USER MOD reduce.3.24.130724 H: found=0, std=0, add=1443, rem=0, adj=45 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: A 74 ASN : amide:sc= 0.625 K(o=4.3,f=-5.6) USER MOD Set 1.2: B 55 SER OG : rot -164:sc= 2.04 USER MOD Set 1.3: B 85 LYS NZ :NH3+ 153:sc= 1.61! (180deg=0.0414!) USER MOD Set 2.1: B 48 HIS : no HE2:sc= 0.142 K(o=0.5,f=-17!) USER MOD Set 2.2: B 89 LYS NZ :NH3+ -150:sc= 0.355 (180deg=-1.5!) USER MOD Set 3.1: B 39 LYS NZ :NH3+ 162:sc= 2.19 (180deg=0.804) USER MOD Set 3.2: B 43 THR OG1 : rot -140:sc= 1.13 USER MOD Set 4.1: A 36 ASN : amide:sc= 0.213 K(o=2.6,f=-8.2!) USER MOD Set 4.2: A 39 LYS NZ :NH3+ -162:sc= 2.35 (180deg=0.885) USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.175 USER MOD Single : A 12 SER OG : rot 70:sc= 1.11 USER MOD Single : A 15 THR OG1 : rot 78:sc= 1.24 USER MOD Single : A 18 THR OG1 : rot 83:sc= 1.05 USER MOD Single : A 19 THR OG1 : rot -73:sc= 1.17 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 120:sc= 0.301 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 45 GLN : amide:sc= -0.619 X(o=-0.62,f=-0.53) USER MOD Single : A 48 HIS : no HE2:sc= 0.97 K(o=0.97,f=-4.4!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot -50:sc= 1.07 USER MOD Single : A 59 LYS NZ :NH3+ -153:sc= 0.405 (180deg=-2.92!) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.186) USER MOD Single : A 62 SER OG : rot 67:sc= 2.21 USER MOD Single : A 66 ASN : amide:sc= -0.486 X(o=-0.49,f=-0.2) USER MOD Single : A 67 GLN : amide:sc= -0.778! K(o=-0.78!,f=-2.1) USER MOD Single : A 69 SER OG : rot 82:sc= 1.11 USER MOD Single : A 72 LYS NZ :NH3+ -166:sc= 2.18 (180deg=0.768) USER MOD Single : A 76 TYR OH : rot 120:sc= -0.459 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ -132:sc= 1.36 (180deg=-2.67!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -146:sc= 2.23 (180deg=0.484) USER MOD Single : B 7 THR OG1 : rot 16:sc= 0.52 USER MOD Single : B 12 SER OG : rot 69:sc= 0.94 USER MOD Single : B 15 THR OG1 : rot 81:sc= 1.13 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 78:sc= 1.24 USER MOD Single : B 22 THR OG1 : rot 80:sc= 0.793 USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 120:sc= 0.289 USER MOD Single : B 34 SER OG : rot 78:sc= 1.15 USER MOD Single : B 36 ASN : amide:sc= -1.41 X(o=-1.4,f=-1.5) USER MOD Single : B 44 GLN :FLIP amide:sc= 0 F(o=-0.65,f=0) USER MOD Single : B 45 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 51 LYS NZ :NH3+ -169:sc= -0.238 (180deg=-0.518) USER MOD Single : B 59 LYS NZ :NH3+ 147:sc= 1.73 (180deg=-1.24!) USER MOD Single : B 60 MET CE :methyl 174:sc=-0.00646 (180deg=-0.0986) USER MOD Single : B 61 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.127) USER MOD Single : B 62 SER OG : rot 73:sc= 1.23 USER MOD Single : B 66 ASN : amide:sc= -0.585 X(o=-0.59,f=-0.18) USER MOD Single : B 67 GLN : amide:sc= -0.833! C(o=-0.83!,f=-1.5!) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ -177:sc= 0.433 (180deg=0.298) USER MOD Single : B 74 ASN : amide:sc= -1.06 K(o=-1.1,f=-2.4) USER MOD Single : B 76 TYR OH : rot 30:sc= 0 USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 LYS NZ :NH3+ 168:sc= 0.13 (180deg=0.0988) USER MOD Single : B 94 LYS NZ :NH3+ -138:sc= 0.225 (180deg=-4.59!) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 4 -15.384 -11.793 8.829 1.00 2.26 N ATOM 41 CA GLU A 4 -15.404 -10.753 7.810 1.00 1.83 C ATOM 42 C GLU A 4 -15.194 -11.419 6.441 1.00 1.48 C ATOM 43 O GLU A 4 -14.264 -12.214 6.293 1.00 1.50 O ATOM 44 CB GLU A 4 -14.326 -9.714 8.156 1.00 1.53 C ATOM 45 CG GLU A 4 -13.739 -8.925 6.973 1.00 2.71 C ATOM 46 CD GLU A 4 -13.901 -7.426 7.138 1.00 4.46 C ATOM 47 OE1 GLU A 4 -15.024 -6.952 6.859 1.00 5.66 O ATOM 48 OE2 GLU A 4 -12.898 -6.797 7.528 1.00 5.02 O ATOM 0 HA GLU A 4 -16.357 -10.226 7.772 1.00 1.83 H new ATOM 0 HB2 GLU A 4 -14.750 -9.003 8.865 1.00 1.53 H new ATOM 0 HB3 GLU A 4 -13.509 -10.225 8.666 1.00 1.53 H new ATOM 0 HG2 GLU A 4 -12.680 -9.164 6.871 1.00 2.71 H new ATOM 0 HG3 GLU A 4 -14.228 -9.241 6.051 1.00 2.71 H new ATOM 55 N PRO A 5 -16.038 -11.121 5.438 1.00 1.36 N ATOM 56 CA PRO A 5 -15.947 -11.711 4.114 1.00 1.29 C ATOM 57 C PRO A 5 -14.924 -10.931 3.280 1.00 1.22 C ATOM 58 O PRO A 5 -15.287 -10.215 2.349 1.00 1.37 O ATOM 59 CB PRO A 5 -17.368 -11.599 3.556 1.00 1.50 C ATOM 60 CG PRO A 5 -17.861 -10.277 4.146 1.00 1.69 C ATOM 61 CD PRO A 5 -17.160 -10.195 5.506 1.00 1.56 C ATOM 0 HA PRO A 5 -15.608 -12.747 4.111 1.00 1.29 H new ATOM 0 HB2 PRO A 5 -17.374 -11.583 2.466 1.00 1.50 H new ATOM 0 HB3 PRO A 5 -17.991 -12.438 3.866 1.00 1.50 H new ATOM 0 HG2 PRO A 5 -17.597 -9.433 3.509 1.00 1.69 H new ATOM 0 HG3 PRO A 5 -18.946 -10.268 4.255 1.00 1.69 H new ATOM 0 HD2 PRO A 5 -16.816 -9.180 5.707 1.00 1.56 H new ATOM 0 HD3 PRO A 5 -17.841 -10.466 6.313 1.00 1.56 H new ATOM 69 N LEU A 6 -13.643 -11.054 3.634 1.00 1.09 N ATOM 70 CA LEU A 6 -12.579 -10.267 3.023 1.00 1.05 C ATOM 71 C LEU A 6 -12.067 -10.854 1.703 1.00 0.98 C ATOM 72 O LEU A 6 -12.543 -11.882 1.228 1.00 1.35 O ATOM 73 CB LEU A 6 -11.451 -9.986 4.016 1.00 1.10 C ATOM 74 CG LEU A 6 -10.437 -11.121 4.211 1.00 1.10 C ATOM 75 CD1 LEU A 6 -9.184 -10.484 4.799 1.00 2.06 C ATOM 76 CD2 LEU A 6 -10.956 -12.227 5.138 1.00 2.04 C ATOM 0 H LEU A 6 -13.318 -11.702 4.352 1.00 1.09 H new ATOM 0 HA LEU A 6 -13.023 -9.308 2.754 1.00 1.05 H new ATOM 0 HB2 LEU A 6 -10.914 -9.097 3.685 1.00 1.10 H new ATOM 0 HB3 LEU A 6 -11.894 -9.749 4.983 1.00 1.10 H new ATOM 0 HG LEU A 6 -10.241 -11.605 3.254 1.00 1.10 H new ATOM 0 HD11 LEU A 6 -8.426 -11.251 4.958 1.00 2.06 H new ATOM 0 HD12 LEU A 6 -8.800 -9.733 4.109 1.00 2.06 H new ATOM 0 HD13 LEU A 6 -9.428 -10.012 5.751 1.00 2.06 H new ATOM 0 HD21 LEU A 6 -10.197 -13.003 5.239 1.00 2.04 H new ATOM 0 HD22 LEU A 6 -11.177 -11.806 6.119 1.00 2.04 H new ATOM 0 HD23 LEU A 6 -11.863 -12.660 4.716 1.00 2.04 H new ATOM 88 N THR A 7 -11.110 -10.145 1.098 1.00 0.81 N ATOM 89 CA THR A 7 -10.527 -10.409 -0.207 1.00 0.86 C ATOM 90 C THR A 7 -9.030 -10.096 -0.166 1.00 0.91 C ATOM 91 O THR A 7 -8.525 -9.572 0.828 1.00 1.09 O ATOM 92 CB THR A 7 -11.222 -9.524 -1.252 1.00 1.01 C ATOM 93 OG1 THR A 7 -10.740 -9.809 -2.552 1.00 3.03 O ATOM 94 CG2 THR A 7 -11.007 -8.049 -0.927 1.00 2.61 C ATOM 0 H THR A 7 -10.701 -9.322 1.539 1.00 0.81 H new ATOM 0 HA THR A 7 -10.663 -11.457 -0.473 1.00 0.86 H new ATOM 0 HB THR A 7 -12.290 -9.740 -1.224 1.00 1.01 H new ATOM 0 HG1 THR A 7 -11.196 -9.236 -3.203 1.00 3.03 H new ATOM 0 HG21 THR A 7 -11.506 -7.435 -1.677 1.00 2.61 H new ATOM 0 HG22 THR A 7 -11.422 -7.829 0.057 1.00 2.61 H new ATOM 0 HG23 THR A 7 -9.940 -7.828 -0.928 1.00 2.61 H new ATOM 102 N GLU A 8 -8.362 -10.368 -1.289 1.00 0.86 N ATOM 103 CA GLU A 8 -6.962 -10.092 -1.561 1.00 0.84 C ATOM 104 C GLU A 8 -6.585 -8.676 -1.105 1.00 0.84 C ATOM 105 O GLU A 8 -5.572 -8.478 -0.427 1.00 0.88 O ATOM 106 CB GLU A 8 -6.712 -10.234 -3.070 1.00 0.89 C ATOM 107 CG GLU A 8 -7.013 -11.641 -3.606 1.00 1.02 C ATOM 108 CD GLU A 8 -6.962 -11.669 -5.132 1.00 1.91 C ATOM 109 OE1 GLU A 8 -7.738 -10.888 -5.728 1.00 2.45 O ATOM 110 OE2 GLU A 8 -6.163 -12.466 -5.669 1.00 3.35 O ATOM 0 H GLU A 8 -8.821 -10.817 -2.081 1.00 0.86 H new ATOM 0 HA GLU A 8 -6.346 -10.802 -1.009 1.00 0.84 H new ATOM 0 HB2 GLU A 8 -7.329 -9.510 -3.603 1.00 0.89 H new ATOM 0 HB3 GLU A 8 -5.672 -9.986 -3.284 1.00 0.89 H new ATOM 0 HG2 GLU A 8 -6.291 -12.350 -3.202 1.00 1.02 H new ATOM 0 HG3 GLU A 8 -7.998 -11.960 -3.266 1.00 1.02 H new ATOM 117 N LEU A 9 -7.391 -7.676 -1.494 1.00 0.86 N ATOM 118 CA LEU A 9 -7.045 -6.290 -1.223 1.00 0.92 C ATOM 119 C LEU A 9 -6.985 -6.073 0.292 1.00 0.98 C ATOM 120 O LEU A 9 -5.939 -5.683 0.817 1.00 1.07 O ATOM 121 CB LEU A 9 -8.034 -5.345 -1.920 1.00 0.98 C ATOM 122 CG LEU A 9 -7.933 -5.265 -3.461 1.00 0.93 C ATOM 123 CD1 LEU A 9 -6.689 -4.486 -3.894 1.00 2.01 C ATOM 124 CD2 LEU A 9 -7.965 -6.616 -4.189 1.00 1.90 C ATOM 0 H LEU A 9 -8.273 -7.807 -1.990 1.00 0.86 H new ATOM 0 HA LEU A 9 -6.060 -6.061 -1.630 1.00 0.92 H new ATOM 0 HB2 LEU A 9 -9.046 -5.655 -1.659 1.00 0.98 H new ATOM 0 HB3 LEU A 9 -7.893 -4.343 -1.515 1.00 0.98 H new ATOM 0 HG LEU A 9 -8.839 -4.738 -3.759 1.00 0.93 H new ATOM 0 HD11 LEU A 9 -6.645 -4.447 -4.982 1.00 2.01 H new ATOM 0 HD12 LEU A 9 -6.737 -3.473 -3.496 1.00 2.01 H new ATOM 0 HD13 LEU A 9 -5.797 -4.983 -3.513 1.00 2.01 H new ATOM 0 HD21 LEU A 9 -7.888 -6.452 -5.264 1.00 1.90 H new ATOM 0 HD22 LEU A 9 -7.128 -7.229 -3.855 1.00 1.90 H new ATOM 0 HD23 LEU A 9 -8.901 -7.127 -3.966 1.00 1.90 H new ATOM 136 N GLU A 10 -8.081 -6.363 1.007 1.00 0.97 N ATOM 137 CA GLU A 10 -8.084 -6.263 2.470 1.00 1.08 C ATOM 138 C GLU A 10 -6.914 -7.040 3.067 1.00 1.02 C ATOM 139 O GLU A 10 -6.152 -6.462 3.839 1.00 1.05 O ATOM 140 CB GLU A 10 -9.408 -6.716 3.118 1.00 1.28 C ATOM 141 CG GLU A 10 -10.214 -5.576 3.759 1.00 1.47 C ATOM 142 CD GLU A 10 -9.409 -4.700 4.719 1.00 2.47 C ATOM 143 OE1 GLU A 10 -9.123 -5.150 5.850 1.00 3.26 O ATOM 144 OE2 GLU A 10 -9.088 -3.538 4.367 1.00 3.56 O ATOM 0 H GLU A 10 -8.966 -6.665 0.600 1.00 0.97 H new ATOM 0 HA GLU A 10 -7.975 -5.202 2.697 1.00 1.08 H new ATOM 0 HB2 GLU A 10 -10.024 -7.201 2.360 1.00 1.28 H new ATOM 0 HB3 GLU A 10 -9.190 -7.465 3.879 1.00 1.28 H new ATOM 0 HG2 GLU A 10 -10.624 -4.947 2.969 1.00 1.47 H new ATOM 0 HG3 GLU A 10 -11.060 -6.003 4.298 1.00 1.47 H new ATOM 151 N GLU A 11 -6.744 -8.310 2.684 1.00 0.99 N ATOM 152 CA GLU A 11 -5.686 -9.141 3.244 1.00 1.02 C ATOM 153 C GLU A 11 -4.308 -8.484 3.050 1.00 0.99 C ATOM 154 O GLU A 11 -3.423 -8.624 3.897 1.00 1.16 O ATOM 155 CB GLU A 11 -5.755 -10.578 2.702 1.00 1.10 C ATOM 156 CG GLU A 11 -5.156 -11.612 3.687 1.00 1.39 C ATOM 157 CD GLU A 11 -6.204 -12.401 4.483 1.00 3.02 C ATOM 158 OE1 GLU A 11 -7.020 -13.082 3.826 1.00 3.82 O ATOM 159 OE2 GLU A 11 -6.223 -12.312 5.735 1.00 4.26 O ATOM 0 H GLU A 11 -7.326 -8.779 1.990 1.00 0.99 H new ATOM 0 HA GLU A 11 -5.841 -9.219 4.320 1.00 1.02 H new ATOM 0 HB2 GLU A 11 -6.794 -10.836 2.497 1.00 1.10 H new ATOM 0 HB3 GLU A 11 -5.220 -10.632 1.754 1.00 1.10 H new ATOM 0 HG2 GLU A 11 -4.537 -12.313 3.128 1.00 1.39 H new ATOM 0 HG3 GLU A 11 -4.499 -11.094 4.386 1.00 1.39 H new ATOM 166 N SER A 12 -4.116 -7.688 1.989 1.00 0.89 N ATOM 167 CA SER A 12 -2.859 -6.960 1.804 1.00 0.84 C ATOM 168 C SER A 12 -2.779 -5.799 2.800 1.00 0.80 C ATOM 169 O SER A 12 -1.766 -5.586 3.466 1.00 0.87 O ATOM 170 CB SER A 12 -2.758 -6.459 0.356 1.00 0.87 C ATOM 171 OG SER A 12 -2.946 -7.525 -0.554 1.00 1.78 O ATOM 0 H SER A 12 -4.808 -7.535 1.255 1.00 0.89 H new ATOM 0 HA SER A 12 -2.018 -7.627 1.993 1.00 0.84 H new ATOM 0 HB2 SER A 12 -3.507 -5.687 0.180 1.00 0.87 H new ATOM 0 HB3 SER A 12 -1.783 -6.001 0.191 1.00 0.87 H new ATOM 0 HG SER A 12 -3.882 -7.815 -0.529 1.00 1.78 H new ATOM 177 N ILE A 13 -3.860 -5.029 2.876 1.00 0.72 N ATOM 178 CA ILE A 13 -3.927 -3.803 3.650 1.00 0.63 C ATOM 179 C ILE A 13 -3.769 -4.097 5.143 1.00 0.61 C ATOM 180 O ILE A 13 -2.967 -3.443 5.817 1.00 0.59 O ATOM 181 CB ILE A 13 -5.252 -3.094 3.322 1.00 0.63 C ATOM 182 CG1 ILE A 13 -5.171 -2.617 1.863 1.00 0.81 C ATOM 183 CG2 ILE A 13 -5.606 -1.903 4.231 1.00 0.59 C ATOM 184 CD1 ILE A 13 -6.562 -2.366 1.312 1.00 0.63 C ATOM 0 H ILE A 13 -4.729 -5.248 2.390 1.00 0.72 H new ATOM 0 HA ILE A 13 -3.105 -3.138 3.385 1.00 0.63 H new ATOM 0 HB ILE A 13 -6.048 -3.819 3.491 1.00 0.63 H new ATOM 0 HG12 ILE A 13 -4.579 -1.704 1.804 1.00 0.81 H new ATOM 0 HG13 ILE A 13 -4.662 -3.366 1.256 1.00 0.81 H new ATOM 0 HG21 ILE A 13 -6.557 -1.475 3.915 1.00 0.59 H new ATOM 0 HG22 ILE A 13 -5.686 -2.244 5.263 1.00 0.59 H new ATOM 0 HG23 ILE A 13 -4.825 -1.146 4.159 1.00 0.59 H new ATOM 0 HD11 ILE A 13 -6.488 -2.029 0.278 1.00 0.63 H new ATOM 0 HD12 ILE A 13 -7.141 -3.288 1.352 1.00 0.63 H new ATOM 0 HD13 ILE A 13 -7.057 -1.600 1.909 1.00 0.63 H new ATOM 196 N GLU A 14 -4.526 -5.073 5.660 1.00 0.68 N ATOM 197 CA GLU A 14 -4.431 -5.480 7.052 1.00 0.77 C ATOM 198 C GLU A 14 -2.990 -5.833 7.397 1.00 0.79 C ATOM 199 O GLU A 14 -2.522 -5.480 8.476 1.00 0.80 O ATOM 200 CB GLU A 14 -5.385 -6.622 7.381 1.00 0.96 C ATOM 201 CG GLU A 14 -4.981 -7.927 6.713 1.00 1.69 C ATOM 202 CD GLU A 14 -5.925 -9.028 7.125 1.00 2.30 C ATOM 203 OE1 GLU A 14 -7.050 -9.067 6.581 1.00 3.08 O ATOM 204 OE2 GLU A 14 -5.548 -9.808 8.023 1.00 3.15 O ATOM 0 H GLU A 14 -5.216 -5.596 5.121 1.00 0.68 H new ATOM 0 HA GLU A 14 -4.737 -4.637 7.672 1.00 0.77 H new ATOM 0 HB2 GLU A 14 -5.417 -6.765 8.461 1.00 0.96 H new ATOM 0 HB3 GLU A 14 -6.393 -6.352 7.065 1.00 0.96 H new ATOM 0 HG2 GLU A 14 -4.995 -7.811 5.629 1.00 1.69 H new ATOM 0 HG3 GLU A 14 -3.960 -8.188 6.992 1.00 1.69 H new ATOM 211 N THR A 15 -2.289 -6.509 6.480 1.00 0.83 N ATOM 212 CA THR A 15 -0.907 -6.907 6.690 1.00 0.88 C ATOM 213 C THR A 15 -0.063 -5.651 6.856 1.00 0.78 C ATOM 214 O THR A 15 0.629 -5.513 7.857 1.00 0.86 O ATOM 215 CB THR A 15 -0.393 -7.843 5.584 1.00 0.99 C ATOM 216 OG1 THR A 15 -1.228 -8.980 5.504 1.00 1.08 O ATOM 217 CG2 THR A 15 1.013 -8.349 5.921 1.00 1.14 C ATOM 0 H THR A 15 -2.669 -6.791 5.577 1.00 0.83 H new ATOM 0 HA THR A 15 -0.832 -7.499 7.602 1.00 0.88 H new ATOM 0 HB THR A 15 -0.385 -7.285 4.648 1.00 0.99 H new ATOM 0 HG1 THR A 15 -2.051 -8.748 5.026 1.00 1.08 H new ATOM 0 HG21 THR A 15 1.362 -9.010 5.128 1.00 1.14 H new ATOM 0 HG22 THR A 15 1.693 -7.502 6.012 1.00 1.14 H new ATOM 0 HG23 THR A 15 0.987 -8.896 6.864 1.00 1.14 H new ATOM 225 N VAL A 16 -0.154 -4.682 5.943 1.00 0.67 N ATOM 226 CA VAL A 16 0.602 -3.455 6.118 1.00 0.64 C ATOM 227 C VAL A 16 0.326 -2.826 7.489 1.00 0.68 C ATOM 228 O VAL A 16 1.261 -2.565 8.247 1.00 0.76 O ATOM 229 CB VAL A 16 0.310 -2.478 4.976 1.00 0.62 C ATOM 230 CG1 VAL A 16 0.964 -1.147 5.332 1.00 0.68 C ATOM 231 CG2 VAL A 16 0.867 -3.000 3.647 1.00 0.67 C ATOM 0 H VAL A 16 -0.728 -4.725 5.101 1.00 0.67 H new ATOM 0 HA VAL A 16 1.664 -3.697 6.085 1.00 0.64 H new ATOM 0 HB VAL A 16 -0.767 -2.362 4.853 1.00 0.62 H new ATOM 0 HG11 VAL A 16 0.775 -0.425 4.538 1.00 0.68 H new ATOM 0 HG12 VAL A 16 0.546 -0.775 6.267 1.00 0.68 H new ATOM 0 HG13 VAL A 16 2.039 -1.289 5.446 1.00 0.68 H new ATOM 0 HG21 VAL A 16 0.645 -2.286 2.854 1.00 0.67 H new ATOM 0 HG22 VAL A 16 1.946 -3.127 3.730 1.00 0.67 H new ATOM 0 HG23 VAL A 16 0.406 -3.959 3.411 1.00 0.67 H new ATOM 241 N VAL A 17 -0.944 -2.546 7.809 1.00 0.66 N ATOM 242 CA VAL A 17 -1.253 -1.873 9.069 1.00 0.75 C ATOM 243 C VAL A 17 -0.793 -2.714 10.276 1.00 0.85 C ATOM 244 O VAL A 17 -0.278 -2.169 11.249 1.00 0.97 O ATOM 245 CB VAL A 17 -2.711 -1.395 9.151 1.00 0.74 C ATOM 246 CG1 VAL A 17 -3.049 -0.434 8.007 1.00 0.67 C ATOM 247 CG2 VAL A 17 -3.696 -2.552 9.136 1.00 0.74 C ATOM 0 H VAL A 17 -1.752 -2.769 7.228 1.00 0.66 H new ATOM 0 HA VAL A 17 -0.671 -0.952 9.103 1.00 0.75 H new ATOM 0 HB VAL A 17 -2.805 -0.872 10.103 1.00 0.74 H new ATOM 0 HG11 VAL A 17 -4.088 -0.115 8.095 1.00 0.67 H new ATOM 0 HG12 VAL A 17 -2.396 0.437 8.059 1.00 0.67 H new ATOM 0 HG13 VAL A 17 -2.904 -0.940 7.052 1.00 0.67 H new ATOM 0 HG21 VAL A 17 -4.713 -2.165 9.196 1.00 0.74 H new ATOM 0 HG22 VAL A 17 -3.577 -3.119 8.213 1.00 0.74 H new ATOM 0 HG23 VAL A 17 -3.505 -3.203 9.989 1.00 0.74 H new ATOM 257 N THR A 18 -0.926 -4.038 10.195 1.00 0.85 N ATOM 258 CA THR A 18 -0.383 -4.980 11.164 1.00 0.98 C ATOM 259 C THR A 18 1.108 -4.745 11.392 1.00 1.07 C ATOM 260 O THR A 18 1.572 -4.602 12.527 1.00 1.19 O ATOM 261 CB THR A 18 -0.633 -6.408 10.664 1.00 1.18 C ATOM 262 OG1 THR A 18 -1.998 -6.716 10.836 1.00 1.60 O ATOM 263 CG2 THR A 18 0.312 -7.437 11.286 1.00 1.62 C ATOM 0 H THR A 18 -1.428 -4.493 9.433 1.00 0.85 H new ATOM 0 HA THR A 18 -0.884 -4.832 12.121 1.00 0.98 H new ATOM 0 HB THR A 18 -0.400 -6.458 9.600 1.00 1.18 H new ATOM 0 HG1 THR A 18 -2.512 -6.355 10.084 1.00 1.60 H new ATOM 0 HG21 THR A 18 0.083 -8.427 10.891 1.00 1.62 H new ATOM 0 HG22 THR A 18 1.343 -7.179 11.043 1.00 1.62 H new ATOM 0 HG23 THR A 18 0.185 -7.440 12.369 1.00 1.62 H new ATOM 271 N THR A 19 1.863 -4.777 10.295 1.00 1.02 N ATOM 272 CA THR A 19 3.299 -4.938 10.317 1.00 0.99 C ATOM 273 C THR A 19 3.975 -3.848 11.153 1.00 1.00 C ATOM 274 O THR A 19 4.927 -4.138 11.875 1.00 1.11 O ATOM 275 CB THR A 19 3.770 -5.012 8.869 1.00 0.98 C ATOM 276 OG1 THR A 19 3.241 -6.155 8.238 1.00 1.28 O ATOM 277 CG2 THR A 19 5.283 -5.062 8.719 1.00 1.08 C ATOM 0 H THR A 19 1.478 -4.689 9.354 1.00 1.02 H new ATOM 0 HA THR A 19 3.589 -5.862 10.817 1.00 0.99 H new ATOM 0 HB THR A 19 3.412 -4.094 8.404 1.00 0.98 H new ATOM 0 HG1 THR A 19 3.696 -6.955 8.575 1.00 1.28 H new ATOM 0 HG21 THR A 19 5.542 -5.114 7.662 1.00 1.08 H new ATOM 0 HG22 THR A 19 5.722 -4.165 9.157 1.00 1.08 H new ATOM 0 HG23 THR A 19 5.670 -5.943 9.231 1.00 1.08 H new ATOM 285 N PHE A 20 3.462 -2.609 11.107 1.00 1.05 N ATOM 286 CA PHE A 20 3.920 -1.553 12.014 1.00 1.14 C ATOM 287 C PHE A 20 3.978 -1.991 13.485 1.00 1.26 C ATOM 288 O PHE A 20 4.908 -1.619 14.195 1.00 1.36 O ATOM 289 CB PHE A 20 3.002 -0.335 11.947 1.00 1.18 C ATOM 290 CG PHE A 20 2.979 0.363 10.612 1.00 0.99 C ATOM 291 CD1 PHE A 20 3.999 1.260 10.256 1.00 1.98 C ATOM 292 CD2 PHE A 20 1.904 0.143 9.741 1.00 1.35 C ATOM 293 CE1 PHE A 20 3.881 2.017 9.080 1.00 1.76 C ATOM 294 CE2 PHE A 20 1.761 0.924 8.587 1.00 1.48 C ATOM 295 CZ PHE A 20 2.734 1.885 8.281 1.00 0.78 C ATOM 0 H PHE A 20 2.734 -2.318 10.454 1.00 1.05 H new ATOM 0 HA PHE A 20 4.928 -1.314 11.675 1.00 1.14 H new ATOM 0 HB2 PHE A 20 1.988 -0.647 12.196 1.00 1.18 H new ATOM 0 HB3 PHE A 20 3.312 0.379 12.710 1.00 1.18 H new ATOM 0 HD1 PHE A 20 4.871 1.367 10.885 1.00 1.98 H new ATOM 0 HD2 PHE A 20 1.183 -0.631 9.960 1.00 1.35 H new ATOM 0 HE1 PHE A 20 4.668 2.697 8.791 1.00 1.76 H new ATOM 0 HE2 PHE A 20 0.908 0.787 7.939 1.00 1.48 H new ATOM 0 HZ PHE A 20 2.601 2.529 7.424 1.00 0.78 H new ATOM 305 N PHE A 21 2.943 -2.687 13.969 1.00 1.33 N ATOM 306 CA PHE A 21 2.861 -3.092 15.369 1.00 1.52 C ATOM 307 C PHE A 21 3.766 -4.302 15.591 1.00 1.42 C ATOM 308 O PHE A 21 4.625 -4.272 16.470 1.00 1.60 O ATOM 309 CB PHE A 21 1.401 -3.366 15.765 1.00 1.72 C ATOM 310 CG PHE A 21 1.088 -3.316 17.256 1.00 2.13 C ATOM 311 CD1 PHE A 21 1.648 -4.266 18.131 1.00 2.80 C ATOM 312 CD2 PHE A 21 0.142 -2.398 17.754 1.00 3.09 C ATOM 313 CE1 PHE A 21 1.300 -4.269 19.493 1.00 3.35 C ATOM 314 CE2 PHE A 21 -0.185 -2.381 19.121 1.00 3.60 C ATOM 315 CZ PHE A 21 0.393 -3.321 19.993 1.00 3.36 C ATOM 0 H PHE A 21 2.147 -2.981 13.403 1.00 1.33 H new ATOM 0 HA PHE A 21 3.211 -2.287 16.015 1.00 1.52 H new ATOM 0 HB2 PHE A 21 0.766 -2.640 15.257 1.00 1.72 H new ATOM 0 HB3 PHE A 21 1.123 -4.351 15.389 1.00 1.72 H new ATOM 0 HD1 PHE A 21 2.349 -4.996 17.754 1.00 2.80 H new ATOM 0 HD2 PHE A 21 -0.336 -1.702 17.080 1.00 3.09 H new ATOM 0 HE1 PHE A 21 1.732 -5.003 20.157 1.00 3.35 H new ATOM 0 HE2 PHE A 21 -0.880 -1.647 19.501 1.00 3.60 H new ATOM 0 HZ PHE A 21 0.140 -3.314 21.043 1.00 3.36 H new ATOM 325 N THR A 22 3.577 -5.352 14.785 1.00 1.29 N ATOM 326 CA THR A 22 4.375 -6.568 14.851 1.00 1.42 C ATOM 327 C THR A 22 4.494 -7.102 13.434 1.00 1.87 C ATOM 328 O THR A 22 3.471 -7.284 12.777 1.00 2.88 O ATOM 329 CB THR A 22 3.696 -7.623 15.745 1.00 2.49 C ATOM 330 OG1 THR A 22 3.396 -7.090 17.018 1.00 3.83 O ATOM 331 CG2 THR A 22 4.606 -8.839 15.949 1.00 3.28 C ATOM 0 H THR A 22 2.857 -5.376 14.063 1.00 1.29 H new ATOM 0 HA THR A 22 5.354 -6.352 15.279 1.00 1.42 H new ATOM 0 HB THR A 22 2.779 -7.923 15.238 1.00 2.49 H new ATOM 0 HG1 THR A 22 2.964 -7.777 17.567 1.00 3.83 H new ATOM 0 HG21 THR A 22 4.102 -9.568 16.584 1.00 3.28 H new ATOM 0 HG22 THR A 22 4.830 -9.292 14.983 1.00 3.28 H new ATOM 0 HG23 THR A 22 5.534 -8.523 16.425 1.00 3.28 H new ATOM 478 N ASP A 31 2.122 3.345 14.493 1.00 1.67 N ATOM 479 CA ASP A 31 2.214 4.270 13.376 1.00 1.31 C ATOM 480 C ASP A 31 3.523 3.942 12.660 1.00 1.49 C ATOM 481 O ASP A 31 4.113 2.897 12.945 1.00 2.37 O ATOM 482 CB ASP A 31 2.183 5.737 13.857 1.00 1.67 C ATOM 483 CG ASP A 31 1.443 6.627 12.884 1.00 2.24 C ATOM 484 OD1 ASP A 31 1.453 6.268 11.687 1.00 3.18 O ATOM 485 OD2 ASP A 31 0.887 7.648 13.348 1.00 2.99 O ATOM 0 HA ASP A 31 1.363 4.161 12.703 1.00 1.31 H new ATOM 0 HB2 ASP A 31 1.705 5.790 14.835 1.00 1.67 H new ATOM 0 HB3 ASP A 31 3.203 6.101 13.981 1.00 1.67 H new ATOM 490 N SER A 32 