USER MOD reduce.3.24.130724 H: found=0, std=0, add=1346, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1340 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 42 THR OG1 : rot 79:sc= 1.66 USER MOD Set 1.2: B 68 SER OG : rot 133:sc= 0.486 USER MOD Set 2.1: B 43 ASN : amide:sc= 0.875 X(o=1.9,f=1.5) USER MOD Set 2.2: B 47 GLN : amide:sc= 1.01 X(o=1.9,f=1.5) USER MOD Set 3.1: A 26 HIS : no HD1:sc= 0.467 K(o=-0.75,f=-11!) USER MOD Set 3.2: B 8 THR OG1 : rot 180:sc= 0 USER MOD Set 3.3: B 11 GLN : amide:sc= -1.22 K(o=-0.75,f=1.7) USER MOD Set 4.1: A 29 SER OG : rot 177:sc= 1.6 USER MOD Set 4.2: B 7 TYR OH : rot 130:sc= 0.885 USER MOD Set 5.1: A 35 MET CE :methyl 144:sc= -0.793 (180deg=-3.74!) USER MOD Set 5.2: B 4 THR OG1 : rot -110:sc= 0.911 USER MOD Set 6.1: A 7 TYR OH : rot 80:sc= 0.801 USER MOD Set 6.2: B 29 SER OG : rot -170:sc= 1.5 USER MOD Set 7.1: A 1 MET CE :methyl -158:sc=-0.00881 (180deg=-0.159) USER MOD Set 7.2: A 67 SER OG : rot -82:sc= 0.989 USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.119 USER MOD Single : A 5 SER OG : rot 140:sc= 1.32 USER MOD Single : A 6 LYS NZ :NH3+ -166:sc= 1.8 (180deg=1.32) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ -107:sc= 0.597 (180deg=0.228) USER MOD Single : A 25 LYS NZ :NH3+ -170:sc= 1.19 (180deg=1.12) USER MOD Single : A 33 THR OG1 : rot 78:sc= 1.28 USER MOD Single : A 39 ASN : amide:sc= -1.04 X(o=-1,f=-1.3) USER MOD Single : A 43 ASN : amide:sc= 0.981 K(o=0.98,f=-4.5!) USER MOD Single : A 46 ASN : amide:sc= -0.919 K(o=-0.92,f=0) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -5.46! K(o=-5.5!,f=-1.1) USER MOD Single : A 55 LYS NZ :NH3+ -177:sc= 0.869 (180deg=0.81) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= -1.39! K(o=-1.4!,f=-0.095) USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 SER OG : rot 82:sc= 1.26 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0047 USER MOD Single : A 75 HIS : no HD1:sc=-0.000764 X(o=-0.00076,f=-0.01) USER MOD Single : A 78 HIS : no HD1:sc= -0.112 X(o=-0.11,f=0) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=-0.0075) USER MOD Single : A 80 HIS : no HD1:sc= -0.237 X(o=-0.24,f=-0.25) USER MOD Single : A 81 HIS : no HE2:sc= 1.11 K(o=1.1,f=-4.6!) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 83 HIS : no HD1:sc= -0.306 X(o=-0.31,f=-0.046) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -129:sc= 0.0675 (180deg=-0.0739) USER MOD Single : B 5 SER OG : rot -2:sc= 0.972 USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ 166:sc= 1.27 (180deg=0.785) USER MOD Single : B 25 LYS NZ :NH3+ -164:sc= -0.0507 (180deg=-0.306) USER MOD Single : B 26 HIS : no HD1:sc= -0.511 K(o=-0.51,f=0.13) USER MOD Single : B 33 THR OG1 : rot 74:sc= 1.25 USER MOD Single : B 35 MET CE :methyl -138:sc= -1.49 (180deg=-3.15!) USER MOD Single : B 39 ASN : amide:sc= 1.11 K(o=1.1,f=-0.0099) USER MOD Single : B 42 THR OG1 : rot 66:sc= 1.2 USER MOD Single : B 46 ASN : amide:sc= -1.15 K(o=-1.1,f=-0.17) USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD Single : B 53 GLN : amide:sc= -0.86 K(o=-0.86,f=-0.19) USER MOD Single : B 55 LYS NZ :NH3+ 173:sc= 1.09 (180deg=0.931) USER MOD Single : B 60 LYS NZ :NH3+ 157:sc= -0.0634 (180deg=-0.975) USER MOD Single : B 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 66 MET CE :methyl 172:sc= 0 (180deg=-0.162) USER MOD Single : B 67 SER OG : rot 180:sc= 0 USER MOD Single : B 71 THR OG1 : rot 180:sc=0.000137 USER MOD Single : B 73 LYS NZ :NH3+ -161:sc= 1.06 (180deg=0.321) USER MOD Single : B 74 THR OG1 : rot -5:sc= 0.0187! USER MOD Single : B 75 HIS : no HD1:sc= -0.022 X(o=-0.022,f=-0.022) USER MOD Single : B 78 HIS : no HD1:sc= -0.0336 X(o=-0.034,f=-0.034) USER MOD Single : B 79 HIS : no HE2:sc= 0.539 K(o=0.54,f=-4.9!) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 81 HIS : no HD1:sc= 0.93 K(o=0.93,f=-3.3!) USER MOD Single : B 82 HIS : no HD1:sc= -0.31 X(o=-0.31,f=-0.011) USER MOD Single : B 83 HIS : no HD1:sc= -0.0684 X(o=-0.068,f=-0.015) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.858 -6.090 10.182 1.00 0.00 N ATOM 2 CA MET A 1 -6.066 -6.368 11.402 1.00 0.00 C ATOM 3 C MET A 1 -6.059 -5.151 12.319 1.00 0.00 C ATOM 4 O MET A 1 -5.455 -4.129 12.003 1.00 0.00 O ATOM 5 CB MET A 1 -4.632 -6.763 11.040 1.00 0.00 C ATOM 6 CG MET A 1 -4.507 -8.157 10.448 1.00 0.00 C ATOM 7 SD MET A 1 -2.791 -8.637 10.175 1.00 0.00 S ATOM 8 CE MET A 1 -3.002 -10.297 9.537 1.00 0.00 C ATOM 0 H1 MET A 1 -6.854 -6.928 9.567 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.837 -5.861 10.448 1.00 0.00 H new ATOM 0 H3 MET A 1 -6.440 -5.285 9.673 1.00 0.00 H new ATOM 0 HA MET A 1 -6.532 -7.202 11.927 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.235 -6.040 10.328 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.012 -6.702 11.935 1.00 0.00 H new ATOM 0 HG2 MET A 1 -4.981 -8.876 11.116 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.047 -8.197 9.502 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.082 -10.863 9.684 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.819 -10.789 10.065 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.234 -10.251 8.473 1.00 0.00 H new ATOM 17 N PRO A 2 -6.729 -5.255 13.476 1.00 0.00 N ATOM 18 CA PRO A 2 -6.930 -4.135 14.390 1.00 0.00 C ATOM 19 C PRO A 2 -5.861 -4.019 15.482 1.00 0.00 C ATOM 20 O PRO A 2 -6.176 -3.715 16.634 1.00 0.00 O ATOM 21 CB PRO A 2 -8.281 -4.479 15.007 1.00 0.00 C ATOM 22 CG PRO A 2 -8.327 -5.975 15.040 1.00 0.00 C ATOM 23 CD PRO A 2 -7.373 -6.479 13.984 1.00 0.00 C ATOM 0 HA PRO A 2 -6.877 -3.175 13.876 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -8.375 -4.060 16.009 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -9.100 -4.073 14.414 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -8.041 -6.346 16.024 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -9.338 -6.332 14.846 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -6.642 -7.171 14.403 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -7.899 -7.012 13.192 1.00 0.00 H new ATOM 31 N ILE A 3 -4.602 -4.242 15.127 1.00 0.00 N ATOM 32 CA ILE A 3 -3.514 -4.078 16.089 1.00 0.00 C ATOM 33 C ILE A 3 -2.888 -2.698 15.917 1.00 0.00 C ATOM 34 O ILE A 3 -2.143 -2.221 16.775 1.00 0.00 O ATOM 35 CB ILE A 3 -2.396 -5.142 15.936 1.00 0.00 C ATOM 36 CG1 ILE A 3 -2.964 -6.508 15.541 1.00 0.00 C ATOM 37 CG2 ILE A 3 -1.603 -5.267 17.230 1.00 0.00 C ATOM 38 CD1 ILE A 3 -3.044 -6.714 14.046 1.00 0.00 C ATOM 0 H ILE A 3 -4.309 -4.533 14.194 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.954 -4.199 17.079 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.735 -4.808 15.136 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.343 -7.291 15.976 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -3.960 -6.617 15.969 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.822 -6.017 17.107 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.148 -4.306 17.472 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.270 -5.567 18.038 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.455 -7.702 13.836 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -3.689 -5.952 13.608 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.046 -6.637 13.614 1.00 0.00 H new ATOM 50 N THR A 4 -3.211 -2.062 14.799 1.00 0.00 N ATOM 51 CA THR A 4 -2.633 -0.781 14.438 1.00 0.00 C ATOM 52 C THR A 4 -3.004 0.309 15.444 1.00 0.00 C ATOM 53 O THR A 4 -4.063 0.252 16.071 1.00 0.00 O ATOM 54 CB THR A 4 -3.113 -0.372 13.037 1.00 0.00 C ATOM 55 OG1 THR A 4 -3.573 -1.537 12.334 1.00 0.00 O ATOM 56 CG2 THR A 4 -1.986 0.275 12.254 1.00 0.00 C ATOM 0 H THR A 4 -3.881 -2.422 14.119 1.00 0.00 H new ATOM 0 HA THR A 4 -1.549 -0.890 14.444 1.00 0.00 H new ATOM 0 HB THR A 4 -3.925 0.347 13.141 1.00 0.00 H new ATOM 0 HG1 THR A 4 -3.882 -1.279 11.440 1.00 0.00 H new ATOM 0 HG21 THR A 4 -2.346 0.558 11.265 1.00 0.00 H new ATOM 0 HG22 THR A 4 -1.640 1.164 12.782 1.00 0.00 H new ATOM 0 HG23 THR A 4 -1.162 -0.431 12.152 1.00 0.00 H new ATOM 64 N SER A 5 -2.112 1.282 15.605 1.00 0.00 N ATOM 65 CA SER A 5 -2.329 2.397 16.520 1.00 0.00 C ATOM 66 C SER A 5 -3.640 3.111 16.232 1.00 0.00 C ATOM 67 O SER A 5 -3.884 3.568 15.112 1.00 0.00 O ATOM 68 CB SER A 5 -1.155 3.370 16.424 1.00 0.00 C ATOM 69 OG SER A 5 0.069 2.689 16.643 1.00 0.00 O ATOM 0 H SER A 5 -1.223 1.320 15.107 1.00 0.00 H new ATOM 0 HA SER A 5 -2.392 2.003 17.534 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.145 3.843 15.442 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.273 4.166 17.159 1.00 0.00 H new ATOM 0 HG SER A 5 0.749 3.033 16.027 1.00 0.00 H new ATOM 75 N LYS A 6 -4.481 3.187 17.254 1.00 0.00 N ATOM 76 CA LYS A 6 -5.766 3.840 17.139 1.00 0.00 C ATOM 77 C LYS A 6 -5.592 5.339 17.334 1.00 0.00 C ATOM 78 O LYS A 6 -5.569 5.843 18.457 1.00 0.00 O ATOM 79 CB LYS A 6 -6.766 3.247 18.152 1.00 0.00 C ATOM 80 CG LYS A 6 -8.210 3.709 17.969 1.00 0.00 C ATOM 81 CD LYS A 6 -8.491 5.020 18.694 1.00 0.00 C ATOM 82 CE LYS A 6 -9.905 5.522 18.437 1.00 0.00 C ATOM 83 NZ LYS A 6 -10.127 5.863 17.005 1.00 0.00 N ATOM 0 H LYS A 6 -4.289 2.799 18.178 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.174 3.668 16.143 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -6.735 2.160 18.079 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -6.440 3.508 19.159 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.419 3.832 16.906 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.886 2.939 18.340 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.345 4.880 19.765 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.774 5.774 18.370 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -10.621 4.759 18.743 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -10.094 6.402 19.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -11.003 6.415 16.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -9.325 6.424 16.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -10.208 4.988 16.448 1.00 0.00 H new ATOM 97 N TYR A 7 -5.389 6.031 16.229 1.00 0.00 N ATOM 98 CA TYR A 7 -5.359 7.487 16.231 1.00 0.00 C ATOM 99 C TYR A 7 -6.776 8.039 16.127 1.00 0.00 C ATOM 100 O TYR A 7 -7.760 7.296 16.237 1.00 0.00 O ATOM 101 CB TYR A 7 -4.530 8.019 15.058 1.00 0.00 C ATOM 102 CG TYR A 7 -3.079 7.605 15.072 1.00 0.00 C ATOM 103 CD1 TYR A 7 -2.208 8.079 16.045 1.00 0.00 C ATOM 104 CD2 TYR A 7 -2.576 6.754 14.100 1.00 0.00 C ATOM 105 CE1 TYR A 7 -0.878 7.711 16.049 1.00 0.00 C ATOM 106 CE2 TYR A 7 -1.248 6.384 14.095 1.00 0.00 C ATOM 107 CZ TYR A 7 -0.402 6.865 15.070 1.00 0.00 C ATOM 108 OH TYR A 7 0.924 6.502 15.062 1.00 0.00 O ATOM 0 H TYR A 7 -5.241 5.609 15.312 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.901 7.812 17.166 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -4.982 7.677 14.127 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -4.583 9.108 15.058 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -2.577 8.746 16.810 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -3.236 6.374 13.334 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -0.214 8.084 16.815 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -0.873 5.720 13.330 1.00 0.00 H new ATOM 0 HH TYR A 7 1.072 5.788 15.717 1.00 0.00 H new ATOM 118 N THR A 8 -6.878 9.344 15.917 1.00 0.00 N ATOM 119 CA THR A 8 -8.157 9.975 15.660 1.00 0.00 C ATOM 120 C THR A 8 -8.745 9.425 14.362 1.00 0.00 C ATOM 121 O THR A 8 -8.180 9.615 13.285 1.00 0.00 O ATOM 122 CB THR A 8 -8.001 11.504 15.557 1.00 0.00 C ATOM 123 OG1 THR A 8 -7.285 11.997 16.700 1.00 0.00 O ATOM 124 CG2 THR A 8 -9.354 12.192 15.467 1.00 0.00 C ATOM 0 H THR A 8 -6.085 9.985 15.920 1.00 0.00 H new ATOM 0 HA THR A 8 -8.829 9.754 16.489 1.00 0.00 H new ATOM 0 HB THR A 8 -7.443 11.727 14.647 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.186 12.969 16.630 1.00 0.00 H new ATOM 0 HG21 THR A 8 -9.210 13.270 15.395 1.00 0.00 H new ATOM 0 HG22 THR A 8 -9.884 11.837 14.583 1.00 0.00 H new ATOM 0 HG23 THR A 8 -9.939 11.962 16.358 1.00 0.00 H new ATOM 132 N ASP A 9 -9.869 8.729 14.468 1.00 0.00 N ATOM 133 CA ASP A 9 -10.456 8.054 13.312 1.00 0.00 C ATOM 134 C ASP A 9 -10.929 9.043 12.253 1.00 0.00 C ATOM 135 O ASP A 9 -10.819 8.768 11.060 1.00 0.00 O ATOM 136 CB ASP A 9 -11.594 7.115 13.731 1.00 0.00 C ATOM 137 CG ASP A 9 -12.507 7.714 14.778 1.00 0.00 