USER MOD reduce.3.24.130724 H: found=0, std=0, add=1696, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1692 hydrogens (26 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 72 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0185) USER MOD Set 1.2: B 89 LYS NZ :NH3+ 174:sc= 0 (180deg=0) USER MOD Set 2.1: A 74 ASN : amide:sc= 0.789 K(o=0.8,f=-3.7!) USER MOD Set 2.2: B 85 LYS NZ :NH3+ 170:sc= 0.00756 (180deg=-0.0858) USER MOD Set 3.1: A 18 THR OG1 : rot -21:sc= 0.183 USER MOD Set 3.2: A 19 THR OG1 : rot -123:sc= 0.155 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 171:sc= 1.07 (180deg=0.915) USER MOD Single : A 7 THR OG1 : rot 99:sc= 0.263 USER MOD Single : A 12 SER OG : rot 61:sc= 0.782 USER MOD Single : A 15 THR OG1 : rot 72:sc= 0.839 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00584) USER MOD Single : A 32 SER OG : rot 140:sc= -0.415 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 74:sc= 0.423 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= -0.0455 K(o=-0.045,f=-2.8) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=-0.0015) USER MOD Single : A 51 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0197) USER MOD Single : A 55 SER OG : rot 18:sc= 0.271 USER MOD Single : A 59 LYS NZ :NH3+ 164:sc= 0.181 (180deg=0.11) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.0228 X(o=-0.023,f=0) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 SER OG : rot -43:sc= 0.622 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 156:sc= 0.406 (180deg=-0.0927) USER MOD Single : A 89 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000661) USER MOD Single : A 90 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0258) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0402) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ANW OAV : rot 166:sc= 0.391! USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 177:sc= -0.113 (180deg=-0.127) USER MOD Single : B 7 THR OG1 : rot 117:sc= 1.2 USER MOD Single : B 12 SER OG : rot 58:sc= 1.11 USER MOD Single : B 15 THR OG1 : rot 82:sc= 1.25 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 73:sc= 1.26 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot -66:sc= 0.298 USER MOD Single : B 34 SER OG : rot -170:sc= -0.0197 USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot 76:sc= 0.208 USER MOD Single : B 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 45 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : B 48 HIS : no HD1:sc= 0 X(o=0,f=-0.05) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 SER OG : rot 21:sc= 0.203 USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 MET CE :methyl -134:sc= 0 (180deg=-0.0116) USER MOD Single : B 61 LYS NZ :NH3+ -168:sc= -0.0429 (180deg=-0.193) USER MOD Single : B 62 SER OG : rot 96:sc= 0.619 USER MOD Single : B 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 ASN :FLIP amide:sc= 0.405 F(o=-0.24,f=0.41) USER MOD Single : B 76 TYR OH : rot 180:sc= -0.144 USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.776) USER MOD Single : B 98 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0107) USER MOD Single : B 99 ANW OAV : rot 179:sc= 0.591 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.502 16.771 7.002 1.00 1.04 N ATOM 2 CA MET A 1 7.753 15.952 6.933 1.00 0.91 C ATOM 3 C MET A 1 7.770 14.801 7.964 1.00 0.73 C ATOM 4 O MET A 1 8.305 13.727 7.673 1.00 0.96 O ATOM 5 CB MET A 1 9.012 16.843 7.081 1.00 1.31 C ATOM 6 CG MET A 1 9.237 17.460 8.470 1.00 1.57 C ATOM 7 SD MET A 1 10.661 18.573 8.514 1.00 2.18 S ATOM 8 CE MET A 1 10.905 18.781 10.276 1.00 2.71 C ATOM 0 H1 MET A 1 6.605 17.614 6.402 1.00 1.04 H new ATOM 0 H2 MET A 1 5.697 16.204 6.667 1.00 1.04 H new ATOM 0 H3 MET A 1 6.333 17.065 7.985 1.00 1.04 H new ATOM 0 HA MET A 1 7.768 15.491 5.945 1.00 0.91 H new ATOM 0 HB2 MET A 1 9.888 16.247 6.823 1.00 1.31 H new ATOM 0 HB3 MET A 1 8.950 17.651 6.352 1.00 1.31 H new ATOM 0 HG2 MET A 1 8.343 18.007 8.769 1.00 1.57 H new ATOM 0 HG3 MET A 1 9.381 16.662 9.199 1.00 1.57 H new ATOM 0 HE1 MET A 1 11.752 19.445 10.450 1.00 2.71 H new ATOM 0 HE2 MET A 1 10.008 19.214 10.719 1.00 2.71 H new ATOM 0 HE3 MET A 1 11.104 17.811 10.733 1.00 2.71 H new ATOM 20 N ALA A 2 7.190 15.027 9.163 1.00 0.77 N ATOM 21 CA ALA A 2 7.142 14.003 10.221 1.00 0.71 C ATOM 22 C ALA A 2 5.806 13.240 10.206 1.00 0.59 C ATOM 23 O ALA A 2 4.795 13.757 9.723 1.00 0.68 O ATOM 24 CB ALA A 2 7.379 14.640 11.588 1.00 1.02 C ATOM 0 H ALA A 2 6.749 15.911 9.419 1.00 0.77 H new ATOM 0 HA ALA A 2 7.937 13.283 10.025 1.00 0.71 H new ATOM 0 HB1 ALA A 2 7.341 13.871 12.359 1.00 1.02 H new ATOM 0 HB2 ALA A 2 8.358 15.119 11.601 1.00 1.02 H new ATOM 0 HB3 ALA A 2 6.608 15.386 11.781 1.00 1.02 H new ATOM 30 N ALA A 3 5.817 12.001 10.745 1.00 0.56 N ATOM 31 CA ALA A 3 4.620 11.147 10.805 1.00 0.54 C ATOM 32 C ALA A 3 3.989 11.190 12.208 1.00 0.55 C ATOM 33 O ALA A 3 4.636 10.807 13.191 1.00 0.70 O ATOM 34 CB ALA A 3 4.985 9.716 10.414 1.00 0.66 C ATOM 0 H ALA A 3 6.651 11.572 11.146 1.00 0.56 H new ATOM 0 HA ALA A 3 3.881 11.525 10.098 1.00 0.54 H new ATOM 0 HB1 ALA A 3 4.095 9.088 10.460 1.00 0.66 H new ATOM 0 HB2 ALA A 3 5.384 9.706 9.400 1.00 0.66 H new ATOM 0 HB3 ALA A 3 5.737 9.331 11.103 1.00 0.66 H new ATOM 40 N GLU A 4 2.729 11.669 12.297 1.00 0.52 N ATOM 41 CA GLU A 4 2.005 11.776 13.580 1.00 0.55 C ATOM 42 C GLU A 4 0.939 10.662 13.705 1.00 0.52 C ATOM 43 O GLU A 4 0.167 10.460 12.762 1.00 0.50 O ATOM 44 CB GLU A 4 1.330 13.160 13.692 1.00 0.61 C ATOM 45 CG GLU A 4 0.788 13.490 15.087 1.00 0.74 C ATOM 46 CD GLU A 4 -0.124 14.703 15.099 1.00 0.86 C ATOM 47 OE1 GLU A 4 -1.325 14.546 14.789 1.00 0.94 O ATOM 48 OE2 GLU A 4 0.362 15.809 15.417 1.00 1.02 O ATOM 0 H GLU A 4 2.192 11.989 11.491 1.00 0.52 H new ATOM 0 HA GLU A 4 2.725 11.658 14.390 1.00 0.55 H new ATOM 0 HB2 GLU A 4 2.050 13.926 13.405 1.00 0.61 H new ATOM 0 HB3 GLU A 4 0.510 13.209 12.976 1.00 0.61 H new ATOM 0 HG2 GLU A 4 0.242 12.628 15.471 1.00 0.74 H new ATOM 0 HG3 GLU A 4 1.625 13.665 15.763 1.00 0.74 H new ATOM 55 N PRO A 5 0.852 9.931 14.875 1.00 0.57 N ATOM 56 CA PRO A 5 -0.152 8.858 15.068 1.00 0.59 C ATOM 57 C PRO A 5 -1.600 9.394 15.030 1.00 0.53 C ATOM 58 O PRO A 5 -1.941 10.328 15.762 1.00 0.59 O ATOM 59 CB PRO A 5 0.190 8.264 16.452 1.00 0.74 C ATOM 60 CG PRO A 5 1.564 8.750 16.767 1.00 0.73 C ATOM 61 CD PRO A 5 1.707 10.075 16.076 1.00 0.67 C ATOM 0 HA PRO A 5 -0.110 8.118 14.269 1.00 0.59 H new ATOM 0 HB2 PRO A 5 -0.525 8.592 17.207 1.00 0.74 H new ATOM 0 HB3 PRO A 5 0.154 7.175 16.431 1.00 0.74 H new ATOM 0 HG2 PRO A 5 1.703 8.855 17.843 1.00 0.73 H new ATOM 0 HG3 PRO A 5 2.317 8.044 16.416 1.00 0.73 H new ATOM 0 HD2 PRO A 5 1.374 10.897 16.710 1.00 0.67 H new ATOM 0 HD3 PRO A 5 2.744 10.279 15.809 1.00 0.67 H new ATOM 69 N LEU A 6 -2.437 8.786 14.164 1.00 0.58 N ATOM 70 CA LEU A 6 -3.847 9.193 13.980 1.00 0.67 C ATOM 71 C LEU A 6 -4.795 7.976 14.203 1.00 0.71 C ATOM 72 O LEU A 6 -4.434 7.057 14.945 1.00 1.19 O ATOM 73 CB LEU A 6 -3.989 9.822 12.563 1.00 0.84 C ATOM 74 CG LEU A 6 -3.198 11.140 12.333 1.00 0.91 C ATOM 75 CD1 LEU A 6 -2.982 11.404 10.838 1.00 1.14 C ATOM 76 CD2 LEU A 6 -3.911 12.330 12.986 1.00 1.03 C ATOM 0 H LEU A 6 -2.157 8.002 13.574 1.00 0.58 H new ATOM 0 HA LEU A 6 -4.138 9.941 14.717 1.00 0.67 H new ATOM 0 HB2 LEU A 6 -3.662 9.089 11.825 1.00 0.84 H new ATOM 0 HB3 LEU A 6 -5.045 10.015 12.375 1.00 0.84 H new ATOM 0 HG LEU A 6 -2.222 11.022 12.803 1.00 0.91 H new ATOM 0 HD11 LEU A 6 -2.426 12.333 10.709 1.00 1.14 H new ATOM 0 HD12 LEU A 6 -2.418 10.580 10.401 1.00 1.14 H new ATOM 0 HD13 LEU A 6 -3.948 11.487 10.340 1.00 1.14 H new ATOM 0 HD21 LEU A 6 -3.337 13.240 12.810 1.00 1.03 H new ATOM 0 HD22 LEU A 6 -4.906 12.440 12.554 1.00 1.03 H new ATOM 0 HD23 LEU A 6 -3.998 12.158 14.059 1.00 1.03 H new ATOM 88 N THR A 7 -6.015 7.984 13.596 1.00 0.52 N ATOM 89 CA THR A 7 -6.993 6.873 13.730 1.00 0.52 C ATOM 90 C THR A 7 -6.387 5.523 13.277 1.00 0.49 C ATOM 91 O THR A 7 -5.440 5.507 12.496 1.00 0.56 O ATOM 92 CB THR A 7 -8.293 7.174 12.913 1.00 0.58 C ATOM 93 OG1 THR A 7 -8.641 8.560 13.056 1.00 0.98 O ATOM 94 CG2 THR A 7 -9.481 6.321 13.365 1.00 0.94 C ATOM 0 H THR A 7 -6.342 8.751 13.008 1.00 0.52 H new ATOM 0 HA THR A 7 -7.248 6.794 14.787 1.00 0.52 H new ATOM 0 HB THR A 7 -8.080 6.929 11.872 1.00 0.58 H new ATOM 0 HG1 THR A 7 -8.321 9.060 12.276 1.00 0.98 H new ATOM 0 HG21 THR A 7 -10.357 6.570 12.766 1.00 0.94 H new ATOM 0 HG22 THR A 7 -9.241 5.266 13.236 1.00 0.94 H new ATOM 0 HG23 THR A 7 -9.692 6.519 14.416 1.00 0.94 H new ATOM 102 N GLU A 8 -6.955 4.407 13.782 1.00 0.51 N ATOM 103 CA GLU A 8 -6.492 3.021 13.489 1.00 0.50 C ATOM 104 C GLU A 8 -5.994 2.798 12.036 1.00 0.46 C ATOM 105 O GLU A 8 -4.877 2.309 11.847 1.00 0.48 O ATOM 106 CB GLU A 8 -7.610 2.015 13.835 1.00 0.55 C ATOM 107 CG GLU A 8 -7.114 0.591 14.088 1.00 0.91 C ATOM 108 CD GLU A 8 -8.128 -0.259 14.831 1.00 0.95 C ATOM 109 OE1 GLU A 8 -8.091 -0.267 16.080 1.00 1.42 O ATOM 110 OE2 GLU A 8 -8.963 -0.908 14.168 1.00 1.14 O ATOM 0 H GLU A 8 -7.757 4.436 14.412 1.00 0.51 H new ATOM 0 HA GLU A 8 -5.618 2.857 14.120 1.00 0.50 H new ATOM 0 HB2 GLU A 8 -8.139 2.367 14.721 1.00 0.55 H new ATOM 0 HB3 GLU A 8 -8.333 1.997 13.019 1.00 0.55 H new ATOM 0 HG2 GLU A 8 -6.878 0.118 13.135 1.00 0.91 H new ATOM 0 HG3 GLU A 8 -6.188 0.630 14.662 1.00 0.91 H new ATOM 117 N LEU A 9 -6.813 3.154 11.020 1.00 0.45 N ATOM 118 CA LEU A 9 -6.418 2.978 9.598 1.00 0.44 C ATOM 119 C LEU A 9 -5.277 3.934 9.205 1.00 0.42 C ATOM 120 O LEU A 9 -4.332 3.524 8.524 1.00 0.43 O ATOM 121 CB LEU A 9 -7.621 3.181 8.651 1.00 0.48 C ATOM 122 CG LEU A 9 -8.719 2.095 8.708 1.00 0.56 C ATOM 123 CD1 LEU A 9 -9.956 2.546 7.933 1.00 0.65 C ATOM 124 CD2 LEU A 9 -8.204 0.753 8.167 1.00 0.65 C ATOM 0 H LEU A 9 -7.740 3.560 11.152 1.00 0.45 H new ATOM 0 HA LEU A 9 -6.061 1.953 9.494 1.00 0.44 H new ATOM 0 HB2 LEU A 9 -8.078 4.144 8.878 1.00 0.48 H new ATOM 0 HB3 LEU A 9 -7.248 3.239 7.629 1.00 0.48 H new ATOM 0 HG LEU A 9 -8.994 1.950 9.753 1.00 0.56 H new ATOM 0 HD11 LEU A 9 -10.720 1.770 7.983 1.00 0.65 H new ATOM 0 HD12 LEU A 9 -10.344 3.466 8.371 1.00 0.65 H new ATOM 0 HD13 LEU A 9 -9.688 2.725 6.892 1.00 0.65 H new ATOM 0 HD21 LEU A 9 -9.000 0.010 8.220 1.00 0.65 H new ATOM 0 HD22 LEU A 9 -7.890 0.875 7.130 1.00 0.65 H new ATOM 0 HD23 LEU A 9 -7.356 0.421 8.766 1.00 0.65 H new ATOM 136 N GLU A 10 -5.378 5.208 9.641 1.00 0.42 N ATOM 137 CA GLU A 10 -4.345 6.229 9.361 1.00 0.44 C ATOM 138 C GLU A 10 -3.017 5.893 10.073 1.00 0.44 C ATOM 139 O GLU A 10 -1.943 6.223 9.563 1.00 0.48 O ATOM 140 CB GLU A 10 -4.813 7.629 9.810 1.00 0.49 C ATOM 141 CG GLU A 10 -6.087 8.128 9.131 1.00 0.54 C ATOM 142 CD GLU A 10 -6.521 9.495 9.632 1.00 0.63 C ATOM 143 OE1 GLU A 10 -5.853 10.492 9.292 1.00 1.03 O ATOM 144 OE2 GLU A 10 -7.527 9.567 10.368 1.00 0.96 O ATOM 0 H GLU A 10 -6.165 5.554 10.189 1.00 0.42 H new ATOM 0 HA GLU A 10 -4.183 6.230 8.283 1.00 0.44 H new ATOM 0 HB2 GLU A 10 -4.975 7.614 10.888 1.00 0.49 H new ATOM 0 HB3 GLU A 10 -4.012 8.343 9.618 1.00 0.49 H new ATOM 0 HG2 GLU A 10 -5.926 8.175 8.054 1.00 0.54 H new ATOM 0 HG3 GLU A 10 -6.890 7.411 9.302 1.00 0.54 H new ATOM 151 N GLU A 11 -3.104 5.233 11.253 1.00 0.44 N ATOM 152 CA GLU A 11 -1.922 4.850 12.048 1.00 0.46 C ATOM 153 C GLU A 11 -1.250 3.572 11.506 1.00 0.45 C ATOM 154 O GLU A 11 -0.053 3.373 11.733 1.00 0.47 O ATOM 155 CB GLU A 11 -2.298 4.675 13.535 1.00 0.52 C ATOM 156 CG GLU A 11 -1.101 4.677 14.488 1.00 0.61 C ATOM 157 CD GLU A 11 -1.508 4.759 15.949 1.00 0.69 C ATOM 158 OE1 GLU A 11 -2.049 5.809 16.356 1.00 0.79 O ATOM 159 OE2 GLU A 11 -1.285 3.776 16.686 1.00 0.81 O ATOM 0 H GLU A 11 -3.990 4.955 11.674 1.00 0.44 H new ATOM 0 HA GLU A 11 -1.198 5.661 11.961 1.00 0.46 H new ATOM 0 HB2 GLU A 11 -2.979 5.476 13.823 1.00 0.52 H new ATOM 0 HB3 GLU A 11 -2.841 3.737 13.653 1.00 0.52 H new ATOM 0 HG2 GLU A 11 -0.516 3.771 14.330 1.00 0.61 H new ATOM 0 HG3 GLU A 11 -0.454 5.521 14.249 1.00 0.61 H new ATOM 166 N SER A 12 -2.019 2.703 10.804 1.00 0.45 N ATOM 167 CA SER A 12 -1.470 1.462 10.208 1.00 0.47 C ATOM 168 C SER A 12 -0.345 1.794 9.204 1.00 0.44 C ATOM 169 O SER A 12 0.708 1.151 9.219 1.00 0.49 O ATOM 170 CB SER A 12 -2.579 0.644 9.517 1.00 0.52 C ATOM 171 OG SER A 12 -3.527 0.163 10.460 1.00 0.63 O ATOM 0 H SER A 12 -3.016 2.839 10.638 1.00 0.45 H new ATOM 0 HA SER A 12 -1.052 0.858 11.014 1.00 0.47 H new ATOM 0 HB2 SER A 12 -3.083 1.264 8.775 1.00 0.52 H new ATOM 0 HB3 SER A 12 -2.135 -0.196 8.983 1.00 0.52 H new ATOM 0 HG SER A 12 -3.947 0.921 10.918 1.00 0.63 H new ATOM 177 N ILE A 13 -0.579 2.808 8.344 1.00 0.42 N ATOM 178 CA ILE A 13 0.430 3.264 7.356 1.00 0.43 C ATOM 179 C ILE A 13 1.435 4.263 7.988 1.00 0.41 C ATOM 180 O ILE A 13 2.521 4.482 7.439 1.00 0.46 O ATOM 181 CB ILE A 13 -0.213 3.884 6.059 1.00 0.47 C ATOM 182 CG1 ILE A 13 -1.201 5.056 6.358 1.00 0.46 C ATOM 183 CG2 ILE A 13 -0.908 2.792 5.239 1.00 0.56 C ATOM 184 CD1 ILE A 13 -0.551 6.427 6.441 1.00 0.44 C ATOM 0 H ILE A 13 -1.456 3.328 8.312 1.00 0.42 H new ATOM 0 HA ILE A 13 0.970 2.368 7.050 1.00 0.43 H new ATOM 0 HB ILE A 13 0.605 4.313 5.480 1.00 0.47 H new ATOM 0 HG12 ILE A 13 -1.965 5.077 5.580 1.00 0.46 H new ATOM 0 HG13 ILE A 13 -1.711 4.853 7.300 1.00 0.46 H new ATOM 0 HG21 ILE A 13 -1.349 3.233 4.345 1.00 0.56 H new ATOM 0 HG22 ILE A 13 -0.179 2.035 4.949 1.00 0.56 H new ATOM 0 HG23 ILE A 13 -1.692 2.329 5.839 1.00 0.56 H new ATOM 0 HD11 ILE A 13 -1.312 7.178 6.652 1.00 0.44 H new ATOM 0 HD12 ILE A 13 0.192 6.430 7.239 1.00 0.44 H new ATOM 0 HD13 ILE A 13 -0.066 6.658 5.493 1.00 0.44 H new ATOM 196 N GLU A 14 1.060 4.865 9.145 1.00 0.39 N ATOM 197 CA GLU A 14 1.916 5.825 9.875 1.00 0.40 C ATOM 198 C GLU A 14 3.083 5.102 10.565 1.00 0.41 C ATOM 199 O GLU A 14 4.210 5.603 10.558 1.00 0.44 O ATOM 200 CB GLU A 14 1.067 6.593 10.915 1.00 0.43 C ATOM 201 CG GLU A 14 1.737 7.804 11.566 1.00 0.52 C ATOM 202 CD GLU A 14 2.649 7.454 12.737 1.00 0.61 C ATOM 203 OE1 GLU A 14 2.277 6.579 13.550 1.00 0.93 O ATOM 204 OE2 GLU A 14 3.730 8.062 12.840 1.00 1.00 O ATOM 0 H GLU A 14 0.159 4.697 9.594 1.00 0.39 H new ATOM 0 HA GLU A 14 2.335 6.534 9.161 1.00 0.40 H new ATOM 0 HB2 GLU A 14 0.150 6.927 10.430 1.00 0.43 H new ATOM 0 HB3 GLU A 14 0.776 5.897 11.702 1.00 0.43 H new ATOM 0 HG2 GLU A 14 2.319 8.334 10.812 1.00 0.52 H new ATOM 0 HG3 GLU A 14 0.965 8.491 11.913 1.00 0.52 H new ATOM 211 N THR A 15 2.794 3.928 11.178 1.00 0.42 N ATOM 212 CA THR A 15 3.817 3.108 11.863 1.00 0.45 C ATOM 213 C THR A 15 4.951 2.682 10.893 1.00 0.43 C ATOM 214 O THR A 15 6.090 2.476 11.324 1.00 0.45 O ATOM 215 CB THR A 15 3.176 1.847 12.532 1.00 0.50 C ATOM 216 OG1 THR A 15 2.003 2.230 13.269 1.00 0.65 O ATOM 217 CG2 THR A 15 4.145 1.152 13.489 1.00 0.77 C ATOM 0 H THR A 15 1.856 3.529 11.210 1.00 0.42 H new ATOM 0 HA THR A 15 4.255 3.730 12.644 1.00 0.45 H new ATOM 0 HB THR A 15 2.920 1.152 11.732 1.00 0.50 H new ATOM 0 HG1 THR A 15 1.287 2.468 12.644 1.00 0.65 H new ATOM 0 HG21 THR A 15 3.659 0.282 13.931 1.00 0.77 H new ATOM 0 HG22 THR A 15 5.031 0.833 12.941 1.00 0.77 H new ATOM 0 HG23 THR A 15 4.436 1.845 14.278 1.00 0.77 H new ATOM 225 N VAL A 16 4.629 2.560 9.583 1.00 0.41 N ATOM 226 CA VAL A 16 5.616 2.196 8.541 1.00 0.42 C ATOM 227 C VAL A 16 6.676 3.319 8.354 1.00 0.42 C ATOM 228 O VAL A 16 7.809 3.036 7.951 1.00 0.46 O ATOM 229 CB VAL A 16 4.914 1.878 7.168 1.00 0.44 C ATOM 230 CG1 VAL A 16 5.920 1.478 6.082 1.00 0.50 C ATOM 231 CG2 VAL A 16 3.856 0.777 7.325 1.00 0.49 C ATOM 0 H VAL A 16 3.687 2.710 9.222 1.00 0.41 H new ATOM 0 HA VAL A 16 6.124 1.294 8.881 1.00 0.42 H new ATOM 0 HB VAL A 16 4.424 2.799 6.852 1.00 0.44 H new ATOM 0 HG11 VAL A 16 5.389 1.268 5.154 1.00 0.50 H new ATOM 0 HG12 VAL A 16 6.625 2.294 5.921 1.00 0.50 H new ATOM 0 HG13 VAL A 16 6.462 0.587 6.399 1.00 0.50 H new ATOM 0 HG21 VAL A 16 3.389 0.580 6.360 1.00 0.49 H new ATOM 0 HG22 VAL A 16 4.330 -0.134 7.691 1.00 0.49 H new ATOM 0 HG23 VAL A 16 3.096 1.101 8.036 1.00 0.49 H new ATOM 241 N VAL A 17 6.301 4.587 8.659 1.00 0.42 N ATOM 242 CA VAL A 17 7.210 5.751 8.533 1.00 0.47 C ATOM 243 C VAL A 17 7.701 6.228 9.934 1.00 0.55 C ATOM 244 O VAL A 17 7.815 7.435 10.190 1.00 0.95 O ATOM 245 CB VAL A 17 6.518 6.946 7.771 1.00 0.51 C ATOM 246 CG1 VAL A 17 7.556 7.934 7.223 1.00 0.60 C ATOM 247 CG2 VAL A 17 5.600 6.451 6.640 1.00 0.52 C ATOM 0 H VAL A 17 5.369 4.828 8.996 1.00 0.42 H new ATOM 0 HA VAL A 17 8.071 5.426 7.949 1.00 0.47 H new ATOM 0 HB VAL A 17 5.897 7.467 8.500 1.00 0.51 H new ATOM 0 HG11 VAL A 17 7.047 8.746 6.703 1.00 0.60 H new ATOM 0 HG12 VAL A 17 8.141 8.341 8.047 1.00 0.60 H new ATOM 0 HG13 VAL A 17 8.218 7.418 6.528 1.00 0.60 H new ATOM 0 HG21 VAL A 17 5.144 7.306 6.141 1.00 0.52 H new ATOM 0 HG22 VAL A 17 6.186 5.881 5.919 1.00 0.52 H new ATOM 0 HG23 VAL A 17 4.819 5.815 7.057 1.00 0.52 H new ATOM 257 N THR A 18 8.014 5.267 10.836 1.00 0.47 N ATOM 258 CA THR A 18 8.484 5.594 12.203 1.00 0.51 C ATOM 259 C THR A 18 9.451 4.537 12.760 1.00 0.51 C ATOM 260 O THR A 18 10.520 4.889 13.266 1.00 0.60 O ATOM 261 CB THR A 18 7.304 5.762 13.205 1.00 0.56 C ATOM 262 OG1 THR A 18 6.458 4.602 13.178 1.00 0.57 O ATOM 263 CG2 THR A 18 6.473 7.000 12.891 1.00 0.62 C ATOM 0 H THR A 18 7.950 4.267 10.644 1.00 0.47 H new ATOM 0 HA THR A 18 9.012 6.542 12.104 1.00 0.51 H new ATOM 0 HB THR A 18 7.735 5.880 14.199 1.00 0.56 H new ATOM 0 HG1 THR A 18 6.586 4.124 12.332 1.00 0.57 H new ATOM 0 HG21 THR A 18 5.659 7.084 13.611 1.00 0.62 H new ATOM 0 HG22 THR A 18 7.104 7.887 12.951 1.00 0.62 H new ATOM 0 HG23 THR A 18 6.061 6.916 11.886 1.00 0.62 H new ATOM 271 N THR A 19 9.066 3.246 12.674 1.00 0.49 N ATOM 272 CA THR A 19 9.893 2.136 13.192 1.00 0.53 C ATOM 273 C THR A 19 11.246 2.029 12.458 1.00 0.53 C ATOM 274 O THR A 19 12.295 2.023 13.106 1.00 0.62 O ATOM 275 CB THR A 19 9.137 0.773 13.121 1.00 0.55 C ATOM 276 OG1 THR A 19 7.782 0.941 13.561 1.00 0.56 O ATOM 277 CG2 THR A 19 9.808 -0.295 13.987 1.00 0.66 C ATOM 0 H THR A 19 8.188 2.947 12.251 1.00 0.49 H new ATOM 0 HA THR A 19 10.094 2.366 14.238 1.00 0.53 H new ATOM 0 HB THR A 19 9.161 0.442 12.083 1.00 0.55 H new ATOM 0 HG1 THR A 19 7.602 0.330 14.306 1.00 0.56 H new ATOM 0 HG21 THR A 19 9.251 -1.229 13.910 1.00 0.66 H new ATOM 0 HG22 THR A 19 10.830 -0.453 13.643 1.00 0.66 H new ATOM 0 HG23 THR A 19 9.821 0.035 15.026 1.00 0.66 H new ATOM 285 N PHE A 20 11.214 1.944 11.108 1.00 0.53 N ATOM 286 CA PHE A 20 12.448 1.841 10.302 1.00 0.57 C ATOM 287 C PHE A 20 12.850 3.194 9.668 1.00 0.57 C ATOM 288 O PHE A 20 13.775 3.235 8.848 1.00 0.89 O ATOM 289 CB PHE A 20 12.292 0.753 9.215 1.00 0.64 C ATOM 290 CG PHE A 20 13.611 0.256 8.633 1.00 0.71 C ATOM 291 CD1 PHE A 20 14.432 -0.601 9.360 1.00 0.83 C ATOM 292 CD2 PHE A 20 14.022 0.643 7.360 1.00 0.76 C ATOM 293 CE1 PHE A 20 15.624 -1.057 8.830 1.00 0.95 C ATOM 294 CE2 PHE A 20 15.214 0.186 6.833 1.00 0.86 C ATOM 295 CZ PHE A 20 16.014 -0.665 7.568 1.00 0.93 C ATOM 0 H PHE A 20 10.354 1.945 10.560 1.00 0.53 H new ATOM 0 HA PHE A 20 13.254 1.555 10.978 1.00 0.57 H new ATOM 0 HB2 PHE A 20 11.753 -0.094 9.640 1.00 0.64 H new ATOM 0 HB3 PHE A 20 11.677 1.149 8.406 1.00 0.64 H new ATOM 0 HD1 PHE A 20 14.134 -0.913 10.350 1.00 0.83 H new ATOM 0 HD2 PHE A 20 13.401 1.308 6.778 1.00 0.76 H new ATOM 0 HE1 PHE A 20 16.251 -1.722 9.406 1.00 0.95 H new ATOM 0 HE2 PHE A 20 15.520 0.495 5.845 1.00 0.86 H new ATOM 0 HZ PHE A 20 16.945 -1.023 7.154 1.00 0.93 H new ATOM 305 N PHE A 21 12.179 4.308 10.050 1.00 0.71 N ATOM 306 CA PHE A 21 12.513 5.639 9.508 1.00 0.73 C ATOM 307 C PHE A 21 13.899 6.110 10.004 1.00 0.66 C ATOM 308 O PHE A 21 14.577 6.864 9.301 1.00 0.67 O ATOM 309 CB PHE A 21 11.424 6.680 9.854 1.00 1.04 C ATOM 310 CG PHE A 21 11.527 7.963 9.044 1.00 1.67 C ATOM 311 CD1 PHE A 21 10.995 8.042 7.760 1.00 1.97 C ATOM 312 CD2 PHE A 21 12.178 9.079 9.559 1.00 2.34 C ATOM 313 CE1 PHE A 21 11.106 9.202 7.018 1.00 2.74 C ATOM 314 CE2 PHE A 21 12.294 10.236 8.814 1.00 3.02 C ATOM 315 CZ PHE A 21 11.758 10.299 7.546 1.00 3.17 C ATOM 0 H PHE A 21 11.413 4.308 10.723 1.00 0.71 H new ATOM 0 HA PHE A 21 12.554 5.548 8.423 1.00 0.73 H new ATOM 0 HB2 PHE A 21 10.443 6.235 9.690 1.00 1.04 H new ATOM 0 HB3 PHE A 21 11.490 6.924 10.914 1.00 1.04 H new ATOM 0 HD1 PHE A 21 10.489 7.186 7.339 1.00 1.97 H new ATOM 0 HD2 PHE A 21 12.598 9.040 10.553 1.00 2.34 H new ATOM 0 HE1 PHE A 21 10.683 9.251 6.025 1.00 2.74 H new ATOM 0 HE2 PHE A 21 12.806 11.093 9.226 1.00 3.02 H new ATOM 0 HZ PHE A 21 11.848 11.205 6.966 1.00 3.17 H new ATOM 325 N THR A 22 14.314 5.655 11.211 1.00 0.75 N ATOM 326 CA THR A 22 15.633 6.003 11.784 1.00 0.89 C ATOM 327 C THR A 22 16.776 5.458 10.897 1.00 0.82 C ATOM 328 O THR A 22 17.791 6.137 10.705 1.00 0.97 O ATOM 329 CB THR A 22 15.782 5.458 13.240 1.00 1.11 C ATOM 330 OG1 THR A 22 14.637 5.834 14.026 1.00 1.25 O ATOM 331 CG2 THR A 22 17.050 5.978 13.924 1.00 1.37 C ATOM 0 H THR A 22 13.752 5.046 11.806 1.00 0.75 H new ATOM 0 HA THR A 22 15.699 7.090 11.817 1.00 0.89 H new ATOM 0 HB THR A 22 15.854 4.373 13.171 1.00 1.11 H new ATOM 0 HG1 THR A 22 14.737 5.487 14.937 1.00 1.25 H new ATOM 0 HG21 THR A 22 17.111 5.573 14.934 1.00 1.37 H new ATOM 0 HG22 THR A 22 17.925 5.666 13.354 1.00 1.37 H new ATOM 0 HG23 THR A 22 17.018 7.066 13.971 1.00 1.37 H new ATOM 339 N PHE A 23 16.598 4.229 10.365 1.00 0.69 N ATOM 340 CA PHE A 23 17.593 3.600 9.474 1.00 0.76 C ATOM 341 C PHE A 23 17.441 4.111 8.025 1.00 0.69 C ATOM 342 O PHE A 23 18.415 4.119 7.268 1.00 0.82 O ATOM 343 CB PHE A 23 17.469 2.058 9.506 1.00 0.87 C ATOM 344 CG PHE A 23 17.855 1.429 10.833 1.00 1.04 C ATOM 345 CD1 PHE A 23 16.967 1.409 11.904 1.00 1.01 C ATOM 346 CD2 PHE A 23 19.111 0.861 11.009 1.00 1.34 C ATOM 347 CE1 PHE A 23 17.326 0.837 13.112 1.00 1.24 C ATOM 348 CE2 PHE A 23 19.471 0.291 12.212 1.00 1.55 C ATOM 349 CZ PHE A 23 18.580 0.278 13.265 1.00 1.49 C ATOM 0 H PHE A 23 15.774 3.654 10.538 1.00 0.69 H new ATOM 0 HA PHE A 23 18.582 3.878 9.839 1.00 0.76 H new ATOM 0 HB2 PHE A 23 16.441 1.783 9.272 1.00 0.87 H new ATOM 0 HB3 PHE A 23 18.098 1.638 8.721 1.00 0.87 H new ATOM 0 HD1 PHE A 23 15.985 1.845 11.791 1.00 1.01 H new ATOM 0 HD2 PHE A 23 19.816 0.866 10.191 1.00 1.34 H new ATOM 0 HE1 PHE A 23 16.626 0.828 13.935 1.00 1.24 H new ATOM 0 HE2 PHE A 23 20.452 -0.146 12.330 1.00 1.55 H new ATOM 0 HZ PHE A 23 18.862 -0.168 14.207 1.00 1.49 H new ATOM 359 N ALA A 24 16.210 4.540 7.646 1.00 0.59 N ATOM 360 CA ALA A 24 15.925 5.067 6.294 1.00 0.67 C ATOM 361 C ALA A 24 16.593 6.434 6.045 1.00 0.62 C ATOM 362 O ALA A 24 17.028 6.714 4.924 1.00 0.83 O ATOM 363 CB ALA A 24 14.413 5.168 6.066 1.00 0.82 C ATOM 0 H ALA A 24 15.398 4.529 8.264 1.00 0.59 H new ATOM 0 HA ALA A 24 16.351 4.362 5.580 1.00 0.67 H new ATOM 0 HB1 ALA A 24 14.221 5.558 5.066 1.00 0.82 H new ATOM 0 HB2 ALA A 24 13.964 4.180 6.163 1.00 0.82 H new ATOM 0 HB3 ALA A 24 13.977 5.839 6.807 1.00 0.82 H new ATOM 369 N ARG A 25 16.682 7.278 7.101 1.00 0.61 N ATOM 370 CA ARG A 25 17.298 8.621 6.993 1.00 0.65 C ATOM 371 C ARG A 25 18.851 8.591 7.086 1.00 0.69 C ATOM 372 O ARG A 25 19.487 9.644 6.972 1.00 0.88 O ATOM 373 CB ARG A 25 16.701 9.592 8.045 1.00 0.75 C ATOM 374 CG ARG A 25 16.997 9.251 9.512 1.00 0.78 C ATOM 375 CD ARG A 25 16.425 10.304 10.466 1.00 0.97 C ATOM 376 NE ARG A 25 16.741 10.032 11.881 1.00 1.09 N ATOM 377 CZ ARG A 25 16.293 10.755 12.929 1.00 1.32 C ATOM 378 NH1 ARG A 25 15.503 11.824 12.759 1.00 1.55 N ATOM 379 NH2 ARG A 25 16.643 10.401 14.167 1.00 1.47 N ATOM 0 H ARG A 25 16.336 7.053 8.034 1.00 0.61 H new ATOM 0 HA ARG A 25 17.055 8.990 5.996 1.00 0.65 H new ATOM 0 HB2 ARG A 25 17.078 10.594 7.841 1.00 