4.002 4.834 11.794 1.00 1.31 N ATOM 491 CA SER A 32 5.314 4.677 11.177 1.00 1.34 C ATOM 492 C SER A 32 6.426 5.198 12.099 1.00 1.17 C ATOM 493 O SER A 32 6.194 5.500 13.268 1.00 1.28 O ATOM 494 CB SER A 32 5.338 5.343 9.797 1.00 1.49 C ATOM 495 OG SER A 32 6.466 4.899 9.061 1.00 2.34 O ATOM 0 H SER A 32 3.499 5.673 11.505 1.00 1.31 H new ATOM 0 HA SER A 32 5.507 3.614 11.029 1.00 1.34 H new ATOM 0 HB2 SER A 32 4.423 5.105 9.254 1.00 1.49 H new ATOM 0 HB3 SER A 32 5.370 6.427 9.908 1.00 1.49 H new ATOM 0 HG SER A 32 6.167 4.458 8.238 1.00 2.34 H new ATOM 501 N LEU A 33 7.648 5.240 11.561 1.00 1.13 N ATOM 502 CA LEU A 33 8.871 5.581 12.277 1.00 1.06 C ATOM 503 C LEU A 33 9.163 7.075 12.080 1.00 1.01 C ATOM 504 O LEU A 33 8.244 7.854 11.837 1.00 1.09 O ATOM 505 CB LEU A 33 10.029 4.688 11.779 1.00 1.26 C ATOM 506 CG LEU A 33 9.806 3.165 11.834 1.00 1.23 C ATOM 507 CD1 LEU A 33 9.184 2.701 13.155 1.00 1.35 C ATOM 508 CD2 LEU A 33 9.019 2.620 10.636 1.00 1.36 C ATOM 0 H LEU A 33 7.814 5.029 10.577 1.00 1.13 H new ATOM 0 HA LEU A 33 8.757 5.398 13.345 1.00 1.06 H new ATOM 0 HB2 LEU A 33 10.249 4.962 10.747 1.00 1.26 H new ATOM 0 HB3 LEU A 33 10.916 4.923 12.367 1.00 1.26 H new ATOM 0 HG LEU A 33 10.807 2.738 11.775 1.00 1.23 H new ATOM 0 HD11 LEU A 33 9.051 1.619 13.134 1.00 1.35 H new ATOM 0 HD12 LEU A 33 9.842 2.970 13.981 1.00 1.35 H new ATOM 0 HD13 LEU A 33 8.216 3.183 13.290 1.00 1.35 H new ATOM 0 HD21 LEU A 33 8.899 1.542 10.740 1.00 1.36 H new ATOM 0 HD22 LEU A 33 8.038 3.093 10.600 1.00 1.36 H new ATOM 0 HD23 LEU A 33 9.561 2.838 9.715 1.00 1.36 H new ATOM 520 N SER A 34 10.433 7.488 12.142 1.00 0.99 N ATOM 521 CA SER A 34 10.866 8.776 11.614 1.00 0.93 C ATOM 522 C SER A 34 11.084 8.648 10.105 1.00 0.84 C ATOM 523 O SER A 34 11.107 7.540 9.568 1.00 0.80 O ATOM 524 CB SER A 34 12.125 9.254 12.346 1.00 1.05 C ATOM 525 OG SER A 34 11.933 9.141 13.742 1.00 1.50 O ATOM 0 H SER A 34 11.184 6.938 12.559 1.00 0.99 H new ATOM 0 HA SER A 34 10.098 9.531 11.783 1.00 0.93 H new ATOM 0 HB2 SER A 34 12.985 8.660 12.038 1.00 1.05 H new ATOM 0 HB3 SER A 34 12.341 10.289 12.081 1.00 1.05 H new ATOM 0 HG SER A 34 12.739 9.445 14.209 1.00 1.50 H new ATOM 531 N VAL A 35 11.225 9.769 9.399 1.00 0.87 N ATOM 532 CA VAL A 35 11.112 9.748 7.949 1.00 0.79 C ATOM 533 C VAL A 35 12.352 9.119 7.301 1.00 0.75 C ATOM 534 O VAL A 35 12.235 8.157 6.541 1.00 0.64 O ATOM 535 CB VAL A 35 10.849 11.162 7.423 1.00 0.87 C ATOM 536 CG1 VAL A 35 10.456 11.109 5.952 1.00 0.85 C ATOM 537 CG2 VAL A 35 9.758 11.936 8.177 1.00 1.05 C ATOM 0 H VAL A 35 11.414 10.686 9.803 1.00 0.87 H new ATOM 0 HA VAL A 35 10.264 9.121 7.675 1.00 0.79 H new ATOM 0 HB VAL A 35 11.786 11.696 7.577 1.00 0.87 H new ATOM 0 HG11 VAL A 35 10.271 12.120 5.588 1.00 0.85 H new ATOM 0 HG12 VAL A 35 11.264 10.658 5.376 1.00 0.85 H new ATOM 0 HG13 VAL A 35 9.551 10.511 5.838 1.00 0.85 H new ATOM 0 HG21 VAL A 35 9.642 12.925 7.734 1.00 1.05 H new ATOM 0 HG22 VAL A 35 8.814 11.395 8.108 1.00 1.05 H new ATOM 0 HG23 VAL A 35 10.042 12.038 9.224 1.00 1.05 H new ATOM 547 N ASN A 36 13.546 9.664 7.573 1.00 0.93 N ATOM 548 CA ASN A 36 14.768 9.122 6.976 1.00 1.03 C ATOM 549 C ASN A 36 14.936 7.662 7.406 1.00 0.96 C ATOM 550 O ASN A 36 15.237 6.802 6.583 1.00 0.90 O ATOM 551 CB ASN A 36 16.032 9.930 7.327 1.00 1.39 C ATOM 552 CG ASN A 36 16.822 10.289 6.066 1.00 2.52 C ATOM 553 OD1 ASN A 36 17.674 9.531 5.608 1.00 3.27 O ATOM 554 ND2 ASN A 36 16.535 11.437 5.462 1.00 2.97 N ATOM 0 H ASN A 36 13.688 10.464 8.190 1.00 0.93 H new ATOM 0 HA ASN A 36 14.655 9.191 5.894 1.00 1.03 H new ATOM 0 HB2 ASN A 36 15.750 10.841 7.856 1.00 1.39 H new ATOM 0 HB3 ASN A 36 16.662 9.351 8.002 1.00 1.39 H new ATOM 0 HD21 ASN A 36 17.024 11.699 4.606 1.00 2.97 H new ATOM 0 HD22 ASN A 36 15.825 12.056 5.854 1.00 2.97 H new ATOM 561 N GLU A 37 14.701 7.409 8.700 1.00 1.02 N ATOM 562 CA GLU A 37 14.682 6.085 9.309 1.00 1.03 C ATOM 563 C GLU A 37 13.849 5.141 8.440 1.00 0.88 C ATOM 564 O GLU A 37 14.375 4.176 7.888 1.00 0.94 O ATOM 565 CB GLU A 37 14.127 6.216 10.738 1.00 1.20 C ATOM 566 CG GLU A 37 14.068 4.900 11.528 1.00 1.29 C ATOM 567 CD GLU A 37 15.442 4.333 11.865 1.00 2.66 C ATOM 568 OE1 GLU A 37 16.407 5.126 11.860 1.00 3.82 O ATOM 569 OE2 GLU A 37 15.491 3.118 12.146 1.00 3.33 O ATOM 0 H GLU A 37 14.512 8.153 9.372 1.00 1.02 H new ATOM 0 HA GLU A 37 15.685 5.662 9.373 1.00 1.03 H new ATOM 0 HB2 GLU A 37 14.743 6.927 11.289 1.00 1.20 H new ATOM 0 HB3 GLU A 37 13.123 6.638 10.686 1.00 1.20 H new ATOM 0 HG2 GLU A 37 13.515 5.065 12.453 1.00 1.29 H new ATOM 0 HG3 GLU A 37 13.511 4.163 10.950 1.00 1.29 H new ATOM 576 N PHE A 38 12.562 5.463 8.258 1.00 0.76 N ATOM 577 CA PHE A 38 11.687 4.741 7.343 1.00 0.68 C ATOM 578 C PHE A 38 12.357 4.529 5.981 1.00 0.65 C ATOM 579 O PHE A 38 12.390 3.400 5.494 1.00 0.68 O ATOM 580 CB PHE A 38 10.339 5.460 7.197 1.00 0.63 C ATOM 581 CG PHE A 38 9.602 5.079 5.926 1.00 0.64 C ATOM 582 CD1 PHE A 38 9.025 3.801 5.812 1.00 1.55 C ATOM 583 CD2 PHE A 38 9.783 5.865 4.772 1.00 1.75 C ATOM 584 CE1 PHE A 38 8.590 3.333 4.559 1.00 1.64 C ATOM 585 CE2 PHE A 38 9.425 5.359 3.513 1.00 1.83 C ATOM 586 CZ PHE A 38 8.777 4.121 3.411 1.00 1.01 C ATOM 0 H PHE A 38 12.103 6.233 8.744 1.00 0.76 H new ATOM 0 HA PHE A 38 11.497 3.755 7.768 1.00 0.68 H new ATOM 0 HB2 PHE A 38 9.713 5.226 8.058 1.00 0.63 H new ATOM 0 HB3 PHE A 38 10.504 6.537 7.206 1.00 0.63 H new ATOM 0 HD1 PHE A 38 8.916 3.178 6.688 1.00 1.55 H new ATOM 0 HD2 PHE A 38 10.198 6.859 4.856 1.00 1.75 H new ATOM 0 HE1 PHE A 38 8.112 2.368 4.479 1.00 1.64 H new ATOM 0 HE2 PHE A 38 9.649 5.925 2.621 1.00 1.83 H new ATOM 0 HZ PHE A 38 8.422 3.773 2.452 1.00 1.01 H new ATOM 596 N LYS A 39 12.870 5.598 5.360 1.00 0.66 N ATOM 597 CA LYS A 39 13.496 5.511 4.044 1.00 0.75 C ATOM 598 C LYS A 39 14.582 4.426 4.019 1.00 0.86 C ATOM 599 O LYS A 39 14.610 3.617 3.091 1.00 0.96 O ATOM 600 CB LYS A 39 13.932 6.903 3.534 1.00 0.95 C ATOM 601 CG LYS A 39 15.204 6.957 2.661 1.00 1.11 C ATOM 602 CD LYS A 39 16.350 7.526 3.508 1.00 2.05 C ATOM 603 CE LYS A 39 17.693 7.603 2.770 1.00 2.59 C ATOM 604 NZ LYS A 39 18.783 8.004 3.688 1.00 3.67 N ATOM 0 H LYS A 39 12.861 6.538 5.755 1.00 0.66 H new ATOM 0 HA LYS A 39 12.759 5.177 3.314 1.00 0.75 H new ATOM 0 HB2 LYS A 39 13.108 7.328 2.961 1.00 0.95 H new ATOM 0 HB3 LYS A 39 14.086 7.549 4.399 1.00 0.95 H new ATOM 0 HG2 LYS A 39 15.458 5.961 2.300 1.00 1.11 H new ATOM 0 HG3 LYS A 39 15.035 7.581 1.783 1.00 1.11 H new ATOM 0 HD2 LYS A 39 16.076 8.525 3.847 1.00 2.05 H new ATOM 0 HD3 LYS A 39 16.471 6.909 4.398 1.00 2.05 H new ATOM 0 HE2 LYS A 39 17.924 6.634 2.327 1.00 2.59 H new ATOM 0 HE3 LYS A 39 17.621 8.319 1.951 1.00 2.59 H new ATOM 0 HZ1 LYS A 39 19.596 8.342 3.135 1.00 3.67 H new ATOM 0 HZ2 LYS A 39 18.448 8.765 4.312 1.00 3.67 H new ATOM 0 HZ3 LYS A 39 19.071 7.187 4.263 1.00 3.67 H new ATOM 618 N GLU A 40 15.472 4.391 5.010 1.00 0.91 N ATOM 619 CA GLU A 40 16.495 3.352 5.049 1.00 1.06 C ATOM 620 C GLU A 40 15.860 1.982 5.322 1.00 1.06 C ATOM 621 O GLU A 40 16.150 1.010 4.620 1.00 1.28 O ATOM 622 CB GLU A 40 17.640 3.739 5.996 1.00 1.27 C ATOM 623 CG GLU A 40 18.152 5.130 5.579 1.00 1.29 C ATOM 624 CD GLU A 40 19.620 5.399 5.862 1.00 1.93 C ATOM 625 OE1 GLU A 40 20.226 4.667 6.669 1.00 2.15 O ATOM 626 OE2 GLU A 40 20.096 6.367 5.227 1.00 3.51 O ATOM 0 H GLU A 40 15.505 5.057 5.782 1.00 0.91 H new ATOM 0 HA GLU A 40 16.966 3.261 4.070 1.00 1.06 H new ATOM 0 HB2 GLU A 40 17.292 3.755 7.029 1.00 1.27 H new ATOM 0 HB3 GLU A 40 18.444 3.005 5.942 1.00 1.27 H new ATOM 0 HG2 GLU A 40 17.977 5.257 4.511 1.00 1.29 H new ATOM 0 HG3 GLU A 40 17.557 5.886 6.092 1.00 1.29 H new ATOM 633 N LEU A 41 14.932 1.910 6.275 1.00 0.94 N ATOM 634 CA LEU A 41 14.185 0.692 6.569 1.00 0.94 C ATOM 635 C LEU A 41 13.588 0.066 5.303 1.00 0.82 C ATOM 636 O LEU A 41 13.864 -1.096 5.025 1.00 0.87 O ATOM 637 CB LEU A 41 13.121 0.946 7.647 1.00 1.01 C ATOM 638 CG LEU A 41 13.569 0.481 9.041 1.00 1.18 C ATOM 639 CD1 LEU A 41 14.819 1.217 9.535 1.00 2.90 C ATOM 640 CD2 LEU A 41 12.424 0.713 10.033 1.00 2.05 C ATOM 0 H LEU A 41 14.677 2.700 6.867 1.00 0.94 H new ATOM 0 HA LEU A 41 14.888 -0.038 6.970 1.00 0.94 H new ATOM 0 HB2 LEU A 41 12.890 2.011 7.680 1.00 1.01 H new ATOM 0 HB3 LEU A 41 12.201 0.429 7.374 1.00 1.01 H new ATOM 0 HG LEU A 41 13.821 -0.577 8.971 1.00 1.18 H new ATOM 0 HD11 LEU A 41 15.091 0.849 10.524 1.00 2.90 H new ATOM 0 HD12 LEU A 41 15.643 1.040 8.843 1.00 2.90 H new ATOM 0 HD13 LEU A 41 14.614 2.286 9.589 1.00 2.90 H new ATOM 0 HD21 LEU A 41 12.731 0.386 11.026 1.00 2.05 H new ATOM 0 HD22 LEU A 41 12.176 1.774 10.061 1.00 2.05 H new ATOM 0 HD23 LEU A 41 11.549 0.144 9.718 1.00 2.05 H new ATOM 652 N VAL A 42 12.797 0.798 4.509 1.00 0.71 N ATOM 653 CA VAL A 42 12.171 0.205 3.326 1.00 0.65 C ATOM 654 C VAL A 42 13.224 -0.453 2.415 1.00 0.59 C ATOM 655 O VAL A 42 13.067 -1.617 2.052 1.00 0.62 O ATOM 656 CB VAL A 42 11.192 1.166 2.611 1.00 0.68 C ATOM 657 CG1 VAL A 42 11.833 2.476 2.150 1.00 2.61 C ATOM 658 CG2 VAL A 42 10.524 0.500 1.408 1.00 1.99 C ATOM 0 H VAL A 42 12.579 1.783 4.661 1.00 0.71 H new ATOM 0 HA VAL A 42 11.523 -0.606 3.659 1.00 0.65 H new ATOM 0 HB VAL A 42 10.447 1.409 3.369 1.00 0.68 H new ATOM 0 HG11 VAL A 42 11.083 3.095 1.658 1.00 2.61 H new ATOM 0 HG12 VAL A 42 12.234 3.008 3.013 1.00 2.61 H new ATOM 0 HG13 VAL A 42 12.640 2.260 1.450 1.00 2.61 H new ATOM 0 HG21 VAL A 42 9.844 1.206 0.932 1.00 1.99 H new ATOM 0 HG22 VAL A 42 11.287 0.192 0.692 1.00 1.99 H new ATOM 0 HG23 VAL A 42 9.965 -0.374 1.740 1.00 1.99 H new ATOM 668 N THR A 43 14.331 0.225 2.085 1.00 0.66 N ATOM 669 CA THR A 43 15.364 -0.421 1.273 1.00 0.74 C ATOM 670 C THR A 43 15.998 -1.613 2.007 1.00 0.70 C ATOM 671 O THR A 43 16.280 -2.631 1.381 1.00 0.86 O ATOM 672 CB THR A 43 16.380 0.581 0.694 1.00 1.10 C ATOM 673 OG1 THR A 43 17.336 -0.089 -0.104 1.00 1.56 O ATOM 674 CG2 THR A 43 17.136 1.382 1.749 1.00 1.28 C ATOM 0 H THR A 43 14.529 1.188 2.358 1.00 0.66 H new ATOM 0 HA THR A 43 14.874 -0.844 0.396 1.00 0.74 H new ATOM 0 HB THR A 43 15.783 1.279 0.107 1.00 1.10 H new ATOM 0 HG1 THR A 43 17.974 0.561 -0.466 1.00 1.56 H new ATOM 0 HG21 THR A 43 17.831 2.064 1.259 1.00 1.28 H new ATOM 0 HG22 THR A 43 16.428 1.954 2.348 1.00 1.28 H new ATOM 0 HG23 THR A 43 17.690 0.701 2.395 1.00 1.28 H new ATOM 682 N GLN A 44 16.181 -1.546 3.328 1.00 0.75 N ATOM 683 CA GLN A 44 16.660 -2.701 4.083 1.00 0.87 C ATOM 684 C GLN A 44 15.689 -3.888 3.972 1.00 0.88 C ATOM 685 O GLN A 44 16.126 -5.028 3.845 1.00 1.04 O ATOM 686 CB GLN A 44 16.925 -2.324 5.545 1.00 1.02 C ATOM 687 CG GLN A 44 18.118 -1.367 5.672 1.00 2.32 C ATOM 688 CD GLN A 44 18.170 -0.734 7.058 1.00 3.32 C ATOM 689 OE1 GLN A 44 17.945 0.460 7.214 1.00 4.89 O ATOM 690 NE2 GLN A 44 18.460 -1.531 8.082 1.00 3.14 N ATOM 0 H GLN A 44 16.006 -0.713 3.890 1.00 0.75 H new ATOM 0 HA GLN A 44 17.606 -3.019 3.645 1.00 0.87 H new ATOM 0 HB2 GLN A 44 16.036 -1.857 5.968 1.00 1.02 H new ATOM 0 HB3 GLN A 44 17.118 -3.226 6.125 1.00 1.02 H new ATOM 0 HG2 GLN A 44 19.044 -1.909 5.481 1.00 2.32 H new ATOM 0 HG3 GLN A 44 18.044 -0.586 4.915 1.00 2.32 H new ATOM 0 HE21 GLN A 44 18.643 -2.522 7.921 1.00 3.14 H new ATOM 0 HE22 GLN A 44 18.500 -1.152 9.028 1.00 3.14 H new ATOM 699 N GLN A 45 14.374 -3.641 4.022 1.00 0.80 N ATOM 700 CA GLN A 45 13.363 -4.681 3.840 1.00 0.81 C ATOM 701 C GLN A 45 13.365 -5.185 2.401 1.00 0.84 C ATOM 702 O GLN A 45 13.049 -6.347 2.168 1.00 0.99 O ATOM 703 CB GLN A 45 11.957 -4.165 4.160 1.00 0.80 C ATOM 704 CG GLN A 45 11.611 -4.103 5.655 1.00 0.90 C ATOM 705 CD GLN A 45 12.508 -3.250 6.551 1.00 1.30 C ATOM 706 OE1 GLN A 45 12.093 -2.191 7.011 1.00 2.52 O ATOM 707 NE2 GLN A 45 13.707 -3.727 6.877 1.00 1.60 N ATOM 0 H GLN A 45 13.985 -2.713 4.190 1.00 0.80 H new ATOM 0 HA GLN A 45 13.616 -5.489 4.527 1.00 0.81 H new ATOM 0 HB2 GLN A 45 11.848 -3.167 3.736 1.00 0.80 H new ATOM 0 HB3 GLN A 45 11.229 -4.805 3.661 1.00 0.80 H new ATOM 0 HG2 GLN A 45 10.591 -3.732 5.749 1.00 0.90 H new ATOM 0 HG3 GLN A 45 11.617 -5.121 6.044 1.00 0.90 H new ATOM 0 HE21 GLN A 45 14.029 -4.610 6.481 1.00 1.60 H new ATOM 0 HE22 GLN A 45 14.303 -3.210 7.523 1.00 1.60 H new ATOM 716 N LEU A 46 13.655 -4.302 1.444 1.00 0.78 N ATOM 717 CA LEU A 46 13.711 -4.629 0.031 1.00 0.84 C ATOM 718 C LEU A 46 15.156 -4.567 -0.471 1.00 0.99 C ATOM 719 O LEU A 46 15.498 -3.643 -1.205 1.00 1.15 O ATOM 720 CB LEU A 46 12.850 -3.642 -0.773 1.00 0.85 C ATOM 721 CG LEU A 46 11.337 -3.790 -0.612 1.00 1.03 C ATOM 722 CD1 LEU A 46 10.761 -3.163 0.656 1.00 1.39 C ATOM 723 CD2 LEU A 46 10.650 -3.138 -1.812 1.00 1.39 C ATOM 0 H LEU A 46 13.860 -3.322 1.640 1.00 0.78 H new ATOM 0 HA LEU A 46 13.327 -5.640 -0.105 1.00 0.84 H new ATOM 0 HB2 LEU A 46 13.129 -2.628 -0.485 1.00 0.85 H new ATOM 0 HB3 LEU A 46 13.096 -3.752 -1.829 1.00 0.85 H new ATOM 0 HG LEU A 46 11.150 -4.862 -0.543 1.00 1.03 H new ATOM 0 HD11 LEU A 46 9.683 -3.319 0.681 1.00 1.39 H new ATOM 0 HD12 LEU A 46 11.216 -3.628 1.531 1.00 1.39 H new ATOM 0 HD13 LEU A 46 10.973 -2.094 0.662 1.00 1.39 H new ATOM 0 HD21 LEU A 46 9.569 -3.236 -1.710 1.00 1.39 H new ATOM 0 HD22 LEU A 46 10.916 -2.082 -1.854 1.00 1.39 H new ATOM 0 HD23 LEU A 46 10.974 -3.630 -2.729 1.00 1.39 H new ATOM 735 N PRO A 47 16.013 -5.565 -0.213 1.00 1.14 N ATOM 736 CA PRO A 47 17.355 -5.590 -0.781 1.00 1.34 C ATOM 737 C PRO A 47 17.345 -6.030 -2.257 1.00 1.34 C ATOM 738 O PRO A 47 18.361 -6.514 -2.765 1.00 1.58 O ATOM 739 CB PRO A 47 18.118 -6.577 0.106 1.00 1.63 C ATOM 740 CG PRO A 47 17.036 -7.594 0.460 1.00 1.61 C ATOM 741 CD PRO A 47 15.783 -6.733 0.622 1.00 1.29 C ATOM 0 HA PRO A 47 17.818 -4.603 -0.793 1.00 1.34 H new ATOM 0 HB2 PRO A 47 18.953 -7.038 -0.422 1.00 1.63 H new ATOM 0 HB3 PRO A 47 18.529 -6.094 0.993 1.00 1.63 H new ATOM 0 HG2 PRO A 47 16.913 -8.340 -0.325 1.00 1.61 H new ATOM 0 HG3 PRO A 47 17.275 -8.133 1.377 1.00 1.61 H new ATOM 0 HD2 PRO A 47 14.890 -7.273 0.306 1.00 1.29 H new ATOM 0 HD3 PRO A 47 15.632 -6.449 1.664 1.00 1.29 H new ATOM 749 N HIS A 48 16.221 -5.860 -2.966 1.00 1.26 N ATOM 750 CA HIS A 48 16.004 -6.289 -4.339 1.00 1.26 C ATOM 751 C HIS A 48 16.621 -5.270 -5.309 1.00 1.38 C ATOM 752 O HIS A 48 15.945 -4.698 -6.163 1.00 2.79 O ATOM 753 CB HIS A 48 14.502 -6.525 -4.559 1.00 1.30 C ATOM 754 CG HIS A 48 14.217 -7.328 -5.804 1.00 1.89 C ATOM 755 ND1 HIS A 48 14.305 -8.698 -5.915 1.00 2.90 N ATOM 756 CD2 HIS A 48 13.963 -6.824 -7.051 1.00 2.60 C ATOM 757 CE1 HIS A 48 14.150 -8.998 -7.218 1.00 3.82 C ATOM 758 NE2 HIS A 48 13.924 -7.894 -7.948 1.00 3.62 N ATOM 0 H HIS A 48 15.403 -5.396 -2.571 1.00 1.26 H new ATOM 0 HA HIS A 48 16.506 -7.236 -4.538 1.00 1.26 H new ATOM 0 HB2 HIS A 48 14.089 -7.044 -3.694 1.00 1.30 H new ATOM 0 HB3 HIS A 48 13.993 -5.564 -4.627 1.00 1.30 H new ATOM 0 HD1 HIS A 48 14.459 -9.360 -5.154 1.00 2.90 H new ATOM 0 HD2 HIS A 48 13.818 -5.783 -7.298 1.00 2.60 H new ATOM 0 HE1 HIS A 48 14.201 -9.998 -7.624 1.00 3.82 H new ATOM 766 N LEU A 49 17.923 -5.023 -5.154 1.00 1.78 N ATOM 767 CA LEU A 49 18.721 -4.087 -5.942 1.00 1.71 C ATOM 768 C LEU A 49 18.381 -2.629 -5.599 1.00 1.32 C ATOM 769 O LEU A 49 19.255 -1.911 -5.124 1.00 1.62 O ATOM 770 CB LEU A 49 18.606 -4.398 -7.448 1.00 1.86 C ATOM 771 CG LEU A 49 19.869 -4.053 -8.257 1.00 2.49 C ATOM 772 CD1 LEU A 49 19.631 -4.421 -9.725 1.00 2.27 C ATOM 773 CD2 LEU A 49 20.260 -2.573 -8.166 1.00 3.78 C ATOM 0 H LEU A 49 18.476 -5.495 -4.439 1.00 1.78 H new ATOM 0 HA LEU A 49 19.770 -4.220 -5.676 1.00 1.71 H new ATOM 0 HB2 LEU A 49 18.385 -5.458 -7.574 1.00 1.86 H new ATOM 0 HB3 LEU A 49 17.761 -3.845 -7.859 1.00 1.86 H new ATOM 0 HG LEU A 49 20.693 -4.625 -7.831 1.00 2.49 H new ATOM 0 HD11 LEU A 49 20.520 -4.181 -10.309 1.00 2.27 H new ATOM 0 HD12 LEU A 49 19.422 -5.488 -9.803 1.00 2.27 H new ATOM 0 HD13 LEU A 49 18.781 -3.856 -10.109 1.00 2.27 H new ATOM 0 HD21 LEU A 49 21.158 -2.397 -8.758 1.00 3.78 H new ATOM 0 HD22 LEU A 49 19.446 -1.957 -8.549 1.00 3.78 H new ATOM 0 HD23 LEU A 49 20.454 -2.311 -7.126 1.00 3.78 H new ATOM 785 N LEU A 50 17.130 -2.203 -5.814 1.00 1.00 N ATOM 786 CA LEU A 50 16.660 -0.843 -5.534 1.00 0.99 C ATOM 787 C LEU A 50 17.462 0.145 -6.382 1.00 1.01 C ATOM 788 O LEU A 50 18.258 0.953 -5.913 1.00 1.29 O ATOM 789 CB LEU A 50 16.614 -0.539 -4.025 1.00 1.42 C ATOM 790 CG LEU A 50 15.371 -1.129 -3.323 1.00 1.99 C ATOM 791 CD1 LEU A 50 14.153 -0.202 -3.407 1.00 3.32 C ATOM 792 CD2 LEU A 50 14.974 -2.510 -3.853 1.00 2.54 C ATOM 0 H LEU A 50 16.402 -2.808 -6.195 1.00 1.00 H new ATOM 0 HA LEU A 50 15.618 -0.735 -5.834 1.00 0.99 H new ATOM 0 HB2 LEU A 50 17.513 -0.937 -3.553 1.00 1.42 H new ATOM 0 HB3 LEU A 50 16.628 0.541 -3.878 1.00 1.42 H new ATOM 0 HG LEU A 50 15.674 -1.233 -2.281 1.00 1.99 H new ATOM 0 HD11 LEU A 50 13.308 -0.665 -2.898 1.00 3.32 H new ATOM 0 HD12 LEU A 50 14.387 0.750 -2.930 1.00 3.32 H new ATOM 0 HD13 LEU A 50 13.897 -0.031 -4.453 1.00 3.32 H new ATOM 0 HD21 LEU A 50 14.094 -2.866 -3.317 1.00 2.54 H new ATOM 0 HD22 LEU A 50 14.747 -2.440 -4.917 1.00 2.54 H new ATOM 0 HD23 LEU A 50 15.798 -3.208 -3.703 1.00 2.54 H new ATOM 804 N LYS A 51 17.238 0.004 -7.689 1.00 0.97 N ATOM 805 CA LYS A 51 17.871 0.757 -8.762 1.00 1.09 C ATOM 806 C LYS A 51 17.404 2.216 -8.794 1.00 1.01 C ATOM 807 O LYS A 51 18.125 3.084 -9.279 1.00 1.09 O ATOM 808 CB LYS A 51 17.553 0.043 -10.085 1.00 1.24 C ATOM 809 CG LYS A 51 16.041 0.000 -10.383 1.00 1.21 C ATOM 810 CD LYS A 51 15.575 1.188 -11.239 1.00 1.35 C ATOM 811 CE LYS A 51 15.430 0.827 -12.716 1.00 1.58 C ATOM 812 NZ LYS A 51 16.737 0.509 -13.328 1.00 2.35 N ATOM 0 H LYS A 51 16.570 -0.680 -8.043 1.00 0.97 H new ATOM 0 HA LYS A 51 18.948 0.791 -8.597 1.00 1.09 H new ATOM 0 HB2 LYS A 51 18.067 0.551 -10.901 1.00 1.24 H new ATOM 0 HB3 LYS A 51 17.942 -0.975 -10.048 1.00 1.24 H new ATOM 0 HG2 LYS A 51 15.802 -0.930 -10.898 1.00 1.21 H new ATOM 0 HG3 LYS A 51 15.489 -0.005 -9.443 1.00 1.21 H new ATOM 0 HD2 LYS A 51 14.619 1.550 -10.862 1.00 1.35 H new ATOM 0 HD3 LYS A 51 16.288 2.006 -11.137 1.00 1.35 H new ATOM 0 HE2 LYS A 51 14.762 -0.028 -12.818 1.00 1.58 H new ATOM 0 HE3 LYS A 51 14.969 1.658 -13.251 1.00 1.58 H new ATOM 0 HZ1 LYS A 51 16.601 0.268 -14.331 1.00 2.35 H new ATOM 0 HZ2 LYS A 51 17.366 1.334 -13.252 1.00 2.35 H new ATOM 0 HZ3 LYS A 51 17.165 -0.299 -12.833 1.00 2.35 H new ATOM 826 N ASP A 52 16.156 2.428 -8.374 1.00 0.95 N ATOM 827 CA ASP A 52 15.490 3.664 -8.014 1.00 1.00 C ATOM 828 C ASP A 52 16.005 4.915 -8.720 1.00 0.94 C ATOM 829 O ASP A 52 16.880 5.606 -8.213 1.00 1.05 O ATOM 830 CB ASP A 52 15.475 3.793 -6.482 1.00 1.32 C ATOM 831 CG ASP A 52 14.970 2.547 -5.754 1.00 1.61 C ATOM 832 OD1 ASP A 52 14.662 1.545 -6.448 1.00 2.68 O ATOM 833 OD2 ASP A 52 14.938 2.605 -4.508 1.00 1.94 O ATOM 0 H ASP A 52 15.519 1.638 -8.268 1.00 0.95 H new ATOM 0 HA ASP A 52 14.467 3.598 -8.385 1.00 1.00 H new ATOM 0 HB2 ASP A 52 16.484 4.018 -6.137 1.00 1.32 H new ATOM 0 HB3 ASP A 52 14.848 4.641 -6.206 1.00 1.32 H new ATOM 838 N VAL A 53 15.413 5.242 -9.874 1.00 1.20 N ATOM 839 CA VAL A 53 15.709 6.472 -10.594 1.00 1.33 C ATOM 840 C VAL A 53 14.470 6.933 -11.366 1.00 1.81 C ATOM 841 O VAL A 53 14.455 7.147 -12.574 1.00 3.58 O ATOM 842 CB VAL A 53 16.983 6.279 -11.425 1.00 2.32 C ATOM 843 CG1 VAL A 53 16.802 5.144 -12.434 1.00 2.98 C ATOM 844 CG2 VAL A 53 17.456 7.569 -12.103 1.00 3.09 C ATOM 0 H VAL A 53 14.714 4.656 -10.331 1.00 1.20 H new ATOM 0 HA VAL A 53 15.932 7.295 -9.916 1.00 1.33 H new ATOM 0 HB VAL A 53 17.776 6.000 -10.731 1.00 2.32 H new ATOM 0 HG11 VAL A 53 17.717 5.023 -13.014 1.00 2.98 H new ATOM 0 HG12 VAL A 53 16.583 4.217 -11.904 1.00 2.98 H new ATOM 0 HG13 VAL A 53 15.976 5.382 -13.105 1.00 2.98 H new ATOM 0 HG21 VAL A 53 18.361 7.368 -12.676 1.00 3.09 H new ATOM 0 HG22 VAL A 53 16.677 7.935 -12.772 1.00 3.09 H new ATOM 0 HG23 VAL A 53 17.667 8.323 -11.344 1.00 3.09 H new ATOM 854 N GLY A 54 13.420 7.129 -10.584 1.00 1.67 N ATOM 855 CA GLY A 54 12.267 7.946 -10.920 1.00 2.03 C ATOM 856 C GLY A 54 11.841 8.650 -9.639 1.00 1.54 C ATOM 857 O GLY A 54 12.546 9.538 -9.162 1.00 1.74 O ATOM 0 H GLY A 54 13.346 6.705 -9.659 1.00 1.67 H new ATOM 0 HA2 GLY A 54 12.519 8.671 -11.694 1.00 2.03 