C ATOM 138 OD1 ASP A 9 -13.337 8.576 14.431 1.00 0.00 O ATOM 139 OD2 ASP A 9 -12.384 7.330 15.962 1.00 0.00 O ATOM 0 H ASP A 9 -10.392 8.616 15.336 1.00 0.00 H new ATOM 0 HA ASP A 9 -9.667 7.450 12.864 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -12.183 6.854 12.852 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -11.168 6.189 14.117 1.00 0.00 H new ATOM 144 N GLU A 10 -11.439 10.195 12.677 1.00 0.00 N ATOM 145 CA GLU A 10 -11.819 11.229 11.721 1.00 0.00 C ATOM 146 C GLU A 10 -10.591 11.793 11.025 1.00 0.00 C ATOM 147 O GLU A 10 -10.634 12.093 9.836 1.00 0.00 O ATOM 148 CB GLU A 10 -12.605 12.359 12.380 1.00 0.00 C ATOM 149 CG GLU A 10 -14.065 12.025 12.625 1.00 0.00 C ATOM 150 CD GLU A 10 -14.902 13.262 12.859 1.00 0.00 C ATOM 151 OE1 GLU A 10 -15.306 13.905 11.868 1.00 0.00 O ATOM 152 OE2 GLU A 10 -15.151 13.605 14.032 1.00 0.00 O ATOM 0 H GLU A 10 -11.596 10.434 13.656 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.468 10.757 10.983 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.135 12.611 13.331 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -12.545 13.247 11.750 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -14.460 11.478 11.769 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -14.145 11.365 13.489 1.00 0.00 H new ATOM 159 N GLN A 11 -9.499 11.926 11.769 1.00 0.00 N ATOM 160 CA GLN A 11 -8.240 12.391 11.201 1.00 0.00 C ATOM 161 C GLN A 11 -7.860 11.522 10.006 1.00 0.00 C ATOM 162 O GLN A 11 -7.678 12.023 8.899 1.00 0.00 O ATOM 163 CB GLN A 11 -7.130 12.357 12.259 1.00 0.00 C ATOM 164 CG GLN A 11 -5.759 12.733 11.724 1.00 0.00 C ATOM 165 CD GLN A 11 -4.658 12.498 12.741 1.00 0.00 C ATOM 166 OE1 GLN A 11 -4.089 11.411 12.814 1.00 0.00 O ATOM 167 NE2 GLN A 11 -4.347 13.511 13.532 1.00 0.00 N ATOM 0 H GLN A 11 -9.460 11.718 12.767 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.363 13.421 10.866 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -7.392 13.038 13.069 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -7.080 11.356 12.687 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.550 12.152 10.826 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -5.761 13.783 11.431 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -4.841 14.399 13.442 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -3.613 13.405 14.232 1.00 0.00 H new ATOM 176 N VAL A 12 -7.781 10.216 10.238 1.00 0.00 N ATOM 177 CA VAL A 12 -7.457 9.262 9.184 1.00 0.00 C ATOM 178 C VAL A 12 -8.460 9.353 8.033 1.00 0.00 C ATOM 179 O VAL A 12 -8.077 9.468 6.867 1.00 0.00 O ATOM 180 CB VAL A 12 -7.452 7.816 9.721 1.00 0.00 C ATOM 181 CG1 VAL A 12 -7.010 6.847 8.635 1.00 0.00 C ATOM 182 CG2 VAL A 12 -6.561 7.694 10.949 1.00 0.00 C ATOM 0 H VAL A 12 -7.938 9.792 11.152 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.461 9.517 8.821 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.469 7.559 10.018 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -7.012 5.831 9.031 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.697 6.909 7.791 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.004 7.105 8.304 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.575 6.665 11.308 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.540 7.973 10.687 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -6.929 8.357 11.733 1.00 0.00 H new ATOM 192 N GLU A 13 -9.742 9.319 8.385 1.00 0.00 N ATOM 193 CA GLU A 13 -10.830 9.365 7.412 1.00 0.00 C ATOM 194 C GLU A 13 -10.717 10.594 6.508 1.00 0.00 C ATOM 195 O GLU A 13 -10.852 10.501 5.286 1.00 0.00 O ATOM 196 CB GLU A 13 -12.173 9.378 8.157 1.00 0.00 C ATOM 197 CG GLU A 13 -13.395 9.401 7.256 1.00 0.00 C ATOM 198 CD GLU A 13 -13.511 8.167 6.385 1.00 0.00 C ATOM 199 OE1 GLU A 13 -13.758 7.070 6.926 1.00 0.00 O ATOM 200 OE2 GLU A 13 -13.382 8.292 5.151 1.00 0.00 O ATOM 0 H GLU A 13 -10.056 9.259 9.353 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.767 8.481 6.777 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -12.227 8.498 8.798 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -12.203 10.250 8.810 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -14.291 9.491 7.870 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -13.354 10.285 6.620 1.00 0.00 H new ATOM 207 N LYS A 14 -10.445 11.740 7.113 1.00 0.00 N ATOM 208 CA LYS A 14 -10.393 12.994 6.378 1.00 0.00 C ATOM 209 C LYS A 14 -9.111 13.103 5.560 1.00 0.00 C ATOM 210 O LYS A 14 -9.106 13.705 4.488 1.00 0.00 O ATOM 211 CB LYS A 14 -10.548 14.190 7.328 1.00 0.00 C ATOM 212 CG LYS A 14 -12.004 14.556 7.620 1.00 0.00 C ATOM 213 CD LYS A 14 -12.777 13.396 8.232 1.00 0.00 C ATOM 214 CE LYS A 14 -14.271 13.678 8.308 1.00 0.00 C ATOM 215 NZ LYS A 14 -14.590 14.830 9.192 1.00 0.00 N ATOM 0 H LYS A 14 -10.257 11.827 8.112 1.00 0.00 H new ATOM 0 HA LYS A 14 -11.230 13.008 5.680 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -10.043 13.965 8.268 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -10.045 15.055 6.895 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -12.033 15.408 8.299 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -12.491 14.868 6.696 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.608 12.496 7.640 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.395 13.195 9.233 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.651 13.877 7.306 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -14.787 12.790 8.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.016 14.483 10.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -13.717 15.352 9.