0.75 H new ATOM 0 HB3 ARG A 25 15.620 9.624 7.910 1.00 0.75 H new ATOM 0 HG2 ARG A 25 16.574 8.275 9.751 1.00 0.78 H new ATOM 0 HG3 ARG A 25 18.075 9.175 9.658 1.00 0.78 H new ATOM 0 HD2 ARG A 25 16.817 11.284 10.194 1.00 0.97 H new ATOM 0 HD3 ARG A 25 15.343 10.348 10.343 1.00 0.97 H new ATOM 0 HE ARG A 25 17.345 9.235 12.083 1.00 1.09 H new ATOM 0 HH11 ARG A 25 15.226 12.109 11.820 1.00 1.55 H new ATOM 0 HH12 ARG A 25 15.179 12.352 13.569 1.00 1.55 H new ATOM 0 HH21 ARG A 25 17.244 9.590 14.315 1.00 1.47 H new ATOM 0 HH22 ARG A 25 16.310 10.941 14.965 1.00 1.47 H new ATOM 393 N GLN A 26 19.461 7.392 7.288 1.00 0.73 N ATOM 394 CA GLN A 26 20.936 7.246 7.377 1.00 0.84 C ATOM 395 C GLN A 26 21.613 7.603 6.033 1.00 0.78 C ATOM 396 O GLN A 26 22.644 8.284 6.019 1.00 0.89 O ATOM 397 CB GLN A 26 21.308 5.804 7.803 1.00 1.01 C ATOM 398 CG GLN A 26 22.753 5.630 8.273 1.00 1.22 C ATOM 399 CD GLN A 26 23.071 4.198 8.694 1.00 1.49 C ATOM 400 OE1 GLN A 26 23.475 3.379 7.867 1.00 1.63 O ATOM 401 NE2 GLN A 26 22.898 3.882 9.982 1.00 1.80 N ATOM 0 H GLN A 26 18.952 6.514 7.392 1.00 0.73 H new ATOM 0 HA GLN A 26 21.301 7.942 8.133 1.00 0.84 H new ATOM 0 HB2 GLN A 26 20.639 5.493 8.605 1.00 1.01 H new ATOM 0 HB3 GLN A 26 21.130 5.134 6.962 1.00 1.01 H new ATOM 0 HG2 GLN A 26 23.429 5.926 7.471 1.00 1.22 H new ATOM 0 HG3 GLN A 26 22.940 6.300 9.112 1.00 1.22 H new ATOM 0 HE21 GLN A 26 22.562 4.586 10.639 1.00 1.80 H new ATOM 0 HE22 GLN A 26 23.102 2.937 10.307 1.00 1.80 H new ATOM 410 N GLU A 27 21.019 7.138 4.910 1.00 0.70 N ATOM 411 CA GLU A 27 21.536 7.411 3.553 1.00 0.76 C ATOM 412 C GLU A 27 20.838 8.653 2.947 1.00 0.93 C ATOM 413 O GLU A 27 20.025 9.297 3.621 1.00 1.59 O ATOM 414 CB GLU A 27 21.344 6.161 2.648 1.00 0.92 C ATOM 415 CG GLU A 27 22.523 5.182 2.650 1.00 1.09 C ATOM 416 CD GLU A 27 23.765 5.728 1.953 1.00 1.27 C ATOM 417 OE1 GLU A 27 23.770 5.781 0.703 1.00 1.52 O ATOM 418 OE2 GLU A 27 24.728 6.100 2.656 1.00 1.46 O ATOM 0 H GLU A 27 20.174 6.567 4.920 1.00 0.70 H new ATOM 0 HA GLU A 27 22.603 7.626 3.616 1.00 0.76 H new ATOM 0 HB2 GLU A 27 20.448 5.630 2.970 1.00 0.92 H new ATOM 0 HB3 GLU A 27 21.167 6.494 1.625 1.00 0.92 H new ATOM 0 HG2 GLU A 27 22.775 4.930 3.680 1.00 1.09 H new ATOM 0 HG3 GLU A 27 22.218 4.257 2.161 1.00 1.09 H new ATOM 425 N GLY A 28 21.163 8.985 1.672 1.00 0.79 N ATOM 426 CA GLY A 28 20.572 10.144 0.987 1.00 0.92 C ATOM 427 C GLY A 28 19.040 10.179 1.014 1.00 0.73 C ATOM 428 O GLY A 28 18.398 9.124 1.063 1.00 0.72 O ATOM 0 H GLY A 28 21.831 8.462 1.105 1.00 0.79 H new ATOM 0 HA2 GLY A 28 20.953 11.056 1.447 1.00 0.92 H new ATOM 0 HA3 GLY A 28 20.906 10.147 -0.051 1.00 0.92 H new ATOM 432 N ARG A 29 18.463 11.407 0.972 1.00 0.72 N ATOM 433 CA ARG A 29 16.999 11.635 1.012 1.00 0.71 C ATOM 434 C ARG A 29 16.393 11.148 2.346 1.00 0.68 C ATOM 435 O ARG A 29 16.413 9.948 2.641 1.00 0.76 O ATOM 436 CB ARG A 29 16.275 10.984 -0.202 1.00 0.73 C ATOM 437 CG ARG A 29 16.206 11.874 -1.452 1.00 0.92 C ATOM 438 CD ARG A 29 14.967 12.773 -1.461 1.00 1.31 C ATOM 439 NE ARG A 29 14.943 13.695 -2.611 1.00 1.46 N ATOM 440 CZ ARG A 29 14.557 13.372 -3.869 1.00 1.91 C ATOM 441 NH1 ARG A 29 14.225 12.115 -4.197 1.00 2.60 N ATOM 442 NH2 ARG A 29 14.526 14.315 -4.813 1.00 2.05 N ATOM 0 H ARG A 29 19.004 12.269 0.909 1.00 0.72 H new ATOM 0 HA ARG A 29 16.841 12.711 0.943 1.00 0.71 H new ATOM 0 HB2 ARG A 29 16.786 10.056 -0.459 1.00 0.73 H new ATOM 0 HB3 ARG A 29 15.261 10.717 0.096 1.00 0.73 H new ATOM 0 HG2 ARG A 29 17.101 12.494 -1.503 1.00 0.92 H new ATOM 0 HG3 ARG A 29 16.202 11.245 -2.342 1.00 0.92 H new ATOM 0 HD2 ARG A 29 14.072 12.151 -1.480 1.00 1.31 H new ATOM 0 HD3 ARG A 29 14.935 13.350 -0.537 1.00 1.31 H new ATOM 0 HE ARG A 29 15.242 14.656 -2.446 1.00 1.46 H new ATOM 0 HH11 ARG A 29 14.260 11.378 -3.493 1.00 2.60 H new ATOM 0 HH12 ARG A 29 13.937 11.896 -5.151 1.00 2.60 H new ATOM 0 HH21 ARG A 29 14.792 15.273 -4.586 1.00 2.05 H new ATOM 0 HH22 ARG A 29 14.236 14.078 -5.762 1.00 2.05 H new ATOM 456 N LYS A 30 15.853 12.094 3.145 1.00 0.67 N ATOM 457 CA LYS A 30 15.243 11.781 4.461 1.00 0.67 C ATOM 458 C LYS A 30 13.975 10.917 4.327 1.00 0.66 C ATOM 459 O LYS A 30 13.745 10.032 5.154 1.00 0.72 O ATOM 460 CB LYS A 30 14.896 13.080 5.227 1.00 0.76 C ATOM 461 CG LYS A 30 16.102 13.934 5.630 1.00 0.82 C ATOM 462 CD LYS A 30 16.956 13.273 6.717 1.00 0.89 C ATOM 463 CE LYS A 30 18.068 14.192 7.228 1.00 1.00 C ATOM 464 NZ LYS A 30 19.024 14.607 6.152 1.00 1.22 N ATOM 0 H LYS A 30 15.826 13.084 2.903 1.00 0.67 H new ATOM 0 HA LYS A 30 15.985 11.210 5.019 1.00 0.67 H new ATOM 0 HB2 LYS A 30 14.233 13.684 4.607 1.00 0.76 H new ATOM 0 HB3 LYS A 30 14.339 12.816 6.126 1.00 0.76 H new ATOM 0 HG2 LYS A 30 16.720 14.121 4.752 1.00 0.82 H new ATOM 0 HG3 LYS A 30 15.753 14.903 5.987 1.00 0.82 H new ATOM 0 HD2 LYS A 30 16.317 12.983 7.551 1.00 0.89 H new ATOM 0 HD3 LYS A 30 17.398 12.358 6.321 1.00 0.89 H new ATOM 0 HE2 LYS A 30 17.621 15.081 7.673 1.00 1.00 H new ATOM 0 HE3 LYS A 30 18.618 13.682 8.019 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 19.773 15.200 6.563 1.00 1.22 H new ATOM 0 HZ2 LYS A 30 19.449 13.762 5.720 1.00 1.22 H new ATOM 0 HZ3 LYS A 30 18.514 15.148 5.425 1.00 1.22 H new ATOM 478 N ASP A 31 13.164 11.180 3.280 1.00 0.66 N ATOM 479 CA ASP A 31 11.913 10.432 3.038 1.00 0.71 C ATOM 480 C ASP A 31 12.125 9.252 2.054 1.00 0.64 C ATOM 481 O ASP A 31 11.193 8.862 1.339 1.00 0.89 O ATOM 482 CB ASP A 31 10.831 11.402 2.509 1.00 0.87 C ATOM 483 CG ASP A 31 10.390 12.425 3.546 1.00 1.03 C ATOM 484 OD1 ASP A 31 9.751 12.025 4.542 1.00 1.38 O ATOM 485 OD2 ASP A 31 10.681 13.625 3.358 1.00 1.43 O ATOM 0 H ASP A 31 13.354 11.905 2.589 1.00 0.66 H new ATOM 0 HA ASP A 31 11.583 9.999 3.982 1.00 0.71 H new ATOM 0 HB2 ASP A 31 11.216 11.924 1.633 1.00 0.87 H new ATOM 0 HB3 ASP A 31 9.964 10.827 2.182 1.00 0.87 H new ATOM 490 N SER A 32 13.343 8.658 2.054 1.00 0.65 N ATOM 491 CA SER A 32 13.687 7.534 1.166 1.00 0.58 C ATOM 492 C SER A 32 14.441 6.430 1.933 1.00 0.56 C ATOM 493 O SER A 32 15.054 6.698 2.970 1.00 0.63 O ATOM 494 CB SER A 32 14.559 8.046 0.009 1.00 0.58 C ATOM 495 OG SER A 32 14.858 7.017 -0.916 1.00 1.09 O ATOM 0 H SER A 32 14.106 8.946 2.667 1.00 0.65 H new ATOM 0 HA SER A 32 12.763 7.107 0.776 1.00 0.58 H new ATOM 0 HB2 SER A 32 14.043 8.858 -0.504 1.00 0.58 H new ATOM 0 HB3 SER A 32 15.486 8.458 0.407 1.00 0.58 H new ATOM 0 HG SER A 32 14.809 7.373 -1.828 1.00 1.09 H new ATOM 501 N LEU A 33 14.383 5.193 1.406 1.00 0.54 N ATOM 502 CA LEU A 33 15.065 4.032 2.011 1.00 0.54 C ATOM 503 C LEU A 33 16.272 3.618 1.149 1.00 0.52 C ATOM 504 O LEU A 33 16.268 3.836 -0.066 1.00 0.66 O ATOM 505 CB LEU A 33 14.088 2.840 2.164 1.00 0.55 C ATOM 506 CG LEU A 33 12.911 3.038 3.155 1.00 0.67 C ATOM 507 CD1 LEU A 33 11.797 3.899 2.546 1.00 0.76 C ATOM 508 CD2 LEU A 33 12.353 1.684 3.609 1.00 0.75 C ATOM 0 H LEU A 33 13.866 4.970 0.555 1.00 0.54 H new ATOM 0 HA LEU A 33 15.417 4.319 3.002 1.00 0.54 H new ATOM 0 HB2 LEU A 33 13.674 2.609 1.183 1.00 0.55 H new ATOM 0 HB3 LEU A 33 14.660 1.968 2.482 1.00 0.55 H new ATOM 0 HG LEU A 33 13.301 3.567 4.025 1.00 0.67 H new ATOM 0 HD11 LEU A 33 10.990 4.015 3.270 1.00 0.76 H new ATOM 0 HD12 LEU A 33 12.196 4.880 2.286 1.00 0.76 H new ATOM 0 HD13 LEU A 33 11.412 3.415 1.649 1.00 0.76 H new ATOM 0 HD21 LEU A 33 11.528 1.845 4.304 1.00 0.75 H new ATOM 0 HD22 LEU A 33 11.994 1.129 2.742 1.00 0.75 H new ATOM 0 HD23 LEU A 33 13.139 1.114 4.105 1.00 0.75 H new ATOM 520 N SER A 34 17.305 3.018 1.780 1.00 0.50 N ATOM 521 CA SER A 34 18.511 2.573 1.053 1.00 0.52 C ATOM 522 C SER A 34 18.259 1.222 0.363 1.00 0.47 C ATOM 523 O SER A 34 17.368 0.469 0.771 1.00 0.47 O ATOM 524 CB SER A 34 19.720 2.465 2.001 1.00 0.62 C ATOM 525 OG SER A 34 20.904 2.120 1.294 1.00 0.68 O ATOM 0 H SER A 34 17.327 2.832 2.783 1.00 0.50 H new ATOM 0 HA SER A 34 18.737 3.320 0.292 1.00 0.52 H new ATOM 0 HB2 SER A 34 19.866 3.414 2.517 1.00 0.62 H new ATOM 0 HB3 SER A 34 19.519 1.714 2.765 1.00 0.62 H new ATOM 0 HG SER A 34 21.654 2.061 1.922 1.00 0.68 H new ATOM 531 N VAL A 35 19.052 0.922 -0.682 1.00 0.50 N ATOM 532 CA VAL A 35 18.914 -0.339 -1.442 1.00 0.49 C ATOM 533 C VAL A 35 19.410 -1.568 -0.629 1.00 0.45 C ATOM 534 O VAL A 35 18.889 -2.672 -0.805 1.00 0.46 O ATOM 535 CB VAL A 35 19.641 -0.244 -2.833 1.00 0.59 C ATOM 536 CG1 VAL A 35 21.172 -0.216 -2.699 1.00 0.63 C ATOM 537 CG2 VAL A 35 19.192 -1.361 -3.782 1.00 0.64 C ATOM 0 H VAL A 35 19.795 1.533 -1.021 1.00 0.50 H new ATOM 0 HA VAL A 35 17.850 -0.488 -1.627 1.00 0.49 H new ATOM 0 HB VAL A 35 19.343 0.709 -3.269 1.00 0.59 H new ATOM 0 HG11 VAL A 35 21.623 -0.150 -3.689 1.00 0.63 H new ATOM 0 HG12 VAL A 35 21.470 0.649 -2.106 1.00 0.63 H new ATOM 0 HG13 VAL A 35 21.511 -1.127 -2.206 1.00 0.63 H new ATOM 0 HG21 VAL A 35 19.716 -1.263 -4.733 1.00 0.64 H new ATOM 0 HG22 VAL A 35 19.423 -2.330 -3.339 1.00 0.64 H new ATOM 0 HG23 VAL A 35 18.118 -1.286 -3.950 1.00 0.64 H new ATOM 547 N ASN A 36 20.411 -1.359 0.254 1.00 0.45 N ATOM 548 CA ASN A 36 20.975 -2.439 1.090 1.00 0.46 C ATOM 549 C ASN A 36 20.243 -2.564 2.445 1.00 0.44 C ATOM 550 O ASN A 36 20.133 -3.670 2.978 1.00 0.55 O ATOM 551 CB ASN A 36 22.483 -2.196 1.319 1.00 0.55 C ATOM 552 CG ASN A 36 23.222 -3.433 1.836 1.00 0.64 C ATOM 553 OD1 ASN A 36 23.712 -4.242 1.044 1.00 0.82 O ATOM 554 ND2 ASN A 36 23.310 -3.591 3.161 1.00 0.77 N ATOM 0 H ASN A 36 20.845 -0.449 0.406 1.00 0.45 H new ATOM 0 HA ASN A 36 20.834 -3.378 0.555 1.00 0.46 H new ATOM 0 HB2 ASN A 36 22.939 -1.874 0.383 1.00 0.55 H new ATOM 0 HB3 ASN A 36 22.609 -1.381 2.032 1.00 0.55 H new ATOM 0 HD21 ASN A 36 23.795 -4.401 3.547 1.00 0.77 H new ATOM 0 HD22 ASN A 36 22.892 -2.901 3.786 1.00 0.77 H new ATOM 561 N GLU A 37 19.746 -1.434 2.999 1.00 0.44 N ATOM 562 CA GLU A 37 19.041 -1.442 4.303 1.00 0.46 C ATOM 563 C GLU A 37 17.629 -2.049 4.203 1.00 0.41 C ATOM 564 O GLU A 37 17.182 -2.714 5.145 1.00 0.43 O ATOM 565 CB GLU A 37 18.977 -0.028 4.914 1.00 0.55 C ATOM 566 CG GLU A 37 20.351 0.572 5.218 1.00 0.70 C ATOM 567 CD GLU A 37 20.276 1.934 5.890 1.00 0.83 C ATOM 568 OE1 GLU A 37 19.998 2.929 5.188 1.00 1.54 O ATOM 569 OE2 GLU A 37 20.502 2.005 7.119 1.00 1.25 O ATOM 0 H GLU A 37 19.819 -0.512 2.568 1.00 0.44 H new ATOM 0 HA GLU A 37 19.625 -2.081 4.966 1.00 0.46 H new ATOM 0 HB2 GLU A 37 18.446 0.631 4.227 1.00 0.55 H new ATOM 0 HB3 GLU A 37 18.395 -0.065 5.835 1.00 0.55 H new ATOM 0 HG2 GLU A 37 20.905 -0.113 5.860 1.00 0.70 H new ATOM 0 HG3 GLU A 37 20.914 0.663 4.289 1.00 0.70 H new ATOM 576 N PHE A 38 16.919 -1.819 3.070 1.00 0.40 N ATOM 577 CA PHE A 38 15.565 -2.391 2.872 1.00 0.39 C ATOM 578 C PHE A 38 15.638 -3.939 2.794 1.00 0.37 C ATOM 579 O PHE A 38 14.735 -4.627 3.274 1.00 0.40 O ATOM 580 CB PHE A 38 14.850 -1.762 1.630 1.00 0.43 C ATOM 581 CG PHE A 38 14.724 -2.645 0.391 1.00 0.41 C ATOM 582 CD1 PHE A 38 13.678 -3.561 0.271 1.00 0.50 C ATOM 583 CD2 PHE A 38 15.645 -2.558 -0.647 1.00 0.49 C ATOM 584 CE1 PHE A 38 13.561 -4.358 -0.851 1.00 0.61 C ATOM 585 CE2 PHE A 38 15.529 -3.357 -1.770 1.00 0.61 C ATOM 586 CZ PHE A 38 14.487 -4.258 -1.870 1.00 0.65 C ATOM 0 H PHE A 38 17.255 -1.251 2.292 1.00 0.40 H new ATOM 0 HA PHE A 38 14.953 -2.135 3.737 1.00 0.39 H new ATOM 0 HB2 PHE A 38 13.849 -1.456 1.933 1.00 0.43 H new ATOM 0 HB3 PHE A 38 15.389 -0.857 1.349 1.00 0.43 H new ATOM 0 HD1 PHE A 38 12.951 -3.648 1.065 1.00 0.50 H new ATOM 0 HD2 PHE A 38 16.463 -1.856 -0.575 1.00 0.49 H new ATOM 0 HE1 PHE A 38 12.744 -5.060 -0.931 1.00 0.61 H new ATOM 0 HE2 PHE A 38 16.252 -3.276 -2.568 1.00 0.61 H new ATOM 0 HZ PHE A 38 14.397 -4.884 -2.745 1.00 0.65 H new ATOM 596 N LYS A 39 16.726 -4.466 2.181 1.00 0.37 N ATOM 597 CA LYS A 39 16.951 -5.925 2.058 1.00 0.40 C ATOM 598 C LYS A 39 17.121 -6.576 3.450 1.00 0.38 C ATOM 599 O LYS A 39 16.627 -7.683 3.678 1.00 0.42 O ATOM 600 CB LYS A 39 18.192 -6.203 1.181 1.00 0.46 C ATOM 601 CG LYS A 39 18.293 -7.642 0.665 1.00 0.55 C ATOM 602 CD LYS A 39 19.579 -7.875 -0.134 1.00 0.64 C ATOM 603 CE LYS A 39 19.656 -9.287 -0.714 1.00 0.76 C ATOM 604 NZ LYS A 39 18.747 -9.472 -1.884 1.00 0.87 N ATOM 0 H LYS A 39 17.463 -3.899 1.763 1.00 0.37 H new ATOM 0 HA LYS A 39 16.076 -6.366 1.580 1.00 0.40 H new ATOM 0 HB2 LYS A 39 18.179 -5.524 0.328 1.00 0.46 H new ATOM 0 HB3 LYS A 39 19.088 -5.973 1.757 1.00 0.46 H new ATOM 0 HG2 LYS A 39 18.259 -8.333 1.508 1.00 0.55 H new ATOM 0 HG3 LYS A 39 17.430 -7.863 0.037 1.00 0.55 H new ATOM 0 HD2 LYS A 39 19.637 -7.148 -0.944 1.00 0.64 H new ATOM 0 HD3 LYS A 39 20.441 -7.702 0.511 1.00 0.64 H new ATOM 0 HE2 LYS A 39 20.682 -9.497 -1.017 1.00 0.76 H new ATOM 0 HE3 LYS A 39 19.399 -10.010 0.060 1.00 0.76 H new ATOM 0 HZ1 LYS A 39 18.835 -10.445 -2.242 1.00 0.87 H new ATOM 0 HZ2 LYS A 39 17.764 -9.299 -1.591 1.00 0.87 H new ATOM 0 HZ3 LYS A 39 19.008 -8.802 -2.635 1.00 0.87 H new ATOM 618 N GLU A 40 17.832 -5.880 4.368 1.00 0.38 N ATOM 619 CA GLU A 40 18.049 -6.373 5.748 1.00 0.40 C ATOM 620 C GLU A 40 16.723 -6.405 6.539 1.00 0.40 C ATOM 621 O GLU A 40 16.533 -7.273 7.399 1.00 0.44 O ATOM 622 CB GLU A 40 19.087 -5.505 6.488 1.00 0.45 C ATOM 623 CG GLU A 40 20.509 -5.625 5.936 1.00 0.49 C ATOM 624 CD GLU A 40 21.535 -4.875 6.769 1.00 0.59 C ATOM 625 OE1 GLU A 40 22.094 -5.481 7.707 1.00 0.73 O ATOM 626 OE2 GLU A 40 21.776 -3.684 6.484 1.00 0.64 O ATOM 0 H GLU A 40 18.265 -4.976 4.178 1.00 0.38 H new ATOM 0 HA GLU A 40 18.435 -7.390 5.678 1.00 0.40 H new ATOM 0 HB2 GLU A 40 18.775 -4.462 6.436 1.00 0.45 H new ATOM 0 HB3 GLU A 40 19.093 -5.784 7.542 1.00 0.45 H new ATOM 0 HG2 GLU A 40 20.787 -6.678 5.889 1.00 0.49 H new ATOM 0 HG3 GLU A 40 20.530 -5.244 4.915 1.00 0.49 H new ATOM 633 N LEU A 41 15.810 -5.454 6.236 1.00 0.39 N ATOM 634 CA LEU A 41 14.487 -5.386 6.887 1.00 0.41 C ATOM 635 C LEU A 41 13.616 -6.604 6.501 1.00 0.40 C ATOM 636 O LEU A 41 12.793 -7.053 7.301 1.00 0.44 O ATOM 637 CB LEU A 41 13.766 -4.071 6.500 1.00 0.44 C ATOM 638 CG LEU A 41 12.472 -3.730 7.279 1.00 0.55 C ATOM 639 CD1 LEU A 41 12.746 -3.595 8.783 1.00 0.65 C ATOM 640 CD2 LEU A 41 11.832 -2.452 6.722 1.00 0.58 C ATOM 0 H LEU A 41 15.969 -4.723 5.543 1.00 0.39 H new ATOM 0 HA LEU A 41 14.639 -5.404 7.966 1.00 0.41 H new ATOM 0 HB2 LEU A 41 14.468 -3.247 6.630 1.00 0.44 H new ATOM 0 HB3 LEU A 41 13.522 -4.117 5.439 1.00 0.44 H new ATOM 0 HG LEU A 41 11.771 -4.553 7.145 1.00 0.55 H new ATOM 0 HD11 LEU A 41 11.818 -3.355 9.302 1.00 0.65 H new ATOM 0 HD12 LEU A 41 13.144 -4.535 9.166 1.00 0.65 H new ATOM 0 HD13 LEU A 41 13.471 -2.799 8.951 1.00 0.65 H new ATOM 0 HD21 LEU A 41 10.924 -2.227 7.281 1.00 0.58 H new ATOM 0 HD22 LEU A 41 12.532 -1.622 6.818 1.00 0.58 H new ATOM 0 HD23 LEU A 41 11.584 -2.598 5.670 1.00 0.58 H new ATOM 652 N VAL A 42 13.812 -7.123 5.269 1.00 0.36 N ATOM 653 CA VAL A 42 13.067 -8.293 4.769 1.00 0.37 C ATOM 654 C VAL A 42 13.674 -9.624 5.284 1.00 0.38 C ATOM 655 O VAL A 42 12.969 -10.633 5.322 1.00 0.41 O ATOM 656 CB VAL A 42 12.996 -8.290 3.198 1.00 0.40 C ATOM 657 CG1 VAL A 42 12.259 -9.518 2.647 1.00 0.45 C ATOM 658 CG2 VAL A 42 12.332 -7.006 2.687 1.00 0.41 C ATOM 0 H VAL A 42 14.484 -6.745 4.601 1.00 0.36 H new ATOM 0 HA VAL A 42 12.052 -8.218 5.160 1.00 0.37 H new ATOM 0 HB VAL A 42 14.023 -8.332 2.835 1.00 0.40 H new ATOM 0 HG11 VAL A 42 12.236 -9.470 1.558 1.00 0.45 H new ATOM 0 HG12 VAL A 42 12.778 -10.424 2.960 1.00 0.45 H new ATOM 0 HG13 VAL A 42 11.239 -9.533 3.031 1.00 0.45 H new ATOM 0 HG21 VAL A 42 12.293 -7.025 1.598 1.00 0.41 H new ATOM 0 HG22 VAL A 42 11.320 -6.937 3.085 1.00 0.41 H new ATOM 0 HG23 VAL A 42 12.910 -6.142 3.014 1.00 0.41 H new ATOM 668 N THR A 43 14.963 -9.621 5.694 1.00 0.39 N ATOM 669 CA THR A 43 15.636 -10.839 6.190 1.00 0.42 C ATOM 670 C THR A 43 15.924 -10.768 7.714 1.00 0.49 C ATOM 671 O THR A 43 16.940 -11.303 8.181 1.00 0.80 O ATOM 672 CB THR A 43 16.964 -11.091 5.393 1.00 0.45 C ATOM 673 OG1 THR A 43 16.814 -10.675 4.023 1.00 0.46 O ATOM 674 CG2 THR A 43 17.385 -12.567 5.425 1.00 0.50 C ATOM 0 H THR A 43 15.555 -8.790 5.690 1.00 0.39 H new ATOM 0 HA THR A 43 14.957 -11.676 6.027 1.00 0.42 H new ATOM 0 HB THR A 43 17.742 -10.502 5.879 1.00 0.45 H new ATOM 0 HG1 THR A 43 16.822 -9.696 3.976 1.00 0.46 H new ATOM 0 HG21 THR A 43 18.309 -12.694 4.861 1.00 0.50 H new ATOM 0 HG22 THR A 43 17.545 -12.877 6.458 1.00 0.50 H new ATOM 0 HG23 THR A 43 16.601 -13.179 4.979 1.00 0.50 H new ATOM 682 N GLN A 44 15.022 -10.121 8.499 1.00 0.41 N ATOM 683 CA GLN A 44 15.197 -10.013 9.969 1.00 0.44 C ATOM 684 C GLN A 44 13.882 -9.640 10.696 1.00 0.44 C ATOM 685 O GLN A 44 13.529 -10.283 11.691 1.00 0.50 O ATOM 686 CB GLN A 44 16.317 -9.000 10.325 1.00 0.48 C ATOM 687 CG GLN A 44 17.060 -9.331 11.621 1.00 0.65 C ATOM 688 CD GLN A 44 18.279 -8.445 11.857 1.00 0.77 C ATOM 689 OE1 GLN A 44 19.369 -8.736 11.364 1.00 1.02 O ATOM 690 NE2 GLN A 44 18.109 -7.366 12.623 1.00 1.10 N ATOM 0 H GLN A 44 14.178 -9.673 8.143 1.00 0.41 H new ATOM 0 HA GLN A 44 15.493 -11.002 10.320 1.00 0.44 H new ATOM 0 HB2 GLN A 44 17.034 -8.963 9.505 1.00 0.48 H new ATOM 0 HB3 GLN A 44 15.880 -8.005 10.412 1.00 0.48 H new ATOM 0 HG2 GLN A 44 16.375 -9.227 12.462 1.00 0.65 H new ATOM 0 HG3 GLN A 44 17.376 -10.374 11.595 1.00 0.65 H new ATOM 0 HE21 GLN A 44 17.190 -7.158 13.014 1.00 1.10 H new ATOM 0 HE22 GLN A 44 18.898 -6.749 12.818 1.00 1.10 H new ATOM 699 N GLN A 45 13.170 -8.600 10.207 1.00 0.41 N ATOM 700 CA GLN A 45 11.897 -8.144 10.817 1.00 0.43 C ATOM 701 C GLN A 45 10.667 -8.447 9.929 1.00 0.41 C ATOM 702 O GLN A 45 9.545 -8.513 10.442 1.00 0.45 O ATOM 703 CB GLN A 45 11.973 -6.631 11.115 1.00 0.47 C ATOM 704 CG GLN A 45 11.001 -6.141 12.193 1.00 0.59 C ATOM 705 CD GLN A 45 11.255 -4.694 12.625 1.00 0.64 C ATOM 706 OE1 GLN A 45 11.733 -3.872 11.839 1.00 0.65 O ATOM 707 NE2 GLN A 45 10.936 -4.369 13.878 1.00 0.84 N ATOM 0 H GLN A 45 13.455 -8.059 9.391 1.00 0.41 H new ATOM 0 HA GLN A 45 11.766 -8.702 11.744 1.00 0.43 H new ATOM 0 HB2 GLN A 45 12.989 -6.386 11.423 1.00 0.47 H new ATOM 0 HB3 GLN A 45 11.778 -6.083 10.193 1.00 0.47 H new ATOM 0 HG2 GLN A 45 9.981 -6.227 11.819 1.00 0.59 H new ATOM 0 HG3 GLN A 45 11.077 -6.792 13.064 1.00 0.59 H new ATOM 0 HE21 GLN A 45 10.542 -5.073 14.503 1.00 0.84 H new ATOM 0 HE22 GLN A 45 11.086 -3.417 14.212 1.00 0.84 H new ATOM 716 N LEU A 46 10.876 -8.637 8.605 1.00 0.40 N ATOM 717 CA LEU A 46 9.781 -8.917 7.657 1.00 0.40 C ATOM 718 C LEU A 46 10.065 -10.177 6.773 1.00 0.40 C ATOM 719 O LEU A 46 9.751 -10.157 5.576 1.00 0.42 O ATOM 720 CB LEU A 46 9.592 -7.661 6.767 1.00 0.41 C ATOM 721 CG LEU A 46 8.237 -7.535 6.023 1.00 0.40 C ATOM 722 CD1 LEU A 46 7.261 -6.657 6.810 1.00 0.59 C ATOM 723 CD2 LEU A 46 8.436 -6.988 4.603 1.00 0.67 C ATOM 0 H LEU A 46 11.799 -8.600 8.171 1.00 0.40 H new ATOM 0 HA LEU A 46 8.873 -9.137 8.219 1.00 0.40 H new ATOM 0 HB2 LEU A 46 9.721 -6.778 7.393 1.00 0.41 H new ATOM 0 HB3 LEU A 46 10.391 -7.646 6.025 1.00 0.41 H new ATOM 0 HG LEU A 46 7.807 -8.533 5.942 1.00 0.40 H new ATOM 0 HD11 LEU A 46 6.318 -6.584 6.267 1.00 0.59 H new ATOM 0 HD12 LEU A 46 7.082 -7.100 7.790 1.00 0.59 H new ATOM 0 HD13 LEU A 46 7.686 -5.661 6.934 1.00 0.59 H new ATOM 0 HD21 LEU A 46 7.470 -6.910 4.104 1.00 0.67 H new ATOM 0 HD22 LEU A 46 8.899 -6.002 4.654 1.00 0.67 H new ATOM 0 HD23 LEU A 46 9.081 -7.663 4.040 1.00 0.67 H new ATOM 735 N PRO A 47 10.642 -11.307 7.323 1.00 0.42 N ATOM 736 CA PRO A 47 10.930 -12.516 6.515 1.00 0.45 C ATOM 737 C PRO A 47 9.719 -13.445 6.301 1.00 0.47 C ATOM 738 O PRO A 47 9.576 -14.018 5.218 1.00 0.52 O ATOM 739 CB PRO A 47 12.025 -13.210 7.332 1.00 0.49 C ATOM 740 CG PRO A 47 11.693 -12.886 8.749 1.00 0.49 C ATOM 741 CD PRO A 47 11.081 -11.505 8.735 1.00 0.46 C ATOM 0 HA PRO A 47 11.218 -12.256 5.496 1.00 0.45 H new ATOM 0 HB2 PRO A 47 12.027 -14.286 7.161 1.00 0.49 H new ATOM 0 HB3 PRO A 47 13.015 -12.843 7.062 1.00 0.49 H new ATOM 0 HG2 PRO A 47 10.997 -13.616 9.162 1.00 0.49 H new ATOM 0 HG3 PRO A 47 12.586 -12.909 9.373 1.00 0.49 H new ATOM 0 HD2 PRO A 47 10.241 -11.436 9.426 1.00 0.46 H new ATOM 0 HD3 PRO A 47 11.804 -10.747 9.036 1.00 0.46 H new ATOM 749 N HIS A 48 8.852 -13.595 7.325 1.00 0.47 N ATOM 750 CA HIS A 48 7.666 -14.472 7.227 1.00 0.52 C ATOM 751 C HIS A 48 6.607 -13.914 6.255 1.00 0.50 C ATOM 752 O HIS A 48 5.846 -14.690 5.667 1.00 0.57 O ATOM 753 CB HIS A 48 7.038 -14.706 8.614 1.00 0.57 C ATOM 754 CG HIS A 48 7.975 -15.339 9.608 1.00 0.65 C ATOM 755 ND1 HIS A 48 8.606 -14.629 10.608 1.00 0.69 N ATOM 756 CD2 HIS A 48 8.388 -16.623 9.746 1.00 0.79 C ATOM 757 CE1 HIS A 48 9.365 -15.445 11.316 1.00 0.80 C ATOM 758 NE2 HIS A 48 9.250 -16.660 10.813 1.00 0.85 N ATOM 0 H HIS A 48 8.950 -13.123 8.224 1.00 0.47 H new ATOM 0 HA HIS A 48 8.013 -15.425 6.828 1.00 0.52 H new ATOM 0 HB2 HIS A 48 6.693 -13.752 9.012 1.00 0.57 H new ATOM 0 HB3 HIS A 48 6.159 -15.341 8.502 1.00 0.57 H new ATOM 0 HD2 HIS A 48 8.093 -17.460 9.131 1.00 0.79 H new ATOM 0 HE1 HIS A 48 9.976 -15.166 12.162 1.00 0.80 H new ATOM 0 HE2 HIS A 48 9.725 -17.492 11.161 1.00 0.85 H new ATOM 767 N LEU A 49 6.567 -12.574 6.076 1.00 0.46 N ATOM 768 CA LEU A 49 5.596 -11.933 5.168 1.00 0.46 C ATOM 769 C LEU A 49 5.903 -12.282 3.701 1.00 0.45 C ATOM 770 O LEU A 49 5.074 -12.900 3.028 1.00 0.53 O ATOM 771 CB LEU A 49 5.576 -10.400 5.376 1.00 0.47 C ATOM 772 CG LEU A 49 4.294 -9.680 4.907 1.00 0.50 C ATOM 773 CD1 LEU A 49 3.108 -10.026 5.807 1.00 0.87 C ATOM 774 CD2 LEU A 49 4.509 -8.171 4.864 1.00 0.53 C ATOM 0 H LEU A 49 7.193 -11.921 6.547 1.00 0.46 H new ATOM 0 HA LEU A 49 4.605 -12.320 5.407 1.00 0.46 H new ATOM 0 HB2 LEU A 49 5.720 -10.193 6.437 1.00 0.47 H new ATOM 0 HB3 LEU A 49 6.427 -9.969 4.849 1.00 0.47 H new ATOM 0 HG LEU A 49 4.066 -10.026 3.899 1.00 0.50 H new ATOM 0 HD11 LEU A 49 2.218 -9.505 5.453 1.00 0.87 H new ATOM 0 HD12 LEU A 49 2.933 -11.102 5.781 1.00 0.87 H new ATOM 0 HD13 LEU A 49 3.326 -9.719 6.830 1.00 0.87 H new ATOM 0 HD21 LEU A 49 3.593 -7.682 4.531 1.00 0.53 H new ATOM 0 HD22 LEU A 49 4.770 -7.812 5.860 1.00 0.53 H new ATOM 0 HD23 LEU A 49 5.317 -7.938 4.171 1.00 0.53 H new ATOM 786 N LEU A 50 7.098 -11.887 3.217 1.00 0.43 N ATOM 787 CA LEU A 50 7.524 -12.188 1.845 1.00 0.45 C ATOM 788 C LEU A 50 8.149 -13.592 1.820 1.00 0.48 C ATOM 789 O LEU A 50 9.202 -13.814 2.429 1.00 0.54 O ATOM 790 CB LEU A 50 8.520 -11.122 1.325 1.00 0.48 C ATOM 791 CG LEU A 50 7.962 -9.679 1.190 1.00 0.57 C ATOM 792 CD1 LEU A 50 9.088 -8.674 0.923 1.00 0.66 C ATOM 793 CD2 LEU A 50 6.894 -9.593 0.090 1.00 0.73 C ATOM 0 H LEU A 50 7.781 -11.359 3.760 1.00 0.43 H new ATOM 0 HA LEU A 50 6.659 -12.165 1.182 1.00 0.45 H new ATOM 0 HB2 LEU A 50 9.378 -11.097 1.996 1.00 0.48 H new ATOM 0 HB3 LEU A 50 8.887 -11.441 0.350 1.00 0.48 H new ATOM 0 HG LEU A 50 7.491 -9.422 2.139 1.00 0.57 H new ATOM 0 HD11 LEU A 50 8.668 -7.672 0.833 1.00 0.66 H new ATOM 0 HD12 LEU A 50 9.799 -8.696 1.749 1.00 0.66 H new ATOM 0 HD13 LEU A 50 9.599 -8.938 -0.003 1.00 0.66 H new ATOM 0 HD21 LEU A 50 6.524 -8.570 0.021 1.00 0.73 H new ATOM 0 HD22 LEU A 50 7.331 -9.886 -0.865 1.00 0.73 H new ATOM 0 HD23 LEU A 50 6.068 -10.262 0.332 1.00 0.73 H new ATOM 805 N LYS A 51 7.485 -14.538 1.120 1.00 0.55 N ATOM 806 CA LYS A 51 7.943 -15.947 1.033 1.00 0.66 C ATOM 807 C LYS A 51 9.411 -16.085 0.577 1.00 0.63 C ATOM 808 O LYS A 51 10.113 -16.993 1.034 1.00 0.76 O ATOM 809 CB LYS A 51 7.006 -16.780 0.121 1.00 0.78 C ATOM 810 CG LYS A 51 7.033 -16.420 -1.381 1.00 0.78 C ATOM 811 CD LYS A 51 5.656 -16.011 -1.913 1.00 1.18 C ATOM 812 CE LYS A 51 5.653 -15.799 -3.431 1.00 1.16 C ATOM 813 NZ LYS A 51 5.816 -17.073 -4.197 1.00 1.32 N ATOM 0 H LYS A 51 6.625 -14.352 0.604 1.00 0.55 H new ATOM 0 HA LYS A 51 