO A 5 -17.083 -12.525 5.347 1.00 2.55 C ATOM 61 CD PRO A 5 -16.079 -12.455 6.507 1.00 2.19 C ATOM 0 HA PRO A 5 -14.325 -13.994 4.172 1.00 1.93 H new ATOM 0 HB2 PRO A 5 -16.680 -13.122 3.289 1.00 2.47 H new ATOM 0 HB3 PRO A 5 -16.652 -14.454 4.427 1.00 2.47 H new ATOM 0 HG2 PRO A 5 -17.303 -11.534 4.951 1.00 2.55 H new ATOM 0 HG3 PRO A 5 -18.031 -12.958 5.667 1.00 2.55 H new ATOM 0 HD2 PRO A 5 -15.975 -11.432 6.870 1.00 2.19 H new ATOM 0 HD3 PRO A 5 -16.416 -13.059 7.349 1.00 2.19 H new ATOM 69 N LEU A 6 -13.042 -11.688 3.989 1.00 1.20 N ATOM 70 CA LEU A 6 -12.323 -10.620 3.298 1.00 1.02 C ATOM 71 C LEU A 6 -11.971 -11.031 1.856 1.00 0.97 C ATOM 72 O LEU A 6 -12.286 -12.139 1.426 1.00 1.27 O ATOM 73 CB LEU A 6 -11.096 -10.187 4.119 1.00 1.01 C ATOM 74 CG LEU A 6 -10.143 -11.303 4.589 1.00 1.04 C ATOM 75 CD1 LEU A 6 -9.601 -12.172 3.449 1.00 1.96 C ATOM 76 CD2 LEU A 6 -8.973 -10.651 5.333 1.00 2.14 C ATOM 0 H LEU A 6 -12.446 -12.252 4.594 1.00 1.20 H new ATOM 0 HA LEU A 6 -12.972 -9.749 3.213 1.00 1.02 H new ATOM 0 HB2 LEU A 6 -10.521 -9.479 3.522 1.00 1.01 H new ATOM 0 HB3 LEU A 6 -11.449 -9.649 4.999 1.00 1.01 H new ATOM 0 HG LEU A 6 -10.714 -11.970 5.234 1.00 1.04 H new ATOM 0 HD11 LEU A 6 -8.938 -12.935 3.857 1.00 1.96 H new ATOM 0 HD12 LEU A 6 -10.431 -12.652 2.931 1.00 1.96 H new ATOM 0 HD13 LEU A 6 -9.048 -11.548 2.747 1.00 1.96 H new ATOM 0 HD21 LEU A 6 -8.284 -11.423 5.676 1.00 2.14 H new ATOM 0 HD22 LEU A 6 -8.450 -9.970 4.662 1.00 2.14 H new ATOM 0 HD23 LEU A 6 -9.352 -10.096 6.191 1.00 2.14 H new ATOM 88 N THR A 7 -11.382 -10.104 1.089 1.00 0.79 N ATOM 89 CA THR A 7 -11.041 -10.256 -0.327 1.00 0.78 C ATOM 90 C THR A 7 -9.587 -9.791 -0.518 1.00 0.74 C ATOM 91 O THR A 7 -9.085 -9.058 0.329 1.00 0.76 O ATOM 92 CB THR A 7 -12.036 -9.416 -1.153 1.00 0.91 C ATOM 93 OG1 THR A 7 -13.370 -9.665 -0.751 1.00 1.37 O ATOM 94 CG2 THR A 7 -11.969 -9.722 -2.649 1.00 1.21 C ATOM 0 H THR A 7 -11.120 -9.189 1.457 1.00 0.79 H new ATOM 0 HA THR A 7 -11.114 -11.291 -0.661 1.00 0.78 H new ATOM 0 HB THR A 7 -11.751 -8.379 -0.974 1.00 0.91 H new ATOM 0 HG1 THR A 7 -13.981 -9.119 -1.289 1.00 1.37 H new ATOM 0 HG21 THR A 7 -12.691 -9.102 -3.180 1.00 1.21 H new ATOM 0 HG22 THR A 7 -10.966 -9.509 -3.019 1.00 1.21 H new ATOM 0 HG23 THR A 7 -12.202 -10.774 -2.816 1.00 1.21 H new ATOM 102 N GLU A 8 -8.906 -10.183 -1.600 1.00 0.77 N ATOM 103 CA GLU A 8 -7.464 -10.008 -1.779 1.00 0.77 C ATOM 104 C GLU A 8 -6.998 -8.563 -1.541 1.00 0.73 C ATOM 105 O GLU A 8 -6.010 -8.316 -0.846 1.00 0.75 O ATOM 106 CB GLU A 8 -7.044 -10.468 -3.188 1.00 0.88 C ATOM 107 CG GLU A 8 -7.467 -11.908 -3.535 1.00 1.05 C ATOM 108 CD GLU A 8 -8.770 -11.975 -4.324 1.00 1.74 C ATOM 109 OE1 GLU A 8 -9.764 -11.416 -3.813 1.00 3.11 O ATOM 110 OE2 GLU A 8 -8.753 -12.548 -5.433 1.00 2.39 O ATOM 0 H GLU A 8 -9.354 -10.641 -2.393 1.00 0.77 H new ATOM 0 HA GLU A 8 -6.979 -10.627 -1.024 1.00 0.77 H new ATOM 0 HB2 GLU A 8 -7.474 -9.788 -3.923 1.00 0.88 H new ATOM 0 HB3 GLU A 8 -5.960 -10.388 -3.276 1.00 0.88 H new ATOM 0 HG2 GLU A 8 -6.675 -12.384 -4.113 1.00 1.05 H new ATOM 0 HG3 GLU A 8 -7.577 -12.480 -2.614 1.00 1.05 H new ATOM 117 N LEU A 9 -7.704 -7.598 -2.140 1.00 0.71 N ATOM 118 CA LEU A 9 -7.367 -6.182 -2.043 1.00 0.73 C ATOM 119 C LEU A 9 -7.302 -5.802 -0.561 1.00 0.73 C ATOM 120 O LEU A 9 -6.302 -5.291 -0.058 1.00 0.78 O ATOM 121 CB LEU A 9 -8.448 -5.338 -2.747 1.00 0.76 C ATOM 122 CG LEU A 9 -8.495 -5.376 -4.287 1.00 0.85 C ATOM 123 CD1 LEU A 9 -7.294 -4.668 -4.914 1.00 1.67 C ATOM 124 CD2 LEU A 9 -8.659 -6.777 -4.881 1.00 1.83 C ATOM 0 H LEU A 9 -8.530 -7.784 -2.709 1.00 0.71 H new ATOM 0 HA LEU A 9 -6.407 -5.993 -2.523 1.00 0.73 H new ATOM 0 HB2 LEU A 9 -9.420 -5.659 -2.374 1.00 0.76 H new ATOM 0 HB3 LEU A 9 -8.316 -4.300 -2.441 1.00 0.76 H new ATOM 0 HG LEU A 9 -9.402 -4.829 -4.544 1.00 0.85 H new ATOM 0 HD11 LEU A 9 -7.368 -4.719 -6.000 1.00 1.67 H new ATOM 0 HD12 LEU A 9 -7.282 -3.624 -4.600 1.00 1.67 H new ATOM 0 HD13 LEU A 9 -6.374 -5.155 -4.590 1.00 1.67 H new ATOM 0 HD21 LEU A 9 -8.682 -6.711 -5.969 1.00 1.83 H new ATOM 0 HD22 LEU A 9 -7.821 -7.403 -4.574 1.00 1.83 H new ATOM 0 HD23 LEU A 9 -9.590 -7.217 -4.524 1.00 1.83 H new ATOM 136 N GLU A 10 -8.406 -6.095 0.123 1.00 0.72 N ATOM 137 CA GLU A 10 -8.636 -5.824 1.526 1.00 0.79 C ATOM 138 C GLU A 10 -7.551 -6.502 2.370 1.00 0.73 C ATOM 139 O GLU A 10 -6.789 -5.847 3.080 1.00 0.75 O ATOM 140 CB GLU A 10 -10.079 -6.277 1.804 1.00 1.05 C ATOM 141 CG GLU A 10 -10.610 -6.265 3.234 1.00 1.19 C ATOM 142 CD GLU A 10 -10.408 -4.939 3.935 1.00 1.87 C ATOM 143 OE1 GLU A 10 -9.258 -4.454 3.925 1.00 3.02 O ATOM 144 OE2 GLU A 10 -11.348 -4.419 4.579 1.00 2.75 O ATOM 0 H GLU A 10 -9.203 -6.553 -0.318 1.00 0.72 H new ATOM 0 HA GLU A 10 -8.554 -4.771 1.797 1.00 0.79 H new ATOM 0 HB2 GLU A 10 -10.739 -5.649 1.206 1.00 1.05 H new ATOM 0 HB3 GLU A 10 -10.180 -7.295 1.427 1.00 1.05 H new ATOM 0 HG2 GLU A 10 -11.674 -6.504 3.222 1.00 1.19 H new ATOM 0 HG3 GLU A 10 -10.114 -7.050 3.805 1.00 1.19 H new ATOM 151 N GLU A 11 -7.407 -7.817 2.208 1.00 0.75 N ATOM 152 CA GLU A 11 -6.381 -8.624 2.854 1.00 0.79 C ATOM 153 C GLU A 11 -4.997 -7.972 2.756 1.00 0.71 C ATOM 154 O GLU A 11 -4.219 -7.985 3.714 1.00 0.72 O ATOM 155 CB GLU A 11 -6.394 -10.022 2.219 1.00 0.90 C ATOM 156 CG GLU A 11 -5.673 -11.073 3.072 1.00 1.05 C ATOM 157 CD GLU A 11 -5.809 -12.478 2.489 1.00 2.15 C ATOM 158 OE1 GLU A 11 -6.525 -12.617 1.474 1.00 3.38 O ATOM 159 OE2 GLU A 11 -5.196 -13.392 3.081 1.00 3.07 O ATOM 0 H GLU A 11 -8.022 -8.363 1.605 1.00 0.75 H new ATOM 0 HA GLU A 11 -6.600 -8.704 3.919 1.00 0.79 H new ATOM 0 HB2 GLU A 11 -7.426 -10.335 2.063 1.00 0.90 H new ATOM 0 HB3 GLU A 11 -5.923 -9.974 1.237 1.00 0.90 H new ATOM 0 HG2 GLU A 11 -4.617 -10.814 3.150 1.00 1.05 H new ATOM 0 HG3 GLU A 11 -6.080 -11.060 4.083 1.00 1.05 H new ATOM 166 N SER A 12 -4.678 -7.362 1.612 1.00 0.70 N ATOM 167 CA SER A 12 -3.368 -6.754 1.456 1.00 0.70 C ATOM 168 C SER A 12 -3.231 -5.534 2.365 1.00 0.63 C ATOM 169 O SER A 12 -2.185 -5.291 2.970 1.00 0.67 O ATOM 170 CB SER A 12 -3.119 -6.397 -0.012 1.00 0.78 C ATOM 171 OG SER A 12 -3.323 -7.521 -0.845 1.00 1.96 O ATOM 0 H SER A 12 -5.295 -7.280 0.804 1.00 0.70 H new ATOM 0 HA SER A 12 -2.606 -7.473 1.757 1.00 0.70 H new ATOM 0 HB2 SER A 12 -3.787 -5.590 -0.313 1.00 0.78 H new ATOM 0 HB3 SER A 12 -2.100 -6.029 -0.133 1.00 0.78 H new ATOM 0 HG SER A 12 -4.276 -7.747 -0.862 1.00 1.96 H new ATOM 177 N ILE A 13 -4.307 -4.763 2.485 1.00 0.56 N ATOM 178 CA ILE A 13 -4.333 -3.599 3.347 1.00 0.50 C ATOM 179 C ILE A 13 -4.212 -4.059 4.797 1.00 0.48 C ATOM 180 O ILE A 13 -3.402 -3.499 5.537 1.00 0.48 O ATOM 181 CB ILE A 13 -5.588 -2.775 3.035 1.00 0.52 C ATOM 182 CG1 ILE A 13 -5.435 -2.234 1.605 1.00 0.71 C ATOM 183 CG2 ILE A 13 -5.846 -1.600 3.988 1.00 0.48 C ATOM 184 CD1 ILE A 13 -6.796 -2.036 0.975 1.00 0.54 C ATOM 0 H ILE A 13 -5.181 -4.932 1.986 1.00 0.56 H new ATOM 0 HA ILE A 13 -3.488 -2.934 3.169 1.00 0.50 H new ATOM 0 HB ILE A 13 -6.445 -3.438 3.156 1.00 0.52 H new ATOM 0 HG12 ILE A 13 -4.893 -1.289 1.622 1.00 0.71 H new ATOM 0 HG13 ILE A 13 -4.846 -2.929 1.006 1.00 0.71 H new ATOM 0 HG21 ILE A 13 -6.754 -1.079 3.686 1.00 0.48 H new ATOM 0 HG22 ILE A 13 -5.964 -1.975 5.005 1.00 0.48 H new ATOM 0 HG23 ILE A 13 -5.003 -0.910 3.952 1.00 0.48 H new ATOM 0 HD11 ILE A 13 -6.676 -1.652 -0.038 1.00 0.54 H new ATOM 0 HD12 ILE A 13 -7.324 -2.989 0.942 1.00 0.54 H new ATOM 0 HD13 ILE A 13 -7.371 -1.324 1.567 1.00 0.54 H new ATOM 196 N GLU A 14 -4.955 -5.107 5.179 1.00 0.51 N ATOM 197 CA GLU A 14 -4.808 -5.749 6.483 1.00 0.58 C ATOM 198 C GLU A 14 -3.338 -6.098 6.745 1.00 0.62 C ATOM 199 O GLU A 14 -2.791 -5.801 7.808 1.00 0.65 O ATOM 200 CB GLU A 14 -5.703 -6.990 6.612 1.00 0.79 C ATOM 201 CG GLU A 14 -7.196 -6.678 6.431 1.00 1.77 C ATOM 202 CD GLU A 14 -7.818 -5.889 7.587 1.00 3.40 C ATOM 203 OE1 GLU A 14 -7.079 -5.495 8.513 1.00 3.69 O ATOM 204 OE2 GLU A 14 -9.035 -5.609 7.510 1.00 4.80 O ATOM 0 H GLU A 14 -5.673 -5.530 4.590 1.00 0.51 H new ATOM 0 HA GLU A 14 -5.136 -5.039 7.242 1.00 0.58 H new ATOM 0 HB2 GLU A 14 -5.400 -7.728 5.869 1.00 0.79 H new ATOM 0 HB3 GLU A 14 -5.549 -7.442 7.592 1.00 0.79 H new ATOM 0 HG2 GLU A 14 -7.328 -6.113 5.508 1.00 1.77 H new ATOM 0 HG3 GLU A 14 -7.740 -7.615 6.312 1.00 1.77 H new ATOM 211 N THR A 15 -2.689 -6.702 5.748 1.00 0.65 N ATOM 212 CA THR A 15 -1.282 -7.067 5.826 1.00 0.72 C ATOM 213 C THR A 15 -0.426 -5.836 6.139 1.00 0.69 C ATOM 214 O THR A 15 0.362 -5.855 7.087 1.00 0.74 O ATOM 215 CB THR A 15 -0.811 -7.804 4.563 1.00 0.80 C ATOM 216 OG1 THR A 15 -1.658 -8.907 4.309 1.00 0.96 O ATOM 217 CG2 THR A 15 0.611 -8.341 4.759 1.00 0.85 C ATOM 0 H THR A 15 -3.130 -6.951 4.863 1.00 0.65 H new ATOM 0 HA THR A 15 -1.158 -7.771 6.649 1.00 0.72 H new ATOM 0 HB THR A 15 -0.835 -7.101 3.731 1.00 0.80 H new ATOM 0 HG1 THR A 15 -2.533 -8.585 4.008 1.00 0.96 H new ATOM 0 HG21 THR A 15 0.931 -8.861 3.856 1.00 0.85 H new ATOM 0 HG22 THR A 15 1.289 -7.511 4.960 1.00 0.85 H new ATOM 0 HG23 THR A 15 0.626 -9.033 5.601 1.00 0.85 H new ATOM 225 N VAL A 16 -0.565 -4.747 5.373 1.00 0.65 N ATOM 226 CA VAL A 16 0.174 -3.532 5.667 1.00 0.65 C ATOM 227 C VAL A 16 -0.097 -3.066 7.101 1.00 0.64 C ATOM 228 O VAL A 16 0.842 -2.868 7.872 1.00 0.69 O ATOM 229 CB VAL A 16 -0.163 -2.431 4.653 1.00 0.64 C ATOM 230 CG1 VAL A 16 0.495 -1.135 5.123 1.00 0.65 C ATOM 231 CG2 VAL A 16 0.322 -2.755 3.236 1.00 0.74 C ATOM 0 H VAL A 16 -1.176 -4.690 4.558 1.00 0.65 H new ATOM 0 HA VAL A 16 1.239 -3.750 5.582 1.00 0.65 H new ATOM 0 HB VAL A 16 -1.248 -2.340 4.604 1.00 0.64 H new ATOM 0 HG11 VAL A 16 0.270 -0.336 4.417 1.00 0.65 H new ATOM 0 HG12 VAL A 16 0.111 -0.868 6.108 1.00 0.65 H new ATOM 0 HG13 VAL A 16 1.574 -1.275 5.180 1.00 0.65 H new ATOM 0 HG21 VAL A 16 0.054 -1.939 2.564 1.00 0.74 H new ATOM 0 HG22 VAL A 16 1.405 -2.880 3.242 1.00 0.74 H new ATOM 0 HG23 VAL A 16 -0.148 -3.677 2.893 1.00 0.74 H new ATOM 241 N VAL A 17 -1.365 -2.842 7.462 1.00 0.60 N ATOM 242 CA VAL A 17 -1.666 -2.265 8.767 1.00 0.62 C ATOM 243 C VAL A 17 -1.127 -3.138 9.907 1.00 0.68 C ATOM 244 O VAL A 17 -0.563 -2.601 10.861 1.00 0.81 O ATOM 245 CB VAL A 17 -3.141 -1.865 8.939 1.00 0.57 C ATOM 246 CG1 VAL A 17 -3.549 -0.817 7.895 1.00 0.60 C ATOM 247 CG2 VAL A 17 -4.080 -3.066 8.866 1.00 0.55 C ATOM 0 H VAL A 17 -2.178 -3.047 6.882 1.00 0.60 H new ATOM 0 HA VAL A 17 -1.127 -1.319 8.820 1.00 0.62 H new ATOM 0 HB VAL A 17 -3.233 -1.433 9.936 1.00 0.57 H new ATOM 0 HG11 VAL A 17 -4.596 -0.550 8.037 1.00 0.60 H new ATOM 0 HG12 VAL A 17 -2.929 0.072 8.011 1.00 0.60 H new ATOM 0 HG13 VAL A 17 -3.412 -1.227 6.895 1.00 0.60 H new ATOM 0 HG21 VAL A 17 -5.109 -2.731 8.993 1.00 0.55 H new ATOM 0 HG22 VAL A 17 -3.974 -3.553 7.896 1.00 0.55 H new ATOM 0 HG23 VAL A 17 -3.828 -3.773 9.656 1.00 0.55 H new ATOM 257 N THR A 18 -1.245 -4.471 9.815 1.00 0.65 N ATOM 258 CA THR A 18 -0.659 -5.323 10.842 1.00 0.77 C ATOM 259 C THR A 18 0.866 -5.213 10.825 1.00 0.81 C ATOM 260 O THR A 18 1.457 -5.136 11.895 1.00 0.90 O ATOM 261 CB THR A 18 -1.165 -6.776 10.804 1.00 0.82 C ATOM 262 OG1 THR A 18 -0.905 -7.412 12.043 1.00 1.60 O ATOM 263 CG2 THR A 18 -0.556 -7.624 9.689 1.00 1.11 C ATOM 0 H THR A 18 -1.726 -4.964 9.063 1.00 0.65 H new ATOM 0 HA THR A 18 -1.006 -4.949 11.805 1.00 0.77 H new ATOM 0 HB THR A 18 -2.234 -6.706 10.605 1.00 0.82 H new ATOM 0 HG1 THR A 18 -1.231 -8.336 12.011 1.00 1.60 H new ATOM 0 HG21 THR A 18 -0.966 -8.633 9.734 1.00 1.11 H new ATOM 0 HG22 THR A 18 -0.793 -7.179 8.723 1.00 1.11 H new ATOM 0 HG23 THR A 18 0.526 -7.666 9.814 1.00 1.11 H new ATOM 271 N THR A 19 1.513 -5.188 9.651 1.00 0.78 N ATOM 272 CA THR A 19 2.974 -5.172 9.548 1.00 0.85 C ATOM 273 C THR A 19 3.631 -4.142 10.482 1.00 0.82 C ATOM 274 O THR A 19 4.650 -4.440 11.102 1.00 0.98 O ATOM 275 CB THR A 19 3.392 -4.994 8.082 1.00 0.96 C ATOM 276 OG1 THR A 19 3.053 -6.151 7.350 1.00 1.46 O ATOM 277 CG2 THR A 19 4.893 -4.767 7.908 1.00 1.09 C ATOM 0 H THR A 19 1.037 -5.178 8.749 1.00 0.78 H new ATOM 0 HA THR A 19 3.345 -6.137 9.894 1.00 0.85 H new ATOM 0 HB THR A 19 2.865 -4.111 7.721 1.00 0.96 H new ATOM 0 HG1 THR A 19 2.089 -6.156 7.174 1.00 1.46 H new ATOM 0 HG21 THR A 19 5.123 -4.649 6.849 1.00 1.09 H new ATOM 0 HG22 THR A 19 5.190 -3.867 8.446 1.00 1.09 H new ATOM 0 HG23 THR A 19 5.439 -5.623 8.304 1.00 1.09 H new ATOM 285 N PHE A 20 3.057 -2.941 10.625 1.00 0.74 N ATOM 286 CA PHE A 20 3.578 -1.951 11.571 1.00 0.84 C ATOM 287 C PHE A 20 3.738 -2.504 12.993 1.00 1.02 C ATOM 288 O PHE A 20 4.698 -2.154 13.680 1.00 1.18 O ATOM 289 CB PHE A 20 2.673 -0.720 11.610 1.00 0.86 C ATOM 290 CG PHE A 20 2.566 -0.003 10.286 1.00 0.72 C ATOM 291 CD1 PHE A 20 3.658 0.726 9.785 1.00 2.23 C ATOM 292 CD2 PHE A 20 1.346 -0.004 9.590 1.00 2.08 C ATOM 293 CE1 PHE A 20 3.515 1.479 8.610 1.00 2.11 C ATOM 294 CE2 PHE A 20 1.230 0.676 8.369 1.00 2.25 C ATOM 295 CZ PHE A 20 2.310 1.432 7.886 1.00 0.87 C ATOM 0 H PHE A 20 2.237 -2.634 10.101 1.00 0.74 H new ATOM 0 HA PHE A 20 4.570 -1.680 11.210 1.00 0.84 H new ATOM 0 HB2 PHE A 20 1.676 -1.023 11.931 1.00 0.86 H new ATOM 0 HB3 PHE A 20 3.052 -0.025 12.360 1.00 0.86 H new ATOM 0 HD1 PHE A 20 4.605 0.707 10.303 1.00 2.23 H new ATOM 0 HD2 PHE A 20 0.495 -0.530 9.996 1.00 2.08 H new ATOM 0 HE1 PHE A 20 4.331 2.095 8.261 1.00 2.11 H new ATOM 0 HE2 PHE A 20 0.313 0.618 7.802 1.00 2.25 H new ATOM 0 HZ PHE A 20 2.216 1.977 6.959 1.00 0.87 H new ATOM 305 N PHE A 21 2.786 -3.325 13.439 1.00 1.04 N ATOM 306 CA PHE A 21 2.824 -4.016 14.722 1.00 1.23 C ATOM 307 C PHE A 21 3.723 -5.245 14.580 1.00 1.33 C ATOM 308 O PHE A 21 4.713 -5.389 15.300 1.00 1.74 O ATOM 309 CB PHE A 21 1.401 -4.426 15.145 1.00 1.20 C ATOM 310 CG PHE A 21 0.557 -3.334 15.785 1.00 1.95 C ATOM 311 CD1 PHE A 21 0.419 -2.070 15.179 1.00 3.82 C ATOM 312 CD2 PHE A 21 -0.168 -3.617 16.959 1.00 2.20 C ATOM 313 CE1 PHE A 21 -0.360 -1.074 15.792 1.00 5.24 C ATOM 314 CE2 PHE A 21 -0.954 -2.625 17.566 1.00 3.47 C ATOM 315 CZ PHE A 21 -1.045 -1.351 16.987 1.00 4.88 C ATOM 0 H PHE A 21 1.945 -3.531 12.900 1.00 1.04 H new ATOM 0 HA PHE A 21 3.224 -3.358 15.493 1.00 1.23 H new ATOM 0 HB2 PHE A 21 0.874 -4.797 14.266 1.00 1.20 H new ATOM 0 HB3 PHE A 21 1.477 -5.257 15.846 1.00 1.20 H new ATOM 0 HD1 PHE A 21 0.913 -1.866 14.241 1.00 3.82 H new ATOM 0 HD2 PHE A 21 -0.119 -4.604 17.395 1.00 2.20 H new ATOM 0 HE1 PHE A 21 -0.432 -0.094 15.344 1.00 5.24 H new ATOM 0 HE2 PHE A 21 -1.489 -2.843 18.479 1.00 3.47 H new ATOM 0 HZ PHE A 21 -1.641 -0.584 17.459 1.00 4.88 H new ATOM 325 N THR A 22 3.402 -6.102 13.611 1.00 1.21 N ATOM 326 CA THR A 22 4.000 -7.405 13.385 1.00 1.66 C ATOM 327 C THR A 22 5.313 -7.212 12.618 1.00 1.91 C ATOM 328 O THR A 22 5.490 -7.699 11.506 1.00 2.29 O ATOM 329 CB THR A 22 2.981 -8.246 12.589 1.00 2.19 C ATOM 330 OG1 THR A 22 1.661 -7.962 13.026 1.00 3.07 O ATOM 331 CG2 THR A 22 3.247 -9.746 12.740 1.00 2.40 C ATOM 0 H THR A 22 2.676 -5.887 12.928 1.00 1.21 H new ATOM 0 HA THR A 22 4.234 -7.922 14.316 1.00 1.66 H new ATOM 0 HB THR A 22 3.090 -7.979 11.538 1.00 2.19 H new ATOM 0 HG1 THR A 22 1.082 -7.820 12.248 1.00 3.07 H new ATOM 0 HG21 THR A 22 2.509 -10.306 12.165 1.00 2.40 H new ATOM 0 HG22 THR A 22 4.246 -9.977 12.371 1.00 2.40 H new ATOM 0 HG23 THR A 22 3.175 -10.024 13.791 1.00 2.40 H new ATOM 478 N ASP A 31 1.466 3.836 14.606 1.00 1.49 N ATOM 479 CA ASP A 31 1.008 3.989 13.222 1.00 1.41 C ATOM 480 C ASP A 31 2.114 3.724 12.205 1.00 1.39 C ATOM 481 O ASP A 31 1.916 2.929 11.293 1.00 2.05 O ATOM 482 CB ASP A 31 0.379 5.376 13.015 1.00 1.48 C ATOM 483 CG ASP A 31 -1.024 5.444 13.604 1.00 1.95 C ATOM 484 OD1 ASP A 31 -1.921 4.781 13.030 1.00 2.90 O ATOM 485 OD2 ASP A 31 -1.177 6.093 14.657 1.00 2.72 O ATOM 0 HA ASP A 31 0.245 3.230 13.048 1.00 1.41 H new ATOM 0 HB2 ASP A 31 1.008 6.135 13.480 1.00 1.48 H new ATOM 0 HB3 ASP A 31 0.339 5.604 11.950 1.00 1.48 H new ATOM 490 N SER A 32 3.265 4.387 12.335 1.00 1.04 N ATOM 491 CA SER A 32 4.453 4.104 11.542 1.00 0.96 C ATOM 492 C SER A 32 5.678 4.574 12.332 1.00 0.91 C ATOM 493 O SER A 32 5.604 4.687 13.557 1.00 1.04 O ATOM 494 CB SER A 32 4.339 4.740 10.146 1.00 0.99 C ATOM 495 OG SER A 32 5.407 4.350 9.299 1.00 1.58 O ATOM 0 H SER A 32 3.395 5.145 13.005 1.00 1.04 H new ATOM 0 HA SER A 32 4.558 3.034 11.363 1.00 0.96 H new ATOM 0 HB2 SER A 32 3.391 4.451 9.692 1.00 0.99 H new ATOM 0 HB3 SER A 32 4.329 5.826 10.241 1.00 0.99 H new ATOM 0 HG SER A 32 5.065 4.186 8.395 1.00 1.58 H new ATOM 501 N LEU A 33 6.794 4.801 11.638 1.00 0.86 N ATOM 502 CA LEU A 33 8.083 5.155 12.217 1.00 0.85 C ATOM 503 C LEU A 33 8.307 6.674 12.127 1.00 0.84 C ATOM 504 O LEU A 33 7.358 7.432 11.934 1.00 1.03 O ATOM 505 CB LEU A 33 9.211 4.392 11.493 1.00 0.96 C ATOM 506 CG LEU A 33 9.057 2.882 11.248 1.00 1.08 C ATOM 507 CD1 LEU A 33 8.668 2.124 12.516 1.00 1.40 C ATOM 508 CD2 LEU A 33 8.111 2.523 10.097 1.00 1.32 C ATOM 0 H LEU A 33 6.822 4.740 10.620 1.00 0.86 H new ATOM 0 HA LEU A 33 8.092 4.871 13.269 1.00 0.85 H new ATOM 0 HB2 LEU A 33 9.360 4.868 10.524 1.00 0.96 H new ATOM 0 HB3 LEU A 33 10.127 4.540 12.065 1.00 0.96 H new ATOM 0 HG LEU A 33 10.051 2.558 10.941 1.00 1.08 H new ATOM 0 HD11 LEU A 33 8.572 1.062 12.290 1.00 1.40 H new ATOM 0 HD12 LEU A 33 9.438 2.265 13.275 1.00 1.40 H new ATOM 0 HD13 LEU A 33 7.717 2.503 12.889 1.00 1.40 H new ATOM 0 HD21 LEU A 33 8.060 1.439 9.993 1.00 1.32 H new ATOM 0 HD22 LEU A 33 7.116 2.914 10.308 1.00 1.32 H new ATOM 0 HD23 LEU A 33 8.483 2.960 9.170 1.00 1.32 H new ATOM 520 N SER A 34 9.566 7.116 12.218 1.00 0.77 N ATOM 521 CA SER A 34 9.994 8.440 11.777 1.00 0.79 C ATOM 522 C SER A 34 10.391 8.357 10.301 1.00 0.70 C ATOM 523 O SER A 34 10.489 7.265 9.742 1.00 0.70 O ATOM 524 CB SER A 34 11.133 8.956 12.664 1.00 0.91 C ATOM 525 OG SER A 34 10.753 8.865 14.023 1.00 1.66 O ATOM 0 H SER A 34 10.323 6.554 12.606 1.00 0.77 H new ATOM 0 HA SER A 34 9.179 9.158 11.873 1.00 0.79 H new ATOM 0 HB2 SER A 34 12.037 8.373 12.489 1.00 0.91 H new ATOM 0 HB3 SER A 34 11.366 9.990 12.409 1.00 0.91 H new ATOM 0 HG SER A 34 11.482 9.193 14.589 1.00 1.66 H new ATOM 531 N VAL A 35 10.588 9.497 9.642 1.00 0.67 N ATOM 532 CA VAL A 35 10.598 9.532 8.183 1.00 0.68 C ATOM 533 C VAL A 35 11.855 8.877 7.571 1.00 0.64 C ATOM 534 O VAL A 35 11.742 7.941 6.778 1.00 0.68 O ATOM 535 CB VAL A 35 10.380 10.974 7.717 1.00 0.80 C ATOM 536 CG1 VAL A 35 10.323 11.061 6.199 1.00 0.85 C ATOM 537 CG2 VAL A 35 9.091 11.600 8.266 1.00 0.89 C ATOM 0 H VAL A 35 10.741 10.400 10.091 1.00 0.67 H new ATOM 0 HA VAL A 35 9.775 8.921 7.813 1.00 0.68 H new ATOM 0 HB VAL A 35 11.234 11.528 8.107 1.00 0.80 H new ATOM 0 HG11 VAL A 35 10.167 12.097 5.900 1.00 0.85 H new ATOM 0 HG12 VAL A 35 11.261 10.699 5.778 1.00 0.85 H new ATOM 0 HG13 VAL A 35 9.500 10.449 5.830 1.00 0.85 H new ATOM 0 HG21 VAL A 35 8.997 12.622 7.898 1.00 0.89 H new ATOM 0 HG22 VAL A 35 8.233 11.015 7.935 1.00 0.89 H new ATOM 0 HG23 VAL A 35 9.126 11.609 9.355 1.00 0.89 H new ATOM 547 N ASN A 36 13.065 9.356 7.889 1.00 0.68 N ATOM 548 CA ASN A 36 14.270 8.748 7.308 1.00 0.79 C ATOM 549 C ASN A 36 14.447 7.322 7.830 1.00 0.68 C ATOM 550 O ASN A 36 14.805 6.432 7.067 1.00 0.64 O ATOM 551 CB ASN A 36 15.561 9.562 7.515 1.00 1.16 C ATOM 552 CG ASN A 36 16.366 9.653 6.213 1.00 2.33 C ATOM 553 OD1 ASN A 36 16.582 8.652 5.537 1.00 3.17 O ATOM 554 ND2 ASN A 36 16.780 10.851 5.801 1.00 2.71 N ATOM 0 H ASN A 36 13.234 10.136 8.524 1.00 0.68 H new ATOM 0 HA ASN A 36 14.104 8.736 6.231 1.00 0.79 H new ATOM 0 HB2 ASN A 36 15.312 10.564 7.864 1.00 1.16 H new ATOM 0 HB3 ASN A 36 16.169 9.096 8.291 1.00 1.16 H new ATOM 0 HD21 ASN A 36 17.281 10.941 4.917 1.00 2.71 H new ATOM 0 