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -15.260 15.463 8.710 1.00 0.00 H new ATOM 229 N ILE A 15 -8.028 12.510 6.053 1.00 0.00 N ATOM 230 CA ILE A 15 -6.788 12.460 5.287 1.00 0.00 C ATOM 231 C ILE A 15 -6.989 11.635 4.021 1.00 0.00 C ATOM 232 O ILE A 15 -6.615 12.059 2.927 1.00 0.00 O ATOM 233 CB ILE A 15 -5.618 11.865 6.101 1.00 0.00 C ATOM 234 CG1 ILE A 15 -5.286 12.758 7.297 1.00 0.00 C ATOM 235 CG2 ILE A 15 -4.390 11.690 5.218 1.00 0.00 C ATOM 236 CD1 ILE A 15 -4.185 12.210 8.182 1.00 0.00 C ATOM 0 H ILE A 15 -7.983 12.062 6.968 1.00 0.00 H new ATOM 0 HA ILE A 15 -6.529 13.488 5.032 1.00 0.00 H new ATOM 0 HB ILE A 15 -5.923 10.887 6.473 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.991 13.742 6.933 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -6.186 12.896 7.896 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.575 11.270 5.807 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.627 11.016 4.394 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -4.088 12.658 4.819 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.006 12.898 9.008 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -4.485 11.239 8.577 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -3.271 12.098 7.599 1.00 0.00 H new ATOM 248 N LEU A 16 -7.607 10.468 4.177 1.00 0.00 N ATOM 249 CA LEU A 16 -7.894 9.588 3.050 1.00 0.00 C ATOM 250 C LEU A 16 -8.746 10.305 2.005 1.00 0.00 C ATOM 251 O LEU A 16 -8.559 10.116 0.802 1.00 0.00 O ATOM 252 CB LEU A 16 -8.609 8.323 3.532 1.00 0.00 C ATOM 253 CG LEU A 16 -7.781 7.403 4.427 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.636 6.261 4.946 1.00 0.00 C ATOM 255 CD2 LEU A 16 -6.580 6.868 3.667 1.00 0.00 C ATOM 0 H LEU A 16 -7.920 10.109 5.079 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.947 9.306 2.589 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.507 8.618 4.075 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.936 7.756 2.660 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.421 7.978 5.280 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.032 5.614 5.582 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.468 6.663 5.524 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.022 5.685 4.105 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.999 6.214 4.318 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.921 6.306 2.798 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.957 7.700 3.339 1.00 0.00 H new ATOM 267 N ALA A 17 -9.667 11.142 2.474 1.00 0.00 N ATOM 268 CA ALA A 17 -10.535 11.907 1.585 1.00 0.00 C ATOM 269 C ALA A 17 -9.715 12.880 0.746 1.00 0.00 C ATOM 270 O ALA A 17 -9.981 13.074 -0.442 1.00 0.00 O ATOM 271 CB ALA A 17 -11.590 12.652 2.390 1.00 0.00 C ATOM 0 H ALA A 17 -9.831 11.308 3.467 1.00 0.00 H new ATOM 0 HA ALA A 17 -11.039 11.215 0.911 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.231 13.219 1.714 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.194 11.937 2.948 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -11.102 13.335 3.085 1.00 0.00 H new ATOM 277 N GLU A 18 -8.709 13.474 1.372 1.00 0.00 N ATOM 278 CA GLU A 18 -7.815 14.390 0.684 1.00 0.00 C ATOM 279 C GLU A 18 -6.932 13.632 -0.303 1.00 0.00 C ATOM 280 O GLU A 18 -6.733 14.075 -1.433 1.00 0.00 O ATOM 281 CB GLU A 18 -6.944 15.141 1.690 1.00 0.00 C ATOM 282 CG GLU A 18 -7.730 16.019 2.649 1.00 0.00 C ATOM 283 CD GLU A 18 -8.468 17.138 1.945 1.00 0.00 C ATOM 284 OE1 GLU A 18 -7.814 18.120 1.536 1.00 0.00 O ATOM 285 OE2 GLU A 18 -9.705 17.049 1.811 1.00 0.00 O ATOM 0 H GLU A 18 -8.492 13.336 2.359 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.420 15.111 0.134 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.365 14.419 2.265 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.231 15.761 1.147 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.446 15.404 3.195 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -7.049 16.445 3.386 1.00 0.00 H new ATOM 292 N VAL A 19 -6.414 12.485 0.131 1.00 0.00 N ATOM 293 CA VAL A 19 -5.564 11.650 -0.716 1.00 0.00 C ATOM 294 C VAL A 19 -6.304 11.241 -1.987 1.00 0.00 C ATOM 295 O VAL A 19 -5.760 11.335 -3.088 1.00 0.00 O ATOM 296 CB VAL A 19 -5.083 10.384 0.030 1.00 0.00 C ATOM 297 CG1 VAL A 19 -4.259 9.486 -0.883 1.00 0.00 C ATOM 298 CG2 VAL A 19 -4.280 10.764 1.264 1.00 0.00 C ATOM 0 H VAL A 19 -6.569 12.111 1.067 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.691 12.246 -0.981 1.00 0.00 H new ATOM 0 HB VAL A 19 -5.965 9.827 0.345 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.935 8.604 -0.330 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -4.866 9.178 -1.734 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.385 10.032 -1.239 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.950 9.860 1.776 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.411 11.350 0.966 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.903 11.355 1.936 1.00 0.00 H new ATOM 308 N ALA A 20 -7.549 10.807 -1.826 1.00 0.00 N ATOM 309 CA ALA A 20 -8.381 10.434 -2.962 1.00 0.00 C ATOM 310 C ALA A 20 -8.613 11.633 -3.875 1.00 0.00 C ATOM 311 O ALA A 20 -8.543 11.518 -5.097 1.00 0.00 O ATOM 312 CB ALA A 20 -9.709 9.864 -2.486 1.00 0.00 C ATOM 0 H ALA A 20 -8.004 10.705 -0.919 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.858 9.665 -3.531 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.318 9.591 -3.348 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.527 8.980 -1.875 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.235 10.613 -1.893 1.00 0.00 H new ATOM 318 N LEU A 21 -8.860 12.787 -3.265 1.00 0.00 N ATOM 319 CA LEU A 21 -9.081 14.024 -4.006 1.00 0.00 C ATOM 320 C LEU A 21 -7.845 14.375 -4.838 1.00 0.00 C ATOM 321 O LEU A 21 -7.963 14.859 -5.965 1.00 0.00 O ATOM 322 CB LEU A 21 -9.436 15.153 -3.025 1.00 0.00 C ATOM 323 CG LEU A 21 -9.818 16.498 -3.651 1.00 0.00 C ATOM 324 CD1 LEU A 21 -10.869 17.194 -2.800 1.00 0.00 C ATOM 325 CD2 LEU A 21 -8.595 17.392 -3.791 1.00 0.00 C ATOM 0 H LEU A 21 -8.912 12.892 -2.252 1.00 0.00 H new ATOM 0 HA LEU A 21 -9.914 13.891 -4.696 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.265 14.817 -2.402 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.584 15.313 -2.364 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.228 16.309 -4.643 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -11.132 18.149 -3.255 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.758 16.566 -2.734 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -10.471 17.366 -1.800 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -8.888 18.342 -4.238 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.161 17.572 -2.807 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -7.858 16.903 -4.429 1.00 