7.896 -16.344 2.047 1.00 0.66 H new ATOM 0 HB2 LYS A 51 7.269 -17.833 0.227 1.00 0.78 H new ATOM 0 HB3 LYS A 51 5.984 -16.668 0.483 1.00 0.78 H new ATOM 0 HG2 LYS A 51 7.738 -15.605 -1.543 1.00 0.78 H new ATOM 0 HG3 LYS A 51 7.399 -17.275 -1.949 1.00 0.78 H new ATOM 0 HD2 LYS A 51 4.927 -16.780 -1.655 1.00 1.18 H new ATOM 0 HD3 LYS A 51 5.338 -15.092 -1.420 1.00 1.18 H new ATOM 0 HE2 LYS A 51 4.718 -15.322 -3.724 1.00 1.16 H new ATOM 0 HE3 LYS A 51 6.458 -15.114 -3.699 1.00 1.16 H new ATOM 0 HZ1 LYS A 51 5.739 -16.878 -5.216 1.00 1.32 H new ATOM 0 HZ2 LYS A 51 6.749 -17.484 -3.993 1.00 1.32 H new ATOM 0 HZ3 LYS A 51 5.073 -17.745 -3.916 1.00 1.32 H new ATOM 827 N ASP A 52 9.864 -15.177 -0.312 1.00 0.64 N ATOM 828 CA ASP A 52 11.236 -15.192 -0.833 1.00 0.71 C ATOM 829 C ASP A 52 12.055 -14.042 -0.215 1.00 0.59 C ATOM 830 O ASP A 52 11.730 -12.866 -0.421 1.00 0.73 O ATOM 831 CB ASP A 52 11.205 -15.083 -2.372 1.00 0.99 C ATOM 832 CG ASP A 52 12.476 -15.586 -3.026 1.00 1.46 C ATOM 833 OD1 ASP A 52 13.502 -14.888 -2.934 1.00 2.08 O ATOM 834 OD2 ASP A 52 12.441 -16.681 -3.626 1.00 2.02 O ATOM 0 H ASP A 52 9.290 -14.420 -0.683 1.00 0.64 H new ATOM 0 HA ASP A 52 11.717 -16.131 -0.559 1.00 0.71 H new ATOM 0 HB2 ASP A 52 10.357 -15.651 -2.754 1.00 0.99 H new ATOM 0 HB3 ASP A 52 11.045 -14.042 -2.654 1.00 0.99 H new ATOM 839 N VAL A 53 13.114 -14.392 0.548 1.00 0.51 N ATOM 840 CA VAL A 53 13.988 -13.392 1.209 1.00 0.52 C ATOM 841 C VAL A 53 15.356 -13.250 0.506 1.00 0.56 C ATOM 842 O VAL A 53 15.915 -12.148 0.473 1.00 0.71 O ATOM 843 CB VAL A 53 14.211 -13.703 2.732 1.00 0.59 C ATOM 844 CG1 VAL A 53 12.922 -13.474 3.524 1.00 0.65 C ATOM 845 CG2 VAL A 53 14.743 -15.125 2.965 1.00 0.64 C ATOM 0 H VAL A 53 13.386 -15.359 0.723 1.00 0.51 H new ATOM 0 HA VAL A 53 13.456 -12.445 1.125 1.00 0.52 H new ATOM 0 HB VAL A 53 14.974 -13.012 3.091 1.00 0.59 H new ATOM 0 HG11 VAL A 53 13.098 -13.695 4.577 1.00 0.65 H new ATOM 0 HG12 VAL A 53 12.610 -12.435 3.419 1.00 0.65 H new ATOM 0 HG13 VAL A 53 12.139 -14.129 3.142 1.00 0.65 H new ATOM 0 HG21 VAL A 53 14.881 -15.291 4.033 1.00 0.64 H new ATOM 0 HG22 VAL A 53 14.029 -15.849 2.574 1.00 0.64 H new ATOM 0 HG23 VAL A 53 15.698 -15.245 2.453 1.00 0.64 H new ATOM 855 N GLY A 54 15.894 -14.359 -0.047 1.00 0.53 N ATOM 856 CA GLY A 54 17.189 -14.326 -0.733 1.00 0.64 C ATOM 857 C GLY A 54 17.120 -13.700 -2.121 1.00 0.61 C ATOM 858 O GLY A 54 17.872 -12.764 -2.415 1.00 0.83 O ATOM 0 H GLY A 54 15.450 -15.277 -0.028 1.00 0.53 H new ATOM 0 HA2 GLY A 54 17.900 -13.767 -0.125 1.00 0.64 H new ATOM 0 HA3 GLY A 54 17.573 -15.343 -0.819 1.00 0.64 H new ATOM 862 N SER A 55 16.215 -14.216 -2.975 1.00 0.57 N ATOM 863 CA SER A 55 16.040 -13.709 -4.347 1.00 0.58 C ATOM 864 C SER A 55 15.021 -12.547 -4.378 1.00 0.51 C ATOM 865 O SER A 55 13.871 -12.715 -4.802 1.00 0.62 O ATOM 866 CB SER A 55 15.611 -14.854 -5.290 1.00 0.74 C ATOM 867 OG SER A 55 15.712 -14.465 -6.650 1.00 0.85 O ATOM 0 H SER A 55 15.592 -14.987 -2.736 1.00 0.57 H new ATOM 0 HA SER A 55 16.995 -13.319 -4.698 1.00 0.58 H new ATOM 0 HB2 SER A 55 16.237 -15.729 -5.112 1.00 0.74 H new ATOM 0 HB3 SER A 55 14.585 -15.146 -5.068 1.00 0.74 H new ATOM 0 HG SER A 55 16.292 -13.679 -6.723 1.00 0.85 H new ATOM 873 N LEU A 56 15.463 -11.363 -3.903 1.00 0.49 N ATOM 874 CA LEU A 56 14.621 -10.147 -3.872 1.00 0.53 C ATOM 875 C LEU A 56 14.783 -9.311 -5.170 1.00 0.58 C ATOM 876 O LEU A 56 14.103 -8.294 -5.340 1.00 1.03 O ATOM 877 CB LEU A 56 14.971 -9.288 -2.619 1.00 0.67 C ATOM 878 CG LEU A 56 13.789 -8.675 -1.820 1.00 0.83 C ATOM 879 CD1 LEU A 56 12.928 -7.749 -2.684 1.00 1.22 C ATOM 880 CD2 LEU A 56 12.934 -9.766 -1.162 1.00 1.21 C ATOM 0 H LEU A 56 16.403 -11.223 -3.534 1.00 0.49 H new ATOM 0 HA LEU A 56 13.578 -10.458 -3.810 1.00 0.53 H new ATOM 0 HB2 LEU A 56 15.553 -9.908 -1.937 1.00 0.67 H new ATOM 0 HB3 LEU A 56 15.619 -8.473 -2.940 1.00 0.67 H new ATOM 0 HG LEU A 56 14.225 -8.065 -1.029 1.00 0.83 H new ATOM 0 HD11 LEU A 56 12.114 -7.344 -2.083 1.00 1.22 H new ATOM 0 HD12 LEU A 56 13.541 -6.931 -3.063 1.00 1.22 H new ATOM 0 HD13 LEU A 56 12.515 -8.312 -3.521 1.00 1.22 H new ATOM 0 HD21 LEU A 56 12.115 -9.304 -0.611 1.00 1.21 H new ATOM 0 HD22 LEU A 56 12.528 -10.423 -1.931 1.00 1.21 H new ATOM 0 HD23 LEU A 56 13.551 -10.347 -0.476 1.00 1.21 H new ATOM 892 N ASP A 57 15.676 -9.753 -6.091 1.00 0.49 N ATOM 893 CA ASP A 57 15.934 -9.047 -7.369 1.00 0.53 C ATOM 894 C ASP A 57 14.686 -8.957 -8.287 1.00 0.47 C ATOM 895 O ASP A 57 14.625 -8.068 -9.140 1.00 0.50 O ATOM 896 CB ASP A 57 17.103 -9.716 -8.127 1.00 0.67 C ATOM 897 CG ASP A 57 16.869 -11.192 -8.427 1.00 0.70 C ATOM 898 OD1 ASP A 57 16.259 -11.497 -9.474 1.00 0.77 O ATOM 899 OD2 ASP A 57 17.293 -12.039 -7.610 1.00 0.77 O ATOM 0 H ASP A 57 16.232 -10.600 -5.970 1.00 0.49 H new ATOM 0 HA ASP A 57 16.201 -8.024 -7.104 1.00 0.53 H new ATOM 0 HB2 ASP A 57 17.269 -9.185 -9.064 1.00 0.67 H new ATOM 0 HB3 ASP A 57 18.014 -9.613 -7.537 1.00 0.67 H new ATOM 904 N GLU A 58 13.701 -9.873 -8.115 1.00 0.46 N ATOM 905 CA GLU A 58 12.467 -9.863 -8.937 1.00 0.51 C ATOM 906 C GLU A 58 11.646 -8.576 -8.696 1.00 0.47 C ATOM 907 O GLU A 58 11.138 -7.976 -9.648 1.00 0.56 O ATOM 908 CB GLU A 58 11.602 -11.113 -8.650 1.00 0.60 C ATOM 909 CG GLU A 58 10.561 -11.422 -9.728 1.00 0.79 C ATOM 910 CD GLU A 58 9.719 -12.646 -9.406 1.00 0.92 C ATOM 911 OE1 GLU A 58 10.225 -13.777 -9.571 1.00 1.09 O ATOM 912 OE2 GLU A 58 8.550 -12.474 -8.997 1.00 1.02 O ATOM 0 H GLU A 58 13.736 -10.620 -7.422 1.00 0.46 H new ATOM 0 HA GLU A 58 12.769 -9.884 -9.984 1.00 0.51 H new ATOM 0 HB2 GLU A 58 12.258 -11.976 -8.538 1.00 0.60 H new ATOM 0 HB3 GLU A 58 11.091 -10.975 -7.697 1.00 0.60 H new ATOM 0 HG2 GLU A 58 9.906 -10.559 -9.851 1.00 0.79 H new ATOM 0 HG3 GLU A 58 11.067 -11.576 -10.681 1.00 0.79 H new ATOM 919 N LYS A 59 11.536 -8.164 -7.413 1.00 0.42 N ATOM 920 CA LYS A 59 10.791 -6.952 -7.027 1.00 0.47 C ATOM 921 C LYS A 59 11.709 -5.709 -6.963 1.00 0.53 C ATOM 922 O LYS A 59 11.229 -4.589 -7.165 1.00 0.91 O ATOM 923 CB LYS A 59 10.076 -7.153 -5.667 1.00 0.52 C ATOM 924 CG LYS A 59 8.814 -8.029 -5.722 1.00 0.60 C ATOM 925 CD LYS A 59 9.125 -9.522 -5.878 1.00 0.81 C ATOM 926 CE LYS A 59 7.876 -10.392 -5.715 1.00 1.17 C ATOM 927 NZ LYS A 59 8.174 -11.846 -5.874 1.00 1.55 N ATOM 0 H LYS A 59 11.957 -8.658 -6.626 1.00 0.42 H new ATOM 0 HA LYS A 59 10.042 -6.778 -7.799 1.00 0.47 H new ATOM 0 HB2 LYS A 59 10.780 -7.600 -4.965 1.00 0.52 H new ATOM 0 HB3 LYS A 59 9.805 -6.176 -5.268 1.00 0.52 H new ATOM 0 HG2 LYS A 59 8.234 -7.878 -4.812 1.00 0.60 H new ATOM 0 HG3 LYS A 59 8.190 -7.705 -6.555 1.00 0.60 H new ATOM 0 HD2 LYS A 59 9.564 -9.699 -6.860 1.00 0.81 H new ATOM 0 HD3 LYS A 59 9.870 -9.816 -5.138 1.00 0.81 H new ATOM 0 HE2 LYS A 59 7.441 -10.218 -4.731 1.00 1.17 H new ATOM 0 HE3 LYS A 59 7.129 -10.094 -6.451 1.00 1.17 H new ATOM 0 HZ1 LYS A 59 7.383 -12.406 -5.496 1.00 1.55 H new ATOM 0 HZ2 LYS A 59 8.303 -12.066 -6.882 1.00 1.55 H new ATOM 0 HZ3 LYS A 59 9.044 -12.081 -5.354 1.00 1.55 H new ATOM 941 N MET A 60 13.027 -5.907 -6.695 1.00 0.39 N ATOM 942 CA MET A 60 14.004 -4.789 -6.606 1.00 0.41 C ATOM 943 C MET A 60 14.042 -3.934 -7.899 1.00 0.42 C ATOM 944 O MET A 60 14.241 -2.719 -7.824 1.00 0.46 O ATOM 945 CB MET A 60 15.420 -5.325 -6.280 1.00 0.45 C ATOM 946 CG MET A 60 16.388 -4.257 -5.758 1.00 0.53 C ATOM 947 SD MET A 60 18.035 -4.907 -5.382 1.00 0.66 S ATOM 948 CE MET A 60 18.790 -4.899 -7.004 1.00 0.84 C ATOM 0 H MET A 60 13.436 -6.828 -6.537 1.00 0.39 H new ATOM 0 HA MET A 60 13.670 -4.141 -5.796 1.00 0.41 H new ATOM 0 HB2 MET A 60 15.335 -6.117 -5.536 1.00 0.45 H new ATOM 0 HB3 MET A 60 15.842 -5.775 -7.178 1.00 0.45 H new ATOM 0 HG2 MET A 60 16.479 -3.464 -6.501 1.00 0.53 H new ATOM 0 HG3 MET A 60 15.969 -3.805 -4.859 1.00 0.53 H new ATOM 0 HE1 MET A 60 19.811 -5.274 -6.932 1.00 0.84 H new ATOM 0 HE2 MET A 60 18.215 -5.537 -7.676 1.00 0.84 H new ATOM 0 HE3 MET A 60 18.804 -3.881 -7.394 1.00 0.84 H new ATOM 958 N LYS A 61 13.847 -4.577 -9.074 1.00 0.44 N ATOM 959 CA LYS A 61 13.841 -3.871 -10.378 1.00 0.49 C ATOM 960 C LYS A 61 12.659 -2.880 -10.475 1.00 0.46 C ATOM 961 O LYS A 61 12.820 -1.778 -11.008 1.00 0.49 O ATOM 962 CB LYS A 61 13.791 -4.880 -11.550 1.00 0.59 C ATOM 963 CG LYS A 61 15.113 -5.617 -11.820 1.00 0.70 C ATOM 964 CD LYS A 61 16.195 -4.714 -12.440 1.00 1.11 C ATOM 965 CE LYS A 61 15.913 -4.376 -13.907 1.00 1.90 C ATOM 966 NZ LYS A 61 16.871 -3.371 -14.456 1.00 2.56 N ATOM 0 H LYS A 61 13.692 -5.583 -9.146 1.00 0.44 H new ATOM 0 HA LYS A 61 14.768 -3.302 -10.447 1.00 0.49 H new ATOM 0 HB2 LYS A 61 13.015 -5.617 -11.344 1.00 0.59 H new ATOM 0 HB3 LYS A 61 13.495 -4.350 -12.455 1.00 0.59 H new ATOM 0 HG2 LYS A 61 15.488 -6.032 -10.884 1.00 0.70 H new ATOM 0 HG3 LYS A 61 14.923 -6.457 -12.488 1.00 0.70 H new ATOM 0 HD2 LYS A 61 16.265 -3.790 -11.865 1.00 1.11 H new ATOM 0 HD3 LYS A 61 17.163 -5.210 -12.365 1.00 1.11 H new ATOM 0 HE2 LYS A 61 15.966 -5.287 -14.503 1.00 1.90 H new ATOM 0 HE3 LYS A 61 14.897 -3.993 -13.999 1.00 1.90 H new ATOM 0 HZ1 LYS A 61 16.638 -3.176 -15.451 1.00 2.56 H new ATOM 0 HZ2 LYS A 61 16.804 -2.491 -13.906 1.00 2.56 H new ATOM 0 HZ3 LYS A 61 17.840 -3.745 -14.394 1.00 2.56 H new ATOM 980 N SER A 62 11.480 -3.283 -9.954 1.00 0.44 N ATOM 981 CA SER A 62 10.276 -2.424 -9.958 1.00 0.46 C ATOM 982 C SER A 62 10.441 -1.220 -9.007 1.00 0.43 C ATOM 983 O SER A 62 9.911 -0.140 -9.283 1.00 0.47 O ATOM 984 CB SER A 62 9.029 -3.233 -9.571 1.00 0.53 C ATOM 985 OG SER A 62 8.774 -4.255 -10.520 1.00 0.61 O ATOM 0 H SER A 62 11.336 -4.197 -9.525 1.00 0.44 H new ATOM 0 HA SER A 62 10.149 -2.043 -10.971 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.169 -3.674 -8.584 1.00 0.53 H new ATOM 0 HB3 SER A 62 8.167 -2.570 -9.504 1.00 0.53 H new ATOM 0 HG SER A 62 7.977 -4.758 -10.253 1.00 0.61 H new ATOM 991 N LEU A 63 11.180 -1.416 -7.889 1.00 0.40 N ATOM 992 CA LEU A 63 11.432 -0.343 -6.903 1.00 0.43 C ATOM 993 C LEU A 63 12.409 0.695 -7.472 1.00 0.45 C ATOM 994 O LEU A 63 12.094 1.883 -7.525 1.00 0.53 O ATOM 995 CB LEU A 63 11.996 -0.911 -5.577 1.00 0.45 C ATOM 996 CG LEU A 63 11.147 -2.001 -4.888 1.00 0.42 C ATOM 997 CD1 LEU A 63 11.905 -2.625 -3.717 1.00 0.48 C ATOM 998 CD2 LEU A 63 9.799 -1.448 -4.417 1.00 0.68 C ATOM 0 H LEU A 63 11.611 -2.309 -7.649 1.00 0.40 H new ATOM 0 HA LEU A 63 10.476 0.136 -6.694 1.00 0.43 H new ATOM 0 HB2 LEU A 63 12.987 -1.321 -5.774 1.00 0.45 H new ATOM 0 HB3 LEU A 63 12.126 -0.085 -4.878 1.00 0.45 H new ATOM 0 HG LEU A 63 10.952 -2.777 -5.628 1.00 0.42 H new ATOM 0 HD11 LEU A 63 11.285 -3.390 -3.249 1.00 0.48 H new ATOM 0 HD12 LEU A 63 12.827 -3.078 -4.081 1.00 0.48 H new ATOM 0 HD13 LEU A 63 12.144 -1.853 -2.985 1.00 0.48 H new ATOM 0 HD21 LEU A 63 9.228 -2.242 -3.937 1.00 0.68 H new ATOM 0 HD22 LEU A 63 9.966 -0.640 -3.705 1.00 0.68 H new ATOM 0 HD23 LEU A 63 9.242 -1.068 -5.274 1.00 0.68 H new ATOM 1010 N ASP A 64 13.588 0.223 -7.917 1.00 0.45 N ATOM 1011 CA ASP A 64 14.623 1.092 -8.487 1.00 0.51 C ATOM 1012 C ASP A 64 14.460 1.185 -10.019 1.00 0.50 C ATOM 1013 O ASP A 64 15.316 0.715 -10.781 1.00 0.54 O ATOM 1014 CB ASP A 64 16.017 0.561 -8.083 1.00 0.60 C ATOM 1015 CG ASP A 64 17.160 1.504 -8.437 1.00 0.83 C ATOM 1016 OD1 ASP A 64 17.269 2.576 -7.803 1.00 1.39 O ATOM 1017 OD2 ASP A 64 17.951 1.164 -9.343 1.00 1.28 O ATOM 0 H ASP A 64 13.845 -0.764 -7.890 1.00 0.45 H new ATOM 0 HA ASP A 64 14.518 2.102 -8.092 1.00 0.51 H new ATOM 0 HB2 ASP A 64 16.029 0.378 -7.008 1.00 0.60 H new ATOM 0 HB3 ASP A 64 16.186 -0.399 -8.571 1.00 0.60 H new ATOM 1022 N VAL A 65 13.328 1.775 -10.458 1.00 0.51 N ATOM 1023 CA VAL A 65 13.035 1.961 -11.889 1.00 0.55 C ATOM 1024 C VAL A 65 13.593 3.318 -12.378 1.00 0.55 C ATOM 1025 O VAL A 65 14.045 3.427 -13.523 1.00 0.60 O ATOM 1026 CB VAL A 65 11.502 1.812 -12.201 1.00 0.64 C ATOM 1027 CG1 VAL A 65 10.660 2.956 -11.619 1.00 0.67 C ATOM 1028 CG2 VAL A 65 11.256 1.654 -13.707 1.00 0.73 C ATOM 0 H VAL A 65 12.602 2.131 -9.837 1.00 0.51 H new ATOM 0 HA VAL A 65 13.538 1.167 -12.442 1.00 0.55 H new ATOM 0 HB VAL A 65 11.172 0.901 -11.702 1.00 0.64 H new ATOM 0 HG11 VAL A 65 9.610 2.798 -11.867 1.00 0.67 H new ATOM 0 HG12 VAL A 65 10.777 2.979 -10.536 1.00 0.67 H new ATOM 0 HG13 VAL A 65 10.994 3.904 -12.041 1.00 0.67 H new ATOM 0 HG21 VAL A 65 10.187 1.553 -13.892 1.00 0.73 H new ATOM 0 HG22 VAL A 65 11.634 2.532 -14.231 1.00 0.73 H new ATOM 0 HG23 VAL A 65 11.772 0.765 -14.069 1.00 0.73 H new ATOM 1038 N ASN A 66 13.554 4.350 -11.496 1.00 0.56 N ATOM 1039 CA ASN A 66 14.100 5.690 -11.807 1.00 0.60 C ATOM 1040 C ASN A 66 15.645 5.624 -11.902 1.00 0.59 C ATOM 1041 O ASN A 66 16.251 6.356 -12.689 1.00 0.66 O ATOM 1042 CB ASN A 66 13.665 6.713 -10.731 1.00 0.67 C ATOM 1043 CG ASN A 66 13.897 8.166 -11.147 1.00 0.94 C ATOM 1044 OD1 ASN A 66 13.038 8.781 -11.783 1.00 1.29 O ATOM 1045 ND2 ASN A 66 15.049 8.728 -10.782 1.00 1.44 N ATOM 0 H ASN A 66 13.149 4.276 -10.563 1.00 0.56 H new ATOM 0 HA ASN A 66 13.705 6.017 -12.769 1.00 0.60 H new ATOM 0 HB2 ASN A 66 12.607 6.570 -10.511 1.00 0.67 H new ATOM 0 HB3 ASN A 66 14.212 6.515 -9.809 1.00 0.67 H new ATOM 0 HD21 ASN A 66 15.244 9.698 -11.028 1.00 1.44 H new ATOM 0 HD22 ASN A 66 15.736 8.188 -10.256 1.00 1.44 H new ATOM 1052 N GLN A 67 16.262 4.733 -11.082 1.00 0.55 N ATOM 1053 CA GLN A 67 17.724 4.504 -11.055 1.00 0.60 C ATOM 1054 C GLN A 67 18.494 5.754 -10.587 1.00 0.63 C ATOM 1055 O GLN A 67 18.979 6.544 -11.406 1.00 0.78 O ATOM 1056 CB GLN A 67 18.240 4.000 -12.428 1.00 0.70 C ATOM 1057 CG GLN A 67 17.512 2.756 -12.946 1.00 0.88 C ATOM 1058 CD GLN A 67 17.764 2.485 -14.428 1.00 1.20 C ATOM 1059 OE1 GLN A 67 17.045 2.998 -15.284 1.00 1.96 O ATOM 1060 NE2 GLN A 67 18.772 1.671 -14.745 1.00 1.86 N ATOM 0 H GLN A 67 15.751 4.151 -10.418 1.00 0.55 H new ATOM 0 HA GLN A 67 17.914 3.720 -10.322 1.00 0.60 H new ATOM 0 HB2 GLN A 67 18.136 4.801 -13.160 1.00 0.70 H new ATOM 0 HB3 GLN A 67 19.304 3.779 -12.346 1.00 0.70 H new ATOM 0 HG2 GLN A 67 17.829 1.889 -12.366 1.00 0.88 H new ATOM 0 HG3 GLN A 67 16.441 2.875 -12.782 1.00 0.88 H new ATOM 0 HE21 GLN A 67 19.349 1.263 -14.009 1.00 1.86 H new ATOM 0 HE22 GLN A 67 18.966 1.457 -15.723 1.00 1.86 H new ATOM 1069 N ASP A 68 18.572 5.931 -9.253 1.00 0.62 N ATOM 1070 CA ASP A 68 19.289 7.068 -8.636 1.00 0.71 C ATOM 1071 C ASP A 68 19.883 6.693 -7.246 1.00 0.77 C ATOM 1072 O ASP A 68 20.223 7.580 -6.457 1.00 1.32 O ATOM 1073 CB ASP A 68 18.323 8.273 -8.504 1.00 0.78 C ATOM 1074 CG ASP A 68 19.034 9.612 -8.413 1.00 1.08 C ATOM 1075 OD1 ASP A 68 19.437 10.144 -9.468 1.00 1.41 O ATOM 1076 OD2 ASP A 68 19.182 10.132 -7.287 1.00 1.37 O ATOM 0 H ASP A 68 18.145 5.297 -8.577 1.00 0.62 H new ATOM 0 HA ASP A 68 20.126 7.335 -9.281 1.00 0.71 H new ATOM 0 HB2 ASP A 68 17.651 8.285 -9.362 1.00 0.78 H new ATOM 0 HB3 ASP A 68 17.705 8.138 -7.616 1.00 0.78 H new ATOM 1081 N SER A 69 20.032 5.367 -6.962 1.00 0.62 N ATOM 1082 CA SER A 69 20.567 4.855 -5.675 1.00 0.67 C ATOM 1083 C SER A 69 19.732 5.313 -4.444 1.00 0.68 C ATOM 1084 O SER A 69 20.250 5.375 -3.321 1.00 1.24 O ATOM 1085 CB SER A 69 22.052 5.241 -5.510 1.00 0.82 C ATOM 1086 OG SER A 69 22.639 4.570 -4.405 1.00 1.31 O ATOM 0 H SER A 69 19.784 4.628 -7.620 1.00 0.62 H new ATOM 0 HA SER A 69 20.487 3.769 -5.713 1.00 0.67 H new ATOM 0 HB2 SER A 69 22.598 4.993 -6.420 1.00 0.82 H new ATOM 0 HB3 SER A 69 22.137 6.319 -5.371 1.00 0.82 H new ATOM 0 HG SER A 69 22.023 4.594 -3.643 1.00 1.31 H new ATOM 1092 N GLU A 70 18.432 5.612 -4.664 1.00 0.66 N ATOM 1093 CA GLU A 70 17.516 6.050 -3.590 1.00 0.77 C ATOM 1094 C GLU A 70 16.113 5.486 -3.846 1.00 0.64 C ATOM 1095 O GLU A 70 15.569 5.661 -4.943 1.00 0.75 O ATOM 1096 CB GLU A 70 17.449 7.592 -3.498 1.00 1.13 C ATOM 1097 CG GLU A 70 18.781 8.266 -3.170 1.00 1.41 C ATOM 1098 CD GLU A 70 18.686 9.782 -3.118 1.00 1.90 C ATOM 1099 OE1 GLU A 70 18.319 10.393 -4.144 1.00 2.41 O ATOM 1100 OE2 GLU A 70 18.983 10.359 -2.050 1.00 2.42 O ATOM 0 H GLU A 70 17.993 5.557 -5.583 1.00 0.66 H new ATOM 0 HA GLU A 70 17.900 5.672 -2.643 1.00 0.77 H new ATOM 0 HB2 GLU A 70 17.082 7.984 -4.446 1.00 1.13 H new ATOM 0 HB3 GLU A 70 16.720 7.867 -2.736 1.00 1.13 H new ATOM 0 HG2 GLU A 70 19.141 7.897 -2.209 1.00 1.41 H new ATOM 0 HG3 GLU A 70 19.520 7.980 -3.918 1.00 1.41 H new ATOM 1107 N LEU A 71 15.535 4.800 -2.837 1.00 0.57 N ATOM 1108 CA LEU A 71 14.192 4.206 -2.959 1.00 0.51 C ATOM 1109 C LEU A 71 13.153 5.037 -2.188 1.00 0.51 C ATOM 1110 O LEU A 71 12.813 4.726 -1.041 1.00 0.53 O ATOM 1111 CB LEU A 71 14.178 2.735 -2.477 1.00 0.53 C ATOM 1112 CG LEU A 71 14.808 1.696 -3.438 1.00 0.66 C ATOM 1113 CD1 LEU A 71 16.336 1.805 -3.469 1.00 0.95 C ATOM 1114 CD2 LEU A 71 14.377 0.277 -3.060 1.00 0.74 C ATOM 0 H LEU A 71 15.979 4.646 -1.932 1.00 0.57 H new ATOM 0 HA LEU A 71 13.925 4.214 -4.016 1.00 0.51 H new ATOM 0 HB2 LEU A 71 14.702 2.682 -1.523 1.00 0.53 H new ATOM 0 HB3 LEU A 71 13.144 2.446 -2.289 1.00 0.53 H new ATOM 0 HG LEU A 71 14.442 1.915 -4.441 1.00 0.66 H new ATOM 0 HD11 LEU A 71 16.740 1.060 -4.154 1.00 0.95 H new ATOM 0 HD12 LEU A 71 16.623 2.801 -3.806 1.00 0.95 H new ATOM 0 HD13 LEU A 71 16.733 1.632 -2.469 1.00 0.95 H new ATOM 0 HD21 LEU A 71 14.831 -0.436 -3.748 1.00 0.74 H new ATOM 0 HD22 LEU A 71 14.701 0.057 -2.043 1.00 0.74 H new ATOM 0 HD23 LEU A 71 13.291 0.198 -3.120 1.00 0.74 H new ATOM 1126 N LYS A 72 12.673 6.116 -2.832 1.00 0.53 N ATOM 1127 CA LYS A 72 11.650 7.010 -2.248 1.00 0.56 C ATOM 1128 C LYS A 72 10.310 6.262 -2.143 1.00 0.50 C ATOM 1129 O LYS A 72 10.111 5.305 -2.875 1.00 0.48 O ATOM 1130 CB LYS A 72 11.485 8.258 -3.147 1.00 0.63 C ATOM 1131 CG LYS A 72 10.789 9.454 -2.489 1.00 0.86 C ATOM 1132 CD LYS A 72 11.764 10.317 -1.689 1.00 1.00 C ATOM 1133 CE LYS A 72 11.116 11.601 -1.180 1.00 1.43 C ATOM 1134 NZ LYS A 72 10.849 12.587 -2.274 1.00 1.89 N ATOM 0 H LYS A 72 12.979 6.394 -3.765 1.00 0.53 H new ATOM 0 HA LYS A 72 11.964 7.322 -1.252 1.00 0.56 H new ATOM 0 HB2 LYS A 72 12.472 8.574 -3.485 1.00 0.63 H new ATOM 0 HB3 LYS A 72 10.920 7.973 -4.035 1.00 0.63 H new ATOM 0 HG2 LYS A 72 10.312 10.063 -3.257 1.00 0.86 H new ATOM 0 HG3 LYS A 72 9.998 9.095 -1.830 1.00 0.86 H new ATOM 0 HD2 LYS A 72 12.143 9.744 -0.843 1.00 1.00 H new ATOM 0 HD3 LYS A 72 12.621 10.568 -2.314 1.00 1.00 H new ATOM 0 HE2 LYS A 72 10.179 11.357 -0.680 1.00 1.43 H new ATOM 0 HE3 LYS A 72 11.765 12.059 -0.434 1.00 1.43 H new ATOM 0 HZ1 LYS A 72 10.488 13.472 -1.863 1.00 1.89 H new ATOM 0 HZ2 LYS A 72 11.731 12.780 -2.790 1.00 1.89 H new ATOM 0 HZ3 LYS A 72 10.143 12.196 -2.929 1.00 1.89 H new ATOM 1148 N PHE A 73 9.399 6.688 -1.241 1.00 0.53 N ATOM 1149 CA PHE A 73 8.071 6.031 -1.102 1.00 0.50 C ATOM 1150 C PHE A 73 7.302 5.990 -2.439 1.00 0.47 C ATOM 1151 O PHE A 73 6.522 5.065 -2.662 1.00 0.47 O ATOM 1152 CB PHE A 73 7.222 6.708 -0.002 1.00 0.56 C ATOM 1153 CG PHE A 73 7.342 6.039 1.359 1.00 0.69 C ATOM 1154 CD1 PHE A 73 8.488 6.198 2.136 1.00 0.87 C ATOM 1155 CD2 PHE A 73 6.316 5.243 1.856 1.00 0.89 C ATOM 1156 CE1 PHE A 73 8.603 5.583 3.369 1.00 1.11 C ATOM 1157 CE2 PHE A 73 6.430 4.624 3.089 1.00 1.12 C ATOM 1158 CZ PHE A 73 7.573 4.796 3.845 1.00 1.20 C ATOM 0 H PHE A 73 9.550 7.471 -0.605 1.00 0.53 H new ATOM 0 HA PHE A 73 8.259 5.000 -0.802 1.00 0.50 H new ATOM 0 HB2 PHE A 73 7.524 7.751 0.088 1.00 0.56 H new ATOM 0 HB3 PHE A 73 6.176 6.704 -0.308 1.00 0.56 H new ATOM 0 HD1 PHE A 73 9.298 6.811 1.770 1.00 0.87 H new ATOM 0 HD2 PHE A 73 5.418 5.106 1.272 1.00 0.89 H new ATOM 0 HE1 PHE A 73 9.497 5.718 3.959 1.00 1.11 H new ATOM 0 HE2 PHE A 73 5.625 4.007 3.460 1.00 1.12 H new ATOM 0 HZ PHE A 73 7.661 4.315 4.808 1.00 1.20 H new ATOM 1168 N ASN A 74 7.516 6.999 -3.319 1.00 0.49 N ATOM 1169 CA ASN A 74 6.869 7.023 -4.647 1.00 0.51 C ATOM 1170 C ASN A 74 7.410 5.883 -5.548 1.00 0.49 C ATOM 1171 O ASN A 74 6.719 5.443 -6.464 1.00 0.53 O ATOM 1172 CB ASN A 74 7.064 8.392 -5.336 1.00 0.57 C ATOM 1173 CG ASN A 74 6.146 8.581 -6.544 1.00 0.65 C ATOM 1174 OD1 ASN A 74 5.018 9.052 -6.405 1.00 0.98 O ATOM 1175 ND2 ASN A 74 6.619 8.213 -7.737 1.00 0.91 N ATOM 0 H ASN A 74 8.125 7.796 -3.133 1.00 0.49 H new ATOM 0 HA ASN A 74 5.801 6.866 -4.497 1.00 0.51 H new ATOM 0 HB2 ASN A 74 6.876 9.187 -4.614 1.00 0.57 H new ATOM 0 HB3 ASN A 74 8.102 8.489 -5.655 1.00 0.57 H new ATOM 0 HD21 ASN A 74 6.040 8.319 -8.570 1.00 0.91 H new ATOM 0 HD22 ASN A 74 7.559 7.826 -7.815 1.00 0.91 H new ATOM 1182 N GLU A 75 8.664 5.442 -5.291 1.00 0.46 N ATOM 1183 CA GLU A 75 9.308 4.338 -6.032 1.00 0.47 C ATOM 1184 C GLU A 75 9.244 3.012 -5.230 1.00 0.43 C ATOM 1185 O GLU A 75 9.162 1.935 -5.822 1.00 0.44 O ATOM 1186 CB GLU A 75 10.782 4.696 -6.346 1.00 0.53 C ATOM 1187 CG GLU A 75 10.978 5.604 -7.564 1.00 0.61 C ATOM 1188 CD GLU A 75 10.497 7.030 -7.342 1.00 0.78 C ATOM 1189 OE1 GLU A 75 11.204 7.797 -6.656 1.00 0.98 O ATOM 1190 OE2 GLU A 75 9.416 7.377 -7.861 1.00 1.03 O ATOM 0 H GLU A 75 9.256 5.843 -4.563 1.00 0.46 H new ATOM 0 HA GLU A 75 8.765 4.197 -6.966 1.00 0.47 H new ATOM 0 HB2 GLU A 75 11.216 5.184 -5.473 1.00 0.53 H new ATOM 0 HB3 GLU A 75 11.339 3.773 -6.505 1.00 0.53 H new ATOM 0 HG2 GLU A 75 12.036 5.623 -7.827 1.00 0.61 H new ATOM 0 HG3 GLU A 75 10.446 5.178 -8.414 1.00 0.61 H new ATOM 1197 N TYR A 76 9.277 3.115 -3.880 1.00 0.42 N ATOM 1198 CA TYR A 76 9.236 1.954 -2.963 1.00 0.41 C ATOM 1199 C TYR A 76 7.789 1.452 -2.709 1.00 0.39 C ATOM 1200 O TYR A 76 7.608 0.432 -2.039 1.00 0.52 O ATOM 1201 CB TYR A 76 9.935 2.337 -1.627 1.00 0.44 C ATOM 1202 CG TYR A 76 10.055 1.227 -0.577 1.00 0.45 C ATOM 1203 CD1 TYR A 76 10.867 0.110 -0.786 1.00 0.52 C ATOM 1204 CD2 TYR A 76 9.362 1.309 0.633 1.00 0.51 C ATOM 1205 CE1 TYR A 76 10.977 -0.883 0.172 1.00 0.59 C ATOM 1206 CE2 TYR A 76 9.474 0.322 1.593 1.00 0.57 C ATOM 1207 CZ TYR A 76 10.280 -0.773 1.358 1.00 0.59 C ATOM 1208 OH TYR A 76 10.398 -1.761 2.316 1.00 0.69 O ATOM 0 H TYR A 76 9.333 4.011 -3.396 1.00 0.42 H new ATOM 0 HA TYR A 76 9.768 1.127 -3.434 1.00 0.41 H new ATOM 0 HB2 TYR A 76 10.937 2.699 -1.857 1.00 0.44 H new ATOM 0 HB3 TYR A 76 9.390 3.170 -1.183 1.00 0.44 H new ATOM 0 HD1 TYR A 76 11.418 0.020 -1.710 1.00 0.52 H new ATOM 0 HD2 TYR A 76 8.726 2.161 0.822 1.00 0.51 H new ATOM 0 HE1 TYR A 76 11.607 -1.742 -0.008 1.00 0.59 H new ATOM 0 HE2 TYR A 76 8.933 0.407 2.524 1.00 0.57 H new ATOM 0 HH TYR A 76 9.845 -1.532 3.092 1.00 0.69 H new ATOM 1218 N TRP A 77 6.763 2.153 -3.257 1.00 0.40 N ATOM 1219 CA TRP A 77 5.346 1.751 -3.084 1.00 0.42 C ATOM 1220 C TRP A 77 5.041 0.395 -3.774 1.00 0.37 C ATOM 1221 O TRP A 77 4.025 -0.237 -3.460 1.00 0.39 O ATOM 1222 CB TRP A 77 4.391 2.895 -3.549 1.00 0.58 C ATOM 1223 CG TRP A 77 3.427 2.561 -4.665 1.00 0.49 C ATOM 1224 CD1 TRP A 77 2.159 2.073 -4.533 1.00 0.53 C ATOM 1225 CD2 TRP A 77 3.656 2.702 -6.075 1.00 0.78 C ATOM 1226 NE1 TRP A 77 1.590 1.899 -5.769 1.00 0.77 N ATOM 1227 CE2 TRP A 77 2.486 2.280 -6.733 1.00 0.97 C ATOM 1228 CE3 TRP A 77 4.734 3.142 -6.845 1.00 1.04 C ATOM 1229 CZ2 TRP A 77 2.369 2.289 -8.119 1.00 1.40 C ATOM 1230 CZ3 TRP A 77 4.617 3.153 -8.221 1.00 1.45 C ATOM 1231 CH2 TRP A 77 3.439 2.729 -8.846 1.00 1.62 C ATOM 0 H TRP A 77 6.891 2.994 -3.819 1.00 0.40 H new ATOM 0 HA TRP A 77 5.164 1.590 -2.021 1.00 0.42 H new ATOM 0 HB2 TRP A 77 3.812 3.227 -2.687 1.00 0.58 H new ATOM 0 HB3 TRP A 77 5.001 3.740 -3.868 1.00 0.58 H new ATOM 0 HD1 TRP A 77 1.674 1.856 -3.593 1.00 0.53 H new ATOM 0 HE1 TRP A 77 0.650 1.543 -5.943 1.00 0.77 H new ATOM 0 HE3 TRP A 77 5.647 3.469 -6.371 1.00 1.04 H new ATOM 0 HZ2 TRP A 77 1.462 1.959 -8.604 1.00 1.40 H new ATOM 0 HZ3 TRP A 77 5.446 3.494 -8.823 1.00 1.45 H new ATOM 0 HH2 TRP A 77 3.374 2.750 -9.924 1.00 1.62 H new ATOM 1242 N ARG A 78 5.915 -0.045 -4.714 1.00 0.39 N ATOM 1243 CA ARG A 78 5.736 -1.339 -5.408 1.00 0.42 C ATOM 1244 C ARG A 78 5.845 -2.504 -4.403 1.00 0.40 C ATOM 1245 O ARG A 78 5.141 -3.502 -4.544 1.00 0.45 O ATOM 1246 CB ARG A 78 6.768 -1.530 -6.547 1.00 0.49 C ATOM 1247 CG ARG A 78 6.842 -0.383 -7.564 1.00 0.64 C ATOM 1248 CD ARG A 78 5.577 -0.240 -8.413 1.00 0.82 C ATOM 1249 NE ARG A 78 5.396 -1.353 -9.365 1.00 1.11 N ATOM 1250 CZ ARG A 78 5.939 -1.424 -10.604 1.00 1.57 C ATOM 1251 NH1 ARG A 78 6.826 -0.514 -11.038 1.00 1.96 N ATOM 1252 NH2 ARG A 78 5.613 -2.442 -11.408 1.00 1.93 N ATOM 0 H ARG A 78 6.743 0.475 -5.005 1.00 0.39 H new ATOM 0 HA ARG A 78 4.742 -1.335 -5.855 1.00 0.42 H new ATOM 0 HB2 ARG A 78 7.754 -1.664 -6.103 1.00 0.49 H new ATOM 0 HB3 ARG A 78 6.531 -2.451 -7.079 1.00 0.49 H new ATOM 0 HG2 ARG A 78 7.022 0.552 -7.033 1.00 0.64 H new ATOM 0 HG3 ARG A 78 7.696 -0.545 -8.222 1.00 0.64 H new ATOM 0 HD2 ARG A 78 4.709 -0.185 -7.756 1.00 0.82 H new ATOM 0 HD3 ARG A 78 5.619 0.700 -8.964 1.00 0.82 H new ATOM 0 HE ARG A 78 4.813 -2.134 -9.065 1.00 1.11 H new ATOM 0 HH11 ARG A 78 7.107 0.255 -10.430 1.00 1.96 H new ATOM 0 HH12 ARG A 78 7.219 -0.592 -11.976 1.00 1.96 H new ATOM 0 HH21 ARG A 78 4.960 -3.157 -11.087 1.00 1.93 H new ATOM 0 HH22 ARG A 78 6.017 -2.503 -12.343 1.00 1.93 H new ATOM 1266 N LEU A 79 6.731 -2.362 -3.384 1.00 0.37 N ATOM 1267 CA LEU A 79 6.902 -3.389 -2.342 1.00 0.37 C ATOM 1268 C LEU A 79 5.807 -3.239 -1.278 1.00 0.36 C ATOM 1269 O LEU A 79 5.323 -4.241 -0.757 1.00 0.39 O ATOM 1270 CB LEU A 79 8.298 -3.319 -1.675 1.00 0.40 C ATOM 1271 CG LEU A 79 8.822 -4.656 -1.088 1.00 0.44 C ATOM 1272 CD1 LEU A 79 9.262 -5.612 -2.202 1.00 0.49 C ATOM 1273 CD2 LEU A 79 9.963 -4.418 -0.096 1.00 0.53 C ATOM 0 H LEU A 79 7.333 -1.547 -3.268 1.00 0.37 H new ATOM 0 HA LEU A 79 6.819 -4.363 -2.825 1.00 0.37 H new ATOM 0 HB2 LEU A 79 9.016 -2.959 -2.411 1.00 0.40 H new ATOM 0 HB3 LEU A 79 8.263 -2.579 -0.875 1.00 0.40 H new ATOM 0 HG LEU A 79 7.999 -5.122 -0.546 1.00 0.44 H new ATOM 0 HD11 LEU A 79 9.625 -6.541 -1.762 1.00 0.49 H new ATOM 0 HD12 LEU A 79 8.415 -5.826 -2.854 1.00 0.49 H new ATOM 0 HD13 LEU A 79 10.060 -5.150 -2.784 1.00 0.49 H new ATOM 0 HD21 LEU A 79 10.308 -5.374 0.298 1.00 0.53 H new ATOM 0 HD22 LEU A 79 10.787 -3.915 -0.603 1.00 0.53 H new ATOM 0 HD23 LEU A 79 9.608 -3.795 0.725 1.00 0.53 H new ATOM 1285 N ILE A 80 5.419 -1.975 -0.963 1.00 0.38 N ATOM 1286 CA ILE A 80 4.356 -1.687 0.028 1.00 0.41 C ATOM 1287 C ILE A 80 3.036 -2.368 -0.398 1.00 0.40 C ATOM 1288 O ILE A 80 2.328 -2.924 0.448 1.00 0.43 O ATOM 1289 CB ILE A 80 4.148 -0.142 0.232 1.00 0.49 C ATOM 1290 CG1 ILE A 80 5.437 0.525 0.803 1.00 0.53 C ATOM 1291 CG2 ILE A 80 2.930 0.162 1.128 1.00 0.59 C ATOM 1292 CD1 ILE A 80 5.738 0.237 2.271 1.00 0.61 C ATOM 0 H ILE A 80 5.829 -1.141 -1.383 1.00 0.38 H new ATOM 0 HA ILE A 80 4.673 -2.096 0.987 1.00 0.41 H new ATOM 0 HB ILE A 80 3.945 0.288 -0.749 1.00 0.49 H new ATOM 0 HG12 ILE A 80 6.288 0.197 0.206 1.00 0.53 H new ATOM 0 HG13 ILE A 80 5.353 1.604 0.674 1.00 0.53 H new ATOM 0 HG21 ILE A 80 2.823 1.241 1.243 1.00 0.59 H new ATOM 0 HG22 ILE A 80 2.029 -0.245 0.668 1.00 0.59 H new ATOM 0 HG23 ILE A 80 3.076 -0.294 2.107 1.00 0.59 H new ATOM 0 HD11 ILE A 80 6.655 0.750 2.562 1.00 0.61 H new ATOM 0 HD12 ILE A 80 4.912 0.592 2.888 1.00 0.61 H new ATOM 0 HD13 ILE A 80 5.862 -0.837 2.413 1.00 0.61 H new ATOM 1304 N GLY A 81 2.713 -2.313 -1.710 1.00 0.40 N ATOM 1305 CA GLY A 81 1.519 -2.976 -2.235 1.00 0.44 C ATOM 1306 C GLY A 81 1.658 -4.499 -2.192 1.00 0.41 C ATOM 1307 O GLY A 81 0.692 -5.203 -1.884 1.00 0.47 O ATOM 0 H GLY A 81 3.263 -1.818 -2.412 1.00 0.40 H new ATOM 0 HA2 GLY A 81 0.648 -2.673 -1.654 1.00 0.44 H new ATOM 0 HA3 GLY A 81 1.345 -2.654 -3.262 1.00 0.44 H new ATOM 1311 N GLU A 82 2.880 -5.001 -2.504 1.00 0.38 N ATOM 1312 CA GLU A 82 3.196 -6.448 -2.477 1.00 0.38 C ATOM 1313 C GLU A 82 3.297 -6.978 -1.025 1.00 0.36 C ATOM 1314 O GLU A 82 3.174 -8.184 -0.796 1.00 0.42 O ATOM 1315 CB GLU A 82 4.514 -6.731 -3.243 1.00 0.43 C ATOM 1316 CG GLU A 82 4.447 -6.447 -4.749 1.00 0.51 C ATOM 1317 CD GLU A 82 3.896 -7.611 -5.558 1.00 0.62 C ATOM 1318 OE1 GLU A 82 4.693 -8.489 -5.957 1.00 0.83 O ATOM 1319 OE2 GLU A 82 2.670 -7.648 -5.788 1.00 0.86 O ATOM 0 H GLU A 82 3.669 -4.416 -2.780 1.00 0.38 H new ATOM 0 HA GLU A 82 2.379 -6.974 -2.972 1.00 0.38 H new ATOM 0 HB2 GLU A 82 5.310 -6.127 -2.807 1.00 0.43 H new ATOM 0 HB3 GLU A 82 4.789 -7.775 -3.095 1.00 0.43 H new ATOM 0 HG2 GLU A 82 3.824 -5.569 -4.918 1.00 0.51 H new ATOM 0 HG3 GLU A 82 5.446 -6.203 -5.110 1.00 0.51 H new ATOM 1326 N LEU A 83 3.540 -6.067 -0.047 1.00 0.36 N ATOM 1327 CA LEU A 83 3.614 -6.428 1.386 1.00 0.39 C ATOM 1328 C LEU A 83 2.227 -6.890 1.875 1.00 0.40 C ATOM 1329 O LEU A 83 2.105 -7.924 2.540 1.00 0.49 O ATOM 1330 CB LEU A 83 4.110 -5.222 2.241 1.00 0.44 C ATOM 1331 CG LEU A 83 5.535 -5.349 2.839 1.00 0.49 C ATOM 1332 CD1 LEU A 83 6.613 -5.143 1.776 1.00 0.67 C ATOM 1333 CD2 LEU A 83 5.732 -4.372 3.999 1.00 0.61 C ATOM 0 H LEU A 83 3.688 -5.075 -0.230 1.00 0.36 H new ATOM 0 HA LEU A 83 4.330 -7.242 1.503 1.00 0.39 H new ATOM 0 HB2 LEU A 83 4.077 -4.326 1.622 1.00 0.44 H new ATOM 0 HB3 LEU A 83 3.407 -5.070 3.060 1.00 0.44 H new ATOM 0 HG LEU A 83 5.635 -6.364 3.222 1.00 0.49 H new ATOM 0 HD11 LEU A 83 7.598 -5.239 2.233 1.00 0.67 H new ATOM 0 HD12 LEU A 83 6.501 -5.894 0.994 1.00 0.67 H new ATOM 0 HD13 LEU A 83 6.510 -4.149 1.342 1.00 0.67 H new ATOM 0 HD21 LEU A 83 6.740 -4.482 4.400 1.00 0.61 H new ATOM 0 HD22 LEU A 83 5.593 -3.351 3.643 1.00 0.61 H new ATOM 0 HD23 LEU A 83 5.004 -4.586 4.782 1.00 0.61 H new ATOM 1345 N ALA A 84 1.185 -6.110 1.517 1.00 0.39 N ATOM 1346 CA ALA A 84 -0.202 -6.422 1.885 1.00 0.45 C ATOM 1347 C ALA A 84 -0.853 -7.424 0.896 1.00 0.45 C ATOM 1348 O ALA A 84 -1.935 -7.946 1.183 1.00 0.55 O ATOM 1349 CB ALA A 84 -1.023 -5.137 1.975 1.00 0.54 C ATOM 0 H ALA A 84 1.285 -5.255 0.970 1.00 0.39 H new ATOM 0 HA ALA A 84 -0.187 -6.903 2.863 1.00 0.45 H new ATOM 0 HB1 ALA A 84 -2.050 -5.380 2.248 1.00 0.54 H new ATOM 0 HB2 ALA A 84 -0.591 -4.482 2.731 1.00 0.54 H new ATOM 0 HB3 ALA A 84 -1.015 -4.631 1.009 1.00 0.54 H new ATOM 1355 N LYS A 85 -0.205 -7.678 -0.271 1.00 0.42 N ATOM 1356 CA LYS A 85 -0.716 -8.638 -1.272 1.00 0.46 C ATOM 1357 C LYS A 85 -0.182 -10.053 -0.986 1.00 0.47 C ATOM 1358 O LYS A 85 -0.945 -11.021 -1.045 1.00 0.55 O ATOM 1359 CB LYS A 85 -0.335 -8.205 -2.704 1.00 0.49 C ATOM 1360 CG LYS A 85 -1.095 -8.951 -3.816 1.00 0.59 C ATOM 1361 CD LYS A 85 -0.469 -8.766 -5.211 1.00 0.64 C ATOM 1362 CE LYS A 85 -0.840 -7.436 -5.877 1.00 0.69 C ATOM 1363 NZ LYS A 85 0.007 -6.292 -5.417 1.00 0.96 N ATOM 0 H LYS A 85 0.671 -7.229 -0.537 1.00 0.42 H new ATOM 0 HA LYS A 85 -1.803 -8.650 -1.197 1.00 0.46 H new ATOM 0 HB2 LYS A 85 -0.519 -7.136 -2.809 1.00 0.49 H new ATOM 0 HB3 LYS A 85 0.735 -8.359 -2.845 1.00 0.49 H new ATOM 0 HG2 LYS A 85 -1.124 -10.014 -3.577 1.00 0.59 H new ATOM 0 HG3 LYS A 85 -2.127 -8.601 -3.839 1.00 0.59 H new ATOM 0 HD2 LYS A 85 0.616 -8.830 -5.125 1.00 0.64 H new ATOM 0 HD3 LYS A 85 -0.787 -9.586 -5.855 1.00 0.64 H new ATOM 0 HE2 LYS A 85 -0.745 -7.539 -6.958 1.00 0.69 H new ATOM 0 HE3 LYS A 85 -1.886 -7.212 -5.669 1.00 0.69 H new ATOM 0 HZ1 LYS A 85 0.011 -5.549 -6.144 1.00 0.96 H new ATOM 0 HZ2 LYS A 85 -0.380 -5.908 -4.531 1.00 0.96 H new ATOM 0 HZ3 LYS A 85 0.980 -6.623 -5.255 1.00 0.96 H new ATOM 1377 N GLU A 86 1.132 -10.170 -0.673 1.00 0.42 N ATOM 1378 CA GLU A 86 1.759 -11.473 -0.368 1.00 0.46 C ATOM 1379 C GLU A 86 1.679 -11.782 1.148 1.00 0.52 C ATOM 1380 O GLU A 86 2.686 -12.107 1.788 1.00 0.92 O ATOM 1381 CB GLU A 86 3.225 -11.509 -0.869 1.00 0.49 C ATOM 1382 CG GLU A 86 3.368 -11.446 -2.390 1.00 0.55 C ATOM 1383 CD GLU A 86 4.815 -11.523 -2.854 1.00 1.03 C ATOM 1384 OE1 GLU A 86 5.505 -10.481 -2.835 1.00 1.52 O ATOM 1385 OE2 GLU A 86 5.258 -12.629 -3.235 1.00 1.65 O ATOM 0 H GLU A 86 1.774 -9.378 -0.626 1.00 0.42 H new ATOM 0 HA GLU A 86 1.205 -12.249 -0.897 1.00 0.46 H new ATOM 0 HB2 GLU A 86 3.768 -10.673 -0.429 1.00 0.49 H new ATOM 0 HB3 GLU A 86 3.698 -12.422 -0.508 1.00 0.49 H new ATOM 0 HG2 GLU A 86 2.805 -12.265 -2.837 1.00 0.55 H new ATOM 0 HG3 GLU A 86 2.924 -10.519 -2.753 1.00 0.55 H new ATOM 1392 N ILE A 87 0.456 -11.675 1.707 1.00 0.44 N ATOM 1393 CA ILE A 87 0.182 -11.959 3.128 1.00 0.47 C ATOM 1394 C ILE A 87 -0.901 -13.058 3.237 1.00 0.51 C ATOM 1395 O ILE A 87 -0.779 -13.971 4.059 1.00 0.61 O ATOM 1396 CB ILE A 87 -0.210 -10.647 3.907 1.00 0.51 C ATOM 1397 CG1 ILE A 87 -0.163 -10.842 5.458 1.00 0.59 C ATOM 1398 CG2 ILE A 87 -1.550 -10.055 3.440 1.00 0.55 C ATOM 1399 CD1 ILE A 87 -1.314 -11.618 6.089 1.00 0.66 C ATOM 0 H ILE A 87 -0.371 -11.388 1.183 1.00 0.44 H new ATOM 0 HA ILE A 87 1.089 -12.333 3.602 1.00 0.47 H new ATOM 0 HB ILE A 87 0.553 -9.910 3.658 1.00 0.51 H new ATOM 0 HG12 ILE A 87 0.768 -11.351 5.708 1.00 0.59 H new ATOM 0 HG13 ILE A 87 -0.122 -9.857 5.923 1.00 0.59 H new ATOM 0 HG21 ILE A 87 -1.768 -9.153 4.012 1.00 0.55 H new ATOM 0 HG22 ILE A 87 -1.489 -9.807 2.380 1.00 0.55 H new ATOM 0 HG23 ILE A 87 -2.344 -10.785 3.596 1.00 0.55 H new ATOM 0 HD11 ILE A 87 -1.162 -11.682 7.166 1.00 0.66 H new ATOM 0 HD12 ILE A 87 -2.254 -11.105 5.885 1.00 0.66 H new ATOM 0 HD13 ILE A 87 -1.350 -12.622 5.667 1.00 0.66 H new ATOM 1411 N ARG A 88 -1.952 -12.967 2.389 1.00 0.54 N ATOM 1412 CA ARG A 88 -3.047 -13.951 2.359 1.00 0.68 C ATOM 1413 C ARG A 88 -2.963 -14.844 1.101 1.00 0.68 C ATOM 1414 O ARG A 88 -3.390 -16.001 1.144 1.00 0.87 O ATOM 1415 CB ARG A 88 -4.432 -13.254 2.452 1.00 0.83 C ATOM 1416 CG ARG A 88 -4.882 -12.428 1.225 1.00 0.91 C ATOM 1417 CD ARG A 88 -4.497 -10.952 1.320 1.00 1.05 C ATOM 1418 NE ARG A 88 -5.211 -10.123 0.323 1.00 1.18 N ATOM 1419 CZ ARG A 88 -5.436 -8.795 0.433 1.00 1.39 C ATOM 1420 NH1 ARG A 88 -4.932 -8.086 1.448 1.00 1.74 N ATOM 1421 NH2 ARG A 88 -6.148 -8.168 -0.504 1.00 1.73 N ATOM 0 H ARG A 88 -2.060 -12.212 1.712 1.00 0.54 H new ATOM 0 HA ARG A 88 -2.935 -14.593 3.233 1.00 0.68 H new ATOM 0 HB2 ARG A 88 -5.185 -14.019 2.641 1.00 0.83 H new ATOM 0 HB3 ARG A 88 -4.423 -12.595 3.320 1.00 0.83 H new ATOM 0 HG2 ARG A 88 -4.439 -12.855 0.325 1.00 0.91 H new ATOM 0 HG3 ARG A 88 -5.964 -12.509 1.117 1.00 0.91 H new ATOM 0 HD2 ARG A 88 -4.719 -10.584 2.322 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -3.422 -10.848 1.173 1.00 1.05 H new ATOM 0 HE ARG A 88 -5.561 -10.591 -0.513 1.00 1.18 H new ATOM 0 HH11 ARG A 88 -4.365 -8.547 2.160 1.00 1.74 H new ATOM 0 HH12 ARG A 88 -5.115 -7.084 1.511 1.00 1.74 H new ATOM 0 HH21 ARG A 88 -6.519 -8.691 -1.298 1.00 1.73 H new ATOM 0 HH22 ARG A 88 -6.322 -7.166 -0.427 1.00 1.73 H new ATOM 1435 N LYS A 89 -2.408 -14.298 -0.011 1.00 0.58 N ATOM 1436 CA LYS A 89 -2.283 -15.035 -1.288 1.00 0.64 C ATOM 1437 C LYS A 89 -0.811 -15.179 -1.756 1.00 0.58 C ATOM 1438 O LYS A 89 -0.545 -15.194 -2.967 1.00 0.69 O ATOM 1439 CB LYS A 89 -3.139 -14.346 -2.381 1.00 0.76 C ATOM 1440 CG LYS A 89 -2.734 -12.900 -2.701 1.00 0.77 C ATOM 1441 CD LYS A 89 -3.577 -12.295 -3.828 1.00 1.00 C ATOM 1442 CE LYS A 89 -4.939 -11.794 -3.346 1.00 1.22 C ATOM 1443 NZ LYS A 89 -5.734 -11.201 -4.459 1.00 1.52 N ATOM 0 H LYS A 89 -2.040 -13.347 -0.045 1.00 0.58 H new ATOM 0 HA LYS A 89 -2.654 -16.045 -1.117 1.00 0.64 H new ATOM 0 HB2 LYS A 89 -3.078 -14.936 -3.295 1.00 0.76 H new ATOM 0 HB3 LYS A 89 -4.182 -14.355 -2.065 1.00 0.76 H new ATOM 0 HG2 LYS A 89 -2.838 -12.289 -1.804 1.00 0.77 H new ATOM 0 HG3 LYS A 89 -1.682 -12.874 -2.984 1.00 0.77 H new ATOM 0 HD2 LYS A 89 -3.030 -11.468 -4.281 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -3.725 -13.043 -4.607 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -5.494 -12.620 -2.902 1.00 1.22 H new ATOM 0 HE3 LYS A 89 -4.796 -11.049 -2.563 1.00 1.22 H new ATOM 0 HZ1 LYS A 89 -6.644 -10.857 -4.091 1.00 1.52 H new ATOM 0 HZ2 LYS A 89 -5.208 -10.408 -4.877 1.00 1.52 H new ATOM 0 HZ3 LYS A 89 -5.906 -11.924 -5.186 1.00 1.52 H new ATOM 1457 N LYS A 90 0.148 -15.311 -0.808 1.00 0.56 N ATOM 1458 CA LYS A 90 1.576 -15.471 -1.172 1.00 0.55 C ATOM 1459 C LYS A 90 1.807 -16.805 -1.925 1.00 0.55 C ATOM 1460 O LYS A 90 2.611 -16.865 -2.860 1.00 0.60 O ATOM 1461 CB LYS A 90 2.515 -15.326 0.066 1.00 0.61 C ATOM 1462 CG LYS A 90 2.615 -16.533 1.030 1.00 0.71 C ATOM 1463 CD LYS A 90 1.621 -16.482 2.200 1.00 0.97 C ATOM 1464 CE LYS A 90 2.008 -15.454 3.275 1.00 1.39 C ATOM 1465 NZ LYS A 90 3.235 -15.835 4.045 1.00 1.87 N ATOM 0 H LYS A 90 -0.036 -15.310 0.195 1.00 0.56 H new ATOM 0 HA LYS A 90 1.837 -14.660 -1.851 1.00 0.55 H new ATOM 0 HB2 LYS A 90 3.518 -15.101 -0.297 1.00 0.61 H new ATOM 0 HB3 LYS A 90 2.183 -14.462 0.641 1.00 0.61 H new ATOM 0 HG2 LYS A 90 2.449 -17.451 0.465 1.00 0.71 H new ATOM 0 HG3 LYS A 90 3.628 -16.583 1.429 1.00 0.71 H new ATOM 0 HD2 LYS A 90 0.629 -16.242 1.816 1.00 0.97 H new ATOM 0 HD3 LYS A 90 1.556 -17.470 2.657 1.00 0.97 H new ATOM 0 HE2 LYS A 90 2.171 -14.486 2.800 1.00 1.39 H new ATOM 0 HE3 LYS A 90 1.176 -15.333 3.968 1.00 1.39 H new ATOM 0 HZ1 LYS A 90 3.384 -15.156 4.818 1.00 1.87 H new ATOM 0 HZ2 LYS A 90 3.114 -16.789 4.441 1.00 1.87 H new ATOM 0 HZ3 LYS A 90 4.060 -15.825 3.411 1.00 1.87 H new ATOM 1479 N LYS A 91 1.084 -17.862 -1.500 1.00 0.57 N ATOM 1480 CA LYS A 91 1.149 -19.193 -2.125 1.00 0.64 C ATOM 1481 C LYS A 91 -0.264 -19.811 -2.135 1.00 0.69 C ATOM 1482 O LYS A 91 -0.490 -20.894 -1.587 1.00 0.71 O ATOM 1483 CB LYS A 91 2.149 -20.104 -1.374 1.00 0.72 C ATOM 1484 CG LYS A 91 3.616 -19.696 -1.531 1.00 0.85 C ATOM 1485 CD LYS A 91 4.546 -20.522 -0.636 1.00 0.97 C ATOM 1486 CE LYS A 91 6.020 -20.209 -0.900 1.00 1.29 C ATOM 1487 NZ LYS A 91 6.555 -20.925 -2.096 1.00 1.53 N ATOM 0 H LYS A 91 0.438 -17.813 -0.712 1.00 0.57 H new ATOM 0 HA LYS A 91 1.505 -19.096 -3.151 1.00 0.64 H new ATOM 0 HB2 LYS A 91 1.896 -20.104 -0.314 1.00 0.72 H new ATOM 0 HB3 LYS A 91 2.029 -21.127 -1.731 1.00 0.72 H new ATOM 0 HG2 LYS A 91 3.915 -19.816 -2.572 1.00 0.85 H new ATOM 0 HG3 LYS A 91 3.725 -18.639 -1.288 1.00 0.85 H new ATOM 0 HD2 LYS A 91 4.314 -20.322 0.410 1.00 0.97 H new ATOM 0 HD3 LYS A 91 4.364 -21.583 -0.806 1.00 0.97 H new ATOM 0 HE2 LYS A 91 6.140 -19.135 -1.041 1.00 1.29 H new ATOM 0 HE3 LYS A 91 6.608 -20.483 -0.024 1.00 1.29 H new ATOM 0 HZ1 LYS A 91 7.556 -20.678 -2.229 1.00 1.53 H new ATOM 0 HZ2 LYS A 91 6.468 -21.952 -1.954 1.00 1.53 H new ATOM 0 HZ3 LYS A 91 6.014 -20.645 -2.939 1.00 1.53 H new ATOM 1501 N ASP A 92 -1.218 -19.092 -2.772 1.00 0.78 N ATOM 1502 CA ASP A 92 -2.637 -19.524 -2.861 1.00 0.87 C ATOM 1503 C ASP A 92 -2.815 -20.867 -3.609 1.00 1.03 C ATOM 1504 O ASP A 92 -3.774 -21.600 -3.342 1.00 1.81 O ATOM 1505 CB ASP A 92 -3.507 -18.419 -3.513 1.00 0.89 C ATOM 1506 CG ASP A 92 -3.107 -18.087 -4.949 1.00 0.98 C ATOM 1507 OD1 ASP A 92 -2.082 -17.395 -5.137 1.00 1.01 O ATOM 1508 OD2 ASP A 92 -3.818 -18.519 -5.881 1.00 1.18 O ATOM 0 H ASP A 92 -1.030 -18.203 -3.236 1.00 0.78 H new ATOM 0 HA ASP A 92 -2.975 -19.689 -1.838 1.00 0.87 H new ATOM 0 HB2 ASP A 92 -4.550 -18.736 -3.500 1.00 0.89 H new ATOM 0 HB3 ASP A 92 -3.441 -17.514 -2.909 1.00 0.89 H new ATOM 1513 N LEU A 93 -1.890 -21.180 -4.542 1.00 0.67 N ATOM 1514 CA LEU A 93 -1.940 -22.434 -5.319 1.00 0.70 C ATOM 1515 C LEU A 93 -1.676 -23.674 -4.432 1.00 0.70 C ATOM 1516 O LEU A 93 -2.273 -24.729 -4.662 1.00 0.79 O ATOM 1517 CB LEU A 93 -0.920 -22.385 -6.481 1.00 0.77 C ATOM 1518 CG LEU A 93 -1.188 -23.360 -7.652 1.00 0.97 C ATOM 1519 CD1 LEU A 93 -2.272 -22.810 -8.584 1.00 1.24 C ATOM 1520 CD2 LEU A 93 0.098 -23.652 -8.430 1.00 1.15 C ATOM 0 H LEU A 93 -1.099 -20.579 -4.774 1.00 0.67 H new ATOM 0 HA LEU A 93 -2.947 -22.527 -5.725 1.00 0.70 H new ATOM 0 HB2 LEU A 93 -0.896 -21.370 -6.876 1.00 0.77 H new ATOM 0 HB3 LEU A 93 0.071 -22.594 -6.079 1.00 0.77 H new ATOM 0 HG LEU A 93 -1.547 -24.298 -7.229 1.00 0.97 H new ATOM 0 HD11 LEU A 93 -2.442 -23.513 -9.399 1.00 1.24 H new ATOM 0 HD12 LEU A 93 -3.197 -22.672 -8.024 1.00 1.24 H new ATOM 0 HD13 LEU A 93 -1.949 -21.853 -8.993 1.00 1.24 H new ATOM 0 HD21 LEU A 93 -0.119 -24.340 -9.247 1.00 1.15 H new ATOM 0 HD22 LEU A 93 0.497 -22.722 -8.835 1.00 1.15 H new ATOM 0 HD23 LEU A 93 0.833 -24.102 -7.763 1.00 1.15 H new ATOM 1532 N LYS A 94 -0.780 -23.536 -3.425 1.00 0.70 N ATOM 1533 CA LYS A 94 -0.433 -24.640 -2.509 1.00 0.77 C ATOM 1534 C LYS A 94 -1.249 -24.563 -1.197 1.00 0.71 C ATOM 1535 O LYS A 94 -2.009 -25.489 -0.891 1.00 0.77 O ATOM 1536 CB LYS A 94 1.091 -24.630 -2.222 1.00 0.92 C ATOM 1537 CG LYS A 94 1.626 -25.876 -1.499 1.00 1.09 C ATOM 1538 CD LYS A 94 1.693 -27.111 -2.411 1.00 1.23 C ATOM 1539 CE LYS A 94 1.812 -28.415 -1.619 1.00 1.57 C ATOM 1540 NZ LYS A 94 0.535 -28.786 -0.936 1.00 1.73 N ATOM 0 H LYS A 94 -0.285 -22.666 -3.229 1.00 0.70 H new ATOM 0 HA LYS A 94 -0.691 -25.582 -2.992 1.00 0.77 H new ATOM 0 HB2 LYS A 94 1.622 -24.521 -3.167 1.00 0.92 H new ATOM 0 HB3 LYS A 94 1.326 -23.751 -1.621 1.00 0.92 H new ATOM 0 HG2 LYS A 94 2.621 -25.664 -1.108 1.00 1.09 H new ATOM 0 HG3 LYS A 94 0.988 -26.096 -0.643 1.00 1.09 H new ATOM 0 HD2 LYS A 94 0.800 -27.148 -3.034 1.00 1.23 H new ATOM 0 HD3 LYS A 94 2.547 -27.018 -3.082 1.00 1.23 H new ATOM 0 HE2 LYS A 94 2.108 -29.220 -2.292 1.00 1.57 H new ATOM 0 HE3 LYS A 94 2.603 -28.314 -0.875 1.00 1.57 H new ATOM 0 HZ1 LYS A 94 0.618 -29.745 -0.542 1.00 1.73 H new ATOM 0 HZ2 LYS A 94 0.343 -28.111 -0.168 1.00 1.73 H new ATOM 0 HZ3 LYS A 94 -0.246 -28.760 -1.622 1.00 1.73 H new ATOM 1554 N ILE A 95 -1.094 -23.456 -0.434 1.00 0.68 N ATOM 1555 CA ILE A 95 -1.810 -23.257 0.852 1.00 0.67 C ATOM 1556 C ILE A 95 -2.894 -22.173 0.716 1.00 0.67 C ATOM 1557 O ILE A 95 -2.705 -21.202 -0.021 1.00 0.77 O ATOM 1558 CB ILE A 95 -0.842 -22.885 2.036 1.00 0.75 C ATOM 1559 CG1 ILE A 95 0.265 -21.886 1.593 1.00 0.87 C ATOM 1560 CG2 ILE A 95 -0.228 -24.150 2.641 1.00 0.85 C ATOM 1561 CD1 ILE A 95 0.995 -21.204 2.739 1.00 1.06 C ATOM 0 H ILE A 95 -0.478 -22.683 -0.686 1.00 0.68 H new ATOM 0 HA ILE A 95 -2.275 -24.213 1.091 1.00 0.67 H new ATOM 0 HB ILE A 95 -1.435 -22.384 2.801 1.00 0.75 H new ATOM 0 HG12 ILE A 95 0.993 -22.418 0.981 1.00 0.87 H new ATOM 0 HG13 ILE A 95 -0.186 -21.122 0.960 1.00 0.87 H new ATOM 0 HG21 ILE A 95 0.439 -23.876 3.458 1.00 0.85 H new ATOM 0 HG22 ILE A 95 -1.021 -24.794 3.020 1.00 0.85 H new ATOM 0 HG23 ILE A 95 0.336 -24.682 1.875 1.00 0.85 H new ATOM 0 HD11 ILE A 95 1.748 -20.526 2.338 1.00 1.06 H new ATOM 0 HD12 ILE A 95 0.282 -20.640 3.340 1.00 1.06 H new ATOM 0 HD13 ILE A 95 1.479 -21.957 3.361 1.00 1.06 H new ATOM 1573 N ARG A 96 -4.026 -22.336 1.438 1.00 0.71 N ATOM 1574 CA ARG A 96 -5.138 -21.364 1.372 1.00 0.77 C ATOM 1575 C ARG A 96 -5.903 -21.227 2.714 1.00 0.77 C ATOM 1576 O ARG A 96 -7.136 -21.305 2.742 1.00 0.93 O ATOM 1577 CB ARG A 96 -6.097 -21.732 0.211 1.00 0.93 C ATOM 1578 CG ARG A 96 -6.664 -23.161 0.260 1.00 1.05 C ATOM 1579 CD ARG A 96 -7.602 -23.459 -0.912 1.00 1.26 C ATOM 1580 NE ARG A 96 -8.867 -22.696 -0.835 1.00 1.40 N ATOM 1581 CZ ARG A 96 -9.126 -21.528 -1.474 1.00 1.83 C ATOM 1582 NH1 ARG A 96 -8.207 -20.916 -2.235 1.00 2.26 N ATOM 1583 NH2 ARG A 96 -10.328 -20.960 -1.336 1.00 2.18 N ATOM 0 H ARG A 96 -4.192 -23.123 2.066 1.00 0.71 H new ATOM 0 HA ARG A 96 -4.701 -20.385 1.176 1.00 0.77 H new ATOM 0 HB2 ARG A 96 -6.929 -21.028 0.211 1.00 0.93 H new ATOM 0 HB3 ARG A 96 -5.567 -21.600 -0.733 1.00 0.93 H new ATOM 0 HG2 ARG A 96 -5.841 -23.876 0.253 1.00 1.05 H new ATOM 0 HG3 ARG A 96 -7.202 -23.303 1.197 1.00 1.05 H new ATOM 0 HD2 ARG A 96 -7.095 -23.222 -1.848 1.00 1.26 H new ATOM 0 HD3 ARG A 96 -7.826 -24.526 -0.932 1.00 1.26 H new ATOM 0 HE ARG A 96 -9.609 -23.082 -0.251 1.00 1.40 H new ATOM 0 HH11 ARG A 96 -7.281 -21.328 -2.347 1.00 2.26 H new ATOM 0 HH12 ARG A 96 -8.434 -20.038 -2.702 1.00 2.26 H new ATOM 0 HH21 ARG A 96 -11.039 -21.405 -0.755 1.00 2.18 H new ATOM 0 HH22 ARG A 96 -10.535 -20.082 -1.812 1.00 2.18 H new ATOM 1597 N LYS A 97 -5.162 -21.015 3.826 1.00 0.72 N ATOM 1598 CA LYS A 97 -5.769 -20.831 5.171 1.00 0.75 C ATOM 1599 C LYS A 97 -4.712 -20.420 6.218 1.00 0.74 C ATOM 1600 O LYS A 97 -3.742 -21.151 6.450 1.00 0.95 O ATOM 1601 CB LYS A 97 -6.538 -22.094 5.646 1.00 0.87 C ATOM 1602 CG LYS A 97 -5.764 -23.413 5.553 1.00 0.94 C ATOM 1603 CD LYS A 97 -6.612 -24.594 6.033 1.00 1.10 C ATOM 1604 CE LYS A 97 -5.951 -25.946 5.766 1.00 1.36 C ATOM 1605 NZ LYS A 97 -4.701 -26.156 6.563 1.00 1.74 N ATOM 0 H LYS A 97 -4.143 -20.967 3.822 1.00 0.72 H new ATOM 0 HA LYS A 97 -6.491 -20.021 5.075 1.00 0.75 H new ATOM 0 HB2 LYS A 97 -6.842 -21.944 6.682 1.00 0.87 H new ATOM 0 HB3 LYS A 97 -7.450 -22.186 5.056 1.00 0.87 H new ATOM 0 HG2 LYS A 97 -5.453 -23.582 4.522 1.00 0.94 H new ATOM 0 HG3 LYS A 97 -4.857 -23.347 6.153 1.00 0.94 H new ATOM 0 HD2 LYS A 97 -6.798 -24.491 7.102 1.00 1.10 H new ATOM 0 HD3 LYS A 97 -7.582 -24.565 5.536 1.00 1.10 H new ATOM 0 HE2 LYS A 97 -6.659 -26.742 5.996 1.00 1.36 H new ATOM 0 HE3 LYS A 97 -5.716 -26.025 4.705 1.00 1.36 H new ATOM 0 HZ1 LYS A 97 -4.299 -27.089 6.339 1.00 1.74 H new ATOM 0 HZ2 LYS A 97 -4.010 -25.416 6.327 1.00 1.74 H new ATOM 0 HZ3 LYS A 97 -4.924 -26.110 7.578 1.00 1.74 H new ATOM 1619 N LYS A 98 -4.914 -19.239 6.844 1.00 0.69 N ATOM 1620 CA LYS A 98 -3.989 -18.709 7.868 1.00 0.72 C ATOM 1621 C LYS A 98 -4.752 -17.881 8.910 1.00 0.76 C ATOM 1622 O LYS A 98 -5.624 -18.393 9.612 1.00 0.98 O ATOM 1623 CB LYS A 98 -2.895 -17.854 7.191 1.00 0.88 C ATOM 1624 CG LYS A 98 -1.754 -17.411 8.115 1.00 1.04 C ATOM 1625 CD LYS A 98 -0.732 -16.541 7.375 1.00 1.35 C ATOM 1626 CE LYS A 98 0.403 -16.069 8.284 1.00 1.61 C ATOM 1627 NZ LYS A 98 1.328 -17.176 8.673 1.00 1.71 N ATOM 0 H LYS A 98 -5.713 -18.634 6.656 1.00 0.69 H new ATOM 0 HA LYS A 98 -3.516 -19.546 8.383 1.00 0.72 H new ATOM 0 HB2 LYS A 98 -2.472 -18.422 6.363 1.00 0.88 H new ATOM 0 HB3 LYS A 98 -3.361 -16.966 6.763 1.00 0.88 H new ATOM 0 HG2 LYS A 98 -2.163 -16.854 8.958 1.00 1.04 H new ATOM 0 HG3 LYS A 98 -1.255 -18.289 8.525 1.00 1.04 H new ATOM 0 HD2 LYS A 98 -0.315 -17.106 6.542 1.00 1.35 H new ATOM 0 HD3 LYS A 98 -1.238 -15.674 6.951 1.00 1.35 H new ATOM 0 HE2 LYS A 98 0.970 -15.289 7.776 1.00 1.61 H new ATOM 0 HE3 LYS A 98 -0.020 -15.621 9.183 1.00 1.61 H new ATOM 0 HZ1 LYS A 98 2.078 -16.802 9.288 1.00 1.71 H new ATOM 0 HZ2 LYS A 98 0.796 -17.910 9.183 1.00 1.71 H new ATOM 0 HZ3 LYS A 98 1.755 -17.588 7.819 1.00 1.71 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 -5.364 -17.766 2.991 1.00 0.85 N ATOM 1643 CA MET B 1 -6.338 -16.864 2.374 1.00 0.86 C ATOM 1644 C MET B 1 -6.922 -15.853 3.397 1.00 0.76 C ATOM 1645 O MET B 1 -7.897 -15.158 3.090 1.00 0.93 O ATOM 1646 CB MET B 1 -7.462 -17.673 1.685 1.00 1.04 C ATOM 1647 CG MET B 1 -8.436 -18.392 2.630 1.00 1.09 C ATOM 1648 SD MET B 1 -9.640 -19.415 1.754 1.00 1.44 S ATOM 1649 CE MET B 1 -10.681 -19.962 3.104 1.00 1.75 C ATOM 0 H1 MET B 1 -5.036 -18.457 2.287 1.00 0.85 H new ATOM 0 H2 MET B 1 -4.553 -17.216 3.339 1.00 0.85 H new ATOM 0 H3 MET B 1 -5.810 -18.267 3.786 1.00 0.85 H new ATOM 0 HA MET B 1 -5.815 -16.281 1.615 1.00 0.86 H new ATOM 0 HB2 MET B 1 -8.033 -16.998 1.048 1.00 1.04 H new ATOM 0 HB3 MET B 1 -7.003 -18.415 1.032 1.00 1.04 H new ATOM 0 HG2 MET B 1 -7.870 -19.017 3.320 1.00 1.09 H new ATOM 0 HG3 MET B 1 -8.965 -17.652 3.231 1.00 1.09 H new ATOM 0 HE1 MET B 1 -11.472 -20.604 2.716 1.00 1.75 H new ATOM 0 HE2 MET B 1 -10.081 -20.519 3.823 1.00 1.75 H new ATOM 0 HE3 MET B 1 -11.125 -19.096 3.595 1.00 1.75 H new ATOM 1659 N ALA B 2 -6.309 -15.768 4.603 1.00 0.73 N ATOM 1660 CA ALA B 2 -6.759 -14.858 5.669 1.00 0.67 C ATOM 1661 C ALA B 2 -5.565 -14.150 6.327 1.00 0.60 C ATOM 1662 O ALA B 2 -4.524 -14.775 6.557 1.00 0.68 O ATOM 1663 CB ALA B 2 -7.560 -15.631 6.714 1.00 0.78 C ATOM 0 H ALA B 2 -5.495 -16.327 4.857 1.00 0.73 H new ATOM 0 HA ALA B 2 -7.399 -14.097 5.223 1.00 0.67 H new ATOM 0 HB1 ALA B 2 -7.888 -14.949 7.498 1.00 0.78 H new ATOM 0 HB2 ALA B 2 -8.430 -16.087 6.242 1.00 0.78 H new ATOM 0 HB3 ALA B 2 -6.934 -16.410 7.149 1.00 0.78 H new ATOM 1669 N ALA B 3 -5.723 -12.847 6.639 1.00 0.57 N ATOM 1670 CA ALA B 3 -4.649 -12.057 7.271 1.00 0.57 C ATOM 1671 C ALA B 3 -4.563 -12.333 8.786 1.00 0.58 C ATOM 1672 O ALA B 3 -5.588 -12.339 9.474 1.00 0.69 O ATOM 1673 CB ALA B 3 -4.834 -10.567 6.979 1.00 0.64 C ATOM 0 H ALA B 3 -6.580 -12.323 6.464 1.00 0.57 H new ATOM 0 HA ALA B 3 -3.699 -12.368 6.836 1.00 0.57 H new ATOM 0 HB1 ALA B 3 -4.032 -10.001 7.453 1.00 0.64 H new ATOM 0 HB2 ALA B 3 -4.807 -10.401 5.902 1.00 0.64 H new ATOM 0 HB3 ALA B 3 -5.795 -10.236 7.373 1.00 0.64 H new ATOM 1679 N GLU B 4 -3.329 -12.560 9.295 1.00 0.56 N ATOM 1680 CA GLU B 4 -3.093 -12.878 10.719 1.00 0.59 C ATOM 1681 C GLU B 4 -1.870 -12.099 11.286 1.00 0.56 C ATOM 1682 O GLU B 4 -0.920 -11.838 10.544 1.00 0.54 O ATOM 1683 CB GLU B 4 -2.868 -14.403 10.839 1.00 0.66 C ATOM 1684 CG GLU B 4 -2.785 -14.949 12.264 1.00 0.79 C ATOM 1685 CD GLU B 4 -2.605 -16.457 12.299 1.00 0.91 C ATOM 1686 OE1 GLU B 4 -1.445 -16.917 12.233 1.00 1.00 O ATOM 1687 OE2 GLU B 4 -3.622 -17.177 12.383 1.00 1.10 O ATOM 0 H GLU B 4 -2.478 -12.528 8.734 1.00 0.56 H new ATOM 0 HA GLU B 4 -3.960 -12.574 11.305 1.00 0.59 H new ATOM 0 HB2 GLU B 4 -3.679 -14.914 10.320 1.00 0.66 H new ATOM 0 HB3 GLU B 4 -1.946 -14.658 10.317 1.00 0.66 H new ATOM 0 HG2 GLU B 4 -1.952 -14.475 12.784 1.00 0.79 H new ATOM 0 HG3 GLU B 4 -3.692 -14.682 12.806 1.00 0.79 H new ATOM 1694 N PRO B 5 -1.875 -11.706 12.614 1.00 0.62 N ATOM 1695 CA PRO B 5 -0.739 -10.979 13.242 1.00 0.65 C ATOM 1696 C PRO B 5 0.552 -11.821 13.320 1.00 0.59 C ATOM 1697 O PRO B 5 0.489 -13.027 13.579 1.00 0.68 O ATOM 1698 CB PRO B 5 -1.247 -10.650 14.661 1.00 0.83 C ATOM 1699 CG PRO B 5 -2.725 -10.824 14.606 1.00 0.80 C ATOM 1700 CD PRO B 5 -2.979 -11.896 13.590 1.00 0.73 C ATOM 0 HA PRO B 5 -0.465 -10.102 12.656 1.00 0.65 H new ATOM 0 HB2 PRO B 5 -0.801 -11.314 15.401 1.00 0.83 H new ATOM 0 HB3 PRO B 5 -0.982 -9.632 14.946 1.00 0.83 H new ATOM 0 HG2 PRO B 5 -3.120 -11.109 15.581 1.00 0.80 H new ATOM 0 HG3 PRO B 5 -3.217 -9.894 14.322 1.00 0.80 H new ATOM 0 HD2 PRO B 5 -2.954 -12.889 14.038 1.00 0.73 H new ATOM 0 HD3 PRO B 5 -3.956 -11.782 13.120 1.00 0.73 H new ATOM 1708 N LEU B 6 1.721 -11.174 13.101 1.00 0.61 N ATOM 1709 CA LEU B 6 3.031 -11.866 13.147 1.00 0.70 C ATOM 1710 C LEU B 6 4.122 -10.990 13.801 1.00 0.73 C ATOM 1711 O LEU B 6 4.815 -11.445 14.716 1.00 1.24 O ATOM 1712 CB LEU B 6 3.474 -12.279 11.723 1.00 0.87 C ATOM 1713 CG LEU B 6 2.626 -13.373 11.027 1.00 0.95 C ATOM 1714 CD1 LEU B 6 3.029 -13.511 9.557 1.00 1.18 C ATOM 1715 CD2 LEU B 6 2.749 -14.724 11.748 1.00 1.08 C ATOM 0 H LEU B 6 1.784 -10.178 12.891 1.00 0.61 H new ATOM 0 HA LEU B 6 2.904 -12.758 13.761 1.00 0.70 H new ATOM 0 HB2 LEU B 6 3.469 -11.390 11.092 1.00 0.87 H new ATOM 0 HB3 LEU B 6 4.506 -12.627 11.774 1.00 0.87 H new ATOM 0 HG LEU B 6 1.582 -13.064 11.076 1.00 0.95 H new ATOM 0 HD11 LEU B 6 2.423 -14.284 9.085 1.00 1.18 H new ATOM 0 HD12 LEU B 6 2.870 -12.562 9.045 1.00 1.18 H new ATOM 0 HD13 LEU B 6 4.082 -13.786 9.493 1.00 1.18 H new ATOM 0 HD21 LEU B 6 2.141 -15.468 11.233 1.00 1.08 H new ATOM 0 HD22 LEU B 6 3.791 -15.043 11.747 1.00 1.08 H new ATOM 0 HD23 LEU B 6 2.402 -14.621 12.776 1.00 1.08 H new ATOM 1727 N THR B 7 4.269 -9.737 13.316 1.00 0.52 N ATOM 1728 CA THR B 7 5.280 -8.781 13.827 1.00 0.50 C ATOM 1729 C THR B 7 4.731 -7.336 13.743 1.00 0.48 C ATOM 1730 O THR B 7 3.745 -7.107 13.052 1.00 0.53 O ATOM 1731 CB THR B 7 6.613 -8.907 13.012 1.00 0.53 C ATOM 1732 OG1 THR B 7 6.956 -10.291 12.852 1.00 0.92 O ATOM 1733 CG2 THR B 7 7.785 -8.191 13.686 1.00 1.06 C ATOM 0 H THR B 7 3.694 -9.360 12.563 1.00 0.52 H new ATOM 0 HA THR B 7 5.491 -9.017 14.870 1.00 0.50 H new ATOM 0 HB THR B 7 6.437 -8.434 12.046 1.00 0.53 H new ATOM 0 HG1 THR B 7 6.940 -10.524 11.900 1.00 0.92 H new ATOM 0 HG21 THR B 7 8.682 -8.311 13.079 1.00 1.06 H new ATOM 0 HG22 THR B 7 7.554 -7.131 13.787 1.00 1.06 H new ATOM 0 HG23 THR B 7 7.955 -8.621 14.673 1.00 1.06 H new ATOM 1741 N GLU B 8 5.363 -6.369 14.449 1.00 0.49 N ATOM 1742 CA GLU B 8 4.913 -4.951 14.445 1.00 0.49 C ATOM 1743 C GLU B 8 4.734 -4.384 13.012 1.00 0.44 C ATOM 1744 O GLU B 8 3.748 -3.696 12.749 1.00 0.47 O ATOM 1745 CB GLU B 8 5.892 -4.067 15.252 1.00 0.54 C ATOM 1746 CG GLU B 8 5.318 -2.710 15.677 1.00 0.95 C ATOM 1747 CD GLU B 8 6.293 -1.880 16.500 1.00 1.01 C ATOM 1748 OE1 GLU B 8 6.446 -2.165 17.707 1.00 1.51 O ATOM 1749 OE2 GLU B 8 6.898 -0.943 15.939 1.00 1.29 O ATOM 0 H GLU B 8 6.185 -6.541 15.028 1.00 0.49 H new ATOM 0 HA GLU B 8 3.933 -4.932 14.922 1.00 0.49 H new ATOM 0 HB2 GLU B 8 6.203 -4.611 16.144 1.00 0.54 H new ATOM 0 HB3 GLU B 8 6.787 -3.898 14.653 1.00 0.54 H new ATOM 0 HG2 GLU B 8 5.033 -2.148 14.787 1.00 0.95 H new ATOM 0 HG3 GLU B 8 4.409 -2.872 16.256 1.00 0.95 H new ATOM 1756 N LEU B 9 5.690 -4.675 12.099 1.00 0.42 N ATOM 1757 CA LEU B 9 5.608 -4.195 10.696 1.00 0.39 C ATOM 1758 C LEU B 9 4.690 -5.096 9.850 1.00 0.38 C ATOM 1759 O LEU B 9 3.950 -4.593 8.997 1.00 0.39 O ATOM 1760 CB LEU B 9 7.008 -4.097 10.049 1.00 0.41 C ATOM 1761 CG LEU B 9 7.917 -2.961 10.576 1.00 0.50 C ATOM 1762 CD1 LEU B 9 9.330 -3.094 10.010 1.00 0.63 C ATOM 1763 CD2 LEU B 9 7.341 -1.577 10.244 1.00 0.65 C ATOM 0 H LEU B 9 6.519 -5.233 12.303 1.00 0.42 H new ATOM 0 HA LEU B 9 5.176 -3.195 10.724 1.00 0.39 H new ATOM 0 HB2 LEU B 9 7.523 -5.046 10.197 1.00 0.41 H new ATOM 0 HB3 LEU B 9 6.882 -3.967 8.974 1.00 0.41 H new ATOM 0 HG LEU B 9 7.961 -3.055 11.661 1.00 0.50 H new ATOM 0 HD11 LEU B 9 9.953 -2.286 10.393 1.00 0.63 H new ATOM 0 HD12 LEU B 9 9.754 -4.052 10.311 1.00 0.63 H new ATOM 0 HD13 LEU B 9 9.293 -3.039 8.922 1.00 0.63 H new ATOM 0 HD21 LEU B 9 8.006 -0.804 10.629 1.00 0.65 H new ATOM 0 HD22 LEU B 9 7.249 -1.471 9.163 1.00 0.65 H new ATOM 0 HD23 LEU B 9 6.358 -1.472 10.703 1.00 0.65 H new ATOM 1775 N GLU B 10 4.741 -6.426 10.082 1.00 0.39 N ATOM 1776 CA GLU B 10 3.875 -7.387 9.361 1.00 0.41 C ATOM 1777 C GLU B 10 2.394 -7.187 9.753 1.00 0.42 C ATOM 1778 O GLU B 10 1.494 -7.450 8.947 1.00 0.47 O ATOM 1779 CB GLU B 10 4.303 -8.842 9.641 1.00 0.46 C ATOM 1780 CG GLU B 10 5.704 -9.194 9.138 1.00 0.50 C ATOM 1781 CD GLU B 10 6.048 -10.665 9.327 1.00 0.56 C ATOM 1782 OE1 GLU B 10 5.442 -11.509 8.634 1.00 0.95 O ATOM 1783 OE2 GLU B 10 6.921 -10.970 10.166 1.00 0.95 O ATOM 0 H GLU B 10 5.369 -6.858 10.760 1.00 0.39 H new ATOM 0 HA GLU B 10 3.986 -7.196 8.294 1.00 0.41 H new ATOM 0 HB2 GLU B 10 4.260 -9.021 10.715 1.00 0.46 H new ATOM 0 HB3 GLU B 10 3.583 -9.516 9.177 1.00 0.46 H new ATOM 0 HG2 GLU B 10 5.779 -8.941 8.080 1.00 0.50 H new ATOM 0 HG3 GLU B 10 6.438 -8.584 9.664 1.00 0.50 H new ATOM 1790 N GLU B 11 2.152 -6.716 10.999 1.00 0.42 N ATOM 1791 CA GLU B 11 0.798 -6.449 11.509 1.00 0.45 C ATOM 1792 C GLU B 11 0.271 -5.099 10.977 1.00 0.43 C ATOM 1793 O GLU B 11 -0.937 -4.941 10.816 1.00 0.45 O ATOM 1794 CB GLU B 11 0.786 -6.455 13.058 1.00 0.51 C ATOM 1795 CG GLU B 11 -0.608 -6.407 13.693 1.00 0.62 C ATOM 1796 CD GLU B 11 -0.560 -6.267 15.206 1.00 0.70 C ATOM 1797 OE1 GLU B 11 -0.386 -5.127 15.690 1.00 0.85 O ATOM 1798 OE2 GLU B 11 -0.699 -7.293 15.904 1.00 0.82 O ATOM 0 H GLU B 11 2.891 -6.513 11.672 1.00 0.42 H new ATOM 0 HA GLU B 11 0.140 -7.242 11.154 1.00 0.45 H new ATOM 0 HB2 GLU B 11 1.298 -7.352 13.407 1.00 0.51 H new ATOM 0 HB3 GLU B 11 1.361 -5.601 13.415 1.00 0.51 H new ATOM 0 HG2 GLU B 11 -1.165 -5.570 13.272 1.00 0.62 H new ATOM 0 HG3 GLU B 11 -1.152 -7.315 13.433 1.00 0.62 H new ATOM 1805 N SER B 12 1.182 -4.130 10.701 1.00 0.43 N ATOM 1806 CA SER B 12 0.793 -2.797 10.185 1.00 0.44 C ATOM 1807 C SER B 12 -0.007 -2.910 8.874 1.00 0.42 C ATOM 1808 O SER B 12 -1.079 -2.317 8.747 1.00 0.47 O ATOM 1809 CB SER B 12 2.032 -1.910 9.969 1.00 0.48 C ATOM 1810 OG SER B 12 2.718 -1.677 11.188 1.00 0.56 O ATOM 0 H SER B 12 2.187 -4.249 10.828 1.00 0.43 H new ATOM 0 HA SER B 12 0.153 -2.334 10.936 1.00 0.44 H new ATOM 0 HB2 SER B 12 2.704 -2.388 9.257 1.00 0.48 H new ATOM 0 HB3 SER B 12 1.729 -0.958 9.532 1.00 0.48 H new ATOM 0 HG SER B 12 2.981 -2.534 11.584 1.00 0.56 H new ATOM 1816 N ILE B 13 0.523 -3.683 7.907 1.00 0.40 N ATOM 1817 CA ILE B 13 -0.154 -3.898 6.610 1.00 0.41 C ATOM 1818 C ILE B 13 -1.330 -4.898 6.744 1.00 0.41 C ATOM 1819 O ILE B 13 -2.292 -4.826 5.973 1.00 0.48 O ATOM 1820 CB ILE B 13 0.836 -4.347 5.472 1.00 0.46 C ATOM 1821 CG1 ILE B 13 1.629 -5.640 5.822 1.00 0.45 C ATOM 1822 CG2 ILE B 13 1.806 -3.208 5.134 1.00 0.53 C ATOM 1823 CD1 ILE B 13 0.865 -6.938 5.611 1.00 0.45 C ATOM 0 H ILE B 13 1.415 -4.169 7.997 1.00 0.40 H new ATOM 0 HA ILE B 13 -0.558 -2.930 6.314 1.00 0.41 H new ATOM 0 HB ILE B 13 0.223 -4.583 4.602 1.00 0.46 H new ATOM 0 HG12 ILE B 13 2.536 -5.667 5.218 1.00 0.45 H new ATOM 0 HG13 ILE B 13 1.942 -5.585 6.865 1.00 0.45 H new ATOM 0 HG21 ILE B 13 2.486 -3.531 4.345 1.00 0.53 H new ATOM 0 HG22 ILE B 13 1.243 -2.339 4.794 1.00 0.53 H new ATOM 0 HG23 ILE B 13 2.380 -2.943 6.022 1.00 0.53 H new ATOM 0 HD11 ILE B 13 1.500 -7.782 5.882 1.00 0.45 H new ATOM 0 HD12 ILE B 13 -0.028 -6.940 6.236 1.00 0.45 H new ATOM 0 HD13 ILE B 13 0.575 -7.023 4.564 1.00 0.45 H new ATOM 1835 N GLU B 14 -1.242 -5.820 7.732 1.00 0.40 N ATOM 1836 CA GLU B 14 -2.296 -6.827 7.990 1.00 0.43 C ATOM 1837 C GLU B 14 -3.562 -6.183 8.607 1.00 0.45 C ATOM 1838 O GLU B 14 -4.678 -6.604 8.293 1.00 0.48 O ATOM 1839 CB GLU B 14 -1.739 -7.942 8.915 1.00 0.46 C ATOM 1840 CG GLU B 14 -2.770 -8.954 9.440 1.00 0.57 C ATOM 1841 CD GLU B 14 -3.307 -8.611 10.822 1.00 0.64 C ATOM 1842 OE1 GLU B 14 -2.569 -8.804 11.809 1.00 0.92 O ATOM 1843 OE2 GLU B 14 -4.461 -8.143 10.912 1.00 1.00 O ATOM 0 H GLU B 14 -0.446 -5.886 8.366 1.00 0.40 H new ATOM 0 HA GLU B 14 -2.590 -7.266 7.037 1.00 0.43 H new ATOM 0 HB2 GLU B 14 -0.968 -8.487 8.371 1.00 0.46 H new ATOM 0 HB3 GLU B 14 -1.254 -7.470 9.769 1.00 0.46 H new ATOM 0 HG2 GLU B 14 -3.603 -9.010 8.739 1.00 0.57 H new ATOM 0 HG3 GLU B 14 -2.313 -9.943 9.471 1.00 0.57 H new ATOM 1850 N THR B 15 -3.377 -5.172 9.487 1.00 0.45 N ATOM 1851 CA THR B 15 -4.503 -4.470 10.145 1.00 0.49 C ATOM 1852 C THR B 15 -5.434 -3.790 9.114 1.00 0.47 C ATOM 1853 O THR B 15 -6.641 -3.720 9.336 1.00 0.50 O ATOM 1854 CB THR B 15 -3.999 -3.419 11.181 1.00 0.54 C ATOM 1855 OG1 THR B 15 -3.054 -4.028 12.073 1.00 0.75 O ATOM 1856 CG2 THR B 15 -5.143 -2.825 12.010 1.00 0.88 C ATOM 0 H THR B 15 -2.457 -4.824 9.758 1.00 0.45 H new ATOM 0 HA THR B 15 -5.076 -5.231 10.676 1.00 0.49 H new ATOM 0 HB THR B 15 -3.532 -2.612 10.616 1.00 0.54 H new ATOM 0 HG1 THR B 15 -2.171 -4.050 11.649 1.00 0.75 H new ATOM 0 HG21 THR B 15 -4.741 -2.099 12.717 1.00 0.88 H new ATOM 0 HG22 THR B 15 -5.854 -2.332 11.348 1.00 0.88 H new ATOM 0 HG23 THR B 15 -5.648 -3.622 12.556 1.00 0.88 H new ATOM 1864 N VAL B 16 -4.865 -3.301 7.989 1.00 0.45 N ATOM 1865 CA VAL B 16 -5.657 -2.646 6.921 1.00 0.47 C ATOM 1866 C VAL B 16 -6.539 -3.689 6.185 1.00 0.47 C ATOM 1867 O VAL B 16 -7.628 -3.353 5.705 1.00 0.52 O ATOM 1868 CB VAL B 16 -4.749 -1.879 5.894 1.00 0.49 C ATOM 1869 CG1 VAL B 16 -5.580 -1.126 4.845 1.00 0.56 C ATOM 1870 CG2 VAL B 16 -3.808 -0.902 6.613 1.00 0.53 C ATOM 0 H VAL B 16 -3.864 -3.347 7.797 1.00 0.45 H new ATOM 0 HA VAL B 16 -6.299 -1.908 7.402 1.00 0.47 H new ATOM 0 HB VAL B 16 -4.153 -2.631 5.377 1.00 0.49 H new ATOM 0 HG11 VAL B 16 -4.913 -0.609 4.155 1.00 0.56 H new ATOM 0 HG12 VAL B 16 -6.196 -1.835 4.292 1.00 0.56 H new ATOM 0 HG13 VAL B 16 -6.221 -0.399 5.343 1.00 0.56 H new ATOM 0 HG21 VAL B 16 -3.191 -0.384 5.879 1.00 0.53 H new ATOM 0 HG22 VAL B 16 -4.397 -0.173 7.170 1.00 0.53 H new ATOM 0 HG23 VAL B 16 -3.167 -1.454 7.301 1.00 0.53 H new ATOM 1880 N VAL B 17 -6.066 -4.954 6.124 1.00 0.46 N ATOM 1881 CA VAL B 17 -6.806 -6.054 5.474 1.00 0.50 C ATOM 1882 C VAL B 17 -8.016 -6.483 6.329 1.00 0.57 C ATOM 1883 O VAL B 17 -9.130 -6.568 5.817 1.00 0.97 O ATOM 1884 CB VAL B 17 -5.892 -7.307 5.214 1.00 0.53 C ATOM 1885 CG1 VAL B 17 -6.640 -8.415 4.453 1.00 0.63 C ATOM 1886 CG2 VAL B 17 -4.616 -6.915 4.465 1.00 0.55 C ATOM 0 H VAL B 17 -5.170 -5.237 6.520 1.00 0.46 H new ATOM 0 HA VAL B 17 -7.151 -5.672 4.513 1.00 0.50 H new ATOM 0 HB VAL B 17 -5.613 -7.704 6.190 1.00 0.53 H new ATOM 0 HG11 VAL B 17 -5.972 -9.262 4.294 1.00 0.63 H new ATOM 0 HG12 VAL B 17 -7.503 -8.738 5.035 1.00 0.63 H new ATOM 0 HG13 VAL B 17 -6.975 -8.032 3.489 1.00 0.63 H new ATOM 0 HG21 VAL B 17 -4.004 -7.802 4.300 1.00 0.55 H new ATOM 0 HG22 VAL B 17 -4.879 -6.472 3.505 1.00 0.55 H new ATOM 0 HG23 VAL B 17 -4.054 -6.192 5.057 1.00 0.55 H new ATOM 1896 N THR B 18 -7.779 -6.729 7.639 1.00 0.50 N ATOM 1897 CA THR B 18 -8.832 -7.185 8.576 1.00 0.52 C ATOM 1898 C THR B 18 -9.883 -6.103 8.906 1.00 0.54 C ATOM 1899 O THR B 18 -11.082 -6.404 8.935 1.00 0.67 O ATOM 1900 CB THR B 18 -8.231 -7.707 9.917 1.00 0.56 C ATOM 1901 OG1 THR B 18 -7.547 -6.648 10.603 1.00 0.58 O ATOM 1902 CG2 THR B 18 -7.259 -8.862 9.694 1.00 0.62 C ATOM 0 H THR B 18 -6.862 -6.618 8.072 1.00 0.50 H new ATOM 0 HA THR B 18 -9.332 -7.995 8.045 1.00 0.52 H new ATOM 0 HB THR B 18 -9.064 -8.068 10.521 1.00 0.56 H new ATOM 0 HG1 THR B 18 -7.176 -6.989 11.444 1.00 0.58 H new ATOM 0 HG21 THR B 18 -6.864 -9.195 10.654 1.00 0.62 H new ATOM 0 HG22 THR B 18 -7.780 -9.688 9.210 1.00 0.62 H new ATOM 0 HG23 THR B 18 -6.438 -8.529 9.059 1.00 0.62 H new ATOM 1910 N THR B 19 -9.436 -4.851 9.150 1.00 0.53 N ATOM 1911 CA THR B 19 -10.347 -3.737 9.514 1.00 0.57 C ATOM 1912 C THR B 19 -11.385 -3.418 8.410 1.00 0.57 C ATOM 1913 O THR B 19 -12.502 -3.003 8.731 1.00 0.66 O ATOM 1914 CB THR B 19 -9.542 -2.448 9.891 1.00 0.60 C ATOM 1915 OG1 THR B 19 -8.571 -2.768 10.899 1.00 0.61 O ATOM 1916 CG2 THR B 19 -10.435 -1.321 10.420 1.00 0.69 C ATOM 0 H THR B 19 -8.453 -4.585 9.102 1.00 0.53 H new ATOM 0 HA THR B 19 -10.904 -4.076 10.387 1.00 0.57 H new ATOM 0 HB THR B 19 -9.065 -2.096 8.976 1.00 0.60 H new ATOM 0 HG1 THR B 19 -7.843 -3.287 10.498 1.00 0.61 H new ATOM 0 HG21 THR B 19 -9.821 -0.454 10.664 1.00 0.69 H new ATOM 0 HG22 THR B 19 -11.164 -1.046 9.658 1.00 0.69 H new ATOM 0 HG23 THR B 19 -10.957 -1.660 11.315 1.00 0.69 H new ATOM 1924 N PHE B 20 -11.025 -3.625 7.125 1.00 0.56 N ATOM 1925 CA PHE B 20 -11.936 -3.340 5.999 1.00 0.60 C ATOM 1926 C PHE B 20 -12.567 -4.612 5.377 1.00 0.60 C ATOM 1927 O PHE B 20 -13.540 -4.492 4.625 1.00 0.94 O ATOM 1928 CB PHE B 20 -11.196 -2.526 4.915 1.00 0.68 C ATOM 1929 CG PHE B 20 -12.109 -1.935 3.855 1.00 0.75 C ATOM 1930 CD1 PHE B 20 -12.917 -0.840 4.141 1.00 0.91 C ATOM 1931 CD2 PHE B 20 -12.170 -2.487 2.581 1.00 0.80 C ATOM 1932 CE1 PHE B 20 -13.758 -0.311 3.182 1.00 1.02 C ATOM 1933 CE2 PHE B 20 -13.015 -1.960 1.623 1.00 0.90 C ATOM 1934 CZ PHE B 20 -13.806 -0.870 1.923 1.00 0.97 C ATOM 0 H PHE B 20 -10.114 -3.987 6.844 1.00 0.56 H new ATOM 0 HA PHE B 20 -12.762 -2.757 6.407 1.00 0.60 H new ATOM 0 HB2 PHE B 20 -10.644 -1.718 5.395 1.00 0.68 H new ATOM 0 HB3 PHE B 20 -10.462 -3.169 4.430 1.00 0.68 H new ATOM 0 HD1 PHE B 20 -12.886 -0.398 5.126 1.00 0.91 H new ATOM 0 HD2 PHE B 20 -11.550 -3.337 2.337 1.00 0.80 H new ATOM 0 HE1 PHE B 20 -14.378 0.541 3.418 1.00 1.02 H new ATOM 0 HE2 PHE B 20 -13.056 -2.402 0.638 1.00 0.90 H new ATOM 0 HZ PHE B 20 -14.462 -0.455 1.172 1.00 0.97 H new ATOM 1944 N PHE B 21 -12.043 -5.825 5.689 1.00 0.71 N ATOM 1945 CA PHE B 21 -12.596 -7.081 5.116 1.00 0.72 C ATOM 1946 C PHE B 21 -14.067 -7.330 5.521 1.00 0.68 C ATOM 1947 O PHE B 21 -14.782 -8.037 4.807 1.00 0.71 O ATOM 1948 CB PHE B 21 -11.730 -8.316 5.480 1.00 1.01 C ATOM 1949 CG PHE B 21 -11.446 -9.224 4.297 1.00 1.63 C ATOM 1950 CD1 PHE B 21 -10.353 -8.992 3.466 1.00 1.93 C ATOM 1951 CD2 PHE B 21 -12.279 -10.298 4.012 1.00 2.26 C ATOM 1952 CE1 PHE B 21 -10.103 -9.811 2.383 1.00 2.67 C ATOM 1953 CE2 PHE B 21 -12.030 -11.116 2.926 1.00 2.92 C ATOM 1954 CZ PHE B 21 -10.939 -10.872 2.111 1.00 3.08 C ATOM 0 H PHE B 21 -11.254 -5.960 6.321 1.00 0.71 H new ATOM 0 HA PHE B 21 -12.570 -6.943 4.035 1.00 0.72 H new ATOM 0 HB2 PHE B 21 -10.785 -7.976 5.902 1.00 1.01 H new ATOM 0 HB3 PHE B 21 -12.237 -8.890 6.255 1.00 1.01 H new ATOM 0 HD1 PHE B 21 -9.693 -8.162 3.671 1.00 1.93 H new ATOM 0 HD2 PHE B 21 -13.131 -10.496 4.646 1.00 2.26 H new ATOM 0 HE1 PHE B 21 -9.251 -9.620 1.748 1.00 2.67 H new ATOM 0 HE2 PHE B 21 -12.687 -11.946 2.714 1.00 2.92 H new ATOM 0 HZ PHE B 21 -10.743 -11.512 1.263 1.00 3.08 H new ATOM 1964 N THR B 22 -14.505 -6.756 6.667 1.00 0.76 N ATOM 1965 CA THR B 22 -15.896 -6.899 7.152 1.00 0.91 C ATOM 1966 C THR B 22 -16.924 -6.440 6.086 1.00 0.84 C ATOM 1967 O THR B 22 -17.975 -7.071 5.927 1.00 1.01 O ATOM 1968 CB THR B 22 -16.110 -6.096 8.476 1.00 1.10 C ATOM 1969 OG1 THR B 22 -15.046 -6.381 9.405 1.00 1.23 O ATOM 1970 CG2 THR B 22 -17.456 -6.416 9.134 1.00 1.37 C ATOM 0 H THR B 22 -13.912 -6.189 7.273 1.00 0.76 H new ATOM 0 HA THR B 22 -16.060 -7.959 7.349 1.00 0.91 H new ATOM 0 HB THR B 22 -16.106 -5.038 8.215 1.00 1.10 H new ATOM 0 HG1 THR B 22 -15.188 -5.872 10.231 1.00 1.23 H new ATOM 0 HG21 THR B 22 -17.560 -5.835 10.050 1.00 1.37 H new ATOM 0 HG22 THR B 22 -18.265 -6.162 8.449 1.00 1.37 H new ATOM 0 HG23 THR B 22 -17.501 -7.479 9.371 1.00 1.37 H new ATOM 1978 N PHE B 23 -16.610 -5.336 5.371 1.00 0.69 N ATOM 1979 CA PHE B 23 -17.482 -4.798 4.303 1.00 0.75 C ATOM 1980 C PHE B 23 -16.970 -5.189 2.902 1.00 0.70 C ATOM 1981 O PHE B 23 -17.774 -5.336 1.979 1.00 0.83 O ATOM 1982 CB PHE B 23 -17.594 -3.262 4.411 1.00 0.84 C ATOM 1983 CG PHE B 23 -18.359 -2.792 5.632 1.00 1.00 C ATOM 1984 CD1 PHE B 23 -19.741 -2.618 5.593 1.00 1.32 C ATOM 1985 CD2 PHE B 23 -17.696 -2.535 6.827 1.00 1.03 C ATOM 1986 CE1 PHE B 23 -20.435 -2.203 6.714 1.00 1.54 C ATOM 1987 CE2 PHE B 23 -18.388 -2.118 7.947 1.00 1.27 C ATOM 1988 CZ PHE B 23 -19.758 -1.953 7.891 1.00 1.48 C ATOM 0 H PHE B 23 -15.755 -4.799 5.516 1.00 0.69 H new ATOM 0 HA PHE B 23 -18.470 -5.238 4.439 1.00 0.75 H new ATOM 0 HB2 PHE B 23 -16.592 -2.834 4.434 1.00 0.84 H new ATOM 0 HB3 PHE B 23 -18.084 -2.878 3.516 1.00 0.84 H new ATOM 0 HD1 PHE B 23 -20.277 -2.810 4.675 1.00 1.32 H new ATOM 0 HD2 PHE B 23 -16.625 -2.663 6.880 1.00 1.03 H new ATOM 0 HE1 PHE B 23 -21.506 -2.074 6.669 1.00 1.54 H new ATOM 0 HE2 PHE B 23 -17.858 -1.921 8.867 1.00 1.27 H new ATOM 0 HZ PHE B 23 -20.299 -1.629 8.767 1.00 1.48 H new ATOM 1998 N ALA B 24 -15.635 -5.369 2.751 1.00 0.61 N ATOM 1999 CA ALA B 24 -15.014 -5.732 1.452 1.00 0.67 C ATOM 2000 C ALA B 24 -15.575 -7.039 0.847 1.00 0.65 C ATOM 2001 O ALA B 24 -15.616 -7.176 -0.380 1.00 0.85 O ATOM 2002 CB ALA B 24 -13.495 -5.831 1.599 1.00 0.77 C ATOM 0 H ALA B 24 -14.966 -5.269 3.514 1.00 0.61 H new ATOM 0 HA ALA B 24 -15.269 -4.933 0.756 1.00 0.67 H new ATOM 0 HB1 ALA B 24 -13.053 -6.098 0.639 1.00 0.77 H new ATOM 0 HB2 ALA B 24 -13.098 -4.870 1.927 1.00 0.77 H new ATOM 0 HB3 ALA B 24 -13.250 -6.596 2.336 1.00 0.77 H new ATOM 2008 N ARG B 25 -16.003 -7.990 1.706 1.00 0.62 N ATOM 2009 CA ARG B 25 -16.555 -9.283 1.244 1.00 0.68 C ATOM 2010 C ARG B 25 -18.036 -9.189 0.777 1.00 0.70 C ATOM 2011 O ARG B 25 -18.551 -10.153 0.201 1.00 0.87 O ATOM 2012 CB ARG B 25 -16.393 -10.368 2.342 1.00 0.77 C ATOM 2013 CG ARG B 25 -17.222 -10.142 3.616 1.00 0.80 C ATOM 2014 CD ARG B 25 -16.920 -11.186 4.695 1.00 1.01 C ATOM 2015 NE ARG B 25 -17.790 -11.036 5.880 1.00 1.10 N ATOM 2016 CZ ARG B 25 -17.779 -11.845 6.966 1.00 1.38 C ATOM 2017 NH1 ARG B 25 -16.941 -12.887 7.056 1.00 1.73 N ATOM 2018 NH2 ARG B 25 -18.626 -11.605 7.969 1.00 1.48 N ATOM 0 H ARG B 25 -15.977 -7.887 2.720 1.00 0.62 H new ATOM 0 HA ARG B 25 -15.976 -9.570 0.366 1.00 0.68 H new ATOM 0 HB2 ARG B 25 -16.666 -11.334 1.918 1.00 0.77 H new ATOM 0 HB3 ARG B 25 -15.340 -10.427 2.619 1.00 0.77 H new ATOM 0 HG2 ARG B 25 -17.017 -9.146 4.009 1.00 0.80 H new ATOM 0 HG3 ARG B 25 -18.283 -10.175 3.368 1.00 0.80 H new ATOM 0 HD2 ARG B 25 -17.048 -12.185 4.277 1.00 1.01 H new ATOM 0 HD3 ARG B 25 -15.877 -11.099 5.000 1.00 1.01 H new ATOM 0 HE ARG B 25 -18.452 -10.260 5.880 1.00 1.10 H new ATOM 0 HH11 ARG B 25 -16.291 -13.086 6.295 1.00 1.73 H new ATOM 0 HH12 ARG B 25 -16.953 -13.481 7.885 1.00 1.73 H new ATOM 0 HH21 ARG B 25 -19.273 -10.819 7.913 1.00 1.48 H new ATOM 0 HH22 ARG B 25 -18.626 -12.208 8.792 1.00 1.48 H new ATOM 2032 N GLN B 26 -18.715 -8.035 1.015 1.00 0.71 N ATOM 2033 CA GLN B 26 -20.134 -7.841 0.615 1.00 0.79 C ATOM 2034 C GLN B 26 -20.327 -7.991 -0.912 1.00 0.73 C ATOM 2035 O GLN B 26 -21.202 -8.742 -1.354 1.00 0.84 O ATOM 2036 CB GLN B 26 -20.647 -6.462 1.104 1.00 0.90 C ATOM 2037 CG GLN B 26 -22.126 -6.188 0.817 1.00 1.09 C ATOM 2038 CD GLN B 26 -22.618 -4.880 1.428 1.00 1.31 C ATOM 2039 OE1 GLN B 26 -22.517 -3.821 0.806 1.00 1.46 O ATOM 2040 NE2 GLN B 26 -23.161 -4.941 2.648 1.00 1.68 N ATOM 0 H GLN B 26 -18.303 -7.227 1.481 1.00 0.71 H new ATOM 0 HA GLN B 26 -20.724 -8.624 1.092 1.00 0.79 H new ATOM 0 HB2 GLN B 26 -20.480 -6.388 2.179 1.00 0.90 H new ATOM 0 HB3 GLN B 26 -20.050 -5.681 0.634 1.00 0.90 H new ATOM 0 HG2 GLN B 26 -22.282 -6.161 -0.261 1.00 1.09 H new ATOM 0 HG3 GLN B 26 -22.725 -7.012 1.205 1.00 1.09 H new ATOM 0 HE21 GLN B 26 -23.228 -5.836 3.132 1.00 1.68 H new ATOM 0 HE22 GLN B 26 -23.509 -4.092 3.094 1.00 1.68 H new ATOM 2049 N GLU B 27 -19.514 -7.267 -1.708 1.00 0.66 N ATOM 2050 CA GLU B 27 -19.583 -7.338 -3.182 1.00 0.71 C ATOM 2051 C GLU B 27 -18.778 -8.547 -3.705 1.00 0.88 C ATOM 2052 O GLU B 27 -18.161 -9.268 -2.912 1.00 1.45 O ATOM 2053 CB GLU B 27 -19.072 -6.017 -3.816 1.00 0.83 C ATOM 2054 CG GLU B 27 -19.954 -4.794 -3.542 1.00 0.93 C ATOM 2055 CD GLU B 27 -21.322 -4.874 -4.211 1.00 1.04 C ATOM 2056 OE1 GLU B 27 -21.390 -4.693 -5.446 1.00 1.23 O ATOM 2057 OE2 GLU B 27 -22.319 -5.117 -3.498 1.00 1.16 O ATOM 0 H GLU B 27 -18.803 -6.627 -1.355 1.00 0.66 H new ATOM 0 HA GLU B 27 -20.625 -7.473 -3.473 1.00 0.71 H new ATOM 0 HB2 GLU B 27 -18.068 -5.815 -3.443 1.00 0.83 H new ATOM 0 HB3 GLU B 27 -18.990 -6.155 -4.894 1.00 0.83 H new ATOM 0 HG2 GLU B 27 -20.089 -4.686 -2.466 1.00 0.93 H new ATOM 0 HG3 GLU B 27 -19.439 -3.898 -3.890 1.00 0.93 H new ATOM 2064 N GLY B 28 -18.796 -8.771 -5.042 1.00 0.73 N ATOM 2065 CA GLY B 28 -18.069 -9.896 -5.653 1.00 0.86 C ATOM 2066 C GLY B 28 -16.572 -9.920 -5.323 1.00 0.69 C ATOM 2067 O GLY B 28 -15.973 -8.864 -5.102 1.00 0.66 O ATOM 0 H GLY B 28 -19.304 -8.189 -5.708 1.00 0.73 H new ATOM 0 HA2 GLY B 28 -18.520 -10.831 -5.320 1.00 0.86 H new ATOM 0 HA3 GLY B 28 -18.192 -9.851 -6.735 1.00 0.86 H new ATOM 2071 N ARG B 29 -15.973 -11.140 -5.297 1.00 0.68 N ATOM 2072 CA ARG B 29 -14.535 -11.353 -4.977 1.00 0.65 C ATOM 2073 C ARG B 29 -14.225 -10.986 -3.509 1.00 0.62 C ATOM 2074 O ARG B 29 -14.540 -9.879 -3.060 1.00 0.69 O ATOM 2075 CB ARG B 29 -13.598 -10.579 -5.944 1.00 0.66 C ATOM 2076 CG ARG B 29 -13.605 -11.119 -7.375 1.00 0.84 C ATOM 2077 CD ARG B 29 -12.767 -10.259 -8.326 1.00 1.28 C ATOM 2078 NE ARG B 29 -12.846 -10.739 -9.720 1.00 1.44 N ATOM 2079 CZ ARG B 29 -12.484 -10.032 -10.813 1.00 1.93 C ATOM 2080 NH1 ARG B 29 -11.984 -8.792 -10.719 1.00 2.62 N ATOM 2081 NH2 ARG B 29 -12.625 -10.588 -12.017 1.00 2.09 N ATOM 0 H ARG B 29 -16.474 -12.005 -5.498 1.00 0.68 H new ATOM 0 HA ARG B 29 -14.339 -12.416 -5.113 1.00 0.65 H new ATOM 0 HB2 ARG B 29 -13.894 -9.530 -5.960 1.00 0.66 H new ATOM 0 HB3 ARG B 29 -12.580 -10.617 -5.556 1.00 0.66 H new ATOM 0 HG2 ARG B 