HD22 ASN A 36 16.596 11.678 6.370 1.00 2.71 H new ATOM 561 N GLU A 37 14.136 7.107 9.115 1.00 0.73 N ATOM 562 CA GLU A 37 14.034 5.781 9.721 1.00 0.79 C ATOM 563 C GLU A 37 13.242 4.873 8.780 1.00 0.70 C ATOM 564 O GLU A 37 13.768 3.886 8.274 1.00 0.72 O ATOM 565 CB GLU A 37 13.396 5.925 11.116 1.00 0.95 C ATOM 566 CG GLU A 37 12.778 4.654 11.722 1.00 1.41 C ATOM 567 CD GLU A 37 13.759 3.539 12.050 1.00 2.09 C ATOM 568 OE1 GLU A 37 14.978 3.796 11.968 1.00 3.03 O ATOM 569 OE2 GLU A 37 13.252 2.450 12.395 1.00 3.36 O ATOM 0 H GLU A 37 13.946 7.865 9.770 1.00 0.73 H new ATOM 0 HA GLU A 37 15.011 5.320 9.862 1.00 0.79 H new ATOM 0 HB2 GLU A 37 14.157 6.295 11.803 1.00 0.95 H new ATOM 0 HB3 GLU A 37 12.620 6.688 11.059 1.00 0.95 H new ATOM 0 HG2 GLU A 37 12.249 4.928 12.635 1.00 1.41 H new ATOM 0 HG3 GLU A 37 12.034 4.266 11.026 1.00 1.41 H new ATOM 576 N PHE A 38 11.995 5.246 8.477 1.00 0.67 N ATOM 577 CA PHE A 38 11.186 4.554 7.485 1.00 0.63 C ATOM 578 C PHE A 38 11.982 4.287 6.202 1.00 0.57 C ATOM 579 O PHE A 38 12.029 3.140 5.764 1.00 0.59 O ATOM 580 CB PHE A 38 9.885 5.322 7.213 1.00 0.64 C ATOM 581 CG PHE A 38 9.303 5.073 5.838 1.00 0.66 C ATOM 582 CD1 PHE A 38 8.591 3.891 5.584 1.00 2.03 C ATOM 583 CD2 PHE A 38 9.649 5.921 4.769 1.00 2.18 C ATOM 584 CE1 PHE A 38 8.142 3.608 4.284 1.00 2.02 C ATOM 585 CE2 PHE A 38 9.339 5.551 3.450 1.00 2.32 C ATOM 586 CZ PHE A 38 8.551 4.414 3.210 1.00 1.01 C ATOM 0 H PHE A 38 11.523 6.037 8.916 1.00 0.67 H new ATOM 0 HA PHE A 38 10.910 3.580 7.889 1.00 0.63 H new ATOM 0 HB2 PHE A 38 9.147 5.045 7.965 1.00 0.64 H new ATOM 0 HB3 PHE A 38 10.073 6.389 7.330 1.00 0.64 H new ATOM 0 HD1 PHE A 38 8.388 3.199 6.388 1.00 2.03 H new ATOM 0 HD2 PHE A 38 10.153 6.856 4.963 1.00 2.18 H new ATOM 0 HE1 PHE A 38 7.482 2.771 4.111 1.00 2.02 H new ATOM 0 HE2 PHE A 38 9.706 6.140 2.622 1.00 2.32 H new ATOM 0 HZ PHE A 38 8.260 4.160 2.201 1.00 1.01 H new ATOM 596 N LYS A 39 12.599 5.312 5.598 1.00 0.57 N ATOM 597 CA LYS A 39 13.348 5.144 4.352 1.00 0.58 C ATOM 598 C LYS A 39 14.398 4.029 4.475 1.00 0.59 C ATOM 599 O LYS A 39 14.489 3.145 3.613 1.00 0.61 O ATOM 600 CB LYS A 39 13.985 6.466 3.893 1.00 0.69 C ATOM 601 CG LYS A 39 14.693 6.289 2.535 1.00 0.89 C ATOM 602 CD LYS A 39 16.199 6.565 2.663 1.00 1.48 C ATOM 603 CE LYS A 39 16.958 6.210 1.374 1.00 2.28 C ATOM 604 NZ LYS A 39 17.308 4.774 1.277 1.00 3.70 N ATOM 0 H LYS A 39 12.592 6.267 5.956 1.00 0.57 H new ATOM 0 HA LYS A 39 12.637 4.842 3.583 1.00 0.58 H new ATOM 0 HB2 LYS A 39 13.218 7.236 3.811 1.00 0.69 H new ATOM 0 HB3 LYS A 39 14.701 6.809 4.640 1.00 0.69 H new ATOM 0 HG2 LYS A 39 14.535 5.275 2.167 1.00 0.89 H new ATOM 0 HG3 LYS A 39 14.256 6.966 1.801 1.00 0.89 H new ATOM 0 HD2 LYS A 39 16.357 7.617 2.899 1.00 1.48 H new ATOM 0 HD3 LYS A 39 16.605 5.988 3.494 1.00 1.48 H new ATOM 0 HE2 LYS A 39 16.349 6.487 0.514 1.00 2.28 H new ATOM 0 HE3 LYS A 39 17.871 6.804 1.323 1.00 2.28 H new ATOM 0 HZ1 LYS A 39 17.663 4.567 0.322 1.00 3.70 H new ATOM 0 HZ2 LYS A 39 18.044 4.548 1.976 1.00 3.70 H new ATOM 0 HZ3 LYS A 39 16.463 4.197 1.465 1.00 3.70 H new ATOM 618 N GLU A 40 15.216 4.093 5.525 1.00 0.66 N ATOM 619 CA GLU A 40 16.251 3.108 5.786 1.00 0.75 C ATOM 620 C GLU A 40 15.635 1.728 6.036 1.00 0.75 C ATOM 621 O GLU A 40 16.138 0.727 5.531 1.00 0.86 O ATOM 622 CB GLU A 40 17.150 3.582 6.933 1.00 0.92 C ATOM 623 CG GLU A 40 17.910 4.854 6.519 1.00 0.95 C ATOM 624 CD GLU A 40 18.970 5.232 7.543 1.00 1.56 C ATOM 625 OE1 GLU A 40 19.912 4.423 7.691 1.00 2.19 O ATOM 626 OE2 GLU A 40 18.831 6.322 8.137 1.00 2.56 O ATOM 0 H GLU A 40 15.174 4.838 6.221 1.00 0.66 H new ATOM 0 HA GLU A 40 16.886 3.004 4.906 1.00 0.75 H new ATOM 0 HB2 GLU A 40 16.547 3.781 7.819 1.00 0.92 H new ATOM 0 HB3 GLU A 40 17.858 2.797 7.199 1.00 0.92 H new ATOM 0 HG2 GLU A 40 18.381 4.698 5.548 1.00 0.95 H new ATOM 0 HG3 GLU A 40 17.206 5.678 6.403 1.00 0.95 H new ATOM 633 N LEU A 41 14.521 1.657 6.760 1.00 0.69 N ATOM 634 CA LEU A 41 13.824 0.402 6.993 1.00 0.72 C ATOM 635 C LEU A 41 13.291 -0.182 5.675 1.00 0.66 C ATOM 636 O LEU A 41 13.624 -1.317 5.359 1.00 0.74 O ATOM 637 CB LEU A 41 12.767 0.562 8.097 1.00 0.79 C ATOM 638 CG LEU A 41 13.318 0.356 9.528 1.00 1.08 C ATOM 639 CD1 LEU A 41 13.453 -1.130 9.885 1.00 2.12 C ATOM 640 CD2 LEU A 41 14.671 1.027 9.810 1.00 2.50 C ATOM 0 H LEU A 41 14.080 2.466 7.198 1.00 0.69 H new ATOM 0 HA LEU A 41 14.526 -0.341 7.372 1.00 0.72 H new ATOM 0 HB2 LEU A 41 12.330 1.558 8.026 1.00 0.79 H new ATOM 0 HB3 LEU A 41 11.962 -0.152 7.922 1.00 0.79 H new ATOM 0 HG LEU A 41 12.568 0.844 10.151 1.00 1.08 H new ATOM 0 HD11 LEU A 41 13.843 -1.227 10.898 1.00 2.12 H new ATOM 0 HD12 LEU A 41 12.476 -1.609 9.825 1.00 2.12 H new ATOM 0 HD13 LEU A 41 14.136 -1.612 9.186 1.00 2.12 H new ATOM 0 HD21 LEU A 41 14.971 0.824 10.838 1.00 2.50 H new ATOM 0 HD22 LEU A 41 15.423 0.630 9.128 1.00 2.50 H new ATOM 0 HD23 LEU A 41 14.581 2.103 9.664 1.00 2.50 H new ATOM 652 N VAL A 42 12.532 0.546 4.843 1.00 0.57 N ATOM 653 CA VAL A 42 12.108 -0.024 3.555 1.00 0.53 C ATOM 654 C VAL A 42 13.338 -0.457 2.736 1.00 0.58 C ATOM 655 O VAL A 42 13.381 -1.576 2.230 1.00 0.66 O ATOM 656 CB VAL A 42 11.177 0.886 2.726 1.00 0.53 C ATOM 657 CG1 VAL A 42 9.799 0.966 3.375 1.00 1.41 C ATOM 658 CG2 VAL A 42 11.701 2.293 2.431 1.00 1.41 C ATOM 0 H VAL A 42 12.209 1.496 5.027 1.00 0.57 H new ATOM 0 HA VAL A 42 11.501 -0.897 3.797 1.00 0.53 H new ATOM 0 HB VAL A 42 11.124 0.402 1.751 1.00 0.53 H new ATOM 0 HG11 VAL A 42 9.153 1.611 2.779 1.00 1.41 H new ATOM 0 HG12 VAL A 42 9.364 -0.032 3.430 1.00 1.41 H new ATOM 0 HG13 VAL A 42 9.894 1.376 4.380 1.00 1.41 H new ATOM 0 HG21 VAL A 42 10.964 2.840 1.843 1.00 1.41 H new ATOM 0 HG22 VAL A 42 11.880 2.819 3.369 1.00 1.41 H new ATOM 0 HG23 VAL A 42 12.633 2.224 1.870 1.00 1.41 H new ATOM 668 N THR A 43 14.357 0.407 2.645 1.00 0.63 N ATOM 669 CA THR A 43 15.626 0.065 2.004 1.00 0.82 C ATOM 670 C THR A 43 16.109 -1.311 2.474 1.00 0.84 C ATOM 671 O THR A 43 16.403 -2.190 1.666 1.00 0.93 O ATOM 672 CB THR A 43 16.646 1.172 2.313 1.00 1.14 C ATOM 673 OG1 THR A 43 16.272 2.349 1.618 1.00 2.39 O ATOM 674 CG2 THR A 43 18.099 0.750 2.067 1.00 1.09 C ATOM 0 H THR A 43 14.322 1.358 3.013 1.00 0.63 H new ATOM 0 HA THR A 43 15.499 0.001 0.923 1.00 0.82 H new ATOM 0 HB THR A 43 16.621 1.379 3.383 1.00 1.14 H new ATOM 0 HG1 THR A 43 15.529 2.783 2.086 1.00 2.39 H new ATOM 0 HG21 THR A 43 18.764 1.580 2.306 1.00 1.09 H new ATOM 0 HG22 THR A 43 18.342 -0.103 2.700 1.00 1.09 H new ATOM 0 HG23 THR A 43 18.225 0.473 1.020 1.00 1.09 H new ATOM 682 N GLN A 44 16.186 -1.485 3.791 1.00 0.85 N ATOM 683 CA GLN A 44 16.641 -2.704 4.426 1.00 0.96 C ATOM 684 C GLN A 44 15.730 -3.888 4.072 1.00 0.93 C ATOM 685 O GLN A 44 16.211 -4.977 3.766 1.00 1.05 O ATOM 686 CB GLN A 44 16.658 -2.449 5.936 1.00 1.03 C ATOM 687 CG GLN A 44 17.470 -3.498 6.677 1.00 1.45 C ATOM 688 CD GLN A 44 17.097 -3.464 8.155 1.00 2.20 C ATOM 689 OE1 GLN A 44 16.207 -4.192 8.585 1.00 3.17 O ATOM 690 NE2 GLN A 44 17.729 -2.591 8.933 1.00 2.85 N ATOM 0 H GLN A 44 15.925 -0.758 4.458 1.00 0.85 H new ATOM 0 HA GLN A 44 17.638 -2.968 4.074 1.00 0.96 H new ATOM 0 HB2 GLN A 44 17.074 -1.461 6.133 1.00 1.03 H new ATOM 0 HB3 GLN A 44 15.636 -2.446 6.315 1.00 1.03 H new ATOM 0 HG2 GLN A 44 17.275 -4.487 6.262 1.00 1.45 H new ATOM 0 HG3 GLN A 44 18.536 -3.305 6.553 1.00 1.45 H new ATOM 0 HE21 GLN A 44 18.464 -2.001 8.544 1.00 2.85 H new ATOM 0 HE22 GLN A 44 17.479 -2.512 9.919 1.00 2.85 H new ATOM 699 N GLN A 45 14.416 -3.676 4.151 1.00 0.83 N ATOM 700 CA GLN A 45 13.395 -4.696 3.972 1.00 0.85 C ATOM 701 C GLN A 45 13.311 -5.188 2.540 1.00 0.86 C ATOM 702 O GLN A 45 12.854 -6.313 2.350 1.00 0.98 O ATOM 703 CB GLN A 45 12.022 -4.149 4.365 1.00 0.83 C ATOM 704 CG GLN A 45 11.706 -4.275 5.866 1.00 0.88 C ATOM 705 CD GLN A 45 12.781 -3.819 6.855 1.00 1.06 C ATOM 706 OE1 GLN A 45 12.620 -2.785 7.492 1.00 2.11 O ATOM 707 NE2 GLN A 45 13.833 -4.608 7.062 1.00 1.65 N ATOM 0 H GLN A 45 14.025 -2.755 4.349 1.00 0.83 H new ATOM 0 HA GLN A 45 13.680 -5.530 4.613 1.00 0.85 H new ATOM 0 HB2 GLN A 45 11.965 -3.099 4.079 1.00 0.83 H new ATOM 0 HB3 GLN A 45 11.256 -4.676 3.797 1.00 0.83 H new ATOM 0 HG2 GLN A 45 10.799 -3.704 6.068 1.00 0.88 H new ATOM 0 HG3 GLN A 45 11.478 -5.320 6.075 1.00 0.88 H new ATOM 0 HE21 GLN A 45 13.944 -5.464 6.518 1.00 1.65 H new ATOM 0 HE22 GLN A 45 14.528 -4.357 7.765 1.00 1.65 H new ATOM 716 N LEU A 46 13.682 -4.352 1.564 1.00 0.81 N ATOM 717 CA LEU A 46 13.510 -4.655 0.152 1.00 0.82 C ATOM 718 C LEU A 46 14.829 -4.991 -0.576 1.00 0.84 C ATOM 719 O LEU A 46 15.139 -4.345 -1.584 1.00 1.09 O ATOM 720 CB LEU A 46 12.770 -3.476 -0.510 1.00 0.88 C ATOM 721 CG LEU A 46 11.264 -3.424 -0.184 1.00 1.00 C ATOM 722 CD1 LEU A 46 10.870 -2.258 0.721 1.00 1.25 C ATOM 723 CD2 LEU A 46 10.458 -3.308 -1.486 1.00 1.39 C ATOM 0 H LEU A 46 14.111 -3.444 1.740 1.00 0.81 H new ATOM 0 HA LEU A 46 12.916 -5.565 0.068 1.00 0.82 H new ATOM 0 HB2 LEU A 46 13.234 -2.543 -0.190 1.00 0.88 H new ATOM 0 HB3 LEU A 46 12.896 -3.541 -1.591 1.00 0.88 H new ATOM 0 HG LEU A 46 11.042 -4.347 0.351 1.00 1.00 H new ATOM 0 HD11 LEU A 46 9.796 -2.288 0.906 1.00 1.25 H new ATOM 0 HD12 LEU A 46 11.404 -2.336 1.668 1.00 1.25 H new ATOM 0 HD13 LEU A 46 11.129 -1.317 0.235 1.00 1.25 H new ATOM 0 HD21 LEU A 46 9.394 -3.271 -1.253 1.00 1.39 H new ATOM 0 HD22 LEU A 46 10.746 -2.398 -2.012 1.00 1.39 H new ATOM 0 HD23 LEU A 46 10.662 -4.172 -2.118 1.00 1.39 H new ATOM 735 N PRO A 47 15.596 -6.029 -0.182 1.00 0.87 N ATOM 736 CA PRO A 47 16.904 -6.334 -0.757 1.00 0.94 C ATOM 737 C PRO A 47 16.799 -7.041 -2.121 1.00 0.96 C ATOM 738 O PRO A 47 17.548 -7.980 -2.395 1.00 1.24 O ATOM 739 CB PRO A 47 17.579 -7.228 0.291 1.00 1.20 C ATOM 740 CG PRO A 47 16.394 -8.049 0.789 1.00 1.29 C ATOM 741 CD PRO A 47 15.305 -6.986 0.874 1.00 1.08 C ATOM 0 HA PRO A 47 17.473 -5.428 -0.965 1.00 0.94 H new ATOM 0 HB2 PRO A 47 18.359 -7.853 -0.143 1.00 1.20 H new ATOM 0 HB3 PRO A 47 18.042 -6.648 1.089 1.00 1.20 H new ATOM 0 HG2 PRO A 47 16.132 -8.851 0.099 1.00 1.29 H new ATOM 0 HG3 PRO A 47 16.592 -8.512 1.756 1.00 1.29 H new ATOM 0 HD2 PRO A 47 14.318 -7.427 0.739 1.00 1.08 H new ATOM 0 HD3 PRO A 47 15.307 -6.502 1.851 1.00 1.08 H new ATOM 749 N HIS A 48 15.888 -6.598 -2.989 1.00 0.99 N ATOM 750 CA HIS A 48 15.826 -6.988 -4.388 1.00 1.10 C ATOM 751 C HIS A 48 16.816 -6.163 -5.224 1.00 1.18 C ATOM 752 O HIS A 48 18.027 -6.368 -5.121 1.00 2.24 O ATOM 753 CB HIS A 48 14.372 -7.043 -4.891 1.00 1.30 C ATOM 754 CG HIS A 48 13.509 -5.800 -4.830 1.00 2.21 C ATOM 755 ND1 HIS A 48 13.644 -4.693 -4.017 1.00 4.11 N ATOM 756 CD2 HIS A 48 12.336 -5.650 -5.523 1.00 2.84 C ATOM 757 CE1 HIS A 48 12.579 -3.904 -4.239 1.00 5.51 C ATOM 758 NE2 HIS A 48 11.743 -4.443 -5.147 1.00 4.72 N ATOM 0 H HIS A 48 15.155 -5.940 -2.725 1.00 0.99 H new ATOM 0 HA HIS A 48 16.169 -8.015 -4.510 1.00 1.10 H new ATOM 0 HB2 HIS A 48 14.399 -7.370 -5.931 1.00 1.30 H new ATOM 0 HB3 HIS A 48 13.861 -7.822 -4.325 1.00 1.30 H new ATOM 0 HD1 HIS A 48 14.409 -4.508 -3.369 1.00 4.11 H new ATOM 0 HD2 HIS A 48 11.936 -6.350 -6.242 1.00 2.84 H new ATOM 0 HE1 HIS A 48 12.414 -2.955 -3.750 1.00 5.51 H new ATOM 766 N LEU A 49 16.325 -5.243 -6.063 1.00 1.05 N ATOM 767 CA LEU A 49 17.158 -4.480 -6.994 1.00 1.15 C ATOM 768 C LEU A 49 17.363 -3.024 -6.556 1.00 1.14 C ATOM 769 O LEU A 49 18.333 -2.418 -6.998 1.00 1.61 O ATOM 770 CB LEU A 49 16.575 -4.581 -8.416 1.00 1.30 C ATOM 771 CG LEU A 49 17.568 -5.061 -9.492 1.00 1.52 C ATOM 772 CD1 LEU A 49 18.795 -4.151 -9.625 1.00 2.06 C ATOM 773 CD2 LEU A 49 17.999 -6.517 -9.271 1.00 2.72 C ATOM 0 H LEU A 49 15.334 -5.007 -6.114 1.00 1.05 H new ATOM 0 HA LEU A 49 18.154 -4.923 -6.992 1.00 1.15 H new ATOM 0 HB2 LEU A 49 15.725 -5.263 -8.397 1.00 1.30 H new ATOM 0 HB3 LEU A 49 16.192 -3.603 -8.706 1.00 1.30 H new ATOM 0 HG LEU A 49 17.023 -5.006 -10.435 1.00 1.52 H new ATOM 0 HD11 LEU A 49 19.456 -4.542 -10.398 1.00 2.06 H new ATOM 0 HD12 LEU A 49 18.474 -3.145 -9.896 1.00 2.06 H new ATOM 0 HD13 LEU A 49 19.328 -4.118 -8.675 1.00 2.06 H new ATOM 0 HD21 LEU A 49 18.699 -6.812 -10.053 1.00 2.72 H new ATOM 0 HD22 LEU A 49 18.482 -6.610 -8.298 1.00 2.72 H new ATOM 0 HD23 LEU A 49 17.123 -7.165 -9.305 1.00 2.72 H new ATOM 785 N LEU A 50 16.449 -2.482 -5.732 1.00 0.97 N ATOM 786 CA LEU A 50 16.462 -1.167 -5.073 1.00 1.07 C ATOM 787 C LEU A 50 17.228 -0.105 -5.865 1.00 1.14 C ATOM 788 O LEU A 50 18.170 0.531 -5.399 1.00 1.41 O ATOM 789 CB LEU A 50 16.803 -1.278 -3.576 1.00 1.40 C ATOM 790 CG LEU A 50 17.895 -2.290 -3.194 1.00 2.12 C ATOM 791 CD1 LEU A 50 19.263 -1.895 -3.746 1.00 4.14 C ATOM 792 CD2 LEU A 50 17.981 -2.373 -1.670 1.00 3.05 C ATOM 0 H LEU A 50 15.606 -3.002 -5.489 1.00 0.97 H new ATOM 0 HA LEU A 50 15.444 -0.778 -5.083 1.00 1.07 H new ATOM 0 HB2 LEU A 50 17.111 -0.294 -3.223 1.00 1.40 H new ATOM 0 HB3 LEU A 50 15.892 -1.539 -3.037 1.00 1.40 H new ATOM 0 HG LEU A 50 17.625 -3.254 -3.626 1.00 2.12 H new ATOM 0 HD11 LEU A 50 20.003 -2.639 -3.451 1.00 4.14 H new ATOM 0 HD12 LEU A 50 19.215 -1.842 -4.834 1.00 4.14 H new ATOM 0 HD13 LEU A 50 19.549 -0.921 -3.348 1.00 4.14 H new ATOM 0 HD21 LEU A 50 18.753 -3.089 -1.388 1.00 3.05 H new ATOM 0 HD22 LEU A 50 18.230 -1.392 -1.266 1.00 3.05 H new ATOM 0 HD23 LEU A 50 17.021 -2.698 -1.269 1.00 3.05 H new ATOM 804 N LYS A 51 16.815 -0.003 -7.127 1.00 1.03 N ATOM 805 CA LYS A 51 17.473 0.757 -8.170 1.00 1.14 C ATOM 806 C LYS A 51 17.118 2.245 -8.135 1.00 1.07 C ATOM 807 O LYS A 51 17.941 3.057 -8.543 1.00 1.19 O ATOM 808 CB LYS A 51 17.153 0.104 -9.515 1.00 1.17 C ATOM 809 CG LYS A 51 15.644 0.099 -9.796 1.00 1.04 C ATOM 810 CD LYS A 51 15.238 1.220 -10.764 1.00 1.17 C ATOM 811 CE LYS A 51 15.346 0.846 -12.249 1.00 1.48 C ATOM 812 NZ LYS A 51 16.748 0.721 -12.697 1.00 2.26 N ATOM 0 H LYS A 51 15.972 -0.473 -7.458 1.00 1.03 H new ATOM 0 HA LYS A 51 18.550 0.732 -8.005 1.00 1.14 H new ATOM 0 HB2 LYS A 51 17.670 0.638 -10.312 1.00 1.17 H new ATOM 0 HB3 LYS A 51 17.528 -0.919 -9.522 1.00 1.17 H new ATOM 0 HG2 LYS A 51 15.356 -0.865 -10.216 1.00 1.04 H new ATOM 0 HG3 LYS A 51 15.100 0.214 -8.859 1.00 1.04 H new ATOM 0 HD2 LYS A 51 14.210 1.514 -10.550 1.00 1.17 H new ATOM 0 HD3 LYS A 51 15.865 2.091 -10.575 1.00 1.17 H new ATOM 0 HE2 LYS A 51 14.827 -0.096 -12.422 1.00 1.48 H new ATOM 0 HE3 LYS A 51 14.842 1.603 -12.849 1.00 1.48 H new ATOM 0 HZ1 LYS A 51 16.775 0.636 -13.733 1.00 2.26 H new ATOM 0 HZ2 LYS A 51 17.282 1.564 -12.405 1.00 2.26 H new ATOM 0 HZ3 LYS A 51 17.175 -0.125 -12.269 1.00 2.26 H new ATOM 826 N ASP A 52 15.891 2.573 -7.709 1.00 0.95 N ATOM 827 CA ASP A 52 15.507 3.874 -7.183 1.00 0.97 C ATOM 828 C ASP A 52 15.787 5.013 -8.163 1.00 0.86 C ATOM 829 O ASP A 52 16.856 5.615 -8.148 1.00 1.05 O ATOM 830 CB ASP A 52 16.089 4.061 -5.775 1.00 1.30 C ATOM 831 CG ASP A 52 15.538 3.051 -4.762 1.00 1.55 C ATOM 832 OD1 ASP A 52 15.082 1.965 -5.198 1.00 2.06 O ATOM 833 OD2 ASP A 52 15.584 3.386 -3.558 1.00 2.49 O ATOM 0 H ASP A 52 15.116 1.910 -7.725 1.00 0.95 H new ATOM 0 HA ASP A 52 14.423 3.910 -7.071 1.00 0.97 H new ATOM 0 HB2 ASP A 52 17.174 3.967 -5.821 1.00 1.30 H new ATOM 0 HB3 ASP A 52 15.871 5.071 -5.429 1.00 1.30 H new ATOM 838 N VAL A 53 14.808 5.334 -9.021 1.00 0.79 N ATOM 839 CA VAL A 53 14.954 6.368 -10.034 1.00 0.84 C ATOM 840 C VAL A 53 13.653 7.134 -10.262 1.00 0.88 C ATOM 841 O VAL A 53 12.557 6.610 -10.055 1.00 1.44 O ATOM 842 CB VAL A 53 15.551 5.756 -11.309 1.00 1.44 C ATOM 843 CG1 VAL A 53 14.611 4.737 -11.967 1.00 1.99 C ATOM 844 CG2 VAL A 53 15.958 6.823 -12.331 1.00 2.11 C ATOM 0 H VAL A 53 13.895 4.879 -9.025 1.00 0.79 H new ATOM 0 HA VAL A 53 15.655 7.124 -9.681 1.00 0.84 H new ATOM 0 HB VAL A 53 16.449 5.230 -10.985 1.00 1.44 H new ATOM 0 HG11 VAL A 53 15.081 4.335 -12.864 1.00 1.99 H new ATOM 0 HG12 VAL A 53 14.408 3.925 -11.268 1.00 1.99 H new ATOM 0 HG13 VAL A 53 13.675 5.226 -12.236 1.00 1.99 H new ATOM 0 HG21 VAL A 53 16.375 6.340 -13.215 1.00 2.11 H new ATOM 0 HG22 VAL A 53 15.083 7.407 -12.615 1.00 2.11 H new ATOM 0 HG23 VAL A 53 16.707 7.482 -11.891 1.00 2.11 H new ATOM 854 N GLY A 54 13.777 8.400 -10.666 1.00 0.96 N ATOM 855 CA GLY A 54 12.658 9.280 -10.948 1.00 1.26 C ATOM 856 C GLY A 54 11.987 9.730 -9.654 1.00 1.15 C ATOM 857 O GLY A 54 12.148 10.871 -9.234 1.00 1.41 O ATOM 0 H GLY A 54 14.684 8.846 -10.807 1.00 0.96 H new ATOM 0 HA2 GLY A 54 13.005 10.150 -11.505 1.00 1.26 H new ATOM 0 HA3 GLY A 54 11.934 8.765 -11.579 1.00 1.26 H new ATOM 861 N SER A 55 11.243 8.826 -9.013 1.00 0.94 N ATOM 862 CA SER A 55 10.553 9.145 -7.771 1.00 1.00 C ATOM 863 C SER A 55 11.496 9.092 -6.569 1.00 0.95 C ATOM 864 O SER A 55 11.154 9.661 -5.534 1.00 1.01 O ATOM 865 CB SER A 55 9.269 8.332 -7.597 1.00 1.12 C ATOM 866 OG SER A 55 8.347 8.700 -8.610 1.00 1.43 O ATOM 0 H SER A 55 11.106 7.869 -9.337 1.00 0.94 H new ATOM 0 HA SER A 55 10.221 10.181 -7.833 1.00 1.00 H new ATOM 0 HB2 SER A 55 9.488 7.266 -7.657 1.00 1.12 H new ATOM 0 HB3 SER A 55 8.839 8.514 -6.612 1.00 1.12 H new ATOM 0 HG SER A 55 7.442 8.442 -8.337 1.00 1.43 H new ATOM 872 N LEU A 56 12.674 8.450 -6.690 1.00 0.89 N ATOM 873 CA LEU A 56 13.657 8.482 -5.610 1.00 0.83 C ATOM 874 C LEU A 56 13.850 9.918 -5.148 1.00 0.85 C ATOM 875 O LEU A 56 13.674 10.195 -3.972 1.00 0.81 O ATOM 876 CB LEU A 56 14.991 7.776 -5.934 1.00 0.86 C ATOM 877 CG LEU A 56 16.220 8.666 -6.241 1.00 1.85 C ATOM 878 CD1 LEU A 56 17.515 7.979 -5.818 1.00 1.95 C ATOM 879 CD2 LEU A 56 16.314 9.061 -7.719 1.00 4.16 C ATOM 0 H LEU A 56 12.957 7.915 -7.511 1.00 0.89 H new ATOM 0 HA LEU A 56 13.252 7.890 -4.789 1.00 0.83 H new ATOM 0 HB2 LEU A 56 15.244 7.134 -5.090 1.00 0.86 H new ATOM 0 HB3 LEU A 56 14.826 7.124 -6.792 1.00 0.86 H new ATOM 0 HG LEU A 56 16.082 9.578 -5.660 1.00 1.85 H new ATOM 0 HD11 LEU A 56 18.362 8.627 -6.045 1.00 1.95 H new ATOM 0 HD12 LEU A 56 17.488 7.780 -4.747 1.00 1.95 H new ATOM 0 HD13 LEU A 56 17.622 7.039 -6.359 1.00 1.95 H new ATOM 0 HD21 LEU A 56 17.195 9.684 -7.874 1.00 4.16 H new ATOM 0 HD22 LEU A 56 16.393 8.163 -8.331 1.00 4.16 H new ATOM 0 HD23 LEU A 56 15.421 9.617 -8.004 1.00 4.16 H new ATOM 891 N ASP A 57 14.174 10.813 -6.085 1.00 0.99 N ATOM 892 CA ASP A 57 14.334 12.243 -5.838 1.00 1.13 C ATOM 893 C ASP A 57 13.135 12.806 -5.068 1.00 1.06 C ATOM 894 O ASP A 57 13.273 13.320 -3.957 1.00 1.06 O ATOM 895 CB ASP A 57 14.515 12.972 -7.176 1.00 1.37 C ATOM 896 CG ASP A 57 14.359 14.476 -7.003 1.00 2.11 C ATOM 897 OD1 ASP A 57 15.061 15.035 -6.138 1.00 2.72 O ATOM 898 OD2 ASP A 57 13.477 15.050 -7.678 1.00 2.90 O ATOM 0 H ASP A 57 14.336 10.554 -7.058 1.00 0.99 H new ATOM 0 HA ASP A 57 15.219 12.400 -5.222 1.00 1.13 H new ATOM 0 HB2 ASP A 57 15.501 12.750 -7.585 1.00 1.37 H new ATOM 0 HB3 ASP A 57 13.782 12.607 -7.895 1.00 1.37 H new ATOM 903 N GLU A 58 11.949 12.690 -5.671 1.00 1.08 N ATOM 904 CA GLU A 58 10.702 13.211 -5.126 1.00 1.19 C ATOM 905 C GLU A 58 10.486 12.747 -3.680 1.00 1.08 C ATOM 906 O GLU A 58 10.044 13.508 -2.818 1.00 1.22 O ATOM 907 CB GLU A 58 9.537 12.799 -6.042 1.00 1.36 C ATOM 908 CG GLU A 58 8.341 13.755 -5.935 1.00 2.04 C ATOM 909 CD GLU A 58 8.531 15.010 -6.782 1.00 2.88 C ATOM 910 OE1 GLU A 58 9.419 15.817 -6.426 1.00 3.65 O ATOM 911 OE2 GLU A 58 7.805 15.130 -7.790 1.00 3.81 O ATOM 0 H GLU A 58 11.831 12.221 -6.569 1.00 1.08 H new ATOM 0 HA GLU A 58 10.752 14.299 -5.095 1.00 1.19 H new ATOM 0 HB2 GLU A 58 9.884 12.770 -7.075 1.00 1.36 H new ATOM 0 HB3 GLU A 58 9.216 11.790 -5.785 1.00 1.36 H new ATOM 0 HG2 GLU A 58 7.435 13.238 -6.252 1.00 2.04 H new ATOM 0 HG3 GLU A 58 8.197 14.040 -4.893 1.00 2.04 H new ATOM 918 N LYS A 59 10.827 11.492 -3.402 