H new ATOM 0 HA3 GLY A 54 11.457 7.330 -11.311 1.00 2.03 H new ATOM 861 N SER A 55 10.765 8.150 -9.024 1.00 1.21 N ATOM 862 CA SER A 55 10.231 8.605 -7.746 1.00 0.99 C ATOM 863 C SER A 55 11.220 8.699 -6.586 1.00 0.85 C ATOM 864 O SER A 55 10.899 9.304 -5.562 1.00 0.90 O ATOM 865 CB SER A 55 8.878 7.979 -7.431 1.00 1.11 C ATOM 866 OG SER A 55 8.015 8.278 -8.514 1.00 1.41 O ATOM 0 H SER A 55 10.222 7.385 -9.424 1.00 1.21 H new ATOM 0 HA SER A 55 10.029 9.666 -7.890 1.00 0.99 H new ATOM 0 HB2 SER A 55 8.974 6.901 -7.302 1.00 1.11 H new ATOM 0 HB3 SER A 55 8.478 8.377 -6.499 1.00 1.11 H new ATOM 0 HG SER A 55 8.052 9.238 -8.706 1.00 1.41 H new ATOM 872 N LEU A 56 12.418 8.128 -6.756 1.00 0.80 N ATOM 873 CA LEU A 56 13.590 8.485 -5.973 1.00 0.99 C ATOM 874 C LEU A 56 13.547 9.987 -5.678 1.00 1.15 C ATOM 875 O LEU A 56 13.510 10.351 -4.511 1.00 1.15 O ATOM 876 CB LEU A 56 14.865 8.123 -6.766 1.00 1.33 C ATOM 877 CG LEU A 56 16.133 8.868 -6.299 1.00 1.98 C ATOM 878 CD1 LEU A 56 16.388 8.635 -4.813 1.00 1.57 C ATOM 879 CD2 LEU A 56 17.376 8.439 -7.081 1.00 3.69 C ATOM 0 H LEU A 56 12.595 7.400 -7.448 1.00 0.80 H new ATOM 0 HA LEU A 56 13.599 7.936 -5.031 1.00 0.99 H new ATOM 0 HB2 LEU A 56 15.037 7.050 -6.685 1.00 1.33 H new ATOM 0 HB3 LEU A 56 14.697 8.340 -7.821 1.00 1.33 H new ATOM 0 HG LEU A 56 15.951 9.927 -6.484 1.00 1.98 H new ATOM 0 HD11 LEU A 56 17.287 9.171 -4.510 1.00 1.57 H new ATOM 0 HD12 LEU A 56 15.537 8.998 -4.237 1.00 1.57 H new ATOM 0 HD13 LEU A 56 16.522 7.569 -4.630 1.00 1.57 H new ATOM 0 HD21 LEU A 56 18.243 8.990 -6.717 1.00 3.69 H new ATOM 0 HD22 LEU A 56 17.541 7.370 -6.944 1.00 3.69 H new ATOM 0 HD23 LEU A 56 17.230 8.650 -8.140 1.00 3.69 H new ATOM 891 N ASP A 57 13.518 10.845 -6.700 1.00 1.38 N ATOM 892 CA ASP A 57 13.483 12.293 -6.476 1.00 1.65 C ATOM 893 C ASP A 57 12.328 12.718 -5.556 1.00 1.51 C ATOM 894 O ASP A 57 12.591 13.231 -4.465 1.00 1.48 O ATOM 895 CB ASP A 57 13.440 13.082 -7.788 1.00 2.01 C ATOM 896 CG ASP A 57 13.356 14.575 -7.481 1.00 2.62 C ATOM 897 OD1 ASP A 57 14.375 15.124 -7.012 1.00 2.65 O ATOM 898 OD2 ASP A 57 12.261 15.147 -7.663 1.00 4.08 O ATOM 0 H ASP A 57 13.518 10.567 -7.681 1.00 1.38 H new ATOM 0 HA ASP A 57 14.417 12.535 -5.969 1.00 1.65 H new ATOM 0 HB2 ASP A 57 14.330 12.871 -8.381 1.00 2.01 H new ATOM 0 HB3 ASP A 57 12.580 12.773 -8.383 1.00 2.01 H new ATOM 903 N GLU A 58 11.065 12.483 -5.954 1.00 1.48 N ATOM 904 CA GLU A 58 9.891 12.829 -5.148 1.00 1.45 C ATOM 905 C GLU A 58 10.086 12.432 -3.684 1.00 1.20 C ATOM 906 O GLU A 58 9.823 13.212 -2.764 1.00 1.28 O ATOM 907 CB GLU A 58 8.612 12.160 -5.683 1.00 1.53 C ATOM 908 CG GLU A 58 8.171 12.650 -7.072 1.00 2.04 C ATOM 909 CD GLU A 58 8.775 11.809 -8.182 1.00 3.21 C ATOM 910 OE1 GLU A 58 9.989 11.990 -8.412 1.00 3.95 O ATOM 911 OE2 GLU A 58 8.044 10.943 -8.718 1.00 4.48 O ATOM 0 H GLU A 58 10.834 12.047 -6.847 1.00 1.48 H new ATOM 0 HA GLU A 58 9.777 13.911 -5.217 1.00 1.45 H new ATOM 0 HB2 GLU A 58 8.771 11.082 -5.725 1.00 1.53 H new ATOM 0 HB3 GLU A 58 7.802 12.335 -4.975 1.00 1.53 H new ATOM 0 HG2 GLU A 58 7.084 12.617 -7.141 1.00 2.04 H new ATOM 0 HG3 GLU A 58 8.467 13.691 -7.202 1.00 2.04 H new ATOM 918 N LYS A 59 10.525 11.196 -3.463 1.00 0.99 N ATOM 919 CA LYS A 59 10.643 10.648 -2.130 1.00 0.88 C ATOM 920 C LYS A 59 11.816 11.289 -1.387 1.00 0.89 C ATOM 921 O LYS A 59 11.628 11.847 -0.310 1.00 0.94 O ATOM 922 CB LYS A 59 10.732 9.117 -2.219 1.00 0.85 C ATOM 923 CG LYS A 59 9.886 8.462 -1.126 1.00 0.71 C ATOM 924 CD LYS A 59 9.383 7.069 -1.513 1.00 0.75 C ATOM 925 CE LYS A 59 10.433 5.973 -1.684 1.00 0.75 C ATOM 926 NZ LYS A 59 11.237 6.176 -2.905 1.00 0.99 N ATOM 0 H LYS A 59 10.806 10.554 -4.205 1.00 0.99 H new ATOM 0 HA LYS A 59 9.757 10.885 -1.541 1.00 0.88 H new ATOM 0 HB2 LYS A 59 10.390 8.784 -3.199 1.00 0.85 H new ATOM 0 HB3 LYS A 59 11.771 8.802 -2.120 1.00 0.85 H new ATOM 0 HG2 LYS A 59 10.476 8.388 -0.213 1.00 0.71 H new ATOM 0 HG3 LYS A 59 9.032 9.102 -0.903 1.00 0.71 H new ATOM 0 HD2 LYS A 59 8.674 6.742 -0.753 1.00 0.75 H new ATOM 0 HD3 LYS A 59 8.830 7.157 -2.448 1.00 0.75 H new ATOM 0 HE2 LYS A 59 11.089 5.958 -0.814 1.00 0.75 H new ATOM 0 HE3 LYS A 59 9.941 5.001 -1.729 1.00 0.75 H new ATOM 0 HZ1 LYS A 59 11.592 5.259 -3.243 1.00 0.99 H new ATOM 0 HZ2 LYS A 59 10.646 6.612 -3.641 1.00 0.99 H new ATOM 0 HZ3 LYS A 59 12.041 6.801 -2.692 1.00 0.99 H new ATOM 940 N MET A 60 13.016 11.230 -1.962 1.00 0.91 N ATOM 941 CA MET A 60 14.222 11.836 -1.422 1.00 1.02 C ATOM 942 C MET A 60 13.924 13.259 -0.967 1.00 1.14 C ATOM 943 O MET A 60 14.197 13.599 0.183 1.00 1.18 O ATOM 944 CB MET A 60 15.354 11.784 -2.454 1.00 1.17 C ATOM 945 CG MET A 60 16.664 12.337 -1.883 1.00 1.43 C ATOM 946 SD MET A 60 18.111 12.060 -2.929 1.00 1.86 S ATOM 947 CE MET A 60 19.386 12.819 -1.907 1.00 2.44 C ATOM 0 H MET A 60 13.176 10.743 -2.844 1.00 0.91 H new ATOM 0 HA MET A 60 14.557 11.272 -0.551 1.00 1.02 H new ATOM 0 HB2 MET A 60 15.504 10.754 -2.779 1.00 1.17 H new ATOM 0 HB3 MET A 60 15.070 12.358 -3.336 1.00 1.17 H new ATOM 0 HG2 MET A 60 16.550 13.408 -1.718 1.00 1.43 H new ATOM 0 HG3 MET A 60 16.842 11.881 -0.909 1.00 1.43 H new ATOM 0 HE1 MET A 60 20.351 12.736 -2.407 1.00 2.44 H new ATOM 0 HE2 MET A 60 19.148 13.871 -1.750 1.00 2.44 H new ATOM 0 HE3 MET A 60 19.432 12.310 -0.944 1.00 2.44 H new ATOM 957 N LYS A 61 13.331 14.074 -1.839 1.00 1.23 N ATOM 958 CA LYS A 61 13.035 15.450 -1.489 1.00 1.37 C ATOM 959 C LYS A 61 11.942 15.526 -0.411 1.00 1.43 C ATOM 960 O LYS A 61 12.061 16.335 0.505 1.00 1.60 O ATOM 961 CB LYS A 61 12.809 16.300 -2.746 1.00 1.47 C ATOM 962 CG LYS A 61 11.374 16.281 -3.279 1.00 1.95 C ATOM 963 CD LYS A 61 11.281 16.322 -4.808 1.00 2.13 C ATOM 964 CE LYS A 61 12.207 17.304 -5.540 1.00 2.28 C ATOM 965 NZ LYS A 61 12.179 18.658 -4.961 1.00 3.46 N ATOM 0 H LYS A 61 13.051 13.803 -2.782 1.00 1.23 H new ATOM 0 HA LYS A 61 13.902 15.908 -1.013 1.00 1.37 H new ATOM 0 HB2 LYS A 61 13.087 17.331 -2.526 1.00 1.47 H new ATOM 0 HB3 LYS A 61 13.479 15.949 -3.531 1.00 1.47 H new ATOM 0 HG2 LYS A 61 10.874 15.382 -2.918 1.00 1.95 H new ATOM 0 HG3 LYS A 61 10.833 17.133 -2.868 1.00 1.95 H new ATOM 0 HD2 LYS A 61 11.484 15.320 -5.186 1.00 2.13 H new ATOM 0 HD3 LYS A 61 10.253 16.562 -5.078 1.00 2.13 H new ATOM 0 HE2 LYS A 61 13.228 16.923 -5.511 1.00 2.28 H new ATOM 0 HE3 LYS A 61 11.916 17.357 -6.589 1.00 2.28 H new ATOM 0 HZ1 LYS A 61 12.451 19.352 -5.687 1.00 3.46 H new ATOM 0 HZ2 LYS A 61 11.219 18.871 -4.621 1.00 3.46 H new ATOM 0 HZ3 LYS A 61 12.847 18.709 -4.166 1.00 3.46 H new ATOM 979 N SER A 62 10.904 14.671 -0.470 1.00 1.30 N ATOM 980 CA SER A 62 9.966 14.549 0.656 1.00 1.24 C ATOM 981 C SER A 62 10.716 14.379 1.986 1.00 1.19 C ATOM 982 O SER A 62 10.395 15.055 2.961 1.00 1.32 O ATOM 983 CB SER A 62 8.959 13.393 0.502 1.00 1.12 C ATOM 984 OG SER A 62 8.118 13.520 -0.634 1.00 1.91 O ATOM 0 H SER A 62 10.698 14.068 -1.267 1.00 1.30 H new ATOM 0 HA SER A 62 9.400 15.481 0.656 1.00 1.24 H new ATOM 0 HB2 SER A 62 9.506 12.452 0.436 1.00 1.12 H new ATOM 0 HB3 SER A 62 8.340 13.339 1.398 1.00 1.12 H new ATOM 0 HG SER A 62 8.653 13.424 -1.449 1.00 1.91 H new ATOM 990 N LEU A 63 11.693 13.465 2.040 1.00 1.09 N ATOM 991 CA LEU A 63 12.474 13.253 3.256 1.00 1.14 C ATOM 992 C LEU A 63 13.286 14.515 3.582 1.00 1.28 C ATOM 993 O LEU A 63 13.199 15.027 4.695 1.00 1.33 O ATOM 994 CB LEU A 63 13.357 11.991 3.164 1.00 1.12 C ATOM 995 CG LEU A 63 12.655 10.624 3.021 1.00 1.37 C ATOM 996 CD1 LEU A 63 11.140 10.610 2.769 1.00 1.54 C ATOM 997 CD2 LEU A 63 13.309 9.870 1.863 1.00 2.05 C ATOM 0 H LEU A 63 11.957 12.866 1.258 1.00 1.09 H new ATOM 0 HA LEU A 63 11.786 13.072 4.082 1.00 1.14 H new ATOM 0 HB2 LEU A 63 14.026 12.113 2.312 1.00 1.12 H new ATOM 0 HB3 LEU A 63 13.981 11.954 4.057 1.00 1.12 H new ATOM 0 HG LEU A 63 12.778 10.169 4.004 1.00 1.37 H new ATOM 0 HD11 LEU A 63 10.794 9.579 2.692 1.00 1.54 H new ATOM 0 HD12 LEU A 63 10.629 11.103 3.596 1.00 1.54 H new ATOM 0 HD13 LEU A 63 10.921 11.137 1.841 1.00 1.54 H new ATOM 0 HD21 LEU A 63 12.828 8.899 1.743 1.00 2.05 H new ATOM 0 HD22 LEU A 63 13.197 10.446 0.944 1.00 2.05 H new ATOM 0 HD23 LEU A 63 14.369 9.726 2.075 1.00 2.05 H new ATOM 1009 N ASP A 64 14.059 15.012 2.610 1.00 1.40 N ATOM 1010 CA ASP A 64 14.985 16.135 2.747 1.00 1.61 C ATOM 1011 C ASP A 64 14.422 17.274 3.610 1.00 1.54 C ATOM 1012 O ASP A 64 15.065 17.719 4.558 1.00 1.62 O ATOM 1013 CB ASP A 64 15.358 16.642 1.350 1.00 1.84 C ATOM 1014 CG ASP A 64 16.367 17.778 1.417 1.00 2.13 C ATOM 1015 OD1 ASP A 64 17.572 17.459 1.484 1.00 2.10 O ATOM 1016 OD2 ASP A 64 15.907 18.939 1.364 1.00 3.26 O ATOM 0 H ASP A 64 14.054 14.624 1.667 1.00 1.40 H new ATOM 0 HA ASP A 64 15.873 15.778 3.268 1.00 1.61 H new ATOM 0 HB2 ASP A 64 15.771 15.822 0.763 1.00 1.84 H new ATOM 0 HB3 ASP A 64 14.460 16.982 0.834 1.00 1.84 H new ATOM 1021 N VAL A 65 13.195 17.705 3.272 1.00 1.45 N ATOM 1022 CA VAL A 65 12.493 18.836 3.883 1.00 1.45 C ATOM 1023 C VAL A 65 12.688 18.883 5.396 1.00 1.33 C ATOM 1024 O VAL A 65 13.302 19.831 5.911 1.00 1.50 O ATOM 1025 CB VAL A 65 10.993 18.760 3.526 1.00 1.42 C ATOM 1026 CG1 VAL A 65 10.131 19.753 4.318 1.00 2.13 C ATOM 1027 CG2 VAL A 65 10.800 19.070 2.045 1.00 2.12 C ATOM 0 H VAL A 65 12.648 17.255 2.538 1.00 1.45 H new ATOM 0 HA VAL A 65 12.918 19.757 3.484 1.00 1.45 H new ATOM 0 HB VAL A 65 10.674 17.749 3.778 1.00 1.42 H new ATOM 0 HG11 VAL A 65 9.088 19.648 4.020 1.00 2.13 H new ATOM 0 HG12 VAL A 65 10.226 19.547 5.384 1.00 2.13 H new ATOM 0 HG13 VAL A 65 10.466 20.770 4.113 1.00 2.13 H new ATOM 0 HG21 VAL A 65 9.740 19.015 1.797 1.00 2.12 H new ATOM 0 HG22 VAL A 65 11.171 20.072 1.832 1.00 2.12 H new ATOM 0 HG23 VAL A 65 11.351 18.344 1.447 1.00 2.12 H new ATOM 1037 N ASN A 66 12.134 17.913 6.101 1.00 1.15 N ATOM 1038 CA ASN A 66 12.260 17.779 7.557 1.00 1.14 C ATOM 1039 C ASN A 66 12.129 16.311 7.951 1.00 1.09 C ATOM 1040 O ASN A 66 11.238 15.938 8.717 1.00 1.11 O ATOM 1041 CB ASN A 66 11.225 18.632 8.318 1.00 1.22 C ATOM 1042 CG ASN A 66 11.470 20.138 8.239 1.00 1.81 C ATOM 1043 OD1 ASN A 66 12.435 20.657 8.792 1.00 2.61 O ATOM 1044 ND2 ASN A 66 10.574 20.878 7.591 1.00 2.51 N ATOM 0 H ASN A 66 11.570 17.177 5.676 1.00 1.15 H new ATOM 0 HA ASN A 66 13.245 18.151 7.838 1.00 1.14 H new ATOM 0 HB2 ASN A 66 10.233 18.416 7.922 1.00 1.22 H new ATOM 0 HB3 ASN A 66 11.223 18.331 9.366 1.00 1.22 H new ATOM 0 HD21 ASN A 66 10.684 21.891 7.549 1.00 2.51 H new ATOM 0 HD22 ASN A 66 9.777 20.432 7.136 1.00 2.51 H new ATOM 1051 N GLN A 67 13.010 15.461 7.424 1.00 1.15 N ATOM 1052 CA GLN A 67 13.080 14.035 7.715 1.00 1.14 C ATOM 1053 C GLN A 67 13.026 13.694 9.208 1.00 1.24 C ATOM 1054 O GLN A 67 12.564 12.630 9.618 1.00 1.27 O ATOM 1055 CB GLN A 67 14.363 13.419 7.146 1.00 1.29 C ATOM 1056 CG GLN A 67 15.676 14.122 7.558 1.00 1.46 C ATOM 1057 CD GLN A 67 15.980 15.317 6.665 1.00 2.52 C ATOM 1058 OE1 GLN A 67 16.476 15.117 5.563 1.00 3.41 O ATOM 1059 NE2 GLN A 67 15.669 16.538 7.098 1.00 2.98 N ATOM 0 H GLN A 67 13.721 15.762 6.757 1.00 1.15 H new ATOM 0 HA GLN A 67 12.192 13.618 7.240 1.00 1.14 H new ATOM 0 HB2 GLN A 67 14.415 12.376 7.460 1.00 1.29 H new ATOM 0 HB3 GLN A 67 14.295 13.422 6.058 1.00 1.29 H new ATOM 0 HG2 GLN A 67 15.602 14.452 8.594 1.00 1.46 H new ATOM 0 HG3 GLN A 67 16.501 13.411 7.508 1.00 1.46 H new ATOM 0 HE21 GLN A 67 15.257 16.662 8.023 1.00 2.98 H new ATOM 0 HE22 GLN A 67 15.843 17.349 6.505 1.00 2.98 H new ATOM 1068 N ASP A 68 13.603 14.600 9.982 1.00 1.42 N ATOM 1069 CA ASP A 68 13.717 14.662 11.424 1.00 1.70 C ATOM 1070 C ASP A 68 12.349 14.692 12.118 1.00 1.77 C ATOM 1071 O ASP A 68 12.262 14.382 13.305 1.00 2.12 O ATOM 1072 CB ASP A 68 14.591 15.887 11.767 1.00 2.03 C ATOM 1073 CG ASP A 68 14.332 17.092 10.859 1.00 3.79 C ATOM 1074 OD1 ASP A 68 14.701 16.974 9.659 1.00 5.30 O ATOM 1075 OD2 ASP A 68 13.725 18.062 11.350 1.00 4.54 O ATOM 0 H ASP A 68 14.058 15.408 9.556 1.00 1.42 H new ATOM 0 HA ASP A 68 14.192 13.757 11.802 1.00 1.70 H new ATOM 0 HB2 ASP A 68 14.409 16.176 12.802 1.00 2.03 H new ATOM 0 HB3 ASP A 68 15.642 15.606 11.695 1.00 2.03 H new ATOM 1080 N SER A 69 11.275 15.007 11.388 1.00 1.53 N ATOM 1081 CA SER A 69 9.913 14.785 11.854 1.00 1.54 C ATOM 1082 C SER A 69 9.659 13.295 12.119 1.00 1.75 C ATOM 1083 O SER A 69 10.440 12.427 11.718 1.00 2.79 O ATOM 1084 CB SER A 69 8.922 15.289 10.796 1.00 1.31 C ATOM 1085 OG SER A 69 9.212 16.624 10.434 1.00 2.50 O ATOM 0 H SER A 69 11.331 15.423 10.458 1.00 1.53 H new ATOM 0 HA SER A 69 9.775 15.332 12.787 1.00 1.54 H new ATOM 0 HB2 SER A 69 8.968 14.650 9.914 1.00 1.31 H new ATOM 0 HB3 SER A 69 7.905 15.225 11.183 1.00 1.31 H new ATOM 0 HG SER A 69 9.929 16.633 9.766 1.00 2.50 H new ATOM 1091 N GLU A 70 8.512 12.978 12.727 1.00 1.35 N ATOM 1092 CA GLU A 70 7.989 11.626 12.617 1.00 1.30 C ATOM 1093 C GLU A 70 7.518 11.392 11.177 1.00 1.45 C ATOM 1094 O GLU A 70 7.432 12.323 10.375 1.00 1.87 O ATOM 1095 CB GLU A 70 6.869 11.365 13.636 1.00 1.21 C ATOM 1096 CG GLU A 70 5.585 12.154 13.351 1.00 2.46 C ATOM 1097 CD GLU A 70 4.437 11.701 14.240 1.00 2.63 C ATOM 1098 OE1 GLU A 70 4.208 10.473 14.307 1.00 3.15 O ATOM 1099 OE2 GLU A 70 3.732 12.572 14.789 1.00 3.34 O ATOM 0 H GLU A 70 7.948 13.621 13.282 1.00 1.35 H new ATOM 0 HA GLU A 70 8.781 10.915 12.852 1.00 1.30 H new ATOM 0 HB2 GLU A 70 6.637 10.300 13.644 1.00 1.21 H new ATOM 0 HB3 GLU A 70 7.229 11.620 14.633 1.00 1.21 H new ATOM 0 HG2 GLU A 70 5.769 13.217 13.507 1.00 2.46 H new ATOM 0 HG3 GLU A 70 5.306 12.029 12.305 1.00 2.46 H new ATOM 1106 N LEU A 71 7.165 10.148 10.878 1.00 1.34 N ATOM 1107 CA LEU A 71 6.406 9.739 9.712 1.00 1.42 C ATOM 1108 C LEU A 71 5.158 9.045 10.249 1.00 1.35 C ATOM 1109 O LEU A 71 5.158 8.564 11.382 1.00 1.35 O ATOM 1110 CB LEU A 71 7.259 8.784 8.863 1.00 1.68 C ATOM 1111 CG LEU A 71 6.657 8.417 7.498 1.00 1.11 C ATOM 1112 CD1 LEU A 71 6.462 9.646 6.605 1.00 2.36 C ATOM 1113 CD2 LEU A 71 7.602 7.453 6.781 1.00 1.88 C ATOM 0 H LEU A 71 7.415 9.360 11.475 1.00 1.34 H new ATOM 0 HA LEU A 71 6.131 10.579 9.074 1.00 1.42 H new ATOM 0 HB2 LEU A 71 8.236 9.239 8.702 1.00 1.68 H new ATOM 0 HB3 LEU A 71 7.424 7.867 9.429 1.00 1.68 H new ATOM 0 HG LEU A 71 5.682 7.964 7.679 1.00 1.11 H new ATOM 0 HD11 LEU A 71 6.034 9.338 5.651 1.00 2.36 H new ATOM 0 HD12 LEU A 71 5.788 10.349 7.095 1.00 2.36 H new ATOM 0 HD13 LEU A 71 7.425 10.127 6.433 1.00 2.36 H new ATOM 0 HD21 LEU A 71 7.183 7.187 5.811 1.00 1.88 H new ATOM 0 HD22 LEU A 71 8.571 7.932 6.639 1.00 1.88 H new ATOM 0 HD23 LEU A 71 7.727 6.552 7.382 1.00 1.88 H new ATOM 1125 N LYS A 72 4.100 8.959 9.442 1.00 1.34 N ATOM 1126 CA LYS A 72 2.880 8.265 9.787 1.00 1.32 C ATOM 1127 C LYS A 72 2.448 7.350 8.647 1.00 1.25 C ATOM 1128 O LYS A 72 2.814 7.577 7.491 1.00 1.15 O ATOM 1129 CB LYS A 72 1.776 9.268 10.135 1.00 1.34 C ATOM 1130 CG LYS A 72 2.120 10.010 11.431 1.00 1.38 C ATOM 1131 CD LYS A 72 0.835 10.568 12.063 1.00 1.77 C ATOM 1132 CE LYS A 72 1.044 11.043 13.505 1.00 2.64 C ATOM 1133 NZ LYS A 72 1.655 9.992 14.344 1.00 4.16 N ATOM 0 H LYS A 72 4.077 9.382 8.514 1.00 1.34 H new ATOM 0 HA LYS A 72 3.065 7.647 10.665 1.00 1.32 H new ATOM 0 HB2 LYS A 72 1.654 9.982 9.321 1.00 1.34 H new ATOM 0 HB3 LYS A 72 0.825 8.748 10.247 1.00 1.34 H new ATOM 0 HG2 LYS A 72 2.616 9.334 12.128 1.00 1.38 H new ATOM 0 HG3 LYS A 72 2.817 10.822 11.223 1.00 1.38 H new ATOM 0 HD2 LYS A 72 0.470 11.399 11.460 1.00 1.77 H new ATOM 0 HD3 LYS A 72 0.063 9.799 12.046 1.00 1.77 H new ATOM 0 HE2 LYS A 72 1.681 11.927 13.508 1.00 2.64 H new ATOM 0 HE3 LYS A 72 0.086 11.339 13.933 1.00 2.64 H new ATOM 0 HZ1 LYS A 72 1.565 10.253 15.347 1.00 4.16 H new ATOM 0 HZ2 LYS A 72 1.169 9.088 14.176 1.00 4.16 H new ATOM 0 HZ3 LYS A 72 2.661 9.895 14.100 1.00 4.16 H new ATOM 1147 N PHE A 73 1.673 6.320 9.001 1.00 1.36 N ATOM 1148 CA PHE A 73 1.179 5.275 8.115 1.00 1.26 C ATOM 1149 C PHE A 73 0.660 5.833 6.788 1.00 1.04 C ATOM 1150 O PHE A 73 0.992 5.308 5.731 1.00 0.89 O ATOM 1151 CB PHE A 73 0.167 4.362 8.833 1.00 1.53 C ATOM 1152 CG PHE A 73 -1.209 4.940 9.137 1.00 1.16 C ATOM 1153 CD1 PHE A 73 -1.363 6.037 10.008 1.00 2.42 C ATOM 1154 CD2 PHE A 73 -2.356 4.284 8.647 1.00 1.83 C ATOM 1155 CE1 PHE A 73 -2.642 6.471 10.388 1.00 2.52 C ATOM 1156 CE2 PHE A 73 -3.635 4.695 9.059 1.00 2.52 C ATOM 1157 CZ PHE A 73 -3.780 5.788 9.930 1.00 2.23 C ATOM 0 H PHE A 73 1.361 6.191 9.963 1.00 1.36 H new ATOM 0 HA PHE A 73 2.026 4.644 7.848 1.00 1.26 H new ATOM 0 HB2 PHE A 73 0.029 3.468 8.224 1.00 1.53 H new ATOM 0 HB3 PHE A 73 0.613 4.041 9.775 1.00 1.53 H new ATOM 0 HD1 PHE A 73 -0.490 6.548 10.386 1.00 2.42 H new ATOM 0 HD2 PHE A 73 -2.252 3.463 7.953 1.00 1.83 H new ATOM 0 HE1 PHE A 73 -2.751 7.330 11.033 1.00 2.52 H new ATOM 0 HE2 PHE A 73 -4.509 4.169 8.705 1.00 2.52 H new ATOM 0 HZ PHE A 73 -4.764 6.102 10.246 1.00 2.23 H new ATOM 1167 N ASN A 74 -0.119 6.916 6.840 1.00 1.11 N ATOM 1168 CA ASN A 74 -0.660 7.586 5.661 1.00 1.09 C ATOM 1169 C ASN A 74 0.437 7.942 4.650 1.00 0.81 C ATOM 1170 O ASN A 74 0.389 7.515 3.499 1.00 0.73 O ATOM 1171 CB ASN A 74 -1.427 8.841 6.103 1.00 1.46 C ATOM 1172 CG ASN A 74 -2.267 9.449 4.982 1.00 1.67 C ATOM 1173 OD1 ASN A 74 -3.489 9.484 5.093 1.00 2.75 O ATOM 1174 ND2 ASN A 74 -1.652 9.967 3.925 1.00 2.84 N ATOM 0 H ASN A 74 -0.394 7.357 7.718 1.00 1.11 H new ATOM 0 HA ASN A 74 -1.340 6.901 5.155 1.00 1.09 H new ATOM 0 HB2 ASN A 74 -2.077 8.587 6.941 1.00 1.46 H new ATOM 0 HB3 ASN A 74 -0.718 9.586 6.464 1.00 1.46 H new ATOM 0 HD21 ASN A 74 -2.196 10.406 3.183 1.00 2.84 H new ATOM 0 HD22 ASN A 74 -0.635 9.926 3.856 1.00 2.84 H new ATOM 1181 N GLU A 75 1.417 8.751 5.067 1.00 0.82 N ATOM 1182 CA GLU A 75 2.510 9.173 4.196 1.00 0.73 C ATOM 1183 C GLU A 75 3.348 7.952 3.817 1.00 0.60 C ATOM 1184 O GLU A 75 3.602 7.728 2.635 1.00 0.50 O ATOM 1185 CB GLU A 75 3.355 10.274 4.864 1.00 1.05 C ATOM 1186 CG GLU A 75 3.142 11.673 4.257 1.00 1.87 C ATOM 1187 CD GLU A 75 4.086 11.963 3.089 1.00 3.54 C ATOM 1188 OE1 GLU A 75 5.312 12.008 3.311 1.00 4.54 O ATOM 1189 OE2 GLU A 75 3.608 12.154 1.950 1.00 4.61 O ATOM 0 H GLU A 75 1.472 9.128 6.013 1.00 0.82 H new ATOM 0 HA GLU A 75 2.104 9.608 3.283 1.00 0.73 H new ATOM 0 HB2 GLU A 75 3.116 10.309 5.927 1.00 1.05 H new ATOM 0 HB3 GLU A 75 4.409 10.009 4.783 1.00 1.05 H new ATOM 0 HG2 GLU A 75 2.111 11.763 3.915 1.00 1.87 H new ATOM 0 HG3 GLU A 75 3.288 12.426 5.031 1.00 1.87 H new ATOM 1196 N TYR A 76 3.739 7.135 4.806 1.00 0.72 N ATOM 1197 CA TYR A 76 4.414 5.860 4.561 1.00 0.70 C ATOM 1198 C TYR A 76 3.787 5.165 3.353 1.00 0.56 C ATOM 1199 O TYR A 76 4.499 4.695 2.467 1.00 0.47 O ATOM 1200 CB TYR A 76 4.353 4.972 5.818 1.00 0.87 C ATOM 1201 CG TYR A 76 4.446 3.470 5.578 1.00 0.77 C ATOM 1202 CD1 TYR A 76 3.345 2.769 5.045 1.00 1.98 C ATOM 1203 CD2 TYR A 76 5.609 2.758 5.920 1.00 2.07 C ATOM 1204 CE1 TYR A 76 3.466 1.422 4.688 1.00 2.27 C ATOM 1205 CE2 TYR A 76 5.703 1.384 5.632 1.00 1.99 C ATOM 1206 CZ TYR A 76 4.643 0.725 4.987 1.00 1.22 C ATOM 1207 OH TYR A 76 4.749 -0.588 4.647 1.00 1.61 O ATOM 0 H TYR A 76 3.595 7.342 5.794 1.00 0.72 H new ATOM 0 HA TYR A 76 5.465 6.045 4.338 1.00 0.70 H new ATOM 0 HB2 TYR A 76 5.164 5.264 6.485 1.00 0.87 H new ATOM 0 HB3 TYR A 76 3.419 5.180 6.341 1.00 0.87 H new ATOM 0 HD1 TYR A 76 2.401 3.276 4.911 1.00 1.98 H new ATOM 0 HD2 TYR A 76 6.430 3.266 6.404 1.00 2.07 H new ATOM 0 HE1 TYR A 76 2.654 0.921 4.183 1.00 2.27 H new ATOM 0 HE2 TYR A 76 6.591 0.835 5.907 1.00 1.99 H new ATOM 0 HH TYR A 76 5.503 -0.707 4.033 1.00 1.61 H new ATOM 1217 N TRP A 77 2.453 5.113 3.317 1.00 0.59 N ATOM 1218 CA TRP A 77 1.730 4.407 2.294 1.00 0.54 C ATOM 1219 C TRP A 77 2.157 4.856 0.895 1.00 0.43 C ATOM 1220 O TRP A 77 2.773 4.080 0.161 1.00 0.43 O ATOM 1221 CB TRP A 77 0.236 4.570 2.556 1.00 0.63 C ATOM 1222 CG TRP A 77 -0.504 3.396 2.084 1.00 0.58 C ATOM 1223 CD1 TRP A 77 -0.853 3.228 0.805 1.00 0.64 C ATOM 1224 CD2 TRP A 77 -1.020 2.253 2.821 1.00 0.51 C ATOM 1225 NE1 TRP A 77 -1.433 1.994 0.662 1.00 0.60 N ATOM 1226 CE2 TRP A 77 -1.641 1.387 1.881 1.00 0.52 C ATOM 1227 CE3 TRP A 77 -1.110 1.895 4.184 1.00 0.48 C ATOM 1228 CZ2 TRP A 77 -2.312 0.225 2.270 1.00 0.51 C ATOM 1229 CZ3 TRP A 77 -1.795 