29 -13.221 -12.139 -7.378 1.00 0.84 H new ATOM 0 HG3 ARG B 29 -14.632 -11.164 -7.739 1.00 0.84 H new ATOM 0 HD2 ARG B 29 -13.111 -9.226 -8.278 1.00 1.28 H new ATOM 0 HD3 ARG B 29 -11.727 -10.265 -7.999 1.00 1.28 H new ATOM 0 HE ARG B 29 -13.203 -11.682 -9.870 1.00 1.44 H new ATOM 0 HH11 ARG B 29 -11.868 -8.357 -9.804 1.00 2.62 H new ATOM 0 HH12 ARG B 29 -11.720 -8.283 -11.563 1.00 2.62 H new ATOM 0 HH21 ARG B 29 -13.001 -11.532 -12.102 1.00 2.09 H new ATOM 0 HH22 ARG B 29 -12.357 -10.069 -12.853 1.00 2.09 H new ATOM 2095 N LYS B 30 -13.596 -11.924 -2.762 1.00 0.64 N ATOM 2096 CA LYS B 30 -13.247 -11.696 -1.340 1.00 0.65 C ATOM 2097 C LYS B 30 -12.109 -10.668 -1.201 1.00 0.63 C ATOM 2098 O LYS B 30 -12.233 -9.703 -0.444 1.00 0.67 O ATOM 2099 CB LYS B 30 -12.845 -13.016 -0.636 1.00 0.73 C ATOM 2100 CG LYS B 30 -13.977 -14.036 -0.463 1.00 0.79 C ATOM 2101 CD LYS B 30 -15.008 -13.597 0.585 1.00 0.87 C ATOM 2102 CE LYS B 30 -16.009 -14.706 0.923 1.00 1.01 C ATOM 2103 NZ LYS B 30 -16.893 -15.062 -0.228 1.00 1.11 N ATOM 0 H LYS B 30 -13.321 -12.840 -3.118 1.00 0.64 H new ATOM 0 HA LYS B 30 -14.139 -11.300 -0.855 1.00 0.65 H new ATOM 0 HB2 LYS B 30 -12.041 -13.483 -1.206 1.00 0.73 H new ATOM 0 HB3 LYS B 30 -12.441 -12.776 0.347 1.00 0.73 H new ATOM 0 HG2 LYS B 30 -14.477 -14.185 -1.420 1.00 0.79 H new ATOM 0 HG3 LYS B 30 -13.554 -14.997 -0.172 1.00 0.79 H new ATOM 0 HD2 LYS B 30 -14.490 -13.290 1.494 1.00 0.87 H new ATOM 0 HD3 LYS B 30 -15.548 -12.725 0.216 1.00 0.87 H new ATOM 0 HE2 LYS B 30 -15.465 -15.594 1.245 1.00 1.01 H new ATOM 0 HE3 LYS B 30 -16.626 -14.388 1.764 1.00 1.01 H new ATOM 0 HZ1 LYS B 30 -17.549 -15.817 0.058 1.00 1.11 H new ATOM 0 HZ2 LYS B 30 -17.435 -14.225 -0.521 1.00 1.11 H new ATOM 0 HZ3 LYS B 30 -16.311 -15.393 -1.024 1.00 1.11 H new ATOM 2117 N ASP B 31 -11.006 -10.879 -1.949 1.00 0.65 N ATOM 2118 CA ASP B 31 -9.839 -9.978 -1.904 1.00 0.69 C ATOM 2119 C ASP B 31 -9.998 -8.812 -2.905 1.00 0.64 C ATOM 2120 O ASP B 31 -9.275 -8.733 -3.908 1.00 0.88 O ATOM 2121 CB ASP B 31 -8.540 -10.768 -2.175 1.00 0.83 C ATOM 2122 CG ASP B 31 -8.264 -11.849 -1.137 1.00 0.94 C ATOM 2123 OD1 ASP B 31 -8.159 -11.511 0.063 1.00 1.36 O ATOM 2124 OD2 ASP B 31 -8.149 -13.030 -1.526 1.00 1.24 O ATOM 0 H ASP B 31 -10.901 -11.665 -2.590 1.00 0.65 H new ATOM 0 HA ASP B 31 -9.777 -9.548 -0.904 1.00 0.69 H new ATOM 0 HB2 ASP B 31 -8.602 -11.228 -3.161 1.00 0.83 H new ATOM 0 HB3 ASP B 31 -7.700 -10.074 -2.199 1.00 0.83 H new ATOM 2129 N SER B 32 -10.962 -7.911 -2.621 1.00 0.65 N ATOM 2130 CA SER B 32 -11.240 -6.738 -3.479 1.00 0.59 C ATOM 2131 C SER B 32 -12.018 -5.649 -2.714 1.00 0.57 C ATOM 2132 O SER B 32 -12.680 -5.942 -1.715 1.00 0.64 O ATOM 2133 CB SER B 32 -12.042 -7.161 -4.725 1.00 0.59 C ATOM 2134 OG SER B 32 -13.308 -7.703 -4.371 1.00 1.13 O ATOM 0 H SER B 32 -11.564 -7.974 -1.800 1.00 0.65 H new ATOM 0 HA SER B 32 -10.280 -6.324 -3.786 1.00 0.59 H new ATOM 0 HB2 SER B 32 -12.184 -6.299 -5.378 1.00 0.59 H new ATOM 0 HB3 SER B 32 -11.474 -7.900 -5.291 1.00 0.59 H new ATOM 0 HG SER B 32 -13.179 -8.543 -3.884 1.00 1.13 H new ATOM 2140 N LEU B 33 -11.926 -4.395 -3.198 1.00 0.55 N ATOM 2141 CA LEU B 33 -12.637 -3.248 -2.602 1.00 0.56 C ATOM 2142 C LEU B 33 -13.698 -2.734 -3.582 1.00 0.55 C ATOM 2143 O LEU B 33 -13.476 -2.749 -4.797 1.00 0.72 O ATOM 2144 CB LEU B 33 -11.657 -2.108 -2.250 1.00 0.59 C ATOM 2145 CG LEU B 33 -10.719 -2.370 -1.045 1.00 0.69 C ATOM 2146 CD1 LEU B 33 -9.480 -3.167 -1.463 1.00 0.79 C ATOM 2147 CD2 LEU B 33 -10.315 -1.054 -0.374 1.00 0.75 C ATOM 0 H LEU B 33 -11.359 -4.150 -4.010 1.00 0.55 H new ATOM 0 HA LEU B 33 -13.116 -3.582 -1.682 1.00 0.56 H new ATOM 0 HB2 LEU B 33 -11.042 -1.900 -3.126 1.00 0.59 H new ATOM 0 HB3 LEU B 33 -12.236 -1.207 -2.046 1.00 0.59 H new ATOM 0 HG LEU B 33 -11.271 -2.970 -0.322 1.00 0.69 H new ATOM 0 HD11 LEU B 33 -8.844 -3.333 -0.594 1.00 0.79 H new ATOM 0 HD12 LEU B 33 -9.788 -4.128 -1.876 1.00 0.79 H new ATOM 0 HD13 LEU B 33 -8.925 -2.608 -2.217 1.00 0.79 H new ATOM 0 HD21 LEU B 33 -9.657 -1.263 0.469 1.00 0.75 H new ATOM 0 HD22 LEU B 33 -9.794 -0.423 -1.094 1.00 0.75 H new ATOM 0 HD23 LEU B 33 -11.207 -0.538 -0.019 1.00 0.75 H new ATOM 2159 N SER B 34 -14.853 -2.281 -3.059 1.00 0.52 N ATOM 2160 CA SER B 34 -15.940 -1.753 -3.907 1.00 0.53 C ATOM 2161 C SER B 34 -15.717 -0.258 -4.214 1.00 0.50 C ATOM 2162 O SER B 34 -14.992 0.420 -3.483 1.00 0.52 O ATOM 2163 CB SER B 34 -17.301 -1.965 -3.230 1.00 0.62 C ATOM 2164 OG SER B 34 -18.370 -1.629 -4.105 1.00 0.69 O ATOM 0 H SER B 34 -15.057 -2.270 -2.060 1.00 0.52 H new ATOM 0 HA SER B 34 -15.933 -2.300 -4.850 1.00 0.53 H new ATOM 0 HB2 SER B 34 -17.397 -3.005 -2.918 1.00 0.62 H new ATOM 0 HB3 SER B 34 -17.360 -1.355 -2.329 1.00 0.62 H new ATOM 0 HG SER B 34 -19.212 -1.621 -3.604 1.00 0.69 H new ATOM 2170 N VAL B 35 -16.351 0.247 -5.296 1.00 0.52 N ATOM 2171 CA VAL B 35 -16.212 1.665 -5.704 1.00 0.53 C ATOM 2172 C VAL B 35 -16.921 2.639 -4.721 1.00 0.48 C ATOM 2173 O VAL B 35 -16.424 3.745 -4.484 1.00 0.52 O ATOM 2174 CB VAL B 35 -16.703 1.896 -7.183 1.00 0.64 C ATOM 2175 CG1 VAL B 35 -18.229 1.793 -7.324 1.00 0.67 C ATOM 2176 CG2 VAL B 35 -16.191 3.231 -7.738 1.00 0.71 C ATOM 0 H VAL B 35 -16.961 -0.303 -5.901 1.00 0.52 H new ATOM 0 HA VAL B 35 -15.147 1.892 -5.665 1.00 0.53 H new ATOM 0 HB VAL B 35 -16.276 1.089 -7.779 1.00 0.64 H new ATOM 0 HG11 VAL B 35 -18.510 1.961 -8.364 1.00 0.67 H new ATOM 0 HG12 VAL B 35 -18.557 0.800 -7.015 1.00 0.67 H new ATOM 0 HG13 VAL B 35 -18.704 2.545 -6.694 1.00 0.67 H new ATOM 0 HG21 VAL B 35 -16.547 3.361 -8.760 1.00 0.71 H new ATOM 0 HG22 VAL B 35 -16.561 4.048 -7.119 1.00 0.71 H new ATOM 0 HG23 VAL B 35 -15.101 3.234 -7.730 1.00 0.71 H new ATOM 2186 N ASN B 36 -18.067 2.212 -4.152 1.00 0.47 N ATOM 2187 CA ASN B 36 -18.845 3.042 -3.207 1.00 0.48 C ATOM 2188 C ASN B 36 -18.358 2.868 -1.744 1.00 0.46 C ATOM 2189 O ASN B 36 -18.543 3.773 -0.927 1.00 0.66 O ATOM 2190 CB ASN B 36 -20.352 2.700 -3.323 1.00 0.55 C ATOM 2191 CG ASN B 36 -21.259 3.705 -2.616 1.00 0.64 C ATOM 2192 OD1 ASN B 36 -21.628 4.730 -3.193 1.00 0.83 O ATOM 2193 ND2 ASN B 36 -21.638 3.414 -1.370 1.00 0.79 N ATOM 0 H ASN B 36 -18.476 1.295 -4.331 1.00 0.47 H new ATOM 0 HA ASN B 36 -18.690 4.087 -3.475 1.00 0.48 H new ATOM 0 HB2 ASN B 36 -20.626 2.653 -4.377 1.00 0.55 H new ATOM 0 HB3 ASN B 36 -20.525 1.709 -2.904 1.00 0.55 H new ATOM 0 HD21 ASN B 36 -22.254 4.050 -0.863 1.00 0.79 H new ATOM 0 HD22 ASN B 36 -21.312 2.556 -0.925 1.00 0.79 H new ATOM 2200 N GLU B 37 -17.737 1.712 -1.421 1.00 0.46 N ATOM 2201 CA GLU B 37 -17.249 1.429 -0.053 1.00 0.50 C ATOM 2202 C GLU B 37 -15.904 2.113 0.253 1.00 0.45 C ATOM 2203 O GLU B 37 -15.731 2.649 1.354 1.00 0.46 O ATOM 2204 CB GLU B 37 -17.121 -0.086 0.177 1.00 0.62 C ATOM 2205 CG GLU B 37 -18.452 -0.833 0.134 1.00 0.69 C ATOM 2206 CD GLU B 37 -18.290 -2.340 0.226 1.00 0.88 C ATOM 2207 OE1 GLU B 37 -17.513 -2.805 1.083 1.00 1.61 O ATOM 2208 OE2 GLU B 37 -18.940 -3.055 -0.568 1.00 1.28 O ATOM 0 H GLU B 37 -17.562 0.961 -2.088 1.00 0.46 H new ATOM 0 HA GLU B 37 -17.991 1.843 0.629 1.00 0.50 H new ATOM 0 HB2 GLU B 37 -16.457 -0.504 -0.580 1.00 0.62 H new ATOM 0 HB3 GLU B 37 -16.650 -0.258 1.145 1.00 0.62 H new ATOM 0 HG2 GLU B 37 -19.081 -0.490 0.955 1.00 0.69 H new ATOM 0 HG3 GLU B 37 -18.972 -0.585 -0.791 1.00 0.69 H new ATOM 2215 N PHE B 38 -14.946 2.085 -0.706 1.00 0.43 N ATOM 2216 CA PHE B 38 -13.623 2.725 -0.503 1.00 0.43 C ATOM 2217 C PHE B 38 -13.770 4.260 -0.381 1.00 0.39 C ATOM 2218 O PHE B 38 -12.977 4.907 0.304 1.00 0.42 O ATOM 2219 CB PHE B 38 -12.613 2.313 -1.618 1.00 0.48 C ATOM 2220 CG PHE B 38 -12.418 3.303 -2.763 1.00 0.46 C ATOM 2221 CD1 PHE B 38 -13.220 3.255 -3.899 1.00 0.52 C ATOM 2222 CD2 PHE B 38 -11.426 4.279 -2.697 1.00 0.55 C ATOM 2223 CE1 PHE B 38 -13.039 4.151 -4.934 1.00 0.61 C ATOM 2224 CE2 PHE B 38 -11.244 5.176 -3.733 1.00 0.65 C ATOM 2225 CZ PHE B 38 -12.052 5.112 -4.851 1.00 0.66 C ATOM 0 H PHE B 38 -15.061 1.634 -1.613 1.00 0.43 H new ATOM 0 HA PHE B 38 -13.210 2.363 0.439 1.00 0.43 H new ATOM 0 HB2 PHE B 38 -11.644 2.136 -1.151 1.00 0.48 H new ATOM 0 HB3 PHE B 38 -12.941 1.363 -2.041 1.00 0.48 H new ATOM 0 HD1 PHE B 38 -13.995 2.506 -3.972 1.00 0.52 H new ATOM 0 HD2 PHE B 38 -10.791 4.336 -1.825 1.00 0.55 H new ATOM 0 HE1 PHE B 38 -13.670 4.100 -5.809 1.00 0.61 H new ATOM 0 HE2 PHE B 38 -10.470 5.927 -3.668 1.00 0.65 H new ATOM 0 HZ PHE B 38 -11.912 5.814 -5.660 1.00 0.66 H new ATOM 2235 N LYS B 39 -14.791 4.825 -1.060 1.00 0.37 N ATOM 2236 CA LYS B 39 -15.082 6.270 -1.015 1.00 0.38 C ATOM 2237 C LYS B 39 -15.625 6.678 0.374 1.00 0.36 C ATOM 2238 O LYS B 39 -15.282 7.751 0.882 1.00 0.39 O ATOM 2239 CB LYS B 39 -16.103 6.641 -2.112 1.00 0.43 C ATOM 2240 CG LYS B 39 -16.150 8.130 -2.454 1.00 0.50 C ATOM 2241 CD LYS B 39 -17.313 8.468 -3.389 1.00 0.60 C ATOM 2242 CE LYS B 39 -17.288 9.932 -3.832 1.00 0.70 C ATOM 2243 NZ LYS B 39 -16.245 10.190 -4.874 1.00 0.81 N ATOM 0 H LYS B 39 -15.432 4.295 -1.650 1.00 0.37 H new ATOM 0 HA LYS B 39 -14.153 6.812 -1.194 1.00 0.38 H new ATOM 0 HB2 LYS B 39 -15.866 6.080 -3.016 1.00 0.43 H new ATOM 0 HB3 LYS B 39 -17.095 6.323 -1.791 1.00 0.43 H new ATOM 0 HG2 LYS B 39 -16.243 8.710 -1.536 1.00 0.50 H new ATOM 0 HG3 LYS B 39 -15.211 8.424 -2.923 1.00 0.50 H new ATOM 0 HD2 LYS B 39 -17.271 7.823 -4.267 1.00 0.60 H new ATOM 0 HD3 LYS B 39 -18.256 8.258 -2.884 1.00 0.60 H new ATOM 0 HE2 LYS B 39 -18.267 10.208 -4.224 1.00 0.70 H new ATOM 0 HE3 LYS B 39 -17.100 10.568 -2.967 1.00 0.70 H new ATOM 0 HZ1 LYS B 39 -16.265 11.194 -5.144 1.00 0.81 H new ATOM 0 HZ2 LYS B 39 -15.307 9.952 -4.493 1.00 0.81 H new ATOM 0 HZ3 LYS B 39 -16.438 9.603 -5.711 1.00 0.81 H new ATOM 2257 N GLU B 40 -16.478 5.813 0.973 1.00 0.35 N ATOM 2258 CA GLU B 40 -17.066 6.064 2.308 1.00 0.38 C ATOM 2259 C GLU B 40 -16.003 5.960 3.419 1.00 0.38 C ATOM 2260 O GLU B 40 -16.060 6.708 4.400 1.00 0.41 O ATOM 2261 CB GLU B 40 -18.229 5.087 2.588 1.00 0.43 C ATOM 2262 CG GLU B 40 -19.491 5.384 1.780 1.00 0.47 C ATOM 2263 CD GLU B 40 -20.602 4.369 2.019 1.00 0.56 C ATOM 2264 OE1 GLU B 40 -20.513 3.247 1.475 1.00 0.63 O ATOM 2265 OE2 GLU B 40 -21.558 4.699 2.754 1.00 0.69 O ATOM 0 H GLU B 40 -16.774 4.933 0.550 1.00 0.35 H new ATOM 0 HA GLU B 40 -17.457 7.082 2.308 1.00 0.38 H new ATOM 0 HB2 GLU B 40 -17.899 4.072 2.369 1.00 0.43 H new ATOM 0 HB3 GLU B 40 -18.472 5.121 3.650 1.00 0.43 H new ATOM 0 HG2 GLU B 40 -19.854 6.379 2.036 1.00 0.47 H new ATOM 0 HG3 GLU B 40 -19.242 5.399 0.719 1.00 0.47 H new ATOM 2272 N LEU B 41 -15.033 5.032 3.258 1.00 0.37 N ATOM 2273 CA LEU B 41 -13.935 4.846 4.235 1.00 0.40 C ATOM 2274 C LEU B 41 -13.059 6.117 4.343 1.00 0.38 C ATOM 2275 O LEU B 41 -12.569 6.443 5.427 1.00 0.40 O ATOM 2276 CB LEU B 41 -13.061 3.632 3.839 1.00 0.44 C ATOM 2277 CG LEU B 41 -12.158 3.051 4.954 1.00 0.55 C ATOM 2278 CD1 LEU B 41 -12.988 2.303 6.006 1.00 0.68 C ATOM 2279 CD2 LEU B 41 -11.067 2.151 4.355 1.00 0.64 C ATOM 0 H LEU B 41 -14.988 4.399 2.459 1.00 0.37 H new ATOM 0 HA LEU B 41 -14.384 4.659 5.210 1.00 0.40 H new ATOM 0 HB2 LEU B 41 -13.717 2.839 3.481 1.00 0.44 H new ATOM 0 HB3 LEU B 41 -12.427 3.924 3.001 1.00 0.44 H new ATOM 0 HG LEU B 41 -11.665 3.882 5.459 1.00 0.55 H new ATOM 0 HD11 LEU B 41 -12.327 1.906 6.776 1.00 0.68 H new ATOM 0 HD12 LEU B 41 -13.703 2.989 6.460 1.00 0.68 H new ATOM 0 HD13 LEU B 41 -13.524 1.482 5.530 1.00 0.68 H new ATOM 0 HD21 LEU B 41 -10.444 1.753 5.156 1.00 0.64 H new ATOM 0 HD22 LEU B 41 -11.532 1.327 3.813 1.00 0.64 H new ATOM 0 HD23 LEU B 41 -10.450 2.733 3.670 1.00 0.64 H new ATOM 2291 N VAL B 42 -12.871 6.817 3.201 1.00 0.37 N ATOM 2292 CA VAL B 42 -12.074 8.062 3.140 1.00 0.38 C ATOM 2293 C VAL B 42 -12.841 9.257 3.770 1.00 0.39 C ATOM 2294 O VAL B 42 -12.212 10.200 4.256 1.00 0.43 O ATOM 2295 CB VAL B 42 -11.667 8.392 1.656 1.00 0.43 C ATOM 2296 CG1 VAL B 42 -10.956 9.749 1.530 1.00 0.48 C ATOM 2297 CG2 VAL B 42 -10.789 7.275 1.074 1.00 0.47 C ATOM 0 H VAL B 42 -13.264 6.537 2.303 1.00 0.37 H new ATOM 0 HA VAL B 42 -11.167 7.901 3.722 1.00 0.38 H new ATOM 0 HB VAL B 42 -12.591 8.457 1.082 1.00 0.43 H new ATOM 0 HG11 VAL B 42 -10.697 9.928 0.487 1.00 0.48 H new ATOM 0 HG12 VAL B 42 -11.618 10.541 1.881 1.00 0.48 H new ATOM 0 HG13 VAL B 42 -10.048 9.742 2.133 1.00 0.48 H new ATOM 0 HG21 VAL B 42 -10.519 7.522 0.047 1.00 0.47 H new ATOM 0 HG22 VAL B 42 -9.884 7.174 1.673 1.00 0.47 H new ATOM 0 HG23 VAL B 42 -11.340 6.335 1.087 1.00 0.47 H new ATOM 2307 N THR B 43 -14.191 9.204 3.766 1.00 0.38 N ATOM 2308 CA THR B 43 -15.034 10.283 4.321 1.00 0.42 C ATOM 2309 C THR B 43 -15.730 9.845 5.640 1.00 0.48 C ATOM 2310 O THR B 43 -16.872 10.237 5.909 1.00 0.83 O ATOM 2311 CB THR B 43 -16.095 10.736 3.261 1.00 0.44 C ATOM 2312 OG1 THR B 43 -15.530 10.685 1.936 1.00 0.46 O ATOM 2313 CG2 THR B 43 -16.611 12.155 3.529 1.00 0.49 C ATOM 0 H THR B 43 -14.721 8.421 3.383 1.00 0.38 H new ATOM 0 HA THR B 43 -14.387 11.127 4.559 1.00 0.42 H new ATOM 0 HB THR B 43 -16.936 10.047 3.339 1.00 0.44 H new ATOM 0 HG1 THR B 43 -15.482 9.753 1.636 1.00 0.46 H new ATOM 0 HG21 THR B 43 -17.344 12.425 2.769 1.00 0.49 H new ATOM 0 HG22 THR B 43 -17.078 12.192 4.513 1.00 0.49 H new ATOM 0 HG23 THR B 43 -15.778 12.857 3.496 1.00 0.49 H new ATOM 2321 N GLN B 44 -15.026 9.041 6.474 1.00 0.42 N ATOM 2322 CA GLN B 44 -15.580 8.561 7.760 1.00 0.44 C ATOM 2323 C GLN B 44 -14.470 8.110 8.733 1.00 0.44 C ATOM 2324 O GLN B 44 -14.419 8.588 9.871 1.00 0.50 O ATOM 2325 CB GLN B 44 -16.595 7.414 7.521 1.00 0.47 C ATOM 2326 CG GLN B 44 -17.476 7.074 8.727 1.00 0.58 C ATOM 2327 CD GLN B 44 -18.599 6.099 8.380 1.00 0.67 C ATOM 2328 OE1 GLN B 44 -19.678 6.514 7.958 1.00 0.91 O ATOM 2329 NE2 GLN B 44 -18.361 4.796 8.557 1.00 0.98 N ATOM 0 H GLN B 44 -14.080 8.714 6.279 1.00 0.42 H new ATOM 0 HA GLN B 44 -16.099 9.399 8.225 1.00 0.44 H new ATOM 0 HB2 GLN B 44 -17.238 7.686 6.684 1.00 0.47 H new ATOM 0 HB3 GLN B 44 -16.048 6.519 7.225 1.00 0.47 H new ATOM 0 HG2 GLN B 44 -16.857 6.644 9.514 1.00 0.58 H new ATOM 0 HG3 GLN B 44 -17.908 7.992 9.127 1.00 0.58 H new ATOM 0 HE21 GLN B 44 -17.455 4.486 8.909 1.00 0.98 H new ATOM 0 HE22 GLN B 44 -19.085 4.111 8.340 1.00 0.98 H new ATOM 2338 N GLN B 45 -13.588 7.190 8.280 1.00 0.42 N ATOM 2339 CA GLN B 45 -12.492 6.660 9.123 1.00 0.43 C ATOM 2340 C GLN B 45 -11.076 7.048 8.605 1.00 0.41 C ATOM 2341 O GLN B 45 -10.083 6.723 9.262 1.00 0.46 O ATOM 2342 CB GLN B 45 -12.632 5.122 9.237 1.00 0.47 C ATOM 2343 CG GLN B 45 -11.905 4.505 10.437 1.00 0.57 C ATOM 2344 CD GLN B 45 -12.257 3.037 10.679 1.00 0.62 C ATOM 2345 OE1 GLN B 45 -12.534 2.286 9.739 1.00 0.70 O ATOM 2346 NE2 GLN B 45 -12.253 2.614 11.947 1.00 0.73 N ATOM 0 H GLN B 45 -13.614 6.800 7.338 1.00 0.42 H new ATOM 0 HA GLN B 45 -12.586 7.119 10.107 1.00 0.43 H new ATOM 0 HB2 GLN B 45 -13.691 4.870 9.301 1.00 0.47 H new ATOM 0 HB3 GLN B 45 -12.250 4.666 8.323 1.00 0.47 H new ATOM 0 HG2 GLN B 45 -10.829 4.591 10.283 1.00 0.57 H new ATOM 0 HG3 GLN B 45 -12.146 5.080 11.331 1.00 0.57 H new ATOM 0 HE21 GLN B 45 -12.019 3.261 12.700 1.00 0.73 H new ATOM 0 HE22 GLN B 45 -12.484 1.644 12.162 1.00 0.73 H new ATOM 2355 N LEU B 46 -10.979 7.746 7.449 1.00 0.39 N ATOM 2356 CA LEU B 46 -9.675 8.155 6.881 1.00 0.38 C ATOM 2357 C LEU B 46 -9.755 9.555 6.191 1.00 0.38 C ATOM 2358 O LEU B 46 -9.309 9.699 5.047 1.00 0.41 O ATOM 2359 CB LEU B 46 -9.219 7.068 5.872 1.00 0.40 C ATOM 2360 CG LEU B 46 -7.706 7.029 5.531 1.00 0.41 C ATOM 2361 CD1 LEU B 46 -6.976 5.989 6.386 1.00 0.58 C ATOM 2362 CD2 LEU B 46 -7.491 6.746 4.039 1.00 0.62 C ATOM 0 H LEU B 46 -11.785 8.036 6.895 1.00 0.39 H new ATOM 0 HA LEU B 46 -8.948 8.247 7.688 1.00 0.38 H new ATOM 0 HB2 LEU B 46 -9.504 6.094 6.269 1.00 0.40 H new ATOM 0 HB3 LEU B 46 -9.774 7.210 4.945 1.00 0.40 H new ATOM 0 HG LEU B 46 -7.287 8.009 5.759 1.00 0.41 H new ATOM 0 HD11 LEU B 46 -5.917 5.983 6.126 1.00 0.58 H new ATOM 0 HD12 LEU B 46 -7.090 6.240 7.441 1.00 0.58 H new ATOM 0 HD13 LEU B 46 -7.401 5.002 6.201 1.00 0.58 H new ATOM 0 HD21 LEU B 46 -6.423 6.723 3.823 1.00 0.62 H new ATOM 0 HD22 LEU B 46 -7.933 5.783 3.784 1.00 0.62 H new ATOM 0 HD23 LEU B 46 -7.964 7.530 3.448 1.00 0.62 H new ATOM 2374 N PRO B 47 -10.304 10.623 6.869 1.00 0.40 N ATOM 2375 CA PRO B 47 -10.433 11.963 6.260 1.00 0.42 C ATOM 2376 C PRO B 47 -9.206 12.900 6.429 1.00 0.42 C ATOM 2377 O PRO B 47 -8.861 13.620 5.486 1.00 0.46 O ATOM 2378 CB PRO B 47 -11.664 12.523 6.981 1.00 0.48 C ATOM 2379 CG PRO B 47 -11.604 11.941 8.357 1.00 0.48 C ATOM 2380 CD PRO B 47 -10.872 10.620 8.250 1.00 0.44 C ATOM 0 HA PRO B 47 -10.514 11.895 5.175 1.00 0.42 H new ATOM 0 HB2 PRO B 47 -11.642 13.612 7.012 1.00 0.48 H new ATOM 0 HB3 PRO B 47 -12.584 12.237 6.471 1.00 0.48 H new ATOM 0 HG2 PRO B 47 -11.085 12.615 9.038 1.00 0.48 H new ATOM 0 HG3 PRO B 47 -12.607 11.794 8.757 1.00 0.48 H new ATOM 0 HD2 PRO B 47 -10.088 10.538 9.002 1.00 0.44 H new ATOM 0 HD3 PRO B 47 -11.547 9.778 8.400 1.00 0.44 H new ATOM 2388 N HIS B 48 -8.554 12.894 7.613 1.00 0.42 N ATOM 2389 CA HIS B 48 -7.391 13.777 7.888 1.00 0.44 C ATOM 2390 C HIS B 48 -6.133 13.373 7.095 1.00 0.43 C ATOM 2391 O HIS B 48 -5.332 14.241 6.731 1.00 0.49 O ATOM 2392 CB HIS B 48 -7.063 13.811 9.397 1.00 0.49 C ATOM 2393 CG HIS B 48 -8.194 14.311 10.255 1.00 0.56 C ATOM 2394 ND1 HIS B 48 -9.122 13.473 10.839 1.00 0.67 N ATOM 2395 CD2 HIS B 48 -8.541 15.568 10.623 1.00 0.70 C ATOM 2396 CE1 HIS B 48 -9.992 14.194 11.525 1.00 0.79 C ATOM 2397 NE2 HIS B 48 -9.663 15.467 11.410 1.00 0.81 N ATOM 0 H HIS B 48 -8.810 12.290 8.394 1.00 0.42 H new ATOM 0 HA HIS B 48 -7.685 14.773 7.557 1.00 0.44 H new ATOM 0 HB2 HIS B 48 -6.789 12.807 9.722 1.00 0.49 H new ATOM 0 HB3 HIS B 48 -6.191 14.446 9.555 1.00 0.49 H new ATOM 0 HD2 HIS B 48 -8.031 16.480 10.349 1.00 0.70 H new ATOM 0 HE1 HIS B 48 -10.830 13.807 12.085 1.00 0.79 H new ATOM 0 HE2 HIS B 48 -10.161 16.249 11.836 1.00 0.81 H new ATOM 2406 N LEU B 49 -5.962 12.062 6.830 1.00 0.41 N ATOM 2407 CA LEU B 49 -4.795 11.550 6.081 1.00 0.42 C ATOM 2408 C LEU B 49 -4.766 12.090 4.636 1.00 0.40 C ATOM 2409 O LEU B 49 -3.790 12.737 4.236 1.00 0.48 O ATOM 2410 CB LEU B 49 -4.786 10.001 6.093 1.00 0.43 C ATOM 2411 CG LEU B 49 -3.675 9.303 5.270 1.00 0.52 C ATOM 2412 CD1 LEU B 49 -2.287 9.736 5.733 1.00 0.88 C ATOM 2413 CD2 LEU B 49 -3.821 7.783 5.351 1.00 0.62 C ATOM 0 H LEU B 49 -6.617 11.338 7.124 1.00 0.41 H new ATOM 0 HA LEU B 49 -3.894 11.908 6.578 1.00 0.42 H new ATOM 0 HB2 LEU B 49 -4.701 9.670 7.128 1.00 0.43 H new ATOM 0 HB3 LEU B 49 -5.751 9.653 5.725 1.00 0.43 H new ATOM 0 HG LEU B 49 -3.788 9.607 4.229 1.00 0.52 H new ATOM 0 HD11 LEU B 49 -1.529 9.228 5.136 1.00 0.88 H new ATOM 0 HD12 LEU B 49 -2.183 10.814 5.611 1.00 0.88 H new ATOM 0 HD13 LEU B 49 -2.156 9.475 6.783 1.00 0.88 H new ATOM 0 HD21 LEU B 49 -3.032 7.310 4.767 1.00 0.62 H new ATOM 0 HD22 LEU B 49 -3.743 7.465 6.391 1.00 0.62 H new ATOM 0 HD23 LEU B 49 -4.792 7.489 4.953 1.00 0.62 H new ATOM 2425 N LEU B 50 -5.833 11.814 3.864 1.00 0.38 N ATOM 2426 CA LEU B 50 -5.935 12.284 2.473 1.00 0.41 C ATOM 2427 C LEU B 50 -6.535 13.698 2.457 1.00 0.45 C ATOM 2428 O LEU B 50 -7.679 13.890 2.878 1.00 0.52 O ATOM 2429 CB LEU B 50 -6.788 11.313 1.625 1.00 0.44 C ATOM 2430 CG LEU B 50 -6.312 9.839 1.606 1.00 0.51 C ATOM 2431 CD1 LEU B 50 -7.314 8.947 0.871 1.00 0.57 C ATOM 2432 CD2 LEU B 50 -4.922 9.703 0.979 1.00 0.70 C ATOM 0 H LEU B 50 -6.635 11.269 4.181 1.00 0.38 H new ATOM 0 HA LEU B 50 -4.939 12.315 2.032 1.00 0.41 H new ATOM 0 HB2 LEU B 50 -7.812 11.340 1.997 1.00 0.44 H new ATOM 0 HB3 LEU B 50 -6.811 11.681 0.599 1.00 0.44 H new ATOM 0 HG LEU B 50 -6.248 9.509 2.643 1.00 0.51 H new ATOM 0 HD11 LEU B 50 -6.955 7.918 0.873 1.00 0.57 H new ATOM 0 HD12 LEU B 50 -8.280 8.995 1.373 1.00 0.57 H new ATOM 0 HD13 LEU B 50 -7.422 9.292 -0.157 1.00 0.57 H new ATOM 0 HD21 LEU B 50 -4.622 8.655 0.983 1.00 0.70 H new ATOM 0 HD22 LEU B 50 -4.949 10.069 -0.047 1.00 0.70 H new ATOM 0 HD23 LEU B 50 -4.205 10.288 1.554 1.00 0.70 H new ATOM 2444 N LYS B 51 -5.745 14.683 1.977 1.00 0.50 N ATOM 2445 CA LYS B 51 -6.163 16.108 1.922 1.00 0.58 C ATOM 2446 C LYS B 51 -7.543 16.328 1.256 1.00 0.53 C ATOM 2447 O LYS B 51 -8.326 17.154 1.739 1.00 0.61 O ATOM 2448 CB LYS B 51 -5.079 16.967 1.222 1.00 0.68 C ATOM 2449 CG LYS B 51 -4.760 16.575 -0.234 1.00 0.72 C ATOM 2450 CD LYS B 51 -3.254 16.460 -0.497 1.00 1.06 C ATOM 2451 CE LYS B 51 -2.940 16.178 -1.967 1.00 1.03 C ATOM 2452 NZ LYS B 51 -3.158 17.373 -2.838 1.00 1.23 N ATOM 0 H LYS B 51 -4.805 14.518 1.618 1.00 0.50 H new ATOM 0 HA LYS B 51 -6.272 16.430 2.958 1.00 0.58 H new ATOM 0 HB2 LYS B 51 -5.400 18.009 1.238 1.00 0.68 H new ATOM 0 HB3 LYS B 51 -4.160 16.908 1.806 1.00 0.68 H new ATOM 0 HG2 LYS B 51 -5.239 15.623 -0.463 1.00 0.72 H new ATOM 0 HG3 LYS B 51 -5.187 17.317 -0.908 1.00 0.72 H new ATOM 0 HD2 LYS B 51 -2.763 17.385 -0.194 1.00 1.06 H new ATOM 0 HD3 LYS B 51 -2.840 15.663 0.120 1.00 1.06 H new ATOM 0 HE2 LYS B 51 -1.904 15.850 -2.058 1.00 1.03 H new ATOM 0 HE3 LYS B 51 -3.566 15.357 -2.318 1.00 1.03 H new ATOM 0 HZ1 LYS B 51 -2.932 17.130 -3.824 1.00 1.23 H new ATOM 0 HZ2 LYS B 51 -4.152 17.672 -2.775 1.00 1.23 H new ATOM 0 HZ3 LYS B 51 -2.542 18.149 -2.523 1.00 1.23 H new ATOM 2466 N ASP B 52 -7.838 15.596 0.163 1.00 0.48 N ATOM 2467 CA ASP B 52 -9.120 15.728 -0.549 1.00 0.54 C ATOM 2468 C ASP B 52 -9.976 14.467 -0.345 1.00 0.48 C ATOM 2469 O ASP B 52 -9.565 13.367 -0.729 1.00 0.60 O ATOM 2470 CB ASP B 52 -8.878 15.993 -2.054 1.00 0.69 C ATOM 2471 CG ASP B 52 -9.887 16.956 -2.656 1.00 1.20 C ATOM 2472 OD1 ASP B 52 -11.098 16.649 -2.618 1.00 1.94 O ATOM 2473 OD2 ASP B 52 -9.466 18.018 -3.160 1.00 1.78 O ATOM 0 H ASP B 52 -7.204 14.908 -0.244 1.00 0.48 H new ATOM 0 HA ASP B 52 -9.662 16.579 -0.138 1.00 0.54 H new ATOM 0 HB2 ASP B 52 -7.874 16.395 -2.190 1.00 0.69 H new ATOM 0 HB3 ASP B 52 -8.918 15.048 -2.595 1.00 0.69 H new ATOM 2478 N VAL B 53 -11.167 14.639 0.265 1.00 0.44 N ATOM 2479 CA VAL B 53 -12.094 13.521 0.544 1.00 0.45 C ATOM 2480 C VAL B 53 -13.292 13.498 -0.428 1.00 0.46 C ATOM 2481 O VAL B 53 -13.815 12.423 -0.736 1.00 0.57 O ATOM 2482 CB VAL B 53 -12.595 13.534 2.025 1.00 0.53 C ATOM 2483 CG1 VAL B 53 -11.430 13.322 2.994 1.00 0.60 C ATOM 2484 CG2 VAL B 53 -13.363 14.819 2.383 1.00 0.58 C ATOM 0 H VAL B 53 -11.511 15.547 0.576 1.00 0.44 H new ATOM 0 HA VAL B 53 -11.521 12.607 0.387 1.00 0.45 H new ATOM 0 HB VAL B 53 -13.297 12.706 2.123 1.00 0.53 H new ATOM 0 HG11 VAL B 53 -11.802 13.335 4.018 1.00 0.60 H new ATOM 0 HG12 VAL B 53 -10.958 12.360 2.791 1.00 0.60 H new ATOM 0 HG13 VAL B 53 -10.699 14.120 2.864 1.00 0.60 H new ATOM 0 HG21 VAL B 53 -13.686 14.772 3.423 1.00 0.58 H new ATOM 0 HG22 VAL B 53 -12.712 15.682 2.244 1.00 0.58 H new ATOM 0 HG23 VAL B 53 -14.235 14.914 1.736 1.00 0.58 H new ATOM 2494 N GLY B 54 -13.726 14.686 -0.896 1.00 0.44 N ATOM 2495 CA GLY B 54 -14.841 14.777 -1.833 1.00 0.51 C ATOM 2496 C GLY B 54 -14.438 14.485 -3.279 1.00 0.51 C ATOM 2497 O GLY B 54 -15.164 13.783 -3.988 1.00 0.67 O ATOM 0 H GLY B 54 -13.318 15.584 -0.637 1.00 0.44 H new ATOM 0 HA2 GLY B 54 -15.619 14.076 -1.531 1.00 0.51 H new ATOM 0 HA3 GLY B 54 -15.273 15.776 -1.778 1.00 0.51 H new ATOM 2501 N SER B 55 -13.268 15.016 -3.710 1.00 0.51 N ATOM 2502 CA SER B 55 -12.767 14.817 -5.085 1.00 0.57 C ATOM 2503 C SER B 55 -11.799 13.617 -5.166 1.00 0.52 C ATOM 2504 O SER B 55 -10.579 13.778 -5.020 1.00 0.63 O ATOM 2505 CB SER B 55 -12.081 16.101 -5.597 1.00 0.74 C ATOM 2506 OG SER B 55 -11.726 15.991 -6.968 1.00 0.92 O ATOM 0 H SER B 55 -12.657 15.584 -3.123 1.00 0.51 H new ATOM 0 HA SER B 55 -13.622 14.596 -5.724 1.00 0.57 H new ATOM 0 