1.00 0.92 N ATOM 919 CA LYS A 59 10.708 10.920 -2.078 1.00 0.89 C ATOM 920 C LYS A 59 11.815 11.472 -1.171 1.00 0.84 C ATOM 921 O LYS A 59 11.556 11.915 -0.055 1.00 0.89 O ATOM 922 CB LYS A 59 10.741 9.392 -2.224 1.00 0.90 C ATOM 923 CG LYS A 59 10.081 8.675 -1.044 1.00 0.68 C ATOM 924 CD LYS A 59 9.478 7.321 -1.443 1.00 0.71 C ATOM 925 CE LYS A 59 10.456 6.203 -1.812 1.00 0.78 C ATOM 926 NZ LYS A 59 11.163 6.461 -3.082 1.00 1.07 N ATOM 0 H LYS A 59 11.195 10.844 -4.099 1.00 0.92 H new ATOM 0 HA LYS A 59 9.767 11.194 -1.601 1.00 0.89 H new ATOM 0 HB2 LYS A 59 10.235 9.108 -3.147 1.00 0.90 H new ATOM 0 HB3 LYS A 59 11.776 9.061 -2.313 1.00 0.90 H new ATOM 0 HG2 LYS A 59 10.819 8.523 -0.256 1.00 0.68 H new ATOM 0 HG3 LYS A 59 9.298 9.310 -0.629 1.00 0.68 H new ATOM 0 HD2 LYS A 59 8.859 6.970 -0.617 1.00 0.71 H new ATOM 0 HD3 LYS A 59 8.814 7.484 -2.292 1.00 0.71 H new ATOM 0 HE2 LYS A 59 11.186 6.086 -1.012 1.00 0.78 H new ATOM 0 HE3 LYS A 59 9.913 5.261 -1.888 1.00 0.78 H new ATOM 0 HZ1 LYS A 59 11.539 5.567 -3.458 1.00 1.07 H new ATOM 0 HZ2 LYS A 59 10.502 6.875 -3.770 1.00 1.07 H new ATOM 0 HZ3 LYS A 59 11.947 7.123 -2.914 1.00 1.07 H new ATOM 940 N MET A 60 13.053 11.460 -1.662 1.00 0.84 N ATOM 941 CA MET A 60 14.249 11.893 -0.965 1.00 0.85 C ATOM 942 C MET A 60 14.033 13.292 -0.410 1.00 0.89 C ATOM 943 O MET A 60 14.168 13.474 0.792 1.00 0.95 O ATOM 944 CB MET A 60 15.467 11.826 -1.897 1.00 0.94 C ATOM 945 CG MET A 60 16.772 12.193 -1.177 1.00 1.11 C ATOM 946 SD MET A 60 18.269 12.098 -2.194 1.00 1.54 S ATOM 947 CE MET A 60 17.978 13.441 -3.370 1.00 3.47 C ATOM 0 H MET A 60 13.252 11.130 -2.606 1.00 0.84 H new ATOM 0 HA MET A 60 14.450 11.224 -0.128 1.00 0.85 H new ATOM 0 HB2 MET A 60 15.552 10.820 -2.308 1.00 0.94 H new ATOM 0 HB3 MET A 60 15.316 12.503 -2.738 1.00 0.94 H new ATOM 0 HG2 MET A 60 16.680 13.207 -0.788 1.00 1.11 H new ATOM 0 HG3 MET A 60 16.893 11.532 -0.319 1.00 1.11 H new ATOM 0 HE1 MET A 60 18.874 13.600 -3.970 1.00 3.47 H new ATOM 0 HE2 MET A 60 17.146 13.179 -4.023 1.00 3.47 H new ATOM 0 HE3 MET A 60 17.739 14.355 -2.827 1.00 3.47 H new ATOM 957 N LYS A 61 13.671 14.262 -1.254 1.00 0.92 N ATOM 958 CA LYS A 61 13.445 15.632 -0.791 1.00 0.99 C ATOM 959 C LYS A 61 12.405 15.656 0.342 1.00 0.97 C ATOM 960 O LYS A 61 12.601 16.288 1.380 1.00 1.01 O ATOM 961 CB LYS A 61 13.076 16.554 -1.965 1.00 1.15 C ATOM 962 CG LYS A 61 11.752 16.157 -2.625 1.00 1.61 C ATOM 963 CD LYS A 61 11.443 16.918 -3.911 1.00 1.96 C ATOM 964 CE LYS A 61 12.472 16.610 -5.012 1.00 1.99 C ATOM 965 NZ LYS A 61 11.896 16.681 -6.368 1.00 2.65 N ATOM 0 H LYS A 61 13.529 14.125 -2.255 1.00 0.92 H new ATOM 0 HA LYS A 61 14.373 16.023 -0.373 1.00 0.99 H new ATOM 0 HB2 LYS A 61 13.007 17.582 -1.609 1.00 1.15 H new ATOM 0 HB3 LYS A 61 13.872 16.527 -2.709 1.00 1.15 H new ATOM 0 HG2 LYS A 61 11.773 15.089 -2.844 1.00 1.61 H new ATOM 0 HG3 LYS A 61 10.941 16.321 -1.915 1.00 1.61 H new ATOM 0 HD2 LYS A 61 10.445 16.653 -4.260 1.00 1.96 H new ATOM 0 HD3 LYS A 61 11.436 17.989 -3.708 1.00 1.96 H new ATOM 0 HE2 LYS A 61 13.300 17.315 -4.937 1.00 1.99 H new ATOM 0 HE3 LYS A 61 12.885 15.614 -4.849 1.00 1.99 H new ATOM 0 HZ1 LYS A 61 12.226 15.870 -6.928 1.00 2.65 H new ATOM 0 HZ2 LYS A 61 10.858 16.659 -6.306 1.00 2.65 H new ATOM 0 HZ3 LYS A 61 12.197 17.564 -6.827 1.00 2.65 H new ATOM 979 N SER A 62 11.300 14.934 0.138 1.00 0.95 N ATOM 980 CA SER A 62 10.230 14.813 1.119 1.00 1.01 C ATOM 981 C SER A 62 10.717 14.241 2.456 1.00 1.00 C ATOM 982 O SER A 62 10.174 14.604 3.498 1.00 1.17 O ATOM 983 CB SER A 62 9.069 13.990 0.551 1.00 1.12 C ATOM 984 OG SER A 62 8.625 14.542 -0.675 1.00 1.95 O ATOM 0 H SER A 62 11.126 14.414 -0.722 1.00 0.95 H new ATOM 0 HA SER A 62 9.871 15.821 1.329 1.00 1.01 H new ATOM 0 HB2 SER A 62 9.387 12.958 0.399 1.00 1.12 H new ATOM 0 HB3 SER A 62 8.247 13.968 1.266 1.00 1.12 H new ATOM 0 HG SER A 62 9.145 14.160 -1.413 1.00 1.95 H new ATOM 990 N LEU A 63 11.720 13.357 2.456 1.00 0.90 N ATOM 991 CA LEU A 63 12.358 12.934 3.700 1.00 0.95 C ATOM 992 C LEU A 63 13.274 14.055 4.210 1.00 0.95 C ATOM 993 O LEU A 63 13.113 14.537 5.331 1.00 1.02 O ATOM 994 CB LEU A 63 13.110 11.596 3.526 1.00 0.98 C ATOM 995 CG LEU A 63 12.266 10.315 3.331 1.00 1.35 C ATOM 996 CD1 LEU A 63 10.787 10.499 2.950 1.00 1.66 C ATOM 997 CD2 LEU A 63 12.916 9.454 2.244 1.00 1.98 C ATOM 0 H LEU A 63 12.103 12.925 1.615 1.00 0.90 H new ATOM 0 HA LEU A 63 11.589 12.751 4.451 1.00 0.95 H new ATOM 0 HB2 LEU A 63 13.774 11.694 2.667 1.00 0.98 H new ATOM 0 HB3 LEU A 63 13.742 11.451 4.402 1.00 0.98 H new ATOM 0 HG LEU A 63 12.256 9.856 4.320 1.00 1.35 H new ATOM 0 HD11 LEU A 63 10.314 9.523 2.845 1.00 1.66 H new ATOM 0 HD12 LEU A 63 10.278 11.066 3.729 1.00 1.66 H new ATOM 0 HD13 LEU A 63 10.719 11.039 2.005 1.00 1.66 H new ATOM 0 HD21 LEU A 63 12.329 8.547 2.098 1.00 1.98 H new ATOM 0 HD22 LEU A 63 12.955 10.015 1.310 1.00 1.98 H new ATOM 0 HD23 LEU A 63 13.928 9.186 2.549 1.00 1.98 H new ATOM 1009 N ASP A 64 14.226 14.470 3.372 1.00 0.91 N ATOM 1010 CA ASP A 64 15.282 15.433 3.660 1.00 0.99 C ATOM 1011 C ASP A 64 14.765 16.672 4.390 1.00 1.03 C ATOM 1012 O ASP A 64 15.374 17.115 5.363 1.00 1.12 O ATOM 1013 CB ASP A 64 15.963 15.831 2.348 1.00 1.01 C ATOM 1014 CG ASP A 64 17.058 16.860 2.585 1.00 1.19 C ATOM 1015 OD1 ASP A 64 18.175 16.426 2.935 1.00 2.01 O ATOM 1016 OD2 ASP A 64 16.754 18.057 2.398 1.00 2.12 O ATOM 0 H ASP A 64 14.280 14.119 2.416 1.00 0.91 H new ATOM 0 HA ASP A 64 15.999 14.957 4.329 1.00 0.99 H new ATOM 0 HB2 ASP A 64 16.388 14.947 1.873 1.00 1.01 H new ATOM 0 HB3 ASP A 64 15.222 16.237 1.659 1.00 1.01 H new ATOM 1021 N VAL A 65 13.639 17.220 3.926 1.00 0.99 N ATOM 1022 CA VAL A 65 13.129 18.493 4.417 1.00 1.05 C ATOM 1023 C VAL A 65 12.944 18.517 5.944 1.00 1.04 C ATOM 1024 O VAL A 65 13.380 19.467 6.590 1.00 1.17 O ATOM 1025 CB VAL A 65 11.875 18.905 3.626 1.00 1.14 C ATOM 1026 CG1 VAL A 65 10.672 17.991 3.882 1.00 1.95 C ATOM 1027 CG2 VAL A 65 11.492 20.357 3.923 1.00 2.42 C ATOM 0 H VAL A 65 13.061 16.792 3.203 1.00 0.99 H new ATOM 0 HA VAL A 65 13.885 19.256 4.234 1.00 1.05 H new ATOM 0 HB VAL A 65 12.140 18.804 2.574 1.00 1.14 H new ATOM 0 HG11 VAL A 65 9.821 18.336 3.294 1.00 1.95 H new ATOM 0 HG12 VAL A 65 10.922 16.970 3.593 1.00 1.95 H new ATOM 0 HG13 VAL A 65 10.415 18.015 4.941 1.00 1.95 H new ATOM 0 HG21 VAL A 65 10.603 20.623 3.351 1.00 2.42 H new ATOM 0 HG22 VAL A 65 11.286 20.468 4.988 1.00 2.42 H new ATOM 0 HG23 VAL A 65 12.314 21.015 3.642 1.00 2.42 H new ATOM 1037 N ASN A 66 12.307 17.497 6.537 1.00 0.94 N ATOM 1038 CA ASN A 66 12.115 17.420 7.990 1.00 0.94 C ATOM 1039 C ASN A 66 12.021 15.963 8.438 1.00 0.90 C ATOM 1040 O ASN A 66 11.056 15.578 9.100 1.00 0.94 O ATOM 1041 CB ASN A 66 10.828 18.154 8.430 1.00 1.00 C ATOM 1042 CG ASN A 66 10.861 19.663 8.220 1.00 1.58 C ATOM 1043 OD1 ASN A 66 10.189 20.188 7.339 1.00 2.98 O ATOM 1044 ND2 ASN A 66 11.615 20.383 9.047 1.00 2.28 N ATOM 0 H ASN A 66 11.913 16.707 6.025 1.00 0.94 H new ATOM 0 HA ASN A 66 12.976 17.901 8.455 1.00 0.94 H new ATOM 0 HB2 ASN A 66 9.983 17.741 7.880 1.00 1.00 H new ATOM 0 HB3 ASN A 66 10.651 17.950 9.486 1.00 1.00 H new ATOM 0 HD21 ASN A 66 11.644 21.399 8.957 1.00 2.28 H new ATOM 0 HD22 ASN A 66 12.164 19.919 9.771 1.00 2.28 H new ATOM 1051 N GLN A 67 13.038 15.148 8.147 1.00 0.89 N ATOM 1052 CA GLN A 67 12.914 13.722 8.422 1.00 0.86 C ATOM 1053 C GLN A 67 12.707 13.377 9.897 1.00 0.95 C ATOM 1054 O GLN A 67 12.199 12.302 10.213 1.00 1.02 O ATOM 1055 CB GLN A 67 14.103 12.908 7.929 1.00 0.87 C ATOM 1056 CG GLN A 67 15.471 13.411 8.415 1.00 0.97 C ATOM 1057 CD GLN A 67 16.129 14.223 7.320 1.00 1.77 C ATOM 1058 OE1 GLN A 67 16.625 13.640 6.361 1.00 2.57 O ATOM 1059 NE2 GLN A 67 16.089 15.545 7.437 1.00 2.37 N ATOM 0 H GLN A 67 13.925 15.440 7.736 1.00 0.89 H new ATOM 0 HA GLN A 67 12.016 13.454 7.866 1.00 0.86 H new ATOM 0 HB2 GLN A 67 13.976 11.874 8.250 1.00 0.87 H new ATOM 0 HB3 GLN A 67 14.098 12.906 6.839 1.00 0.87 H new ATOM 0 HG2 GLN A 67 15.349 14.020 9.311 1.00 0.97 H new ATOM 0 HG3 GLN A 67 16.105 12.567 8.687 1.00 0.97 H new ATOM 0 HE21 GLN A 67 15.662 15.972 8.259 1.00 2.37 H new ATOM 0 HE22 GLN A 67 16.485 16.134 6.704 1.00 2.37 H new ATOM 1068 N ASP A 68 13.180 14.255 10.782 1.00 1.02 N ATOM 1069 CA ASP A 68 13.104 14.070 12.218 1.00 1.13 C ATOM 1070 C ASP A 68 11.654 13.844 12.663 1.00 1.18 C ATOM 1071 O ASP A 68 11.399 13.126 13.628 1.00 1.38 O ATOM 1072 CB ASP A 68 13.712 15.310 12.881 1.00 1.21 C ATOM 1073 CG ASP A 68 13.679 15.206 14.398 1.00 2.08 C ATOM 1074 OD1 ASP A 68 14.502 14.430 14.926 1.00 2.89 O ATOM 1075 OD2 ASP A 68 12.856 15.933 14.994 1.00 2.91 O ATOM 0 H ASP A 68 13.633 15.127 10.509 1.00 1.02 H new ATOM 0 HA ASP A 68 13.662 13.183 12.518 1.00 1.13 H new ATOM 0 HB2 ASP A 68 14.742 15.434 12.546 1.00 1.21 H new ATOM 0 HB3 ASP A 68 13.165 16.198 12.564 1.00 1.21 H new ATOM 1080 N SER A 69 10.704 14.433 11.927 1.00 1.12 N ATOM 1081 CA SER A 69 9.282 14.267 12.174 1.00 1.20 C ATOM 1082 C SER A 69 8.858 12.794 12.158 1.00 1.30 C ATOM 1083 O SER A 69 9.569 11.904 11.684 1.00 2.37 O ATOM 1084 CB SER A 69 8.472 15.032 11.119 1.00 1.17 C ATOM 1085 OG SER A 69 9.045 16.295 10.844 1.00 2.25 O ATOM 0 H SER A 69 10.912 15.043 11.137 1.00 1.12 H new ATOM 0 HA SER A 69 9.082 14.666 13.169 1.00 1.20 H new ATOM 0 HB2 SER A 69 8.422 14.446 10.201 1.00 1.17 H new ATOM 0 HB3 SER A 69 7.448 15.164 11.469 1.00 1.17 H new ATOM 0 HG SER A 69 9.741 16.197 10.161 1.00 2.25 H new ATOM 1091 N GLU A 70 7.638 12.555 12.625 1.00 0.98 N ATOM 1092 CA GLU A 70 7.004 11.258 12.526 1.00 0.94 C ATOM 1093 C GLU A 70 6.604 10.969 11.085 1.00 0.82 C ATOM 1094 O GLU A 70 6.510 11.866 10.248 1.00 1.16 O ATOM 1095 CB GLU A 70 5.744 11.199 13.395 1.00 1.29 C ATOM 1096 CG GLU A 70 5.976 11.710 14.817 1.00 2.10 C ATOM 1097 CD GLU A 70 5.546 13.166 14.979 1.00 3.24 C ATOM 1098 OE1 GLU A 70 5.981 13.983 14.136 1.00 4.16 O ATOM 1099 OE2 GLU A 70 4.763 13.424 15.917 1.00 4.06 O ATOM 0 H GLU A 70 7.064 13.262 13.084 1.00 0.98 H new ATOM 0 HA GLU A 70 7.723 10.515 12.871 1.00 0.94 H new ATOM 0 HB2 GLU A 70 4.958 11.790 12.926 1.00 1.29 H new ATOM 0 HB3 GLU A 70 5.387 10.170 13.438 1.00 1.29 H new ATOM 0 HG2 GLU A 70 5.422 11.088 15.520 1.00 2.10 H new ATOM 0 HG3 GLU A 70 7.032 11.614 15.069 1.00 2.10 H new ATOM 1106 N LEU A 71 6.275 9.706 10.844 1.00 0.85 N ATOM 1107 CA LEU A 71 5.572 9.243 9.665 1.00 0.86 C ATOM 1108 C LEU A 71 4.330 8.517 10.177 1.00 0.80 C ATOM 1109 O LEU A 71 4.343 7.981 11.285 1.00 0.88 O ATOM 1110 CB LEU A 71 6.497 8.313 8.868 1.00 1.18 C ATOM 1111 CG LEU A 71 6.029 8.049 7.428 1.00 1.10 C ATOM 1112 CD1 LEU A 71 6.228 9.275 6.531 1.00 2.13 C ATOM 1113 CD2 LEU A 71 6.871 6.916 6.844 1.00 1.87 C ATOM 0 H LEU A 71 6.501 8.951 11.492 1.00 0.85 H new ATOM 0 HA LEU A 71 5.280 10.052 8.996 1.00 0.86 H new ATOM 0 HB2 LEU A 71 7.496 8.748 8.840 1.00 1.18 H new ATOM 0 HB3 LEU A 71 6.578 7.361 9.393 1.00 1.18 H new ATOM 0 HG LEU A 71 4.968 7.801 7.461 1.00 1.10 H new ATOM 0 HD11 LEU A 71 5.885 9.047 5.522 1.00 2.13 H new ATOM 0 HD12 LEU A 71 5.656 10.113 6.928 1.00 2.13 H new ATOM 0 HD13 LEU A 71 7.285 9.538 6.504 1.00 2.13 H new ATOM 0 HD21 LEU A 71 6.552 6.715 5.821 1.00 1.87 H new ATOM 0 HD22 LEU A 71 7.922 7.205 6.846 1.00 1.87 H new ATOM 0 HD23 LEU A 71 6.741 6.018 7.447 1.00 1.87 H new ATOM 1125 N LYS A 72 3.247 8.512 9.403 1.00 0.76 N ATOM 1126 CA LYS A 72 2.066 7.708 9.658 1.00 0.75 C ATOM 1127 C LYS A 72 1.794 6.844 8.424 1.00 0.72 C ATOM 1128 O LYS A 72 2.386 7.037 7.357 1.00 0.71 O ATOM 1129 CB LYS A 72 0.870 8.596 10.035 1.00 0.85 C ATOM 1130 CG LYS A 72 0.930 9.142 11.474 1.00 1.25 C ATOM 1131 CD LYS A 72 1.731 10.437 11.694 1.00 1.61 C ATOM 1132 CE LYS A 72 1.217 11.603 10.834 1.00 2.10 C ATOM 1133 NZ LYS A 72 2.013 11.789 9.606 1.00 3.41 N ATOM 0 H LYS A 72 3.170 9.083 8.561 1.00 0.76 H new ATOM 0 HA LYS A 72 2.231 7.050 10.511 1.00 0.75 H new ATOM 0 HB2 LYS A 72 0.819 9.434 9.340 1.00 0.85 H new ATOM 0 HB3 LYS A 72 -0.049 8.023 9.912 1.00 0.85 H new ATOM 0 HG2 LYS A 72 -0.091 9.313 11.815 1.00 1.25 H new ATOM 0 HG3 LYS A 72 1.354 8.368 12.113 1.00 1.25 H new ATOM 0 HD2 LYS A 72 1.681 10.717 12.746 1.00 1.61 H new ATOM 0 HD3 LYS A 72 2.780 10.255 11.463 1.00 1.61 H new ATOM 0 HE2 LYS A 72 0.176 11.422 10.565 1.00 2.10 H new ATOM 0 HE3 LYS A 72 1.239 12.521 11.421 1.00 2.10 H new ATOM 0 HZ1 LYS A 72 1.420 12.225 8.871 1.00 3.41 H new ATOM 0 HZ2 LYS A 72 2.824 12.408 9.808 1.00 3.41 H new ATOM 0 HZ3 LYS A 72 2.356 10.866 9.272 1.00 3.41 H new ATOM 1147 N PHE A 73 0.931 5.837 8.597 1.00 0.79 N ATOM 1148 CA PHE A 73 0.724 4.787 7.612 1.00 0.87 C ATOM 1149 C PHE A 73 0.310 5.346 6.247 1.00 0.69 C ATOM 1150 O PHE A 73 0.660 4.768 5.224 1.00 0.61 O ATOM 1151 CB PHE A 73 -0.260 3.734 8.136 1.00 1.18 C ATOM 1152 CG PHE A 73 -1.629 4.273 8.483 1.00 1.03 C ATOM 1153 CD1 PHE A 73 -2.582 4.469 7.468 1.00 2.45 C ATOM 1154 CD2 PHE A 73 -1.938 4.627 9.809 1.00 1.72 C ATOM 1155 CE1 PHE A 73 -3.809 5.075 7.770 1.00 3.02 C ATOM 1156 CE2 PHE A 73 -3.169 5.234 10.108 1.00 2.25 C ATOM 1157 CZ PHE A 73 -4.105 5.464 9.087 1.00 2.51 C ATOM 0 H PHE A 73 0.356 5.733 9.433 1.00 0.79 H new ATOM 0 HA PHE A 73 1.681 4.290 7.453 1.00 0.87 H new ATOM 0 HB2 PHE A 73 -0.371 2.953 7.384 1.00 1.18 H new ATOM 0 HB3 PHE A 73 0.167 3.265 9.022 1.00 1.18 H new ATOM 0 HD1 PHE A 73 -2.369 4.153 6.457 1.00 2.45 H new ATOM 0 HD2 PHE A 73 -1.227 4.432 10.599 1.00 1.72 H new ATOM 0 HE1 PHE A 73 -4.532 5.244 6.985 1.00 3.02 H new ATOM 0 HE2 PHE A 73 -3.396 5.524 11.123 1.00 2.25 H new ATOM 0 HZ PHE A 73 -5.049 5.938 9.313 1.00 2.51 H new ATOM 1167 N ASN A 74 -0.423 6.461 6.219 1.00 0.72 N ATOM 1168 CA ASN A 74 -0.866 7.129 4.999 1.00 0.69 C ATOM 1169 C ASN A 74 0.318 7.616 4.154 1.00 0.62 C ATOM 1170 O ASN A 74 0.376 7.334 2.956 1.00 0.64 O ATOM 1171 CB ASN A 74 -1.820 8.283 5.346 1.00 0.86 C ATOM 1172 CG ASN A 74 -1.180 9.277 6.310 1.00 2.08 C ATOM 1173 OD1 ASN A 74 -0.867 8.907 7.437 1.00 3.23 O ATOM 1174 ND2 ASN A 74 -0.935 10.508 5.878 1.00 3.05 N ATOM 0 H ASN A 74 -0.732 6.935 7.068 1.00 0.72 H new ATOM 0 HA ASN A 74 -1.407 6.403 4.392 1.00 0.69 H new ATOM 0 HB2 ASN A 74 -2.113 8.800 4.432 1.00 0.86 H new ATOM 0 HB3 ASN A 74 -2.731 7.881 5.790 1.00 0.86 H new ATOM 0 HD21 ASN A 74 -0.472 11.181 6.490 1.00 3.05 H new ATOM 0 HD22 ASN A 74 -1.209 10.781 4.934 1.00 3.05 H new ATOM 1181 N GLU A 75 1.264 8.347 4.755 1.00 0.64 N ATOM 1182 CA GLU A 75 2.430 8.836 4.031 1.00 0.66 C ATOM 1183 C GLU A 75 3.314 7.657 3.643 1.00 0.58 C ATOM 1184 O GLU A 75 3.742 7.554 2.493 1.00 0.59 O ATOM 1185 CB GLU A 75 3.230 9.827 4.877 1.00 0.86 C ATOM 1186 CG GLU A 75 2.415 11.050 5.329 1.00 1.29 C ATOM 1187 CD GLU A 75 2.054 11.030 6.806 1.00 2.53 C ATOM 1188 OE1 GLU A 75 2.774 10.388 7.602 1.00 3.71 O ATOM 1189 OE2 GLU A 75 1.083 11.720 7.193 1.00 3.31 O ATOM 0 H GLU A 75 1.240 8.610 5.740 1.00 0.64 H new ATOM 0 HA GLU A 75 2.089 9.355 3.135 1.00 0.66 H new ATOM 0 HB2 GLU A 75 3.615 9.312 5.757 1.00 0.86 H new ATOM 0 HB3 GLU A 75 4.093 10.167 4.304 1.00 0.86 H new ATOM 0 HG2 GLU A 75 2.984 11.955 5.115 1.00 1.29 H new ATOM 0 HG3 GLU A 75 1.499 11.103 4.741 1.00 1.29 H new ATOM 1196 N TYR A 76 3.564 6.758 4.605 1.00 0.57 N ATOM 1197 CA TYR A 76 4.219 5.483 4.336 1.00 0.55 C ATOM 1198 C TYR A 76 3.648 4.886 3.053 1.00 0.49 C ATOM 1199 O TYR A 76 4.402 4.532 2.151 1.00 0.49 O ATOM 1200 CB TYR A 76 4.032 4.554 5.542 1.00 0.60 C ATOM 1201 CG TYR A 76 4.369 3.088 5.329 1.00 0.69 C ATOM 1202 CD1 TYR A 76 3.451 2.235 4.685 1.00 1.84 C ATOM 1203 CD2 TYR A 76 5.511 2.537 5.936 1.00 1.79 C ATOM 1204 CE1 TYR A 76 3.707 0.857 4.594 1.00 1.99 C ATOM 1205 CE2 TYR A 76 5.785 1.163 5.817 1.00 1.86 C ATOM 1206 CZ TYR A 76 4.885 0.324 5.140 1.00 1.15 C ATOM 1207 OH TYR A 76 5.150 -1.007 5.029 1.00 1.47 O ATOM 0 H TYR A 76 3.317 6.899 5.585 1.00 0.57 H new ATOM 0 HA TYR A 76 5.290 5.622 4.189 1.00 0.55 H new ATOM 0 HB2 TYR A 76 4.647 4.930 6.360 1.00 0.60 H new ATOM 0 HB3 TYR A 76 2.994 4.621 5.866 1.00 0.60 H new ATOM 0 HD1 TYR A 76 2.546 2.643 4.259 1.00 1.84 H new ATOM 0 HD2 TYR A 76 6.181 3.172 6.496 1.00 1.79 H new ATOM 0 HE1 TYR A 76 2.997 0.207 4.104 1.00 1.99 H new ATOM 0 HE2 TYR A 76 6.687 0.753 6.246 1.00 1.86 H new ATOM 0 HH TYR A 76 6.059 -1.132 4.686 1.00 1.47 H new ATOM 1217 N TRP A 77 2.316 4.815 2.958 1.00 0.49 N ATOM 1218 CA TRP A 77 1.636 4.221 1.833 1.00 0.46 C ATOM 1219 C TRP A 77 2.142 4.767 0.500 1.00 0.47 C ATOM 1220 O TRP A 77 2.792 4.044 -0.256 1.00 0.49 O ATOM 1221 CB TRP A 77 0.126 4.399 1.993 1.00 0.47 C ATOM 1222 CG TRP A 77 -0.573 3.170 1.602 1.00 0.46 C ATOM 1223 CD1 TRP A 77 -0.836 2.852 0.329 1.00 0.49 C ATOM 1224 CD2 TRP A 77 -1.129 2.113 2.428 1.00 0.45 C ATOM 1225 NE1 TRP A 77 -1.408 1.607 0.292 1.00 0.50 N ATOM 1226 CE2 TRP A 77 -1.683 1.134 1.558 1.00 0.48 C ATOM 1227 CE3 TRP A 77 -1.304 1.920 3.814 1.00 0.45 C ATOM 1228 CZ2 TRP A 77 -2.371 0.016 2.037 1.00 0.50 C ATOM 1229 CZ3 TRP A 77 -2.013 0.804 4.291 1.00 0.46 C ATOM 1230 CH2 TRP A 77 -2.501 -0.165 3.416 1.00 0.48 C ATOM 0 H TRP A 77 1.686 5.176 3.674 1.00 0.49 H new ATOM 0 HA TRP A 77 1.859 3.154 1.819 1.00 0.46 H new ATOM 0 HB2 TRP A 77 -0.111 4.647 3.028 1.00 0.47 H new ATOM 0 HB3 TRP A 77 -0.216 5.232 1.379 1.00 0.47 H new ATOM 0 HD1 TRP A 77 -0.631 3.475 -0.529 1.00 0.49 H new ATOM 0 HE1 TRP A 77 -1.606 1.093 -0.567 1.00 0.50 H new ATOM 0 HE3 TRP A 77 -0.891 2.633 4.512 1.00 0.45 H new ATOM 0 HZ2 TRP A 77 -2.797 -0.700 1.349 1.00 0.50 H new ATOM 0 HZ3 TRP A 77 -2.182 0.696 5.352 1.00 0.46 H new ATOM 0 HH2 TRP A 77 -2.978 -1.053 3.803 1.00 0.48 H new ATOM 1241 N ARG A 78 1.867 6.045 0.227 1.00 0.50 N ATOM 1242 CA ARG A 78 2.439 6.761 -0.900 1.00 0.57 C ATOM 1243 C ARG A 78 3.900 6.376 -1.120 1.00 0.57 C ATOM 1244 O ARG A 78 4.261 5.947 -2.212 1.00 0.63 O ATOM 1245 CB ARG A 78 2.452 8.259 -0.593 1.00 0.90 C ATOM 1246 CG ARG A 78 1.052 8.866 -0.552 1.00 1.38 C ATOM 1247 CD ARG A 78 1.064 10.364 -0.873 1.00 1.79 C ATOM 1248 NE ARG A 78 1.952 10.691 -2.012 1.00 3.21 N ATOM 1249 CZ ARG A 78 2.618 11.846 -2.171 1.00 4.01 C ATOM 1250 NH1 ARG A 78 2.199 12.948 -1.541 1.00 3.93 N ATOM 1251 NH2 ARG A 78 3.700 11.878 -2.952 1.00 5.52 N ATOM 0 H ARG A 78 1.234 6.611 0.792 1.00 0.50 H new ATOM 0 HA ARG A 78 1.838 6.514 -1.775 1.00 0.57 H new ATOM 0 HB2 ARG A 78 2.943 8.425 0.366 1.00 0.90 H new ATOM 0 HB3 ARG A 78 3.045 8.775 -1.348 1.00 0.90 H new ATOM 0 HG2 ARG A 78 0.412 8.348 -1.266 1.00 1.38 H new ATOM 0 HG3 ARG A 78 0.619 8.711 0.436 1.00 1.38 H new ATOM 0 HD2 ARG A 78 0.050 10.692 -1.101 1.00 1.79 H new ATOM 0 HD3 ARG A 78 1.388 10.919 0.008 1.00 1.79 H new ATOM 0 HE ARG A 78 2.067 9.981 -2.735 1.00 3.21 H new ATOM 0 HH11 ARG A 78 1.375 12.910 -0.941 1.00 3.93 H new ATOM 0 HH12 ARG A 78 2.703 13.827 -1.660 1.00 3.93 H new ATOM 0 HH21 ARG A 78 4.015 11.029 -3.422 1.00 5.52 H new ATOM 0 HH22 ARG A 78 4.212 12.751 -3.078 1.00 5.52 H new ATOM 1265 N LEU A 79 4.736 6.538 -0.090 1.00 0.55 N ATOM 1266 CA LEU A 79 6.168 6.333 -0.215 1.00 0.55 C ATOM 1267 C LEU A 79 6.484 4.922 -0.725 1.00 0.53 C ATOM 1268 O LEU A 79 7.315 4.782 -1.621 1.00 0.57 O ATOM 1269 CB LEU A 79 6.879 6.651 1.111 1.00 0.57 C ATOM 1270 CG LEU A 79 7.148 8.147 1.405 1.00 0.59 C ATOM 1271 CD1 LEU A 79 6.190 9.155 0.753 1.00 0.84 C ATOM 1272 CD2 LEU A 79 7.144 8.398 2.917 1.00 0.81 C ATOM 0 H LEU A 79 4.434 6.813 0.845 1.00 0.55 H new ATOM 0 HA LEU A 79 6.553 7.027 -0.962 1.00 0.55 H new ATOM 0 HB2 LEU A 79 6.280 6.245 1.926 1.00 0.57 H new ATOM 0 HB3 LEU A 79 7.833 6.123 1.123 1.00 0.57 H new ATOM 0 HG LEU A 79 8.123 8.325 0.952 1.00 0.59 H new ATOM 0 HD11 LEU A 79 6.481 10.167 1.033 1.00 0.84 