0.728 4.569 1.00 0.47 C ATOM 1230 CH2 TRP A 77 -2.344 -0.132 3.619 1.00 0.49 C ATOM 0 H TRP A 77 1.855 5.567 4.007 1.00 0.59 H new ATOM 0 HA TRP A 77 1.966 3.343 2.331 1.00 0.54 H new ATOM 0 HB2 TRP A 77 0.062 4.711 3.623 1.00 0.63 H new ATOM 0 HB3 TRP A 77 -0.131 5.464 2.052 1.00 0.63 H new ATOM 0 HD1 TRP A 77 -0.703 3.947 0.013 1.00 0.64 H new ATOM 0 HE1 TRP A 77 -1.680 1.577 -0.236 1.00 0.60 H new ATOM 0 HE3 TRP A 77 -0.650 2.520 4.935 1.00 0.48 H new ATOM 0 HZ2 TRP A 77 -2.802 -0.393 1.532 1.00 0.51 H new ATOM 0 HZ3 TRP A 77 -1.897 0.494 5.618 1.00 0.47 H new ATOM 0 HH2 TRP A 77 -2.790 -1.067 3.924 1.00 0.49 H new ATOM 1241 N ARG A 78 1.851 6.102 0.515 1.00 0.44 N ATOM 1242 CA ARG A 78 2.288 6.625 -0.772 1.00 0.50 C ATOM 1243 C ARG A 78 3.799 6.443 -0.958 1.00 0.48 C ATOM 1244 O ARG A 78 4.219 6.120 -2.065 1.00 0.54 O ATOM 1245 CB ARG A 78 1.815 8.071 -0.993 1.00 0.73 C ATOM 1246 CG ARG A 78 2.521 9.194 -0.231 1.00 1.57 C ATOM 1247 CD ARG A 78 3.812 9.668 -0.911 1.00 3.23 C ATOM 1248 NE ARG A 78 4.322 10.860 -0.227 1.00 3.52 N ATOM 1249 CZ ARG A 78 5.454 11.535 -0.465 1.00 4.88 C ATOM 1250 NH1 ARG A 78 6.289 11.210 -1.455 1.00 6.38 N ATOM 1251 NH2 ARG A 78 5.745 12.563 0.329 1.00 5.16 N ATOM 0 H ARG A 78 1.308 6.756 1.078 1.00 0.44 H new ATOM 0 HA ARG A 78 1.809 6.038 -1.556 1.00 0.50 H new ATOM 0 HB2 ARG A 78 1.900 8.289 -2.058 1.00 0.73 H new ATOM 0 HB3 ARG A 78 0.755 8.115 -0.742 1.00 0.73 H new ATOM 0 HG2 ARG A 78 1.840 10.039 -0.130 1.00 1.57 H new ATOM 0 HG3 ARG A 78 2.754 8.850 0.777 1.00 1.57 H new ATOM 0 HD2 ARG A 78 4.560 8.875 -0.886 1.00 3.23 H new ATOM 0 HD3 ARG A 78 3.620 9.893 -1.960 1.00 3.23 H new ATOM 0 HE ARG A 78 3.739 11.222 0.528 1.00 3.52 H new ATOM 0 HH11 ARG A 78 6.075 10.421 -2.065 1.00 6.38 H new ATOM 0 HH12 ARG A 78 7.141 11.751 -1.602 1.00 6.38 H new ATOM 0 HH21 ARG A 78 5.114 12.814 1.090 1.00 5.16 H new ATOM 0 HH22 ARG A 78 6.599 13.099 0.177 1.00 5.16 H new ATOM 1265 N LEU A 79 4.614 6.614 0.099 1.00 0.45 N ATOM 1266 CA LEU A 79 6.060 6.441 -0.038 1.00 0.46 C ATOM 1267 C LEU A 79 6.389 5.037 -0.551 1.00 0.45 C ATOM 1268 O LEU A 79 7.153 4.904 -1.507 1.00 0.48 O ATOM 1269 CB LEU A 79 6.855 6.750 1.249 1.00 0.53 C ATOM 1270 CG LEU A 79 7.223 8.235 1.431 1.00 0.60 C ATOM 1271 CD1 LEU A 79 6.079 9.095 1.950 1.00 1.04 C ATOM 1272 CD2 LEU A 79 8.372 8.402 2.426 1.00 1.34 C ATOM 0 H LEU A 79 4.299 6.866 1.036 1.00 0.45 H new ATOM 0 HA LEU A 79 6.380 7.182 -0.771 1.00 0.46 H new ATOM 0 HB2 LEU A 79 6.270 6.426 2.109 1.00 0.53 H new ATOM 0 HB3 LEU A 79 7.771 6.159 1.246 1.00 0.53 H new ATOM 0 HG LEU A 79 7.497 8.567 0.430 1.00 0.60 H new ATOM 0 HD11 LEU A 79 6.416 10.127 2.052 1.00 1.04 H new ATOM 0 HD12 LEU A 79 5.245 9.053 1.249 1.00 1.04 H new ATOM 0 HD13 LEU A 79 5.755 8.722 2.922 1.00 1.04 H new ATOM 0 HD21 LEU A 79 8.609 9.460 2.534 1.00 1.34 H new ATOM 0 HD22 LEU A 79 8.077 7.996 3.394 1.00 1.34 H new ATOM 0 HD23 LEU A 79 9.250 7.869 2.061 1.00 1.34 H new ATOM 1284 N ILE A 80 5.843 3.977 0.058 1.00 0.44 N ATOM 1285 CA ILE A 80 6.107 2.645 -0.482 1.00 0.45 C ATOM 1286 C ILE A 80 5.496 2.535 -1.887 1.00 0.43 C ATOM 1287 O ILE A 80 6.132 1.999 -2.787 1.00 0.52 O ATOM 1288 CB ILE A 80 5.765 1.477 0.475 1.00 0.46 C ATOM 1289 CG1 ILE A 80 4.274 1.138 0.510 1.00 0.58 C ATOM 1290 CG2 ILE A 80 6.236 1.764 1.892 1.00 0.49 C ATOM 1291 CD1 ILE A 80 3.938 -0.247 1.069 1.00 0.50 C ATOM 0 H ILE A 80 5.245 4.011 0.884 1.00 0.44 H new ATOM 0 HA ILE A 80 7.186 2.530 -0.581 1.00 0.45 H new ATOM 0 HB ILE A 80 6.296 0.614 0.073 1.00 0.46 H new ATOM 0 HG12 ILE A 80 3.760 1.890 1.109 1.00 0.58 H new ATOM 0 HG13 ILE A 80 3.876 1.211 -0.502 1.00 0.58 H new ATOM 0 HG21 ILE A 80 5.980 0.924 2.538 1.00 0.49 H new ATOM 0 HG22 ILE A 80 7.317 1.907 1.894 1.00 0.49 H new ATOM 0 HG23 ILE A 80 5.750 2.667 2.261 1.00 0.49 H new ATOM 0 HD11 ILE A 80 2.858 -0.394 1.053 1.00 0.50 H new ATOM 0 HD12 ILE A 80 4.417 -1.012 0.458 1.00 0.50 H new ATOM 0 HD13 ILE A 80 4.299 -0.323 2.095 1.00 0.50 H new ATOM 1303 N GLY A 81 4.296 3.087 -2.104 1.00 0.44 N ATOM 1304 CA GLY A 81 3.679 3.175 -3.426 1.00 0.47 C ATOM 1305 C GLY A 81 4.677 3.606 -4.496 1.00 0.48 C ATOM 1306 O GLY A 81 4.871 2.924 -5.502 1.00 0.61 O ATOM 0 H GLY A 81 3.725 3.487 -1.360 1.00 0.44 H new ATOM 0 HA2 GLY A 81 3.256 2.207 -3.694 1.00 0.47 H new ATOM 0 HA3 GLY A 81 2.853 3.885 -3.394 1.00 0.47 H new ATOM 1310 N GLU A 82 5.325 4.739 -4.253 1.00 0.44 N ATOM 1311 CA GLU A 82 6.337 5.314 -5.117 1.00 0.49 C ATOM 1312 C GLU A 82 7.494 4.330 -5.373 1.00 0.52 C ATOM 1313 O GLU A 82 7.998 4.268 -6.496 1.00 0.62 O ATOM 1314 CB GLU A 82 6.743 6.664 -4.509 1.00 0.55 C ATOM 1315 CG GLU A 82 5.605 7.683 -4.729 1.00 0.91 C ATOM 1316 CD GLU A 82 5.663 8.929 -3.853 1.00 1.52 C ATOM 1317 OE1 GLU A 82 6.435 8.960 -2.868 1.00 2.38 O ATOM 1318 OE2 GLU A 82 4.866 9.852 -4.135 1.00 2.63 O ATOM 0 H GLU A 82 5.151 5.299 -3.418 1.00 0.44 H new ATOM 0 HA GLU A 82 5.952 5.503 -6.119 1.00 0.49 H new ATOM 0 HB2 GLU A 82 6.945 6.551 -3.444 1.00 0.55 H new ATOM 0 HB3 GLU A 82 7.663 7.023 -4.971 1.00 0.55 H new ATOM 0 HG2 GLU A 82 5.616 7.994 -5.774 1.00 0.91 H new ATOM 0 HG3 GLU A 82 4.653 7.182 -4.555 1.00 0.91 H new ATOM 1325 N LEU A 83 7.867 3.483 -4.403 1.00 0.58 N ATOM 1326 CA LEU A 83 8.916 2.492 -4.634 1.00 0.72 C ATOM 1327 C LEU A 83 8.553 1.572 -5.802 1.00 0.83 C ATOM 1328 O LEU A 83 9.424 1.185 -6.581 1.00 0.83 O ATOM 1329 CB LEU A 83 9.331 1.756 -3.345 1.00 0.88 C ATOM 1330 CG LEU A 83 8.729 0.362 -3.064 1.00 2.17 C ATOM 1331 CD1 LEU A 83 9.382 -0.769 -3.863 1.00 3.41 C ATOM 1332 CD2 LEU A 83 8.953 0.051 -1.582 1.00 2.70 C ATOM 0 H LEU A 83 7.463 3.467 -3.467 1.00 0.58 H new ATOM 0 HA LEU A 83 9.820 3.020 -4.939 1.00 0.72 H new ATOM 0 HB2 LEU A 83 10.416 1.652 -3.358 1.00 0.88 H new ATOM 0 HB3 LEU A 83 9.083 2.400 -2.501 1.00 0.88 H new ATOM 0 HG LEU A 83 7.679 0.405 -3.352 1.00 2.17 H new ATOM 0 HD11 LEU A 83 8.904 -1.716 -3.610 1.00 3.41 H new ATOM 0 HD12 LEU A 83 9.264 -0.576 -4.929 1.00 3.41 H new ATOM 0 HD13 LEU A 83 10.443 -0.821 -3.619 1.00 3.41 H new ATOM 0 HD21 LEU A 83 8.538 -0.930 -1.349 1.00 2.70 H new ATOM 0 HD22 LEU A 83 10.022 0.053 -1.367 1.00 2.70 H new ATOM 0 HD23 LEU A 83 8.459 0.808 -0.973 1.00 2.70 H new ATOM 1344 N ALA A 84 7.266 1.232 -5.950 1.00 0.96 N ATOM 1345 CA ALA A 84 6.831 0.394 -7.059 1.00 1.08 C ATOM 1346 C ALA A 84 7.015 1.074 -8.430 1.00 1.12 C ATOM 1347 O ALA A 84 7.101 0.371 -9.435 1.00 1.33 O ATOM 1348 CB ALA A 84 5.398 -0.095 -6.821 1.00 1.04 C ATOM 0 H ALA A 84 6.520 1.524 -5.319 1.00 0.96 H new ATOM 0 HA ALA A 84 7.480 -0.481 -7.093 1.00 1.08 H new ATOM 0 HB1 ALA A 84 5.084 -0.720 -7.656 1.00 1.04 H new ATOM 0 HB2 ALA A 84 5.360 -0.675 -5.899 1.00 1.04 H new ATOM 0 HB3 ALA A 84 4.730 0.762 -6.738 1.00 1.04 H new ATOM 1354 N LYS A 85 7.116 2.413 -8.505 1.00 1.03 N ATOM 1355 CA LYS A 85 7.583 3.067 -9.732 1.00 1.12 C ATOM 1356 C LYS A 85 9.082 2.833 -9.902 1.00 0.97 C ATOM 1357 O LYS A 85 9.540 2.494 -10.987 1.00 1.09 O ATOM 1358 CB LYS A 85 7.332 4.583 -9.710 1.00 1.41 C ATOM 1359 CG LYS A 85 5.891 5.023 -10.000 1.00 1.17 C ATOM 1360 CD LYS A 85 5.832 6.546 -9.788 1.00 1.66 C ATOM 1361 CE LYS A 85 4.665 7.252 -10.495 1.00 2.55 C ATOM 1362 NZ LYS A 85 5.115 8.073 -11.634 1.00 3.47 N ATOM 0 H LYS A 85 6.884 3.050 -7.743 1.00 1.03 H new ATOM 0 HA LYS A 85 7.023 2.633 -10.560 1.00 1.12 H new ATOM 0 HB2 LYS A 85 7.619 4.966 -8.731 1.00 1.41 H new ATOM 0 HB3 LYS A 85 7.990 5.052 -10.441 1.00 1.41 H new ATOM 0 HG2 LYS A 85 5.607 4.765 -11.020 1.00 1.17 H new ATOM 0 HG3 LYS A 85 5.192 4.514 -9.336 1.00 1.17 H new ATOM 0 HD2 LYS A 85 5.765 6.747 -8.719 1.00 1.66 H new ATOM 0 HD3 LYS A 85 6.767 6.983 -10.137 1.00 1.66 H new ATOM 0 HE2 LYS A 85 3.952 6.507 -10.847 1.00 2.55 H new ATOM 0 HE3 LYS A 85 4.139 7.884 -9.780 1.00 2.55 H new ATOM 0 HZ1 LYS A 85 4.293 8.529 -12.079 1.00 3.47 H new ATOM 0 HZ2 LYS A 85 5.775 8.802 -11.297 1.00 3.47 H new ATOM 0 HZ3 LYS A 85 5.594 7.467 -12.331 1.00 3.47 H new ATOM 1376 N GLU A 86 9.834 3.085 -8.832 1.00 0.80 N ATOM 1377 CA GLU A 86 11.289 3.027 -8.783 1.00 0.76 C ATOM 1378 C GLU A 86 11.810 1.636 -9.191 1.00 0.78 C ATOM 1379 O GLU A 86 12.310 1.460 -10.303 1.00 0.87 O ATOM 1380 CB GLU A 86 11.706 3.450 -7.367 1.00 0.70 C ATOM 1381 CG GLU A 86 11.420 4.943 -7.152 1.00 0.89 C ATOM 1382 CD GLU A 86 11.246 5.283 -5.680 1.00 1.13 C ATOM 1383 OE1 GLU A 86 11.984 4.728 -4.839 1.00 1.96 O ATOM 1384 OE2 GLU A 86 10.387 6.130 -5.353 1.00 1.95 O ATOM 0 H GLU A 86 9.424 3.347 -7.936 1.00 0.80 H new ATOM 0 HA GLU A 86 11.739 3.708 -9.505 1.00 0.76 H new ATOM 0 HB2 GLU A 86 11.164 2.859 -6.629 1.00 0.70 H new ATOM 0 HB3 GLU A 86 12.767 3.251 -7.218 1.00 0.70 H new ATOM 0 HG2 GLU A 86 12.238 5.532 -7.566 1.00 0.89 H new ATOM 0 HG3 GLU A 86 10.519 5.222 -7.698 1.00 0.89 H new ATOM 1391 N ILE A 87 11.716 0.647 -8.302 1.00 0.77 N ATOM 1392 CA ILE A 87 12.177 -0.706 -8.570 1.00 0.83 C ATOM 1393 C ILE A 87 11.083 -1.455 -9.330 1.00 0.80 C ATOM 1394 O ILE A 87 10.162 -2.031 -8.749 1.00 0.80 O ATOM 1395 CB ILE A 87 12.687 -1.423 -7.306 1.00 0.92 C ATOM 1396 CG1 ILE A 87 13.121 -2.875 -7.589 1.00 1.17 C ATOM 1397 CG2 ILE A 87 11.704 -1.404 -6.131 1.00 1.18 C ATOM 1398 CD1 ILE A 87 14.267 -2.966 -8.603 1.00 1.39 C ATOM 0 H ILE A 87 11.315 0.768 -7.372 1.00 0.77 H new ATOM 0 HA ILE A 87 13.060 -0.674 -9.209 1.00 0.83 H new ATOM 0 HB ILE A 87 13.557 -0.839 -7.007 1.00 0.92 H new ATOM 0 HG12 ILE A 87 13.430 -3.345 -6.656 1.00 1.17 H new ATOM 0 HG13 ILE A 87 12.266 -3.439 -7.962 1.00 1.17 H new ATOM 0 HG21 ILE A 87 12.141 -1.930 -5.282 1.00 1.18 H new ATOM 0 HG22 ILE A 87 11.494 -0.372 -5.849 1.00 1.18 H new ATOM 0 HG23 ILE A 87 10.777 -1.896 -6.424 1.00 1.18 H new ATOM 0 HD11 ILE A 87 14.530 -4.012 -8.762 1.00 1.39 H new ATOM 0 HD12 ILE A 87 13.953 -2.523 -9.548 1.00 1.39 H new ATOM 0 HD13 ILE A 87 15.135 -2.428 -8.221 1.00 1.39 H new ATOM 1410 N ARG A 88 11.202 -1.478 -10.658 1.00 0.88 N ATOM 1411 CA ARG A 88 10.199 -2.046 -11.552 1.00 0.94 C ATOM 1412 C ARG A 88 10.372 -3.567 -11.603 1.00 0.92 C ATOM 1413 O ARG A 88 10.711 -4.129 -12.643 1.00 1.21 O ATOM 1414 CB ARG A 88 10.352 -1.403 -12.943 1.00 1.17 C ATOM 1415 CG ARG A 88 10.089 0.110 -12.882 1.00 1.99 C ATOM 1416 CD ARG A 88 10.484 0.845 -14.166 1.00 2.24 C ATOM 1417 NE ARG A 88 9.693 0.405 -15.326 1.00 2.43 N ATOM 1418 CZ ARG A 88 9.819 0.908 -16.565 1.00 2.95 C ATOM 1419 NH1 ARG A 88 10.711 1.877 -16.801 1.00 3.14 N ATOM 1420 NH2 ARG A 88 9.060 0.438 -17.562 1.00 4.02 N ATOM 0 H ARG A 88 12.011 -1.096 -11.148 1.00 0.88 H new ATOM 0 HA ARG A 88 9.192 -1.838 -11.190 1.00 0.94 H new ATOM 0 HB2 ARG A 88 11.357 -1.586 -13.324 1.00 1.17 H new ATOM 0 HB3 ARG A 88 9.657 -1.869 -13.641 1.00 1.17 H new ATOM 0 HG2 ARG A 88 9.031 0.280 -12.685 1.00 1.99 H new ATOM 0 HG3 ARG A 88 10.642 0.534 -12.044 1.00 1.99 H new ATOM 0 HD2 ARG A 88 10.351 1.917 -14.024 1.00 2.24 H new ATOM 0 HD3 ARG A 88 11.542 0.679 -14.366 1.00 2.24 H new ATOM 0 HE ARG A 88 9.003 -0.331 -15.179 1.00 2.43 H new ATOM 0 HH11 ARG A 88 11.292 2.231 -16.041 1.00 3.14 H new ATOM 0 HH12 ARG A 88 10.810 2.262 -17.741 1.00 3.14 H new ATOM 0 HH21 ARG A 88 8.384 -0.304 -17.382 1.00 4.02 H new ATOM 0 HH22 ARG A 88 9.158 0.822 -18.502 1.00 4.02 H new ATOM 1434 N LYS A 89 10.145 -4.229 -10.464 1.00 0.96 N ATOM 1435 CA LYS A 89 10.199 -5.680 -10.353 1.00 0.98 C ATOM 1436 C LYS A 89 9.211 -6.322 -11.339 1.00 1.28 C ATOM 1437 O LYS A 89 8.080 -5.862 -11.471 1.00 1.97 O ATOM 1438 CB LYS A 89 10.001 -6.117 -8.888 1.00 1.57 C ATOM 1439 CG LYS A 89 8.629 -5.771 -8.273 1.00 0.92 C ATOM 1440 CD LYS A 89 8.688 -4.885 -7.012 1.00 1.57 C ATOM 1441 CE LYS A 89 9.191 -5.704 -5.815 1.00 2.40 C ATOM 1442 NZ LYS A 89 9.289 -4.961 -4.540 1.00 3.07 N ATOM 0 H LYS A 89 9.916 -3.762 -9.586 1.00 0.96 H new ATOM 0 HA LYS A 89 11.188 -6.041 -10.637 1.00 0.98 H new ATOM 0 HB2 LYS A 89 10.146 -7.195 -8.826 1.00 1.57 H new ATOM 0 HB3 LYS A 89 10.779 -5.655 -8.281 1.00 1.57 H new ATOM 0 HG2 LYS A 89 8.026 -5.265 -9.027 1.00 0.92 H new ATOM 0 HG3 LYS A 89 8.114 -6.699 -8.024 1.00 0.92 H new ATOM 0 HD2 LYS A 89 9.349 -4.036 -7.185 1.00 1.57 H new ATOM 0 HD3 LYS A 89 7.699 -4.480 -6.796 1.00 1.57 H new ATOM 0 HE2 LYS A 89 8.524 -6.554 -5.671 1.00 2.40 H new ATOM 0 HE3 LYS A 89 10.174 -6.107 -6.058 1.00 2.40 H new ATOM 0 HZ1 LYS A 89 10.215 -5.143 -4.103 1.00 3.07 H new ATOM 0 HZ2 LYS A 89 9.186 -3.942 -4.723 1.00 3.07 H new ATOM 0 HZ3 LYS A 89 8.535 -5.275 -3.896 1.00 3.07 H new ATOM 1456 N LYS A 90 9.652 -7.355 -12.068 1.00 1.55 N ATOM 1457 CA LYS A 90 8.885 -7.951 -13.158 1.00 2.09 C ATOM 1458 C LYS A 90 7.529 -8.472 -12.667 1.00 2.50 C ATOM 1459 O LYS A 90 6.497 -8.151 -13.251 1.00 3.38 O ATOM 1460 CB LYS A 90 9.701 -9.082 -13.805 1.00 2.87 C ATOM 1461 CG LYS A 90 10.879 -8.577 -14.654 1.00 3.19 C ATOM 1462 CD LYS A 90 10.421 -8.127 -16.051 1.00 4.16 C ATOM 1463 CE LYS A 90 11.631 -7.744 -16.920 1.00 4.90 C ATOM 1464 NZ LYS A 90 11.242 -7.414 -18.308 1.00 5.94 N ATOM 0 H LYS A 90 10.557 -7.800 -11.914 1.00 1.55 H new ATOM 0 HA LYS A 90 8.687 -7.181 -13.904 1.00 2.09 H new ATOM 0 HB2 LYS A 90 10.082 -9.738 -13.023 1.00 2.87 H new ATOM 0 HB3 LYS A 90 9.042 -9.682 -14.432 1.00 2.87 H new ATOM 0 HG2 LYS A 90 11.364 -7.745 -14.144 1.00 3.19 H new ATOM 0 HG3 LYS A 90 11.623 -9.368 -14.752 1.00 3.19 H new ATOM 0 HD2 LYS A 90 9.860 -8.929 -16.532 1.00 4.16 H new ATOM 0 HD3 LYS A 90 9.746 -7.276 -15.962 1.00 4.16 H new ATOM 0 HE2 LYS A 90 12.140 -6.889 -16.474 1.00 4.90 H new ATOM 0 HE3 LYS A 90 12.344 -8.569 -16.931 1.00 4.90 H new ATOM 0 HZ1 LYS A 90 12.090 -7.162 -18.856 1.00 5.94 H new ATOM 0 HZ2 LYS A 90 10.780 -8.237 -18.744 1.00 5.94 H new ATOM 0 HZ3 LYS A 90 10.582 -6.610 -18.302 1.00 5.94 H new ATOM 1478 N LYS A 91 7.562 -9.295 -11.614 1.00 2.55 N ATOM 1479 CA LYS A 91 6.402 -9.837 -10.905 1.00 3.52 C ATOM 1480 C LYS A 91 6.875 -10.735 -9.760 1.00 3.28 C ATOM 1481 O LYS A 91 6.372 -10.640 -8.643 1.00 3.87 O ATOM 1482 CB LYS A 91 5.414 -10.579 -11.829 1.00 4.58 C ATOM 1483 CG LYS A 91 6.022 -11.705 -12.682 1.00 4.21 C ATOM 1484 CD LYS A 91 4.915 -12.357 -13.524 1.00 5.32 C ATOM 1485 CE LYS A 91 5.451 -13.559 -14.315 1.00 5.13 C ATOM 1486 NZ LYS A 91 4.382 -14.240 -15.076 1.00 6.20 N ATOM 0 H LYS A 91 8.444 -9.616 -11.214 1.00 2.55 H new ATOM 0 HA LYS A 91 5.844 -8.993 -10.500 1.00 3.52 H new ATOM 0 HB2 LYS A 91 4.618 -11.001 -11.216 1.00 4.58 H new ATOM 0 HB3 LYS A 91 4.951 -9.851 -12.496 1.00 4.58 H new ATOM 0 HG2 LYS A 91 6.801 -11.305 -13.331 1.00 4.21 H new ATOM 0 HG3 LYS A 91 6.493 -12.449 -12.040 1.00 4.21 H new ATOM 0 HD2 LYS A 91 4.103 -12.680 -12.873 1.00 5.32 H new ATOM 0 HD3 LYS A 91 4.498 -11.622 -14.213 1.00 5.32 H new ATOM 0 HE2 LYS A 91 6.228 -13.224 -15.002 1.00 5.13 H new ATOM 0 HE3 LYS A 91 5.915 -14.267 -13.629 1.00 5.13 H new ATOM 0 HZ1 LYS A 91 4.785 -15.045 -15.596 1.00 6.20 H new ATOM 0 HZ2 LYS A 91 3.652 -14.582 -14.419 1.00 6.20 H new ATOM 0 HZ3 LYS A 91 3.956 -13.572 -15.749 1.00 6.20 H new ATOM 1500 N ASP A 92 7.870 -11.580 -10.043 1.00 2.72 N ATOM 1501 CA ASP A 92 8.539 -12.423 -9.079 1.00 2.68 C ATOM 1502 C ASP A 92 9.805 -11.666 -8.743 1.00 1.81 C ATOM 1503 O ASP A 92 10.758 -11.643 -9.520 1.00 2.05 O ATOM 1504 CB ASP A 92 8.864 -13.802 -9.664 1.00 3.20 C ATOM 1505 CG ASP A 92 9.697 -14.655 -8.705 1.00 4.62 C ATOM 1506 OD1 ASP A 92 10.124 -14.132 -7.648 1.00 5.69 O ATOM 1507 OD2 ASP A 92 9.899 -15.834 -9.056 1.00 5.51 O ATOM 0 H ASP A 92 8.237 -11.691 -10.988 1.00 2.72 H new ATOM 0 HA ASP A 92 7.919 -12.618 -8.204 1.00 2.68 H new ATOM 0 HB2 ASP A 92 7.936 -14.323 -9.898 1.00 3.20 H new ATOM 0 HB3 ASP A 92 9.406 -13.678 -10.602 1.00 3.20 H new ATOM 1512 N LEU A 93 9.752 -10.978 -7.614 1.00 1.64 N ATOM 1513 CA LEU A 93 10.930 -10.438 -6.977 1.00 1.28 C ATOM 1514 C LEU A 93 11.686 -11.500 -6.164 1.00 1.19 C ATOM 1515 O LEU A 93 12.888 -11.357 -5.971 1.00 1.32 O ATOM 1516 CB LEU A 93 10.637 -9.148 -6.193 1.00 1.99 C ATOM 1517 CG LEU A 93 9.461 -9.095 -5.202 1.00 1.87 C ATOM 1518 CD1 LEU A 93 8.077 -9.154 -5.867 1.00 2.24 C ATOM 1519 CD2 LEU A 93 9.578 -10.114 -4.072 1.00 3.32 C ATOM 0 H LEU A 93 8.884 -10.781 -7.116 1.00 1.64 H new ATOM 0 HA LEU A 93 11.613 -10.137 -7.771 1.00 1.28 H new ATOM 0 HB2 LEU A 93 11.540 -8.896 -5.637 1.00 1.99 H new ATOM 0 HB3 LEU A 93 10.480 -8.354 -6.923 1.00 1.99 H new ATOM 0 HG LEU A 93 9.541 -8.105 -4.752 1.00 1.87 H new ATOM 0 HD11 LEU A 93 7.303 -9.112 -5.101 1.00 2.24 H new ATOM 0 HD12 LEU A 93 7.963 -8.308 -6.545 1.00 2.24 H new ATOM 0 HD13 LEU A 93 7.982 -10.084 -6.428 1.00 2.24 H new ATOM 0 HD21 LEU A 93 8.717 -10.023 -3.410 1.00 3.32 H new ATOM 0 HD22 LEU A 93 9.609 -11.120 -4.491 1.00 3.32 H new ATOM 0 HD23 LEU A 93 10.492 -9.928 -3.507 1.00 3.32 H new ATOM 1531 N LYS A 94 11.038 -12.574 -5.694 1.00 1.27 N ATOM 1532 CA LYS A 94 11.663 -13.478 -4.727 1.00 1.38 C ATOM 1533 C LYS A 94 12.781 -14.288 -5.374 1.00 1.43 C ATOM 1534 O LYS A 94 13.724 -14.680 -4.694 1.00 1.69 O ATOM 1535 CB LYS A 94 10.639 -14.383 -4.024 1.00 1.61 C ATOM 1536 CG LYS A 94 9.560 -13.535 -3.346 1.00 1.66 C ATOM 1537 CD LYS A 94 8.816 -14.247 -2.209 1.00 2.06 C ATOM 1538 CE LYS A 94 7.674 -13.322 -1.764 1.00 2.38 C ATOM 1539 NZ LYS A 94 6.924 -13.803 -0.589 1.00 3.18 N ATOM 0 H LYS A 94 10.090 -12.834 -5.966 1.00 1.27 H new ATOM 0 HA LYS A 94 12.108 -12.856 -3.951 1.00 1.38 H new ATOM 0 HB2 LYS A 94 10.181 -15.056 -4.748 1.00 1.61 H new ATOM 0 HB3 LYS A 94 11.141 -15.005 -3.283 1.00 1.61 H new ATOM 0 HG2 LYS A 94 10.021 -12.630 -2.951 1.00 1.66 H new ATOM 0 HG3 LYS A 94 8.836 -13.222 -4.098 1.00 1.66 H new ATOM 0 HD2 LYS A 94 8.424 -15.206 -2.547 1.00 2.06 H new ATOM 0 HD3 LYS A 94 9.490 -14.453 -1.378 1.00 2.06 H new ATOM 0 HE2 LYS A 94 8.086 -12.338 -1.539 1.00 2.38 H new ATOM 0 HE3 LYS A 94 6.981 -13.195 -2.595 1.00 2.38 H new ATOM 0 HZ1 LYS A 94 5.925 -13.527 -0.678 1.00 3.18 H new ATOM 0 HZ2 LYS A 94 6.993 -14.839 -0.534 1.00 3.18 H new ATOM 0 HZ3 LYS A 94 7.324 -13.383 0.274 1.00 3.18 H new ATOM 1553 N ILE A 95 12.727 -14.488 -6.693 1.00 1.34 N ATOM 1554 CA ILE A 95 13.866 -14.994 -7.446 1.00 1.56 C ATOM 1555 C ILE A 95 15.174 -14.242 -7.136 1.00 1.66 C ATOM 1556 O ILE A 95 16.257 -14.802 -7.287 1.00 1.94 O ATOM 1557 CB ILE A 95 13.511 -14.949 -8.940 1.00 1.55 C ATOM 1558 CG1 ILE A 95 14.480 -15.802 -9.770 1.00 2.58 C ATOM 1559 CG2 ILE A 95 13.447 -13.505 -9.461 1.00 2.15 C ATOM 1560 CD1 ILE A 95 13.912 -16.028 -11.170 1.00 2.57 C ATOM 0 H ILE A 95 11.899 -14.305 -7.260 1.00 1.34 H new ATOM 0 HA ILE A 95 14.061 -16.023 -7.144 1.00 1.56 H new ATOM 0 HB ILE A 95 12.516 -15.379 -9.052 1.00 1.55 H new ATOM 0 HG12 ILE A 95 15.448 -15.305 -9.837 1.00 2.58 H new ATOM 0 HG13 ILE A 95 14.647 -16.760 -9.278 1.00 2.58 H new ATOM 0 HG21 ILE A 95 13.194 -13.512 -10.521 1.00 2.15 H new ATOM 0 HG22 ILE A 95 12.686 -12.953 -8.909 1.00 2.15 H new ATOM 0 HG23 ILE A 95 14.416 -13.025 -9.323 1.00 2.15 H new ATOM 0 HD11 ILE A 95 14.607 -16.634 -11.751 1.00 2.57 H new ATOM 0 HD12 ILE A 95 12.955 -16.544 -11.095 1.00 2.57 H new ATOM 0 HD13 ILE A 95 13.768 -15.067 -11.664 1.00 2.57 H new ATOM 1572 N ARG A 96 15.081 -12.971 -6.727 1.00 1.51 N ATOM 1573 CA ARG A 96 16.160 -12.086 -6.309 1.00 1.78 C ATOM 1574 C ARG A 96 17.063 -11.642 -7.457 1.00 2.10 C ATOM 1575 O ARG A 96 17.313 -10.445 -7.613 1.00 2.80 O ATOM 1576 CB ARG A 96 16.978 -12.627 -5.128 1.00 2.22 C ATOM 1577 CG ARG A 96 18.045 -11.621 -4.643 1.00 2.96 C ATOM 1578 CD ARG A 96 17.473 -10.243 -4.257 1.00 3.83 C ATOM 1579 NE ARG A 96 18.495 -9.216 -4.025 1.00 4.73 N ATOM 1580 CZ ARG A 96 19.149 -8.535 -4.980 1.00 5.71 C ATOM 1581 NH1 ARG A 96 19.018 -8.853 -6.273 1.00 6.13 N ATOM 1582 NH2 ARG A 96 19.918 -7.504 -4.625 1.00 6.79 N ATOM 0 H ARG A 96 14.176 -12.504 -6.678 1.00 1.51 H new ATOM 0 HA ARG A 96 15.648 -11.193 -5.949 1.00 1.78 H new ATOM 0 HB2 ARG A 96 16.307 -12.866 -4.303 1.00 2.22 H new ATOM 0 HB3 ARG A 96 17.466 -13.556 -5.422 1.00 2.22 H new ATOM 0 HG2 ARG A 96 18.563 -12.043 -3.782 1.00 2.96 H new ATOM 0 HG3 ARG A 96 18.789 -11.488 -5.429 1.00 2.96 H new ATOM 0 HD2 ARG A 96 16.805 -9.904 -5.049 1.00 3.83 H new ATOM 0 HD3 ARG A 96 16.870 -10.351 -3.355 1.00 3.83 H new ATOM 0 HE ARG A 96 18.729 -9.001 -3.056 1.00 4.73 