HB2 SER B 55 -12.750 16.951 -5.460 1.00 0.74 H new ATOM 0 HB3 SER B 55 -11.188 16.299 -5.004 1.00 0.74 H new ATOM 0 HG SER B 55 -12.264 15.289 -7.390 1.00 0.92 H new ATOM 2512 N LEU B 56 -12.359 12.410 -5.386 1.00 0.47 N ATOM 2513 CA LEU B 56 -11.567 11.169 -5.524 1.00 0.47 C ATOM 2514 C LEU B 56 -11.649 10.627 -6.973 1.00 0.48 C ATOM 2515 O LEU B 56 -11.595 9.415 -7.191 1.00 0.81 O ATOM 2516 CB LEU B 56 -12.041 10.103 -4.486 1.00 0.58 C ATOM 2517 CG LEU B 56 -11.175 9.932 -3.205 1.00 0.75 C ATOM 2518 CD1 LEU B 56 -9.797 9.335 -3.527 1.00 1.09 C ATOM 2519 CD2 LEU B 56 -11.024 11.252 -2.444 1.00 1.24 C ATOM 0 H LEU B 56 -13.365 12.267 -5.473 1.00 0.47 H new ATOM 0 HA LEU B 56 -10.521 11.396 -5.316 1.00 0.47 H new ATOM 0 HB2 LEU B 56 -13.055 10.357 -4.178 1.00 0.58 H new ATOM 0 HB3 LEU B 56 -12.094 9.138 -4.991 1.00 0.58 H new ATOM 0 HG LEU B 56 -11.703 9.230 -2.560 1.00 0.75 H new ATOM 0 HD11 LEU B 56 -9.222 9.231 -2.607 1.00 1.09 H new ATOM 0 HD12 LEU B 56 -9.924 8.356 -3.989 1.00 1.09 H new ATOM 0 HD13 LEU B 56 -9.266 9.994 -4.214 1.00 1.09 H new ATOM 0 HD21 LEU B 56 -10.413 11.092 -1.556 1.00 1.24 H new ATOM 0 HD22 LEU B 56 -10.544 11.990 -3.087 1.00 1.24 H new ATOM 0 HD23 LEU B 56 -12.008 11.615 -2.147 1.00 1.24 H new ATOM 2531 N ASP B 57 -11.756 11.540 -7.968 1.00 0.48 N ATOM 2532 CA ASP B 57 -11.835 11.147 -9.394 1.00 0.49 C ATOM 2533 C ASP B 57 -10.432 10.904 -9.986 1.00 0.44 C ATOM 2534 O ASP B 57 -10.253 9.985 -10.789 1.00 0.46 O ATOM 2535 CB ASP B 57 -12.619 12.186 -10.233 1.00 0.60 C ATOM 2536 CG ASP B 57 -12.053 13.601 -10.166 1.00 0.64 C ATOM 2537 OD1 ASP B 57 -11.133 13.913 -10.955 1.00 0.69 O ATOM 2538 OD2 ASP B 57 -12.533 14.395 -9.329 1.00 0.73 O ATOM 0 H ASP B 57 -11.789 12.547 -7.810 1.00 0.48 H new ATOM 0 HA ASP B 57 -12.386 10.208 -9.439 1.00 0.49 H new ATOM 0 HB2 ASP B 57 -12.632 11.861 -11.273 1.00 0.60 H new ATOM 0 HB3 ASP B 57 -13.654 12.205 -9.892 1.00 0.60 H new ATOM 2543 N GLU B 58 -9.438 11.732 -9.579 1.00 0.45 N ATOM 2544 CA GLU B 58 -8.045 11.596 -10.056 1.00 0.50 C ATOM 2545 C GLU B 58 -7.416 10.267 -9.579 1.00 0.47 C ATOM 2546 O GLU B 58 -6.592 9.684 -10.287 1.00 0.57 O ATOM 2547 CB GLU B 58 -7.182 12.790 -9.572 1.00 0.59 C ATOM 2548 CG GLU B 58 -5.842 12.938 -10.302 1.00 0.73 C ATOM 2549 CD GLU B 58 -4.977 14.057 -9.737 1.00 0.92 C ATOM 2550 OE1 GLU B 58 -5.198 15.229 -10.111 1.00 1.10 O ATOM 2551 OE2 GLU B 58 -4.075 13.760 -8.924 1.00 1.06 O ATOM 0 H GLU B 58 -9.578 12.499 -8.922 1.00 0.45 H new ATOM 0 HA GLU B 58 -8.070 11.593 -11.146 1.00 0.50 H new ATOM 0 HB2 GLU B 58 -7.753 13.710 -9.696 1.00 0.59 H new ATOM 0 HB3 GLU B 58 -6.990 12.675 -8.505 1.00 0.59 H new ATOM 0 HG2 GLU B 58 -5.295 11.997 -10.240 1.00 0.73 H new ATOM 0 HG3 GLU B 58 -6.029 13.129 -11.359 1.00 0.73 H new ATOM 2558 N LYS B 59 -7.810 9.805 -8.371 1.00 0.43 N ATOM 2559 CA LYS B 59 -7.307 8.544 -7.793 1.00 0.48 C ATOM 2560 C LYS B 59 -8.100 7.322 -8.309 1.00 0.54 C ATOM 2561 O LYS B 59 -7.494 6.311 -8.661 1.00 0.91 O ATOM 2562 CB LYS B 59 -7.360 8.595 -6.246 1.00 0.52 C ATOM 2563 CG LYS B 59 -6.228 9.397 -5.584 1.00 0.59 C ATOM 2564 CD LYS B 59 -6.448 10.912 -5.642 1.00 0.79 C ATOM 2565 CE LYS B 59 -5.339 11.678 -4.915 1.00 1.19 C ATOM 2566 NZ LYS B 59 -5.670 13.124 -4.729 1.00 1.47 N ATOM 0 H LYS B 59 -8.480 10.293 -7.776 1.00 0.43 H new ATOM 0 HA LYS B 59 -6.271 8.431 -8.112 1.00 0.48 H new ATOM 0 HB2 LYS B 59 -8.315 9.025 -5.944 1.00 0.52 H new ATOM 0 HB3 LYS B 59 -7.335 7.575 -5.863 1.00 0.52 H new ATOM 0 HG2 LYS B 59 -6.135 9.090 -4.542 1.00 0.59 H new ATOM 0 HG3 LYS B 59 -5.285 9.154 -6.074 1.00 0.59 H new ATOM 0 HD2 LYS B 59 -6.489 11.233 -6.683 1.00 0.79 H new ATOM 0 HD3 LYS B 59 -7.411 11.156 -5.195 1.00 0.79 H new ATOM 0 HE2 LYS B 59 -5.164 11.220 -3.941 1.00 1.19 H new ATOM 0 HE3 LYS B 59 -4.411 11.591 -5.480 1.00 1.19 H new ATOM 0 HZ1 LYS B 59 -4.889 13.598 -4.233 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -5.811 13.570 -5.658 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -6.541 13.211 -4.167 1.00 1.47 H new ATOM 2580 N MET B 60 -9.451 7.427 -8.370 1.00 0.40 N ATOM 2581 CA MET B 60 -10.331 6.314 -8.826 1.00 0.43 C ATOM 2582 C MET B 60 -9.959 5.802 -10.237 1.00 0.45 C ATOM 2583 O MET B 60 -9.897 4.588 -10.452 1.00 0.49 O ATOM 2584 CB MET B 60 -11.813 6.745 -8.785 1.00 0.47 C ATOM 2585 CG MET B 60 -12.819 5.614 -9.013 1.00 0.55 C ATOM 2586 SD MET B 60 -14.527 6.198 -9.062 1.00 0.67 S ATOM 2587 CE MET B 60 -14.611 6.867 -10.723 1.00 0.81 C ATOM 0 H MET B 60 -9.959 8.272 -8.109 1.00 0.40 H new ATOM 0 HA MET B 60 -10.177 5.485 -8.135 1.00 0.43 H new ATOM 0 HB2 MET B 60 -12.017 7.203 -7.817 1.00 0.47 H new ATOM 0 HB3 MET B 60 -11.974 7.513 -9.541 1.00 0.47 H new ATOM 0 HG2 MET B 60 -12.585 5.109 -9.950 1.00 0.55 H new ATOM 0 HG3 MET B 60 -12.715 4.875 -8.218 1.00 0.55 H new ATOM 0 HE1 MET B 60 -15.091 7.845 -10.697 1.00 0.81 H new ATOM 0 HE2 MET B 60 -13.603 6.968 -11.126 1.00 0.81 H new ATOM 0 HE3 MET B 60 -15.190 6.195 -11.357 1.00 0.81 H new ATOM 2597 N LYS B 61 -9.729 6.732 -11.192 1.00 0.47 N ATOM 2598 CA LYS B 61 -9.344 6.371 -12.581 1.00 0.53 C ATOM 2599 C LYS B 61 -7.954 5.707 -12.619 1.00 0.48 C ATOM 2600 O LYS B 61 -7.707 4.832 -13.454 1.00 0.52 O ATOM 2601 CB LYS B 61 -9.361 7.614 -13.502 1.00 0.63 C ATOM 2602 CG LYS B 61 -10.763 8.084 -13.923 1.00 0.78 C ATOM 2603 CD LYS B 61 -11.462 7.117 -14.899 1.00 1.13 C ATOM 2604 CE LYS B 61 -10.807 7.066 -16.282 1.00 1.87 C ATOM 2605 NZ LYS B 61 -10.760 8.405 -16.945 1.00 2.39 N ATOM 0 H LYS B 61 -9.802 7.736 -11.029 1.00 0.47 H new ATOM 0 HA LYS B 61 -10.079 5.655 -12.947 1.00 0.53 H new ATOM 0 HB2 LYS B 61 -8.856 8.434 -12.992 1.00 0.63 H new ATOM 0 HB3 LYS B 61 -8.783 7.392 -14.399 1.00 0.63 H new ATOM 0 HG2 LYS B 61 -11.382 8.202 -13.033 1.00 0.78 H new ATOM 0 HG3 LYS B 61 -10.685 9.066 -14.389 1.00 0.78 H new ATOM 0 HD2 LYS B 61 -11.462 6.116 -14.468 1.00 1.13 H new ATOM 0 HD3 LYS B 61 -12.504 7.416 -15.010 1.00 1.13 H new ATOM 0 HE2 LYS B 61 -9.794 6.676 -16.186 1.00 1.87 H new ATOM 0 HE3 LYS B 61 -11.357 6.370 -16.915 1.00 1.87 H new ATOM 0 HZ1 LYS B 61 -10.499 8.288 -17.945 1.00 2.39 H new ATOM 0 HZ2 LYS B 61 -11.695 8.857 -16.881 1.00 2.39 H new ATOM 0 HZ3 LYS B 61 -10.053 9.003 -16.471 1.00 2.39 H new ATOM 2619 N SER B 62 -7.056 6.136 -11.711 1.00 0.46 N ATOM 2620 CA SER B 62 -5.700 5.572 -11.603 1.00 0.47 C ATOM 2621 C SER B 62 -5.734 4.177 -10.937 1.00 0.44 C ATOM 2622 O SER B 62 -4.883 3.332 -11.229 1.00 0.50 O ATOM 2623 CB SER B 62 -4.796 6.519 -10.794 1.00 0.54 C ATOM 2624 OG SER B 62 -4.661 7.777 -11.438 1.00 0.63 O ATOM 0 H SER B 62 -7.250 6.877 -11.038 1.00 0.46 H new ATOM 0 HA SER B 62 -5.295 5.462 -12.609 1.00 0.47 H new ATOM 0 HB2 SER B 62 -5.214 6.661 -9.797 1.00 0.54 H new ATOM 0 HB3 SER B 62 -3.813 6.066 -10.666 1.00 0.54 H new ATOM 0 HG SER B 62 -5.304 8.410 -11.057 1.00 0.63 H new ATOM 2630 N LEU B 63 -6.728 3.947 -10.047 1.00 0.41 N ATOM 2631 CA LEU B 63 -6.889 2.663 -9.342 1.00 0.44 C ATOM 2632 C LEU B 63 -7.453 1.581 -10.276 1.00 0.47 C ATOM 2633 O LEU B 63 -6.770 0.594 -10.561 1.00 0.57 O ATOM 2634 CB LEU B 63 -7.816 2.825 -8.109 1.00 0.45 C ATOM 2635 CG LEU B 63 -7.250 3.660 -6.943 1.00 0.42 C ATOM 2636 CD1 LEU B 63 -8.367 4.093 -5.987 1.00 0.47 C ATOM 2637 CD2 LEU B 63 -6.166 2.891 -6.185 1.00 0.69 C ATOM 0 H LEU B 63 -7.433 4.643 -9.802 1.00 0.41 H new ATOM 0 HA LEU B 63 -5.901 2.349 -9.005 1.00 0.44 H new ATOM 0 HB2 LEU B 63 -8.749 3.283 -8.438 1.00 0.45 H new ATOM 0 HB3 LEU B 63 -8.063 1.832 -7.732 1.00 0.45 H new ATOM 0 HG LEU B 63 -6.795 4.554 -7.369 1.00 0.42 H new ATOM 0 HD11 LEU B 63 -7.942 4.681 -5.173 1.00 0.47 H new ATOM 0 HD12 LEU B 63 -9.096 4.697 -6.528 1.00 0.47 H new ATOM 0 HD13 LEU B 63 -8.859 3.210 -5.579 1.00 0.47 H new ATOM 0 HD21 LEU B 63 -5.787 3.506 -5.369 1.00 0.69 H new ATOM 0 HD22 LEU B 63 -6.588 1.971 -5.780 1.00 0.69 H new ATOM 0 HD23 LEU B 63 -5.350 2.647 -6.865 1.00 0.69 H new ATOM 2649 N ASP B 64 -8.695 1.786 -10.765 1.00 0.47 N ATOM 2650 CA ASP B 64 -9.362 0.824 -11.657 1.00 0.55 C ATOM 2651 C ASP B 64 -8.871 1.003 -13.106 1.00 0.53 C ATOM 2652 O ASP B 64 -9.485 1.725 -13.901 1.00 0.60 O ATOM 2653 CB ASP B 64 -10.898 0.987 -11.548 1.00 0.66 C ATOM 2654 CG ASP B 64 -11.683 -0.207 -12.084 1.00 0.85 C ATOM 2655 OD1 ASP B 64 -11.362 -1.355 -11.703 1.00 1.32 O ATOM 2656 OD2 ASP B 64 -12.621 0.009 -12.880 1.00 1.27 O ATOM 0 H ASP B 64 -9.254 2.613 -10.554 1.00 0.47 H new ATOM 0 HA ASP B 64 -9.107 -0.191 -11.351 1.00 0.55 H new ATOM 0 HB2 ASP B 64 -11.164 1.145 -10.503 1.00 0.66 H new ATOM 0 HB3 ASP B 64 -11.199 1.882 -12.093 1.00 0.66 H new ATOM 2661 N VAL B 65 -7.739 0.346 -13.428 1.00 0.53 N ATOM 2662 CA VAL B 65 -7.128 0.415 -14.771 1.00 0.56 C ATOM 2663 C VAL B 65 -7.728 -0.638 -15.735 1.00 0.56 C ATOM 2664 O VAL B 65 -7.864 -0.366 -16.933 1.00 0.61 O ATOM 2665 CB VAL B 65 -5.562 0.288 -14.692 1.00 0.64 C ATOM 2666 CG1 VAL B 65 -5.093 -1.101 -14.233 1.00 0.68 C ATOM 2667 CG2 VAL B 65 -4.898 0.682 -16.018 1.00 0.72 C ATOM 0 H VAL B 65 -7.226 -0.242 -12.771 1.00 0.53 H new ATOM 0 HA VAL B 65 -7.364 1.397 -15.181 1.00 0.56 H new ATOM 0 HB VAL B 65 -5.241 0.994 -13.925 1.00 0.64 H new ATOM 0 HG11 VAL B 65 -4.004 -1.124 -14.199 1.00 0.68 H new ATOM 0 HG12 VAL B 65 -5.492 -1.310 -13.240 1.00 0.68 H new ATOM 0 HG13 VAL B 65 -5.450 -1.856 -14.934 1.00 0.68 H new ATOM 0 HG21 VAL B 65 -3.816 0.582 -15.927 1.00 0.72 H new ATOM 0 HG22 VAL B 65 -5.257 0.028 -16.813 1.00 0.72 H new ATOM 0 HG23 VAL B 65 -5.148 1.716 -16.257 1.00 0.72 H new ATOM 2677 N ASN B 66 -8.089 -1.829 -15.208 1.00 0.56 N ATOM 2678 CA ASN B 66 -8.673 -2.921 -16.021 1.00 0.60 C ATOM 2679 C ASN B 66 -10.125 -2.611 -16.467 1.00 0.61 C ATOM 2680 O ASN B 66 -10.586 -3.156 -17.475 1.00 0.68 O ATOM 2681 CB ASN B 66 -8.623 -4.257 -15.244 1.00 0.65 C ATOM 2682 CG ASN B 66 -8.326 -5.453 -16.144 1.00 0.90 C ATOM 2683 OD1 ASN B 66 -7.164 -5.752 -16.423 1.00 1.38 O ATOM 2684 ND2 ASN B 66 -9.372 -6.149 -16.603 1.00 1.32 N ATOM 0 H ASN B 66 -7.986 -2.060 -14.220 1.00 0.56 H new ATOM 0 HA ASN B 66 -8.069 -3.008 -16.925 1.00 0.60 H new ATOM 0 HB2 ASN B 66 -7.860 -4.193 -14.469 1.00 0.65 H new ATOM 0 HB3 ASN B 66 -9.577 -4.415 -14.740 1.00 0.65 H new ATOM 0 HD21 ASN B 66 -9.221 -6.958 -17.206 1.00 1.32 H new ATOM 0 HD22 ASN B 66 -10.320 -5.871 -16.350 1.00 1.32 H new ATOM 2691 N GLN B 67 -10.836 -1.744 -15.698 1.00 0.59 N ATOM 2692 CA GLN B 67 -12.229 -1.334 -15.985 1.00 0.64 C ATOM 2693 C GLN B 67 -13.217 -2.514 -15.880 1.00 0.64 C ATOM 2694 O GLN B 67 -13.560 -3.151 -16.884 1.00 0.77 O ATOM 2695 CB GLN B 67 -12.353 -0.601 -17.347 1.00 0.75 C ATOM 2696 CG GLN B 67 -11.565 0.710 -17.413 1.00 0.96 C ATOM 2697 CD GLN B 67 -11.959 1.594 -18.593 1.00 1.28 C ATOM 2698 OE1 GLN B 67 -12.833 2.454 -18.465 1.00 2.02 O ATOM 2699 NE2 GLN B 67 -11.326 1.388 -19.750 1.00 1.87 N ATOM 0 H GLN B 67 -10.453 -1.310 -14.858 1.00 0.59 H new ATOM 0 HA GLN B 67 -12.506 -0.618 -15.211 1.00 0.64 H new ATOM 0 HB2 GLN B 67 -12.006 -1.264 -18.140 1.00 0.75 H new ATOM 0 HB3 GLN B 67 -13.405 -0.393 -17.543 1.00 0.75 H new ATOM 0 HG2 GLN B 67 -11.717 1.264 -16.487 1.00 0.96 H new ATOM 0 HG3 GLN B 67 -10.501 0.483 -17.478 1.00 0.96 H new ATOM 0 HE21 GLN B 67 -10.608 0.667 -19.817 1.00 1.87 H new ATOM 0 HE22 GLN B 67 -11.560 1.952 -20.567 1.00 1.87 H new ATOM 2708 N ASP B 68 -13.637 -2.804 -14.628 1.00 0.65 N ATOM 2709 CA ASP B 68 -14.603 -3.883 -14.324 1.00 0.72 C ATOM 2710 C ASP B 68 -15.509 -3.525 -13.107 1.00 0.79 C ATOM 2711 O ASP B 68 -16.171 -4.410 -12.553 1.00 1.30 O ATOM 2712 CB ASP B 68 -13.834 -5.202 -14.060 1.00 0.76 C ATOM 2713 CG ASP B 68 -14.709 -6.446 -14.158 1.00 0.97 C ATOM 2714 OD1 ASP B 68 -15.102 -6.809 -15.288 1.00 1.16 O ATOM 2715 OD2 ASP B 68 -14.999 -7.058 -13.106 1.00 1.25 O ATOM 0 H ASP B 68 -13.317 -2.298 -13.802 1.00 0.65 H new ATOM 0 HA ASP B 68 -15.259 -4.007 -15.185 1.00 0.72 H new ATOM 0 HB2 ASP B 68 -13.016 -5.286 -14.775 1.00 0.76 H new ATOM 0 HB3 ASP B 68 -13.386 -5.160 -13.067 1.00 0.76 H new ATOM 2720 N SER B 69 -15.550 -2.221 -12.703 1.00 0.66 N ATOM 2721 CA SER B 69 -16.353 -1.726 -11.552 1.00 0.71 C ATOM 2722 C SER B 69 -15.707 -2.066 -10.187 1.00 0.71 C ATOM 2723 O SER B 69 -15.566 -1.179 -9.341 1.00 1.26 O ATOM 2724 CB SER B 69 -17.817 -2.218 -11.596 1.00 0.86 C ATOM 2725 OG SER B 69 -18.640 -1.449 -10.733 1.00 1.35 O ATOM 0 H SER B 69 -15.023 -1.484 -13.171 1.00 0.66 H new ATOM 0 HA SER B 69 -16.365 -0.641 -11.652 1.00 0.71 H new ATOM 0 HB2 SER B 69 -18.195 -2.154 -12.616 1.00 0.86 H new ATOM 0 HB3 SER B 69 -17.860 -3.268 -11.305 1.00 0.86 H new ATOM 0 HG SER B 69 -19.562 -1.779 -10.780 1.00 1.35 H new ATOM 2731 N GLU B 70 -15.333 -3.346 -9.976 1.00 0.69 N ATOM 2732 CA GLU B 70 -14.701 -3.799 -8.718 1.00 0.75 C ATOM 2733 C GLU B 70 -13.210 -3.408 -8.674 1.00 0.62 C ATOM 2734 O GLU B 70 -12.461 -3.701 -9.613 1.00 0.78 O ATOM 2735 CB GLU B 70 -14.837 -5.335 -8.556 1.00 1.11 C ATOM 2736 CG GLU B 70 -16.259 -5.872 -8.755 1.00 1.39 C ATOM 2737 CD GLU B 70 -16.346 -7.384 -8.663 1.00 1.87 C ATOM 2738 OE1 GLU B 70 -15.971 -8.066 -9.641 1.00 2.40 O ATOM 2739 OE2 GLU B 70 -16.790 -7.885 -7.612 1.00 2.37 O ATOM 0 H GLU B 70 -15.459 -4.088 -10.665 1.00 0.69 H new ATOM 0 HA GLU B 70 -15.219 -3.305 -7.896 1.00 0.75 H new ATOM 0 HB2 GLU B 70 -14.175 -5.823 -9.271 1.00 1.11 H new ATOM 0 HB3 GLU B 70 -14.493 -5.614 -7.560 1.00 1.11 H new ATOM 0 HG2 GLU B 70 -16.915 -5.431 -8.005 1.00 1.39 H new ATOM 0 HG3 GLU B 70 -16.628 -5.552 -9.729 1.00 1.39 H new ATOM 2746 N LEU B 71 -12.788 -2.738 -7.581 1.00 0.54 N ATOM 2747 CA LEU B 71 -11.383 -2.321 -7.404 1.00 0.51 C ATOM 2748 C LEU B 71 -10.594 -3.403 -6.636 1.00 0.50 C ATOM 2749 O LEU B 71 -10.510 -3.360 -5.404 1.00 0.52 O ATOM 2750 CB LEU B 71 -11.288 -0.959 -6.664 1.00 0.58 C ATOM 2751 CG LEU B 71 -11.708 0.298 -7.470 1.00 0.78 C ATOM 2752 CD1 LEU B 71 -13.226 0.361 -7.680 1.00 1.13 C ATOM 2753 CD2 LEU B 71 -11.201 1.569 -6.782 1.00 0.92 C ATOM 0 H LEU B 71 -13.401 -2.475 -6.809 1.00 0.54 H new ATOM 0 HA LEU B 71 -10.943 -2.198 -8.394 1.00 0.51 H new ATOM 0 HB2 LEU B 71 -11.908 -1.013 -5.769 1.00 0.58 H new ATOM 0 HB3 LEU B 71 -10.259 -0.823 -6.331 1.00 0.58 H new ATOM 0 HG LEU B 71 -11.248 0.226 -8.456 1.00 0.78 H new ATOM 0 HD11 LEU B 71 -13.478 1.256 -8.249 1.00 1.13 H new ATOM 0 HD12 LEU B 71 -13.554 -0.522 -8.229 1.00 1.13 H new ATOM 0 HD13 LEU B 71 -13.726 0.393 -6.712 1.00 1.13 H new ATOM 0 HD21 LEU B 71 -11.504 2.442 -7.361 1.00 0.92 H new ATOM 0 HD22 LEU B 71 -11.624 1.633 -5.779 1.00 0.92 H new ATOM 0 HD23 LEU B 71 -10.113 1.538 -6.716 1.00 0.92 H new ATOM 2765 N LYS B 72 -10.021 -4.379 -7.379 1.00 0.52 N ATOM 2766 CA LYS B 72 -9.223 -5.485 -6.784 1.00 0.54 C ATOM 2767 C LYS B 72 -7.991 -4.924 -6.044 1.00 0.48 C ATOM 2768 O LYS B 72 -7.579 -3.795 -6.326 1.00 0.46 O ATOM 2769 CB LYS B 72 -8.778 -6.469 -7.901 1.00 0.60 C ATOM 2770 CG LYS B 72 -8.498 -7.900 -7.428 1.00 0.78 C ATOM 2771 CD LYS B 72 -8.210 -8.846 -8.603 1.00 0.91 C ATOM 2772 CE LYS B 72 -8.181 -10.319 -8.182 1.00 1.29 C ATOM 2773 NZ LYS B 72 -6.968 -10.670 -7.384 1.00 1.81 N ATOM 0 H LYS B 72 -10.095 -4.425 -8.395 1.00 0.52 H new ATOM 0 HA LYS B 72 -9.842 -6.019 -6.063 1.00 0.54 H new ATOM 0 HB2 LYS B 72 -9.553 -6.500 -8.667 1.00 0.60 H new ATOM 0 HB3 LYS B 72 -7.878 -6.076 -8.374 1.00 0.60 H new ATOM 0 HG2 LYS B 72 -7.647 -7.897 -6.747 1.00 0.78 H new ATOM 0 HG3 LYS B 72 -9.355 -8.270 -6.865 1.00 0.78 H new ATOM 0 HD2 LYS B 72 -8.971 -8.707 -9.371 1.00 0.91 H new ATOM 0 HD3 LYS B 72 -7.252 -8.581 -9.051 1.00 0.91 H new ATOM 0 HE2 LYS B 72 -9.073 -10.542 -7.596 1.00 1.29 H new ATOM 0 HE3 LYS B 72 -8.219 -10.947 -9.072 1.00 1.29 H new ATOM 0 HZ1 LYS B 72 -7.001 -11.677 -7.127 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 -6.115 -10.485 -7.949 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 -6.942 -10.093 -6.519 1.00 1.81 H new ATOM 2787 N PHE B 73 -7.394 -5.697 -5.103 1.00 0.51 N ATOM 2788 CA PHE B 73 -6.203 -5.217 -4.359 1.00 0.49 C ATOM 2789 C PHE B 73 -4.985 -5.023 -5.292 1.00 0.46 C ATOM 2790 O PHE B 73 -4.118 -4.195 -5.000 1.00 0.46 O ATOM 2791 CB PHE B 73 -5.842 -6.135 -3.171 1.00 0.55 C ATOM 2792 CG PHE B 73 -5.134 -5.404 -2.041 1.00 0.69 C ATOM 2793 CD1 PHE B 73 -5.859 -4.643 -1.121 1.00 0.90 C ATOM 2794 CD2 PHE B 73 -3.751 -5.466 -1.901 1.00 0.89 C ATOM 2795 CE1 PHE B 73 -5.219 -3.972 -0.097 1.00 1.15 C ATOM 2796 CE2 PHE B 73 -3.112 -4.794 -0.878 1.00 1.14 C ATOM 2797 CZ PHE B 73 -3.845 -4.047 0.025 1.00 1.23 C ATOM 0 H PHE B 73 -7.708 -6.633 -4.846 1.00 0.51 H new ATOM 0 HA PHE B 73 -6.472 -4.244 -3.947 1.00 0.49 H new ATOM 0 HB2 PHE B 73 -6.753 -6.593 -2.784 1.00 0.55 H new ATOM 0 HB3 PHE B 73 -5.205 -6.945 -3.527 1.00 0.55 H new ATOM 0 HD1 PHE B 73 -6.933 -4.578 -1.211 1.00 0.90 H new ATOM 0 HD2 PHE B 73 -3.170 -6.047 -2.602 1.00 0.89 H new ATOM 0 HE1 PHE B 73 -5.793 -3.389 0.608 1.00 1.15 H new ATOM 0 HE2 PHE B 73 -2.038 -4.852 -0.783 1.00 1.14 H new ATOM 0 HZ PHE B 73 -3.344 -3.522 0.825 1.00 1.23 H new ATOM 2807 N ASN B 74 -4.922 -5.790 -6.410 1.00 0.47 N ATOM 2808 CA ASN B 74 -3.840 -5.645 -7.411 1.00 0.50 C ATOM 2809 C ASN B 74 -3.996 -4.301 -8.175 1.00 0.48 C ATOM 2810 O ASN B 74 -3.040 -3.819 -8.782 1.00 0.54 O ATOM 2811 CB ASN B 74 -3.848 -6.835 -8.403 1.00 0.55 C ATOM 2812 CG ASN B 74 -2.521 -7.031 -9.148 1.00 0.63 C ATOM 2813 OD1 ASN B 74 -2.178 -8.280 -9.466 1.00 0.99 O flip ATOM 2814 ND2 ASN B 74 -1.808 -6.068 -9.441 1.00 0.93 N flip ATOM 0 H ASN B 74 -5.606 -6.512 -6.638 1.00 0.47 H new ATOM 0 HA ASN B 74 -2.883 -5.644 -6.889 1.00 0.50 H new ATOM 0 HB2 ASN B 74 -4.086 -7.748 -7.858 1.00 0.55 H new ATOM 0 HB3 ASN B 74 -4.644 -6.682 -9.132 1.00 0.55 H new ATOM 0 HD21 ASN B 74 -2.096 -5.124 -9.185 1.00 0.93 H new ATOM 0 HD22 ASN B 74 -0.931 -6.216 -9.939 1.00 0.93 H new ATOM 2821 N GLU B 75 -5.222 -3.727 -8.147 1.00 0.44 N ATOM 2822 CA GLU B 75 -5.545 -2.440 -8.789 1.00 0.47 C ATOM 2823 C GLU B 75 -5.626 -1.295 -7.748 1.00 0.41 C ATOM 2824 O GLU B 75 -5.392 -0.132 -8.091 1.00 0.42 O ATOM 2825 CB GLU B 75 -6.889 -2.570 -9.539 1.00 0.54 C ATOM 2826 CG GLU B 75 -6.875 -3.599 -10.672 1.00 0.64 C ATOM 2827 CD GLU B 75 -8.211 -3.707 -11.394 1.00 0.76 C ATOM 2828 OE1 GLU B 75 -8.638 -2.705 -12.007 1.00 0.91 O ATOM 2829 OE2 GLU B 75 -8.824 -4.795 -11.350 1.00 0.93 O ATOM 0 H GLU B 75 -6.019 -4.152 -7.673 1.00 0.44 H new ATOM 0 HA GLU B 75 -4.750 -2.193 -9.492 1.00 0.47 H new ATOM 0 HB2 GLU B 75 -7.666 -2.842 -8.825 1.00 0.54 H new ATOM 0 HB3 GLU B 75 -7.159 -1.597 -9.949 1.00 0.54 H new ATOM 0 HG2 GLU B 75 -6.101 -3.330 -11.390 1.00 0.64 H new ATOM 0 HG3 GLU B 75 -6.608 -4.575 -10.266 1.00 0.64 H new ATOM 2836 N TYR B 76 -5.958 -1.634 -6.475 1.00 0.41 N ATOM 2837 CA TYR B 76 -6.077 -0.643 -5.379 1.00 0.39 C ATOM 2838 C TYR B 76 -4.713 -0.288 -4.727 1.00 0.36 C ATOM 2839 O TYR B 76 -4.661 0.628 -3.899 1.00 0.43 O ATOM 2840 CB TYR B 76 -7.070 -1.167 -4.307 1.00 0.43 C ATOM 2841 CG TYR B 76 -7.392 -0.188 -3.174 1.00 0.44 C ATOM 2842 CD1 TYR B 76 -8.223 0.910 -3.381 1.00 0.50 C ATOM 2843 CD2 TYR B 76 -6.866 -0.371 -1.894 1.00 0.52 C ATOM 2844 CE1 TYR B 76 -8.515 1.791 -2.357 1.00 0.58 C ATOM 2845 CE2 TYR B 76 -7.157 0.508 -0.868 1.00 0.59 C ATOM 2846 CZ TYR B 76 -7.979 1.584 -1.102 1.00 0.59 C ATOM 2847 OH TYR B 76 -8.270 2.457 -0.075 1.00 0.71 O ATOM 0 H TYR B 76 -6.149 -2.593 -6.184 1.00 0.41 H new ATOM 0 HA TYR B 76 -6.455 0.280 -5.819 1.00 0.39 H new ATOM 0 HB2 TYR B 76 -8.001 -1.442 -4.802 1.00 0.43 H new ATOM 0 HB3 TYR B 76 -6.660 -2.078 -3.871 1.00 0.43 H new ATOM 0 HD1 TYR B 76 -8.647 1.076 -4.360 1.00 0.50 H new ATOM 0 HD2 TYR B 76 -6.220 -1.215 -1.702 1.00 0.52 H new ATOM 0 HE1 TYR B 76 -9.160 2.638 -2.538 1.00 0.58 H new ATOM 0 HE2 TYR B 76 -6.739 0.350 0.115 1.00 0.59 H new ATOM 0 HH TYR B 76 -7.813 2.166 0.741 1.00 0.71 H new ATOM 2857 N TRP B 77 -3.603 -0.974 -5.111 1.00 0.39 N ATOM 2858 CA TRP B 77 -2.268 -0.693 -4.525 1.00 0.40 C ATOM 2859 C TRP B 77 -1.765 0.741 -4.844 1.00 0.35 C ATOM 2860 O TRP B 77 -0.833 1.220 -4.191 1.00 0.37 O ATOM 2861 CB TRP B 77 -1.233 -1.793 -4.915 1.00 0.58 C ATOM 2862 CG TRP B 77 -0.231 -1.445 -5.999 1.00 0.48 C ATOM 2863 CD1 TRP B 77 1.110 -1.232 -5.831 1.00 0.56 C ATOM 2864 CD2 TRP B 77 -0.484 -1.292 -7.403 1.00 0.74 C ATOM 2865 NE1 TRP B 77 1.703 -0.962 -7.040 1.00 0.79 N ATOM 2866 CE2 TRP B 77 0.747 -0.995 -8.020 1.00 0.94 C ATOM 2867 CE3 TRP B 77 -1.629 -1.380 -8.196 1.00 0.98 C ATOM 2868 CZ2 TRP B 77 0.862 -0.787 -9.392 1.00 1.34 C ATOM 2869 CZ3 TRP B 77 -1.513 -1.175 -9.557 1.00 1.37 C ATOM 2870 CH2 TRP B 77 -0.276 -0.885 -10.143 1.00 1.54 C ATOM 0 H TRP B 77 -3.607 -1.714 -5.813 1.00 0.39 H new ATOM 0 HA TRP B 77 -2.381 -0.730 -3.441 1.00 0.40 H new ATOM 0 HB2 TRP B 77 -0.679 -2.069 -4.018 1.00 0.58 H new ATOM 0 HB3 TRP B 77 -1.784 -2.678 -5.235 1.00 0.58 H new ATOM 0 HD1 TRP B 77 1.628 -1.271 -4.884 1.00 0.56 H new ATOM 0 HE1 TRP B 77 2.694 -0.768 -7.184 1.00 0.79 H new ATOM 0 HE3 TRP B 77 -2.588 -1.604 -7.754 1.00 0.98 H new ATOM 0 HZ2 TRP B 77 1.815 -0.557 -9.846 1.00 1.34 H new ATOM 0 HZ3 TRP B 77 -2.393 -1.240 -10.180 1.00 1.37 H new ATOM 0 HH2 TRP B 77 -0.219 -0.735 -11.211 1.00 1.54 H new ATOM 2881 N ARG B 78 -2.384 1.421 -5.841 1.00 0.37 N ATOM 2882 CA ARG B 78 -2.019 2.807 -6.206 1.00 0.41 C ATOM 2883 C ARG B 78 -2.352 3.783 -5.059 1.00 0.38 C ATOM 2884 O ARG B 78 -1.644 4.776 -4.873 1.00 0.45 O ATOM 2885 CB ARG B 78 -2.748 3.265 -7.491 1.00 0.49 C ATOM 2886 CG ARG B 78 -2.505 2.386 -8.726 1.00 0.68 C ATOM 2887 CD ARG B 78 -1.154 2.654 -9.397 1.00 0.88 C ATOM 2888 NE ARG B 78 -1.261 3.597 -10.525 1.00 1.17 N ATOM 2889 CZ ARG B 78 -1.669 3.279 -11.779 1.00 1.72 C ATOM 2890 NH1 ARG B 78 -2.040 2.032 -12.103 1.00 2.14 N ATOM 2891 NH2 ARG B 78 -1.708 4.228 -12.713 1.00 2.15 N ATOM 0 H ARG B 78 -3.138 1.029 -6.405 1.00 0.37 H new ATOM 0 HA ARG B 78 -0.945 2.816 -6.390 1.00 0.41 H new ATOM 0 HB2 ARG B 78 -3.819 3.296 -7.291 1.00 0.49 H new ATOM 0 HB3 ARG B 78 -2.438 4.284 -7.723 1.00 0.49 H new ATOM 0 HG2 ARG B 78 -2.557 1.337 -8.434 1.00 0.68 H new ATOM 0 HG3 ARG B 78 -3.303 2.556 -9.449 1.00 0.68 H new ATOM 0 HD2 ARG B 78 -0.458 3.053 -8.659 1.00 0.88 H new ATOM 0 HD3 ARG B 78 -0.736 1.713 -9.753 1.00 0.88 H new ATOM 0 HE ARG B 78 -1.007 4.569 -10.348 1.00 1.17 H new ATOM 0 HH11 ARG B 78 -2.020 1.295 -11.399 1.00 2.14 H new ATOM 0 HH12 ARG B 78 -2.343 1.821 -13.054 1.00 2.14 H new ATOM 0 HH21 ARG B 78 -1.433 5.183 -12.482 1.00 2.15 H new ATOM 0 HH22 ARG B 78 -2.013 4.000 -13.659 1.00 2.15 H new ATOM 2905 N LEU B 79 -3.434 3.492 -4.296 1.00 0.33 N ATOM 2906 CA LEU B 79 -3.853 4.338 -3.164 1.00 0.34 C ATOM 2907 C LEU B 79 -3.064 3.988 -1.895 1.00 0.32 C ATOM 2908 O LEU B 79 -2.758 4.882 -1.106 1.00 0.36 O ATOM 2909 CB LEU B 79 -5.374 4.227 -2.896 1.00 0.36 C ATOM 2910 CG LEU B 79 -6.061 5.522 -2.404 1.00 0.41 C ATOM 2911 CD1 LEU B 79 -6.101 6.586 -3.506 1.00 0.49 C ATOM 2912 CD2 LEU B 79 -7.475 5.235 -1.889 1.00 0.48 C ATOM 0 H LEU B 79 -4.028 2.677 -4.448 1.00 0.33 H new ATOM 0 HA LEU B 79 -3.636 5.370 -3.438 1.00 0.34 H new ATOM 0 HB2 LEU B 79 -5.864 3.903 -3.814 1.00 0.36 H new ATOM 0 HB3 LEU B 79 -5.538 3.445 -2.154 1.00 0.36 H new ATOM 0 HG LEU B 79 -5.466 5.911 -1.578 1.00 0.41 H new ATOM 0 HD11 LEU B 79 -6.590 7.484 -3.128 1.00 0.49 H new ATOM 0 HD12 LEU B 79 -5.084 6.829 -3.814 1.00 0.49 H new ATOM 0 HD13 LEU B 79 -6.657 6.203 -4.362 1.00 0.49 H new ATOM 0 HD21 LEU B 79 -7.934 6.164 -1.550 1.00 0.48 H new ATOM 0 HD22 LEU B 79 -8.075 4.806 -2.692 1.00 0.48 H new ATOM 0 HD23 LEU B 79 -7.424 4.531 -1.059 1.00 0.48 H new ATOM 2924 N ILE B 80 -2.734 2.686 -1.698 1.00 0.34 N ATOM 2925 CA ILE B 80 -1.939 2.243 -0.523 1.00 0.37 C ATOM 2926 C ILE B 80 -0.607 3.032 -0.460 