0.00 H new ATOM 337 N VAL A 22 -6.665 14.108 -4.284 1.00 0.00 N ATOM 338 CA VAL A 22 -5.408 14.340 -4.991 1.00 0.00 C ATOM 339 C VAL A 22 -5.317 13.458 -6.235 1.00 0.00 C ATOM 340 O VAL A 22 -4.846 13.892 -7.292 1.00 0.00 O ATOM 341 CB VAL A 22 -4.186 14.073 -4.078 1.00 0.00 C ATOM 342 CG1 VAL A 22 -2.888 14.132 -4.865 1.00 0.00 C ATOM 343 CG2 VAL A 22 -4.147 15.066 -2.926 1.00 0.00 C ATOM 0 H VAL A 22 -6.553 13.729 -3.344 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.394 15.388 -5.290 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.292 13.068 -3.670 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.048 13.941 -4.197 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.905 13.378 -5.652 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.778 15.120 -5.312 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.281 14.860 -2.297 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.076 16.079 -3.321 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.057 14.971 -2.333 1.00 0.00 H new ATOM 353 N LEU A 23 -5.791 12.228 -6.110 1.00 0.00 N ATOM 354 CA LEU A 23 -5.745 11.282 -7.210 1.00 0.00 C ATOM 355 C LEU A 23 -6.700 11.701 -8.321 1.00 0.00 C ATOM 356 O LEU A 23 -6.367 11.596 -9.504 1.00 0.00 O ATOM 357 CB LEU A 23 -6.065 9.871 -6.717 1.00 0.00 C ATOM 358 CG LEU A 23 -5.095 9.329 -5.664 1.00 0.00 C ATOM 359 CD1 LEU A 23 -5.423 7.891 -5.315 1.00 0.00 C ATOM 360 CD2 LEU A 23 -3.660 9.438 -6.153 1.00 0.00 C ATOM 0 H LEU A 23 -6.212 11.863 -5.256 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.735 11.278 -7.619 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.073 9.865 -6.301 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.069 9.194 -7.571 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.204 9.933 -4.763 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.720 7.529 -4.565 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.437 7.835 -4.919 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.349 7.273 -6.210 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.985 9.048 -5.391 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.543 8.861 -7.071 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.421 10.483 -6.349 1.00 0.00 H new ATOM 372 N GLU A 24 -7.877 12.191 -7.945 1.00 0.00 N ATOM 373 CA GLU A 24 -8.825 12.720 -8.920 1.00 0.00 C ATOM 374 C GLU A 24 -8.257 13.953 -9.627 1.00 0.00 C ATOM 375 O GLU A 24 -8.497 14.159 -10.816 1.00 0.00 O ATOM 376 CB GLU A 24 -10.165 13.064 -8.264 1.00 0.00 C ATOM 377 CG GLU A 24 -11.176 11.928 -8.293 1.00 0.00 C ATOM 378 CD GLU A 24 -10.896 10.840 -7.276 1.00 0.00 C ATOM 379 OE1 GLU A 24 -9.990 10.010 -7.512 1.00 0.00 O ATOM 380 OE2 GLU A 24 -11.604 10.797 -6.248 1.00 0.00 O ATOM 0 H GLU A 24 -8.196 12.233 -6.977 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.995 11.940 -9.662 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -9.987 13.353 -7.228 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.593 13.931 -8.768 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.171 12.334 -8.113 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.187 11.488 -9.290 1.00 0.00 H new ATOM 387 N LYS A 25 -7.482 14.755 -8.895 1.00 0.00 N ATOM 388 CA LYS A 25 -6.840 15.947 -9.462 1.00 0.00 C ATOM 389 C LYS A 25 -5.895 15.578 -10.602 1.00 0.00 C ATOM 390 O LYS A 25 -5.536 16.426 -11.419 1.00 0.00 O ATOM 391 CB LYS A 25 -6.058 16.709 -8.385 1.00 0.00 C ATOM 392 CG LYS A 25 -6.929 17.410 -7.356 1.00 0.00 C ATOM 393 CD LYS A 25 -6.106 17.919 -6.181 1.00 0.00 C ATOM 394 CE LYS A 25 -5.156 19.036 -6.580 1.00 0.00 C ATOM 395 NZ LYS A 25 -4.196 19.347 -5.488 1.00 0.00 N ATOM 0 H LYS A 25 -7.282 14.602 -7.907 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.632 16.585 -9.853 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -5.398 16.011 -7.870 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -5.422 17.450 -8.870 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.449 18.245 -7.826 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.693 16.721 -6.995 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -6.776 18.277 -5.400 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.534 17.094 -5.757 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.608 18.747 -7.477 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -5.727 19.930 -6.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -3.677 20.218 -5.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -4.715 19.481 -4.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -3.524 18.561 -5.382 1.00 0.00 H new ATOM 409 N HIS A 26 -5.477 14.319 -10.652 1.00 0.00 N ATOM 410 CA HIS A 26 -4.547 13.873 -11.681 1.00 0.00 C ATOM 411 C HIS A 26 -5.139 12.743 -12.515 1.00 0.00 C ATOM 412 O HIS A 26 -4.447 12.167 -13.355 1.00 0.00 O ATOM 413 CB HIS A 26 -3.226 13.416 -11.054 1.00 0.00 C ATOM 414 CG HIS A 26 -2.413 14.529 -10.464 1.00 0.00 C ATOM 415 ND1 HIS A 26 -1.386 15.146 -11.140 1.00 0.00 N ATOM 416 CD2 HIS A 26 -2.466 15.119 -9.245 1.00 0.00 C ATOM 417 CE1 HIS A 26 -0.841 16.066 -10.365 1.00 0.00 C ATOM 418 NE2 HIS A 26 -1.478 16.069 -9.208 1.00 0.00 N ATOM 0 H HIS A 26 -5.765 13.593 -9.996 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.357 14.721 -12.338 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.440 12.684 -10.275 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -2.631 12.909 -11.814 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.158 14.884 -8.450 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -0.014 16.707 -10.632 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -1.269 16.678 -8.417 1.00 0.00 H new ATOM 427 N ALA A 27 -6.420 12.440 -12.284 1.00 0.00 N ATOM 428 CA ALA A 27 -7.107 11.350 -12.983 1.00 0.00 C ATOM 429 C ALA A 27 -6.315 10.047 -12.876 1.00 0.00 C ATOM 430 O ALA A 27 -6.124 9.334 -13.864 1.00 0.00 O ATOM 431 CB ALA A 27 -7.340 11.721 -14.440 1.00 0.00 C ATOM 0 H ALA A 27 -7.005 12.938 -11.614 1.00 0.00 H new ATOM 0 HA ALA A 27 -8.075 11.193 -12.506 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -7.851 10.902 -14.947 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -7.954 12.620 -14.493 