H new ATOM 0 HH11 ARG A 96 18.412 -9.626 -6.549 1.00 6.13 H new ATOM 0 HH12 ARG A 96 19.524 -8.323 -6.982 1.00 6.13 H new ATOM 0 HH21 ARG A 96 20.002 -7.245 -3.642 1.00 6.79 H new ATOM 0 HH22 ARG A 96 20.422 -6.975 -5.337 1.00 6.79 H new ATOM 1681 N GLU B 4 14.051 -14.543 -0.404 1.00 2.31 N ATOM 1682 CA GLU B 4 15.156 -13.631 -0.685 1.00 2.15 C ATOM 1683 C GLU B 4 15.433 -12.940 0.663 1.00 2.15 C ATOM 1684 O GLU B 4 14.719 -13.227 1.624 1.00 2.54 O ATOM 1685 CB GLU B 4 14.887 -12.696 -1.885 1.00 2.07 C ATOM 1686 CG GLU B 4 14.013 -11.455 -1.645 1.00 2.21 C ATOM 1687 CD GLU B 4 14.484 -10.248 -2.457 1.00 2.91 C ATOM 1688 OE1 GLU B 4 14.369 -10.284 -3.701 1.00 3.17 O ATOM 1689 OE2 GLU B 4 15.043 -9.325 -1.829 1.00 4.01 O ATOM 0 HA GLU B 4 16.053 -14.144 -1.033 1.00 2.15 H new ATOM 0 HB2 GLU B 4 15.850 -12.358 -2.269 1.00 2.07 H new ATOM 0 HB3 GLU B 4 14.420 -13.288 -2.672 1.00 2.07 H new ATOM 0 HG2 GLU B 4 12.980 -11.685 -1.906 1.00 2.21 H new ATOM 0 HG3 GLU B 4 14.026 -11.204 -0.584 1.00 2.21 H new ATOM 1696 N PRO B 5 16.424 -12.055 0.831 1.00 2.30 N ATOM 1697 CA PRO B 5 16.664 -11.442 2.133 1.00 2.56 C ATOM 1698 C PRO B 5 15.618 -10.359 2.492 1.00 2.31 C ATOM 1699 O PRO B 5 15.964 -9.351 3.103 1.00 2.45 O ATOM 1700 CB PRO B 5 18.114 -10.938 2.072 1.00 3.18 C ATOM 1701 CG PRO B 5 18.512 -10.929 0.589 1.00 3.19 C ATOM 1702 CD PRO B 5 17.353 -11.573 -0.173 1.00 2.61 C ATOM 0 HA PRO B 5 16.543 -12.152 2.951 1.00 2.56 H new ATOM 0 HB2 PRO B 5 18.196 -9.939 2.501 1.00 3.18 H new ATOM 0 HB3 PRO B 5 18.775 -11.587 2.647 1.00 3.18 H new ATOM 0 HG2 PRO B 5 18.688 -9.911 0.240 1.00 3.19 H new ATOM 0 HG3 PRO B 5 19.437 -11.484 0.432 1.00 3.19 H new ATOM 0 HD2 PRO B 5 16.872 -10.851 -0.833 1.00 2.61 H new ATOM 0 HD3 PRO B 5 17.707 -12.391 -0.800 1.00 2.61 H new ATOM 1710 N LEU B 6 14.337 -10.566 2.152 1.00 2.11 N ATOM 1711 CA LEU B 6 13.255 -9.600 2.333 1.00 2.02 C ATOM 1712 C LEU B 6 12.483 -9.817 3.638 1.00 1.76 C ATOM 1713 O LEU B 6 12.794 -10.728 4.414 1.00 2.17 O ATOM 1714 CB LEU B 6 12.345 -9.543 1.094 1.00 2.05 C ATOM 1715 CG LEU B 6 11.256 -10.628 0.984 1.00 1.87 C ATOM 1716 CD1 LEU B 6 10.592 -10.605 -0.401 1.00 2.42 C ATOM 1717 CD2 LEU B 6 11.739 -12.057 1.247 1.00 3.13 C ATOM 0 H LEU B 6 14.021 -11.439 1.731 1.00 2.11 H new ATOM 0 HA LEU B 6 13.712 -8.615 2.432 1.00 2.02 H new ATOM 0 HB2 LEU B 6 11.857 -8.568 1.075 1.00 2.05 H new ATOM 0 HB3 LEU B 6 12.975 -9.602 0.206 1.00 2.05 H new ATOM 0 HG LEU B 6 10.549 -10.371 1.773 1.00 1.87 H new ATOM 0 HD11 LEU B 6 9.828 -11.381 -0.451 1.00 2.42 H new ATOM 0 HD12 LEU B 6 10.132 -9.631 -0.568 1.00 2.42 H new ATOM 0 HD13 LEU B 6 11.344 -10.787 -1.168 1.00 2.42 H new ATOM 0 HD21 LEU B 6 10.902 -12.748 1.147 1.00 3.13 H new ATOM 0 HD22 LEU B 6 12.514 -12.318 0.526 1.00 3.13 H new ATOM 0 HD23 LEU B 6 12.146 -12.124 2.256 1.00 3.13 H new ATOM 1729 N THR B 7 11.511 -8.945 3.929 1.00 1.32 N ATOM 1730 CA THR B 7 10.719 -8.972 5.156 1.00 1.16 C ATOM 1731 C THR B 7 9.299 -8.435 4.903 1.00 1.10 C ATOM 1732 O THR B 7 9.044 -7.859 3.848 1.00 1.24 O ATOM 1733 CB THR B 7 11.514 -8.247 6.257 1.00 1.24 C ATOM 1734 OG1 THR B 7 12.564 -9.096 6.671 1.00 1.79 O ATOM 1735 CG2 THR B 7 10.714 -7.866 7.505 1.00 1.12 C ATOM 0 H THR B 7 11.250 -8.185 3.301 1.00 1.32 H new ATOM 0 HA THR B 7 10.554 -9.990 5.507 1.00 1.16 H new ATOM 0 HB THR B 7 11.850 -7.311 5.810 1.00 1.24 H new ATOM 0 HG1 THR B 7 12.697 -9.801 6.004 1.00 1.79 H new ATOM 0 HG21 THR B 7 11.368 -7.361 8.216 1.00 1.12 H new ATOM 0 HG22 THR B 7 9.899 -7.199 7.225 1.00 1.12 H new ATOM 0 HG23 THR B 7 10.305 -8.766 7.964 1.00 1.12 H new ATOM 1743 N GLU B 8 8.382 -8.663 5.861 1.00 1.03 N ATOM 1744 CA GLU B 8 6.921 -8.562 5.765 1.00 1.03 C ATOM 1745 C GLU B 8 6.379 -7.380 4.945 1.00 0.97 C ATOM 1746 O GLU B 8 5.366 -7.501 4.257 1.00 1.11 O ATOM 1747 CB GLU B 8 6.301 -8.639 7.172 1.00 1.12 C ATOM 1748 CG GLU B 8 4.855 -9.155 7.110 1.00 2.06 C ATOM 1749 CD GLU B 8 4.302 -9.460 8.493 1.00 3.07 C ATOM 1750 OE1 GLU B 8 4.004 -8.476 9.204 1.00 4.04 O ATOM 1751 OE2 GLU B 8 4.208 -10.660 8.828 1.00 3.72 O ATOM 0 H GLU B 8 8.671 -8.946 6.797 1.00 1.03 H new ATOM 0 HA GLU B 8 6.603 -9.422 5.175 1.00 1.03 H new ATOM 0 HB2 GLU B 8 6.899 -9.298 7.801 1.00 1.12 H new ATOM 0 HB3 GLU B 8 6.319 -7.653 7.636 1.00 1.12 H new ATOM 0 HG2 GLU B 8 4.225 -8.411 6.623 1.00 2.06 H new ATOM 0 HG3 GLU B 8 4.817 -10.056 6.497 1.00 2.06 H new ATOM 1758 N LEU B 9 7.065 -6.237 4.979 1.00 0.90 N ATOM 1759 CA LEU B 9 6.699 -5.074 4.185 1.00 0.99 C ATOM 1760 C LEU B 9 6.642 -5.484 2.703 1.00 1.11 C ATOM 1761 O LEU B 9 5.641 -5.289 2.016 1.00 1.33 O ATOM 1762 CB LEU B 9 7.725 -3.948 4.418 1.00 1.03 C ATOM 1763 CG LEU B 9 7.883 -3.411 5.860 1.00 0.99 C ATOM 1764 CD1 LEU B 9 6.622 -2.722 6.380 1.00 1.76 C ATOM 1765 CD2 LEU B 9 8.384 -4.430 6.894 1.00 1.88 C ATOM 0 H LEU B 9 7.891 -6.096 5.561 1.00 0.90 H new ATOM 0 HA LEU B 9 5.719 -4.701 4.481 1.00 0.99 H new ATOM 0 HB2 LEU B 9 8.699 -4.306 4.084 1.00 1.03 H new ATOM 0 HB3 LEU B 9 7.456 -3.110 3.775 1.00 1.03 H new ATOM 0 HG LEU B 9 8.677 -2.672 5.753 1.00 0.99 H new ATOM 0 HD11 LEU B 9 6.794 -2.367 7.396 1.00 1.76 H new ATOM 0 HD12 LEU B 9 6.377 -1.877 5.736 1.00 1.76 H new ATOM 0 HD13 LEU B 9 5.794 -3.430 6.379 1.00 1.76 H new ATOM 0 HD21 LEU B 9 8.459 -3.951 7.870 1.00 1.88 H new ATOM 0 HD22 LEU B 9 7.684 -5.264 6.952 1.00 1.88 H new ATOM 0 HD23 LEU B 9 9.365 -4.800 6.595 1.00 1.88 H new ATOM 1777 N GLU B 10 7.714 -6.114 2.227 1.00 1.06 N ATOM 1778 CA GLU B 10 7.887 -6.599 0.865 1.00 1.14 C ATOM 1779 C GLU B 10 7.110 -7.903 0.640 1.00 1.34 C ATOM 1780 O GLU B 10 6.685 -8.184 -0.482 1.00 1.76 O ATOM 1781 CB GLU B 10 9.393 -6.719 0.644 1.00 1.04 C ATOM 1782 CG GLU B 10 9.888 -7.240 -0.710 1.00 1.26 C ATOM 1783 CD GLU B 10 9.650 -6.406 -1.971 1.00 1.77 C ATOM 1784 OE1 GLU B 10 8.511 -5.982 -2.266 1.00 2.91 O ATOM 1785 OE2 GLU B 10 10.631 -6.198 -2.721 1.00 2.52 O ATOM 0 H GLU B 10 8.526 -6.309 2.814 1.00 1.06 H new ATOM 0 HA GLU B 10 7.472 -5.915 0.125 1.00 1.14 H new ATOM 0 HB2 GLU B 10 9.832 -5.734 0.802 1.00 1.04 H new ATOM 0 HB3 GLU B 10 9.792 -7.374 1.419 1.00 1.04 H new ATOM 0 HG2 GLU B 10 10.962 -7.403 -0.624 1.00 1.26 H new ATOM 0 HG3 GLU B 10 9.429 -8.215 -0.872 1.00 1.26 H new ATOM 1792 N GLU B 11 6.841 -8.676 1.701 1.00 1.23 N ATOM 1793 CA GLU B 11 5.847 -9.743 1.588 1.00 1.40 C ATOM 1794 C GLU B 11 4.457 -9.149 1.283 1.00 1.38 C ATOM 1795 O GLU B 11 3.661 -9.750 0.565 1.00 1.59 O ATOM 1796 CB GLU B 11 5.784 -10.627 2.841 1.00 1.48 C ATOM 1797 CG GLU B 11 7.146 -11.063 3.409 1.00 2.89 C ATOM 1798 CD GLU B 11 7.941 -12.039 2.567 1.00 3.35 C ATOM 1799 OE1 GLU B 11 7.361 -12.722 1.697 1.00 3.48 O ATOM 1800 OE2 GLU B 11 9.150 -12.133 2.851 1.00 4.67 O ATOM 0 H GLU B 11 7.282 -8.586 2.616 1.00 1.23 H new ATOM 0 HA GLU B 11 6.159 -10.382 0.762 1.00 1.40 H new ATOM 0 HB2 GLU B 11 5.241 -10.089 3.618 1.00 1.48 H new ATOM 0 HB3 GLU B 11 5.204 -11.520 2.607 1.00 1.48 H new ATOM 0 HG2 GLU B 11 7.753 -10.171 3.565 1.00 2.89 H new ATOM 0 HG3 GLU B 11 6.981 -11.511 4.389 1.00 2.89 H new ATOM 1807 N SER B 12 4.145 -7.956 1.802 1.00 1.23 N ATOM 1808 CA SER B 12 2.893 -7.292 1.457 1.00 1.25 C ATOM 1809 C SER B 12 3.022 -6.779 0.022 1.00 1.27 C ATOM 1810 O SER B 12 2.151 -6.972 -0.823 1.00 1.42 O ATOM 1811 CB SER B 12 2.582 -6.167 2.451 1.00 1.27 C ATOM 1812 OG SER B 12 2.721 -6.625 3.782 1.00 2.04 O ATOM 0 H SER B 12 4.736 -7.440 2.453 1.00 1.23 H new ATOM 0 HA SER B 12 2.056 -7.987 1.517 1.00 1.25 H new ATOM 0 HB2 SER B 12 3.254 -5.326 2.278 1.00 1.27 H new ATOM 0 HB3 SER B 12 1.567 -5.803 2.290 1.00 1.27 H new ATOM 0 HG SER B 12 3.668 -6.791 3.974 1.00 2.04 H new ATOM 1818 N ILE B 13 4.177 -6.186 -0.263 1.00 1.25 N ATOM 1819 CA ILE B 13 4.601 -5.825 -1.599 1.00 1.51 C ATOM 1820 C ILE B 13 4.291 -6.734 -2.785 1.00 1.33 C ATOM 1821 O ILE B 13 3.415 -6.431 -3.592 1.00 1.25 O ATOM 1822 CB ILE B 13 5.438 -4.553 -1.789 1.00 0.94 C ATOM 1823 CG1 ILE B 13 5.097 -3.448 -0.782 1.00 1.08 C ATOM 1824 CG2 ILE B 13 5.428 -4.022 -3.225 1.00 0.98 C ATOM 1825 CD1 ILE B 13 6.406 -2.922 -0.198 1.00 0.96 C ATOM 0 H ILE B 13 4.859 -5.939 0.454 1.00 1.25 H new ATOM 0 HA ILE B 13 3.647 -5.514 -2.025 1.00 1.51 H new ATOM 0 HB ILE B 13 6.461 -4.868 -1.581 1.00 0.94 H new ATOM 0 HG12 ILE B 13 4.547 -2.644 -1.271 1.00 1.08 H new ATOM 0 HG13 ILE B 13 4.456 -3.838 0.009 1.00 1.08 H new ATOM 0 HG21 ILE B 13 6.040 -3.122 -3.284 1.00 0.98 H new ATOM 0 HG22 ILE B 13 5.832 -4.780 -3.896 1.00 0.98 H new ATOM 0 HG23 ILE B 13 4.405 -3.785 -3.518 1.00 0.98 H new ATOM 0 HD11 ILE B 13 6.192 -2.133 0.523 1.00 0.96 H new ATOM 0 HD12 ILE B 13 6.935 -3.735 0.300 1.00 0.96 H new ATOM 0 HD13 ILE B 13 7.027 -2.522 -0.999 1.00 0.96 H new ATOM 1837 N GLU B 14 4.898 -7.919 -2.821 1.00 1.33 N ATOM 1838 CA GLU B 14 4.641 -8.929 -3.825 1.00 1.26 C ATOM 1839 C GLU B 14 3.150 -9.271 -3.901 1.00 1.16 C ATOM 1840 O GLU B 14 2.643 -9.567 -4.982 1.00 1.26 O ATOM 1841 CB GLU B 14 5.535 -10.133 -3.529 1.00 1.49 C ATOM 1842 CG GLU B 14 5.336 -10.657 -2.103 1.00 1.80 C ATOM 1843 CD GLU B 14 4.428 -11.875 -2.044 1.00 2.92 C ATOM 1844 OE1 GLU B 14 3.613 -12.035 -2.971 1.00 3.50 O ATOM 1845 OE2 GLU B 14 4.654 -12.699 -1.133 1.00 3.95 O ATOM 0 H GLU B 14 5.597 -8.202 -2.134 1.00 1.33 H new ATOM 0 HA GLU B 14 4.891 -8.558 -4.819 1.00 1.26 H new ATOM 0 HB2 GLU B 14 5.319 -10.929 -4.242 1.00 1.49 H new ATOM 0 HB3 GLU B 14 6.579 -9.853 -3.670 1.00 1.49 H new ATOM 0 HG2 GLU B 14 6.306 -10.912 -1.676 1.00 1.80 H new ATOM 0 HG3 GLU B 14 4.914 -9.864 -1.485 1.00 1.80 H new ATOM 1852 N THR B 15 2.431 -9.124 -2.783 1.00 0.98 N ATOM 1853 CA THR B 15 1.010 -9.427 -2.734 1.00 0.97 C ATOM 1854 C THR B 15 0.269 -8.354 -3.524 1.00 0.92 C ATOM 1855 O THR B 15 -0.497 -8.680 -4.428 1.00 0.91 O ATOM 1856 CB THR B 15 0.477 -9.585 -1.300 1.00 1.03 C ATOM 1857 OG1 THR B 15 1.259 -10.507 -0.569 1.00 1.14 O ATOM 1858 CG2 THR B 15 -0.953 -10.131 -1.336 1.00 1.16 C ATOM 0 H THR B 15 2.819 -8.795 -1.899 1.00 0.98 H new ATOM 0 HA THR B 15 0.836 -10.401 -3.192 1.00 0.97 H new ATOM 0 HB THR B 15 0.514 -8.604 -0.826 1.00 1.03 H new ATOM 0 HG1 THR B 15 2.071 -10.063 -0.246 1.00 1.14 H new ATOM 0 HG21 THR B 15 -1.326 -10.241 -0.318 1.00 1.16 H new ATOM 0 HG22 THR B 15 -1.593 -9.439 -1.884 1.00 1.16 H new ATOM 0 HG23 THR B 15 -0.959 -11.102 -1.832 1.00 1.16 H new ATOM 1866 N VAL B 16 0.514 -7.071 -3.242 1.00 0.93 N ATOM 1867 CA VAL B 16 -0.096 -6.020 -4.032 1.00 0.92 C ATOM 1868 C VAL B 16 0.275 -6.187 -5.515 1.00 0.96 C ATOM 1869 O VAL B 16 -0.607 -6.247 -6.376 1.00 0.94 O ATOM 1870 CB VAL B 16 0.189 -4.620 -3.448 1.00 0.90 C ATOM 1871 CG1 VAL B 16 1.622 -4.271 -3.069 1.00 2.62 C ATOM 1872 CG2 VAL B 16 -0.291 -3.584 -4.454 1.00 0.91 C ATOM 0 H VAL B 16 1.119 -6.748 -2.487 1.00 0.93 H new ATOM 0 HA VAL B 16 -1.181 -6.114 -3.980 1.00 0.92 H new ATOM 0 HB VAL B 16 -0.342 -4.624 -2.496 1.00 0.90 H new ATOM 0 HG11 VAL B 16 1.657 -3.255 -2.675 1.00 2.62 H new ATOM 0 HG12 VAL B 16 1.977 -4.967 -2.310 1.00 2.62 H new ATOM 0 HG13 VAL B 16 2.259 -4.340 -3.951 1.00 2.62 H new ATOM 0 HG21 VAL B 16 -0.101 -2.584 -4.065 1.00 0.91 H new ATOM 0 HG22 VAL B 16 0.244 -3.715 -5.395 1.00 0.91 H new ATOM 0 HG23 VAL B 16 -1.360 -3.710 -4.624 1.00 0.91 H new ATOM 1882 N VAL B 17 1.572 -6.269 -5.830 1.00 1.06 N ATOM 1883 CA VAL B 17 1.999 -6.333 -7.227 1.00 1.14 C ATOM 1884 C VAL B 17 1.383 -7.541 -7.954 1.00 1.01 C ATOM 1885 O VAL B 17 0.915 -7.402 -9.083 1.00 0.99 O ATOM 1886 CB VAL B 17 3.524 -6.170 -7.432 1.00 1.24 C ATOM 1887 CG1 VAL B 17 4.203 -5.333 -6.343 1.00 1.64 C ATOM 1888 CG2 VAL B 17 4.307 -7.479 -7.541 1.00 3.59 C ATOM 0 H VAL B 17 2.331 -6.292 -5.148 1.00 1.06 H new ATOM 0 HA VAL B 17 1.591 -5.448 -7.715 1.00 1.14 H new ATOM 0 HB VAL B 17 3.562 -5.654 -8.391 1.00 1.24 H new ATOM 0 HG11 VAL B 17 5.270 -5.261 -6.552 1.00 1.64 H new ATOM 0 HG12 VAL B 17 3.768 -4.334 -6.328 1.00 1.64 H new ATOM 0 HG13 VAL B 17 4.054 -5.808 -5.373 1.00 1.64 H new ATOM 0 HG21 VAL B 17 5.365 -7.259 -7.683 1.00 3.59 H new ATOM 0 HG22 VAL B 17 4.176 -8.058 -6.627 1.00 3.59 H new ATOM 0 HG23 VAL B 17 3.939 -8.054 -8.391 1.00 3.59 H new ATOM 1898 N THR B 18 1.340 -8.718 -7.315 1.00 0.99 N ATOM 1899 CA THR B 18 0.741 -9.895 -7.934 1.00 0.99 C ATOM 1900 C THR B 18 -0.783 -9.753 -8.024 1.00 0.98 C ATOM 1901 O THR B 18 -1.372 -10.190 -9.011 1.00 1.02 O ATOM 1902 CB THR B 18 1.198 -11.200 -7.255 1.00 1.23 C ATOM 1903 OG1 THR B 18 1.143 -12.257 -8.191 1.00 1.71 O ATOM 1904 CG2 THR B 18 0.347 -11.587 -6.044 1.00 1.30 C ATOM 0 H THR B 18 1.711 -8.874 -6.378 1.00 0.99 H new ATOM 0 HA THR B 18 1.105 -9.962 -8.959 1.00 0.99 H new ATOM 0 HB THR B 18 2.214 -11.025 -6.900 1.00 1.23 H new ATOM 0 HG1 THR B 18 1.435 -13.089 -7.763 1.00 1.71 H new ATOM 0 HG21 THR B 18 0.725 -12.515 -5.615 1.00 1.30 H new ATOM 0 HG22 THR B 18 0.397 -10.795 -5.296 1.00 1.30 H new ATOM 0 HG23 THR B 18 -0.688 -11.727 -6.356 1.00 1.30 H new ATOM 1912 N THR B 19 -1.433 -9.121 -7.038 1.00 0.95 N ATOM 1913 CA THR B 19 -2.871 -8.863 -7.084 1.00 0.92 C ATOM 1914 C THR B 19 -3.217 -8.045 -8.333 1.00 0.96 C ATOM 1915 O THR B 19 -4.178 -8.361 -9.030 1.00 1.02 O ATOM 1916 CB THR B 19 -3.330 -8.190 -5.781 1.00 0.96 C ATOM 1917 OG1 THR B 19 -3.154 -9.083 -4.704 1.00 1.06 O ATOM 1918 CG2 THR B 19 -4.806 -7.781 -5.793 1.00 1.02 C ATOM 0 H THR B 19 -0.977 -8.778 -6.193 1.00 0.95 H new ATOM 0 HA THR B 19 -3.415 -9.805 -7.160 1.00 0.92 H new ATOM 0 HB THR B 19 -2.725 -7.289 -5.678 1.00 0.96 H new ATOM 0 HG1 THR B 19 -2.209 -9.102 -4.446 1.00 1.06 H new ATOM 0 HG21 THR B 19 -5.061 -7.312 -4.843 1.00 1.02 H new ATOM 0 HG22 THR B 19 -4.981 -7.075 -6.605 1.00 1.02 H new ATOM 0 HG23 THR B 19 -5.427 -8.664 -5.940 1.00 1.02 H new ATOM 1926 N PHE B 20 -2.412 -7.028 -8.664 1.00 1.00 N ATOM 1927 CA PHE B 20 -2.592 -6.300 -9.920 1.00 1.12 C ATOM 1928 C PHE B 20 -2.580 -7.211 -11.151 1.00 1.26 C ATOM 1929 O PHE B 20 -3.265 -6.918 -12.128 1.00 1.44 O ATOM 1930 CB PHE B 20 -1.549 -5.191 -10.073 1.00 1.19 C ATOM 1931 CG PHE B 20 -1.916 -3.921 -9.343 1.00 0.91 C ATOM 1932 CD1 PHE B 20 -2.958 -3.122 -9.849 1.00 1.21 C ATOM 1933 CD2 PHE B 20 -1.208 -3.510 -8.200 1.00 2.04 C ATOM 1934 CE1 PHE B 20 -3.230 -1.878 -9.265 1.00 1.32 C ATOM 1935 CE2 PHE B 20 -1.449 -2.241 -7.648 1.00 1.90 C ATOM 1936 CZ PHE B 20 -2.421 -1.407 -8.222 1.00 0.78 C ATOM 0 H PHE B 20 -1.640 -6.696 -8.086 1.00 1.00 H new ATOM 0 HA PHE B 20 -3.584 -5.851 -9.865 1.00 1.12 H new ATOM 0 HB2 PHE B 20 -0.589 -5.551 -9.702 1.00 1.19 H new ATOM 0 HB3 PHE B 20 -1.418 -4.968 -11.132 1.00 1.19 H new ATOM 0 HD1 PHE B 20 -3.547 -3.467 -10.686 1.00 1.21 H new ATOM 0 HD2 PHE B 20 -0.481 -4.168 -7.748 1.00 2.04 H new ATOM 0 HE1 PHE B 20 -4.060 -1.284 -9.617 1.00 1.32 H new ATOM 0 HE2 PHE B 20 -0.889 -1.909 -6.786 1.00 1.90 H new ATOM 0 HZ PHE B 20 -2.546 -0.398 -7.858 1.00 0.78 H new ATOM 1946 N PHE B 21 -1.798 -8.294 -11.129 1.00 1.23 N ATOM 1947 CA PHE B 21 -1.848 -9.293 -12.188 1.00 1.34 C ATOM 1948 C PHE B 21 -3.146 -10.091 -12.058 1.00 1.36 C ATOM 1949 O PHE B 21 -3.910 -10.227 -13.011 1.00 1.48 O ATOM 1950 CB PHE B 21 -0.615 -10.215 -12.132 1.00 1.45 C ATOM 1951 CG PHE B 21 0.176 -10.271 -13.426 1.00 2.10 C ATOM 1952 CD1 PHE B 21 -0.438 -10.741 -14.604 1.00 2.56 C ATOM 1953 CD2 PHE B 21 1.508 -9.817 -13.467 1.00 3.35 C ATOM 1954 CE1 PHE B 21 0.269 -10.734 -15.819 1.00 3.53 C ATOM 1955 CE2 PHE B 21 2.219 -9.821 -14.681 1.00 4.14 C ATOM 1956 CZ PHE B 21 1.596 -10.271 -15.859 1.00 4.04 C ATOM 0 H PHE B 21 -1.126 -8.497 -10.389 1.00 1.23 H new ATOM 0 HA PHE B 21 -1.832 -8.796 -13.158 1.00 1.34 H new ATOM 0 HB2 PHE B 21 0.042 -9.876 -11.331 1.00 1.45 H new ATOM 0 HB3 PHE B 21 -0.940 -11.223 -11.873 1.00 1.45 H new ATOM 0 HD1 PHE B 21 -1.454 -11.107 -14.573 1.00 2.56 H new ATOM 0 HD2 PHE B 21 1.985 -9.465 -12.564 1.00 3.35 H new ATOM 0 HE1 PHE B 21 -0.208 -11.085 -16.723 1.00 3.53 H new ATOM 0 HE2 PHE B 21 3.243 -9.479 -14.708 1.00 4.14 H new ATOM 0 HZ PHE B 21 2.137 -10.261 -16.794 1.00 4.04 H new ATOM 1966 N THR B 22 -3.396 -10.614 -10.862 1.00 1.43 N ATOM 1967 CA THR B 22 -4.458 -11.567 -10.590 1.00 1.69 C ATOM 1968 C THR B 22 -5.757 -10.795 -10.352 1.00 1.58 C ATOM 1969 O THR B 22 -6.444 -10.994 -9.353 1.00 1.79 O ATOM 1970 CB THR B 22 -4.035 -12.386 -9.353 1.00 2.10 C ATOM 1971 OG1 THR B 22 -2.654 -12.701 -9.431 1.00 3.19 O ATOM 1972 CG2 THR B 22 -4.816 -13.698 -9.233 1.00 2.41 C ATOM 0 H THR B 22 -2.848 -10.378 -10.035 1.00 1.43 H new ATOM 0 HA THR B 22 -4.627 -12.249 -11.424 1.00 1.69 H new ATOM 0 HB THR B 22 -4.248 -11.771 -8.479 1.00 2.10 H new ATOM 0 HG1 THR B 22 -2.125 -11.928 -9.143 1.00 3.19 H new ATOM 0 HG21 THR B 22 -4.483 -14.240 -8.348 1.00 2.41 H new ATOM 0 HG22 THR B 22 -5.881 -13.481 -9.147 1.00 2.41 H new ATOM 0 HG23 THR B 22 -4.640 -14.308 -10.119 1.00 2.41 H new ATOM 2097 N LYS B 30 -2.748 -4.239 -16.402 1.00 1.87 N ATOM 2098 CA LYS B 30 -2.907 -2.939 -17.066 1.00 1.88 C ATOM 2099 C LYS B 30 -2.435 -1.777 -16.176 1.00 1.91 C ATOM 2100 O LYS B 30 -2.950 -0.665 -16.257 1.00 3.58 O ATOM 2101 CB LYS B 30 -4.363 -2.764 -17.534 1.00 2.46 C ATOM 2102 CG LYS B 30 -4.677 -3.505 -18.844 1.00 3.25 C ATOM 2103 CD LYS B 30 -4.677 -5.037 -18.768 1.00 4.86 C ATOM 2104 CE LYS B 30 -5.713 -5.533 -17.750 1.00 6.21 C ATOM 2105 NZ LYS B 30 -6.379 -6.775 -18.194 1.00 8.10 N ATOM 0 HA LYS B 30 -2.264 -2.920 -17.946 1.00 1.88 H new ATOM 0 HB2 LYS B 30 -5.033 -3.123 -16.753 1.00 2.46 H new ATOM 0 HB3 LYS B 30 -4.569 -1.702 -17.668 1.00 2.46 H new ATOM 0 HG2 LYS B 30 -5.655 -3.179 -19.197 1.00 3.25 H new ATOM 0 HG3 LYS B 30 -3.949 -3.198 -19.595 1.00 3.25 H new ATOM 0 HD2 LYS B 30 -4.898 -5.454 -19.751 1.00 4.86 H new ATOM 0 HD3 LYS B 30 -3.685 -5.391 -18.486 1.00 4.86 H new ATOM 0 HE2 LYS B 30 -5.224 -5.707 -16.792 1.00 6.21 H new ATOM 0 HE3 LYS B 30 -6.462 -4.758 -17.589 1.00 6.21 H new ATOM 0 HZ1 LYS B 30 -7.070 -7.074 -17.477 1.00 8.10 H new ATOM 0 HZ2 LYS B 30 -6.868 -6.603 -19.096 1.00 8.10 H new ATOM 0 HZ3 LYS B 30 -5.668 -7.523 -18.323 1.00 8.10 H new ATOM 2119 N ASP B 31 -1.420 -2.036 -15.346 1.00 1.33 N ATOM 2120 CA ASP B 31 -0.777 -1.105 -14.436 1.00 1.18 C ATOM 2121 C ASP B 31 -1.691 -0.744 -13.262 1.00 1.42 C ATOM 2122 O ASP B 31 -1.354 -1.017 -12.115 1.00 2.12 O ATOM 2123 CB ASP B 31 -0.201 0.103 -15.190 1.00 1.28 C ATOM 2124 CG ASP B 31 1.220 0.391 -14.759 1.00 2.03 C ATOM 2125 OD1 ASP B 31 2.104 -0.326 -15.291 1.00 2.61 O ATOM 2126 OD2 ASP B 31 1.395 1.275 -13.896 1.00 3.13 O ATOM 0 H ASP B 31 -1.004 -2.966 -15.295 1.00 1.33 H new ATOM 0 HA ASP B 31 0.083 -1.598 -13.982 1.00 1.18 H new ATOM 0 HB2 ASP B 31 -0.226 -0.089 -16.263 1.00 1.28 H new ATOM 0 HB3 ASP B 31 -0.824 0.979 -15.008 1.00 1.28 H new ATOM 2131 N SER B 32 -2.875 -0.199 -13.542 1.00 1.09 N ATOM 2132 CA SER B 32 -3.992 -0.170 -12.609 1.00 1.11 C ATOM 2133 C SER B 32 -5.294 -0.032 -13.410 1.00 1.09 C ATOM 2134 O SER B 32 -5.378 -0.533 -14.528 1.00 1.13 O ATOM 2135 CB SER B 32 -3.774 0.926 -11.559 1.00 1.13 C ATOM 2136 OG SER B 32 -4.774 0.900 -10.558 1.00 1.70 O ATOM 0 H SER B 32 -3.084 0.240 -14.438 1.00 1.09 H new ATOM 0 HA SER B 32 -4.064 -1.099 -12.043 1.00 1.11 H new ATOM 0 HB2 SER B 32 -2.795 0.798 -11.098 1.00 1.13 H new ATOM 0 HB3 SER B 32 -3.772 1.901 -12.046 1.00 1.13 H new ATOM 0 HG SER B 32 -4.358 0.748 -9.684 1.00 1.70 H new ATOM 2142 N LEU B 33 -6.304 0.618 -12.827 1.00 1.11 N ATOM 2143 CA LEU B 33 -7.640 0.778 -13.387 1.00 1.12 C ATOM 2144 C LEU B 33 -7.892 2.245 -13.740 1.00 1.10 C ATOM 2145 O LEU B 33 -7.001 3.092 -13.640 1.00 1.20 O ATOM 2146 CB LEU B 33 -8.702 0.312 -12.369 1.00 1.12 C ATOM 2147 CG LEU B 33 -8.579 -1.107 -11.796 1.00 1.18 C ATOM 2148 CD1 LEU B 33 -8.415 -2.179 -12.878 1.00 1.71 C ATOM 2149 CD2 LEU B 33 -7.478 -1.192 -10.743 1.00 1.50 C ATOM 0 H LEU B 33 -6.205 1.064 -11.915 1.00 1.11 H new ATOM 0 HA LEU B 33 -7.711 0.171 -14.289 1.00 1.12 H new ATOM 0 HB2 LEU B 33 -8.692 1.011 -11.533 1.00 1.12 H new ATOM 0 HB3 LEU B 33 -9.679 0.396 -12.844 1.00 1.12 H new ATOM 0 HG LEU B 33 -9.527 -1.321 -11.303 1.00 1.18 H new ATOM 0 HD11 LEU B 33 -8.333 -3.160 -12.409 1.00 1.71 H new ATOM 0 HD12 LEU B 33 -9.281 -2.164 -13.539 1.00 1.71 H new ATOM 0 HD13 LEU B 33 -7.513 -1.977 -13.456 1.00 1.71 H new ATOM 0 HD21 LEU B 33 -7.419 -2.211 -10.359 1.00 1.50 H new ATOM 0 HD22 LEU B 33 -6.523 -0.918 -11.192 1.00 1.50 H new ATOM 0 HD23 LEU B 33 -7.704 -0.508 -9.925 1.00 1.50 H new ATOM 2161 N SER B 34 -9.138 2.553 -14.087 1.00 1.04 N ATOM 2162 CA SER B 34 -9.626 3.922 -14.128 1.00 0.98 C ATOM 2163 C SER B 34 -9.886 4.392 -12.696 1.00 0.92 C ATOM 2164 O SER B 34 -10.098 3.570 -11.802 1.00 0.89 O ATOM 2165 CB SER B 34 -10.897 4.020 -14.978 1.00 1.03 C ATOM 2166 OG SER B 34 -10.784 3.221 -16.137 1.00 1.45 O ATOM 0 H SER B 34 -9.837 1.857 -14.348 1.00 1.04 H new ATOM 0 HA SER B 34 -8.877 4.565 -14.590 1.00 0.98 H new ATOM 0 HB2 SER B 34 -11.758 3.700 -14.392 1.00 1.03 H new ATOM 0 HB3 SER B 34 -11.072 5.058 -15.261 1.00 1.03 H new ATOM 0 HG SER B 34 -10.939 2.282 -15.903 1.00 1.45 H new ATOM 2172 N VAL B 35 -9.891 5.706 -12.450 1.00 0.93 N ATOM 2173 CA VAL B 35 -10.121 6.207 -11.096 1.00 0.89 C ATOM 2174 C VAL B 35 -11.486 5.748 -10.558 1.00 0.73 C ATOM 2175 O VAL B 35 -11.574 5.261 -9.429 1.00 0.75 O ATOM 2176 CB VAL B 35 -10.014 7.736 -11.000 1.00 1.15 C ATOM 2177 CG1 VAL B 35 -9.665 8.139 -9.562 1.00 1.16 C ATOM 2178 CG2 VAL B 35 -8.975 8.379 -11.925 1.00 1.42 C ATOM 0 H VAL B 35 -9.742 6.427 -13.156 1.00 0.93 H new ATOM 0 HA VAL B 35 -9.328 5.782 -10.480 1.00 0.89 H new ATOM 0 HB VAL B 35 -10.990 8.102 -11.317 1.00 1.15 H new ATOM 0 HG11 VAL B 35 -9.590 9.224 -9.496 1.00 1.16 H new ATOM 0 HG12 VAL B 35 -10.445 7.788 -8.886 1.00 1.16 H new ATOM 0 HG13 VAL B 35 -8.712 7.691 -9.280 1.00 1.16 H new ATOM 0 HG21 VAL B 35 -8.978 9.459 -11.781 1.00 1.42 H new ATOM 0 HG22 VAL B 35 -7.986 7.985 -11.691 1.00 1.42 H new ATOM 0 HG23 VAL B 35 -9.221 8.151 -12.962 1.00 1.42 H new ATOM 2188 N ASN B 36 -12.548 5.929 -11.357 1.00 0.74 N ATOM 2189 CA ASN B 36 -13.905 5.554 -10.942 1.00 0.94 C ATOM 2190 C ASN B 36 -13.928 4.076 -10.530 1.00 0.94 C ATOM 2191 O ASN B 36 -14.216 3.766 -9.370 1.00 0.99 O ATOM 2192 CB ASN B 36 -14.985 5.841 -12.003 1.00 1.27 C ATOM 2193 CG ASN B 36 -14.674 5.291 -13.390 1.00 3.33 C ATOM 2194 OD1 ASN B 36 -15.074 4.185 -13.726 1.00 4.55 O ATOM 2195 ND2 ASN B 36 -13.934 6.033 -14.205 1.00 4.23 N ATOM 0 H ASN B 36 -12.492 6.332 -12.292 1.00 0.74 H new ATOM 0 HA ASN B 36 -14.158 6.186 -10.090 1.00 0.94 H new ATOM 0 HB2 ASN B 36 -15.931 5.419 -11.663 1.00 1.27 H new ATOM 0 HB3 ASN B 36 -15.125 6.919 -12.077 1.00 1.27 H new ATOM 0 HD21 ASN B 36 -13.689 5.683 -15.131 1.00 4.23 H new ATOM 0 HD22 ASN B 36 -13.611 6.953 -13.905 1.00 4.23 H new ATOM 2202 N GLU B 37 -13.565 3.189 -11.469 1.00 1.00 N ATOM 2203 CA GLU B 37 -13.401 1.760 -11.255 1.00 1.16 C ATOM 2204 C GLU B 37 -12.687 1.514 -9.933 1.00 1.05 C ATOM 2205 O GLU B 37 -13.224 0.848 -9.055 1.00 1.15 O ATOM 2206 CB GLU B 37 -12.559 1.140 -12.379 1.00 1.42 C ATOM 2207 CG GLU B 37 -13.228 1.100 -13.752 1.00 1.56 C ATOM 2208 CD GLU B 37 -12.289 0.433 -14.750 1.00 2.44 C ATOM 2209 OE1 GLU B 37 -11.151 0.943 -14.872 1.00 3.34 O ATOM 2210 OE2 GLU B 37 -12.701 -0.586 -15.340 1.00 3.08 O ATOM 0 H GLU B 37 -13.373 3.467 -12.431 1.00 1.00 H new ATOM 0 HA GLU B 37 -14.391 1.304 -11.243 1.00 1.16 H new ATOM 0 HB2 GLU B 37 -11.628 1.700 -12.463 1.00 1.42 H new ATOM 0 HB3 GLU B 37 -12.294 0.122 -12.093 1.00 1.42 H new ATOM 0 HG2 GLU B 37 -14.168 0.550 -13.696 1.00 1.56 H new ATOM 0 HG3 GLU B 37 -13.469 2.111 -14.081 1.00 1.56 H new ATOM 2217 N PHE B 38 -11.469 2.048 -9.806 1.00 0.93 N ATOM 2218 CA PHE B 38 -10.654 1.889 -8.615 1.00 0.92 C ATOM 2219 C PHE B 38 -11.461 2.173 -7.350 1.00 0.82 C ATOM 2220 O PHE B 38 -11.508 1.314 -6.470 1.00 0.85 O ATOM 2221 CB PHE B 38 -9.403 2.771 -8.702 1.00 0.92 C ATOM 2222 CG PHE B 38 -8.789 3.084 -7.354 1.00 1.13 C ATOM 2223 CD1 PHE B 38 -8.229 2.039 -6.601 1.00 1.64 C ATOM 2224 CD2 PHE B 38 -9.052 4.325 -6.743 1.00 2.24 C ATOM 2225 CE1 PHE B 38 -7.900 2.242 -5.252 1.00 1.79 C ATOM 2226 CE2 PHE B 38 -8.740 4.521 -5.389 1.00 2.53 C ATOM 2227 CZ PHE B 38 -8.145 3.489 -4.647 1.00 1.79 C ATOM 0 H PHE B 38 -11.025 2.605 -10.536 1.00 0.93 H new ATOM 0 HA PHE B 38 -10.328 0.851 -8.557 1.00 0.92 H new ATOM 0 HB2 PHE B 38 -8.659 2.273 -9.324 1.00 0.92 H new ATOM 0 HB3 PHE B 38 -9.661 3.705 -9.200 1.00 0.92 H new ATOM 0 HD1 PHE B 38 -8.051 1.078 -7.061 1.00 1.64 H new ATOM 0 HD2 PHE B 38 -9.494 5.126 -7.317 1.00 2.24 H new ATOM 0 HE1 PHE B 38 -7.459 1.441 -4.678 1.00 1.79 H new ATOM 0 HE2 PHE B 38 -8.958 5.468 -4.917 1.00 2.53 H new ATOM 0 HZ PHE B 38 -7.876 3.651 -3.614 1.00 1.79 H new ATOM 2237 N LYS B 39 -12.081 3.357 -7.249 1.00 0.76 N ATOM 2238 CA LYS B 39 -12.798 3.722 -6.033 1.00 0.77 C ATOM 2239 C LYS B 39 -13.821 2.633 -5.717 1.00 0.86 C ATOM 2240 O LYS B 39 -13.763 2.014 -4.653 1.00 1.04 O ATOM 2241 CB LYS B 39 -13.445 5.117 -6.135 1.00 0.86 C ATOM 2242 CG LYS B 39 -13.596 5.816 -4.771 1.00 1.28 C ATOM 2243 CD LYS B 39 -14.617 5.159 -3.822 1.00 2.58 C ATOM 2244 CE LYS B 39 -14.587 5.855 -2.455 1.00 3.76 C ATOM 2245 NZ LYS B 39 -15.421 5.185 -1.434 1.00 5.25 N ATOM 0 H LYS B 39 -12.098 4.063 -7.985 1.00 0.76 H new ATOM 0 HA LYS B 39 -12.088 3.791 -5.209 1.00 0.77 H new ATOM 0 HB2 LYS B 39 -12.842 5.743 -6.792 1.00 0.86 H new ATOM 0 HB3 LYS B 39 -14.427 5.022 -6.598 1.00 0.86 H new ATOM 0 HG2 LYS B 39 -12.624 5.837 -4.279 1.00 1.28 H new ATOM 0 HG3 LYS B 39 -13.891 6.852 -4.939 1.00 1.28 H new ATOM 0 HD2 LYS B 39 -15.617 5.223 -4.250 1.00 2.58 H new ATOM 0 HD3 LYS B 39 -14.388 4.100 -3.705 1.00 2.58 H new ATOM 0 HE2 LYS B 39 -13.557 5.898 -2.100 1.00 3.76 H new ATOM 0 HE3 LYS B 39 -14.927 6.884 -2.572 1.00 3.76 H new ATOM 0 HZ1 LYS B 39 -15.132 5.502 -0.487 1.00 5.25 H new ATOM 0 HZ2 LYS B 39 -16.421 5.426 -1.589 1.00 5.25 H new ATOM 0 HZ3 LYS B 39 -15.298 4.155 -1.507 1.00 5.25 H new ATOM 2259 N GLU B 40 -14.748 2.394 -6.645 1.00 0.87 N ATOM 2260 CA GLU B 40 -15.832 1.449 -6.433 1.00 0.95 C ATOM 2261 C GLU B 40 -15.285 0.068 -6.067 1.00 0.93 C ATOM 2262 O GLU B 40 -15.715 -0.532 -5.084 1.00 1.05 O ATOM 2263 CB GLU B 40 -16.730 1.416 -7.672 1.00 1.08 C ATOM 2264 CG GLU B 40 -17.393 2.784 -7.890 1.00 1.11 C ATOM 2265 CD GLU B 40 -18.357 2.765 -9.068 1.00 1.57 C ATOM 2266 OE1 GLU B 40 -19.160 1.809 -9.122 1.00 2.23 O ATOM 2267 OE2 GLU B 40 -18.278 3.711 -9.880 1.00 2.51 O ATOM 0 H GLU B 40 -14.765 2.849 -7.558 1.00 0.87 H new ATOM 0 HA GLU B 40 -16.441 1.772 -5.589 1.00 0.95 H new ATOM 0 HB2 GLU B 40 -16.141 1.147 -8.549 1.00 1.08 H new ATOM 0 HB3 GLU B 40 -17.495 0.649 -7.554 1.00 1.08 H new ATOM 0 HG2 GLU B 40 -17.929 3.076 -6.987 1.00 1.11 H new ATOM 0 HG3 GLU B 40 -16.624 3.537 -8.062 1.00 1.11 H new ATOM 2274 N LEU B 41 -14.307 -0.422 -6.828 1.00 0.84 N ATOM 2275 CA LEU B 41 -13.661 -1.703 -6.588 1.00 0.84 C ATOM 2276 C LEU B 41 -13.058 -1.769 -5.186 1.00 0.80 C ATOM 2277 O LEU B 41 -13.247 -2.777 -4.506 1.00 0.92 O ATOM 2278 CB LEU B 41 -12.591 -1.979 -7.655 1.00 0.87 C ATOM 2279 CG LEU B 41 -13.188 -2.296 -9.037 1.00 1.19 C ATOM 2280 CD1 LEU B 41 -12.105 -2.142 -10.111 1.00 2.67 C ATOM 2281 CD2 LEU B 41 -13.743 -3.726 -9.100 1.00 2.12 C ATOM 0 H LEU B 41 -13.938 0.072 -7.641 1.00 0.84 H new ATOM 0 HA LEU B 41 -14.424 -2.478 -6.657 1.00 0.84 H new ATOM 0 HB2 LEU B 41 -11.937 -1.111 -7.738 1.00 0.87 H new ATOM 0 HB3 LEU B 41 -11.971 -2.816 -7.332 1.00 0.87 H new ATOM 0 HG LEU B 41 -14.007 -1.598 -9.212 1.00 1.19 H new ATOM 0 HD11 LEU B 41 -12.529 -2.367 -11.090 1.00 2.67 H new ATOM 0 HD12 LEU B 41 -11.729 -1.119 -10.105 1.00 2.67 H new ATOM 0 HD13 LEU B 41 -11.286 -2.831 -9.903 1.00 2.67 H new ATOM 0 HD21 LEU B 41 -14.156 -3.913 -10.091 1.00 2.12 H new ATOM 0 HD22 LEU B 41 -12.941 -4.437 -8.901 1.00 2.12 H new ATOM 0 HD23 LEU B 41 -14.527 -3.845 -8.352 1.00 2.12 H new ATOM 2293 N VAL B 42 -12.337 -0.741 -4.728 1.00 0.72 N ATOM 2294 CA VAL B 42 -11.681 -0.839 -3.428 1.00 0.73 C ATOM 2295 C VAL B 42 -12.767 -0.815 -2.350 1.00 0.82 C ATOM 2296 O VAL B 42 -12.864 -1.736 -1.542 1.00 0.78 O ATOM 2297 CB VAL B 42 -10.521 0.168 -3.238 1.00 0.76 C ATOM 2298 CG1 VAL B 42 -10.927 1.641 -3.132 1.00 2.10 C ATOM 2299 CG2 VAL B 42 -9.736 -0.185 -1.975 1.00 2.47 C ATOM 0 H VAL B 42 -12.197 0.140 -5.222 1.00 0.72 H new ATOM 0 HA VAL B 42 -11.151 -1.788 -3.346 1.00 0.73 H new ATOM 0 HB VAL B 42 -9.930 0.073 -4.149 1.00 0.76 H new ATOM 0 HG11 VAL B 42 -10.036 2.255 -3.001 1.00 2.10 H new ATOM 0 HG12 VAL B 42 -11.445 1.942 -4.043 1.00 2.10 H new ATOM 0 HG13 VAL B 42 -11.589 1.775 -2.277 1.00 2.10 H new ATOM 0 HG21 VAL B 42 -8.920 0.525 -1.843 1.00 2.47 H new ATOM 0 HG22 VAL B 42 -10.398 -0.141 -1.111 1.00 2.47 H new ATOM 0 HG23 VAL B 42 -9.329 -1.192 -2.069 1.00 2.47 H new ATOM 2309 N THR B 43 -13.644 0.188 -2.394 1.00 1.02 N ATOM 2310 CA THR B 43 -14.817 0.270 -1.533 1.00 1.07 C ATOM 2311 C THR B 43 -15.516 -1.099 -1.427 1.00 1.11 C ATOM 2312 O THR B 43 -15.792 -1.570 -0.329 1.00 1.24 O ATOM 2313 CB THR B 43 -15.725 1.428 -2.011 1.00 1.20 C ATOM 2314 OG1 THR B 43 -15.648 2.526 -1.120 1.00 1.95 O ATOM 2315 CG2 THR B 43 -17.185 1.052 -2.258 1.00 1.40 C ATOM 0 H THR B 43 -13.556 0.974 -3.038 1.00 1.02 H new ATOM 0 HA THR B 43 -14.527 0.512 -0.510 1.00 1.07 H new ATOM 0 HB THR B 43 -15.329 1.704 -2.988 1.00 1.20 H new ATOM 0 HG1 THR B 43 -16.540 2.916 -1.003 1.00 1.95 H new ATOM 0 HG21 THR B 43 -17.736 1.932 -2.589 1.00 1.40 H new ATOM 0 HG22 THR B 43 -17.237 0.281 -3.026 1.00 1.40 H new ATOM 0 HG23 THR B 43 -17.625 0.675 -1.335 1.00 1.40 H new ATOM 2323 N GLN B 44 -15.768 -1.753 -2.566 1.00 1.07 N ATOM 2324 CA GLN B 44 -16.414 -3.056 -2.615 1.00 1.12 C ATOM 2325 C GLN B 44 -15.552 -4.122 -1.933 1.00 1.03 C ATOM 2326 O GLN B 44 -16.046 -4.868 -1.090 1.00 1.09 O ATOM 2327 CB GLN B 44 -16.716 -3.396 -4.080 1.00 1.20 C ATOM 2328 CG GLN B 44 -17.605 -4.639 -4.213 1.00 2.12 C ATOM 2329 CD GLN B 44 -17.849 -5.058 -5.664 1.00 2.60 C ATOM 2330 OE1 GLN B 44 -17.672 -4.155 -6.626 1.00 3.70 O flip ATOM 2331 NE2 GLN B 44 -18.209 -6.201 -5.925 1.00 2.79 N flip ATOM 0 H GLN B 44 -15.524 -1.384 -3.485 1.00 1.07 H new ATOM 0 HA GLN B 44 -17.354 -3.030 -2.063 1.00 1.12 H new ATOM 0 HB2 GLN B 44 -17.208 -2.547 -4.555 1.00 1.20 H new ATOM 0 HB3 GLN B 44 -15.780 -3.562 -4.614 1.00 1.20 H new ATOM 0 HG2 GLN B 44 -17.142 -5.467 -3.676 1.00 2.12 H new ATOM 0 HG3 GLN B 44 -18.564 -4.444 -3.733 1.00 2.12 H new ATOM 0 HE21 GLN B 44 -18.339 -6.879 -5.174 1.00 2.79 H new ATOM 0 HE22 GLN B 44 -18.378 -6.474 -6.893 1.00 2.79 H new ATOM 2340 N GLN B 45 -14.271 -4.208 -2.302 1.00 0.92 N ATOM 2341 CA GLN B 45 -13.354 -5.202 -1.760 1.00 0.86 C ATOM 2342 C GLN B 45 -13.200 -5.080 -0.243 1.00 0.79 C ATOM 2343 O GLN B 45 -12.899 -6.082 0.400 1.00 0.80 O ATOM 2344 CB GLN B 45 -11.969 -5.111 -2.422 1.00 0.89 C ATOM 2345 CG GLN B 45 -11.742 -6.143 -3.536 1.00 0.76 C ATOM 2346 CD GLN B 45 -12.569 -5.848 -4.784 1.00 0.98 C ATOM 2347 OE1 GLN B 45 -13.774 -6.077 -4.808 1.00 2.07 O ATOM 2348 NE2 GLN B 45 -11.931 -5.363 -5.848 1.00 2.30 N ATOM 0 H GLN B 45 -13.844 -3.586 -2.988 1.00 0.92 H new ATOM 0 HA GLN B 45 -13.794 -6.174 -1.984 1.00 0.86 H new ATOM 0 HB2 GLN B 45 -11.840 -4.111 -2.835 1.00 0.89 H new ATOM 0 HB3 GLN B 45 -11.203 -5.242 -1.658 1.00 0.89 H new ATOM 0 HG2 GLN B 45 -10.685 -6.160 -3.801 1.00 0.76 H new ATOM 0 HG3 GLN B 45 -11.994 -7.136 -3.164 1.00 0.76 H new ATOM 0 HE21 GLN B 45 -10.928 -5.181 -5.802 1.00 2.30 H new ATOM 0 HE22 GLN B 45 -12.445 -5.173 -6.708 1.00 2.30 H new ATOM 2357 N LEU B 46 -13.330 -3.881 0.333 1.00 0.82 N ATOM 2358 CA LEU B 46 -13.048 -3.679 1.751 1.00 0.87 C ATOM 2359 C LEU B 46 -14.335 -3.503 2.584 1.00 1.00 C ATOM 2360 O LEU B 46 -14.543 -2.422 3.139 1.00 1.21 O ATOM 2361 CB LEU B 46 -12.080 -2.495 1.918 1.00 1.02 C ATOM 2362 CG LEU B 46 -10.890 -2.405 0.942 1.00 1.08 C ATOM 2363 CD1 LEU B 46 -10.108 -1.134 1.272 1.00 1.74 C ATOM 2364 CD2 LEU B 46 -9.934 -3.592 0.924 1.00 2.69 C ATOM 0 H LEU B 46 -13.628 -3.040 -0.162 1.00 0.82 H new ATOM 0 HA LEU B 46 -12.568 -4.577 2.140 1.00 0.87 H new ATOM 0 HB2 LEU B 46 -12.657 -1.574 1.831 1.00 1.02 H new ATOM 0 HB3 LEU B 46 -11.682 -2.527 2.932 1.00 1.02 H new ATOM 0 HG LEU B 46 -11.328 -2.398 -0.056 1.00 1.08 H new ATOM 0 HD11 LEU B 46 -9.258 -1.044 0.596 1.00 1.74 H new ATOM 0 HD12 LEU B 46 -10.758 -0.267 1.156 1.00 1.74 H new ATOM 0 HD13 LEU B 46 -9.750 -1.184 2.300 1.00 1.74 H new ATOM 0 HD21 LEU B 46 -9.141 -3.409 0.199 1.00 2.69 H new ATOM 0 HD22 LEU B 46 -9.497 -3.723 1.914 1.00 2.69 H new ATOM 0 HD23 LEU B 46 -10.479 -4.494 0.646 1.00 2.69 H new ATOM 2376 N PRO B 47 -15.184 -4.539 2.750 1.00 0.96 N ATOM 2377 CA PRO B 47 -16.549 -4.412 3.261 1.00 0.98 C ATOM 2378 C PRO B 47 -16.659 -3.936 4.715 1.00 1.04 C ATOM 2379 O PRO B 47 -17.768 -3.646 5.167 1.00 1.34 O ATOM 2380 CB PRO B 47 -17.188 -5.795 3.093 1.00 1.09 C ATOM 2381 CG PRO B 47 -15.988 -6.733 3.167 1.00 1.07 C ATOM 2382 CD PRO B 47 -14.937 -5.930 2.411 1.00 0.91 C ATOM 0 HA PRO B 47 -17.060 -3.631 2.698 1.00 0.98 H new ATOM 0 HB2 PRO B 47 -17.913 -6.004 3.879 1.00 1.09 H new ATOM 0 HB3 PRO B 47 -17.714 -5.885 2.142 1.00 1.09 H new ATOM 0 HG2 PRO B 47 -15.689 -6.938 4.195 1.00 1.07 H new ATOM 0 HG3 PRO B 47 -16.188 -7.695 2.696 1.00 1.07 H new ATOM 0 HD2 PRO B 47 -13.931 -6.231 2.702 1.00 0.91 H new ATOM 0 HD3 PRO B 47 -15.020 -6.091 1.336 1.00 0.91 H new ATOM 2390 N HIS B 48 -15.550 -3.854 5.455 1.00 1.08 N ATOM 2391 CA HIS B 48 -15.520 -3.326 6.811 1.00 1.16 C ATOM 2392 C HIS B 48 -15.929 -1.844 6.860 1.00 1.61 C ATOM 2393 O HIS B 48 -15.093 -0.955 6.990 1.00 3.41 O ATOM 2394 CB HIS B 48 -14.141 -3.560 7.431 1.00 1.33 C ATOM 2395 CG HIS B 48 -12.973 -2.830 6.813 1.00 1.91 C ATOM 2396 ND1 HIS B 48 -12.885 -2.287 5.547 1.00 3.54 N ATOM 2397 CD2 HIS B 48 -11.846 -2.470 7.495 1.00 2.68 C ATOM 2398 CE1 HIS B 48 -11.709 -1.636 5.478 1.00 4.74 C ATOM 2399 NE2 HIS B 48 -11.035 -1.721 6.638 1.00 4.14 N ATOM 0 H HIS B 48 -14.637 -4.159 5.119 1.00 1.08 H new ATOM 0 HA HIS B 48 -16.259 -3.864 7.405 1.00 1.16 H new ATOM 0 HB2 HIS B 48 -14.193 -3.284 8.484 1.00 1.33 H new ATOM 0 HB3 HIS B 48 -13.930 -4.629 7.392 1.00 1.33 H new ATOM 0 HD1 HIS B 48 -13.580 -2.364 4.804 1.00 3.54 H new ATOM 0 HD2 HIS B 48 -11.620 -2.721 8.521 1.00 2.68 H new ATOM 0 HE1 HIS B 48 -11.353 -1.113 4.603 1.00 4.74 H new ATOM 2407 N LEU B 49 -17.225 -1.549 6.746 1.00 1.09 N ATOM 2408 CA LEU B 49 -17.822 -0.234 6.968 1.00 1.17 C ATOM 2409 C LEU B 49 -17.567 0.769 5.829 1.00 1.25 C ATOM 2410 O LEU B 49 -18.473 1.535 5.515 1.00 1.60 O ATOM 2411 CB LEU B 49 -17.420 0.317 8.349 1.00 1.18 C ATOM 2412 CG LEU B 49 -18.318 1.457 8.857 1.00 1.68 C ATOM 2413 CD1 LEU B 49 -19.728 0.976 9.220 1.00 2.07 C ATOM 2414 CD2 LEU B 49 -17.675 2.082 10.101 1.00 2.78 C ATOM 0 H LEU B 49 -17.916 -2.252 6.485 1.00 1.09 H new ATOM 0 HA LEU B 49 -18.903 -0.376 6.962 1.00 1.17 H new ATOM 0 HB2 LEU B 49 -17.441 -0.497 9.073 1.00 1.18 H new ATOM 0 HB3 LEU B 49 -16.391 0.674 8.300 1.00 1.18 H new ATOM 0 HG LEU B 49 -18.412 2.185 8.051 1.00 1.68 H new ATOM 0 HD11 LEU B 49 -20.321 1.820 9.573 1.00 2.07 H new ATOM 0 HD12 LEU B 49 -20.202 0.542 8.340 1.00 2.07 H new ATOM 0 HD13 LEU B 49 -19.665 0.223 10.006 1.00 2.07 H new ATOM 0 HD21 LEU B 49 -18.305 2.892 10.468 1.00 2.78 H new ATOM 0 HD22 LEU B 49 -17.570 1.323 10.877 1.00 2.78 H new ATOM 0 HD23 LEU B 49 -16.692 2.476 9.843 1.00 2.78 H new ATOM 2426 N LEU B 50 -16.369 0.765 5.223 1.00 1.23 N ATOM 2427 CA LEU B 50 -15.933 1.607 4.102 1.00 1.58 C ATOM 2428 C LEU B 50 -16.501 3.028 4.166 1.00 1.67 C ATOM 2429 O LEU B 50 -17.134 3.531 3.241 1.00 2.16 O ATOM 2430 CB LEU B 50 -16.041 0.906 2.731 1.00 2.22 C ATOM 2431 CG LEU B 50 -17.364 0.278 2.244 1.00 1.58 C ATOM 2432 CD1 LEU B 50 -17.821 -0.939 3.055 1.00 3.14 C ATOM 2433 CD2 LEU B 50 -18.522 1.262 2.077 1.00 2.85 C ATOM 0 H LEU B 50 -15.631 0.130 5.525 1.00 1.23 H new ATOM 0 HA LEU B 50 -14.859 1.752 4.223 1.00 1.58 H new ATOM 0 HB2 LEU B 50 -15.742 1.636 1.979 1.00 2.22 H new ATOM 0 HB3 LEU B 50 -15.293 0.113 2.722 1.00 2.22 H new ATOM 0 HG LEU B 50 -17.095 -0.070 1.247 1.00 1.58 H new ATOM 0 HD11 LEU B 50 -18.758 -1.318 2.646 1.00 3.14 H new ATOM 0 HD12 LEU B 50 -17.060 -1.718 3.002 1.00 3.14 H new ATOM 0 HD13 LEU B 50 -17.971 -0.648 4.095 1.00 3.14 H new ATOM 0 HD21 LEU B 50 -19.407 0.727 1.732 1.00 2.85 H new ATOM 0 HD22 LEU B 50 -18.736 1.738 3.034 1.00 2.85 H new ATOM 0 HD23 LEU B 50 -18.250 2.023 1.346 1.00 2.85 H new ATOM 2445 N LYS B 51 -16.281 3.659 5.320 1.00 1.32 N ATOM 2446 CA LYS B 51 -16.994 4.867 5.697 1.00 1.39 C ATOM 2447 C LYS B 51 -16.503 6.115 4.964 1.00 1.42 C ATOM 2448 O LYS B 51 -17.331 6.951 4.621 1.00 1.73 O ATOM 2449 CB LYS B 51 -16.979 5.035 7.217 1.00 1.29 C ATOM 2450 CG LYS B 51 -15.564 4.985 7.812 1.00 1.07 C ATOM 2451 CD LYS B 51 -15.116 6.352 8.326 1.00 1.30 C ATOM 2452 CE LYS B 51 -15.601 6.675 9.746 1.00 1.70 C ATOM 2453 NZ LYS B 51 -17.039 7.011 9.793 1.00 3.13 N ATOM 0 H LYS B 51 -15.604 3.343 6.014 1.00 1.32 H new ATOM 0 HA LYS B 51 -18.029 4.748 5.376 1.00 1.39 H new ATOM 0 HB2 LYS B 51 -17.443 5.987 7.476 1.00 1.29 H new ATOM 0 HB3 LYS B 51 -17.586 4.251 7.670 1.00 1.29 H new ATOM 0 HG2 LYS B 51 -15.538 4.263 8.629 1.00 1.07 H new ATOM 0 HG3 LYS B 51 -14.863 4.634 7.054 1.00 1.07 H new ATOM 0 HD2 LYS B 51 -14.027 6.397 8.306 1.00 1.30 H new ATOM 0 HD3 LYS B 51 -15.480 7.122 7.645 1.00 1.30 H new ATOM 0 HE2 LYS B 51 -15.410 5.820 10.394 1.00 1.70 H new ATOM 0 HE3 LYS B 51 -15.023 7.510 10.142 1.00 1.70 H new ATOM 0 HZ1 LYS B 51 -17.275 7.399 10.729 1.00 3.13 H new ATOM 0 HZ2 LYS B 51 -17.254 7.718 9.061 1.00 3.13 H new ATOM 0 HZ3 LYS B 51 -17.602 6.153 9.622 1.00 3.13 H new ATOM 2467 N ASP B 52 -15.183 6.269 4.776 1.00 1.25 N ATOM 2468 CA ASP B 52 -14.593 7.341 3.984 1.00 1.24 C ATOM 2469 C ASP B 52 -14.938 8.707 4.600 1.00 1.12 C ATOM 2470 O ASP B 52 -15.839 9.396 4.121 1.00 1.31 O ATOM 2471 CB ASP B 52 -14.979 7.256 2.490 1.00 1.54 C ATOM 2472 CG ASP B 52 -14.377 6.084 1.716 1.00 2.09 C ATOM 2473 OD1 ASP B 52 -14.308 4.964 2.264 1.00 2.36 O ATOM 2474 OD2 ASP B 52 -14.071 6.293 0.513 1.00 3.38 O ATOM 0 H ASP B 52 -14.491 5.638 5.180 1.00 1.25 H new ATOM 0 HA ASP B 52 -13.510 7.220 4.012 1.00 1.24 H new ATOM 0 HB2 ASP B 52 -16.065 7.196 2.417 1.00 1.54 H new ATOM 0 HB3 ASP B 52 -14.677 8.183 2.002 1.00 1.54 H new ATOM 2479 N VAL B 53 -14.213 9.120 5.646 1.00 1.06 N ATOM 2480 CA VAL B 53 -14.223 10.488 6.160 1.00 1.20 C ATOM 2481 C VAL B 53 -12.787 10.989 6.338 1.00 1.35 C ATOM 2482 O VAL B 53 -11.852 10.194 6.378 1.00 1.74 O ATOM 2483 CB VAL B 53 -15.033 10.614 7.460 1.00 1.66 C ATOM 2484 CG1 VAL B 53 -16.471 10.110 7.279 1.00 2.43 C ATOM 2485 CG2 VAL B 53 -14.342 9.916 8.638 1.00 2.87 C ATOM 0 H VAL B 53 -13.593 8.499 6.166 1.00 1.06 H new ATOM 0 HA VAL B 53 -14.724 11.120 5.427 1.00 1.20 H new ATOM 0 HB VAL B 53 -15.083 11.676 7.700 1.00 1.66 H new ATOM 0 HG11 VAL B 53 -17.014 10.214 8.218 1.00 2.43 H new ATOM 0 HG12 VAL B 53 -16.967 10.696 6.506 1.00 2.43 H new ATOM 0 HG13 VAL B 53 -16.454 9.061 6.984 1.00 2.43 H new ATOM 0 HG21 VAL B 53 -14.949 10.030 9.536 1.00 2.87 H new ATOM 0 HG22 VAL B 53 -14.222 8.856 8.413 1.00 2.87 H new ATOM 0 HG23 VAL B 53 -13.362 10.365 8.803 1.00 2.87 H new ATOM 2495 N GLY B 54 -12.601 12.305 6.452 1.00 1.51 N ATOM 2496 CA GLY B 54 -11.282 12.914 6.525 1.00 1.83 C ATOM 2497 C GLY B 54 -10.736 13.097 5.113 1.00 1.51 C ATOM 2498 O GLY B 54 -10.932 14.155 4.528 1.00 1.88 O ATOM 0 H GLY B 54 -13.367 12.977 6.496 1.00 1.51 H new ATOM 0 HA2 GLY B 54 -11.340 13.877 7.033 1.00 1.83 H new ATOM 0 HA3 GLY B 54 -10.610 12.286 7.109 1.00 1.83 H new ATOM 2502 N SER B 55 -10.104 12.060 4.559 1.00 1.10 N ATOM 2503 CA SER B 55 -9.545 12.089 3.209 1.00 1.07 C ATOM 2504 C SER B 55 -10.601 12.031 2.100 1.00 1.20 C ATOM 2505 O SER B 55 -10.264 12.123 0.916 1.00 1.25 O ATOM 2506 CB SER B 55 -8.497 11.010 2.981 1.00 1.19 C ATOM 2507 OG SER B 55 -7.579 10.922 4.049 1.00 1.49 O ATOM 0 H SER B 55 -9.966 11.171 5.039 1.00 1.10 H new ATOM 0 HA SER B 55 -9.059 13.063 3.145 1.00 1.07 H new ATOM 0 HB2 SER B 55 -8.992 10.048 2.850 1.00 1.19 H new ATOM 0 HB3 SER B 55 -7.958 11.220 2.057 1.00 1.19 H new ATOM 0 HG SER B 55 -6.792 10.412 3.763 1.00 1.49 H new ATOM 2513 N LEU B 56 -11.845 11.695 2.469 1.00 1.28 N ATOM 2514 CA LEU B 56 -12.950 11.489 1.543 1.00 1.31 C ATOM 2515 C LEU B 56 -12.937 12.508 0.412 1.00 1.15 C ATOM 2516 O LEU B 56 -13.087 12.137 -0.746 1.00 1.05 O