H new ATOM 0 HD12 LEU A 79 6.236 9.051 -0.331 1.00 0.84 H new ATOM 0 HD13 LEU A 79 5.173 8.963 1.093 1.00 0.84 H new ATOM 0 HD21 LEU A 79 7.334 9.454 3.111 1.00 0.81 H new ATOM 0 HD22 LEU A 79 6.173 8.123 3.329 1.00 0.81 H new ATOM 0 HD23 LEU A 79 7.922 7.797 3.388 1.00 0.81 H new ATOM 1284 N ILE A 80 5.840 3.871 -0.201 1.00 0.49 N ATOM 1285 CA ILE A 80 6.088 2.529 -0.735 1.00 0.48 C ATOM 1286 C ILE A 80 5.487 2.373 -2.138 1.00 0.49 C ATOM 1287 O ILE A 80 6.017 1.618 -2.945 1.00 0.51 O ATOM 1288 CB ILE A 80 5.716 1.376 0.225 1.00 0.47 C ATOM 1289 CG1 ILE A 80 4.249 0.967 0.124 1.00 0.58 C ATOM 1290 CG2 ILE A 80 6.030 1.725 1.671 1.00 0.43 C ATOM 1291 CD1 ILE A 80 3.850 -0.258 0.953 1.00 0.45 C ATOM 0 H ILE A 80 5.167 3.919 0.564 1.00 0.49 H new ATOM 0 HA ILE A 80 7.170 2.437 -0.831 1.00 0.48 H new ATOM 0 HB ILE A 80 6.329 0.532 -0.090 1.00 0.47 H new ATOM 0 HG12 ILE A 80 3.632 1.811 0.433 1.00 0.58 H new ATOM 0 HG13 ILE A 80 4.016 0.768 -0.922 1.00 0.58 H new ATOM 0 HG21 ILE A 80 5.755 0.890 2.315 1.00 0.43 H new ATOM 0 HG22 ILE A 80 7.096 1.926 1.773 1.00 0.43 H new ATOM 0 HG23 ILE A 80 5.464 2.610 1.963 1.00 0.43 H new ATOM 0 HD11 ILE A 80 2.789 -0.464 0.811 1.00 0.45 H new ATOM 0 HD12 ILE A 80 4.433 -1.121 0.631 1.00 0.45 H new ATOM 0 HD13 ILE A 80 4.043 -0.062 2.008 1.00 0.45 H new ATOM 1303 N GLY A 81 4.395 3.079 -2.446 1.00 0.50 N ATOM 1304 CA GLY A 81 3.868 3.182 -3.804 1.00 0.54 C ATOM 1305 C GLY A 81 4.947 3.666 -4.767 1.00 0.54 C ATOM 1306 O GLY A 81 5.259 3.024 -5.768 1.00 0.66 O ATOM 0 H GLY A 81 3.852 3.596 -1.755 1.00 0.50 H new ATOM 0 HA2 GLY A 81 3.493 2.211 -4.128 1.00 0.54 H new ATOM 0 HA3 GLY A 81 3.024 3.871 -3.820 1.00 0.54 H new ATOM 1310 N GLU A 82 5.533 4.808 -4.422 1.00 0.47 N ATOM 1311 CA GLU A 82 6.615 5.439 -5.147 1.00 0.46 C ATOM 1312 C GLU A 82 7.813 4.482 -5.224 1.00 0.51 C ATOM 1313 O GLU A 82 8.393 4.317 -6.294 1.00 0.66 O ATOM 1314 CB GLU A 82 6.902 6.782 -4.463 1.00 0.47 C ATOM 1315 CG GLU A 82 5.714 7.749 -4.661 1.00 0.83 C ATOM 1316 CD GLU A 82 5.613 8.828 -3.588 1.00 1.59 C ATOM 1317 OE1 GLU A 82 6.634 9.063 -2.907 1.00 2.41 O ATOM 1318 OE2 GLU A 82 4.509 9.417 -3.470 1.00 2.83 O ATOM 0 H GLU A 82 5.251 5.335 -3.596 1.00 0.47 H new ATOM 0 HA GLU A 82 6.361 5.652 -6.185 1.00 0.46 H new ATOM 0 HB2 GLU A 82 7.079 6.625 -3.399 1.00 0.47 H new ATOM 0 HB3 GLU A 82 7.810 7.221 -4.876 1.00 0.47 H new ATOM 0 HG2 GLU A 82 5.805 8.227 -5.636 1.00 0.83 H new ATOM 0 HG3 GLU A 82 4.788 7.174 -4.673 1.00 0.83 H new ATOM 1325 N LEU A 83 8.137 3.774 -4.135 1.00 0.48 N ATOM 1326 CA LEU A 83 9.129 2.708 -4.151 1.00 0.55 C ATOM 1327 C LEU A 83 8.770 1.668 -5.229 1.00 0.59 C ATOM 1328 O LEU A 83 9.579 1.406 -6.119 1.00 0.69 O ATOM 1329 CB LEU A 83 9.270 2.111 -2.738 1.00 0.60 C ATOM 1330 CG LEU A 83 10.633 1.487 -2.402 1.00 1.08 C ATOM 1331 CD1 LEU A 83 11.066 0.485 -3.468 1.00 2.26 C ATOM 1332 CD2 LEU A 83 11.729 2.539 -2.190 1.00 2.35 C ATOM 0 H LEU A 83 7.714 3.929 -3.220 1.00 0.48 H new ATOM 0 HA LEU A 83 10.108 3.102 -4.423 1.00 0.55 H new ATOM 0 HB2 LEU A 83 9.064 2.897 -2.011 1.00 0.60 H new ATOM 0 HB3 LEU A 83 8.502 1.348 -2.609 1.00 0.60 H new ATOM 0 HG LEU A 83 10.498 0.959 -1.458 1.00 1.08 H new ATOM 0 HD11 LEU A 83 12.034 0.063 -3.199 1.00 2.26 H new ATOM 0 HD12 LEU A 83 10.328 -0.314 -3.537 1.00 2.26 H new ATOM 0 HD13 LEU A 83 11.145 0.990 -4.431 1.00 2.26 H new ATOM 0 HD21 LEU A 83 12.670 2.042 -1.955 1.00 2.35 H new ATOM 0 HD22 LEU A 83 11.847 3.130 -3.099 1.00 2.35 H new ATOM 0 HD23 LEU A 83 11.450 3.194 -1.365 1.00 2.35 H new ATOM 1344 N ALA A 84 7.565 1.078 -5.202 1.00 0.60 N ATOM 1345 CA ALA A 84 7.130 0.177 -6.264 1.00 0.71 C ATOM 1346 C ALA A 84 7.287 0.802 -7.660 1.00 0.69 C ATOM 1347 O ALA A 84 7.710 0.119 -8.590 1.00 0.89 O ATOM 1348 CB ALA A 84 5.693 -0.291 -6.011 1.00 0.78 C ATOM 0 H ALA A 84 6.882 1.212 -4.457 1.00 0.60 H new ATOM 0 HA ALA A 84 7.783 -0.696 -6.246 1.00 0.71 H new ATOM 0 HB1 ALA A 84 5.383 -0.962 -6.812 1.00 0.78 H new ATOM 0 HB2 ALA A 84 5.644 -0.817 -5.057 1.00 0.78 H new ATOM 0 HB3 ALA A 84 5.029 0.573 -5.984 1.00 0.78 H new ATOM 1354 N LYS A 85 6.936 2.082 -7.827 1.00 0.59 N ATOM 1355 CA LYS A 85 7.089 2.795 -9.093 1.00 0.74 C ATOM 1356 C LYS A 85 8.554 2.815 -9.549 1.00 0.76 C ATOM 1357 O LYS A 85 8.845 2.505 -10.703 1.00 0.94 O ATOM 1358 CB LYS A 85 6.514 4.213 -8.963 1.00 0.92 C ATOM 1359 CG LYS A 85 6.425 4.923 -10.319 1.00 1.15 C ATOM 1360 CD LYS A 85 6.010 6.392 -10.129 1.00 1.57 C ATOM 1361 CE LYS A 85 6.631 7.309 -11.191 1.00 1.95 C ATOM 1362 NZ LYS A 85 8.084 7.492 -10.984 1.00 2.72 N ATOM 0 H LYS A 85 6.536 2.652 -7.082 1.00 0.59 H new ATOM 0 HA LYS A 85 6.528 2.266 -9.864 1.00 0.74 H new ATOM 0 HB2 LYS A 85 5.522 4.162 -8.515 1.00 0.92 H new ATOM 0 HB3 LYS A 85 7.139 4.797 -8.288 1.00 0.92 H new ATOM 0 HG2 LYS A 85 7.388 4.873 -10.827 1.00 1.15 H new ATOM 0 HG3 LYS A 85 5.702 4.414 -10.957 1.00 1.15 H new ATOM 0 HD2 LYS A 85 4.924 6.470 -10.174 1.00 1.57 H new ATOM 0 HD3 LYS A 85 6.313 6.729 -9.138 1.00 1.57 H new ATOM 0 HE2 LYS A 85 6.456 6.888 -12.181 1.00 1.95 H new ATOM 0 HE3 LYS A 85 6.136 8.280 -11.166 1.00 1.95 H new ATOM 0 HZ1 LYS A 85 8.413 8.310 -11.536 1.00 2.72 H new ATOM 0 HZ2 LYS A 85 8.273 7.657 -9.975 1.00 2.72 H new ATOM 0 HZ3 LYS A 85 8.589 6.638 -11.296 1.00 2.72 H new ATOM 1376 N GLU A 86 9.455 3.229 -8.655 1.00 0.69 N ATOM 1377 CA GLU A 86 10.900 3.213 -8.838 1.00 0.77 C ATOM 1378 C GLU A 86 11.363 1.826 -9.284 1.00 0.80 C ATOM 1379 O GLU A 86 11.821 1.646 -10.413 1.00 0.87 O ATOM 1380 CB GLU A 86 11.550 3.629 -7.513 1.00 0.81 C ATOM 1381 CG GLU A 86 11.496 5.150 -7.316 1.00 1.04 C ATOM 1382 CD GLU A 86 11.320 5.546 -5.857 1.00 1.25 C ATOM 1383 OE1 GLU A 86 12.032 4.997 -4.991 1.00 1.93 O ATOM 1384 OE2 GLU A 86 10.489 6.437 -5.569 1.00 2.11 O ATOM 0 H GLU A 86 9.181 3.600 -7.745 1.00 0.69 H new ATOM 0 HA GLU A 86 11.197 3.913 -9.619 1.00 0.77 H new ATOM 0 HB2 GLU A 86 11.041 3.135 -6.685 1.00 0.81 H new ATOM 0 HB3 GLU A 86 12.587 3.295 -7.494 1.00 0.81 H new ATOM 0 HG2 GLU A 86 12.413 5.595 -7.701 1.00 1.04 H new ATOM 0 HG3 GLU A 86 10.673 5.559 -7.901 1.00 1.04 H new ATOM 1391 N ILE A 87 11.290 0.844 -8.388 1.00 0.76 N ATOM 1392 CA ILE A 87 11.876 -0.460 -8.637 1.00 0.81 C ATOM 1393 C ILE A 87 10.913 -1.297 -9.486 1.00 0.80 C ATOM 1394 O ILE A 87 9.989 -1.927 -8.980 1.00 0.82 O ATOM 1395 CB ILE A 87 12.327 -1.088 -7.303 1.00 0.91 C ATOM 1396 CG1 ILE A 87 13.381 -2.201 -7.462 1.00 1.27 C ATOM 1397 CG2 ILE A 87 11.169 -1.539 -6.408 1.00 1.09 C ATOM 1398 CD1 ILE A 87 12.975 -3.378 -8.356 1.00 1.23 C ATOM 0 H ILE A 87 10.829 0.933 -7.483 1.00 0.76 H new ATOM 0 HA ILE A 87 12.787 -0.392 -9.232 1.00 0.81 H new ATOM 0 HB ILE A 87 12.819 -0.265 -6.785 1.00 0.91 H new ATOM 0 HG12 ILE A 87 14.292 -1.759 -7.866 1.00 1.27 H new ATOM 0 HG13 ILE A 87 13.626 -2.588 -6.473 1.00 1.27 H new ATOM 0 HG21 ILE A 87 11.566 -1.970 -5.489 1.00 1.09 H new ATOM 0 HG22 ILE A 87 10.541 -0.681 -6.165 1.00 1.09 H new ATOM 0 HG23 ILE A 87 10.574 -2.287 -6.932 1.00 1.09 H new ATOM 0 HD11 ILE A 87 13.789 -4.101 -8.398 1.00 1.23 H new ATOM 0 HD12 ILE A 87 12.085 -3.856 -7.946 1.00 1.23 H new ATOM 0 HD13 ILE A 87 12.761 -3.015 -9.361 1.00 1.23 H new ATOM 1410 N ARG A 88 11.166 -1.369 -10.795 1.00 0.91 N ATOM 1411 CA ARG A 88 10.350 -2.173 -11.694 1.00 1.05 C ATOM 1412 C ARG A 88 10.792 -3.634 -11.587 1.00 1.07 C ATOM 1413 O ARG A 88 11.503 -4.157 -12.443 1.00 1.30 O ATOM 1414 CB ARG A 88 10.467 -1.649 -13.132 1.00 1.30 C ATOM 1415 CG ARG A 88 9.704 -0.329 -13.306 1.00 1.70 C ATOM 1416 CD ARG A 88 9.740 0.112 -14.775 1.00 1.80 C ATOM 1417 NE ARG A 88 8.771 1.190 -15.029 1.00 2.44 N ATOM 1418 CZ ARG A 88 8.429 1.640 -16.248 1.00 2.91 C ATOM 1419 NH1 ARG A 88 9.092 1.205 -17.326 1.00 2.81 N ATOM 1420 NH2 ARG A 88 7.428 2.517 -16.387 1.00 4.10 N ATOM 0 H ARG A 88 11.933 -0.877 -11.253 1.00 0.91 H new ATOM 0 HA ARG A 88 9.300 -2.103 -11.411 1.00 1.05 H new ATOM 0 HB2 ARG A 88 11.517 -1.501 -13.383 1.00 1.30 H new ATOM 0 HB3 ARG A 88 10.075 -2.393 -13.826 1.00 1.30 H new ATOM 0 HG2 ARG A 88 8.671 -0.452 -12.980 1.00 1.70 H new ATOM 0 HG3 ARG A 88 10.147 0.442 -12.676 1.00 1.70 H new ATOM 0 HD2 ARG A 88 10.743 0.453 -15.031 1.00 1.80 H new ATOM 0 HD3 ARG A 88 9.519 -0.739 -15.419 1.00 1.80 H new ATOM 0 HE ARG A 88 8.327 1.627 -14.221 1.00 2.44 H new ATOM 0 HH11 ARG A 88 9.853 0.535 -17.220 1.00 2.81 H new ATOM 0 HH12 ARG A 88 8.836 1.544 -18.253 1.00 2.81 H new ATOM 0 HH21 ARG A 88 6.921 2.847 -15.566 1.00 4.10 H new ATOM 0 HH22 ARG A 88 7.172 2.856 -17.314 1.00 4.10 H new ATOM 1434 N LYS A 89 10.354 -4.285 -10.506 1.00 1.06 N ATOM 1435 CA LYS A 89 10.501 -5.721 -10.310 1.00 1.12 C ATOM 1436 C LYS A 89 9.861 -6.488 -11.469 1.00 1.28 C ATOM 1437 O LYS A 89 8.910 -6.016 -12.093 1.00 1.77 O ATOM 1438 CB LYS A 89 9.957 -6.183 -8.944 1.00 1.53 C ATOM 1439 CG LYS A 89 8.529 -5.740 -8.569 1.00 0.99 C ATOM 1440 CD LYS A 89 8.476 -4.314 -7.989 1.00 1.52 C ATOM 1441 CE LYS A 89 7.828 -4.172 -6.603 1.00 1.65 C ATOM 1442 NZ LYS A 89 8.833 -4.195 -5.512 1.00 2.58 N ATOM 0 H LYS A 89 9.880 -3.817 -9.733 1.00 1.06 H new ATOM 0 HA LYS A 89 11.567 -5.947 -10.303 1.00 1.12 H new ATOM 0 HB2 LYS A 89 9.991 -7.272 -8.918 1.00 1.53 H new ATOM 0 HB3 LYS A 89 10.636 -5.824 -8.171 1.00 1.53 H new ATOM 0 HG2 LYS A 89 7.894 -5.791 -9.454 1.00 0.99 H new ATOM 0 HG3 LYS A 89 8.117 -6.438 -7.841 1.00 0.99 H new ATOM 0 HD2 LYS A 89 9.494 -3.928 -7.933 1.00 1.52 H new ATOM 0 HD3 LYS A 89 7.933 -3.679 -8.689 1.00 1.52 H new ATOM 0 HE2 LYS A 89 7.268 -3.238 -6.559 1.00 1.65 H new ATOM 0 HE3 LYS A 89 7.112 -4.981 -6.453 1.00 1.65 H new ATOM 0 HZ1 LYS A 89 8.421 -4.644 -4.670 1.00 2.58 H new ATOM 0 HZ2 LYS A 89 9.667 -4.735 -5.819 1.00 2.58 H new ATOM 0 HZ3 LYS A 89 9.117 -3.222 -5.281 1.00 2.58 H new ATOM 1456 N LYS A 90 10.363 -7.697 -11.742 1.00 1.72 N ATOM 1457 CA LYS A 90 9.912 -8.547 -12.838 1.00 2.15 C ATOM 1458 C LYS A 90 8.594 -9.239 -12.460 1.00 2.18 C ATOM 1459 O LYS A 90 8.464 -10.454 -12.614 1.00 3.33 O ATOM 1460 CB LYS A 90 11.011 -9.580 -13.142 1.00 3.09 C ATOM 1461 CG LYS A 90 12.355 -8.931 -13.504 1.00 3.87 C ATOM 1462 CD LYS A 90 13.416 -10.025 -13.700 1.00 5.10 C ATOM 1463 CE LYS A 90 14.824 -9.451 -13.916 1.00 6.24 C ATOM 1464 NZ LYS A 90 14.926 -8.644 -15.149 1.00 6.45 N ATOM 0 H LYS A 90 11.112 -8.117 -11.191 1.00 1.72 H new ATOM 0 HA LYS A 90 9.728 -7.947 -13.729 1.00 2.15 H new ATOM 0 HB2 LYS A 90 11.147 -10.225 -12.274 1.00 3.09 H new ATOM 0 HB3 LYS A 90 10.687 -10.217 -13.965 1.00 3.09 H new ATOM 0 HG2 LYS A 90 12.253 -8.341 -14.415 1.00 3.87 H new ATOM 0 HG3 LYS A 90 12.665 -8.246 -12.714 1.00 3.87 H new ATOM 0 HD2 LYS A 90 13.424 -10.678 -12.828 1.00 5.10 H new ATOM 0 HD3 LYS A 90 13.143 -10.641 -14.557 1.00 5.10 H new ATOM 0 HE2 LYS A 90 15.096 -8.835 -13.059 1.00 6.24 H new ATOM 0 HE3 LYS A 90 15.543 -10.269 -13.961 1.00 6.24 H new ATOM 0 HZ1 LYS A 90 15.896 -8.281 -15.247 1.00 6.45 H new ATOM 0 HZ2 LYS A 90 14.693 -9.236 -15.972 1.00 6.45 H new ATOM 0 HZ3 LYS A 90 14.261 -7.846 -15.098 1.00 6.45 H new ATOM 1478 N LYS A 91 7.627 -8.472 -11.949 1.00 2.51 N ATOM 1479 CA LYS A 91 6.521 -8.895 -11.092 1.00 3.61 C ATOM 1480 C LYS A 91 7.027 -9.574 -9.810 1.00 3.51 C ATOM 1481 O LYS A 91 6.817 -9.083 -8.700 1.00 4.26 O ATOM 1482 CB LYS A 91 5.514 -9.823 -11.803 1.00 4.67 C ATOM 1483 CG LYS A 91 4.966 -9.357 -13.160 1.00 5.17 C ATOM 1484 CD LYS A 91 5.766 -9.760 -14.413 1.00 5.09 C ATOM 1485 CE LYS A 91 5.807 -11.267 -14.743 1.00 4.99 C ATOM 1486 NZ LYS A 91 6.749 -12.045 -13.910 1.00 5.33 N ATOM 0 H LYS A 91 7.596 -7.470 -12.138 1.00 2.51 H new ATOM 0 HA LYS A 91 5.993 -7.977 -10.833 1.00 3.61 H new ATOM 0 HB2 LYS A 91 5.991 -10.792 -11.946 1.00 4.67 H new ATOM 0 HB3 LYS A 91 4.668 -9.980 -11.133 1.00 4.67 H new ATOM 0 HG2 LYS A 91 3.952 -9.743 -13.267 1.00 5.17 H new ATOM 0 HG3 LYS A 91 4.892 -8.270 -13.140 1.00 5.17 H new ATOM 0 HD2 LYS A 91 5.347 -9.233 -15.270 1.00 5.09 H new ATOM 0 HD3 LYS A 91 6.791 -9.408 -14.292 1.00 5.09 H new ATOM 0 HE2 LYS A 91 4.806 -11.681 -14.623 1.00 4.99 H new ATOM 0 HE3 LYS A 91 6.079 -11.391 -15.791 1.00 4.99 H new ATOM 0 HZ1 LYS A 91 7.307 -12.679 -14.517 1.00 5.33 H new ATOM 0 HZ2 LYS A 91 7.387 -11.395 -13.408 1.00 5.33 H new ATOM 0 HZ3 LYS A 91 6.216 -12.609 -13.218 1.00 5.33 H new ATOM 1500 N ASP A 92 7.716 -10.702 -9.970 1.00 2.96 N ATOM 1501 CA ASP A 92 7.804 -11.748 -8.969 1.00 3.17 C ATOM 1502 C ASP A 92 9.071 -11.515 -8.167 1.00 2.39 C ATOM 1503 O ASP A 92 10.038 -12.270 -8.258 1.00 2.41 O ATOM 1504 CB ASP A 92 7.780 -13.119 -9.659 1.00 3.75 C ATOM 1505 CG ASP A 92 6.541 -13.295 -10.521 1.00 4.91 C ATOM 1506 OD1 ASP A 92 5.431 -13.281 -9.956 1.00 5.92 O ATOM 1507 OD2 ASP A 92 6.716 -13.358 -11.759 1.00 5.35 O ATOM 0 H ASP A 92 8.238 -10.913 -10.820 1.00 2.96 H new ATOM 0 HA ASP A 92 6.955 -11.727 -8.285 1.00 3.17 H new ATOM 0 HB2 ASP A 92 8.671 -13.231 -10.276 1.00 3.75 H new ATOM 0 HB3 ASP A 92 7.813 -13.906 -8.905 1.00 3.75 H new ATOM 1512 N LEU A 93 9.074 -10.427 -7.398 1.00 2.12 N ATOM 1513 CA LEU A 93 10.274 -9.976 -6.707 1.00 1.57 C ATOM 1514 C LEU A 93 10.891 -11.047 -5.800 1.00 1.38 C ATOM 1515 O LEU A 93 12.088 -10.996 -5.523 1.00 1.47 O ATOM 1516 CB LEU A 93 10.032 -8.640 -5.992 1.00 2.16 C ATOM 1517 CG LEU A 93 8.949 -8.637 -4.901 1.00 2.10 C ATOM 1518 CD1 LEU A 93 9.478 -9.188 -3.579 1.00 3.52 C ATOM 1519 CD2 LEU A 93 8.525 -7.191 -4.636 1.00 3.38 C ATOM 0 H LEU A 93 8.254 -9.842 -7.240 1.00 2.12 H new ATOM 0 HA LEU A 93 11.032 -9.796 -7.470 1.00 1.57 H new ATOM 0 HB2 LEU A 93 10.971 -8.318 -5.542 1.00 2.16 H new ATOM 0 HB3 LEU A 93 9.765 -7.895 -6.741 1.00 2.16 H new ATOM 0 HG LEU A 93 8.124 -9.257 -5.252 1.00 2.10 H new ATOM 0 HD11 LEU A 93 8.683 -9.170 -2.833 1.00 3.52 H new ATOM 0 HD12 LEU A 93 9.818 -10.214 -3.722 1.00 3.52 H new ATOM 0 HD13 LEU A 93 10.311 -8.574 -3.237 1.00 3.52 H new ATOM 0 HD21 LEU A 93 7.756 -7.173 -3.863 1.00 3.38 H new ATOM 0 HD22 LEU A 93 9.388 -6.614 -4.303 1.00 3.38 H new ATOM 0 HD23 LEU A 93 8.128 -6.754 -5.553 1.00 3.38 H new ATOM 1531 N LYS A 94 10.100 -12.044 -5.382 1.00 1.32 N ATOM 1532 CA LYS A 94 10.567 -13.195 -4.622 1.00 1.13 C ATOM 1533 C LYS A 94 11.703 -13.951 -5.315 1.00 1.17 C ATOM 1534 O LYS A 94 12.439 -14.670 -4.657 1.00 1.20 O ATOM 1535 CB LYS A 94 9.391 -14.121 -4.277 1.00 1.28 C ATOM 1536 CG LYS A 94 8.414 -13.414 -3.329 1.00 1.53 C ATOM 1537 CD LYS A 94 7.360 -14.388 -2.782 1.00 1.75 C ATOM 1538 CE LYS A 94 6.909 -13.953 -1.379 1.00 2.39 C ATOM 1539 NZ LYS A 94 5.568 -14.444 -1.021 1.00 2.96 N ATOM 0 H LYS A 94 9.098 -12.067 -5.570 1.00 1.32 H new ATOM 0 HA LYS A 94 10.993 -12.816 -3.693 1.00 1.13 H new ATOM 0 HB2 LYS A 94 8.873 -14.417 -5.189 1.00 1.28 H new ATOM 0 HB3 LYS A 94 9.763 -15.034 -3.812 1.00 1.28 H new ATOM 0 HG2 LYS A 94 8.966 -12.970 -2.501 1.00 1.53 H new ATOM 0 HG3 LYS A 94 7.919 -12.598 -3.856 1.00 1.53 H new ATOM 0 HD2 LYS A 94 6.502 -14.421 -3.453 1.00 1.75 H new ATOM 0 HD3 LYS A 94 7.772 -15.396 -2.743 1.00 1.75 H new ATOM 0 HE2 LYS A 94 7.629 -14.315 -0.645 1.00 2.39 H new ATOM 0 HE3 LYS A 94 6.917 -12.864 -1.323 1.00 2.39 H new ATOM 0 HZ1 LYS A 94 5.507 -14.566 0.010 1.00 2.96 H new ATOM 0 HZ2 LYS A 94 4.852 -13.756 -1.331 1.00 2.96 H new ATOM 0 HZ3 LYS A 94 5.396 -15.357 -1.488 1.00 2.96 H new ATOM 1553 N ILE A 95 11.878 -13.782 -6.625 1.00 1.38 N ATOM 1554 CA ILE A 95 13.005 -14.317 -7.382 1.00 1.63 C ATOM 1555 C ILE A 95 14.345 -13.665 -7.000 1.00 1.78 C ATOM 1556 O ILE A 95 15.406 -14.142 -7.401 1.00 2.12 O ATOM 1557 CB ILE A 95 12.654 -14.292 -8.889 1.00 1.70 C ATOM 1558 CG1 ILE A 95 11.434 -15.203 -9.144 1.00 2.40 C ATOM 1559 CG2 ILE A 95 13.826 -14.721 -9.780 1.00 1.75 C ATOM 1560 CD1 ILE A 95 10.917 -15.147 -10.584 1.00 2.62 C ATOM 0 H ILE A 95 11.222 -13.256 -7.202 1.00 1.38 H new ATOM 0 HA ILE A 95 13.171 -15.361 -7.115 1.00 1.63 H new ATOM 0 HB ILE A 95 12.420 -13.261 -9.154 1.00 1.70 H new ATOM 0 HG12 ILE A 95 11.703 -16.232 -8.903 1.00 2.40 H new ATOM 0 HG13 ILE A 95 10.629 -14.917 -8.467 1.00 2.40 H new ATOM 0 HG21 ILE A 95 13.521 -14.684 -10.826 1.00 1.75 H new ATOM 0 HG22 ILE A 95 14.668 -14.047 -9.624 1.00 1.75 H new ATOM 0 HG23 ILE A 95 14.124 -15.738 -9.525 1.00 1.75 H new ATOM 0 HD11 ILE A 95 10.060 -15.812 -10.689 1.00 2.62 H new ATOM 0 HD12 ILE A 95 10.617 -14.127 -10.823 1.00 2.62 H new ATOM 0 HD13 ILE A 95 11.706 -15.462 -11.266 1.00 2.62 H new ATOM 1572 N ARG A 96 14.337 -12.512 -6.325 1.00 1.69 N ATOM 1573 CA ARG A 96 15.527 -11.884 -5.752 1.00 1.84 C ATOM 1574 C ARG A 96 16.194 -10.981 -6.799 1.00 2.55 C ATOM 1575 O ARG A 96 16.488 -9.817 -6.526 1.00 3.31 O ATOM 1576 CB ARG A 96 16.538 -12.909 -5.184 1.00 1.95 C ATOM 1577 CG ARG A 96 17.177 -12.495 -3.852 1.00 2.08 C ATOM 1578 CD ARG A 96 17.788 -11.091 -3.806 1.00 3.18 C ATOM 1579 NE ARG A 96 18.926 -10.958 -4.721 1.00 3.77 N ATOM 1580 CZ ARG A 96 19.498 -9.781 -5.015 1.00 4.98 C ATOM 1581 NH1 ARG A 96 19.056 -8.666 -4.436 1.00 5.79 N ATOM 1582 NH2 ARG A 96 20.522 -9.723 -5.871 1.00 5.97 N ATOM 0 H ARG A 96 13.483 -11.979 -6.159 1.00 1.69 H new ATOM 0 HA ARG A 96 15.199 -11.281 -4.905 1.00 1.84 H new ATOM 0 HB2 ARG A 96 16.031 -13.865 -5.049 1.00 1.95 H new ATOM 0 HB3 ARG A 96 17.328 -13.068 -5.918 1.00 1.95 H new ATOM 0 HG2 ARG A 96 16.419 -12.565 -3.071 1.00 2.08 H new ATOM 0 HG3 ARG A 96 17.956 -13.217 -3.606 1.00 2.08 H new ATOM 0 HD2 ARG A 96 17.026 -10.355 -4.065 1.00 3.18 H new ATOM 0 HD3 ARG A 96 18.112 -10.870 -2.789 1.00 3.18 H new ATOM 0 HE ARG A 96 19.301 -11.802 -5.155 1.00 3.77 H new ATOM 0 HH11 ARG A 96 18.284 -8.708 -3.771 1.00 5.79 H new ATOM 0 HH12 ARG A 96 19.489 -7.770 -4.658 1.00 5.79 H new ATOM 0 HH21 ARG A 96 20.873 -10.577 -6.305 1.00 5.97 H new ATOM 0 HH22 ARG A 96 20.953 -8.825 -6.091 1.00 5.97 H new ATOM 1681 N GLU B 4 12.597 -14.114 -1.340 1.00 2.05 N ATOM 1682 CA GLU B 4 14.035 -14.256 -1.158 1.00 1.53 C ATOM 1683 C GLU B 4 14.738 -12.911 -0.939 1.00 2.16 C ATOM 1684 O GLU B 4 14.524 -11.987 -1.720 1.00 3.89 O ATOM 1685 CB GLU B 4 14.625 -14.874 -2.423 1.00 2.28 C ATOM 1686 CG GLU B 4 14.172 -16.319 -2.628 1.00 4.53 C ATOM 1687 CD GLU B 4 14.946 -17.023 -3.737 1.00 6.11 C ATOM 1688 OE1 GLU B 4 16.005 -16.488 -4.134 1.00 6.29 O ATOM 1689 OE2 GLU B 4 14.479 -18.109 -4.140 1.00 7.49 O ATOM 0 HA GLU B 4 14.190 -14.876 -0.275 1.00 1.53 H new ATOM 0 HB2 GLU B 4 14.332 -14.278 -3.287 1.00 2.28 H new ATOM 0 HB3 GLU B 4 15.713 -14.841 -2.367 1.00 2.28 H new ATOM 0 HG2 GLU B 4 14.296 -16.871 -1.696 1.00 4.53 H new ATOM 0 HG3 GLU B 4 13.109 -16.332 -2.867 1.00 4.53 H new ATOM 1696 N PRO B 5 15.678 -12.836 0.022 1.00 1.69 N ATOM 1697 CA PRO B 5 15.469 -13.185 1.418 1.00 1.82 C ATOM 1698 C PRO B 5 14.466 -12.153 1.939 1.00 1.69 C ATOM 1699 O PRO B 5 14.846 -11.079 2.404 1.00 1.80 O ATOM 1700 CB PRO B 5 16.842 -13.065 2.100 1.00 2.38 C ATOM 1701 CG PRO B 5 17.781 -12.495 1.033 1.00 2.36 C ATOM 1702 CD PRO B 5 16.846 -11.987 -0.061 1.00 2.15 C ATOM 0 HA PRO B 5 15.083 -14.189 1.596 1.00 1.82 H new ATOM 0 HB2 PRO B 5 16.792 -12.410 2.969 1.00 2.38 H new ATOM 0 HB3 PRO B 5 17.191 -14.036 2.452 1.00 2.38 H new ATOM 0 HG2 PRO B 5 18.397 -11.691 1.434 1.00 2.36 H new ATOM 0 HG3 PRO B 5 18.460 -13.258 0.653 1.00 2.36 H new ATOM 0 HD2 PRO B 5 16.585 -10.940 0.097 1.00 2.15 H new ATOM 0 HD3 PRO B 5 17.314 -12.054 -1.043 1.00 2.15 H new ATOM 1710 N LEU B 6 13.179 -12.448 1.787 1.00 1.70 N ATOM 1711 CA LEU B 6 12.164 -11.398 1.774 1.00 1.69 C ATOM 1712 C LEU B 6 11.784 -10.954 3.181 1.00 1.38 C ATOM 1713 O LEU B 6 11.963 -11.719 4.129 1.00 1.62 O ATOM 1714 CB LEU B 6 10.898 -11.922 1.081 1.00 2.17 C ATOM 1715 CG LEU B 6 10.378 -10.915 0.066 1.00 1.43 C ATOM 1716 CD1 LEU B 6 11.235 -10.964 -1.194 1.00 3.10 C ATOM 1717 CD2 LEU B 6 8.916 -11.215 -0.240 1.00 2.12 C ATOM 0 H LEU B 6 12.816 -13.394 1.672 1.00 1.70 H new ATOM 0 HA LEU B 6 12.584 -10.545 1.241 1.00 1.69 H new ATOM 0 HB2 LEU B 6 11.116 -12.867 0.583 1.00 2.17 H new ATOM 0 HB3 LEU B 6 10.128 -12.124 1.826 1.00 2.17 H new ATOM 0 HG LEU B 6 10.441 -9.906 0.474 1.00 1.43 H new ATOM 0 HD11 LEU B 6 10.859 -10.241 -1.918 1.00 3.10 H new ATOM 0 HD12 LEU B 6 12.267 -10.721 -0.942 1.00 3.10 H new ATOM 0 HD13 LEU B 6 11.192 -11.965 -1.624 1.00 3.10 H new ATOM 0 HD21 LEU B 6 8.541 -10.495 -0.967 1.00 2.12 H new ATOM 0 HD22 LEU B 6 8.829 -12.222 -0.649 1.00 2.12 H new ATOM 0 HD23 LEU B 6 8.330 -11.144 0.677 1.00 2.12 H new ATOM 1729 N THR B 7 11.183 -9.768 3.303 1.00 1.19 N ATOM 1730 CA THR B 7 10.713 -9.218 4.572 1.00 1.11 C ATOM 1731 C THR B 7 9.227 -8.855 4.483 1.00 1.03 C ATOM 1732 O THR B 7 8.704 -8.667 3.388 1.00 1.19 O ATOM 1733 CB THR B 7 11.576 -8.005 4.956 1.00 1.32 C ATOM 1734 OG1 THR B 7 12.885 -8.120 4.437 1.00 2.10 O ATOM 1735 CG2 THR B 7 11.675 -7.873 6.478 1.00 1.57 C ATOM 0 H THR B 7 11.007 -9.154 2.508 1.00 1.19 H new ATOM 0 HA THR B 7 10.813 -9.969 5.355 1.00 1.11 H new ATOM 0 HB THR B 7 11.093 -7.124 4.533 1.00 1.32 H new ATOM 0 HG1 THR B 7 12.989 -7.512 3.675 1.00 2.10 H new ATOM 0 HG21 THR B 7 12.290 -7.009 6.729 1.00 1.57 H new ATOM 0 HG22 THR B 7 10.677 -7.743 6.898 1.00 1.57 H new ATOM 0 HG23 THR B 7 12.128 -8.773 6.893 1.00 1.57 H new ATOM 1743 N GLU B 8 8.553 -8.743 5.629 1.00 1.08 N ATOM 1744 CA GLU B 8 7.130 -8.477 5.794 1.00 1.13 C ATOM 1745 C GLU B 8 6.637 -7.363 4.859 1.00 1.05 C ATOM 1746 O GLU B 8 5.714 -7.563 4.067 1.00 1.24 O ATOM 1747 CB GLU B 8 6.858 -8.116 7.268 1.00 1.40 C ATOM 1748 CG GLU B 8 6.955 -9.291 8.263 1.00 1.85 C ATOM 1749 CD GLU B 8 8.361 -9.784 8.621 1.00 2.70 C ATOM 1750 OE1 GLU B 8 9.340 -9.191 8.115 1.00 3.74 O ATOM 1751 OE2 GLU B 8 8.438 -10.755 9.403 1.00 3.18 O ATOM 0 H GLU B 8 9.024 -8.844 6.528 1.00 1.08 H new ATOM 0 HA GLU B 8 6.576 -9.376 5.523 1.00 1.13 H new ATOM 0 HB2 GLU B 8 7.565 -7.344 7.572 1.00 1.40 H new ATOM 0 HB3 GLU B 8 5.861 -7.681 7.341 1.00 1.40 H new ATOM 0 HG2 GLU B 8 6.454 -8.996 9.185 1.00 1.85 H new ATOM 0 HG3 GLU B 8 6.396 -10.131 7.851 1.00 1.85 H new ATOM 1758 N LEU B 9 7.267 -6.186 4.940 1.00 0.93 N ATOM 1759 CA LEU B 9 6.935 -5.035 4.104 1.00 1.00 C ATOM 1760 C LEU B 9 6.918 -5.477 2.637 1.00 1.12 C ATOM 1761 O LEU B 9 5.934 -5.303 1.913 1.00 1.33 O ATOM 1762 CB LEU B 9 7.973 -3.910 4.295 1.00 1.09 C ATOM 1763 CG LEU B 9 7.913 -3.157 5.637 1.00 1.06 C ATOM 1764 CD1 LEU B 9 8.229 -4.029 6.863 1.00 2.27 C ATOM 1765 CD2 LEU B 9 8.780 -1.895 5.583 1.00 2.75 C ATOM 0 H LEU B 9 8.028 -6.007 5.595 1.00 0.93 H new ATOM 0 HA LEU B 9 5.956 -4.653 4.392 1.00 1.00 H new ATOM 0 HB2 LEU B 9 8.969 -4.339 4.186 1.00 1.09 H new ATOM 0 HB3 LEU B 9 7.848 -3.187 3.489 1.00 1.09 H new ATOM 0 HG LEU B 9 6.874 -2.859 5.777 1.00 1.06 H new ATOM 0 HD11 LEU B 9 8.165 -3.423 7.767 1.00 2.27 H new ATOM 0 HD12 LEU B 9 7.511 -4.847 6.923 1.00 2.27 H new ATOM 0 HD13 LEU B 9 9.236 -4.437 6.770 1.00 2.27 H new ATOM 0 HD21 LEU B 9 8.726 -1.375 6.540 1.00 2.75 H new ATOM 0 HD22 LEU B 9 9.814 -2.172 5.379 1.00 2.75 H new ATOM 0 HD23 LEU B 9 8.418 -1.238 4.792 1.00 2.75 H new ATOM 1777 N GLU B 10 8.034 -6.075 2.224 1.00 1.06 N ATOM 1778 CA GLU B 10 8.282 -6.516 0.868 1.00 1.17 C ATOM 1779 C GLU B 10 7.229 -7.536 0.419 1.00 1.18 C ATOM 1780 O GLU B 10 6.704 -7.442 -0.690 1.00 1.33 O ATOM 1781 CB GLU B 10 9.714 -7.054 0.792 1.00 1.25 C ATOM 1782 CG GLU B 10 10.224 -6.940 -0.644 1.00 1.25 C ATOM 1783 CD GLU B 10 11.632 -7.473 -0.863 1.00 2.85 C ATOM 1784 OE1 GLU B 10 12.086 -8.263 -0.011 1.00 4.27 O ATOM 1785 OE2 GLU B 10 12.243 -7.037 -1.865 1.00 3.50 O ATOM 0 H GLU B 10 8.813 -6.269 2.853 1.00 1.06 H new ATOM 0 HA GLU B 10 8.192 -5.682 0.172 1.00 1.17 H new ATOM 0 HB2 GLU B 10 10.361 -6.492 1.465 1.00 1.25 H new ATOM 0 HB3 GLU B 10 9.741 -8.094 1.118 1.00 1.25 H new ATOM 0 HG2 GLU B 10 9.541 -7.477 -1.302 1.00 1.25 H new ATOM 0 HG3 GLU B 10 10.196 -5.892 -0.943 1.00 1.25 H new ATOM 1792 N GLU B 11 6.879 -8.488 1.287 1.00 1.10 N ATOM 1793 CA GLU B 11 5.821 -9.444 0.980 1.00 1.15 C ATOM 1794 C GLU B 11 4.475 -8.735 0.798 1.00 1.06 C ATOM 1795 O GLU B 11 3.669 -9.110 -0.056 1.00 1.12 O ATOM 1796 CB GLU B 11 5.746 -10.555 2.037 1.00 1.18 C ATOM 1797 CG GLU B 11 4.830 -11.686 1.540 1.00 1.65 C ATOM 1798 CD GLU B 11 5.120 -13.014 2.222 1.00 2.05 C ATOM 1799 OE1 GLU B 11 4.746 -13.152 3.403 1.00 2.77 O ATOM 1800 OE2 GLU B 11 5.713 -13.875 1.533 1.00 2.67 O ATOM 0 H GLU B 11 7.312 -8.615 2.202 1.00 1.10 H new ATOM 0 HA GLU B 11 6.066 -9.923 0.032 1.00 1.15 H new ATOM 0 HB2 GLU B 11 6.744 -10.945 2.239 1.00 1.18 H new ATOM 0 HB3 GLU B 11 5.365 -10.152 2.975 1.00 1.18 H new ATOM 0 HG2 GLU B 11 3.790 -11.411 1.716 1.00 1.65 H new ATOM 0 HG3 GLU B 11 4.951 -11.800 0.463 1.00 1.65 H new ATOM 1807 N SER B 12 4.212 -7.678 1.570 1.00 1.04 N ATOM 1808 CA SER B 12 2.942 -6.979 1.434 1.00 1.08 C ATOM 1809 C SER B 12 2.898 -6.353 0.034 1.00 1.00 C ATOM 1810 O SER B 12 1.913 -6.440 -0.703 1.00 1.07 O ATOM 1811 CB SER B 12 2.801 -5.957 2.567 1.00 1.24 C ATOM 1812 OG SER B 12 1.438 -5.636 2.753 1.00 1.79 O ATOM 0 H SER B 12 4.844 -7.299 2.275 1.00 1.04 H new ATOM 0 HA SER B 12 2.090 -7.653 1.524 1.00 1.08 H new ATOM 0 HB2 SER B 12 3.218 -6.362 3.489 1.00 1.24 H new ATOM 0 HB3 SER B 12 3.367 -5.056 2.330 1.00 1.24 H new ATOM 0 HG SER B 12 1.311 -5.254 3.647 1.00 1.79 H new ATOM 1818 N ILE B 13 4.027 -5.766 -0.356 1.00 0.93 N ATOM 1819 CA ILE B 13 4.200 -5.137 -1.650 1.00 0.92 C ATOM 1820 C ILE B 13 4.037 -6.147 -2.789 1.00 0.88 C ATOM 1821 O ILE B 13 3.282 -5.876 -3.725 1.00 0.85 O ATOM 1822 CB ILE B 13 5.555 -4.418 -1.655 1.00 0.96 C ATOM 1823 CG1 ILE B 13 5.448 -3.245 -0.670 1.00 0.99 C ATOM 1824 CG2 ILE B 13 5.992 -3.876 -3.023 1.00 1.04 C ATOM 1825 CD1 ILE B 13 6.806 -2.793 -0.174 1.00 0.93 C ATOM 0 H ILE B 13 4.858 -5.717 0.233 1.00 0.93 H new ATOM 0 HA ILE B 13 3.420 -4.396 -1.823 1.00 0.92 H new ATOM 0 HB ILE B 13 6.311 -5.152 -1.376 1.00 0.96 H new ATOM 0 HG12 ILE B 13 4.943 -2.410 -1.155 1.00 0.99 H new ATOM 0 HG13 ILE B 13 4.832 -3.540 0.179 1.00 0.99 H new ATOM 0 HG21 ILE B 13 6.960 -3.385 -2.927 1.00 1.04 H new ATOM 0 HG22 ILE B 13 6.072 -4.700 -3.732 1.00 1.04 H new ATOM 0 HG23 ILE B 13 5.255 -3.158 -3.382 1.00 1.04 H new ATOM 0 HD11 ILE B 13 6.682 -1.962 0.520 1.00 0.93 H new ATOM 0 HD12 ILE B 13 7.301 -3.620 0.335 1.00 0.93 H new ATOM 0 HD13 ILE B 13 7.414 -2.472 -1.020 1.00 0.93 H new ATOM 1837 N GLU B 14 4.742 -7.286 -2.735 1.00 0.90 N ATOM 1838 CA GLU B 14 4.652 -8.284 -3.798 1.00 0.89 C ATOM 1839 C GLU B 14 3.194 -8.731 -3.981 1.00 0.87 C ATOM 1840 O GLU B 14 2.672 -8.753 -5.098 1.00 0.85 O ATOM 1841 CB GLU B 14 5.683 -9.410 -3.639 1.00 1.11 C ATOM 1842 CG GLU B 14 5.344 -10.523 -2.649 1.00 1.56 C ATOM 1843 CD GLU B 14 4.527 -11.665 -3.246 1.00 2.44 C ATOM 1844 OE1 GLU B 14 4.069 -11.513 -4.397 1.00 3.05 O ATOM 1845 OE2 GLU B 14 4.414 -12.697 -2.551 1.00 3.41 O ATOM 0 H GLU B 14 5.373 -7.533 -1.973 1.00 0.90 H new ATOM 0 HA GLU B 14 4.940 -7.829 -4.746 1.00 0.89 H new ATOM 0 HB2 GLU B 14 5.844 -9.863 -4.617 1.00 1.11 H new ATOM 0 HB3 GLU B 14 6.630 -8.963 -3.336 1.00 1.11 H new ATOM 0 HG2 GLU B 14 6.271 -10.928 -2.244 1.00 1.56 H new ATOM 0 HG3 GLU B 14 4.791 -10.094 -1.813 1.00 1.56 H new ATOM 1852 N THR B 15 2.512 -8.960 -2.853 1.00 0.92 N ATOM 1853 CA THR B 15 1.096 -9.298 -2.830 1.00 0.92 C ATOM 1854 C THR B 15 0.296 -8.257 -3.617 1.00 0.87 C ATOM 1855 O THR B 15 -0.437 -8.609 -4.543 1.00 0.88 O ATOM 1856 CB THR B 15 0.573 -9.469 -1.395 1.00 0.99 C ATOM 1857 OG1 THR B 15 1.346 -10.436 -0.714 1.00 1.10 O ATOM 1858 CG2 THR B 15 -0.878 -9.957 -1.406 1.00 1.09 C ATOM 0 H THR B 15 2.936 -8.914 -1.927 1.00 0.92 H new ATOM 0 HA THR B 15 0.964 -10.264 -3.317 1.00 0.92 H new ATOM 0 HB THR B 15 0.639 -8.502 -0.897 1.00 0.99 H new ATOM 0 HG1 THR B 15 2.158 -10.016 -0.360 1.00 1.10 H new ATOM 0 HG21 THR B 15 -1.231 -10.072 -0.381 1.00 1.09 H new ATOM 0 HG22 THR B 15 -1.502 -9.230 -1.925 1.00 1.09 H new ATOM 0 HG23 THR B 15 -0.935 -10.917 -1.919 1.00 1.09 H new ATOM 1866 N VAL B 16 0.436 -6.968 -3.283 1.00 0.84 N ATOM 1867 CA VAL B 16 -0.266 -5.924 -4.008 1.00 0.81 C ATOM 1868 C VAL B 16 0.020 -6.018 -5.510 1.00 0.78 C ATOM 1869 O VAL B 16 -0.914 -6.082 -6.310 1.00 0.77 O ATOM 1870 CB VAL B 16 0.098 -4.544 -3.442 1.00 0.83 C ATOM 1871 CG1 VAL B 16 -0.426 -3.457 -4.379 1.00 0.83 C ATOM 1872 CG2 VAL B 16 -0.515 -4.330 -2.053 1.00 0.98 C ATOM 0 H VAL B 16 1.026 -6.634 -2.521 1.00 0.84 H new ATOM 0 HA VAL B 16 -1.339 -6.064 -3.875 1.00 0.81 H new ATOM 0 HB VAL B 16 1.183 -4.491 -3.358 1.00 0.83 H new ATOM 0 HG11 VAL B 16 -0.168 -2.476 -3.979 1.00 0.83 H new ATOM 0 HG12 VAL B 16 0.025 -3.577 -5.364 1.00 0.83 H new ATOM 0 HG13 VAL B 16 -1.509 -3.541 -4.464 1.00 0.83 H new ATOM 0 HG21 VAL B 16 -0.238 -3.344 -1.681 1.00 0.98 H new ATOM 0 HG22 VAL B 16 -1.601 -4.401 -2.120 1.00 0.98 H new ATOM 0 HG23 VAL B 16 -0.143 -5.093 -1.370 1.00 0.98 H new ATOM 1882 N VAL B 17 1.297 -6.004 -5.908 1.00 0.81 N ATOM 1883 CA VAL B 17 1.612 -5.981 -7.334 1.00 0.82 C ATOM 1884 C VAL B 17 1.045 -7.201 -8.069 1.00 0.75 C ATOM 1885 O VAL B 17 0.527 -7.044 -9.174 1.00 0.77 O ATOM 1886 CB VAL B 17 3.094 -5.710 -7.647 1.00 0.77 C ATOM 1887 CG1 VAL B 17 3.524 -4.324 -7.151 1.00 1.07 C ATOM 1888 CG2 VAL B 17 4.009 -6.763 -7.039 1.00 0.79 C ATOM 0 H VAL B 17 2.103 -6.008 -5.283 1.00 0.81 H new ATOM 0 HA VAL B 17 1.094 -5.110 -7.736 1.00 0.82 H new ATOM 0 HB VAL B 17 3.189 -5.752 -8.732 1.00 0.77 H new ATOM 0 HG11 VAL B 17 4.576 -4.163 -7.387 1.00 1.07 H new ATOM 0 HG12 VAL B 17 2.921 -3.559 -7.641 1.00 1.07 H new ATOM 0 HG13 VAL B 17 3.381 -4.263 -6.072 1.00 1.07 H new ATOM 0 HG21 VAL B 17 5.045 -6.531 -7.286 1.00 0.79 H new ATOM 0 HG22 VAL B 17 3.887 -6.770 -5.956 1.00 0.79 H new ATOM 0 HG23 VAL B 17 3.752 -7.744 -7.439 1.00 0.79 H new ATOM 1898 N THR B 18 1.089 -8.406 -7.481 1.00 0.76 N ATOM 1899 CA THR B 18 0.429 -9.531 -8.137 1.00 0.79 C ATOM 1900 C THR B 18 -1.086 -9.326 -8.175 1.00 0.76 C ATOM 1901 O THR B 18 -1.694 -9.649 -9.190 1.00 0.81 O ATOM 1902 CB THR B 18 0.834 -10.908 -7.582 1.00 1.09 C ATOM 1903 OG1 THR B 18 0.329 -11.926 -8.431 1.00 1.89 O ATOM 1904 CG2 THR B 18 0.355 -11.178 -6.158 1.00 1.26 C ATOM 0 H THR B 18 1.551 -8.617 -6.597 1.00 0.76 H new ATOM 0 HA THR B 18 0.790 -9.544 -9.165 1.00 0.79 H new ATOM 0 HB THR B 18 1.924 -10.908 -7.551 1.00 1.09 H new ATOM 0 HG1 THR B 18 0.587 -12.803 -8.079 1.00 1.89 H new ATOM 0 HG21 THR B 18 0.683 -12.169 -5.845 1.00 1.26 H new ATOM 0 HG22 THR B 18 0.772 -10.429 -5.485 1.00 1.26 H new ATOM 0 HG23 THR B 18 -0.733 -11.129 -6.125 1.00 1.26 H new ATOM 1912 N THR B 19 -1.707 -8.811 -7.104 1.00 0.75 N ATOM 1913 CA THR B 19 -3.163 -8.700 -6.997 1.00 0.81 C ATOM 1914 C THR B 19 -3.800 -7.976 -8.193 1.00 0.78 C ATOM 1915 O THR B 19 -4.901 -8.339 -8.603 1.00 0.92 O ATOM 1916 CB THR B 19 -3.554 -8.092 -5.641 1.00 0.90 C ATOM 1917 OG1 THR B 19 -3.144 -8.966 -4.611 1.00 1.07 O ATOM 1918 CG2 THR B 19 -5.066 -7.906 -5.484 1.00 1.05 C ATOM 0 H THR B 19 -1.209 -8.459 -6.286 1.00 0.75 H new ATOM 0 HA THR B 19 -3.577 -9.707 -7.036 1.00 0.81 H new ATOM 0 HB THR B 19 -3.071 -7.116 -5.586 1.00 0.90 H new ATOM 0 HG1 THR B 19 -2.202 -8.800 -4.396 1.00 1.07 H new ATOM 0 HG21 THR B 19 -5.280 -7.473 -4.507 1.00 1.05 H new ATOM 0 HG22 THR B 19 -5.434 -7.240 -6.264 1.00 1.05 H new ATOM 0 HG23 THR B 19 -5.562 -8.873 -5.569 1.00 1.05 H new ATOM 1926 N PHE B 20 -3.119 -6.993 -8.796 1.00 0.71 N ATOM 1927 CA PHE B 20 -3.595 -6.383 -10.042 1.00 0.79 C ATOM 1928 C PHE B 20 -3.959 -7.427 -11.107 1.00 1.02 C ATOM 1929 O PHE B 20 -4.911 -7.233 -11.865 1.00 1.25 O ATOM 1930 CB PHE B 20 -2.544 -5.429 -10.619 1.00 0.79 C ATOM 1931 CG PHE B 20 -2.217 -4.244 -9.738 1.00 0.73 C ATOM 1932 CD1 PHE B 20 -3.206 -3.288 -9.446 1.00 1.93 C ATOM 1933 CD2 PHE B 20 -0.901 -4.043 -9.291 1.00 2.46 C ATOM 1934 CE1 PHE B 20 -2.877 -2.146 -8.697 1.00 1.75 C ATOM 1935 CE2 PHE B 20 -0.604 -2.970 -8.436 1.00 2.79 C ATOM 1936 CZ PHE B 20 -1.590 -2.015 -8.147 1.00 1.26 C ATOM 0 H PHE B 20 -2.243 -6.606 -8.444 1.00 0.71 H new ATOM 0 HA PHE B 20 -4.498 -5.830 -9.784 1.00 0.79 H new ATOM 0 HB2 PHE B 20 -1.628 -5.989 -10.806 1.00 0.79 H new ATOM 0 HB3 PHE B 20 -2.896 -5.062 -11.583 1.00 0.79 H new ATOM 0 HD1 PHE B 20 -4.217 -3.432 -9.797 1.00 1.93 H new ATOM 0 HD2 PHE B 20 -0.116 -4.715 -9.606 1.00 2.46 H new ATOM 0 HE1 PHE B 20 -3.612 -1.370 -8.544 1.00 1.75 H new ATOM 0 HE2 PHE B 20 0.381 -2.880 -8.002 1.00 2.79 H new ATOM 0 HZ PHE B 20 -1.360 -1.180 -7.502 1.00 1.26 H new ATOM 1946 N PHE B 21 -3.173 -8.500 -11.206 1.00 1.03 N ATOM 1947 CA PHE B 21 -3.493 -9.676 -12.003 1.00 1.37 C ATOM 1948 C PHE B 21 -4.436 -10.580 -11.199 1.00 1.58 C ATOM 1949 O PHE B 21 -5.540 -10.912 -11.635 1.00 2.20 O ATOM 1950 CB PHE B 21 -2.187 -10.393 -12.388 1.00 1.34 C ATOM 1951 CG PHE B 21 -2.221 -11.144 -13.707 1.00 2.11 C ATOM 1952 CD1 PHE B 21 -3.117 -12.215 -13.897 1.00 3.82 C ATOM 1953 CD2 PHE B 21 -1.283 -10.837 -14.714 1.00 2.52 C ATOM 1954 CE1 PHE B 21 -3.051 -12.991 -15.068 1.00 4.63 C ATOM 1955 CE2 PHE B 21 -1.214 -11.618 -15.880 1.00 3.35 C ATOM 1956 CZ PHE B 21 -2.078 -12.714 -16.043 1.00 4.02 C ATOM 0 H PHE B 21 -2.278 -8.573 -10.722 1.00 1.03 H new ATOM 0 HA PHE B 21 -4.003 -9.398 -12.925 1.00 1.37 H new ATOM 0 HB2 PHE B 21 -1.386 -9.655 -12.430 1.00 1.34 H new ATOM 0 HB3 PHE B 21 -1.931 -11.096 -11.595 1.00 1.34 H new ATOM 0 HD1 PHE B 21 -3.856 -12.440 -13.142 1.00 3.82 H new ATOM 0 HD2 PHE B 21 -0.615 -9.998 -14.589 1.00 2.52 H new ATOM 0 HE1 PHE B 21 -3.749 -13.801 -15.218 1.00 4.63 H new ATOM 0 HE2 PHE B 21 -0.497 -11.376 -16.651 1.00 3.35 H new ATOM 0 HZ PHE B 21 -1.994 -13.343 -16.917 1.00 4.02 H new ATOM 1966 N THR B 22 -3.985 -10.981 -10.011 1.00 1.59 N ATOM 1967 CA THR B 22 -4.561 -12.043 -9.210 1.00 2.34 C ATOM 1968 C THR B 22 -5.752 -11.502 -8.418 1.00 2.79 C ATOM 1969 O THR B 22 -5.699 -11.375 -7.197 1.00 3.24 O ATOM 1970 CB THR B 22 -3.458 -12.615 -8.297 1.00 2.85 C ATOM 1971 OG1 THR B 22 -2.234 -12.692 -9.010 1.00 3.53 O ATOM 1972 CG2 THR B 22 -3.834 -14.008 -7.783 1.00 3.31 C ATOM 0 H THR B 22 -3.173 -10.552 -9.568 1.00 1.59 H new ATOM 0 HA THR B 22 -4.938 -12.850 -9.839 1.00 2.34 H new ATOM 0 HB THR B 22 -3.348 -11.948 -7.442 1.00 2.85 H new ATOM 0 HG1 THR B 22 -1.521 -12.277 -8.482 1.00 3.53 H new ATOM 0 HG21 THR B 22 -3.038 -14.386 -7.142 1.00 3.31 H new ATOM 0 HG22 THR B 22 -4.761 -13.947 -7.213 1.00 3.31 H new ATOM 0 HG23 THR B 22 -3.971 -14.683 -8.628 1.00 3.31 H new ATOM 2097 N LYS B 30 -3.184 -3.972 -17.342 1.00 1.54 N ATOM 2098 CA LYS B 30 -3.163 -2.576 -17.746 1.00 1.82 C ATOM 2099 C LYS B 30 -2.928 -1.754 -16.480 1.00 2.15 C ATOM 2100 O LYS B 30 -3.775 -0.978 -16.050 1.00 4.09 O ATOM 2101 CB LYS B 30 -4.458 -2.233 -18.498 1.00 2.22 C ATOM 2102 CG LYS B 30 -4.282 -1.042 -19.453 1.00 2.60 C ATOM 2103 CD LYS B 30 -3.873 0.242 -18.717 1.00 3.28 C ATOM 2104 CE LYS B 30 -3.669 1.431 -19.650 1.00 3.71 C ATOM 2105 NZ LYS B 30 -4.879 1.729 -20.439 1.00 4.08 N ATOM 0 HA LYS B 30 -2.362 -2.349 -18.449 1.00 1.82 H new ATOM 0 HB2 LYS B 30 -4.788 -3.104 -19.064 1.00 2.22 H new ATOM 0 HB3 LYS B 30 -5.244 -2.005 -17.778 1.00 2.22 H new ATOM 0 HG2 LYS B 30 -3.526 -1.287 -20.199 1.00 2.60 H new ATOM 0 HG3 LYS B 30 -5.215 -0.869 -19.989 1.00 2.60 H new ATOM 0 HD2 LYS B 30 -4.639 0.492 -17.983 1.00 3.28 H new ATOM 0 HD3 LYS B 30 -2.951 0.059 -18.166 1.00 3.28 H new ATOM 0 HE2 LYS B 30 -3.393 2.308 -19.064 1.00 3.71 H new ATOM 0 HE3 LYS B 30 -2.838 1.224 -20.325 1.00 3.71 H new ATOM 0 HZ1 LYS B 30 -5.025 2.758 -20.476 1.00 4.08 H new ATOM 0 HZ2 LYS B 30 -4.763 1.361 -21.405 1.00 4.08 H new ATOM 0 HZ3 LYS B 30 -5.704 1.279 -19.993 1.00 4.08 H new ATOM 2119 N ASP B 31 -1.761 -1.984 -15.889 1.00 1.10 N ATOM 2120 CA ASP B 31 -1.328 -1.512 -14.587 1.00 1.05 C ATOM 2121 C ASP B 31 -2.325 -1.858 -13.472 1.00 1.09 C ATOM 2122 O ASP B 31 -2.056 -2.741 -12.661 1.00 1.36 O ATOM 2123 CB ASP B 31 -0.985 -0.019 -14.632 1.00 1.21 C ATOM 2124 CG ASP B 31 0.199 0.283 -15.540 1.00 1.71 C ATOM 2125 OD1 ASP B 31 -0.023 0.350 -16.768 1.00 2.94 O ATOM 2126 OD2 ASP B 31 1.306 0.444 -14.981 1.00 2.26 O ATOM 0 H ASP B 31 -1.043 -2.547 -16.344 1.00 1.10 H new ATOM 0 HA ASP B 31 -0.413 -2.047 -14.334 1.00 1.05 H new ATOM 0 HB2 ASP B 31 -1.855 0.539 -14.978 1.00 1.21 H new ATOM 0 HB3 ASP B 31 -0.763 0.329 -13.623 1.00 1.21 H new ATOM 2131 N SER B 32 -3.461 -1.161 -13.421 1.00 1.10 N ATOM 2132 CA SER B 32 -4.548 -1.373 -12.482 1.00 1.20 C ATOM 2133 C SER B 32 -5.884 -1.365 -13.246 1.00 1.34 C ATOM 2134 O SER B 32 -6.000 -2.017 -14.283 1.00 1.67 O ATOM 2135 CB SER B 32 -4.445 -0.304 -11.384 1.00 1.22 C ATOM 2136 OG SER B 32 -5.423 -0.492 -10.379 1.00 1.98 O ATOM 0 H SER B 32 -3.651 -0.396 -14.069 1.00 1.10 H new ATOM 0 HA SER B 32 -4.488 -2.344 -11.991 1.00 1.20 H new ATOM 0 HB2 SER B 32 -3.452 -0.336 -10.936 1.00 1.22 H new ATOM 0 HB3 SER B 32 -4.563 0.685 -11.827 1.00 1.22 H new ATOM 0 HG SER B 32 -5.145 -1.219 -9.784 1.00 1.98 H new ATOM 2142 N LEU B 33 -6.898 -0.679 -12.707 1.00 1.17 N ATOM 2143 CA LEU B 33 -8.240 -0.569 -13.274 1.00 1.20 C ATOM 2144 C LEU B 33 -8.472 0.869 -13.780 1.00 1.15 C ATOM 2145 O LEU B 33 -7.524 1.525 -14.219 1.00 1.24 O ATOM 2146 CB LEU B 33 -9.284 -1.013 -12.230 1.00 1.22 C ATOM 2147 CG LEU B 33 -9.163 -2.435 -11.650 1.00 1.34 C ATOM 2148 CD1 LEU B 33 -9.060 -3.501 -12.747 1.00 1.90 C ATOM 2149 CD2 LEU B 33 -8.052 -2.610 -10.608 1.00 1.38 C ATOM 0 H LEU B 33 -6.799 -0.167 -11.830 1.00 1.17 H new ATOM 0 HA LEU B 33 -8.346 -1.232 -14.133 1.00 1.20 H new ATOM 0 HB2 LEU B 33 -9.247 -0.309 -11.399 1.00 1.22 H new ATOM 0 HB3 LEU B 33 -10.271 -0.919 -12.683 1.00 1.22 H new ATOM 0 HG LEU B 33 -10.098 -2.584 -11.109 1.00 1.34 H new ATOM 0 HD11 LEU B 33 -8.977 -4.487 -12.290 1.00 1.90 H new ATOM 0 HD12 LEU B 33 -9.951 -3.466 -13.373 1.00 1.90 H new ATOM 0 HD13 LEU B 33 -8.179 -3.309 -13.359 1.00 1.90 H new ATOM 0 HD21 LEU B 33 -8.042 -3.642 -10.256 1.00 1.38 H new ATOM 0 HD22 LEU B 33 -7.089 -2.371 -11.059 1.00 1.38 H new ATOM 0 HD23 LEU B 33 -8.234 -1.942 -9.766 1.00 1.38 H new ATOM 2161 N SER B 34 -9.704 1.390 -13.719 1.00 1.18 N ATOM 2162 CA SER B 34 -10.007 2.793 -13.969 1.00 1.06 C ATOM 2163 C SER B 34 -10.231 3.478 -12.621 1.00 0.91 C ATOM 2164 O SER B 34 -10.548 2.825 -11.634 1.00 0.92 O ATOM 2165 CB SER B 34 -11.230 2.911 -14.881 1.00 1.15 C ATOM 2166 OG SER B 34 -11.473 4.271 -15.198 1.00 1.93 O ATOM 0 H SER B 34 -10.528 0.834 -13.490 1.00 1.18 H new ATOM 0 HA SER B 34 -9.180 3.284 -14.482 1.00 1.06 H new ATOM 0 HB2 SER B 34 -11.068 2.340 -15.795 1.00 1.15 H new ATOM 0 HB3 SER B 34 -12.103 2.483 -14.388 1.00 1.15 H new ATOM 0 HG SER B 34 -12.256 4.336 -15.783 1.00 1.93 H new ATOM 2172 N VAL B 35 -10.024 4.793 -12.551 1.00 0.86 N ATOM 2173 CA VAL B 35 -9.900 5.504 -11.284 1.00 0.80 C ATOM 2174 C VAL B 35 -11.232 5.523 -10.517 1.00 0.75 C ATOM 2175 O VAL B 35 -11.309 5.105 -9.361 1.00 0.75 O ATOM 2176 CB VAL B 35 -9.370 6.916 -11.575 1.00 0.90 C ATOM 2177 CG1 VAL B 35 -9.196 7.739 -10.305 1.00 0.87 C ATOM 2178 CG2 VAL B 35 -8.037 6.896 -12.328 1.00 1.12 C ATOM 0 H VAL B 35 -9.938 5.393 -13.372 1.00 0.86 H new ATOM 0 HA VAL B 35 -9.194 4.987 -10.633 1.00 0.80 H new ATOM 0 HB VAL B 35 -10.128 7.381 -12.205 1.00 0.90 H new ATOM 0 HG11 VAL B 35 -8.819 8.729 -10.562 1.00 0.87 H new ATOM 0 HG12 VAL B 35 -10.157 7.836 -9.800 1.00 0.87 H new ATOM 0 HG13 VAL B 35 -8.487 7.242 -9.643 1.00 0.87 H new ATOM 0 HG21 VAL B 35 -7.706 7.919 -12.509 1.00 1.12 H new ATOM 0 HG22 VAL B 35 -7.290 