1.00 0.36 C ATOM 2927 O ILE B 80 -0.124 3.344 0.631 1.00 0.39 O ATOM 2928 CB ILE B 80 -1.675 0.690 -0.536 1.00 0.44 C ATOM 2929 CG1 ILE B 80 -3.007 -0.114 -0.533 1.00 0.47 C ATOM 2930 CG2 ILE B 80 -0.783 0.245 0.641 1.00 0.54 C ATOM 2931 CD1 ILE B 80 -3.905 0.111 0.679 1.00 0.56 C ATOM 0 H ILE B 80 -3.003 1.932 -2.330 1.00 0.34 H new ATOM 0 HA ILE B 80 -2.521 2.454 0.374 1.00 0.37 H new ATOM 0 HB ILE B 80 -1.142 0.474 -1.462 1.00 0.44 H new ATOM 0 HG12 ILE B 80 -3.568 0.142 -1.432 1.00 0.47 H new ATOM 0 HG13 ILE B 80 -2.771 -1.176 -0.596 1.00 0.47 H new ATOM 0 HG21 ILE B 80 -0.627 -0.833 0.592 1.00 0.54 H new ATOM 0 HG22 ILE B 80 0.179 0.754 0.581 1.00 0.54 H new ATOM 0 HG23 ILE B 80 -1.270 0.499 1.583 1.00 0.54 H new ATOM 0 HD11 ILE B 80 -4.806 -0.495 0.582 1.00 0.56 H new ATOM 0 HD12 ILE B 80 -3.371 -0.175 1.585 1.00 0.56 H new ATOM 0 HD13 ILE B 80 -4.181 1.164 0.737 1.00 0.56 H new ATOM 2943 N GLY B 81 -0.029 3.344 -1.645 1.00 0.36 N ATOM 2944 CA GLY B 81 1.196 4.144 -1.719 1.00 0.39 C ATOM 2945 C GLY B 81 0.919 5.631 -1.484 1.00 0.37 C ATOM 2946 O GLY B 81 1.742 6.325 -0.881 1.00 0.42 O ATOM 0 H GLY B 81 -0.396 3.052 -2.551 1.00 0.36 H new ATOM 0 HA2 GLY B 81 1.910 3.786 -0.977 1.00 0.39 H new ATOM 0 HA3 GLY B 81 1.659 4.011 -2.697 1.00 0.39 H new ATOM 2950 N GLU B 82 -0.249 6.120 -1.974 1.00 0.34 N ATOM 2951 CA GLU B 82 -0.675 7.528 -1.787 1.00 0.36 C ATOM 2952 C GLU B 82 -0.972 7.815 -0.299 1.00 0.33 C ATOM 2953 O GLU B 82 -0.746 8.932 0.173 1.00 0.40 O ATOM 2954 CB GLU B 82 -1.931 7.847 -2.634 1.00 0.41 C ATOM 2955 CG GLU B 82 -1.688 7.900 -4.142 1.00 0.49 C ATOM 2956 CD GLU B 82 -1.067 9.213 -4.596 1.00 0.61 C ATOM 2957 OE1 GLU B 82 -1.828 10.163 -4.882 1.00 0.91 O ATOM 2958 OE2 GLU B 82 0.177 9.293 -4.653 1.00 0.79 O ATOM 0 H GLU B 82 -0.914 5.556 -2.503 1.00 0.34 H new ATOM 0 HA GLU B 82 0.144 8.166 -2.119 1.00 0.36 H new ATOM 0 HB2 GLU B 82 -2.692 7.094 -2.429 1.00 0.41 H new ATOM 0 HB3 GLU B 82 -2.336 8.806 -2.311 1.00 0.41 H new ATOM 0 HG2 GLU B 82 -1.034 7.076 -4.429 1.00 0.49 H new ATOM 0 HG3 GLU B 82 -2.634 7.752 -4.663 1.00 0.49 H new ATOM 2965 N LEU B 83 -1.490 6.793 0.425 1.00 0.33 N ATOM 2966 CA LEU B 83 -1.799 6.902 1.866 1.00 0.35 C ATOM 2967 C LEU B 83 -0.504 7.103 2.674 1.00 0.37 C ATOM 2968 O LEU B 83 -0.409 8.029 3.478 1.00 0.45 O ATOM 2969 CB LEU B 83 -2.554 5.638 2.373 1.00 0.42 C ATOM 2970 CG LEU B 83 -4.101 5.732 2.415 1.00 0.51 C ATOM 2971 CD1 LEU B 83 -4.715 5.696 1.012 1.00 0.69 C ATOM 2972 CD2 LEU B 83 -4.680 4.612 3.287 1.00 0.63 C ATOM 0 H LEU B 83 -1.703 5.878 0.027 1.00 0.33 H new ATOM 0 HA LEU B 83 -2.447 7.767 2.009 1.00 0.35 H new ATOM 0 HB2 LEU B 83 -2.280 4.797 1.736 1.00 0.42 H new ATOM 0 HB3 LEU B 83 -2.198 5.407 3.377 1.00 0.42 H new ATOM 0 HG LEU B 83 -4.360 6.694 2.857 1.00 0.51 H new ATOM 0 HD11 LEU B 83 -5.800 5.764 1.088 1.00 0.69 H new ATOM 0 HD12 LEU B 83 -4.338 6.536 0.428 1.00 0.69 H new ATOM 0 HD13 LEU B 83 -4.444 4.762 0.520 1.00 0.69 H new ATOM 0 HD21 LEU B 83 -5.767 4.691 3.307 1.00 0.63 H new ATOM 0 HD22 LEU B 83 -4.394 3.645 2.874 1.00 0.63 H new ATOM 0 HD23 LEU B 83 -4.291 4.703 4.301 1.00 0.63 H new ATOM 2984 N ALA B 84 0.498 6.232 2.429 1.00 0.38 N ATOM 2985 CA ALA B 84 1.806 6.306 3.114 1.00 0.44 C ATOM 2986 C ALA B 84 2.603 7.576 2.731 1.00 0.45 C ATOM 2987 O ALA B 84 3.448 8.029 3.506 1.00 0.55 O ATOM 2988 CB ALA B 84 2.632 5.055 2.818 1.00 0.55 C ATOM 0 H ALA B 84 0.425 5.466 1.759 1.00 0.38 H new ATOM 0 HA ALA B 84 1.604 6.363 4.184 1.00 0.44 H new ATOM 0 HB1 ALA B 84 3.592 5.124 3.329 1.00 0.55 H new ATOM 0 HB2 ALA B 84 2.096 4.173 3.170 1.00 0.55 H new ATOM 0 HB3 ALA B 84 2.798 4.974 1.744 1.00 0.55 H new ATOM 2994 N LYS B 85 2.326 8.144 1.536 1.00 0.41 N ATOM 2995 CA LYS B 85 3.010 9.360 1.051 1.00 0.45 C ATOM 2996 C LYS B 85 2.341 10.647 1.585 1.00 0.47 C ATOM 2997 O LYS B 85 3.037 11.615 1.902 1.00 0.57 O ATOM 2998 CB LYS B 85 3.027 9.377 -0.497 1.00 0.49 C ATOM 2999 CG LYS B 85 3.958 10.438 -1.115 1.00 0.57 C ATOM 3000 CD LYS B 85 3.456 10.974 -2.465 1.00 0.66 C ATOM 3001 CE LYS B 85 3.961 10.159 -3.657 1.00 0.79 C ATOM 3002 NZ LYS B 85 3.333 8.806 -3.752 1.00 1.10 N ATOM 0 H LYS B 85 1.629 7.776 0.888 1.00 0.41 H new ATOM 0 HA LYS B 85 4.033 9.336 1.428 1.00 0.45 H new ATOM 0 HB2 LYS B 85 3.330 8.393 -0.855 1.00 0.49 H new ATOM 0 HB3 LYS B 85 2.013 9.548 -0.857 1.00 0.49 H new ATOM 0 HG2 LYS B 85 4.063 11.269 -0.418 1.00 0.57 H new ATOM 0 HG3 LYS B 85 4.950 10.007 -1.249 1.00 0.57 H new ATOM 0 HD2 LYS B 85 2.366 10.973 -2.467 1.00 0.66 H new ATOM 0 HD3 LYS B 85 3.774 12.010 -2.579 1.00 0.66 H new ATOM 0 HE2 LYS B 85 3.763 10.710 -4.576 1.00 0.79 H new ATOM 0 HE3 LYS B 85 5.042 10.046 -3.580 1.00 0.79 H new ATOM 0 HZ1 LYS B 85 3.583 8.370 -4.663 1.00 1.10 H new ATOM 0 HZ2 LYS B 85 3.679 8.207 -2.975 1.00 1.10 H new ATOM 0 HZ3 LYS B 85 2.299 8.898 -3.684 1.00 1.10 H new ATOM 3016 N GLU B 86 0.994 10.648 1.692 1.00 0.42 N ATOM 3017 CA GLU B 86 0.237 11.831 2.165 1.00 0.46 C ATOM 3018 C GLU B 86 0.207 11.976 3.711 1.00 0.50 C ATOM 3019 O GLU B 86 -0.350 12.955 4.216 1.00 0.81 O ATOM 3020 CB GLU B 86 -1.200 11.808 1.597 1.00 0.52 C ATOM 3021 CG GLU B 86 -1.277 12.144 0.106 1.00 0.59 C ATOM 3022 CD GLU B 86 -2.676 11.993 -0.470 1.00 1.01 C ATOM 3023 OE1 GLU B 86 -3.552 12.820 -0.135 1.00 1.48 O ATOM 3024 OE2 GLU B 86 -2.893 11.050 -1.262 1.00 1.68 O ATOM 0 H GLU B 86 0.409 9.846 1.458 1.00 0.42 H new ATOM 0 HA GLU B 86 0.769 12.705 1.790 1.00 0.46 H new ATOM 0 HB2 GLU B 86 -1.630 10.820 1.761 1.00 0.52 H new ATOM 0 HB3 GLU B 86 -1.812 12.518 2.153 1.00 0.52 H new ATOM 0 HG2 GLU B 86 -0.936 13.168 -0.047 1.00 0.59 H new ATOM 0 HG3 GLU B 86 -0.593 11.495 -0.442 1.00 0.59 H new ATOM 3031 N ILE B 87 0.805 11.020 4.461 1.00 0.48 N ATOM 3032 CA ILE B 87 0.840 11.096 5.937 1.00 0.51 C ATOM 3033 C ILE B 87 1.902 12.116 6.408 1.00 0.53 C ATOM 3034 O ILE B 87 1.632 12.908 7.315 1.00 0.58 O ATOM 3035 CB ILE B 87 1.057 9.673 6.592 1.00 0.56 C ATOM 3036 CG1 ILE B 87 0.485 9.598 8.043 1.00 0.61 C ATOM 3037 CG2 ILE B 87 2.516 9.186 6.530 1.00 0.62 C ATOM 3038 CD1 ILE B 87 1.212 10.405 9.116 1.00 0.63 C ATOM 0 H ILE B 87 1.264 10.197 4.072 1.00 0.48 H new ATOM 0 HA ILE B 87 -0.133 11.450 6.277 1.00 0.51 H new ATOM 0 HB ILE B 87 0.482 8.980 5.978 1.00 0.56 H new ATOM 0 HG12 ILE B 87 -0.553 9.929 8.016 1.00 0.61 H new ATOM 0 HG13 ILE B 87 0.479 8.553 8.351 1.00 0.61 H new ATOM 0 HG21 ILE B 87 2.592 8.204 6.997 1.00 0.62 H new ATOM 0 HG22 ILE B 87 2.833 9.118 5.489 1.00 0.62 H new ATOM 0 HG23 ILE B 87 3.158 9.890 7.060 1.00 0.62 H new ATOM 0 HD11 ILE B 87 0.714 10.266 10.076 1.00 0.63 H new ATOM 0 HD12 ILE B 87 2.245 10.064 9.190 1.00 0.63 H new ATOM 0 HD13 ILE B 87 1.197 11.462 8.849 1.00 0.63 H new ATOM 3050 N ARG B 88 3.085 12.121 5.755 1.00 0.57 N ATOM 3051 CA ARG B 88 4.179 13.040 6.115 1.00 0.67 C ATOM 3052 C ARG B 88 4.318 14.204 5.111 1.00 0.67 C ATOM 3053 O ARG B 88 4.618 15.327 5.524 1.00 0.84 O ATOM 3054 CB ARG B 88 5.525 12.275 6.300 1.00 0.75 C ATOM 3055 CG ARG B 88 6.254 11.816 5.020 1.00 0.82 C ATOM 3056 CD ARG B 88 5.752 10.476 4.478 1.00 1.05 C ATOM 3057 NE ARG B 88 6.364 10.148 3.185 1.00 1.17 N ATOM 3058 CZ ARG B 88 7.597 9.629 3.007 1.00 1.26 C ATOM 3059 NH1 ARG B 88 8.407 9.359 4.038 1.00 1.64 N ATOM 3060 NH2 ARG B 88 8.023 9.394 1.775 1.00 1.55 N ATOM 0 H ARG B 88 3.303 11.498 4.977 1.00 0.57 H new ATOM 0 HA ARG B 88 3.918 13.486 7.075 1.00 0.67 H new ATOM 0 HB2 ARG B 88 6.203 12.915 6.864 1.00 0.75 H new ATOM 0 HB3 ARG B 88 5.332 11.395 6.914 1.00 0.75 H new ATOM 0 HG2 ARG B 88 6.134 12.578 4.250 1.00 0.82 H new ATOM 0 HG3 ARG B 88 7.321 11.738 5.228 1.00 0.82 H new ATOM 0 HD2 ARG B 88 5.975 9.687 5.196 1.00 1.05 H new ATOM 0 HD3 ARG B 88 4.668 10.511 4.369 1.00 1.05 H new ATOM 0 HE ARG B 88 5.809 10.328 2.348 1.00 1.17 H new ATOM 0 HH11 ARG B 88 8.098 9.545 4.992 1.00 1.64 H new ATOM 0 HH12 ARG B 88 9.333 8.967 3.870 1.00 1.64 H new ATOM 0 HH21 ARG B 88 7.422 9.605 0.979 1.00 1.55 H new ATOM 0 HH22 ARG B 88 8.952 9.002 1.623 1.00 1.55 H new ATOM 3074 N LYS B 89 4.091 13.945 3.800 1.00 0.60 N ATOM 3075 CA LYS B 89 4.216 14.988 2.763 1.00 0.67 C ATOM 3076 C LYS B 89 2.976 15.060 1.834 1.00 0.63 C ATOM 3077 O LYS B 89 3.005 14.588 0.692 1.00 0.76 O ATOM 3078 CB LYS B 89 5.524 14.800 1.951 1.00 0.76 C ATOM 3079 CG LYS B 89 5.733 13.403 1.354 1.00 0.78 C ATOM 3080 CD LYS B 89 6.856 13.391 0.315 1.00 1.06 C ATOM 3081 CE LYS B 89 7.144 11.986 -0.223 1.00 1.32 C ATOM 3082 NZ LYS B 89 7.322 11.969 -1.707 1.00 1.65 N ATOM 0 H LYS B 89 3.823 13.029 3.442 1.00 0.60 H new ATOM 0 HA LYS B 89 4.266 15.947 3.278 1.00 0.67 H new ATOM 0 HB2 LYS B 89 5.536 15.528 1.140 1.00 0.76 H new ATOM 0 HB3 LYS B 89 6.370 15.030 2.599 1.00 0.76 H new ATOM 0 HG2 LYS B 89 5.968 12.698 2.152 1.00 0.78 H new ATOM 0 HG3 LYS B 89 4.806 13.063 0.892 1.00 0.78 H new ATOM 0 HD2 LYS B 89 6.586 14.045 -0.514 1.00 1.06 H new ATOM 0 HD3 LYS B 89 7.763 13.799 0.761 1.00 1.06 H new ATOM 0 HE2 LYS B 89 8.044 11.595 0.253 1.00 1.32 H new ATOM 0 HE3 LYS B 89 6.325 11.321 0.050 1.00 1.32 H new ATOM 0 HZ1 LYS B 89 7.614 11.018 -2.011 1.00 1.65 H new ATOM 0 HZ2 LYS B 89 6.423 12.219 -2.167 1.00 1.65 H new ATOM 0 HZ3 LYS B 89 8.052 12.658 -1.977 1.00 1.65 H new ATOM 3096 N LYS B 90 1.885 15.663 2.351 1.00 0.58 N ATOM 3097 CA LYS B 90 0.631 15.863 1.579 1.00 0.56 C ATOM 3098 C LYS B 90 0.632 17.272 0.958 1.00 0.54 C ATOM 3099 O LYS B 90 0.201 17.452 -0.185 1.00 0.58 O ATOM 3100 CB LYS B 90 -0.644 15.643 2.445 1.00 0.59 C ATOM 3101 CG LYS B 90 -0.595 16.216 3.872 1.00 0.66 C ATOM 3102 CD LYS B 90 -1.914 16.004 4.632 1.00 0.96 C ATOM 3103 CE LYS B 90 -2.904 17.155 4.430 1.00 1.48 C ATOM 3104 NZ LYS B 90 -2.701 18.256 5.416 1.00 2.03 N ATOM 0 H LYS B 90 1.843 16.023 3.304 1.00 0.58 H new ATOM 0 HA LYS B 90 0.601 15.112 0.789 1.00 0.56 H new ATOM 0 HB2 LYS B 90 -1.493 16.086 1.925 1.00 0.59 H new ATOM 0 HB3 LYS B 90 -0.834 14.572 2.511 1.00 0.59 H new ATOM 0 HG2 LYS B 90 0.219 15.744 4.423 1.00 0.66 H new ATOM 0 HG3 LYS B 90 -0.372 17.282 3.826 1.00 0.66 H new ATOM 0 HD2 LYS B 90 -2.374 15.073 4.301 1.00 0.96 H new ATOM 0 HD3 LYS B 90 -1.702 15.895 5.696 1.00 0.96 H new ATOM 0 HE2 LYS B 90 -2.797 17.550 3.420 1.00 1.48 H new ATOM 0 HE3 LYS B 90 -3.922 16.775 4.517 1.00 1.48 H new ATOM 0 HZ1 LYS B 90 -3.393 19.012 5.240 1.00 2.03 H new ATOM 0 HZ2 LYS B 90 -2.829 17.887 6.380 1.00 2.03 H new ATOM 0 HZ3 LYS B 90 -1.739 18.638 5.317 1.00 2.03 H new ATOM 3118 N LYS B 91 1.110 18.260 1.741 1.00 0.55 N ATOM 3119 CA LYS B 91 1.241 19.660 1.309 1.00 0.59 C ATOM 3120 C LYS B 91 2.630 20.186 1.748 1.00 0.62 C ATOM 3121 O LYS B 91 2.741 21.241 2.376 1.00 0.69 O ATOM 3122 CB LYS B 91 0.109 20.522 1.916 1.00 0.64 C ATOM 3123 CG LYS B 91 -1.307 20.102 1.507 1.00 0.74 C ATOM 3124 CD LYS B 91 -2.372 20.886 2.277 1.00 0.84 C ATOM 3125 CE LYS B 91 -3.783 20.357 2.017 1.00 1.14 C ATOM 3126 NZ LYS B 91 -4.311 20.751 0.675 1.00 1.36 N ATOM 0 H LYS B 91 1.418 18.103 2.701 1.00 0.55 H new ATOM 0 HA LYS B 91 1.156 19.721 0.224 1.00 0.59 H new ATOM 0 HB2 LYS B 91 0.185 20.484 3.003 1.00 0.64 H new ATOM 0 HB3 LYS B 91 0.264 21.560 1.622 1.00 0.64 H new ATOM 0 HG2 LYS B 91 -1.440 20.262 0.437 1.00 0.74 H new ATOM 0 HG3 LYS B 91 -1.437 19.035 1.689 1.00 0.74 H new ATOM 0 HD2 LYS B 91 -2.158 20.834 3.344 1.00 0.84 H new ATOM 0 HD3 LYS B 91 -2.322 21.937 1.993 1.00 0.84 H new ATOM 0 HE2 LYS B 91 -3.779 19.270 2.096 1.00 1.14 H new ATOM 0 HE3 LYS B 91 -4.454 20.730 2.790 1.00 1.14 H new ATOM 0 HZ1 LYS B 91 -5.269 20.366 0.552 1.00 1.36 H new ATOM 0 HZ2 LYS B 91 -4.343 21.788 0.605 1.00 1.36 H new ATOM 0 HZ3 LYS B 91 -3.689 20.373 -0.068 1.00 1.36 H new ATOM 3140 N ASP B 92 3.693 19.429 1.379 1.00 0.66 N ATOM 3141 CA ASP B 92 5.105 19.745 1.745 1.00 0.74 C ATOM 3142 C ASP B 92 5.517 21.212 1.475 1.00 0.92 C ATOM 3143 O ASP B 92 6.297 21.779 2.245 1.00 1.72 O ATOM 3144 CB ASP B 92 6.088 18.780 1.038 1.00 0.75 C ATOM 3145 CG ASP B 92 5.970 18.787 -0.484 1.00 0.88 C ATOM 3146 OD1 ASP B 92 6.643 19.617 -1.130 1.00 1.15 O ATOM 3147 OD2 ASP B 92 5.205 17.961 -1.025 1.00 0.93 O ATOM 0 H ASP B 92 3.600 18.581 0.819 1.00 0.66 H new ATOM 0 HA ASP B 92 5.160 19.606 2.825 1.00 0.74 H new ATOM 0 HB2 ASP B 92 7.108 19.047 1.315 1.00 0.75 H new ATOM 0 HB3 ASP B 92 5.914 17.767 1.402 1.00 0.75 H new ATOM 3152 N LEU B 93 5.000 21.814 0.385 1.00 0.63 N ATOM 3153 CA LEU B 93 5.325 23.210 0.027 1.00 0.66 C ATOM 3154 C LEU B 93 4.615 24.216 0.959 1.00 0.69 C ATOM 3155 O LEU B 93 5.227 25.201 1.388 1.00 0.82 O ATOM 3156 CB LEU B 93 4.952 23.496 -1.444 1.00 0.71 C ATOM 3157 CG LEU B 93 5.719 24.657 -2.118 1.00 0.97 C ATOM 3158 CD1 LEU B 93 7.177 24.271 -2.388 1.00 1.27 C ATOM 3159 CD2 LEU B 93 5.023 25.090 -3.412 1.00 1.18 C ATOM 0 H LEU B 93 4.357 21.357 -0.261 1.00 0.63 H new ATOM 0 HA LEU B 93 6.400 23.336 0.152 1.00 0.66 H new ATOM 0 HB2 LEU B 93 5.120 22.589 -2.025 1.00 0.71 H new ATOM 0 HB3 LEU B 93 3.885 23.713 -1.493 1.00 0.71 H new ATOM 0 HG LEU B 93 5.718 25.503 -1.431 1.00 0.97 H new ATOM 0 HD11 LEU B 93 7.693 25.106 -2.862 1.00 1.27 H new ATOM 0 HD12 LEU B 93 7.669 24.028 -1.446 1.00 1.27 H new ATOM 0 HD13 LEU B 93 7.208 23.404 -3.048 1.00 1.27 H new ATOM 0 HD21 LEU B 93 5.580 25.908 -3.869 1.00 1.18 H new ATOM 0 HD22 LEU B 93 4.983 24.248 -4.103 1.00 1.18 H new ATOM 0 HD23 LEU B 93 4.010 25.423 -3.186 1.00 1.18 H new ATOM 3171 N LYS B 94 3.325 23.958 1.265 1.00 0.66 N ATOM 3172 CA LYS B 94 2.525 24.838 2.146 1.00 0.74 C ATOM 3173 C LYS B 94 2.919 24.643 3.627 1.00 0.70 C ATOM 3174 O LYS B 94 3.211 25.620 4.324 1.00 0.79 O ATOM 3175 CB LYS B 94 1.012 24.563 1.949 1.00 0.84 C ATOM 3176 CG LYS B 94 0.071 25.618 2.548 1.00 1.00 C ATOM 3177 CD LYS B 94 -0.066 26.859 1.660 1.00 1.15 C ATOM 3178 CE LYS B 94 -1.135 27.826 2.179 1.00 1.45 C ATOM 3179 NZ LYS B 94 -0.709 28.544 3.418 1.00 1.61 N ATOM 0 H LYS B 94 2.815 23.147 0.915 1.00 0.66 H new ATOM 0 HA LYS B 94 2.733 25.873 1.874 1.00 0.74 H new ATOM 0 HB2 LYS B 94 0.810 24.484 0.881 1.00 0.84 H new ATOM 0 HB3 LYS B 94 0.775 23.595 2.391 1.00 0.84 H new ATOM 0 HG2 LYS B 94 -0.913 25.176 2.702 1.00 1.00 H new ATOM 0 HG3 LYS B 94 0.443 25.917 3.528 1.00 1.00 H new ATOM 0 HD2 LYS B 94 0.893 27.374 1.608 1.00 1.15 H new ATOM 0 HD3 LYS B 94 -0.318 26.552 0.645 1.00 1.15 H new ATOM 0 HE2 LYS B 94 -1.367 28.555 1.403 1.00 1.45 H new ATOM 0 HE3 LYS B 94 -2.052 27.273 2.381 1.00 1.45 H new ATOM 0 HZ1 LYS B 94 -1.468 29.185 3.726 1.00 1.61 H new ATOM 0 HZ2 LYS B 94 -0.513 27.853 4.170 1.00 1.61 H new ATOM 0 HZ3 LYS B 94 0.151 29.095 3.222 1.00 1.61 H new ATOM 3193 N ILE B 95 2.917 23.375 4.090 1.00 0.65 N ATOM 3194 CA ILE B 95 3.265 23.022 5.481 1.00 0.66 C ATOM 3195 C ILE B 95 4.248 21.836 5.513 1.00 0.68 C ATOM 3196 O ILE B 95 4.049 20.844 4.801 1.00 0.78 O ATOM 3197 CB ILE B 95 1.992 22.685 6.337 1.00 0.74 C ATOM 3198 CG1 ILE B 95 1.021 21.742 5.572 1.00 0.83 C ATOM 3199 CG2 ILE B 95 1.286 23.978 6.763 1.00 0.84 C ATOM 3200 CD1 ILE B 95 -0.135 21.212 6.405 1.00 1.04 C ATOM 0 H ILE B 95 2.675 22.570 3.512 1.00 0.65 H new ATOM 0 HA ILE B 95 3.744 23.896 5.922 1.00 0.66 H new ATOM 0 HB ILE B 95 2.315 22.153 7.232 1.00 0.74 H new ATOM 0 HG12 ILE B 95 0.617 22.278 4.713 1.00 0.83 H new ATOM 0 HG13 ILE B 95 1.588 20.897 5.182 1.00 0.83 H new ATOM 0 HG21 ILE B 95 0.405 23.733 7.356 1.00 0.84 H new ATOM 0 HG22 ILE B 95 1.967 24.585 7.359 1.00 0.84 H new ATOM 0 HG23 ILE B 95 0.983 24.536 5.877 1.00 0.84 H new ATOM 0 HD11 ILE B 95 -0.759 20.564 5.790 1.00 1.04 H new ATOM 0 HD12 ILE B 95 0.255 20.645 7.250 1.00 1.04 H new ATOM 0 HD13 ILE B 95 -0.731 22.047 6.773 1.00 1.04 H new ATOM 3212 N ARG B 96 5.307 21.950 6.338 1.00 0.70 N ATOM 3213 CA ARG B 96 6.330 20.898 6.465 1.00 0.79 C ATOM 3214 C ARG B 96 6.698 20.643 7.947 1.00 0.79 C ATOM 3215 O ARG B 96 7.879 20.490 8.284 1.00 1.02 O ATOM 3216 CB ARG B 96 7.580 21.270 5.624 1.00 0.99 C ATOM 3217 CG ARG B 96 8.244 22.603 6.004 1.00 1.12 C ATOM 3218 CD ARG B 96 9.558 22.830 5.249 1.00 1.41 C ATOM 3219 NE ARG B 96 10.626 21.901 5.670 1.00 1.59 N ATOM 3220 CZ ARG B 96 11.873 21.867 5.155 1.00 2.01 C ATOM 3221 NH1 ARG B 96 12.255 22.711 4.184 1.00 2.42 N ATOM 3222 NH2 ARG B 96 12.751 20.973 5.620 1.00 2.37 N ATOM 0 H ARG B 96 5.475 22.765 6.928 1.00 0.70 H new ATOM 0 HA ARG B 96 5.918 19.966 6.077 1.00 0.79 H new ATOM 0 HB2 ARG B 96 8.317 20.473 5.723 1.00 0.99 H new ATOM 0 HB3 ARG B 96 7.294 21.310 4.573 1.00 0.99 H new ATOM 0 HG2 ARG B 96 7.558 23.423 5.791 1.00 1.12 H new ATOM 0 HG3 ARG B 96 8.436 22.619 7.077 1.00 1.12 H new ATOM 0 HD2 ARG B 96 9.382 22.714 4.180 1.00 1.41 H new ATOM 0 HD3 ARG B 96 9.891 23.856 5.408 1.00 1.41 H new ATOM 0 HE ARG B 96 10.404 21.233 6.408 1.00 1.59 H new ATOM 0 HH11 ARG B 96 11.597 23.399 3.818 1.00 2.42 H new ATOM 0 HH12 ARG B 96 13.204 22.665 3.812 1.00 2.42 H new ATOM 0 HH21 ARG B 96 12.476 20.324 6.358 1.00 2.37 H new ATOM 0 HH22 ARG B 96 13.696 20.939 5.237 1.00 2.37 H new ATOM 3236 N LYS B 97 5.678 20.589 8.833 1.00 0.72 N ATOM 3237 CA LYS B 97 5.902 20.347 10.272 1.00 0.76 C ATOM 3238 C LYS B 97 4.610 19.886 10.984 1.00 0.76 C ATOM 3239 O LYS B 97 3.838 20.704 11.501 1.00 1.04 O ATOM 3240 CB LYS B 97 6.526 21.591 10.969 1.00 0.89 C ATOM 3241 CG LYS B 97 5.773 22.916 10.763 1.00 0.94 C ATOM 3242 CD LYS B 97 6.542 24.121 11.326 1.00 1.16 C ATOM 3243 CE LYS B 97 6.378 24.291 12.844 1.00 1.49 C ATOM 3244 NZ LYS B 97 7.339 23.465 13.637 1.00 1.86 N ATOM 0 H LYS B 97 4.698 20.709 8.577 1.00 0.72 H new ATOM 0 HA LYS B 97 6.621 19.532 10.353 1.00 0.76 H new ATOM 0 HB2 LYS B 97 6.589 21.392 12.039 1.00 0.89 H new ATOM 0 HB3 LYS B 97 7.547 21.714 10.607 1.00 0.89 H new ATOM 0 HG2 LYS B 97 5.595 23.068 9.698 1.00 0.94 H new ATOM 0 HG3 LYS B 97 4.797 22.855 11.244 1.00 0.94 H new ATOM 0 HD2 LYS B 97 7.601 24.009 11.092 1.00 1.16 H new ATOM 0 HD3 LYS B 97 6.199 25.027 10.827 1.00 1.16 H new ATOM 0 HE2 LYS B 97 6.513 25.341 13.102 1.00 1.49 H new ATOM 0 HE3 LYS B 97 5.360 24.022 13.125 1.00 1.49 H new ATOM 0 HZ1 LYS B 97 7.552 23.946 14.534 1.00 1.86 H new ATOM 0 HZ2 LYS B 97 6.917 22.535 13.834 1.00 1.86 H new ATOM 0 HZ3 LYS B 97 8.218 23.339 13.095 1.00 1.86 H new ATOM 3258 N LYS B 98 4.370 18.558 10.978 1.00 0.71 N ATOM 3259 CA LYS B 98 3.189 17.962 11.630 1.00 0.74 C ATOM 3260 C LYS B 98 3.463 16.491 11.991 1.00 0.90 C ATOM 3261 O LYS B 98 3.894 16.235 13.135 1.00 1.07 O ATOM 3262 CB LYS B 98 1.937 18.095 10.727 1.00 0.96 C ATOM 3263 CG LYS B 98 0.618 17.749 11.429 1.00 1.08 C ATOM 3264 CD LYS B 98 -0.603 18.015 10.542 1.00 1.52 C ATOM 3265 CE LYS B 98 -1.921 17.717 11.263 1.00 1.69 C ATOM 3266 NZ LYS B 98 -2.210 18.687 12.365 1.00 1.85 N ATOM 3267 OXT LYS B 98 3.256 15.612 11.124 1.00 1.15 O ATOM 0 H LYS B 98 4.982 17.878 10.527 1.00 0.71 H new ATOM 0 HA LYS B 98 2.990 18.506 12.553 1.00 0.74 H new ATOM 0 HB2 LYS B 98 1.879 19.117 10.353 1.00 0.96 H new ATOM 0 HB3 LYS B 98 2.056 17.444 9.861 1.00 0.96 H new ATOM 0 HG2 LYS B 98 0.630 16.699 11.721 1.00 1.08 H new ATOM 0 HG3 LYS B 98 0.533 18.334 12.345 1.00 1.08 H new ATOM 0 HD2 LYS B 98 -0.595 19.056 10.220 1.00 1.52 H new ATOM 0 HD3 LYS B 98 -0.537 17.402 9.643 1.00 1.52 H new ATOM 0 HE2 LYS B 98 -2.738 17.739 10.542 1.00 1.69 H new ATOM 0 HE3 LYS B 98 -1.886 16.708 11.673 1.00 1.69 H new ATOM 0 HZ1 LYS B 98 -3.136 18.469 12.785 1.00 1.85 H new ATOM 0 HZ2 LYS B 98 -1.473 18.613 13.095 1.00 1.85 H new ATOM 0 HZ3 LYS B 98 -2.222 19.654 11.982 1.00 1.85 H new TER 3281 LYS B 98 HETATM 3282 NAA ANW A 99 13.390 15.589 10.483 1.00 4.56 N HETATM 3283 NAB ANW A 99 14.667 16.781 8.952 1.00 6.22 N HETATM 3284 CAC ANW A 99 7.775 10.283 13.977 1.00 5.26 C HETATM 3285 CAD ANW A 99 9.004 9.971 13.119 1.00 4.51 C HETATM 3286 CAE ANW A 99 9.907 8.986 13.866 1.00 5.16 C HETATM 3287 CAF ANW A 99 9.702 11.144 12.851 1.00 3.64 C HETATM 3288 CAG ANW A 99 9.937 11.516 11.531 1.00 3.13 C HETATM 3289 CAH ANW A 99 10.662 12.669 11.250 1.00 2.76 C HETATM 3290 CAI ANW A 99 11.159 13.449 12.287 1.00 3.04 C HETATM 3291 CAJ ANW A 99 10.909 13.090 13.607 1.00 3.59 C HETATM 3292 CAK ANW A 99 10.185 11.936 13.887 1.00 3.84 C HETATM 3293 CAL ANW A 99 12.470 14.645 10.731 1.00 3.63 C HETATM 3294 CAM ANW A 99 13.590 16.054 9.242 1.00 5.17 C HETATM 3295 CAN ANW A 99 12.847 15.580 8.167 1.00 5.05 C HETATM 3296 CAO ANW A 99 11.888 14.604 8.400 1.00 4.25 C HETATM 3297 CAP ANW A 99 11.698 14.134 9.694 1.00 3.42 C HETATM 3298 CAQ ANW A 99 10.858 13.055 9.931 1.00 3.01 C HETATM 3299 CAR ANW A 99 12.949 16.168 6.910 1.00 6.05 C HETATM 3300 OAS ANW A 99 12.060 14.438 12.016 1.00 3.49 O HETATM 3301 OAT ANW A 99 10.281 12.484 9.009 1.00 3.52 O HETATM 3302 OAU ANW A 99 12.333 15.674 5.941 1.00 6.33 O HETATM 3303 OAV ANW A 99 13.636 17.200 6.751 1.00 6.88 O HETATM 0 HOAV ANW A 99 13.782 17.352 5.794 1.00 6.88 H new HETATM 0 HNAB ANW A 99 15.352 16.990 9.678 1.00 6.22 H new HETATM 0 HNAA ANW A 99 14.807 17.129 8.003 1.00 6.22 H new HETATM 0 HAEB ANW A 99 10.225 9.428 14.810 1.00 5.16 H new HETATM 0 HAEA ANW A 99 9.357 8.066 14.063 1.00 5.16 H new HETATM 0 HACB ANW A 99 7.226 9.362 14.174 1.00 5.26 H new HETATM 0 HACA ANW A 99 8.093 10.725 14.921 1.00 5.26 H new HETATM 0 HAO ANW A 99 11.291 14.211 7.577 1.00 4.25 H new HETATM 0 HAK ANW A 99 9.996 11.651 14.922 1.00 3.84 H new HETATM 0 HAJ ANW A 99 11.280 13.712 14.421 1.00 3.59 H new HETATM 0 HAG ANW A 99 9.552 10.903 10.716 1.00 3.13 H new HETATM 0 HAE ANW A 99 10.783 8.762 13.257 1.00 5.16 H new HETATM 0 HAD ANW A 99 8.686 9.526 12.176 1.00 4.51 H new HETATM 0 HAC ANW A 99 7.130 10.984 13.447 1.00 5.26 H new HETATM 3317 NAA ANW B 99 -11.551 -16.130 1.953 1.00 4.81 N HETATM 3318 NAB ANW B 99 -12.814 -17.344 0.429 1.00 6.57 N HETATM 3319 CAC ANW B 99 -10.510 -10.478 8.092 1.00 5.53 C HETATM 3320 CAD ANW B 99 -10.165 -11.966 8.212 1.00 4.77 C HETATM 3321 CAE ANW B 99 -8.737 -12.121 8.744 1.00 5.55 C HETATM 3322 CAF ANW B 99 -10.275 -12.584 6.973 1.00 3.85 C HETATM 3323 CAG ANW B 99 -11.155 -13.651 6.814 1.00 3.21 C HETATM 3324 CAH ANW B 99 -11.300 -14.259 5.573 1.00 2.83 C HETATM 3325 CAI ANW B 99 -10.559 -13.802 4.487 1.00 3.21 C HETATM 3326 CAJ ANW B 99 -9.672 -12.742 4.647 1.00 3.83 C HETATM 3327 CAK ANW B 99 -9.533 -12.133 5.888 1.00 4.12 C HETATM 3328 CAL ANW B 99 -11.481 -15.507 3.138 1.00 3.82 C HETATM 3329 CAM ANW B 99 -12.532 -17.004 1.682 1.00 5.45 C HETATM 3330 CAN ANW B 99 -13.499 -17.312 2.632 1.00 5.26 C HETATM 3331 CAO ANW B 99 -13.457 -16.664 3.863 1.00 4.33 C HETATM 3332 CAP ANW B 99 -12.437 -15.756 4.117 1.00 3.50 C HETATM 3333 CAQ ANW B 99 -12.269 -15.236 5.393 1.00 3.00 C HETATM 3334 CAR ANW B 99 -14.363 -18.384 2.443 1.00 6.31 C HETATM 3335 OAS ANW B 99 -10.660 -14.429 3.281 1.00 3.68 O HETATM 3336 OAT ANW B 99 -12.948 -15.638 6.336 1.00 3.40 O HETATM 3337 OAU ANW B 99 -15.242 -18.635 3.296 1.00 6.52 O HETATM 3338 OAV ANW B 99 -14.257 -19.106 1.429 1.00 7.25 O HETATM 0 HOAV ANW B 99 -14.932 -19.816 1.461 1.00 7.25 H new HETATM 0 HNAB ANW B 99 -12.282 -16.939 -0.341 1.00 6.57 H new HETATM 0 HNAA ANW B 99 -13.563 -18.010 0.237 1.00 6.57 H new HETATM 0 HAEB ANW B 99 -8.039 -11.642 8.058 1.00 5.55 H new HETATM 0 HAEA ANW B 99 -8.661 -11.652 9.725 1.00 5.55 H new HETATM 0 HACB ANW B 99 -10.436 -10.007 9.072 1.00 5.53 H new HETATM 0 HACA ANW B 99 -9.814 -9.997 7.405 1.00 5.53 H new HETATM 0 HAO ANW B 99 -14.216 -16.867 4.619 1.00 4.33 H new HETATM 0 HAK ANW B 99 -8.841 -11.300 6.011 1.00 4.12 H new HETATM 0 HAJ ANW B 99 -9.086 -12.389 3.798 1.00 3.83 H new HETATM 0 HAG ANW B 99 -11.732 -14.011 7.666 1.00 3.21 H new HETATM 0 HAE ANW B 99 -8.493 -13.180 8.829 1.00 5.55 H new HETATM 0 HAD ANW B 99 -10.862 -12.438 8.904 1.00 4.77 H new HETATM 0 HAC ANW B 99 -11.526 -10.370 7.713 1.00 5.53 H new