ATOM 2517 CB LEU B 56 -14.297 11.484 2.285 1.00 1.60 C ATOM 2518 CG LEU B 56 -14.963 12.850 2.565 1.00 3.27 C ATOM 2519 CD1 LEU B 56 -16.416 12.641 2.972 1.00 3.36 C ATOM 2520 CD2 LEU B 56 -14.283 13.667 3.672 1.00 5.76 C ATOM 0 H LEU B 56 -12.109 11.557 3.444 1.00 1.28 H new ATOM 0 HA LEU B 56 -12.818 10.508 1.087 1.00 1.31 H new ATOM 0 HB2 LEU B 56 -14.997 10.881 1.707 1.00 1.60 H new ATOM 0 HB3 LEU B 56 -14.153 10.978 3.240 1.00 1.60 H new ATOM 0 HG LEU B 56 -14.871 13.413 1.636 1.00 3.27 H new ATOM 0 HD11 LEU B 56 -16.881 13.607 3.168 1.00 3.36 H new ATOM 0 HD12 LEU B 56 -16.951 12.138 2.166 1.00 3.36 H new ATOM 0 HD13 LEU B 56 -16.457 12.029 3.873 1.00 3.36 H new ATOM 0 HD21 LEU B 56 -14.812 14.611 3.805 1.00 5.76 H new ATOM 0 HD22 LEU B 56 -14.305 13.104 4.605 1.00 5.76 H new ATOM 0 HD23 LEU B 56 -13.249 13.867 3.393 1.00 5.76 H new ATOM 2532 N ASP B 57 -12.757 13.781 0.768 1.00 1.32 N ATOM 2533 CA ASP B 57 -12.725 14.880 -0.186 1.00 1.41 C ATOM 2534 C ASP B 57 -11.656 14.633 -1.245 1.00 1.20 C ATOM 2535 O ASP B 57 -11.988 14.527 -2.423 1.00 1.19 O ATOM 2536 CB ASP B 57 -12.521 16.235 0.500 1.00 1.86 C ATOM 2537 CG ASP B 57 -12.458 17.339 -0.550 1.00 3.05 C ATOM 2538 OD1 ASP B 57 -13.457 17.485 -1.285 1.00 3.69 O ATOM 2539 OD2 ASP B 57 -11.403 18.000 -0.643 1.00 4.10 O ATOM 0 H ASP B 57 -12.629 14.076 1.736 1.00 1.32 H new ATOM 0 HA ASP B 57 -13.698 14.919 -0.676 1.00 1.41 H new ATOM 0 HB2 ASP B 57 -13.338 16.428 1.196 1.00 1.86 H new ATOM 0 HB3 ASP B 57 -11.601 16.223 1.084 1.00 1.86 H new ATOM 2544 N GLU B 58 -10.385 14.508 -0.849 1.00 1.21 N ATOM 2545 CA GLU B 58 -9.287 14.210 -1.758 1.00 1.24 C ATOM 2546 C GLU B 58 -9.664 13.063 -2.695 1.00 0.99 C ATOM 2547 O GLU B 58 -9.572 13.194 -3.917 1.00 1.20 O ATOM 2548 CB GLU B 58 -8.000 13.874 -0.989 1.00 1.38 C ATOM 2549 CG GLU B 58 -7.522 15.012 -0.074 1.00 1.58 C ATOM 2550 CD GLU B 58 -8.016 14.846 1.356 1.00 2.66 C ATOM 2551 OE1 GLU B 58 -9.246 14.965 1.543 1.00 3.68 O ATOM 2552 OE2 GLU B 58 -7.164 14.566 2.227 1.00 3.53 O ATOM 0 H GLU B 58 -10.093 14.613 0.123 1.00 1.21 H new ATOM 0 HA GLU B 58 -9.097 15.102 -2.355 1.00 1.24 H new ATOM 0 HB2 GLU B 58 -8.167 12.980 -0.388 1.00 1.38 H new ATOM 0 HB3 GLU B 58 -7.211 13.635 -1.702 1.00 1.38 H new ATOM 0 HG2 GLU B 58 -6.433 15.046 -0.079 1.00 1.58 H new ATOM 0 HG3 GLU B 58 -7.873 15.965 -0.469 1.00 1.58 H new ATOM 2559 N LYS B 59 -10.099 11.936 -2.131 1.00 0.74 N ATOM 2560 CA LYS B 59 -10.423 10.760 -2.926 1.00 0.77 C ATOM 2561 C LYS B 59 -11.562 11.029 -3.913 1.00 0.83 C ATOM 2562 O LYS B 59 -11.394 10.896 -5.125 1.00 0.97 O ATOM 2563 CB LYS B 59 -10.710 9.572 -1.992 1.00 0.80 C ATOM 2564 CG LYS B 59 -9.418 8.759 -1.914 1.00 1.11 C ATOM 2565 CD LYS B 59 -9.395 7.567 -0.956 1.00 1.18 C ATOM 2566 CE LYS B 59 -10.617 6.653 -1.102 1.00 1.21 C ATOM 2567 NZ LYS B 59 -11.614 6.950 -0.051 1.00 1.59 N ATOM 0 H LYS B 59 -10.234 11.816 -1.127 1.00 0.74 H new ATOM 0 HA LYS B 59 -9.563 10.504 -3.544 1.00 0.77 H new ATOM 0 HB2 LYS B 59 -11.010 9.919 -1.003 1.00 0.80 H new ATOM 0 HB3 LYS B 59 -11.528 8.964 -2.378 1.00 0.80 H new ATOM 0 HG2 LYS B 59 -9.190 8.392 -2.915 1.00 1.11 H new ATOM 0 HG3 LYS B 59 -8.611 9.435 -1.631 1.00 1.11 H new ATOM 0 HD2 LYS B 59 -8.490 6.985 -1.132 1.00 1.18 H new ATOM 0 HD3 LYS B 59 -9.344 7.934 0.069 1.00 1.18 H new ATOM 0 HE2 LYS B 59 -11.065 6.790 -2.086 1.00 1.21 H new ATOM 0 HE3 LYS B 59 -10.308 5.610 -1.035 1.00 1.21 H new ATOM 0 HZ1 LYS B 59 -12.571 6.794 -0.427 1.00 1.59 H new ATOM 0 HZ2 LYS B 59 -11.456 6.324 0.764 1.00 1.59 H new ATOM 0 HZ3 LYS B 59 -11.517 7.941 0.249 1.00 1.59 H new ATOM 2581 N MET B 60 -12.723 11.397 -3.386 1.00 0.82 N ATOM 2582 CA MET B 60 -13.920 11.683 -4.156 1.00 0.91 C ATOM 2583 C MET B 60 -13.616 12.702 -5.253 1.00 0.96 C ATOM 2584 O MET B 60 -13.914 12.457 -6.420 1.00 1.05 O ATOM 2585 CB MET B 60 -15.014 12.169 -3.198 1.00 0.97 C ATOM 2586 CG MET B 60 -16.338 12.474 -3.910 1.00 1.12 C ATOM 2587 SD MET B 60 -17.760 12.693 -2.808 1.00 2.60 S ATOM 2588 CE MET B 60 -17.167 14.026 -1.740 1.00 4.12 C ATOM 0 H MET B 60 -12.858 11.507 -2.381 1.00 0.82 H new ATOM 0 HA MET B 60 -14.275 10.782 -4.657 1.00 0.91 H new ATOM 0 HB2 MET B 60 -15.184 11.410 -2.434 1.00 0.97 H new ATOM 0 HB3 MET B 60 -14.668 13.066 -2.685 1.00 0.97 H new ATOM 0 HG2 MET B 60 -16.214 13.379 -4.505 1.00 1.12 H new ATOM 0 HG3 MET B 60 -16.556 11.663 -4.605 1.00 1.12 H new ATOM 0 HE1 MET B 60 -17.971 14.346 -1.077 1.00 4.12 H new ATOM 0 HE2 MET B 60 -16.326 13.669 -1.145 1.00 4.12 H new ATOM 0 HE3 MET B 60 -16.846 14.868 -2.353 1.00 4.12 H new ATOM 2598 N LYS B 61 -13.015 13.836 -4.895 1.00 0.97 N ATOM 2599 CA LYS B 61 -12.753 14.903 -5.845 1.00 1.11 C ATOM 2600 C LYS B 61 -11.763 14.436 -6.918 1.00 1.10 C ATOM 2601 O LYS B 61 -11.933 14.747 -8.094 1.00 1.15 O ATOM 2602 CB LYS B 61 -12.351 16.203 -5.130 1.00 1.27 C ATOM 2603 CG LYS B 61 -10.846 16.320 -4.859 1.00 1.60 C ATOM 2604 CD LYS B 61 -10.504 17.242 -3.687 1.00 1.68 C ATOM 2605 CE LYS B 61 -11.273 18.568 -3.627 1.00 2.24 C ATOM 2606 NZ LYS B 61 -11.175 19.334 -4.881 1.00 4.01 N ATOM 0 H LYS B 61 -12.700 14.035 -3.945 1.00 0.97 H new ATOM 0 HA LYS B 61 -13.673 15.148 -6.376 1.00 1.11 H new ATOM 0 HB2 LYS B 61 -12.669 17.052 -5.734 1.00 1.27 H new ATOM 0 HB3 LYS B 61 -12.887 16.267 -4.183 1.00 1.27 H new ATOM 0 HG2 LYS B 61 -10.443 15.327 -4.659 1.00 1.60 H new ATOM 0 HG3 LYS B 61 -10.351 16.689 -5.757 1.00 1.60 H new ATOM 0 HD2 LYS B 61 -10.683 16.699 -2.759 1.00 1.68 H new ATOM 0 HD3 LYS B 61 -9.438 17.465 -3.725 1.00 1.68 H new ATOM 0 HE2 LYS B 61 -12.322 18.366 -3.409 1.00 2.24 H new ATOM 0 HE3 LYS B 61 -10.887 19.171 -2.805 1.00 2.24 H new ATOM 0 HZ1 LYS B 61 -11.201 20.352 -4.669 1.00 4.01 H new ATOM 0 HZ2 LYS B 61 -10.282 19.102 -5.360 1.00 4.01 H new ATOM 0 HZ3 LYS B 61 -11.974 19.089 -5.501 1.00 4.01 H new ATOM 2620 N SER B 62 -10.741 13.662 -6.532 1.00 1.11 N ATOM 2621 CA SER B 62 -9.860 13.036 -7.514 1.00 1.25 C ATOM 2622 C SER B 62 -10.656 12.237 -8.551 1.00 1.33 C ATOM 2623 O SER B 62 -10.297 12.260 -9.727 1.00 1.50 O ATOM 2624 CB SER B 62 -8.786 12.167 -6.857 1.00 1.32 C ATOM 2625 OG SER B 62 -7.928 12.964 -6.066 1.00 1.65 O ATOM 0 H SER B 62 -10.509 13.459 -5.560 1.00 1.11 H new ATOM 0 HA SER B 62 -9.345 13.844 -8.034 1.00 1.25 H new ATOM 0 HB2 SER B 62 -9.255 11.402 -6.239 1.00 1.32 H new ATOM 0 HB3 SER B 62 -8.209 11.649 -7.623 1.00 1.32 H new ATOM 0 HG SER B 62 -8.398 13.244 -5.253 1.00 1.65 H new ATOM 2631 N LEU B 63 -11.736 11.552 -8.146 1.00 1.29 N ATOM 2632 CA LEU B 63 -12.646 10.986 -9.134 1.00 1.47 C ATOM 2633 C LEU B 63 -13.331 12.135 -9.894 1.00 1.43 C ATOM 2634 O LEU B 63 -13.164 12.242 -11.105 1.00 1.50 O ATOM 2635 CB LEU B 63 -13.662 9.975 -8.549 1.00 1.59 C ATOM 2636 CG LEU B 63 -13.173 8.548 -8.304 1.00 1.87 C ATOM 2637 CD1 LEU B 63 -12.167 8.519 -7.143 1.00 2.19 C ATOM 2638 CD2 LEU B 63 -14.440 7.748 -7.970 1.00 2.79 C ATOM 0 H LEU B 63 -11.990 11.384 -7.172 1.00 1.29 H new ATOM 0 HA LEU B 63 -12.055 10.389 -9.829 1.00 1.47 H new ATOM 0 HB2 LEU B 63 -14.026 10.373 -7.602 1.00 1.59 H new ATOM 0 HB3 LEU B 63 -14.516 9.927 -9.224 1.00 1.59 H new ATOM 0 HG LEU B 63 -12.653 8.130 -9.166 1.00 1.87 H new ATOM 0 HD11 LEU B 63 -11.828 7.496 -6.981 1.00 2.19 H new ATOM 0 HD12 LEU B 63 -11.312 9.150 -7.386 1.00 2.19 H new ATOM 0 HD13 LEU B 63 -12.646 8.890 -6.237 1.00 2.19 H new ATOM 0 HD21 LEU B 63 -14.174 6.708 -7.780 1.00 2.79 H new ATOM 0 HD22 LEU B 63 -14.913 8.169 -7.083 1.00 2.79 H new ATOM 0 HD23 LEU B 63 -15.133 7.798 -8.809 1.00 2.79 H new ATOM 2650 N ASP B 64 -14.071 13.000 -9.194 1.00 1.38 N ATOM 2651 CA ASP B 64 -14.886 14.068 -9.783 1.00 1.44 C ATOM 2652 C ASP B 64 -14.203 14.766 -10.968 1.00 1.44 C ATOM 2653 O ASP B 64 -14.799 14.921 -12.033 1.00 1.59 O ATOM 2654 CB ASP B 64 -15.234 15.096 -8.700 1.00 1.35 C ATOM 2655 CG ASP B 64 -16.097 16.223 -9.244 1.00 1.51 C ATOM 2656 OD1 ASP B 64 -17.324 16.004 -9.337 1.00 2.17 O ATOM 2657 OD2 ASP B 64 -15.512 17.291 -9.523 1.00 1.70 O ATOM 0 H ASP B 64 -14.121 12.977 -8.176 1.00 1.38 H new ATOM 0 HA ASP B 64 -15.790 13.604 -10.176 1.00 1.44 H new ATOM 0 HB2 ASP B 64 -15.758 14.600 -7.883 1.00 1.35 H new ATOM 0 HB3 ASP B 64 -14.316 15.510 -8.284 1.00 1.35 H new ATOM 2662 N VAL B 65 -12.939 15.157 -10.776 1.00 1.31 N ATOM 2663 CA VAL B 65 -12.133 15.867 -11.766 1.00 1.30 C ATOM 2664 C VAL B 65 -12.165 15.168 -13.126 1.00 1.38 C ATOM 2665 O VAL B 65 -12.628 15.733 -14.113 1.00 1.47 O ATOM 2666 CB VAL B 65 -10.691 16.002 -11.242 1.00 1.29 C ATOM 2667 CG1 VAL B 65 -9.701 16.501 -12.303 1.00 1.64 C ATOM 2668 CG2 VAL B 65 -10.662 16.991 -10.081 1.00 1.73 C ATOM 0 H VAL B 65 -12.438 14.983 -9.905 1.00 1.31 H new ATOM 0 HA VAL B 65 -12.555 16.861 -11.916 1.00 1.30 H new ATOM 0 HB VAL B 65 -10.384 15.002 -10.937 1.00 1.29 H new ATOM 0 HG11 VAL B 65 -8.705 16.573 -11.866 1.00 1.64 H new ATOM 0 HG12 VAL B 65 -9.681 15.802 -13.139 1.00 1.64 H new ATOM 0 HG13 VAL B 65 -10.013 17.483 -12.658 1.00 1.64 H new ATOM 0 HG21 VAL B 65 -9.642 17.087 -9.710 1.00 1.73 H new ATOM 0 HG22 VAL B 65 -11.017 17.963 -10.422 1.00 1.73 H new ATOM 0 HG23 VAL B 65 -11.307 16.630 -9.280 1.00 1.73 H new ATOM 2678 N ASN B 66 -11.596 13.964 -13.182 1.00 1.35 N ATOM 2679 CA ASN B 66 -11.476 13.175 -14.412 1.00 1.37 C ATOM 2680 C ASN B 66 -11.347 11.693 -14.067 1.00 1.30 C ATOM 2681 O ASN B 66 -10.347 11.047 -14.391 1.00 1.29 O ATOM 2682 CB ASN B 66 -10.288 13.642 -15.279 1.00 1.42 C ATOM 2683 CG ASN B 66 -10.590 14.888 -16.109 1.00 1.79 C ATOM 2684 OD1 ASN B 66 -11.374 14.835 -17.049 1.00 2.83 O ATOM 2685 ND2 ASN B 66 -9.933 16.008 -15.817 1.00 2.25 N ATOM 0 H ASN B 66 -11.199 13.501 -12.364 1.00 1.35 H new ATOM 0 HA ASN B 66 -12.381 13.327 -15.001 1.00 1.37 H new ATOM 0 HB2 ASN B 66 -9.434 13.845 -14.632 1.00 1.42 H new ATOM 0 HB3 ASN B 66 -9.996 12.832 -15.948 1.00 1.42 H new ATOM 0 HD21 ASN B 66 -10.077 16.846 -16.381 1.00 2.25 H new ATOM 0 HD22 ASN B 66 -9.285 16.029 -15.029 1.00 2.25 H new ATOM 2692 N GLN B 67 -12.371 11.145 -13.410 1.00 1.30 N ATOM 2693 CA GLN B 67 -12.381 9.787 -12.905 1.00 1.29 C ATOM 2694 C GLN B 67 -12.087 8.752 -13.975 1.00 1.38 C ATOM 2695 O GLN B 67 -11.716 7.617 -13.675 1.00 1.55 O ATOM 2696 CB GLN B 67 -13.720 9.422 -12.256 1.00 1.34 C ATOM 2697 CG GLN B 67 -14.972 9.671 -13.119 1.00 1.49 C ATOM 2698 CD GLN B 67 -15.426 11.127 -13.082 1.00 2.12 C ATOM 2699 OE1 GLN B 67 -15.987 11.569 -12.085 1.00 3.24 O ATOM 2700 NE2 GLN B 67 -15.183 11.886 -14.147 1.00 2.58 N ATOM 0 H GLN B 67 -13.234 11.653 -13.214 1.00 1.30 H new ATOM 0 HA GLN B 67 -11.585 9.767 -12.160 1.00 1.29 H new ATOM 0 HB2 GLN B 67 -13.694 8.367 -11.982 1.00 1.34 H new ATOM 0 HB3 GLN B 67 -13.821 9.989 -11.331 1.00 1.34 H new ATOM 0 HG2 GLN B 67 -14.762 9.385 -14.150 1.00 1.49 H new ATOM 0 HG3 GLN B 67 -15.783 9.032 -12.770 1.00 1.49 H new ATOM 0 HE21 GLN B 67 -14.714 11.488 -14.961 1.00 2.58 H new ATOM 0 HE22 GLN B 67 -15.465 12.866 -14.150 1.00 2.58 H new ATOM 2709 N ASP B 68 -12.398 9.117 -15.208 1.00 1.39 N ATOM 2710 CA ASP B 68 -12.275 8.320 -16.400 1.00 1.48 C ATOM 2711 C ASP B 68 -10.811 7.958 -16.646 1.00 1.50 C ATOM 2712 O ASP B 68 -10.520 6.937 -17.262 1.00 1.66 O ATOM 2713 CB ASP B 68 -12.857 9.128 -17.575 1.00 1.49 C ATOM 2714 CG ASP B 68 -14.187 9.809 -17.250 1.00 2.84 C ATOM 2715 OD1 ASP B 68 -14.162 10.686 -16.350 1.00 4.04 O ATOM 2716 OD2 ASP B 68 -15.197 9.433 -17.876 1.00 3.70 O ATOM 0 H ASP B 68 -12.769 10.046 -15.407 1.00 1.39 H new ATOM 0 HA ASP B 68 -12.825 7.385 -16.294 1.00 1.48 H new ATOM 0 HB2 ASP B 68 -12.134 9.886 -17.877 1.00 1.49 H new ATOM 0 HB3 ASP B 68 -12.997 8.464 -18.428 1.00 1.49 H new ATOM 2721 N SER B 69 -9.886 8.807 -16.186 1.00 1.40 N ATOM 2722 CA SER B 69 -8.468 8.610 -16.421 1.00 1.44 C ATOM 2723 C SER B 69 -7.936 7.373 -15.686 1.00 1.60 C ATOM 2724 O SER B 69 -8.507 6.917 -14.693 1.00 2.86 O ATOM 2725 CB SER B 69 -7.699 9.874 -16.024 1.00 1.38 C ATOM 2726 OG SER B 69 -6.410 9.864 -16.611 1.00 1.70 O ATOM 0 H SER B 69 -10.106 9.643 -15.644 1.00 1.40 H new ATOM 0 HA SER B 69 -8.316 8.427 -17.485 1.00 1.44 H new ATOM 0 HB2 SER B 69 -8.247 10.759 -16.347 1.00 1.38 H new ATOM 0 HB3 SER B 69 -7.613 9.931 -14.939 1.00 1.38 H new ATOM 0 HG SER B 69 -5.927 10.677 -16.353 1.00 1.70 H new ATOM 2732 N GLU B 70 -6.810 6.859 -16.183 1.00 0.97 N ATOM 2733 CA GLU B 70 -6.089 5.720 -15.640 1.00 1.05 C ATOM 2734 C GLU B 70 -5.203 6.136 -14.482 1.00 1.13 C ATOM 2735 O GLU B 70 -4.261 6.914 -14.685 1.00 1.44 O ATOM 2736 CB GLU B 70 -5.084 5.228 -16.661 1.00 1.31 C ATOM 2737 CG GLU B 70 -5.612 4.367 -17.782 1.00 1.57 C ATOM 2738 CD GLU B 70 -4.605 4.404 -18.934 1.00 2.27 C ATOM 2739 OE1 GLU B 70 -3.456 4.843 -18.658 1.00 3.68 O ATOM 2740 OE2 GLU B 70 -4.989 4.016 -20.054 1.00 2.38 O ATOM 0 H GLU B 70 -6.360 7.247 -17.012 1.00 0.97 H new ATOM 0 HA GLU B 70 -6.842 4.985 -15.355 1.00 1.05 H new ATOM 0 HB2 GLU B 70 -4.596 6.097 -17.102 1.00 1.31 H new ATOM 0 HB3 GLU B 70 -4.314 4.664 -16.134 1.00 1.31 H new ATOM 0 HG2 GLU B 70 -5.757 3.343 -17.438 1.00 1.57 H new ATOM 0 HG3 GLU B 70 -6.583 4.732 -18.115 1.00 1.57 H new ATOM 2747 N LEU B 71 -5.366 5.455 -13.355 1.00 1.30 N ATOM 2748 CA LEU B 71 -4.332 5.486 -12.318 1.00 1.36 C ATOM 2749 C LEU B 71 -3.256 4.437 -12.615 1.00 1.10 C ATOM 2750 O LEU B 71 -3.343 3.703 -13.597 1.00 1.14 O ATOM 2751 CB LEU B 71 -4.876 5.477 -10.872 1.00 1.99 C ATOM 2752 CG LEU B 71 -6.321 5.028 -10.643 1.00 1.48 C ATOM 2753 CD1 LEU B 71 -6.422 3.508 -10.732 1.00 1.92 C ATOM 2754 CD2 LEU B 71 -6.736 5.474 -9.236 1.00 2.45 C ATOM 0 H LEU B 71 -6.183 4.886 -13.134 1.00 1.30 H new ATOM 0 HA LEU B 71 -3.845 6.460 -12.365 1.00 1.36 H new ATOM 0 HB2 LEU B 71 -4.229 4.832 -10.278 1.00 1.99 H new ATOM 0 HB3 LEU B 71 -4.774 6.486 -10.472 1.00 1.99 H new ATOM 0 HG LEU B 71 -6.969 5.468 -11.401 1.00 1.48 H new ATOM 0 HD11 LEU B 71 -7.455 3.202 -10.567 1.00 1.92 H new ATOM 0 HD12 LEU B 71 -6.099 3.179 -11.720 1.00 1.92 H new ATOM 0 HD13 LEU B 71 -5.784 3.056 -9.973 1.00 1.92 H new ATOM 0 HD21 LEU B 71 -7.764 5.166 -9.045 1.00 2.45 H new ATOM 0 HD22 LEU B 71 -6.077 5.014 -8.499 1.00 2.45 H new ATOM 0 HD23 LEU B 71 -6.662 6.559 -9.162 1.00 2.45 H new ATOM 2766 N LYS B 72 -2.201 4.420 -11.799 1.00 0.98 N ATOM 2767 CA LYS B 72 -1.073 3.502 -11.853 1.00 0.87 C ATOM 2768 C LYS B 72 -0.704 3.173 -10.405 1.00 0.85 C ATOM 2769 O LYS B 72 -1.242 3.805 -9.491 1.00 0.82 O ATOM 2770 CB LYS B 72 0.111 4.136 -12.609 1.00 0.95 C ATOM 2771 CG LYS B 72 -0.074 4.097 -14.135 1.00 1.23 C ATOM 2772 CD LYS B 72 -0.745 5.348 -14.726 1.00 1.50 C ATOM 2773 CE LYS B 72 -1.372 4.986 -16.081 1.00 2.27 C ATOM 2774 NZ LYS B 72 -2.197 6.072 -16.642 1.00 3.18 N ATOM 0 H LYS B 72 -2.110 5.091 -11.036 1.00 0.98 H new ATOM 0 HA LYS B 72 -1.331 2.592 -12.395 1.00 0.87 H new ATOM 0 HB2 LYS B 72 0.231 5.171 -12.287 1.00 0.95 H new ATOM 0 HB3 LYS B 72 1.029 3.612 -12.344 1.00 0.95 H new ATOM 0 HG2 LYS B 72 0.901 3.967 -14.604 1.00 1.23 H new ATOM 0 HG3 LYS B 72 -0.671 3.223 -14.394 1.00 1.23 H new ATOM 0 HD2 LYS B 72 -1.510 5.722 -14.045 1.00 1.50 H new ATOM 0 HD3 LYS B 72 -0.012 6.145 -14.851 1.00 1.50 H new ATOM 0 HE2 LYS B 72 -0.580 4.737 -16.787 1.00 2.27 H new ATOM 0 HE3 LYS B 72 -1.987 4.093 -15.964 1.00 2.27 H new ATOM 0 HZ1 LYS B 72 -2.634 5.753 -17.530 1.00 3.18 H new ATOM 0 HZ2 LYS B 72 -2.941 6.329 -15.962 1.00 3.18 H new ATOM 0 HZ3 LYS B 72 -1.598 6.901 -16.830 1.00 3.18 H new ATOM 2788 N PHE B 73 0.193 2.197 -10.202 1.00 0.92 N ATOM 2789 CA PHE B 73 0.480 1.588 -8.901 1.00 0.90 C ATOM 2790 C PHE B 73 0.486 2.609 -7.767 1.00 0.76 C ATOM 2791 O PHE B 73 -0.343 2.522 -6.870 1.00 0.59 O ATOM 2792 CB PHE B 73 1.834 0.861 -8.926 1.00 1.28 C ATOM 2793 CG PHE B 73 1.860 -0.399 -9.762 1.00 1.19 C ATOM 2794 CD1 PHE B 73 2.144 -0.326 -11.135 1.00 1.80 C ATOM 2795 CD2 PHE B 73 1.622 -1.652 -9.163 1.00 3.09 C ATOM 2796 CE1 PHE B 73 2.144 -1.493 -11.913 1.00 2.96 C ATOM 2797 CE2 PHE B 73 1.645 -2.821 -9.941 1.00 4.36 C ATOM 2798 CZ PHE B 73 1.892 -2.741 -11.321 1.00 4.07 C ATOM 0 H PHE B 73 0.751 1.802 -10.959 1.00 0.92 H new ATOM 0 HA PHE B 73 -0.323 0.875 -8.713 1.00 0.90 H new ATOM 0 HB2 PHE B 73 2.592 1.547 -9.304 1.00 1.28 H new ATOM 0 HB3 PHE B 73 2.114 0.608 -7.903 1.00 1.28 H new ATOM 0 HD1 PHE B 73 2.362 0.628 -11.592 1.00 1.80 H new ATOM 0 HD2 PHE B 73 1.422 -1.714 -8.104 1.00 3.09 H new ATOM 0 HE1 PHE B 73 2.339 -1.431 -12.973 1.00 2.96 H new ATOM 0 HE2 PHE B 73 1.473 -3.781 -9.478 1.00 4.36 H new ATOM 0 HZ PHE B 73 1.888 -3.636 -11.925 1.00 4.07 H new ATOM 2808 N ASN B 74 1.393 3.587 -7.817 1.00 1.02 N ATOM 2809 CA ASN B 74 1.558 4.548 -6.727 1.00 1.15 C ATOM 2810 C ASN B 74 0.316 5.431 -6.497 1.00 0.89 C ATOM 2811 O ASN B 74 0.054 5.818 -5.359 1.00 0.92 O ATOM 2812 CB ASN B 74 2.857 5.351 -6.871 1.00 1.74 C ATOM 2813 CG ASN B 74 2.741 6.547 -7.800 1.00 1.37 C ATOM 2814 OD1 ASN B 74 3.211 7.631 -7.475 1.00 2.52 O ATOM 2815 ND2 ASN B 74 2.136 6.352 -8.967 1.00 2.13 N ATOM 0 H ASN B 74 2.026 3.734 -8.604 1.00 1.02 H new ATOM 0 HA ASN B 74 1.653 3.965 -5.811 1.00 1.15 H new ATOM 0 HB2 ASN B 74 3.170 5.697 -5.886 1.00 1.74 H new ATOM 0 HB3 ASN B 74 3.642 4.691 -7.241 1.00 1.74 H new ATOM 0 HD21 ASN B 74 2.049 7.121 -9.631 1.00 2.13 H new ATOM 0 HD22 ASN B 74 1.758 5.433 -9.198 1.00 2.13 H new ATOM 2822 N GLU B 75 -0.459 5.718 -7.552 1.00 0.76 N ATOM 2823 CA GLU B 75 -1.664 6.541 -7.490 1.00 0.59 C ATOM 2824 C GLU B 75 -2.797 5.754 -6.839 1.00 0.51 C ATOM 2825 O GLU B 75 -3.474 6.264 -5.948 1.00 0.64 O ATOM 2826 CB GLU B 75 -2.045 7.064 -8.885 1.00 0.72 C ATOM 2827 CG GLU B 75 -1.519 8.483 -9.148 1.00 1.30 C ATOM 2828 CD GLU B 75 -0.013 8.596 -8.973 1.00 2.61 C ATOM 2829 OE1 GLU B 75 0.705 8.342 -9.966 1.00 3.53 O ATOM 2830 OE2 GLU B 75 0.405 8.894 -7.833 1.00 3.76 O ATOM 0 H GLU B 75 -0.257 5.374 -8.491 1.00 0.76 H new ATOM 0 HA GLU B 75 -1.468 7.416 -6.871 1.00 0.59 H new ATOM 0 HB2 GLU B 75 -1.650 6.388 -9.643 1.00 0.72 H new ATOM 0 HB3 GLU B 75 -3.130 7.058 -8.987 1.00 0.72 H new ATOM 0 HG2 GLU B 75 -1.786 8.782 -10.162 1.00 1.30 H new ATOM 0 HG3 GLU B 75 -2.012 9.180 -8.470 1.00 1.30 H new ATOM 2837 N TYR B 76 -2.978 4.496 -7.244 1.00 0.50 N ATOM 2838 CA TYR B 76 -3.789 3.566 -6.466 1.00 0.57 C ATOM 2839 C TYR B 76 -3.324 3.630 -5.007 1.00 0.57 C ATOM 2840 O TYR B 76 -4.111 3.918 -4.104 1.00 0.66 O ATOM 2841 CB TYR B 76 -3.675 2.158 -7.077 1.00 0.67 C ATOM 2842 CG TYR B 76 -3.887 0.980 -6.137 1.00 1.05 C ATOM 2843 CD1 TYR B 76 -2.802 0.489 -5.383 1.00 2.07 C ATOM 2844 CD2 TYR B 76 -5.062 0.210 -6.228 1.00 1.69 C ATOM 2845 CE1 TYR B 76 -2.906 -0.723 -4.690 1.00 2.46 C ATOM 2846 CE2 TYR B 76 -5.151 -1.029 -5.569 1.00 1.96 C ATOM 2847 CZ TYR B 76 -4.064 -1.501 -4.812 1.00 1.96 C ATOM 2848 OH TYR B 76 -4.093 -2.735 -4.241 1.00 2.44 O ATOM 0 H TYR B 76 -2.578 4.104 -8.096 1.00 0.50 H new ATOM 0 HA TYR B 76 -4.846 3.833 -6.490 1.00 0.57 H new ATOM 0 HB2 TYR B 76 -4.400 2.080 -7.887 1.00 0.67 H new ATOM 0 HB3 TYR B 76 -2.686 2.061 -7.524 1.00 0.67 H new ATOM 0 HD1 TYR B 76 -1.882 1.053 -5.339 1.00 2.07 H new ATOM 0 HD2 TYR B 76 -5.899 0.573 -6.807 1.00 1.69 H new ATOM 0 HE1 TYR B 76 -2.094 -1.058 -4.062 1.00 2.46 H new ATOM 0 HE2 TYR B 76 -6.053 -1.618 -5.644 1.00 1.96 H new ATOM 0 HH TYR B 76 -3.517 -2.742 -3.448 1.00 2.44 H new ATOM 2858 N TRP B 77 -2.026 3.397 -4.801 1.00 0.53 N ATOM 2859 CA TRP B 77 -1.411 3.236 -3.503 1.00 0.50 C ATOM 2860 C TRP B 77 -1.789 4.373 -2.569 1.00 0.50 C ATOM 2861 O TRP B 77 -2.474 4.139 -1.580 1.00 0.55 O ATOM 2862 CB TRP B 77 0.094 3.125 -3.657 1.00 0.52 C ATOM 2863 CG TRP B 77 0.634 2.055 -2.821 1.00 0.52 C ATOM 2864 CD1 TRP B 77 0.987 2.242 -1.543 1.00 0.50 C ATOM 2865 CD2 TRP B 77 1.138 0.755 -3.214 1.00 0.50 C ATOM 2866 NE1 TRP B 77 1.633 1.136 -1.085 1.00 0.47 N ATOM 2867 CE2 TRP B 77 1.928 0.300 -2.134 1.00 0.49 C ATOM 2868 CE3 TRP B 77 1.166 -0.010 -4.402 1.00 0.55 C ATOM 2869 CZ2 TRP B 77 2.841 -0.724 -2.286 1.00 0.77 C ATOM 2870 CZ3 TRP B 77 2.104 -1.047 -4.551 1.00 0.58 C ATOM 2871 CH2 TRP B 77 3.029 -1.305 -3.539 1.00 0.95 C ATOM 0 H TRP B 77 -1.359 3.314 -5.568 1.00 0.53 H new ATOM 0 HA TRP B 77 -1.783 2.316 -3.053 1.00 0.50 H new ATOM 0 HB2 TRP B 77 0.342 2.934 -4.701 1.00 0.52 H new ATOM 0 HB3 TRP B 77 0.561 4.072 -3.386 