6.373 -11.731 1.00 1.12 H new ATOM 0 HG23 VAL B 35 -8.165 6.382 -13.281 1.00 1.12 H new ATOM 2188 N ASN B 36 -12.289 6.041 -11.145 1.00 0.79 N ATOM 2189 CA ASN B 36 -13.585 6.181 -10.489 1.00 0.96 C ATOM 2190 C ASN B 36 -14.157 4.804 -10.143 1.00 1.00 C ATOM 2191 O ASN B 36 -14.620 4.586 -9.026 1.00 1.09 O ATOM 2192 CB ASN B 36 -14.555 7.003 -11.350 1.00 1.22 C ATOM 2193 CG ASN B 36 -15.652 7.641 -10.488 1.00 2.34 C ATOM 2194 OD1 ASN B 36 -16.373 6.968 -9.753 1.00 3.17 O ATOM 2195 ND2 ASN B 36 -15.780 8.966 -10.527 1.00 2.85 N ATOM 0 H ASN B 36 -12.270 6.371 -12.110 1.00 0.79 H new ATOM 0 HA ASN B 36 -13.446 6.728 -9.557 1.00 0.96 H new ATOM 0 HB2 ASN B 36 -14.006 7.781 -11.880 1.00 1.22 H new ATOM 0 HB3 ASN B 36 -15.009 6.362 -12.106 1.00 1.22 H new ATOM 0 HD21 ASN B 36 -16.479 9.428 -9.945 1.00 2.85 H new ATOM 0 HD22 ASN B 36 -15.179 9.519 -11.139 1.00 2.85 H new ATOM 2202 N GLU B 37 -14.083 3.865 -11.094 1.00 1.02 N ATOM 2203 CA GLU B 37 -14.537 2.497 -10.895 1.00 1.23 C ATOM 2204 C GLU B 37 -13.756 1.862 -9.739 1.00 1.08 C ATOM 2205 O GLU B 37 -14.376 1.408 -8.778 1.00 1.21 O ATOM 2206 CB GLU B 37 -14.511 1.742 -12.236 1.00 1.56 C ATOM 2207 CG GLU B 37 -14.312 0.221 -12.141 1.00 1.69 C ATOM 2208 CD GLU B 37 -12.841 -0.154 -12.019 1.00 2.71 C ATOM 2209 OE1 GLU B 37 -12.045 0.471 -12.754 1.00 3.05 O ATOM 2210 OE2 GLU B 37 -12.531 -1.032 -11.188 1.00 4.09 O ATOM 0 H GLU B 37 -13.704 4.041 -12.024 1.00 1.02 H new ATOM 0 HA GLU B 37 -15.579 2.453 -10.579 1.00 1.23 H new ATOM 0 HB2 GLU B 37 -15.448 1.935 -12.759 1.00 1.56 H new ATOM 0 HB3 GLU B 37 -13.712 2.157 -12.850 1.00 1.56 H new ATOM 0 HG2 GLU B 37 -14.857 -0.163 -11.279 1.00 1.69 H new ATOM 0 HG3 GLU B 37 -14.736 -0.256 -13.024 1.00 1.69 H new ATOM 2217 N PHE B 38 -12.416 1.910 -9.771 1.00 0.91 N ATOM 2218 CA PHE B 38 -11.585 1.547 -8.627 1.00 0.83 C ATOM 2219 C PHE B 38 -12.153 2.091 -7.315 1.00 0.76 C ATOM 2220 O PHE B 38 -12.259 1.336 -6.356 1.00 0.81 O ATOM 2221 CB PHE B 38 -10.137 2.014 -8.806 1.00 0.78 C ATOM 2222 CG PHE B 38 -9.378 2.230 -7.509 1.00 0.82 C ATOM 2223 CD1 PHE B 38 -8.842 1.142 -6.798 1.00 1.78 C ATOM 2224 CD2 PHE B 38 -9.364 3.516 -6.935 1.00 1.75 C ATOM 2225 CE1 PHE B 38 -8.286 1.345 -5.522 1.00 1.88 C ATOM 2226 CE2 PHE B 38 -8.896 3.698 -5.626 1.00 2.01 C ATOM 2227 CZ PHE B 38 -8.325 2.622 -4.931 1.00 1.41 C ATOM 0 H PHE B 38 -11.885 2.202 -10.591 1.00 0.91 H new ATOM 0 HA PHE B 38 -11.591 0.458 -8.576 1.00 0.83 H new ATOM 0 HB2 PHE B 38 -9.603 1.277 -9.406 1.00 0.78 H new ATOM 0 HB3 PHE B 38 -10.137 2.946 -9.371 1.00 0.78 H new ATOM 0 HD1 PHE B 38 -8.857 0.153 -7.231 1.00 1.78 H new ATOM 0 HD2 PHE B 38 -9.715 4.364 -7.505 1.00 1.75 H new ATOM 0 HE1 PHE B 38 -7.829 0.520 -4.995 1.00 1.88 H new ATOM 0 HE2 PHE B 38 -8.975 4.666 -5.153 1.00 2.01 H new ATOM 0 HZ PHE B 38 -7.916 2.773 -3.943 1.00 1.41 H new ATOM 2237 N LYS B 39 -12.506 3.382 -7.250 1.00 0.72 N ATOM 2238 CA LYS B 39 -13.033 3.956 -6.014 1.00 0.77 C ATOM 2239 C LYS B 39 -14.235 3.155 -5.478 1.00 0.97 C ATOM 2240 O LYS B 39 -14.389 3.017 -4.264 1.00 1.16 O ATOM 2241 CB LYS B 39 -13.224 5.488 -6.127 1.00 0.96 C ATOM 2242 CG LYS B 39 -14.477 6.068 -5.446 1.00 0.91 C ATOM 2243 CD LYS B 39 -15.624 6.089 -6.464 1.00 1.52 C ATOM 2244 CE LYS B 39 -16.953 6.594 -5.892 1.00 2.34 C ATOM 2245 NZ LYS B 39 -18.009 6.601 -6.930 1.00 3.44 N ATOM 0 H LYS B 39 -12.436 4.037 -8.029 1.00 0.72 H new ATOM 0 HA LYS B 39 -12.286 3.850 -5.228 1.00 0.77 H new ATOM 0 HB2 LYS B 39 -12.346 5.975 -5.702 1.00 0.96 H new ATOM 0 HB3 LYS B 39 -13.255 5.753 -7.184 1.00 0.96 H new ATOM 0 HG2 LYS B 39 -14.751 5.464 -4.581 1.00 0.91 H new ATOM 0 HG3 LYS B 39 -14.277 7.075 -5.081 1.00 0.91 H new ATOM 0 HD2 LYS B 39 -15.338 6.721 -7.305 1.00 1.52 H new ATOM 0 HD3 LYS B 39 -15.768 5.082 -6.856 1.00 1.52 H new ATOM 0 HE2 LYS B 39 -17.260 5.959 -5.060 1.00 2.34 H new ATOM 0 HE3 LYS B 39 -16.823 7.600 -5.494 1.00 2.34 H new ATOM 0 HZ1 LYS B 39 -18.652 7.401 -6.765 1.00 3.44 H new ATOM 0 HZ2 LYS B 39 -17.572 6.695 -7.869 1.00 3.44 H new ATOM 0 HZ3 LYS B 39 -18.545 5.711 -6.886 1.00 3.44 H new ATOM 2259 N GLU B 40 -15.071 2.593 -6.354 1.00 1.00 N ATOM 2260 CA GLU B 40 -16.161 1.724 -5.929 1.00 1.20 C ATOM 2261 C GLU B 40 -15.641 0.313 -5.644 1.00 1.14 C ATOM 2262 O GLU B 40 -15.999 -0.291 -4.635 1.00 1.27 O ATOM 2263 CB GLU B 40 -17.304 1.757 -6.949 1.00 1.41 C ATOM 2264 CG GLU B 40 -17.690 3.222 -7.195 1.00 1.37 C ATOM 2265 CD GLU B 40 -19.099 3.427 -7.721 1.00 1.95 C ATOM 2266 OE1 GLU B 40 -19.736 2.439 -8.137 1.00 2.45 O ATOM 2267 OE2 GLU B 40 -19.495 4.614 -7.671 1.00 2.80 O ATOM 0 H GLU B 40 -15.010 2.727 -7.363 1.00 1.00 H new ATOM 0 HA GLU B 40 -16.576 2.094 -4.992 1.00 1.20 H new ATOM 0 HB2 GLU B 40 -16.994 1.284 -7.881 1.00 1.41 H new ATOM 0 HB3 GLU B 40 -18.161 1.196 -6.577 1.00 1.41 H new ATOM 0 HG2 GLU B 40 -17.582 3.774 -6.261 1.00 1.37 H new ATOM 0 HG3 GLU B 40 -16.985 3.655 -7.905 1.00 1.37 H new ATOM 2274 N LEU B 41 -14.772 -0.214 -6.504 1.00 1.00 N ATOM 2275 CA LEU B 41 -14.176 -1.529 -6.315 1.00 0.94 C ATOM 2276 C LEU B 41 -13.572 -1.657 -4.912 1.00 0.84 C ATOM 2277 O LEU B 41 -13.861 -2.602 -4.183 1.00 0.87 O ATOM 2278 CB LEU B 41 -13.122 -1.770 -7.407 1.00 0.97 C ATOM 2279 CG LEU B 41 -12.689 -3.237 -7.519 1.00 1.82 C ATOM 2280 CD1 LEU B 41 -13.794 -4.089 -8.158 1.00 2.05 C ATOM 2281 CD2 LEU B 41 -11.425 -3.315 -8.382 1.00 2.97 C ATOM 0 H LEU B 41 -14.463 0.262 -7.352 1.00 1.00 H new ATOM 0 HA LEU B 41 -14.949 -2.293 -6.401 1.00 0.94 H new ATOM 0 HB2 LEU B 41 -13.522 -1.442 -8.367 1.00 0.97 H new ATOM 0 HB3 LEU B 41 -12.246 -1.155 -7.199 1.00 0.97 H new ATOM 0 HG LEU B 41 -12.493 -3.624 -6.519 1.00 1.82 H new ATOM 0 HD11 LEU B 41 -13.461 -5.125 -8.226 1.00 2.05 H new ATOM 0 HD12 LEU B 41 -14.694 -4.036 -7.546 1.00 2.05 H new ATOM 0 HD13 LEU B 41 -14.012 -3.712 -9.157 1.00 2.05 H new ATOM 0 HD21 LEU B 41 -11.107 -4.354 -8.469 1.00 2.97 H new ATOM 0 HD22 LEU B 41 -11.637 -2.916 -9.374 1.00 2.97 H new ATOM 0 HD23 LEU B 41 -10.631 -2.730 -7.918 1.00 2.97 H new ATOM 2293 N VAL B 42 -12.755 -0.683 -4.506 1.00 0.80 N ATOM 2294 CA VAL B 42 -12.131 -0.691 -3.195 1.00 0.79 C ATOM 2295 C VAL B 42 -13.210 -0.620 -2.105 1.00 0.90 C ATOM 2296 O VAL B 42 -13.193 -1.438 -1.191 1.00 0.95 O ATOM 2297 CB VAL B 42 -11.019 0.378 -3.097 1.00 0.73 C ATOM 2298 CG1 VAL B 42 -11.552 1.814 -3.094 1.00 2.48 C ATOM 2299 CG2 VAL B 42 -10.149 0.150 -1.862 1.00 2.18 C ATOM 0 H VAL B 42 -12.513 0.126 -5.078 1.00 0.80 H new ATOM 0 HA VAL B 42 -11.608 -1.633 -3.031 1.00 0.79 H new ATOM 0 HB VAL B 42 -10.418 0.261 -3.999 1.00 0.73 H new ATOM 0 HG11 VAL B 42 -10.718 2.512 -3.023 1.00 2.48 H new ATOM 0 HG12 VAL B 42 -12.103 2.000 -4.016 1.00 2.48 H new ATOM 0 HG13 VAL B 42 -12.215 1.954 -2.241 1.00 2.48 H new ATOM 0 HG21 VAL B 42 -9.374 0.915 -1.816 1.00 2.18 H new ATOM 0 HG22 VAL B 42 -10.767 0.206 -0.966 1.00 2.18 H new ATOM 0 HG23 VAL B 42 -9.684 -0.834 -1.921 1.00 2.18 H new ATOM 2309 N THR B 43 -14.179 0.299 -2.198 1.00 1.01 N ATOM 2310 CA THR B 43 -15.209 0.399 -1.161 1.00 1.18 C ATOM 2311 C THR B 43 -15.982 -0.927 -1.026 1.00 1.25 C ATOM 2312 O THR B 43 -16.324 -1.340 0.079 1.00 1.38 O ATOM 2313 CB THR B 43 -16.090 1.659 -1.346 1.00 1.38 C ATOM 2314 OG1 THR B 43 -16.475 2.193 -0.095 1.00 1.78 O ATOM 2315 CG2 THR B 43 -17.394 1.424 -2.112 1.00 1.53 C ATOM 0 H THR B 43 -14.270 0.969 -2.962 1.00 1.01 H new ATOM 0 HA THR B 43 -14.729 0.550 -0.194 1.00 1.18 H new ATOM 0 HB THR B 43 -15.455 2.333 -1.922 1.00 1.38 H new ATOM 0 HG1 THR B 43 -17.029 2.989 -0.236 1.00 1.78 H new ATOM 0 HG21 THR B 43 -17.943 2.362 -2.192 1.00 1.53 H new ATOM 0 HG22 THR B 43 -17.167 1.050 -3.111 1.00 1.53 H new ATOM 0 HG23 THR B 43 -18.002 0.692 -1.580 1.00 1.53 H new ATOM 2323 N GLN B 44 -16.217 -1.635 -2.139 1.00 1.23 N ATOM 2324 CA GLN B 44 -16.810 -2.968 -2.106 1.00 1.31 C ATOM 2325 C GLN B 44 -15.873 -3.974 -1.423 1.00 1.25 C ATOM 2326 O GLN B 44 -16.272 -4.638 -0.467 1.00 1.42 O ATOM 2327 CB GLN B 44 -17.176 -3.433 -3.524 1.00 1.37 C ATOM 2328 CG GLN B 44 -18.299 -2.602 -4.164 1.00 1.91 C ATOM 2329 CD GLN B 44 -19.680 -2.855 -3.562 1.00 3.63 C ATOM 2330 OE1 GLN B 44 -19.856 -3.685 -2.676 1.00 4.88 O ATOM 2331 NE2 GLN B 44 -20.688 -2.136 -4.046 1.00 4.51 N ATOM 0 H GLN B 44 -16.002 -1.299 -3.078 1.00 1.23 H new ATOM 0 HA GLN B 44 -17.726 -2.916 -1.517 1.00 1.31 H new ATOM 0 HB2 GLN B 44 -16.290 -3.381 -4.156 1.00 1.37 H new ATOM 0 HB3 GLN B 44 -17.482 -4.479 -3.489 1.00 1.37 H new ATOM 0 HG2 GLN B 44 -18.058 -1.544 -4.061 1.00 1.91 H new ATOM 0 HG3 GLN B 44 -18.334 -2.819 -5.232 1.00 1.91 H new ATOM 0 HE21 GLN B 44 -20.518 -1.451 -4.783 1.00 4.51 H new ATOM 0 HE22 GLN B 44 -21.631 -2.269 -3.681 1.00 4.51 H new ATOM 2340 N GLN B 45 -14.635 -4.112 -1.914 1.00 1.06 N ATOM 2341 CA GLN B 45 -13.682 -5.087 -1.384 1.00 1.00 C ATOM 2342 C GLN B 45 -13.363 -4.847 0.087 1.00 0.93 C ATOM 2343 O GLN B 45 -13.048 -5.815 0.773 1.00 0.96 O ATOM 2344 CB GLN B 45 -12.383 -5.119 -2.203 1.00 0.96 C ATOM 2345 CG GLN B 45 -12.421 -6.023 -3.446 1.00 0.89 C ATOM 2346 CD GLN B 45 -13.738 -6.029 -4.225 1.00 1.49 C ATOM 2347 OE1 GLN B 45 -13.884 -5.336 -5.224 1.00 1.88 O ATOM 2348 NE2 GLN B 45 -14.694 -6.860 -3.820 1.00 2.50 N ATOM 0 H GLN B 45 -14.270 -3.553 -2.685 1.00 1.06 H new ATOM 0 HA GLN B 45 -14.170 -6.058 -1.468 1.00 1.00 H new ATOM 0 HB2 GLN B 45 -12.145 -4.103 -2.518 1.00 0.96 H new ATOM 0 HB3 GLN B 45 -11.571 -5.451 -1.556 1.00 0.96 H new ATOM 0 HG2 GLN B 45 -11.623 -5.714 -4.121 1.00 0.89 H new ATOM 0 HG3 GLN B 45 -12.199 -7.044 -3.136 1.00 0.89 H new ATOM 0 HE21 GLN B 45 -14.555 -7.430 -2.985 1.00 2.50 H new ATOM 0 HE22 GLN B 45 -15.566 -6.928 -4.344 1.00 2.50 H new ATOM 2357 N LEU B 46 -13.420 -3.600 0.561 1.00 0.92 N ATOM 2358 CA LEU B 46 -13.224 -3.242 1.962 1.00 0.94 C ATOM 2359 C LEU B 46 -14.588 -3.053 2.644 1.00 1.02 C ATOM 2360 O LEU B 46 -14.977 -1.920 2.919 1.00 1.04 O ATOM 2361 CB LEU B 46 -12.419 -1.935 2.061 1.00 0.93 C ATOM 2362 CG LEU B 46 -10.908 -2.018 1.792 1.00 1.04 C ATOM 2363 CD1 LEU B 46 -10.524 -2.567 0.414 1.00 1.11 C ATOM 2364 CD2 LEU B 46 -10.370 -0.595 1.951 1.00 1.78 C ATOM 0 H LEU B 46 -13.608 -2.794 -0.036 1.00 0.92 H new ATOM 0 HA LEU B 46 -12.676 -4.042 2.459 1.00 0.94 H new ATOM 0 HB2 LEU B 46 -12.848 -1.220 1.359 1.00 0.93 H new ATOM 0 HB3 LEU B 46 -12.562 -1.525 3.061 1.00 0.93 H new ATOM 0 HG LEU B 46 -10.476 -2.729 2.496 1.00 1.04 H new ATOM 0 HD11 LEU B 46 -9.438 -2.587 0.320 1.00 1.11 H new ATOM 0 HD12 LEU B 46 -10.916 -3.578 0.303 1.00 1.11 H new ATOM 0 HD13 LEU B 46 -10.944 -1.928 -0.362 1.00 1.11 H new ATOM 0 HD21 LEU B 46 -9.295 -0.590 1.771 1.00 1.78 H new ATOM 0 HD22 LEU B 46 -10.861 0.062 1.233 1.00 1.78 H new ATOM 0 HD23 LEU B 46 -10.570 -0.241 2.962 1.00 1.78 H new ATOM 2376 N PRO B 47 -15.329 -4.117 2.988 1.00 1.14 N ATOM 2377 CA PRO B 47 -16.640 -3.989 3.607 1.00 1.27 C ATOM 2378 C PRO B 47 -16.593 -3.413 5.031 1.00 1.47 C ATOM 2379 O PRO B 47 -17.653 -3.105 5.568 1.00 1.83 O ATOM 2380 CB PRO B 47 -17.220 -5.406 3.603 1.00 1.52 C ATOM 2381 CG PRO B 47 -15.966 -6.266 3.720 1.00 1.57 C ATOM 2382 CD PRO B 47 -15.002 -5.519 2.814 1.00 1.23 C ATOM 0 HA PRO B 47 -17.254 -3.279 3.053 1.00 1.27 H new ATOM 0 HB2 PRO B 47 -17.905 -5.568 4.436 1.00 1.52 H new ATOM 0 HB3 PRO B 47 -17.775 -5.617 2.689 1.00 1.52 H new ATOM 0 HG2 PRO B 47 -15.603 -6.325 4.746 1.00 1.57 H new ATOM 0 HG3 PRO B 47 -16.137 -7.289 3.383 1.00 1.57 H new ATOM 0 HD2 PRO B 47 -13.967 -5.719 3.090 1.00 1.23 H new ATOM 0 HD3 PRO B 47 -15.120 -5.825 1.775 1.00 1.23 H new ATOM 2390 N HIS B 48 -15.403 -3.257 5.631 1.00 1.43 N ATOM 2391 CA HIS B 48 -15.168 -3.078 7.065 1.00 1.52 C ATOM 2392 C HIS B 48 -16.237 -2.229 7.766 1.00 1.60 C ATOM 2393 O HIS B 48 -16.785 -2.641 8.786 1.00 2.44 O ATOM 2394 CB HIS B 48 -13.785 -2.439 7.217 1.00 1.75 C ATOM 2395 CG HIS B 48 -13.251 -2.431 8.625 1.00 1.99 C ATOM 2396 ND1 HIS B 48 -12.190 -3.185 9.062 1.00 3.02 N ATOM 2397 CD2 HIS B 48 -13.607 -1.582 9.643 1.00 2.85 C ATOM 2398 CE1 HIS B 48 -11.898 -2.767 10.300 1.00 3.51 C ATOM 2399 NE2 HIS B 48 -12.723 -1.791 10.704 1.00 3.34 N ATOM 0 H HIS B 48 -14.534 -3.253 5.096 1.00 1.43 H new ATOM 0 HA HIS B 48 -15.221 -4.052 7.551 1.00 1.52 H new ATOM 0 HB2 HIS B 48 -13.081 -2.972 6.578 1.00 1.75 H new ATOM 0 HB3 HIS B 48 -13.831 -1.412 6.854 1.00 1.75 H new ATOM 0 HD1 HIS B 48 -11.715 -3.923 8.542 1.00 3.02 H new ATOM 0 HD2 HIS B 48 -14.425 -0.877 9.627 1.00 2.85 H new ATOM 0 HE1 HIS B 48 -11.095 -3.168 10.900 1.00 3.51 H new ATOM 2407 N LEU B 49 -16.528 -1.042 7.225 1.00 1.42 N ATOM 2408 CA LEU B 49 -17.642 -0.211 7.670 1.00 1.35 C ATOM 2409 C LEU B 49 -18.027 0.726 6.526 1.00 1.27 C ATOM 2410 O LEU B 49 -19.166 0.700 6.065 1.00 1.30 O ATOM 2411 CB LEU B 49 -17.267 0.548 8.961 1.00 1.41 C ATOM 2412 CG LEU B 49 -18.443 1.064 9.810 1.00 1.60 C ATOM 2413 CD1 LEU B 49 -19.341 2.064 9.074 1.00 2.38 C ATOM 2414 CD2 LEU B 49 -19.284 -0.080 10.392 1.00 2.68 C ATOM 0 H LEU B 49 -15.991 -0.631 6.461 1.00 1.42 H new ATOM 0 HA LEU B 49 -18.507 -0.825 7.919 1.00 1.35 H new ATOM 0 HB2 LEU B 49 -16.659 -0.110 9.581 1.00 1.41 H new ATOM 0 HB3 LEU B 49 -16.641 1.398 8.690 1.00 1.41 H new ATOM 0 HG LEU B 49 -17.976 1.604 10.633 1.00 1.60 H new ATOM 0 HD11 LEU B 49 -20.147 2.383 9.734 1.00 2.38 H new ATOM 0 HD12 LEU B 49 -18.752 2.931 8.775 1.00 2.38 H new ATOM 0 HD13 LEU B 49 -19.764 1.590 8.188 1.00 2.38 H new ATOM 0 HD21 LEU B 49 -20.101 0.333 10.983 1.00 2.68 H new ATOM 0 HD22 LEU B 49 -19.692 -0.682 9.580 1.00 2.68 H new ATOM 0 HD23 LEU B 49 -18.657 -0.706 11.027 1.00 2.68 H new ATOM 2426 N LEU B 50 -17.045 1.511 6.067 1.00 1.42 N ATOM 2427 CA LEU B 50 -17.151 2.569 5.066 1.00 1.52 C ATOM 2428 C LEU B 50 -17.675 3.832 5.749 1.00 1.56 C ATOM 2429 O LEU B 50 -18.781 4.295 5.485 1.00 1.83 O ATOM 2430 CB LEU B 50 -17.937 2.202 3.793 1.00 1.83 C ATOM 2431 CG LEU B 50 -17.375 1.051 2.934 1.00 1.72 C ATOM 2432 CD1 LEU B 50 -15.849 1.081 2.801 1.00 3.08 C ATOM 2433 CD2 LEU B 50 -17.824 -0.334 3.400 1.00 2.65 C ATOM 0 H LEU B 50 -16.090 1.413 6.412 1.00 1.42 H new ATOM 0 HA LEU B 50 -16.149 2.744 4.673 1.00 1.52 H new ATOM 0 HB2 LEU B 50 -18.954 1.942 4.086 1.00 1.83 H new ATOM 0 HB3 LEU B 50 -18.003 3.092 3.167 1.00 1.83 H new ATOM 0 HG LEU B 50 -17.805 1.229 1.948 1.00 1.72 H new ATOM 0 HD11 LEU B 50 -15.521 0.244 2.185 1.00 3.08 H new ATOM 0 HD12 LEU B 50 -15.543 2.017 2.334 1.00 3.08 H new ATOM 0 HD13 LEU B 50 -15.396 1.003 3.789 1.00 3.08 H new ATOM 0 HD21 LEU B 50 -17.391 -1.095 2.750 1.00 2.65 H new ATOM 0 HD22 LEU B 50 -17.490 -0.499 4.424 1.00 2.65 H new ATOM 0 HD23 LEU B 50 -18.911 -0.397 3.358 1.00 2.65 H new ATOM 2445 N LYS B 51 -16.876 4.356 6.685 1.00 1.41 N ATOM 2446 CA LYS B 51 -17.181 5.591 7.407 1.00 1.49 C ATOM 2447 C LYS B 51 -16.792 6.813 6.569 1.00 1.40 C ATOM 2448 O LYS B 51 -17.440 7.853 6.617 1.00 1.52 O ATOM 2449 CB LYS B 51 -16.510 5.556 8.789 1.00 1.52 C ATOM 2450 CG LYS B 51 -14.972 5.589 8.771 1.00 1.49 C ATOM 2451 CD LYS B 51 -14.417 7.012 8.556 1.00 1.67 C ATOM 2452 CE LYS B 51 -13.295 7.416 9.529 1.00 2.35 C ATOM 2453 NZ LYS B 51 -12.323 8.337 8.896 1.00 4.06 N ATOM 0 H LYS B 51 -15.992 3.929 6.963 1.00 1.41 H new ATOM 0 HA LYS B 51 -18.255 5.674 7.576 1.00 1.49 H new ATOM 0 HB2 LYS B 51 -16.869 6.405 9.371 1.00 1.52 H new ATOM 0 HB3 LYS B 51 -16.832 4.654 9.309 1.00 1.52 H new ATOM 0 HG2 LYS B 51 -14.592 5.192 9.712 1.00 1.49 H new ATOM 0 HG3 LYS B 51 -14.606 4.936 7.979 1.00 1.49 H new ATOM 0 HD2 LYS B 51 -14.041 7.091 7.536 1.00 1.67 H new ATOM 0 HD3 LYS B 51 -15.236 7.725 8.650 1.00 1.67 H new ATOM 0 HE2 LYS B 51 -13.730 7.894 10.407 1.00 2.35 H new ATOM 0 HE3 LYS B 51 -12.776 6.523 9.876 1.00 2.35 H new ATOM 0 HZ1 LYS B 51 -11.483 8.426 9.503 1.00 4.06 H new ATOM 0 HZ2 LYS B 51 -12.042 7.961 7.968 1.00 4.06 H new ATOM 0 HZ3 LYS B 51 -12.761 9.272 8.772 1.00 4.06 H new ATOM 2467 N ASP B 52 -15.685 6.643 5.849 1.00 1.22 N ATOM 2468 CA ASP B 52 -15.172 7.362 4.704 1.00 1.02 C ATOM 2469 C ASP B 52 -15.363 8.876 4.735 1.00 1.02 C ATOM 2470 O ASP B 52 -16.372 9.406 4.280 1.00 1.18 O ATOM 2471 CB ASP B 52 -15.636 6.651 3.426 1.00 1.28 C ATOM 2472 CG ASP B 52 -15.224 5.174 3.397 1.00 1.81 C ATOM 2473 OD1 ASP B 52 -14.718 4.685 4.441 1.00 2.72 O ATOM 2474 OD2 ASP B 52 -15.451 4.543 2.344 1.00 2.43 O ATOM 0 H ASP B 52 -15.045 5.889 6.099 1.00 1.22 H new ATOM 0 HA ASP B 52 -14.083 7.318 4.733 1.00 1.02 H new ATOM 0 HB2 ASP B 52 -16.721 6.725 3.346 1.00 1.28 H new ATOM 0 HB3 ASP B 52 -15.217 7.160 2.558 1.00 1.28 H new ATOM 2479 N VAL B 53 -14.349 9.571 5.267 1.00 1.16 N ATOM 2480 CA VAL B 53 -14.328 11.020 5.402 1.00 1.33 C ATOM 2481 C VAL B 53 -12.867 11.472 5.455 1.00 1.36 C ATOM 2482 O VAL B 53 -12.003 10.694 5.872 1.00 1.66 O ATOM 2483 CB VAL B 53 -15.152 11.459 6.627 1.00 1.79 C ATOM 2484 CG1 VAL B 53 -14.618 10.892 7.947 1.00 2.59 C ATOM 2485 CG2 VAL B 53 -15.224 12.985 6.722 1.00 3.05 C ATOM 0 H VAL B 53 -13.504 9.124 5.622 1.00 1.16 H new ATOM 0 HA VAL B 53 -14.799 11.502 4.545 1.00 1.33 H new ATOM 0 HB VAL B 53 -16.151 11.051 6.474 1.00 1.79 H new ATOM 0 HG11 VAL B 53 -15.242 11.238 8.771 1.00 2.59 H new ATOM 0 HG12 VAL B 53 -14.638 9.803 7.910 1.00 2.59 H new ATOM 0 HG13 VAL B 53 -13.593 11.231 8.101 1.00 2.59 H new ATOM 0 HG21 VAL B 53 -15.811 13.268 7.596 1.00 3.05 H new ATOM 0 HG22 VAL B 53 -14.217 13.392 6.815 1.00 3.05 H new ATOM 0 HG23 VAL B 53 -15.695 13.384 5.823 1.00 3.05 H new ATOM 2495 N GLY B 54 -12.575 12.699 5.017 1.00 1.52 N ATOM 2496 CA GLY B 54 -11.245 13.281 5.025 1.00 1.73 C ATOM 2497 C GLY B 54 -10.473 12.746 3.830 1.00 1.56 C ATOM 2498 O GLY B 54 -10.299 13.435 2.829 1.00 2.00 O ATOM 0 H GLY B 54 -13.283 13.327 4.637 1.00 1.52 H new ATOM 0 HA2 GLY B 54 -11.308 14.368 4.979 1.00 1.73 H new ATOM 0 HA3 GLY B 54 -10.728 13.031 5.952 1.00 1.73 H new ATOM 2502 N SER B 55 -10.054 11.481 3.920 1.00 1.20 N ATOM 2503 CA SER B 55 -9.522 10.784 2.761 1.00 1.37 C ATOM 2504 C SER B 55 -10.548 10.781 1.636 1.00 1.08 C ATOM 2505 O SER B 55 -10.189 10.956 0.477 1.00 1.19 O ATOM 2506 CB SER B 55 -9.236 9.337 3.100 1.00 1.87 C ATOM 2507 OG SER B 55 -8.312 9.196 4.134 1.00 2.47 O ATOM 0 H SER B 55 -10.075 10.929 4.777 1.00 1.20 H new ATOM 0 HA SER B 55 -8.609 11.297 2.458 1.00 1.37 H new ATOM 0 HB2 SER B 55 -10.167 8.844 3.381 1.00 1.87 H new ATOM 0 HB3 SER B 55 -8.861 8.828 2.212 1.00 1.87 H new ATOM 0 HG SER B 55 -7.852 8.335 4.046 1.00 2.47 H new ATOM 2513 N LEU B 56 -11.824 10.575 1.988 1.00 0.88 N ATOM 2514 CA LEU B 56 -12.916 10.631 1.032 1.00 0.86 C ATOM 2515 C LEU B 56 -12.777 11.919 0.246 1.00 0.87 C ATOM 2516 O LEU B 56 -12.673 11.874 -0.969 1.00 0.92 O ATOM 2517 CB LEU B 56 -14.261 10.564 1.760 1.00 0.97 C ATOM 2518 CG LEU B 56 -15.525 10.605 0.881 1.00 1.46 C ATOM 2519 CD1 LEU B 56 -15.854 11.984 0.291 1.00 1.93 C ATOM 2520 CD2 LEU B 56 -15.503 9.535 -0.216 1.00 2.33 C ATOM 0 H LEU B 56 -12.118 10.366 2.942 1.00 0.88 H new ATOM 0 HA LEU B 56 -12.877 9.781 0.351 1.00 0.86 H new ATOM 0 HB2 LEU B 56 -14.285 9.646 2.348 1.00 0.97 H new ATOM 0 HB3 LEU B 56 -14.309 11.395 2.464 1.00 0.97 H new ATOM 0 HG LEU B 56 -16.336 10.379 1.573 1.00 1.46 H new ATOM 0 HD11 LEU B 56 -16.759 11.915 -0.312 1.00 1.93 H new ATOM 0 HD12 LEU B 56 -16.011 12.698 1.100 1.00 1.93 H new ATOM 0 HD13 LEU B 56 -15.026 12.319 -0.334 1.00 1.93 H new ATOM 0 HD21 LEU B 56 -16.415 9.604 -0.809 1.00 2.33 H new ATOM 0 HD22 LEU B 56 -14.638 9.692 -0.860 1.00 2.33 H new ATOM 0 HD23 LEU B 56 -15.441 8.547 0.240 1.00 2.33 H new ATOM 2532 N ASP B 57 -12.749 13.054 0.939 1.00 0.98 N ATOM 2533 CA ASP B 57 -12.686 14.368 0.337 1.00 1.18 C ATOM 2534 C ASP B 57 -11.440 14.484 -0.554 1.00 1.17 C ATOM 2535 O ASP B 57 -11.553 14.752 -1.752 1.00 1.30 O ATOM 2536 CB ASP B 57 -12.696 15.431 1.452 1.00 1.42 C ATOM 2537 CG ASP B 57 -13.812 15.216 2.471 1.00 2.73 C ATOM 2538 OD1 ASP B 57 -13.771 14.156 3.145 1.00 4.21 O ATOM 2539 OD2 ASP B 57 -14.677 16.110 2.561 1.00 3.48 O ATOM 0 H ASP B 57 -12.770 13.078 1.958 1.00 0.98 H new ATOM 0 HA ASP B 57 -13.554 14.531 -0.302 1.00 1.18 H new ATOM 0 HB2 ASP B 57 -11.735 15.419 1.966 1.00 1.42 H new ATOM 0 HB3 ASP B 57 -12.806 16.419 1.004 1.00 1.42 H new ATOM 2544 N GLU B 58 -10.258 14.291 0.046 1.00 1.14 N ATOM 2545 CA GLU B 58 -8.947 14.345 -0.607 1.00 1.27 C ATOM 2546 C GLU B 58 -8.957 13.548 -1.923 1.00 1.17 C ATOM 2547 O GLU B 58 -8.615 14.049 -3.001 1.00 1.33 O ATOM 2548 CB GLU B 58 -7.892 13.806 0.377 1.00 1.32 C ATOM 2549 CG GLU B 58 -7.665 14.756 1.573 1.00 1.87 C ATOM 2550 CD GLU B 58 -7.018 14.080 2.781 1.00 3.51 C ATOM 2551 OE1 GLU B 58 -6.670 12.882 2.707 1.00 4.66 O ATOM 2552 OE2 GLU B 58 -6.921 14.720 3.854 1.00 4.47 O ATOM 0 H GLU B 58 -10.188 14.084 1.042 1.00 1.14 H new ATOM 0 HA GLU B 58 -8.701 15.374 -0.868 1.00 1.27 H new ATOM 0 HB2 GLU B 58 -8.208 12.830 0.746 1.00 1.32 H new ATOM 0 HB3 GLU B 58 -6.949 13.658 -0.150 1.00 1.32 H new ATOM 0 HG2 GLU B 58 -7.035 15.586 1.252 1.00 1.87 H new ATOM 0 HG3 GLU B 58 -8.622 15.181 1.875 1.00 1.87 H new ATOM 2559 N LYS B 59 -9.387 12.296 -1.828 1.00 1.00 N ATOM 2560 CA LYS B 59 -9.369 11.345 -2.919 1.00 1.06 C ATOM 2561 C LYS B 59 -10.459 11.673 -3.937 1.00 1.06 C ATOM 2562 O LYS B 59 -10.223 11.609 -5.138 1.00 1.08 O ATOM 2563 CB LYS B 59 -9.551 9.946 -2.328 1.00 1.09 C ATOM 2564 CG LYS B 59 -9.132 8.852 -3.313 1.00 1.02 C ATOM 2565 CD LYS B 59 -8.940 7.503 -2.609 1.00 1.09 C ATOM 2566 CE LYS B 59 -10.212 6.704 -2.331 1.00 1.29 C ATOM 2567 NZ LYS B 59 -11.085 7.370 -1.340 1.00 1.61 N ATOM 0 H LYS B 59 -9.767 11.909 -0.964 1.00 1.00 H new ATOM 0 HA LYS B 59 -8.419 11.393 -3.451 1.00 1.06 H new ATOM 0 HB2 LYS B 59 -8.962 9.858 -1.415 1.00 1.09 H new ATOM 0 HB3 LYS B 59 -10.595 9.803 -2.049 1.00 1.09 H new ATOM 0 HG2 LYS B 59 -9.889 8.753 -4.091 1.00 1.02 H new ATOM 0 HG3 LYS B 59 -8.204 9.141 -3.806 1.00 1.02 H new ATOM 0 HD2 LYS B 59 -8.276 6.890 -3.218 1.00 1.09 H new ATOM 0 HD3 LYS B 59 -8.432 7.680 -1.661 1.00 1.09 H new ATOM 0 HE2 LYS B 59 -10.762 6.565 -3.262 1.00 1.29 H new ATOM 0 HE3 LYS B 59 -9.944 5.712 -1.968 1.00 1.29 H new ATOM 0 HZ1 LYS B 59 -11.717 6.667 -0.906 1.00 1.61 H new ATOM 0 HZ2 LYS B 59 -10.499 7.811 -0.602 1.00 1.61 H new ATOM 0 HZ3 LYS B 59 -11.654 8.101 -1.814 1.00 1.61 H new ATOM 2581 N MET B 60 -11.660 12.010 -3.467 1.00 1.07 N ATOM 2582 CA MET B 60 -12.803 12.316 -4.311 1.00 1.10 C ATOM 2583 C MET B 60 -12.422 13.420 -5.281 1.00 1.13 C ATOM 2584 O MET B 60 -12.669 13.272 -6.469 1.00 1.13 O ATOM 2585 CB MET B 60 -14.039 12.687 -3.477 1.00 1.13 C ATOM 2586 CG MET B 60 -15.249 13.044 -4.352 1.00 1.29 C ATOM 2587 SD MET B 60 -15.824 11.729 -5.458 1.00 2.93 S ATOM 2588 CE MET B 60 -17.105 12.622 -6.365 1.00 2.88 C ATOM 0 H MET B 60 -11.864 12.078 -2.470 1.00 1.07 H new ATOM 0 HA MET B 60 -13.076 11.427 -4.879 1.00 1.10 H new ATOM 0 HB2 MET B 60 -14.299 11.852 -2.826 1.00 1.13 H new ATOM 0 HB3 MET B 60 -13.799 13.532 -2.832 1.00 1.13 H new ATOM 0 HG2 MET B 60 -16.074 13.334 -3.701 1.00 1.29 H new ATOM 0 HG3 MET B 60 -14.996 13.917 -4.954 1.00 1.29 H new ATOM 0 HE1 MET B 60 -17.566 11.956 -7.094 1.00 2.88 H new ATOM 0 HE2 MET B 60 -17.863 12.978 -5.668 1.00 2.88 H new ATOM 0 HE3 MET B 60 -16.660 13.472 -6.882 1.00 2.88 H new ATOM 2598 N LYS B 61 -11.790 14.494 -4.795 1.00 1.20 N ATOM 2599 CA LYS B 61 -11.274 15.535 -5.680 1.00 1.35 C ATOM 2600 C LYS B 61 -10.389 14.891 -6.752 1.00 1.22 C ATOM 2601 O LYS B 61 -10.627 15.021 -7.950 1.00 1.20 O ATOM 2602 CB LYS B 61 -10.446 16.548 -4.882 1.00 1.66 C ATOM 2603 CG LYS B 61 -11.227 17.241 -3.758 1.00 1.55 C ATOM 2604 CD LYS B 61 -10.236 17.499 -2.618 1.00 1.70 C ATOM 2605 CE LYS B 61 -10.881 18.084 -1.354 1.00 2.15 C ATOM 2606 NZ LYS B 61 -11.506 19.400 -1.588 1.00 2.33 N ATOM 0 H LYS B 61 -11.626 14.661 -3.802 1.00 1.20 H new ATOM 0 HA LYS B 61 -12.112 16.052 -6.148 1.00 1.35 H new ATOM 0 HB2 LYS B 61 -9.584 16.039 -4.452 1.00 1.66 H new ATOM 0 HB3 LYS B 61 -10.061 17.306 -5.564 1.00 1.66 H new ATOM 0 HG2 LYS B 61 -11.662 18.176 -4.110 1.00 1.55 H new ATOM 0 HG3 LYS B 61 -12.052 16.614 -3.418 1.00 1.55 H new ATOM 0 HD2 LYS B 61 -9.741 16.563 -2.361 1.00 1.70 H new ATOM 0 HD3 LYS B 61 -9.463 18.183 -2.969 1.00 1.70 H new ATOM 0 HE2 LYS B 61 -11.635 17.390 -0.982 1.00 2.15 H new ATOM 0 HE3 LYS B 61 -10.124 18.180 -0.576 1.00 2.15 H new ATOM 0 HZ1 LYS B 61 -11.925 19.748 -0.702 1.00 2.33 H new ATOM 0 HZ2 LYS B 61 -10.785 20.073 -1.917 1.00 2.33 H new ATOM 0 HZ3 LYS B 61 -12.249 19.308 -2.310 1.00 2.33 H new ATOM 2620 N SER B 62 -9.361 14.179 -6.290 1.00 1.20 N ATOM 2621 CA SER B 62 -8.391 13.509 -7.142 1.00 1.19 C ATOM 2622 C SER B 62 -9.052 12.665 -8.246 1.00 1.14 C ATOM 2623 O SER B 62 -8.622 12.722 -9.397 1.00 1.25 O ATOM 2624 CB SER B 62 -7.426 12.691 -6.278 1.00 1.18 C ATOM 2625 OG SER B 62 -6.912 13.485 -5.219 1.00 2.11 O ATOM 0 H SER B 62 -9.180 14.052 -5.294 1.00 1.20 H new ATOM 0 HA SER B 62 -7.819 14.271 -7.672 1.00 1.19 H new ATOM 0 HB2 SER B 62 -7.941 11.821 -5.871 1.00 1.18 H new ATOM 0 HB3 SER B 62 -6.606 12.318 -6.892 1.00 1.18 H new ATOM 0 HG SER B 62 -7.536 13.467 -4.464 1.00 2.11 H new ATOM 2631 N LEU B 63 -10.088 11.885 -7.915 1.00 1.07 N ATOM 2632 CA LEU B 63 -10.838 11.119 -8.908 1.00 1.07 C ATOM 2633 C LEU B 63 -11.623 12.076 -9.816 1.00 1.10 C ATOM 2634 O LEU B 63 -11.516 12.001 -11.039 1.00 1.12 O ATOM 2635 CB LEU B 63 -11.781 10.092 -8.243 1.00 1.07 C ATOM 2636 CG LEU B 63 -11.149 8.881 -7.523 1.00 1.10 C ATOM 2637 CD1 LEU B 63 -9.646 8.964 -7.220 1.00 1.16 C ATOM 2638 CD2 LEU B 63 -11.890 8.658 -6.204 1.00 1.44 C ATOM 0 H LEU B 63 -10.425 11.770 -6.959 1.00 1.07 H new ATOM 0 HA LEU B 63 -10.128 10.556 -9.513 1.00 1.07 H new ATOM 0 HB2 LEU B 63 -12.397 10.625 -7.519 1.00 1.07 H new ATOM 0 HB3 LEU B 63 -12.452 9.709 -9.012 1.00 1.07 H new ATOM 0 HG LEU B 63 -11.250 8.057 -8.229 1.00 1.10 H new ATOM 0 HD11 LEU B 63 -9.326 8.053 -6.714 1.00 1.16 H new ATOM 0 HD12 LEU B 63 -9.092 9.075 -8.152 1.00 1.16 H new ATOM 0 HD13 LEU B 63 -9.451 9.823 -6.578 1.00 1.16 H new ATOM 0 HD21 LEU B 63 -11.456 7.805 -5.682 1.00 1.44 H new ATOM 0 HD22 LEU B 63 -11.801 9.548 -5.581 1.00 1.44 H new ATOM 0 HD23 LEU B 63 -12.943 8.461 -6.407 1.00 1.44 H new ATOM 2650 N ASP B 64 -12.407 12.968 -9.208 1.00 1.14 N ATOM 2651 CA ASP B 64 -13.326 13.885 -9.872 1.00 1.19 C ATOM 2652 C ASP B 64 -12.642 14.662 -10.996 1.00 1.20 C ATOM 2653 O ASP B 64 -13.197 14.768 -12.088 1.00 1.26 O ATOM 2654 CB ASP B 64 -13.937 14.829 -8.832 1.00 1.23 C ATOM 2655 CG ASP B 64 -14.919 15.798 -9.466 1.00 1.36 C ATOM 2656 OD1 ASP B 64 -16.091 15.394 -9.614 1.00 1.81 O ATOM 2657 OD2 ASP B 64 -14.482 16.930 -9.766 1.00 2.93 O ATOM 0 H ASP B 64 -12.417 13.073 -8.193 1.00 1.14 H new ATOM 0 HA ASP B 64 -14.121 13.304 -10.339 1.00 1.19 H new ATOM 0 HB2 ASP B 64 -14.445 14.246 -8.064 1.00 1.23 H new ATOM 0 HB3 ASP B 64 -13.143 15.387 -8.335 1.00 1.23 H new ATOM 2662 N VAL B 65 -11.423 15.151 -10.736 1.00 1.17 N ATOM 2663 CA VAL B 65 -10.607 15.895 -11.697 1.00 1.21 C ATOM 2664 C VAL B 65 -10.591 15.206 -13.061 1.00 1.19 C ATOM 2665 O VAL B 65 -11.114 15.733 -14.040 1.00 1.24 O ATOM 2666 CB VAL B 65 -9.178 16.061 -11.142 1.00 1.25 C ATOM 2667 CG1 VAL B 65 -8.161 16.552 -12.182 1.00 1.71 C ATOM 2668 CG2 VAL B 65 -9.189 17.081 -10.008 1.00 1.61 C ATOM 0 H VAL B 65 -10.968 15.036 -9.830 1.00 1.17 H new ATOM 0 HA VAL B 65 -11.047 16.882 -11.841 1.00 1.21 H new ATOM 0 HB VAL B 65 -8.872 15.069 -10.811 1.00 1.25 H new ATOM 0 HG11 VAL B 65 -7.180 16.644 -11.716 1.00 1.71 H new ATOM 0 HG12 VAL B 65 -8.107 15.838 -13.004 1.00 1.71 H new ATOM 0 HG13 VAL B 65 -8.473 17.523 -12.566 1.00 1.71 H new ATOM 0 HG21 VAL B 65 -8.179 17.199 -9.615 1.00 1.61 H new ATOM 0 HG22 VAL B 65 -9.546 18.040 -10.384 1.00 1.61 H new ATOM 0 HG23 VAL B 65 -9.849 16.734 -9.213 1.00 1.61 H new ATOM 2678 N ASN B 66 -9.943 14.041 -13.132 1.00 1.16 N ATOM 2679 CA ASN B 66 -9.783 13.312 -14.392 1.00 1.19 C ATOM 2680 C ASN B 66 -9.667 11.810 -14.149 1.00 1.24 C ATOM 2681 O ASN B 66 -8.714 11.170 -14.596 1.00 1.27 O ATOM 2682 CB ASN B 66 -8.571 13.832 -15.193 1.00 1.20 C ATOM 2683 CG ASN B 66 -8.799 15.192 -15.849 1.00 1.48 C ATOM 2684 OD1 ASN B 66 -8.208 16.189 -15.448 1.00 2.81 O ATOM 2685 ND2 ASN B 66 -9.624 15.242 -16.891 1.00 1.92 N ATOM 0 H ASN B 66 -9.519 13.580 -12.327 1.00 1.16 H new ATOM 0 HA ASN B 66 -10.678 13.490 -14.988 1.00 1.19 H new ATOM 0 HB2 ASN B 66 -7.711 13.901 -14.527 1.00 1.20 H new ATOM 0 HB3 ASN B 66 -8.319 13.105 -15.965 1.00 1.20 H new ATOM 0 HD21 ASN B 66 -9.778 16.125 -17.378 1.00 1.92 H new ATOM 0 HD22 ASN B 66 -10.103 14.397 -17.203 1.00 1.92 H new ATOM 2692 N GLN B 67 -10.684 11.217 -13.518 1.00 1.28 N ATOM 2693 CA GLN B 67 -10.772 9.773 -13.346 1.00 1.26 C ATOM 2694 C GLN B 67 -10.504 9.001 -14.641 1.00 1.36 C ATOM 2695 O GLN B 67 -9.927 7.913 -14.632 1.00 1.53 O ATOM 2696 CB GLN B 67 -12.147 9.356 -12.811 1.00 1.27 C ATOM 2697 CG GLN B 67 -13.357 9.969 -13.544 1.00 1.37 C ATOM 2698 CD GLN B 67 -13.847 11.226 -12.842 1.00 2.28 C ATOM 2699 OE1 GLN B 67 -14.444 11.124 -11.775 1.00 3.15 O ATOM 2700 NE2 GLN B 67 -13.591 12.393 -13.427 1.00 3.17 N ATOM 0 H GLN B 67 -11.468 11.729 -13.113 1.00 1.28 H new ATOM 0 HA GLN B 67 -9.995 9.520 -12.624 1.00 1.26 H new ATOM 0 HB2 GLN B 67 -12.224 8.270 -12.864 1.00 1.27 H new ATOM 0 HB3 GLN B 67 -12.206 9.629 -11.757 1.00 1.27 H new ATOM 0 HG2 GLN B 67 -13.081 10.207 -14.571 1.00 1.37 H new ATOM 0 HG3 GLN B 67 -14.164 9.238 -13.593 1.00 1.37 H new ATOM 0 HE21 GLN B 67 -13.090 12.419 -14.315 1.00 3.17 H new ATOM 0 HE22 GLN B 67 -13.895 13.262 -12.987 1.00 3.17 H new ATOM 2709 N ASP B 68 -10.951 9.576 -15.756 1.00 1.37 N ATOM 2710 CA ASP B 68 -10.873 8.977 -17.071 1.00 1.43 C ATOM 2711 C ASP B 68 -9.426 8.600 -17.442 1.00 1.50 C ATOM 2712 O ASP B 68 -9.202 7.703 -18.249 1.00 1.69 O ATOM 2713 CB ASP B 68 -11.463 9.981 -18.066 1.00 1.40 C ATOM 2714 CG ASP B 68 -11.383 9.474 -19.497 1.00 2.23 C ATOM 2715 OD1 ASP B 68 -12.207 8.594 -19.828 1.00 2.73 O ATOM 2716 OD2 ASP B 68 -10.520 10.001 -20.228 1.00 3.63 O ATOM 0 H ASP B 68 -11.388 10.497 -15.761 1.00 1.37 H new ATOM 0 HA ASP B 68 -11.438 8.045 -17.092 1.00 1.43 H new ATOM 0 HB2 ASP B 68 -12.504 10.179 -17.808 1.00 1.40 H new ATOM 0 HB3 ASP B 68 -10.929 10.928 -17.986 1.00 1.40 H new ATOM 2721 N SER B 69 -8.437 9.226 -16.785 1.00 1.43 N ATOM 2722 CA SER B 69 -7.003 8.973 -16.935 1.00 1.53 C ATOM 2723 C SER B 69 -6.577 7.505 -16.741 1.00 1.59 C ATOM 2724 O SER B 69 -5.397 7.205 -16.926 1.00 3.21 O ATOM 2725 CB SER B 69 -6.266 9.863 -15.918 1.00 1.51 C ATOM 2726 OG SER B 69 -4.855 9.830 -16.076 1.00 2.34 O ATOM 0 H SER B 69 -8.630 9.958 -16.102 1.00 1.43 H new ATOM 0 HA SER B 69 -6.743 9.207 -17.967 1.00 1.53 H new ATOM 0 HB2 SER B 69 -6.614 10.891 -16.022 1.00 1.51 H new ATOM 0 HB3 SER B 69 -6.521 9.541 -14.908 1.00 1.51 H new ATOM 0 HG SER B 69 -4.437 10.412 -15.408 1.00 2.34 H new ATOM 2732 N GLU B 70 -7.477 6.620 -16.298 1.00 0.95 N ATOM 2733 CA GLU B 70 -7.191 5.254 -15.878 1.00 0.99 C ATOM 2734 C GLU B 70 -6.315 5.231 -14.636 1.00 1.01 C ATOM 2735 O GLU B 70 -5.703 6.229 -14.251 1.00 1.19 O ATOM 2736 CB GLU B 70 -6.592 4.374 -16.984 1.00 1.24 C ATOM 2737 CG GLU B 70 -7.652 3.987 -18.008 1.00 1.96 C ATOM 2738 CD GLU B 70 -7.002 3.221 -19.146 1.00 2.41 C ATOM 2739 OE1 GLU B 70 -6.227 3.830 -19.918 1.00 2.51 O ATOM 2740 OE2 GLU B 70 -7.136 1.978 -19.186 1.00 3.49 O ATOM 0 H GLU B 70 -8.467 6.852 -16.221 1.00 0.95 H new ATOM 0 HA GLU B 70 -8.159 4.815 -15.637 1.00 0.99 H new ATOM 0 HB2 GLU B 70 -5.781 4.908 -17.479 1.00 1.24 H new ATOM 0 HB3 GLU B 70 -6.160 3.475 -16.544 1.00 1.24 H new ATOM 0 HG2 GLU B 70 -8.422 3.375 -17.537 1.00 1.96 H new ATOM 0 HG3 GLU B 70 -8.145 4.880 -18.392 1.00 1.96 H new ATOM 2747 N LEU B 71 -6.296 4.075 -13.982 1.00 1.12 N ATOM 2748 CA LEU B 71 -5.548 3.891 -12.755 1.00 1.31 C ATOM 2749 C LEU B 71 -4.254 3.151 -13.069 1.00 1.16 C ATOM 2750 O LEU B 71 -4.243 2.206 -13.855 1.00 1.25 O ATOM 2751 CB LEU B 71 -6.422 3.172 -11.725 1.00 1.65 C ATOM 2752 CG LEU B 71 -5.867 3.240 -10.297 1.00 1.50 C ATOM 2753 CD1 LEU B 71 -5.808 4.668 -9.744 1.00 1.53 C ATOM 2754 CD2 LEU B 71 -6.831 2.462 -9.403 1.00 2.65 C ATOM 0 H LEU B 71 -6.799 3.244 -14.291 1.00 1.12 H new ATOM 0 HA LEU B 71 -5.273 4.850 -12.315 1.00 1.31 H new ATOM 0 HB2 LEU B 71 -7.420 3.609 -11.739 1.00 1.65 H new ATOM 0 HB3 LEU B 71 -6.527 2.127 -12.016 1.00 1.65 H new ATOM 0 HG LEU B 71 -4.854 2.838 -10.313 1.00 1.50 H new ATOM 0 HD11 LEU B 71 -5.407 4.649 -8.731 1.00 1.53 H new ATOM 0 HD12 LEU B 71 -5.164 5.277 -10.378 1.00 1.53 H new ATOM 0 HD13 LEU B 71 -6.811 5.094 -9.729 1.00 1.53 H new ATOM 0 HD21 LEU B 71 -6.472 2.485 -8.374 1.00 2.65 H new ATOM 0 HD22 LEU B 71 -7.820 2.917 -9.453 1.00 2.65 H new ATOM 0 HD23 LEU B 71 -6.889 1.428 -9.744 1.00 2.65 H new ATOM 2766 N LYS B 72 -3.158 3.600 -12.458 1.00 1.01 N ATOM 2767 CA LYS B 72 -1.836 3.022 -12.594 1.00 0.94 C ATOM 2768 C LYS B 72 -1.408 2.620 -11.187 1.00 0.89 C ATOM 2769 O LYS B 72 -1.839 3.258 -10.225 1.00 0.75 O ATOM 2770 CB LYS B 72 -0.852 4.019 -13.232 1.00 1.04 C ATOM 2771 CG LYS B 72 -1.421 4.779 -14.446 1.00 1.39 C ATOM 2772 CD LYS B 72 -2.065 6.107 -14.010 1.00 2.47 C ATOM 2773 CE LYS B 72 -2.711 6.900 -15.153 1.00 3.34 C ATOM 2774 NZ LYS B 72 -3.657 7.900 -14.612 1.00 4.79 N ATOM 0 H LYS B 72 -3.175 4.406 -11.833 1.00 1.01 H new ATOM 0 HA LYS B 72 -1.845 2.158 -13.259 1.00 0.94 H new ATOM 0 HB2 LYS B 72 -0.544 4.742 -12.477 1.00 1.04 H new ATOM 0 HB3 LYS B 72 0.044 3.481 -13.542 1.00 1.04 H new ATOM 0 HG2 LYS B 72 -0.624 4.975 -15.164 1.00 1.39 H new ATOM 0 HG3 LYS B 72 -2.161 4.160 -14.953 1.00 1.39 H new ATOM 0 HD2 LYS B 72 -2.822 5.899 -13.254 1.00 2.47 H new ATOM 0 HD3 LYS B 72 -1.304 6.728 -13.537 1.00 2.47 H new ATOM 0 HE2 LYS B 72 -1.940 7.399 -15.740 1.00 3.34 H new ATOM 0 HE3 LYS B 72 -3.234 6.221 -15.826 1.00 3.34 H new ATOM 0 HZ1 LYS B 72 -3.998 8.508 -15.384 1.00 4.79 H new ATOM 0 HZ2 LYS B 72 -4.464 7.413 -14.173 1.00 4.79 H new ATOM 0 HZ3 LYS B 72 -3.175 8.483 -13.898 1.00 4.79 H new ATOM 2788 N PHE B 73 -0.598 1.568 -11.048 1.00 1.06 N ATOM 2789 CA PHE B 73 -0.323 0.950 -9.755 1.00 1.07 C ATOM 2790 C PHE B 73 0.152 1.968 -8.712 1.00 0.95 C ATOM 2791 O PHE B 73 -0.289 1.938 -7.566 1.00 0.81 O ATOM 2792 CB PHE B 73 0.647 -0.227 -9.904 1.00 1.40 C ATOM 2793 CG PHE B 73 2.012 0.108 -10.466 1.00 0.83 C ATOM 2794 CD1 PHE B 73 2.220 0.131 -11.856 1.00 1.98 C ATOM 2795 CD2 PHE B 73 3.106 0.265 -9.594 1.00 2.05 C ATOM 2796 CE1 PHE B 73 3.505 0.354 -12.377 1.00 2.37 C ATOM 2797 CE2 PHE B 73 4.401 0.410 -10.117 1.00 2.91 C ATOM 2798 CZ PHE B 73 4.601 0.479 -11.506 1.00 2.60 C ATOM 0 H PHE B 73 -0.116 1.123 -11.829 1.00 1.06 H new ATOM 0 HA PHE B 73 -1.264 0.551 -9.377 1.00 1.07 H new ATOM 0 HB2 PHE B 73 0.782 -0.688 -8.925 1.00 1.40 H new ATOM 0 HB3 PHE B 73 0.184 -0.975 -10.548 1.00 1.40 H new ATOM 0 HD1 PHE B 73 1.388 -0.024 -12.527 1.00 1.98 H new ATOM 0 HD2 PHE B 73 2.950 0.274 -8.525 1.00 2.05 H new ATOM 0 HE1 PHE B 73 3.651 0.429 -13.444 1.00 2.37 H new ATOM 0 HE2 PHE B 73 5.247 0.469 -9.449 1.00 2.91 H new ATOM 0 HZ PHE B 73 5.594 0.628 -11.903 1.00 2.60 H new ATOM 2808 N ASN B 74 1.022 2.894 -9.115 1.00 1.10 N ATOM 2809 CA ASN B 74 1.488 3.970 -8.248 1.00 1.14 C ATOM 2810 C ASN B 74 0.332 4.835 -7.731 1.00 0.98 C ATOM 2811 O ASN B 74 0.297 5.196 -6.555 1.00 0.97 O ATOM 2812 CB ASN B 74 2.494 4.841 -8.998 1.00 1.43 C ATOM 2813 CG ASN B 74 3.023 5.944 -8.086 1.00 1.46 C ATOM 2814 OD1 ASN B 74 3.737 5.671 -7.130 1.00 2.67 O ATOM 2815 ND2 ASN B 74 2.694 7.200 -8.373 1.00 1.86 N ATOM 0 H ASN B 74 1.422 2.917 -10.053 1.00 1.10 H new ATOM 0 HA ASN B 74 1.967 3.512 -7.383 1.00 1.14 H new ATOM 0 HB2 ASN B 74 3.321 4.228 -9.356 1.00 1.43 H new ATOM 0 HB3 ASN B 74 2.021 5.281 -9.876 1.00 1.43 H new ATOM 0 HD21 ASN B 74 3.038 7.963 -7.790 1.00 1.86 H new ATOM 0 HD22 ASN B 74 2.097 7.400 -9.176 1.00 1.86 H new ATOM 2822 N GLU B 75 -0.605 5.194 -8.615 1.00 0.94 N ATOM 2823 CA GLU B 75 -1.737 6.033 -8.255 1.00 0.84 C ATOM 2824 C GLU B 75 -2.695 5.254 -7.357 1.00 0.73 C ATOM 2825 O GLU B 75 -3.103 5.747 -6.305 1.00 0.76 O ATOM 2826 CB GLU B 75 -2.453 6.551 -9.507 1.00 0.90 C ATOM 2827 CG GLU B 75 -1.523 7.315 -10.460 1.00 1.50 C ATOM 2828 CD GLU B 75 -2.236 8.519 -11.062 1.00 2.28 C ATOM 2829 OE1 GLU B 75 -2.315 9.517 -10.310 1.00 3.06 O ATOM 2830 OE2 GLU B 75 -2.707 8.417 -12.217 1.00 3.66 O ATOM 0 H GLU B 75 -0.594 4.909 -9.594 1.00 0.94 H new ATOM 0 HA GLU B 75 -1.371 6.899 -7.704 1.00 0.84 H new ATOM 0 HB2 GLU B 75 -2.897 5.709 -10.039 1.00 0.90 H new ATOM 0 HB3 GLU B 75 -3.271 7.205 -9.206 1.00 0.90 H new ATOM 0 HG2 GLU B 75 -0.634 7.645 -9.922 1.00 1.50 H new ATOM 0 HG3 GLU B 75 -1.185 6.651 -11.256 1.00 1.50 H new ATOM 2837 N TYR B 76 -3.020 4.024 -7.767 1.00 0.69 N ATOM 2838 CA TYR B 76 -3.731 3.070 -6.929 1.00 0.68 C ATOM 2839 C TYR B 76 -3.138 3.111 -5.526 1.00 0.64 C ATOM 2840 O TYR B 76 -3.882 3.235 -4.559 1.00 0.65 O ATOM 2841 CB TYR B 76 -3.654 1.665 -7.544 1.00 0.77 C ATOM 2842 CG TYR B 76 -3.942 0.520 -6.592 1.00 1.04 C ATOM 2843 CD1 TYR B 76 -2.909 0.022 -5.777 1.00 1.95 C ATOM 2844 CD2 TYR B 76 -5.196 -0.120 -6.594 1.00 1.77 C ATOM 2845 CE1 TYR B 76 -3.128 -1.095 -4.963 1.00 2.30 C ATOM 2846 CE2 TYR B 76 -5.402 -1.268 -5.806 1.00 2.03 C ATOM 2847 CZ TYR B 76 -4.362 -1.756 -4.993 1.00 1.87 C ATOM 2848 OH TYR B 76 -4.544 -2.843 -4.192 1.00 2.31 O ATOM 0 H TYR B 76 -2.793 3.666 -8.695 1.00 0.69 H new ATOM 0 HA TYR B 76 -4.787 3.334 -6.866 1.00 0.68 H new ATOM 0 HB2 TYR B 76 -4.359 1.611 -8.374 1.00 0.77 H new ATOM 0 HB3 TYR B 76 -2.658 1.525 -7.963 1.00 0.77 H new ATOM 0 HD1 TYR B 76 -1.943 0.504 -5.780 1.00 1.95 H new ATOM 0 HD2 TYR B 76 -6.000 0.270 -7.200 1.00 1.77 H new ATOM 0 HE1 TYR B 76 -2.343 -1.448 -4.310 1.00 2.30 H new ATOM 0 HE2 TYR B 76 -6.356 -1.773 -5.825 1.00 2.03 H new ATOM 0 HH TYR B 76 -5.379 -2.742 -3.688 1.00 2.31 H new ATOM 2858 N TRP B 77 -1.808 3.030 -5.416 1.00 0.63 N ATOM 2859 CA TRP B 77 -1.143 2.912 -4.142 1.00 0.65 C ATOM 2860 C TRP B 77 -1.572 3.994 -3.150 1.00 0.65 C ATOM 2861 O TRP B 77 -2.323 3.708 -2.217 1.00 0.66 O ATOM 2862 CB TRP B 77 0.370 2.861 -4.353 1.00 0.72 C ATOM 2863 CG TRP B 77 0.975 1.925 -3.405 1.00 0.57 C ATOM 2864 CD1 TRP B 77 1.227 2.245 -2.131 1.00 0.52 C ATOM 2865 CD2 TRP B 77 1.452 0.571 -3.612 1.00 0.53 C ATOM 2866 NE1 TRP B 77 1.747 1.152 -1.494 1.00 0.44 N ATOM 2867 CE2 TRP B 77 1.980 0.117 -2.376 1.00 0.45 C ATOM 2868 CE3 TRP B 77 1.583 -0.285 -4.726 1.00 0.67 C ATOM 2869 CZ2 TRP B 77 2.621 -1.117 -2.253 1.00 0.55 C ATOM 2870 CZ3 TRP B 77 2.235 -1.524 -4.598 1.00 0.72 C ATOM 2871 CH2 TRP B 77 2.714 -1.958 -3.362 1.00 0.69 C ATOM 0 H TRP B 77 -1.175 3.046 -6.215 1.00 0.63 H new ATOM 0 HA TRP B 77 -1.451 1.974 -3.679 1.00 0.65 H new ATOM 0 HB2 TRP B 77 0.593 2.552 -5.374 1.00 0.72 H new ATOM 0 HB3 TRP B 77 0.798 3.855 -4.220 1.00 0.72 H new ATOM 0 HD1 TRP B 77 1.049 3.209 -1.679 1.00 0.52 H new ATOM 0 HE1 TRP B 77 1.938 1.108 -0.493 1.00 0.44 H new ATOM 0 HE3 TRP B 77 1.180 0.013 -5.683 1.00 0.67 H new ATOM 0 HZ2 TRP B 77 3.042 -1.419 -1.305 1.00 0.55 H new ATOM 0 HZ3 TRP B 77 2.367 -2.149 -5.469 1.00 0.72 H new ATOM 0 HH2 TRP B 77 3.154 -2.939 -3.264 1.00 0.69 H new ATOM 2882 N ARG B 78 -1.108 5.235 -3.338 1.00 0.65 N ATOM 2883 CA ARG B 78 -1.565 6.367 -2.552 1.00 0.66 C ATOM 2884 C ARG B 78 -3.091 6.349 -2.340 1.00 0.71 C ATOM 2885 O ARG B 78 -3.526 