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -6.382 11.907 -14.926 1.00 0.00 H new ATOM 437 N ALA A 28 -5.872 9.741 -11.662 1.00 0.00 N ATOM 438 CA ALA A 28 -5.017 8.591 -11.417 1.00 0.00 C ATOM 439 C ALA A 28 -5.713 7.279 -11.762 1.00 0.00 C ATOM 440 O ALA A 28 -6.890 7.080 -11.457 1.00 0.00 O ATOM 441 CB ALA A 28 -4.562 8.577 -9.967 1.00 0.00 C ATOM 0 H ALA A 28 -6.095 10.281 -10.826 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.148 8.683 -12.069 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.922 7.711 -9.795 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -4.005 9.489 -9.752 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -5.432 8.521 -9.313 1.00 0.00 H new ATOM 447 N SER A 29 -4.973 6.398 -12.413 1.00 0.00 N ATOM 448 CA SER A 29 -5.454 5.066 -12.734 1.00 0.00 C ATOM 449 C SER A 29 -5.273 4.150 -11.524 1.00 0.00 C ATOM 450 O SER A 29 -4.527 4.488 -10.605 1.00 0.00 O ATOM 451 CB SER A 29 -4.670 4.524 -13.929 1.00 0.00 C ATOM 452 OG SER A 29 -3.274 4.577 -13.673 1.00 0.00 O ATOM 0 H SER A 29 -4.023 6.586 -12.733 1.00 0.00 H new ATOM 0 HA SER A 29 -6.513 5.106 -12.988 1.00 0.00 H new ATOM 0 HB2 SER A 29 -4.970 3.496 -14.132 1.00 0.00 H new ATOM 0 HB3 SER A 29 -4.905 5.106 -14.820 1.00 0.00 H new ATOM 0 HG SER A 29 -2.788 4.177 -14.424 1.00 0.00 H new ATOM 458 N PRO A 30 -5.954 2.992 -11.490 1.00 0.00 N ATOM 459 CA PRO A 30 -5.774 2.005 -10.418 1.00 0.00 C ATOM 460 C PRO A 30 -4.312 1.601 -10.265 1.00 0.00 C ATOM 461 O PRO A 30 -3.806 1.448 -9.152 1.00 0.00 O ATOM 462 CB PRO A 30 -6.615 0.814 -10.882 1.00 0.00 C ATOM 463 CG PRO A 30 -7.642 1.410 -11.780 1.00 0.00 C ATOM 464 CD PRO A 30 -6.967 2.562 -12.469 1.00 0.00 C ATOM 0 HA PRO A 30 -6.073 2.392 -9.444 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -6.006 0.079 -11.408 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.076 0.301 -10.038 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -8.001 0.678 -12.503 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.509 1.748 -11.212 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.512 2.257 -13.412 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -7.671 3.362 -12.699 1.00 0.00 H new ATOM 472 N GLU A 31 -3.642 1.458 -11.402 1.00 0.00 N ATOM 473 CA GLU A 31 -2.234 1.096 -11.438 1.00 0.00 C ATOM 474 C GLU A 31 -1.383 2.186 -10.790 1.00 0.00 C ATOM 475 O GLU A 31 -0.577 1.913 -9.899 1.00 0.00 O ATOM 476 CB GLU A 31 -1.804 0.867 -12.888 1.00 0.00 C ATOM 477 CG GLU A 31 -2.664 -0.165 -13.606 1.00 0.00 C ATOM 478 CD GLU A 31 -2.371 -0.257 -15.088 1.00 0.00 C ATOM 479 OE1 GLU A 31 -1.435 -0.982 -15.473 1.00 0.00 O ATOM 480 OE2 GLU A 31 -3.088 0.393 -15.880 1.00 0.00 O ATOM 0 H GLU A 31 -4.060 1.590 -12.323 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.087 0.175 -10.873 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.852 1.812 -13.429 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.764 0.541 -12.906 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.505 -1.142 -13.149 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -3.715 0.086 -13.465 1.00 0.00 H new ATOM 487 N LEU A 32 -1.593 3.426 -11.229 1.00 0.00 N ATOM 488 CA LEU A 32 -0.885 4.578 -10.677 1.00 0.00 C ATOM 489 C LEU A 32 -1.204 4.745 -9.190 1.00 0.00 C ATOM 490 O LEU A 32 -0.318 5.030 -8.384 1.00 0.00 O ATOM 491 CB LEU A 32 -1.269 5.846 -11.452 1.00 0.00 C ATOM 492 CG LEU A 32 -0.668 7.157 -10.934 1.00 0.00 C ATOM 493 CD1 LEU A 32 0.849 7.090 -10.922 1.00 0.00 C ATOM 494 CD2 LEU A 32 -1.142 8.326 -11.784 1.00 0.00 C ATOM 0 H LEU A 32 -2.253 3.659 -11.971 1.00 0.00 H new ATOM 0 HA LEU A 32 0.187 4.411 -10.778 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.969 5.717 -12.492 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.355 5.939 -11.443 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.008 7.308 -9.910 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.252 8.032 -10.550 1.00 0.00 H new ATOM 0 HD12 LEU A 32 1.172 6.276 -10.273 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.213 6.914 -11.934 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.708 9.251 -11.405 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.829 8.175 -12.817 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.229 8.391 -11.740 1.00 0.00 H new ATOM 506 N THR A 33 -2.469 4.543 -8.839 1.00 0.00 N ATOM 507 CA THR A 33 -2.926 4.664 -7.460 1.00 0.00 C ATOM 508 C THR A 33 -2.148 3.732 -6.531 1.00 0.00 C ATOM 509 O THR A 33 -1.683 4.142 -5.466 1.00 0.00 O ATOM 510 CB THR A 33 -4.430 4.337 -7.352 1.00 0.00 C ATOM 511 OG1 THR A 33 -5.197 5.259 -8.140 1.00 0.00 O ATOM 512 CG2 THR A 33 -4.898 4.381 -5.907 1.00 0.00 C ATOM 0 H THR A 33 -3.204 4.292 -9.500 1.00 0.00 H new ATOM 0 HA THR A 33 -2.752 5.696 -7.154 1.00 0.00 H new ATOM 0 HB THR A 33 -4.581 3.326 -7.732 1.00 0.00 H new ATOM 0 HG1 THR A 33 -5.142 5.006 -9.085 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.962 4.147 -5.862 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.340 3.650 -5.321 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.729 5.378 -5.500 1.00 0.00 H new ATOM 520 N LEU A 34 -1.990 2.484 -6.951 1.00 0.00 N ATOM 521 CA LEU A 34 -1.342 1.498 -6.114 1.00 0.00 C ATOM 522 C LEU A 34 0.155 1.762 -6.037 1.00 0.00 C ATOM 523 O LEU A 34 0.790 1.464 -5.028 1.00 0.00 O ATOM 524 CB LEU A 34 -1.600 0.087 -6.633 1.00 0.00 C ATOM 525 CG LEU A 34 -1.859 -0.951 -5.542 1.00 0.00 C ATOM 526 CD1 LEU A 34 -3.331 -0.985 -5.175 1.00 0.00 C ATOM 527 CD2 LEU A 34 -1.369 -2.323 -5.976 1.00 0.00 C ATOM 0 H LEU A 34 -2.300 2.138 -7.859 1.00 0.00 H new ATOM 0 HA LEU A 34 -1.765 1.579 -5.113 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -2.458 0.112 -7.305 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.742 -0.232 -7.224 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.298 -0.663 -4.653 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.495 -1.730 -4.397 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -3.638 -0.005 -4.809 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.920 -1.244 -6.055 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.564 -3.046 -5.184 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.894 -2.627 -6.882 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.298 -2.281 -6.174 1.00 0.00 H new ATOM 539 N MET A 35 0.722 2.328 -7.100 1.00 0.00 N ATOM 540 CA MET A 35 2.133 2.689 -7.086 1.00 0.00 C ATOM 541 C MET A 35 2.366 3.835 -6.111 1.00 0.00 C ATOM 542 O MET A 35 3.402 3.893 -5.454 1.00 0.00 O ATOM 543 CB MET A 35 2.635 3.075 -8.478 1.00 0.00 C ATOM 544 CG MET A 35 4.138 3.337 -8.519 1.00 0.00 C ATOM 545 SD MET A 35 4.755 3.712 -10.175 1.00 0.00 S ATOM 546 CE MET A 35 3.849 5.209 -10.542 1.00 0.00 C ATOM 0 H MET A 35 0.233 2.543 -7.969 1.00 0.00 H new ATOM 0 HA MET A 35 2.696 1.814 -6.763 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.392 2.277 -9.180 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.107 3.967 -8.814 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.373 4.169 -7.855 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.663 2.463 -8.133 1.00 0.00 H new ATOM 0 HE1 MET A 35 4.481 5.884 -11.119 1.00 0.00 H new ATOM 0 HE2 MET A 35 2.958 4.963 -11.120 1.00 0.00 H new ATOM 0 HE3 MET A 35 3.555 5.694 -9.611 1.00 0.00 H new ATOM 556 N ILE A 36 1.395 4.739 -6.016 1.00 0.00 N ATOM 557 CA ILE A 36 1.443 5.797 -5.016 1.00 0.00 C ATOM 558 C ILE A 36 1.561 5.175 -3.632 1.00 0.00 C ATOM 559 O ILE A 36 2.444 5.532 -2.850 1.00 0.00 O ATOM 560 CB ILE A 36 0.190 6.712 -5.062 1.00 0.00 C ATOM 561 CG1 ILE A 36 0.085 7.433 -6.409 1.00 0.00 C ATOM 562 CG2 ILE A 36 0.216 7.726 -3.927 1.00 0.00 C ATOM 563 CD1 ILE A 36 1.310 8.246 -6.768 1.00 0.00 C ATOM 0 H ILE A 36 0.571 4.759 -6.616 1.00 0.00 H new ATOM 0 HA ILE A 36 2.311 6.418 -5.236 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.687 6.077 -4.941 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -0.091 6.695 -7.192 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -0.783 8.092 -6.390 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -0.672 8.355 -3.981 1.00 0.00 H new ATOM 0 HG22 ILE A 36 0.232 7.202 -2.971 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.107 8.348 -4.015 1.00 0.00 H new ATOM 0 HD11 ILE A 36 1.158 8.726 -7.735 1.00 0.00 H new ATOM 0 HD12 ILE A 36 1.477 9.008 -6.007 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.179 7.590 -6.821 1.00 0.00 H new ATOM 575 N ALA A 37 0.685 4.216 -3.354 1.00 0.00 N ATOM 576 CA ALA A 37 0.712 3.495 -2.088 1.00 0.00 C ATOM 577 C ALA A 37 2.039 2.760 -1.904 1.00 0.00 C ATOM 578 O ALA A 37 2.635 2.794 -0.826 1.00 0.00 O ATOM 579 CB ALA A 37 -0.446 2.515 -2.014 1.00 0.00 C ATOM 0 H ALA A 37 -0.055 3.920 -3.991 1.00 0.00 H new ATOM 0 HA ALA A 37 0.611 4.222 -1.282 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -0.413 1.984 -1.063 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.388 3.058 -2.094 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.370 1.799 -2.832 1.00 0.00 H new ATOM 585 N GLY A 38 2.489 2.099 -2.965 1.00 0.00 N ATOM 586 CA GLY A 38 3.753 1.387 -2.928 1.00 0.00 C ATOM 587 C GLY A 38 4.932 2.291 -2.629 1.00 0.00 C ATOM 588 O GLY A 38 5.781 1.956 -1.803 1.00 0.00 O ATOM 0 H GLY A 38 1.996 2.044 -3.856 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.701 0.604 -2.171 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.914 0.894 -3.886 1.00 0.00 H new ATOM 592 N ASN A 39 4.981 3.439 -3.289 1.00 0.00 N ATOM 593 CA ASN A 39 6.063 4.395 -3.079 1.00 0.00 C ATOM 594 C ASN A 39 6.003 4.973 -1.671 1.00 0.00 C ATOM 595 O ASN A 39 7.040 5.243 -1.067 1.00 0.00 O ATOM 596 CB ASN A 39 6.026 5.522 -4.118 1.00 0.00 C ATOM 597 CG ASN A 39 6.493 5.071 -5.493 1.00 0.00 C ATOM 598 OD1 ASN A 39 6.338 3.911 -5.870 1.00 0.00 O ATOM 599 ND2 ASN A 39 7.080 5.987 -6.252 1.00 0.00 N ATOM 0 H ASN A 39 4.285 3.733 -3.975 1.00 0.00 H new ATOM 0 HA ASN A 39 7.004 3.858 -3.199 1.00 0.00 H new ATOM 0 HB2 ASN A 39 5.009 5.908 -4.193 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.655 6.345 -3.778 1.00 0.00 H new ATOM 0 HD21 ASN A 39 7.420 5.738 -7.181 1.00 0.00 H new ATOM 0 HD22 ASN A 39 7.192 6.940 -5.907 1.00 0.00 H new ATOM 606 N ILE A 40 4.791 5.151 -1.146 1.00 0.00 N ATOM 607 CA ILE A 40 4.621 5.569 0.244 1.00 0.00 C ATOM 608 C ILE A 40 5.289 4.560 1.171 1.00 0.00 C ATOM 609 O ILE A 40 6.149 4.918 1.977 1.00 0.00 O ATOM 610 CB ILE A 40 3.132 5.721 0.645 1.00 0.00 C ATOM 611 CG1 ILE A 40 2.475 6.881 -0.110 1.00 0.00 C ATOM 612 CG2 ILE A 40 3.004 5.937 2.148 1.00 0.00 C ATOM 613 CD1 ILE A 40 1.005 7.062 0.214 1.00 0.00 C ATOM 0 H ILE A 40 3.919 5.013 -1.658 1.00 0.00 H new ATOM 0 HA ILE A 40 5.089 6.548 0.341 1.00 0.00 H new ATOM 0 HB ILE A 40 2.616 4.799 0.375 1.00 0.00 H new ATOM 0 HG12 ILE A 40 3.006 7.803 0.125 1.00 0.00 H new ATOM 0 HG13 ILE A 40 2.584 6.714 -1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 40 1.952 6.042 2.412 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.427 5.082 2.676 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.541 6.842 2.433 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.607 7.901 -0.357 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.460 6.155 -0.047 1.00 0.00 H new ATOM 0 HD13 ILE A 40 0.889 7.261 1.279 1.00 0.00 H new ATOM 625 N ALA A 41 4.907 3.291 1.030 1.00 0.00 N ATOM 626 CA ALA A 41 5.481 2.225 1.834 1.00 0.00 C ATOM 627 C ALA A 41 6.991 2.156 1.650 1.00 0.00 C ATOM 628 O ALA A 41 7.732 2.034 2.620 1.00 0.00 O ATOM 629 CB ALA A 41 4.841 0.894 1.474 1.00 0.00 C ATOM 0 H ALA A 41 4.200 2.981 0.363 1.00 0.00 H new ATOM 0 HA ALA A 41 5.279 2.441 2.883 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.279 0.103 2.083 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.768 0.944 1.661 1.00 0.00 H new ATOM 0 HB3 ALA A 41 5.016 0.679 0.420 1.00 0.00 H new ATOM 635 N THR A 42 7.438 2.259 0.404 1.00 0.00 N ATOM 636 CA THR A 42 8.862 2.220 0.095 1.00 0.00 C ATOM 637 C THR A 42 9.599 3.375 0.774 1.00 0.00 C ATOM 638 O THR A 42 10.654 3.176 1.375 1.00 0.00 O ATOM 639 CB THR A 42 9.106 2.275 -1.427 1.00 0.00 C ATOM 640 OG1 THR A 42 8.406 1.202 -2.071 1.00 0.00 O ATOM 641 CG2 THR A 42 10.588 2.174 -1.748 1.00 0.00 C ATOM 0 H THR A 42 6.834 2.370 -0.410 1.00 0.00 H new ATOM 0 HA THR A 42 9.251 1.276 0.477 1.00 0.00 H new ATOM 0 HB THR A 42 8.736 3.232 -1.794 