1.00 0.52 H new ATOM 0 HD1 TRP B 77 0.789 3.133 -0.965 1.00 0.50 H new ATOM 0 HE1 TRP B 77 1.864 0.955 -0.108 1.00 0.47 H new ATOM 0 HE3 TRP B 77 0.466 0.202 -5.197 1.00 0.55 H new ATOM 0 HZ2 TRP B 77 3.408 -1.074 -1.436 1.00 0.77 H new ATOM 0 HZ3 TRP B 77 2.108 -1.645 -5.450 1.00 0.58 H new ATOM 0 HH2 TRP B 77 3.879 -1.946 -3.724 1.00 0.95 H new ATOM 2882 N ARG B 78 -1.343 5.597 -2.872 1.00 0.49 N ATOM 2883 CA ARG B 78 -1.626 6.757 -2.045 1.00 0.58 C ATOM 2884 C ARG B 78 -3.113 6.820 -1.664 1.00 0.65 C ATOM 2885 O ARG B 78 -3.418 6.971 -0.484 1.00 0.72 O ATOM 2886 CB ARG B 78 -1.046 8.034 -2.685 1.00 0.75 C ATOM 2887 CG ARG B 78 -1.736 8.593 -3.935 1.00 1.43 C ATOM 2888 CD ARG B 78 -0.717 9.129 -4.956 1.00 1.33 C ATOM 2889 NE ARG B 78 0.259 10.072 -4.382 1.00 2.06 N ATOM 2890 CZ ARG B 78 1.561 10.113 -4.730 1.00 3.19 C ATOM 2891 NH1 ARG B 78 2.007 9.442 -5.793 1.00 3.71 N ATOM 2892 NH2 ARG B 78 2.425 10.812 -3.995 1.00 4.70 N ATOM 0 H ARG B 78 -0.778 5.803 -3.696 1.00 0.49 H new ATOM 0 HA ARG B 78 -1.111 6.665 -1.089 1.00 0.58 H new ATOM 0 HB2 ARG B 78 -1.046 8.817 -1.926 1.00 0.75 H new ATOM 0 HB3 ARG B 78 -0.005 7.836 -2.939 1.00 0.75 H new ATOM 0 HG2 ARG B 78 -2.339 7.812 -4.398 1.00 1.43 H new ATOM 0 HG3 ARG B 78 -2.418 9.393 -3.647 1.00 1.43 H new ATOM 0 HD2 ARG B 78 -0.181 8.288 -5.396 1.00 1.33 H new ATOM 0 HD3 ARG B 78 -1.254 9.624 -5.766 1.00 1.33 H new ATOM 0 HE ARG B 78 -0.070 10.734 -3.679 1.00 2.06 H new ATOM 0 HH11 ARG B 78 1.360 8.888 -6.355 1.00 3.71 H new ATOM 0 HH12 ARG B 78 2.995 9.483 -6.044 1.00 3.71 H new ATOM 0 HH21 ARG B 78 2.101 11.316 -3.169 1.00 4.70 H new ATOM 0 HH22 ARG B 78 3.410 10.843 -4.258 1.00 4.70 H new ATOM 2906 N LEU B 79 -4.044 6.609 -2.605 1.00 0.68 N ATOM 2907 CA LEU B 79 -5.467 6.616 -2.269 1.00 0.80 C ATOM 2908 C LEU B 79 -5.845 5.464 -1.329 1.00 0.71 C ATOM 2909 O LEU B 79 -6.601 5.691 -0.384 1.00 0.76 O ATOM 2910 CB LEU B 79 -6.368 6.656 -3.515 1.00 0.97 C ATOM 2911 CG LEU B 79 -6.570 8.085 -4.056 1.00 1.33 C ATOM 2912 CD1 LEU B 79 -5.274 8.828 -4.387 1.00 1.39 C ATOM 2913 CD2 LEU B 79 -7.457 8.058 -5.308 1.00 1.81 C ATOM 0 H LEU B 79 -3.838 6.434 -3.589 1.00 0.68 H new ATOM 0 HA LEU B 79 -5.646 7.544 -1.726 1.00 0.80 H new ATOM 0 HB2 LEU B 79 -5.929 6.035 -4.296 1.00 0.97 H new ATOM 0 HB3 LEU B 79 -7.338 6.224 -3.271 1.00 0.97 H new ATOM 0 HG LEU B 79 -7.047 8.633 -3.243 1.00 1.33 H new ATOM 0 HD11 LEU B 79 -5.511 9.824 -4.761 1.00 1.39 H new ATOM 0 HD12 LEU B 79 -4.664 8.913 -3.488 1.00 1.39 H new ATOM 0 HD13 LEU B 79 -4.723 8.276 -5.149 1.00 1.39 H new ATOM 0 HD21 LEU B 79 -7.592 9.074 -5.680 1.00 1.81 H new ATOM 0 HD22 LEU B 79 -6.982 7.450 -6.078 1.00 1.81 H new ATOM 0 HD23 LEU B 79 -8.428 7.632 -5.057 1.00 1.81 H new ATOM 2925 N ILE B 80 -5.358 4.232 -1.532 1.00 0.63 N ATOM 2926 CA ILE B 80 -5.662 3.180 -0.555 1.00 0.58 C ATOM 2927 C ILE B 80 -5.029 3.529 0.811 1.00 0.57 C ATOM 2928 O ILE B 80 -5.581 3.187 1.853 1.00 0.57 O ATOM 2929 CB ILE B 80 -5.397 1.734 -1.053 1.00 0.56 C ATOM 2930 CG1 ILE B 80 -4.015 1.220 -0.656 1.00 0.67 C ATOM 2931 CG2 ILE B 80 -5.531 1.587 -2.564 1.00 0.75 C ATOM 2932 CD1 ILE B 80 -3.730 -0.248 -0.979 1.00 0.48 C ATOM 0 H ILE B 80 -4.780 3.948 -2.323 1.00 0.63 H new ATOM 0 HA ILE B 80 -6.743 3.165 -0.414 1.00 0.58 H new ATOM 0 HB ILE B 80 -6.168 1.139 -0.563 1.00 0.56 H new ATOM 0 HG12 ILE B 80 -3.264 1.834 -1.153 1.00 0.67 H new ATOM 0 HG13 ILE B 80 -3.888 1.367 0.417 1.00 0.67 H new ATOM 0 HG21 ILE B 80 -5.334 0.553 -2.848 1.00 0.75 H new ATOM 0 HG22 ILE B 80 -6.541 1.860 -2.868 1.00 0.75 H new ATOM 0 HG23 ILE B 80 -4.814 2.242 -3.058 1.00 0.75 H new ATOM 0 HD11 ILE B 80 -2.721 -0.503 -0.654 1.00 0.48 H new ATOM 0 HD12 ILE B 80 -4.450 -0.881 -0.460 1.00 0.48 H new ATOM 0 HD13 ILE B 80 -3.816 -0.407 -2.054 1.00 0.48 H new ATOM 2944 N GLY B 81 -3.895 4.237 0.808 1.00 0.60 N ATOM 2945 CA GLY B 81 -3.285 4.851 1.983 1.00 0.63 C ATOM 2946 C GLY B 81 -4.269 5.764 2.693 1.00 0.64 C ATOM 2947 O GLY B 81 -4.544 5.601 3.883 1.00 0.64 O ATOM 0 H GLY B 81 -3.361 4.402 -0.045 1.00 0.60 H new ATOM 0 HA2 GLY B 81 -2.945 4.075 2.668 1.00 0.63 H new ATOM 0 HA3 GLY B 81 -2.405 5.421 1.684 1.00 0.63 H new ATOM 2951 N GLU B 82 -4.818 6.720 1.947 1.00 0.72 N ATOM 2952 CA GLU B 82 -5.848 7.594 2.463 1.00 0.80 C ATOM 2953 C GLU B 82 -6.999 6.768 3.039 1.00 0.84 C ATOM 2954 O GLU B 82 -7.431 7.011 4.164 1.00 0.89 O ATOM 2955 CB GLU B 82 -6.310 8.570 1.370 1.00 0.83 C ATOM 2956 CG GLU B 82 -5.207 9.532 0.895 1.00 0.80 C ATOM 2957 CD GLU B 82 -4.538 10.285 2.033 1.00 2.72 C ATOM 2958 OE1 GLU B 82 -5.238 10.532 3.037 1.00 4.08 O ATOM 2959 OE2 GLU B 82 -3.331 10.584 1.919 1.00 3.65 O ATOM 0 H GLU B 82 -4.559 6.903 0.978 1.00 0.72 H new ATOM 0 HA GLU B 82 -5.446 8.195 3.279 1.00 0.80 H new ATOM 0 HB2 GLU B 82 -6.675 7.999 0.516 1.00 0.83 H new ATOM 0 HB3 GLU B 82 -7.151 9.153 1.747 1.00 0.83 H new ATOM 0 HG2 GLU B 82 -4.452 8.967 0.348 1.00 0.80 H new ATOM 0 HG3 GLU B 82 -5.636 10.250 0.196 1.00 0.80 H new ATOM 2966 N LEU B 83 -7.460 5.750 2.309 1.00 0.82 N ATOM 2967 CA LEU B 83 -8.509 4.874 2.795 1.00 0.84 C ATOM 2968 C LEU B 83 -8.130 4.247 4.137 1.00 0.79 C ATOM 2969 O LEU B 83 -8.928 4.313 5.075 1.00 0.89 O ATOM 2970 CB LEU B 83 -8.905 3.878 1.701 1.00 0.87 C ATOM 2971 CG LEU B 83 -10.171 3.082 2.049 1.00 1.49 C ATOM 2972 CD1 LEU B 83 -10.900 2.697 0.757 1.00 1.72 C ATOM 2973 CD2 LEU B 83 -9.801 1.809 2.816 1.00 2.96 C ATOM 0 H LEU B 83 -7.117 5.518 1.377 1.00 0.82 H new ATOM 0 HA LEU B 83 -9.408 5.450 3.012 1.00 0.84 H new ATOM 0 HB2 LEU B 83 -9.066 4.416 0.767 1.00 0.87 H new ATOM 0 HB3 LEU B 83 -8.081 3.185 1.532 1.00 0.87 H new ATOM 0 HG LEU B 83 -10.818 3.700 2.672 1.00 1.49 H new ATOM 0 HD11 LEU B 83 -11.799 2.132 1.001 1.00 1.72 H new ATOM 0 HD12 LEU B 83 -11.176 3.600 0.212 1.00 1.72 H new ATOM 0 HD13 LEU B 83 -10.244 2.085 0.138 1.00 1.72 H new ATOM 0 HD21 LEU B 83 -10.707 1.253 3.057 1.00 2.96 H new ATOM 0 HD22 LEU B 83 -9.149 1.190 2.200 1.00 2.96 H new ATOM 0 HD23 LEU B 83 -9.284 2.077 3.737 1.00 2.96 H new ATOM 2985 N ALA B 84 -6.920 3.687 4.266 1.00 0.68 N ATOM 2986 CA ALA B 84 -6.427 3.198 5.546 1.00 0.70 C ATOM 2987 C ALA B 84 -6.571 4.229 6.677 1.00 0.81 C ATOM 2988 O ALA B 84 -6.838 3.829 7.808 1.00 0.87 O ATOM 2989 CB ALA B 84 -4.983 2.702 5.413 1.00 0.66 C ATOM 0 H ALA B 84 -6.267 3.564 3.492 1.00 0.68 H new ATOM 0 HA ALA B 84 -7.057 2.355 5.830 1.00 0.70 H new ATOM 0 HB1 ALA B 84 -4.632 2.341 6.380 1.00 0.66 H new ATOM 0 HB2 ALA B 84 -4.942 1.891 4.686 1.00 0.66 H new ATOM 0 HB3 ALA B 84 -4.346 3.521 5.079 1.00 0.66 H new ATOM 2995 N LYS B 85 -6.401 5.534 6.412 1.00 0.90 N ATOM 2996 CA LYS B 85 -6.656 6.556 7.432 1.00 1.07 C ATOM 2997 C LYS B 85 -8.157 6.800 7.634 1.00 1.11 C ATOM 2998 O LYS B 85 -8.595 7.057 8.755 1.00 1.28 O ATOM 2999 CB LYS B 85 -5.842 7.852 7.196 1.00 1.38 C ATOM 3000 CG LYS B 85 -6.479 8.933 6.292 1.00 1.16 C ATOM 3001 CD LYS B 85 -6.589 10.316 6.963 1.00 1.67 C ATOM 3002 CE LYS B 85 -5.387 11.240 6.710 1.00 2.00 C ATOM 3003 NZ LYS B 85 -5.266 11.618 5.285 1.00 2.45 N ATOM 0 H LYS B 85 -6.092 5.900 5.512 1.00 0.90 H new ATOM 0 HA LYS B 85 -6.287 6.161 8.379 1.00 1.07 H new ATOM 0 HB2 LYS B 85 -5.636 8.303 8.167 1.00 1.38 H new ATOM 0 HB3 LYS B 85 -4.881 7.573 6.763 1.00 1.38 H new ATOM 0 HG2 LYS B 85 -5.888 9.027 5.381 1.00 1.16 H new ATOM 0 HG3 LYS B 85 -7.474 8.604 5.993 1.00 1.16 H new ATOM 0 HD2 LYS B 85 -7.493 10.809 6.606 1.00 1.67 H new ATOM 0 HD3 LYS B 85 -6.705 10.177 8.038 1.00 1.67 H new ATOM 0 HE2 LYS B 85 -5.488 12.140 7.316 1.00 2.00 H new ATOM 0 HE3 LYS B 85 -4.473 10.741 7.031 1.00 2.00 H new ATOM 0 HZ1 LYS B 85 -4.787 12.538 5.209 1.00 2.45 H new ATOM 0 HZ2 LYS B 85 -4.712 10.897 4.780 1.00 2.45 H new ATOM 0 HZ3 LYS B 85 -6.214 11.685 4.862 1.00 2.45 H new ATOM 3017 N GLU B 86 -8.930 6.758 6.545 1.00 1.01 N ATOM 3018 CA GLU B 86 -10.356 7.102 6.521 1.00 1.13 C ATOM 3019 C GLU B 86 -11.091 6.086 7.401 1.00 1.11 C ATOM 3020 O GLU B 86 -11.713 6.455 8.395 1.00 1.18 O ATOM 3021 CB GLU B 86 -10.954 7.180 5.077 1.00 1.19 C ATOM 3022 CG GLU B 86 -11.141 8.400 4.102 1.00 1.20 C ATOM 3023 CD GLU B 86 -11.124 7.920 2.661 1.00 1.39 C ATOM 3024 OE1 GLU B 86 -11.281 6.700 2.457 1.00 2.12 O ATOM 3025 OE2 GLU B 86 -11.007 8.747 1.732 1.00 2.45 O ATOM 0 H GLU B 86 -8.573 6.477 5.632 1.00 1.01 H new ATOM 0 HA GLU B 86 -10.487 8.110 6.916 1.00 1.13 H new ATOM 0 HB2 GLU B 86 -10.365 6.465 4.503 1.00 1.19 H new ATOM 0 HB3 GLU B 86 -11.955 6.760 5.177 1.00 1.19 H new ATOM 0 HG2 GLU B 86 -12.083 8.905 4.315 1.00 1.20 H new ATOM 0 HG3 GLU B 86 -10.346 9.128 4.261 1.00 1.20 H new ATOM 3032 N ILE B 87 -11.013 4.799 7.054 1.00 1.08 N ATOM 3033 CA ILE B 87 -11.706 3.739 7.774 1.00 1.08 C ATOM 3034 C ILE B 87 -10.897 3.337 9.019 1.00 1.15 C ATOM 3035 O ILE B 87 -9.785 2.823 8.932 1.00 1.24 O ATOM 3036 CB ILE B 87 -12.024 2.579 6.806 1.00 1.09 C ATOM 3037 CG1 ILE B 87 -13.193 1.682 7.255 1.00 1.22 C ATOM 3038 CG2 ILE B 87 -10.807 1.728 6.425 1.00 1.40 C ATOM 3039 CD1 ILE B 87 -13.063 1.070 8.655 1.00 1.83 C ATOM 0 H ILE B 87 -10.464 4.466 6.262 1.00 1.08 H new ATOM 0 HA ILE B 87 -12.669 4.084 8.151 1.00 1.08 H new ATOM 0 HB ILE B 87 -12.348 3.099 5.904 1.00 1.09 H new ATOM 0 HG12 ILE B 87 -14.111 2.268 7.219 1.00 1.22 H new ATOM 0 HG13 ILE B 87 -13.303 0.872 6.534 1.00 1.22 H new ATOM 0 HG21 ILE B 87 -11.116 0.936 5.743 1.00 1.40 H new ATOM 0 HG22 ILE B 87 -10.062 2.356 5.937 1.00 1.40 H new ATOM 0 HG23 ILE B 87 -10.377 1.286 7.323 1.00 1.40 H new ATOM 0 HD11 ILE B 87 -13.940 0.458 8.868 1.00 1.83 H new ATOM 0 HD12 ILE B 87 -12.168 0.449 8.699 1.00 1.83 H new ATOM 0 HD13 ILE B 87 -12.989 1.867 9.395 1.00 1.83 H new ATOM 3051 N ARG B 88 -11.474 3.540 10.208 1.00 1.22 N ATOM 3052 CA ARG B 88 -10.813 3.218 11.464 1.00 1.36 C ATOM 3053 C ARG B 88 -10.949 1.717 11.741 1.00 1.25 C ATOM 3054 O ARG B 88 -11.826 1.275 12.476 1.00 1.51 O ATOM 3055 CB ARG B 88 -11.399 4.060 12.606 1.00 1.62 C ATOM 3056 CG ARG B 88 -11.051 5.547 12.443 1.00 2.15 C ATOM 3057 CD ARG B 88 -11.483 6.331 13.690 1.00 2.79 C ATOM 3058 NE ARG B 88 -11.066 7.741 13.604 1.00 3.77 N ATOM 3059 CZ ARG B 88 -11.177 8.634 14.602 1.00 4.72 C ATOM 3060 NH1 ARG B 88 -11.743 8.274 15.759 1.00 5.22 N ATOM 3061 NH2 ARG B 88 -10.722 9.883 14.440 1.00 5.81 N ATOM 0 H ARG B 88 -12.409 3.931 10.320 1.00 1.22 H new ATOM 0 HA ARG B 88 -9.752 3.459 11.393 1.00 1.36 H new ATOM 0 HB2 ARG B 88 -12.482 3.939 12.630 1.00 1.62 H new ATOM 0 HB3 ARG B 88 -11.016 3.698 13.560 1.00 1.62 H new ATOM 0 HG2 ARG B 88 -9.979 5.662 12.285 1.00 2.15 H new ATOM 0 HG3 ARG B 88 -11.548 5.950 11.561 1.00 2.15 H new ATOM 0 HD2 ARG B 88 -12.566 6.275 13.801 1.00 2.79 H new ATOM 0 HD3 ARG B 88 -11.048 5.874 14.579 1.00 2.79 H new ATOM 0 HE ARG B 88 -10.664 8.063 12.724 1.00 3.77 H new ATOM 0 HH11 ARG B 88 -12.090 7.323 15.883 1.00 5.22 H new ATOM 0 HH12 ARG B 88 -11.828 8.951 16.517 1.00 5.22 H new ATOM 0 HH21 ARG B 88 -10.290 10.158 13.558 1.00 5.81 H new ATOM 0 HH22 ARG B 88 -10.807 10.559 15.199 1.00 5.81 H new ATOM 3075 N LYS B 89 -10.010 0.957 11.167 1.00 1.17 N ATOM 3076 CA LYS B 89 -9.812 -0.492 11.276 1.00 1.11 C ATOM 3077 C LYS B 89 -9.824 -1.060 12.710 1.00 1.37 C ATOM 3078 O LYS B 89 -9.884 -2.277 12.879 1.00 1.21 O ATOM 3079 CB LYS B 89 -8.547 -0.883 10.485 1.00 1.73 C ATOM 3080 CG LYS B 89 -8.769 -0.618 8.983 1.00 1.67 C ATOM 3081 CD LYS B 89 -7.562 -0.899 8.071 1.00 1.49 C ATOM 3082 CE LYS B 89 -7.462 -2.379 7.681 1.00 2.28 C ATOM 3083 NZ LYS B 89 -8.530 -2.802 6.746 1.00 3.03 N ATOM 0 H LYS B 89 -9.307 1.378 10.560 1.00 1.17 H new ATOM 0 HA LYS B 89 -10.688 -0.966 10.833 1.00 1.11 H new ATOM 0 HB2 LYS B 89 -7.692 -0.310 10.842 1.00 1.73 H new ATOM 0 HB3 LYS B 89 -8.316 -1.936 10.648 1.00 1.73 H new ATOM 0 HG2 LYS B 89 -9.606 -1.228 8.645 1.00 1.67 H new ATOM 0 HG3 LYS B 89 -9.062 0.424 8.856 1.00 1.67 H new ATOM 0 HD2 LYS B 89 -7.641 -0.292 7.169 1.00 1.49 H new ATOM 0 HD3 LYS B 89 -6.647 -0.596 8.579 1.00 1.49 H new ATOM 0 HE2 LYS B 89 -6.491 -2.564 7.223 1.00 2.28 H new ATOM 0 HE3 LYS B 89 -7.511 -2.991 8.582 1.00 2.28 H new ATOM 0 HZ1 LYS B 89 -8.747 -3.807 6.899 1.00 3.03 H new ATOM 0 HZ2 LYS B 89 -9.384 -2.234 6.915 1.00 3.03 H new ATOM 0 HZ3 LYS B 89 -8.209 -2.662 5.767 1.00 3.03 H new ATOM 3097 N LYS B 90 -9.689 -0.215 13.738 1.00 2.13 N ATOM 3098 CA LYS B 90 -9.648 -0.568 15.157 1.00 2.83 C ATOM 3099 C LYS B 90 -8.293 -1.188 15.505 1.00 1.73 C ATOM 3100 O LYS B 90 -7.482 -0.580 16.199 1.00 2.04 O ATOM 3101 CB LYS B 90 -10.798 -1.505 15.608 1.00 4.60 C ATOM 3102 CG LYS B 90 -12.230 -1.056 15.278 1.00 5.93 C ATOM 3103 CD LYS B 90 -13.214 -2.070 15.900 1.00 7.81 C ATOM 3104 CE LYS B 90 -14.688 -1.724 15.623 1.00 9.19 C ATOM 3105 NZ LYS B 90 -15.638 -2.591 16.364 1.00 10.78 N ATOM 0 H LYS B 90 -9.601 0.790 13.591 1.00 2.13 H new ATOM 0 HA LYS B 90 -9.788 0.364 15.705 1.00 2.83 H new ATOM 0 HB2 LYS B 90 -10.636 -2.483 15.155 1.00 4.60 H new ATOM 0 HB3 LYS B 90 -10.724 -1.638 16.687 1.00 4.60 H new ATOM 0 HG2 LYS B 90 -12.415 -0.057 15.673 1.00 5.93 H new ATOM 0 HG3 LYS B 90 -12.372 -1.003 14.199 1.00 5.93 H new ATOM 0 HD2 LYS B 90 -13.000 -3.064 15.507 1.00 7.81 H new ATOM 0 HD3 LYS B 90 -13.052 -2.111 16.977 1.00 7.81 H new ATOM 0 HE2 LYS B 90 -14.868 -0.684 15.894 1.00 9.19 H new ATOM 0 HE3 LYS B 90 -14.881 -1.813 14.554 1.00 9.19 H new ATOM 0 HZ1 LYS B 90 -16.613 -2.310 16.137 1.00 10.78 H new ATOM 0 HZ2 LYS B 90 -15.490 -3.583 16.089 1.00 10.78 H new ATOM 0 HZ3 LYS B 90 -15.477 -2.488 17.386 1.00 10.78 H new ATOM 3119 N LYS B 91 -8.083 -2.413 15.025 1.00 1.72 N ATOM 3120 CA LYS B 91 -7.001 -3.324 15.373 1.00 2.80 C ATOM 3121 C LYS B 91 -7.311 -4.647 14.680 1.00 3.09 C ATOM 3122 O LYS B 91 -6.479 -5.176 13.945 1.00 3.85 O ATOM 3123 CB LYS B 91 -6.874 -3.481 16.905 1.00 3.92 C ATOM 3124 CG LYS B 91 -6.057 -4.708 17.357 1.00 5.45 C ATOM 3125 CD LYS B 91 -5.688 -4.648 18.850 1.00 6.60 C ATOM 3126 CE LYS B 91 -4.525 -3.698 19.209 1.00 7.75 C ATOM 3127 NZ LYS B 91 -3.188 -4.305 19.017 1.00 9.69 N ATOM 0 H LYS B 91 -8.712 -2.821 14.333 1.00 1.72 H new ATOM 0 HA LYS B 91 -6.037 -2.940 15.040 1.00 2.80 H new ATOM 0 HB2 LYS B 91 -6.411 -2.582 17.312 1.00 3.92 H new ATOM 0 HB3 LYS B 91 -7.874 -3.548 17.335 1.00 3.92 H new ATOM 0 HG2 LYS B 91 -6.630 -5.615 17.163 1.00 5.45 H new ATOM 0 HG3 LYS B 91 -5.146 -4.774 16.762 1.00 5.45 H new ATOM 0 HD2 LYS B 91 -6.570 -4.343 19.413 1.00 6.60 H new ATOM 0 HD3 LYS B 91 -5.429 -5.653 19.183 1.00 6.60 H new ATOM 0 HE2 LYS B 91 -4.599 -2.799 18.598 1.00 7.75 H new ATOM 0 HE3 LYS B 91 -4.628 -3.386 20.248 1.00 7.75 H new ATOM 0 HZ1 LYS B 91 -2.459 -3.566 19.077 1.00 9.69 H new ATOM 0 HZ2 LYS B 91 -3.021 -5.017 19.756 1.00 9.69 H new ATOM 0 HZ3 LYS B 91 -3.144 -4.759 18.083 1.00 9.69 H new ATOM 3141 N ASP B 92 -8.528 -5.152 14.910 1.00 2.92 N ATOM 3142 CA ASP B 92 -9.020 -6.412 14.374 1.00 3.32 C ATOM 3143 C ASP B 92 -10.144 -6.142 13.380 1.00 2.34 C ATOM 3144 O ASP B 92 -11.309 -6.429 13.647 1.00 2.53 O ATOM 3145 CB ASP B 92 -9.468 -7.322 15.526 1.00 4.55 C ATOM 3146 CG ASP B 92 -9.834 -8.711 15.033 1.00 6.09 C ATOM 3147 OD1 ASP B 92 -8.947 -9.392 14.467 1.00 7.35 O ATOM 3148 OD2 ASP B 92 -10.957 -9.184 15.314 1.00 6.73 O ATOM 0 H ASP B 92 -9.215 -4.674 15.494 1.00 2.92 H new ATOM 0 HA ASP B 92 -8.225 -6.930 13.837 1.00 3.32 H new ATOM 0 HB2 ASP B 92 -8.669 -7.396 16.263 1.00 4.55 H new ATOM 0 HB3 ASP B 92 -10.326 -6.876 16.030 1.00 4.55 H new ATOM 3153 N LEU B 93 -9.790 -5.591 12.217 1.00 1.66 N ATOM 3154 CA LEU B 93 -10.730 -5.346 11.129 1.00 1.10 C ATOM 3155 C LEU B 93 -11.610 -6.569 10.832 1.00 0.97 C ATOM 3156 O LEU B 93 -12.786 -6.411 10.519 1.00 0.98 O ATOM 3157 CB LEU B 93 -10.052 -4.767 9.875 1.00 1.75 C ATOM 3158 CG LEU B 93 -8.779 -5.420 9.301 1.00 1.47 C ATOM 3159 CD1 LEU B 93 -7.535 -5.240 10.182 1.00 2.16 C ATOM 3160 CD2 LEU B 93 -8.975 -6.873 8.876 1.00 2.18 C ATOM 0 H LEU B 93 -8.835 -5.301 12.005 1.00 1.66 H new ATOM 0 HA LEU B 93 -11.408 -4.567 11.477 1.00 1.10 H new ATOM 0 HB2 LEU B 93 -10.797 -4.762 9.080 1.00 1.75 H new ATOM 0 HB3 LEU B 93 -9.810 -3.727 10.092 1.00 1.75 H new ATOM 0 HG LEU B 93 -8.582 -4.858 8.388 1.00 1.47 H new ATOM 0 HD11 LEU B 93 -6.682 -5.727 9.710 1.00 2.16 H new ATOM 0 HD12 LEU B 93 -7.325 -4.177 10.303 1.00 2.16 H new ATOM 0 HD13 LEU B 93 -7.714 -5.688 11.160 1.00 2.16 H new ATOM 0 HD21 LEU B 93 -8.038 -7.266 8.482 1.00 2.18 H new ATOM 0 HD22 LEU B 93 -9.284 -7.465 9.737 1.00 2.18 H new ATOM 0 HD23 LEU B 93 -9.743 -6.926 8.105 1.00 2.18 H new ATOM 3172 N LYS B 94 -11.075 -7.780 11.046 1.00 1.17 N ATOM 3173 CA LYS B 94 -11.764 -9.054 10.864 1.00 1.19 C ATOM 3174 C LYS B 94 -13.107 -9.131 11.600 1.00 1.19 C ATOM 3175 O LYS B 94 -13.921 -10.005 11.299 1.00 1.26 O ATOM 3176 CB LYS B 94 -10.891 -10.205 11.391 1.00 1.49 C ATOM 3177 CG LYS B 94 -9.497 -10.370 10.770 1.00 2.61 C ATOM 3178 CD LYS B 94 -9.465 -11.090 9.414 1.00 3.72 C ATOM 3179 CE LYS B 94 -8.025 -10.985 8.883 1.00 5.26 C ATOM 3180 NZ LYS B 94 -7.861 -11.413 7.473 1.00 6.65 N ATOM 0 H LYS B 94 -10.113 -7.897 11.363 1.00 1.17 H new ATOM 0 HA LYS B 94 -11.949 -9.138 9.793 1.00 1.19 H new ATOM 0 HB2 LYS B 94 -10.768 -10.071 12.466 1.00 1.49 H new ATOM 0 HB3 LYS B 94 -11.438 -11.137 11.246 1.00 1.49 H new ATOM 0 HG2 LYS B 94 -9.052 -9.382 10.649 1.00 2.61 H new ATOM 0 HG3 LYS B 94 -8.868 -10.920 11.470 1.00 2.61 H new ATOM 0 HD2 LYS B 94 -9.760 -12.133 9.524 1.00 3.72 H new ATOM 0 HD3 LYS B 94 -10.167 -10.632 8.717 1.00 3.72 H new ATOM 0 HE2 LYS B 94 -7.690 -9.952 8.978 1.00 5.26 H new ATOM 0 HE3 LYS B 94 -7.373 -11.591 9.512 1.00 5.26 H new ATOM 0 HZ1 LYS B 94 -6.992 -11.977 7.380 1.00 6.65 H new ATOM 0 HZ2 LYS B 94 -8.679 -11.988 7.187 1.00 6.65 H new ATOM 0 HZ3 LYS B 94 -7.796 -10.575 6.861 1.00 6.65 H new ATOM 3194 N ILE B 95 -13.312 -8.274 12.603 1.00 1.30 N ATOM 3195 CA ILE B 95 -14.550 -8.167 13.358 1.00 1.52 C ATOM 3196 C ILE B 95 -15.713 -7.618 12.510 1.00 1.54 C ATOM 3197 O ILE B 95 -16.877 -7.743 12.901 1.00 1.89 O ATOM 3198 CB ILE B 95 -14.269 -7.354 14.637 1.00 1.81 C ATOM 3199 CG1 ILE B 95 -15.205 -7.724 15.791 1.00 2.07 C ATOM 3200 CG2 ILE B 95 -14.340 -5.848 14.396 1.00 2.91 C ATOM 3201 CD1 ILE B 95 -14.692 -8.961 16.516 1.00 2.59 C ATOM 0 H ILE B 95 -12.596 -7.619 12.917 1.00 1.30 H new ATOM 0 HA ILE B 95 -14.892 -9.160 13.652 1.00 1.52 H new ATOM 0 HB ILE B 95 -13.250 -7.618 14.921 1.00 1.81 H new ATOM 0 HG12 ILE B 95 -15.279 -6.890 16.489 1.00 2.07 H new ATOM 0 HG13 ILE B 95 -16.209 -7.909 15.408 1.00 2.07 H new ATOM 0 HG21 ILE B 95 -14.135 -5.320 15.327 1.00 2.91 H new ATOM 0 HG22 ILE B 95 -13.600 -5.564 13.647 1.00 2.91 H new ATOM 0 HG23 ILE B 95 -15.336 -5.583 14.041 1.00 2.91 H new ATOM 0 HD11 ILE B 95 -15.369 -9.210 17.333 1.00 2.59 H new ATOM 0 HD12 ILE B 95 -14.642 -9.797 15.818 1.00 2.59 H new ATOM 0 HD13 ILE B 95 -13.698 -8.762 16.916 1.00 2.59 H new ATOM 3213 N ARG B 96 -15.411 -6.966 11.378 1.00 1.36 N ATOM 3214 CA ARG B 96 -16.351 -6.519 10.350 1.00 1.55 C ATOM 3215 C ARG B 96 -17.095 -5.252 10.780 1.00 2.05 C ATOM 3216 O ARG B 96 -17.013 -4.210 10.133 1.00 2.90 O ATOM 3217 CB ARG B 96 -17.321 -7.648 9.972 1.00 1.79 C ATOM 3218 CG ARG B 96 -17.984 -7.389 8.618 1.00 2.49 C ATOM 3219 CD ARG B 96 -19.039 -8.461 8.337 1.00 2.56 C ATOM 3220 NE ARG B 96 -19.608 -8.283 6.992 1.00 3.61 N ATOM 3221 CZ ARG B 96 -20.544 -9.077 6.448 1.00 4.10 C ATOM 3222 NH1 ARG B 96 -20.986 -10.141 7.126 1.00 3.68 N ATOM 3223 NH2 ARG B 96 -21.029 -8.801 5.231 1.00 5.63 N ATOM 0 H ARG B 96 -14.448 -6.725 11.146 1.00 1.36 H new ATOM 0 HA ARG B 96 -15.777 -6.262 9.460 1.00 1.55 H new ATOM 0 HB2 ARG B 96 -16.783 -8.595 9.939 1.00 1.79 H new ATOM 0 HB3 ARG B 96 -18.087 -7.743 10.741 1.00 1.79 H new ATOM 0 HG2 ARG B 96 -18.447 -6.402 8.613 1.00 2.49 H new ATOM 0 HG3 ARG B 96 -17.232 -7.392 7.829 1.00 2.49 H new ATOM 0 HD2 ARG B 96 -18.591 -9.451 8.421 1.00 2.56 H new ATOM 0 HD3 ARG B 96 -19.831 -8.405 9.084 1.00 2.56 H new ATOM 0 HE ARG B 96 -19.267 -7.501 6.433 1.00 3.61 H new ATOM 0 HH11 ARG B 96 -20.612 -10.347 8.053 1.00 3.68 H new ATOM 0 HH12 ARG B 96 -21.697 -10.747 6.717 1.00 3.68 H new ATOM 0 HH21 ARG B 96 -20.687 -7.988 4.718 1.00 5.63 H new ATOM 0 HH22 ARG B 96 -21.740 -9.404 4.817 1.00 5.63 H new