6.591 -1.221 1.00 0.72 O ATOM 2886 CB ARG B 78 -1.081 7.679 -3.185 1.00 0.71 C ATOM 2887 CG ARG B 78 -1.672 7.989 -4.558 1.00 1.50 C ATOM 2888 CD ARG B 78 -1.220 9.370 -5.034 1.00 1.57 C ATOM 2889 NE ARG B 78 -2.219 9.956 -5.948 1.00 2.89 N ATOM 2890 CZ ARG B 78 -2.203 9.922 -7.291 1.00 4.15 C ATOM 2891 NH1 ARG B 78 -1.142 9.477 -7.960 1.00 4.62 N ATOM 2892 NH2 ARG B 78 -3.256 10.326 -8.003 1.00 5.52 N ATOM 0 H ARG B 78 -0.407 5.473 -4.040 1.00 0.65 H new ATOM 0 HA ARG B 78 -1.126 6.290 -1.557 1.00 0.66 H new ATOM 0 HB2 ARG B 78 -1.319 8.501 -2.509 1.00 0.71 H new ATOM 0 HB3 ARG B 78 0.005 7.644 -3.273 1.00 0.71 H new ATOM 0 HG2 ARG B 78 -1.359 7.230 -5.275 1.00 1.50 H new ATOM 0 HG3 ARG B 78 -2.760 7.952 -4.509 1.00 1.50 H new ATOM 0 HD2 ARG B 78 -1.074 10.027 -4.176 1.00 1.57 H new ATOM 0 HD3 ARG B 78 -0.258 9.289 -5.541 1.00 1.57 H new ATOM 0 HE ARG B 78 -3.006 10.438 -5.514 1.00 2.89 H new ATOM 0 HH11 ARG B 78 -0.319 9.153 -7.453 1.00 4.62 H new ATOM 0 HH12 ARG B 78 -1.152 9.460 -8.980 1.00 4.62 H new ATOM 0 HH21 ARG B 78 -4.092 10.668 -7.528 1.00 5.52 H new ATOM 0 HH22 ARG B 78 -3.226 10.293 -9.022 1.00 5.52 H new ATOM 2906 N LEU B 79 -3.907 6.036 -3.364 1.00 0.75 N ATOM 2907 CA LEU B 79 -5.364 6.007 -3.206 1.00 0.78 C ATOM 2908 C LEU B 79 -5.814 4.955 -2.177 1.00 0.72 C ATOM 2909 O LEU B 79 -6.667 5.252 -1.339 1.00 0.75 O ATOM 2910 CB LEU B 79 -6.089 5.814 -4.551 1.00 0.87 C ATOM 2911 CG LEU B 79 -6.379 7.084 -5.387 1.00 1.07 C ATOM 2912 CD1 LEU B 79 -5.280 8.149 -5.420 1.00 1.24 C ATOM 2913 CD2 LEU B 79 -6.683 6.682 -6.831 1.00 1.47 C ATOM 0 H LEU B 79 -3.580 5.802 -4.301 1.00 0.75 H new ATOM 0 HA LEU B 79 -5.650 6.985 -2.819 1.00 0.78 H new ATOM 0 HB2 LEU B 79 -5.493 5.136 -5.162 1.00 0.87 H new ATOM 0 HB3 LEU B 79 -7.038 5.315 -4.355 1.00 0.87 H new ATOM 0 HG LEU B 79 -7.224 7.548 -4.878 1.00 1.07 H new ATOM 0 HD11 LEU B 79 -5.604 8.987 -6.037 1.00 1.24 H new ATOM 0 HD12 LEU B 79 -5.083 8.500 -4.407 1.00 1.24 H new ATOM 0 HD13 LEU B 79 -4.370 7.720 -5.839 1.00 1.24 H new ATOM 0 HD21 LEU B 79 -6.888 7.575 -7.422 1.00 1.47 H new ATOM 0 HD22 LEU B 79 -5.825 6.158 -7.251 1.00 1.47 H new ATOM 0 HD23 LEU B 79 -7.554 6.027 -6.851 1.00 1.47 H new ATOM 2925 N ILE B 80 -5.283 3.724 -2.204 1.00 0.66 N ATOM 2926 CA ILE B 80 -5.635 2.763 -1.155 1.00 0.62 C ATOM 2927 C ILE B 80 -5.061 3.242 0.192 1.00 0.56 C ATOM 2928 O ILE B 80 -5.651 3.000 1.241 1.00 0.55 O ATOM 2929 CB ILE B 80 -5.346 1.281 -1.497 1.00 0.61 C ATOM 2930 CG1 ILE B 80 -3.959 0.842 -1.032 1.00 0.60 C ATOM 2931 CG2 ILE B 80 -5.478 0.954 -2.980 1.00 0.84 C ATOM 2932 CD1 ILE B 80 -3.636 -0.643 -1.211 1.00 0.56 C ATOM 0 H ILE B 80 -4.633 3.381 -2.912 1.00 0.66 H new ATOM 0 HA ILE B 80 -6.722 2.750 -1.070 1.00 0.62 H new ATOM 0 HB ILE B 80 -6.115 0.730 -0.955 1.00 0.61 H new ATOM 0 HG12 ILE B 80 -3.214 1.424 -1.574 1.00 0.60 H new ATOM 0 HG13 ILE B 80 -3.854 1.093 0.024 1.00 0.60 H new ATOM 0 HG21 ILE B 80 -5.260 -0.102 -3.141 1.00 0.84 H new ATOM 0 HG22 ILE B 80 -6.494 1.170 -3.311 1.00 0.84 H new ATOM 0 HG23 ILE B 80 -4.774 1.560 -3.550 1.00 0.84 H new ATOM 0 HD11 ILE B 80 -2.628 -0.842 -0.848 1.00 0.56 H new ATOM 0 HD12 ILE B 80 -4.350 -1.241 -0.645 1.00 0.56 H new ATOM 0 HD13 ILE B 80 -3.700 -0.904 -2.267 1.00 0.56 H new ATOM 2944 N GLY B 81 -3.921 3.942 0.166 1.00 0.57 N ATOM 2945 CA GLY B 81 -3.354 4.627 1.323 1.00 0.59 C ATOM 2946 C GLY B 81 -4.360 5.569 1.975 1.00 0.62 C ATOM 2947 O GLY B 81 -4.658 5.456 3.165 1.00 0.66 O ATOM 0 H GLY B 81 -3.359 4.047 -0.679 1.00 0.57 H new ATOM 0 HA2 GLY B 81 -3.020 3.890 2.054 1.00 0.59 H new ATOM 0 HA3 GLY B 81 -2.474 5.192 1.015 1.00 0.59 H new ATOM 2951 N GLU B 82 -4.896 6.495 1.178 1.00 0.66 N ATOM 2952 CA GLU B 82 -6.004 7.344 1.563 1.00 0.74 C ATOM 2953 C GLU B 82 -7.113 6.463 2.141 1.00 0.71 C ATOM 2954 O GLU B 82 -7.541 6.708 3.265 1.00 0.75 O ATOM 2955 CB GLU B 82 -6.466 8.167 0.355 1.00 0.89 C ATOM 2956 CG GLU B 82 -5.476 9.273 -0.029 1.00 0.99 C ATOM 2957 CD GLU B 82 -5.941 10.011 -1.281 1.00 2.10 C ATOM 2958 OE1 GLU B 82 -6.153 9.317 -2.297 1.00 3.51 O ATOM 2959 OE2 GLU B 82 -6.088 11.248 -1.206 1.00 2.69 O ATOM 0 H GLU B 82 -4.560 6.672 0.231 1.00 0.66 H new ATOM 0 HA GLU B 82 -5.707 8.056 2.333 1.00 0.74 H new ATOM 0 HB2 GLU B 82 -6.609 7.503 -0.497 1.00 0.89 H new ATOM 0 HB3 GLU B 82 -7.435 8.615 0.576 1.00 0.89 H new ATOM 0 HG2 GLU B 82 -5.374 9.978 0.796 1.00 0.99 H new ATOM 0 HG3 GLU B 82 -4.491 8.840 -0.202 1.00 0.99 H new ATOM 2966 N LEU B 83 -7.531 5.409 1.429 1.00 0.67 N ATOM 2967 CA LEU B 83 -8.544 4.476 1.911 1.00 0.69 C ATOM 2968 C LEU B 83 -8.248 3.987 3.341 1.00 0.66 C ATOM 2969 O LEU B 83 -9.116 4.086 4.205 1.00 0.73 O ATOM 2970 CB LEU B 83 -8.744 3.323 0.918 1.00 0.74 C ATOM 2971 CG LEU B 83 -10.203 2.874 0.746 1.00 1.04 C ATOM 2972 CD1 LEU B 83 -10.951 2.712 2.067 1.00 2.19 C ATOM 2973 CD2 LEU B 83 -10.976 3.819 -0.175 1.00 2.33 C ATOM 0 H LEU B 83 -7.172 5.183 0.501 1.00 0.67 H new ATOM 0 HA LEU B 83 -9.490 5.013 1.972 1.00 0.69 H new ATOM 0 HB2 LEU B 83 -8.354 3.626 -0.054 1.00 0.74 H new ATOM 0 HB3 LEU B 83 -8.151 2.470 1.248 1.00 0.74 H new ATOM 0 HG LEU B 83 -10.147 1.887 0.286 1.00 1.04 H new ATOM 0 HD11 LEU B 83 -11.974 2.393 1.869 1.00 2.19 H new ATOM 0 HD12 LEU B 83 -10.450 1.963 2.679 1.00 2.19 H new ATOM 0 HD13 LEU B 83 -10.964 3.664 2.597 1.00 2.19 H new ATOM 0 HD21 LEU B 83 -12.004 3.471 -0.274 1.00 2.33 H new ATOM 0 HD22 LEU B 83 -10.972 4.823 0.248 1.00 2.33 H new ATOM 0 HD23 LEU B 83 -10.503 3.837 -1.157 1.00 2.33 H new ATOM 2985 N ALA B 84 -7.033 3.504 3.631 1.00 0.60 N ATOM 2986 CA ALA B 84 -6.653 3.135 4.996 1.00 0.63 C ATOM 2987 C ALA B 84 -6.875 4.265 6.020 1.00 0.73 C ATOM 2988 O ALA B 84 -7.177 3.994 7.179 1.00 0.85 O ATOM 2989 CB ALA B 84 -5.197 2.656 5.017 1.00 0.61 C ATOM 0 H ALA B 84 -6.299 3.361 2.938 1.00 0.60 H new ATOM 0 HA ALA B 84 -7.312 2.323 5.303 1.00 0.63 H new ATOM 0 HB1 ALA B 84 -4.919 2.383 6.035 1.00 0.61 H new ATOM 0 HB2 ALA B 84 -5.090 1.788 4.366 1.00 0.61 H new ATOM 0 HB3 ALA B 84 -4.546 3.456 4.665 1.00 0.61 H new ATOM 2995 N LYS B 85 -6.675 5.528 5.630 1.00 0.81 N ATOM 2996 CA LYS B 85 -6.920 6.707 6.472 1.00 1.02 C ATOM 2997 C LYS B 85 -8.418 7.087 6.470 1.00 1.20 C ATOM 2998 O LYS B 85 -8.910 7.707 7.414 1.00 1.63 O ATOM 2999 CB LYS B 85 -5.928 7.803 6.025 1.00 1.30 C ATOM 3000 CG LYS B 85 -5.868 9.140 6.801 1.00 1.30 C ATOM 3001 CD LYS B 85 -6.534 10.262 5.990 1.00 1.38 C ATOM 3002 CE LYS B 85 -6.100 11.711 6.241 1.00 2.14 C ATOM 3003 NZ LYS B 85 -6.788 12.588 5.265 1.00 2.86 N ATOM 0 H LYS B 85 -6.331 5.766 4.700 1.00 0.81 H new ATOM 0 HA LYS B 85 -6.724 6.520 7.528 1.00 1.02 H new ATOM 0 HB2 LYS B 85 -4.929 7.368 6.047 1.00 1.30 H new ATOM 0 HB3 LYS B 85 -6.150 8.039 4.984 1.00 1.30 H new ATOM 0 HG2 LYS B 85 -6.369 9.032 7.763 1.00 1.30 H new ATOM 0 HG3 LYS B 85 -4.830 9.400 7.009 1.00 1.30 H new ATOM 0 HD2 LYS B 85 -6.372 10.047 4.934 1.00 1.38 H new ATOM 0 HD3 LYS B 85 -7.608 10.204 6.166 1.00 1.38 H new ATOM 0 HE2 LYS B 85 -6.350 12.009 7.259 1.00 2.14 H new ATOM 0 HE3 LYS B 85 -5.019 11.805 6.137 1.00 2.14 H new ATOM 0 HZ1 LYS B 85 -6.315 13.514 5.236 1.00 2.86 H new ATOM 0 HZ2 LYS B 85 -6.754 12.152 4.322 1.00 2.86 H new ATOM 0 HZ3 LYS B 85 -7.780 12.715 5.551 1.00 2.86 H new ATOM 3017 N GLU B 86 -9.147 6.681 5.424 1.00 0.99 N ATOM 3018 CA GLU B 86 -10.586 6.835 5.242 1.00 1.12 C ATOM 3019 C GLU B 86 -11.257 5.900 6.248 1.00 1.10 C ATOM 3020 O GLU B 86 -11.779 6.367 7.256 1.00 1.27 O ATOM 3021 CB GLU B 86 -10.923 6.498 3.771 1.00 1.16 C ATOM 3022 CG GLU B 86 -12.063 7.201 3.019 1.00 1.48 C ATOM 3023 CD GLU B 86 -11.764 7.287 1.519 1.00 2.07 C ATOM 3024 OE1 GLU B 86 -10.667 7.766 1.162 1.00 2.18 O ATOM 3025 OE2 GLU B 86 -12.590 6.863 0.682 1.00 3.52 O ATOM 0 H GLU B 86 -8.714 6.205 4.633 1.00 0.99 H new ATOM 0 HA GLU B 86 -10.943 7.848 5.425 1.00 1.12 H new ATOM 0 HB2 GLU B 86 -10.014 6.666 3.193 1.00 1.16 H new ATOM 0 HB3 GLU B 86 -11.132 5.429 3.733 1.00 1.16 H new ATOM 0 HG2 GLU B 86 -12.995 6.659 3.177 1.00 1.48 H new ATOM 0 HG3 GLU B 86 -12.205 8.203 3.423 1.00 1.48 H new ATOM 3032 N ILE B 87 -11.198 4.588 6.024 1.00 0.95 N ATOM 3033 CA ILE B 87 -11.851 3.587 6.841 1.00 0.97 C ATOM 3034 C ILE B 87 -10.978 3.297 8.068 1.00 1.01 C ATOM 3035 O ILE B 87 -9.809 2.942 7.940 1.00 1.12 O ATOM 3036 CB ILE B 87 -12.176 2.356 5.965 1.00 0.95 C ATOM 3037 CG1 ILE B 87 -13.507 1.700 6.356 1.00 1.25 C ATOM 3038 CG2 ILE B 87 -11.047 1.320 5.863 1.00 1.12 C ATOM 3039 CD1 ILE B 87 -13.608 1.289 7.824 1.00 1.55 C ATOM 0 H ILE B 87 -10.677 4.189 5.244 1.00 0.95 H new ATOM 0 HA ILE B 87 -12.807 3.934 7.232 1.00 0.97 H new ATOM 0 HB ILE B 87 -12.280 2.763 4.959 1.00 0.95 H new ATOM 0 HG12 ILE B 87 -14.318 2.392 6.130 1.00 1.25 H new ATOM 0 HG13 ILE B 87 -13.658 0.818 5.734 1.00 1.25 H new ATOM 0 HG21 ILE B 87 -11.368 0.494 5.229 1.00 1.12 H new ATOM 0 HG22 ILE B 87 -10.162 1.787 5.431 1.00 1.12 H new ATOM 0 HG23 ILE B 87 -10.809 0.943 6.857 1.00 1.12 H new ATOM 0 HD11 ILE B 87 -14.581 0.835 8.008 1.00 1.55 H new ATOM 0 HD12 ILE B 87 -12.822 0.570 8.055 1.00 1.55 H new ATOM 0 HD13 ILE B 87 -13.492 2.169 8.457 1.00 1.55 H new ATOM 3051 N ARG B 88 -11.528 3.438 9.278 1.00 1.10 N ATOM 3052 CA ARG B 88 -10.754 3.292 10.505 1.00 1.22 C ATOM 3053 C ARG B 88 -10.612 1.799 10.814 1.00 1.20 C ATOM 3054 O ARG B 88 -11.232 1.283 11.740 1.00 1.40 O ATOM 3055 CB ARG B 88 -11.444 4.065 11.643 1.00 1.47 C ATOM 3056 CG ARG B 88 -10.642 4.115 12.956 1.00 2.24 C ATOM 3057 CD ARG B 88 -9.411 5.029 12.871 1.00 2.81 C ATOM 3058 NE ARG B 88 -8.714 5.124 14.166 1.00 4.02 N ATOM 3059 CZ ARG B 88 -9.063 5.920 15.192 1.00 4.71 C ATOM 3060 NH1 ARG B 88 -10.166 6.672 15.108 1.00 4.57 N ATOM 3061 NH2 ARG B 88 -8.309 5.962 16.296 1.00 6.08 N ATOM 0 H ARG B 88 -12.513 3.654 9.429 1.00 1.10 H new ATOM 0 HA ARG B 88 -9.755 3.712 10.393 1.00 1.22 H new ATOM 0 HB2 ARG B 88 -11.635 5.085 11.309 1.00 1.47 H new ATOM 0 HB3 ARG B 88 -12.413 3.608 11.841 1.00 1.47 H new ATOM 0 HG2 ARG B 88 -11.291 4.463 13.759 1.00 2.24 H new ATOM 0 HG3 ARG B 88 -10.322 3.107 13.219 1.00 2.24 H new ATOM 0 HD2 ARG B 88 -8.725 4.646 12.115 1.00 2.81 H new ATOM 0 HD3 ARG B 88 -9.718 6.024 12.549 1.00 2.81 H new ATOM 0 HE ARG B 88 -7.893 4.533 14.296 1.00 4.02 H new ATOM 0 HH11 ARG B 88 -10.741 6.641 14.266 1.00 4.57 H new ATOM 0 HH12 ARG B 88 -10.432 7.276 15.886 1.00 4.57 H new ATOM 0 HH21 ARG B 88 -7.467 5.389 16.361 1.00 6.08 H new ATOM 0 HH22 ARG B 88 -8.576 6.567 17.073 1.00 6.08 H new ATOM 3075 N LYS B 89 -9.766 1.122 10.032 1.00 1.23 N ATOM 3076 CA LYS B 89 -9.526 -0.315 10.121 1.00 1.37 C ATOM 3077 C LYS B 89 -9.138 -0.744 11.531 1.00 1.44 C ATOM 3078 O LYS B 89 -9.440 -1.851 11.970 1.00 1.44 O ATOM 3079 CB LYS B 89 -8.425 -0.699 9.138 1.00 1.89 C ATOM 3080 CG LYS B 89 -8.284 -2.194 8.833 1.00 1.42 C ATOM 3081 CD LYS B 89 -7.741 -2.308 7.403 1.00 1.90 C ATOM 3082 CE LYS B 89 -8.903 -2.188 6.407 1.00 2.28 C ATOM 3083 NZ LYS B 89 -9.556 -3.489 6.223 1.00 3.65 N ATOM 0 H LYS B 89 -9.216 1.574 9.301 1.00 1.23 H new ATOM 0 HA LYS B 89 -10.453 -0.830 9.870 1.00 1.37 H new ATOM 0 HB2 LYS B 89 -8.604 -0.173 8.200 1.00 1.89 H new ATOM 0 HB3 LYS B 89 -7.474 -0.338 9.530 1.00 1.89 H new ATOM 0 HG2 LYS B 89 -7.607 -2.671 9.542 1.00 1.42 H new ATOM 0 HG3 LYS B 89 -9.246 -2.699 8.922 1.00 1.42 H new ATOM 0 HD2 LYS B 89 -7.006 -1.525 7.218 1.00 1.90 H new ATOM 0 HD3 LYS B 89 -7.231 -3.262 7.271 1.00 1.90 H new ATOM 0 HE2 LYS B 89 -9.627 -1.459 6.770 1.00 2.28 H new ATOM 0 HE3 LYS B 89 -8.533 -1.821 5.450 1.00 2.28 H new ATOM 0 HZ1 LYS B 89 -10.484 -3.351 5.775 1.00 3.65 H new ATOM 0 HZ2 LYS B 89 -8.964 -4.092 5.616 1.00 3.65 H new ATOM 0 HZ3 LYS B 89 -9.683 -3.948 7.148 1.00 3.65 H new ATOM 3097 N LYS B 90 -8.459 0.139 12.260 1.00 1.72 N ATOM 3098 CA LYS B 90 -8.109 -0.076 13.653 1.00 2.12 C ATOM 3099 C LYS B 90 -9.358 0.146 14.526 1.00 2.28 C ATOM 3100 O LYS B 90 -9.351 0.987 15.423 1.00 2.99 O ATOM 3101 CB LYS B 90 -6.905 0.821 13.993 1.00 3.50 C ATOM 3102 CG LYS B 90 -5.674 0.328 13.206 1.00 4.78 C ATOM 3103 CD LYS B 90 -4.582 1.387 12.998 1.00 6.46 C ATOM 3104 CE LYS B 90 -3.856 1.771 14.294 1.00 7.38 C ATOM 3105 NZ LYS B 90 -2.627 2.541 14.012 1.00 9.11 N ATOM 0 H LYS B 90 -8.135 1.033 11.891 1.00 1.72 H new ATOM 0 HA LYS B 90 -7.793 -1.100 13.854 1.00 2.12 H new ATOM 0 HB2 LYS B 90 -7.124 1.858 13.738 1.00 3.50 H new ATOM 0 HB3 LYS B 90 -6.704 0.791 15.064 1.00 3.50 H new ATOM 0 HG2 LYS B 90 -5.241 -0.523 13.731 1.00 4.78 H new ATOM 0 HG3 LYS B 90 -6.003 -0.032 12.231 1.00 4.78 H new ATOM 0 HD2 LYS B 90 -3.854 1.012 12.279 1.00 6.46 H new ATOM 0 HD3 LYS B 90 -5.030 2.280 12.562 1.00 6.46 H new ATOM 0 HE2 LYS B 90 -4.521 2.361 14.925 1.00 7.38 H new ATOM 0 HE3 LYS B 90 -3.603 0.870 14.853 1.00 7.38 H new ATOM 0 HZ1 LYS B 90 -2.023 2.554 14.859 1.00 9.11 H new ATOM 0 HZ2 LYS B 90 -2.111 2.096 13.226 1.00 9.11 H new ATOM 0 HZ3 LYS B 90 -2.880 3.516 13.752 1.00 9.11 H new ATOM 3119 N LYS B 91 -10.415 -0.630 14.250 1.00 2.66 N ATOM 3120 CA LYS B 91 -11.570 -0.843 15.104 1.00 3.90 C ATOM 3121 C LYS B 91 -12.163 -2.234 14.842 1.00 3.79 C ATOM 3122 O LYS B 91 -12.141 -3.069 15.743 1.00 4.32 O ATOM 3123 CB LYS B 91 -12.678 0.182 14.829 1.00 5.29 C ATOM 3124 CG LYS B 91 -12.474 1.568 15.436 1.00 6.16 C ATOM 3125 CD LYS B 91 -13.705 2.464 15.208 1.00 7.50 C ATOM 3126 CE LYS B 91 -15.010 1.911 15.820 1.00 8.08 C ATOM 3127 NZ LYS B 91 -15.750 0.997 14.920 1.00 8.70 N ATOM 0 H LYS B 91 -10.481 -1.150 13.375 1.00 2.66 H new ATOM 0 HA LYS B 91 -11.226 -0.742 16.133 1.00 3.90 H new ATOM 0 HB2 LYS B 91 -12.784 0.292 13.750 1.00 5.29 H new ATOM 0 HB3 LYS B 91 -13.619 -0.221 15.202 1.00 5.29 H new ATOM 0 HG2 LYS B 91 -12.282 1.475 16.505 1.00 6.16 H new ATOM 0 HG3 LYS B 91 -11.594 2.035 14.994 1.00 6.16 H new ATOM 0 HD2 LYS B 91 -13.507 3.449 15.631 1.00 7.50 H new ATOM 0 HD3 LYS B 91 -13.848 2.600 14.136 1.00 7.50 H new ATOM 0 HE2 LYS B 91 -14.772 1.383 16.744 1.00 8.08 H new ATOM 0 HE3 LYS B 91 -15.658 2.746 16.088 1.00 8.08 H new ATOM 0 HZ1 LYS B 91 -16.656 1.431 14.653 1.00 8.70 H new ATOM 0 HZ2 LYS B 91 -15.186 0.820 14.065 1.00 8.70 H new ATOM 0 HZ3 LYS B 91 -15.928 0.097 15.410 1.00 8.70 H new ATOM 3141 N ASP B 92 -12.688 -2.492 13.632 1.00 3.52 N ATOM 3142 CA ASP B 92 -13.652 -3.580 13.452 1.00 3.80 C ATOM 3143 C ASP B 92 -13.154 -4.552 12.375 1.00 2.56 C ATOM 3144 O ASP B 92 -13.889 -4.924 11.461 1.00 2.81 O ATOM 3145 CB ASP B 92 -15.026 -2.979 13.056 1.00 5.15 C ATOM 3146 CG ASP B 92 -15.356 -1.636 13.689 1.00 6.29 C ATOM 3147 OD1 ASP B 92 -15.804 -1.591 14.858 1.00 6.63 O ATOM 3148 OD2 ASP B 92 -15.144 -0.595 13.027 1.00 7.36 O ATOM 0 H ASP B 92 -12.465 -1.972 12.783 1.00 3.52 H new ATOM 0 HA ASP B 92 -13.760 -4.135 14.384 1.00 3.80 H new ATOM 0 HB2 ASP B 92 -15.057 -2.868 11.972 1.00 5.15 H new ATOM 0 HB3 ASP B 92 -15.806 -3.691 13.326 1.00 5.15 H new ATOM 3153 N LEU B 93 -11.917 -5.039 12.527 1.00 1.69 N ATOM 3154 CA LEU B 93 -11.242 -5.861 11.519 1.00 1.00 C ATOM 3155 C LEU B 93 -12.086 -7.102 11.205 1.00 0.88 C ATOM 3156 O LEU B 93 -12.556 -7.291 10.085 1.00 1.16 O ATOM 3157 CB LEU B 93 -9.839 -6.205 12.049 1.00 2.14 C ATOM 3158 CG LEU B 93 -8.917 -6.894 11.026 1.00 2.14 C ATOM 3159 CD1 LEU B 93 -7.456 -6.632 11.415 1.00 2.92 C ATOM 3160 CD2 LEU B 93 -9.140 -8.411 10.939 1.00 3.14 C ATOM 0 H LEU B 93 -11.353 -4.872 13.360 1.00 1.69 H new ATOM 0 HA LEU B 93 -11.129 -5.324 10.577 1.00 1.00 H new ATOM 0 HB2 LEU B 93 -9.359 -5.288 12.390 1.00 2.14 H new ATOM 0 HB3 LEU B 93 -9.943 -6.853 12.919 1.00 2.14 H new ATOM 0 HG LEU B 93 -9.153 -6.474 10.048 1.00 2.14 H new ATOM 0 HD11 LEU B 93 -6.796 -7.116 10.696 1.00 2.92 H new ATOM 0 HD12 LEU B 93 -7.267 -5.559 11.416 1.00 2.92 H new ATOM 0 HD13 LEU B 93 -7.267 -7.035 12.410 1.00 2.92 H new ATOM 0 HD21 LEU B 93 -8.460 -8.837 10.201 1.00 3.14 H new ATOM 0 HD22 LEU B 93 -8.949 -8.863 11.912 1.00 3.14 H new ATOM 0 HD23 LEU B 93 -10.170 -8.611 10.642 1.00 3.14 H new ATOM 3172 N LYS B 94 -12.318 -7.924 12.230 1.00 1.42 N ATOM 3173 CA LYS B 94 -12.956 -9.228 12.088 1.00 1.51 C ATOM 3174 C LYS B 94 -14.465 -9.114 11.853 1.00 1.46 C ATOM 3175 O LYS B 94 -15.096 -10.055 11.372 1.00 1.45 O ATOM 3176 CB LYS B 94 -12.538 -10.124 13.281 1.00 2.45 C ATOM 3177 CG LYS B 94 -13.611 -11.031 13.898 1.00 4.42 C ATOM 3178 CD LYS B 94 -13.910 -12.260 13.029 1.00 5.02 C ATOM 3179 CE LYS B 94 -15.364 -12.701 13.259 1.00 7.24 C ATOM 3180 NZ LYS B 94 -15.697 -13.936 12.524 1.00 8.15 N ATOM 0 H LYS B 94 -12.064 -7.698 13.192 1.00 1.42 H new ATOM 0 HA LYS B 94 -12.603 -9.723 11.183 1.00 1.51 H new ATOM 0 HB2 LYS B 94 -11.712 -10.755 12.954 1.00 2.45 H new ATOM 0 HB3 LYS B 94 -12.152 -9.477 14.068 1.00 2.45 H new ATOM 0 HG2 LYS B 94 -13.282 -11.358 14.884 1.00 4.42 H new ATOM 0 HG3 LYS B 94 -14.528 -10.459 14.041 1.00 4.42 H new ATOM 0 HD2 LYS B 94 -13.751 -12.023 11.977 1.00 5.02 H new ATOM 0 HD3 LYS B 94 -13.227 -13.072 13.279 1.00 5.02 H new ATOM 0 HE2 LYS B 94 -15.529 -12.859 14.325 1.00 7.24 H new ATOM 0 HE3 LYS B 94 -16.037 -11.902 12.947 1.00 7.24 H new ATOM 0 HZ1 LYS B 94 -16.687 -14.194 12.710 1.00 8.15 H new ATOM 0 HZ2 LYS B 94 -15.566 -13.779 11.504 1.00 8.15 H new ATOM 0 HZ3 LYS B 94 -15.073 -14.706 12.839 1.00 8.15 H new ATOM 3194 N ILE B 95 -15.069 -7.974 12.196 1.00 1.93 N ATOM 3195 CA ILE B 95 -16.500 -7.774 12.018 1.00 2.50 C ATOM 3196 C ILE B 95 -16.889 -7.911 10.544 1.00 2.43 C ATOM 3197 O ILE B 95 -17.998 -8.356 10.247 1.00 2.93 O ATOM 3198 CB ILE B 95 -16.917 -6.426 12.643 1.00 3.24 C ATOM 3199 CG1 ILE B 95 -17.340 -6.578 14.112 1.00 3.62 C ATOM 3200 CG2 ILE B 95 -18.077 -5.730 11.942 1.00 4.36 C ATOM 3201 CD1 ILE B 95 -16.133 -6.846 14.994 1.00 3.11 C ATOM 0 H ILE B 95 -14.582 -7.174 12.600 1.00 1.93 H new ATOM 0 HA ILE B 95 -17.053 -8.553 12.543 1.00 2.50 H new ATOM 0 HB ILE B 95 -16.017 -5.821 12.536 1.00 3.24 H new ATOM 0 HG12 ILE B 95 -17.846 -5.672 14.445 1.00 3.62 H new ATOM 0 HG13 ILE B 95 -18.055 -7.396 14.207 1.00 3.62 H new ATOM 0 HG21 ILE B 95 -18.299 -4.792 12.451 1.00 4.36 H new ATOM 0 HG22 ILE B 95 -17.806 -5.526 10.906 1.00 4.36 H new ATOM 0 HG23 ILE B 95 -18.956 -6.374 11.967 1.00 4.36 H new ATOM 0 HD11 ILE B 95 -16.455 -6.950 16.030 1.00 3.11 H new ATOM 0 HD12 ILE B 95 -15.644 -7.765 14.672 1.00 3.11 H new ATOM 0 HD13 ILE B 95 -15.432 -6.015 14.914 1.00 3.11 H new ATOM 3213 N ARG B 96 -15.998 -7.526 9.624 1.00 2.07 N ATOM 3214 CA ARG B 96 -16.212 -7.547 8.180 1.00 2.42 C ATOM 3215 C ARG B 96 -17.206 -6.465 7.737 1.00 3.21 C ATOM 3216 O ARG B 96 -16.878 -5.660 6.878 1.00 4.35 O ATOM 3217 CB ARG B 96 -16.532 -8.942 7.648 1.00 2.53 C ATOM 3218 CG ARG B 96 -16.623 -8.919 6.108 1.00 3.24 C ATOM 3219 CD ARG B 96 -18.060 -8.804 5.571 1.00 3.98 C ATOM 3220 NE ARG B 96 -18.962 -9.771 6.223 1.00 3.69 N ATOM 3221 CZ ARG B 96 -20.181 -9.488 6.712 1.00 3.78 C ATOM 3222 NH1 ARG B 96 -20.840 -8.396 6.330 1.00 4.40 N ATOM 3223 NH2 ARG B 96 -20.759 -10.276 7.619 1.00 4.34 N ATOM 0 H ARG B 96 -15.073 -7.178 9.879 1.00 2.07 H new ATOM 0 HA ARG B 96 -15.263 -7.288 7.710 1.00 2.42 H new ATOM 0 HB2 ARG B 96 -15.761 -9.645 7.963 1.00 2.53 H new ATOM 0 HB3 ARG B 96 -17.474 -9.292 8.070 1.00 2.53 H new ATOM 0 HG2 ARG B 96 -16.037 -8.081 5.731 1.00 3.24 H new ATOM 0 HG3 ARG B 96 -16.170 -9.828 5.713 1.00 3.24 H new ATOM 0 HD2 ARG B 96 -18.430 -7.792 5.735 1.00 3.98 H new ATOM 0 HD3 ARG B 96 -18.061 -8.973 4.494 1.00 3.98 H new ATOM 0 HE ARG B 96 -18.634 -10.733 6.310 1.00 3.69 H new ATOM 0 HH11 ARG B 96 -20.420 -7.757 5.655 1.00 4.40 H new ATOM 0 HH12 ARG B 96 -21.765 -8.198 6.713 1.00 4.40 H new ATOM 0 HH21 ARG B 96 -20.275 -11.110 7.953 1.00 4.34 H new ATOM 0 HH22 ARG B 96 -21.685 -10.045 7.979 1.00 4.34 H new