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.459 1.436 -2.160 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.730 2.215 -2.828 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.119 3.003 -1.280 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.979 1.231 -1.367 1.00 0.00 H new ATOM 649 N ASN A 43 9.031 4.573 0.693 1.00 0.00 N ATOM 650 CA ASN A 43 9.618 5.747 1.333 1.00 0.00 C ATOM 651 C ASN A 43 9.746 5.520 2.836 1.00 0.00 C ATOM 652 O ASN A 43 10.771 5.851 3.445 1.00 0.00 O ATOM 653 CB ASN A 43 8.763 6.987 1.062 1.00 0.00 C ATOM 654 CG ASN A 43 9.365 8.251 1.647 1.00 0.00 C ATOM 655 OD1 ASN A 43 9.121 8.591 2.802 1.00 0.00 O ATOM 656 ND2 ASN A 43 10.146 8.960 0.849 1.00 0.00 N ATOM 0 H ASN A 43 8.163 4.758 0.190 1.00 0.00 H new ATOM 0 HA ASN A 43 10.611 5.908 0.914 1.00 0.00 H new ATOM 0 HB2 ASN A 43 8.641 7.111 -0.014 1.00 0.00 H new ATOM 0 HB3 ASN A 43 7.768 6.836 1.480 1.00 0.00 H new ATOM 0 HD21 ASN A 43 10.571 9.824 1.187 1.00 0.00 H new ATOM 0 HD22 ASN A 43 10.324 8.643 -0.104 1.00 0.00 H new ATOM 663 N VAL A 44 8.709 4.935 3.424 1.00 0.00 N ATOM 664 CA VAL A 44 8.735 4.569 4.831 1.00 0.00 C ATOM 665 C VAL A 44 9.833 3.543 5.082 1.00 0.00 C ATOM 666 O VAL A 44 10.664 3.723 5.967 1.00 0.00 O ATOM 667 CB VAL A 44 7.377 4.000 5.303 1.00 0.00 C ATOM 668 CG1 VAL A 44 7.437 3.613 6.774 1.00 0.00 C ATOM 669 CG2 VAL A 44 6.259 5.004 5.063 1.00 0.00 C ATOM 0 H VAL A 44 7.839 4.704 2.945 1.00 0.00 H new ATOM 0 HA VAL A 44 8.936 5.475 5.402 1.00 0.00 H new ATOM 0 HB VAL A 44 7.165 3.104 4.720 1.00 0.00 H new ATOM 0 HG11 VAL A 44 6.471 3.215 7.085 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.206 2.854 6.920 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.677 4.492 7.372 1.00 0.00 H new ATOM 0 HG21 VAL A 44 5.313 4.583 5.402 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.468 5.920 5.616 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.195 5.229 3.999 1.00 0.00 H new ATOM 679 N LEU A 45 9.855 2.491 4.265 1.00 0.00 N ATOM 680 CA LEU A 45 10.853 1.428 4.386 1.00 0.00 C ATOM 681 C LEU A 45 12.271 1.962 4.206 1.00 0.00 C ATOM 682 O LEU A 45 13.239 1.316 4.606 1.00 0.00 O ATOM 683 CB LEU A 45 10.598 0.322 3.360 1.00 0.00 C ATOM 684 CG LEU A 45 9.262 -0.407 3.493 1.00 0.00 C ATOM 685 CD1 LEU A 45 9.105 -1.438 2.388 1.00 0.00 C ATOM 686 CD2 LEU A 45 9.146 -1.065 4.857 1.00 0.00 C ATOM 0 H LEU A 45 9.188 2.351 3.506 1.00 0.00 H new ATOM 0 HA LEU A 45 10.760 1.020 5.392 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.657 0.756 2.362 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.401 -0.411 3.436 1.00 0.00 H new ATOM 0 HG LEU A 45 8.460 0.325 3.396 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.148 -1.947 2.499 1.00 0.00 H new ATOM 0 HD12 LEU A 45 9.141 -0.941 1.419 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.913 -2.167 2.453 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.188 -1.579 4.933 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.955 -1.785 4.984 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.212 -0.304 5.635 1.00 0.00 H new ATOM 698 N ASN A 46 12.396 3.128 3.593 1.00 0.00 N ATOM 699 CA ASN A 46 13.700 3.744 3.389 1.00 0.00 C ATOM 700 C ASN A 46 14.093 4.618 4.574 1.00 0.00 C ATOM 701 O ASN A 46 15.112 4.378 5.224 1.00 0.00 O ATOM 702 CB ASN A 46 13.726 4.583 2.106 1.00 0.00 C ATOM 703 CG ASN A 46 13.948 3.759 0.846 1.00 0.00 C ATOM 704 OD1 ASN A 46 14.576 4.225 -0.100 1.00 0.00 O ATOM 705 ND2 ASN A 46 13.424 2.544 0.812 1.00 0.00 N ATOM 0 H ASN A 46 11.612 3.668 3.228 1.00 0.00 H new ATOM 0 HA ASN A 46 14.422 2.932 3.295 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.784 5.124 2.016 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.516 5.330 2.186 1.00 0.00 H new ATOM 0 HD21 ASN A 46 13.536 1.963 -0.019 1.00 0.00 H new ATOM 0 HD22 ASN A 46 12.908 2.188 1.617 1.00 0.00 H new ATOM 712 N GLN A 47 13.277 5.622 4.865 1.00 0.00 N ATOM 713 CA GLN A 47 13.659 6.651 5.828 1.00 0.00 C ATOM 714 C GLN A 47 12.791 6.642 7.083 1.00 0.00 C ATOM 715 O GLN A 47 13.269 6.967 8.168 1.00 0.00 O ATOM 716 CB GLN A 47 13.572 8.030 5.175 1.00 0.00 C ATOM 717 CG GLN A 47 14.450 8.184 3.947 1.00 0.00 C ATOM 718 CD GLN A 47 14.234 9.510 3.252 1.00 0.00 C ATOM 719 OE1 GLN A 47 14.899 10.503 3.554 1.00 0.00 O ATOM 720 NE2 GLN A 47 13.304 9.537 2.315 1.00 0.00 N ATOM 0 H GLN A 47 12.353 5.748 4.453 1.00 0.00 H new ATOM 0 HA GLN A 47 14.682 6.430 6.133 1.00 0.00 H new ATOM 0 HB2 GLN A 47 12.536 8.225 4.896 1.00 0.00 H new ATOM 0 HB3 GLN A 47 13.853 8.787 5.908 1.00 0.00 H new ATOM 0 HG2 GLN A 47 15.497 8.094 4.237 1.00 0.00 H new ATOM 0 HG3 GLN A 47 14.242 7.372 3.250 1.00 0.00 H new ATOM 0 HE21 GLN A 47 12.776 8.692 2.096 1.00 0.00 H new ATOM 0 HE22 GLN A 47 13.113 10.403 1.810 1.00 0.00 H new ATOM 729 N ARG A 48 11.529 6.267 6.947 1.00 0.00 N ATOM 730 CA ARG A 48 10.563 6.459 8.027 1.00 0.00 C ATOM 731 C ARG A 48 10.384 5.195 8.866 1.00 0.00 C ATOM 732 O ARG A 48 9.431 5.082 9.635 1.00 0.00 O ATOM 733 CB ARG A 48 9.215 6.908 7.455 1.00 0.00 C ATOM 734 CG ARG A 48 9.325 8.120 6.544 1.00 0.00 C ATOM 735 CD ARG A 48 7.962 8.612 6.083 1.00 0.00 C ATOM 736 NE ARG A 48 8.087 9.625 5.038 1.00 0.00 N ATOM 737 CZ ARG A 48 7.487 10.813 5.064 1.00 0.00 C ATOM 738 NH1 ARG A 48 6.684 11.137 6.067 1.00 0.00 N ATOM 739 NH2 ARG A 48 7.685 11.677 4.072 1.00 0.00 N ATOM 0 H ARG A 48 11.148 5.831 6.108 1.00 0.00 H new ATOM 0 HA ARG A 48 10.955 7.235 8.684 1.00 0.00 H new ATOM 0 HB2 ARG A 48 8.771 6.083 6.899 1.00 0.00 H new ATOM 0 HB3 ARG A 48 8.538 7.140 8.277 1.00 0.00 H new ATOM 0 HG2 ARG A 48 9.841 8.923 7.070 1.00 0.00 H new ATOM 0 HG3 ARG A 48 9.932 7.866 5.675 1.00 0.00 H new ATOM 0 HD2 ARG A 48 7.377 7.771 5.709 1.00 0.00 H new ATOM 0 HD3 ARG A 48 7.417 9.027 6.931 1.00 0.00 H new ATOM 0 HE ARG A 48 8.674 9.407 4.233 1.00 0.00 H new ATOM 0 HH11 ARG A 48 6.522 10.474 6.825 1.00 0.00 H new ATOM 0 HH12 ARG A 48 6.227 12.049 6.081 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.296 11.429 3.294 1.00 0.00 H new ATOM 0 HH22 ARG A 48 7.226 12.588 4.090 1.00 0.00 H new ATOM 753 N VAL A 49 11.308 4.259 8.734 1.00 0.00 N ATOM 754 CA VAL A 49 11.251 3.027 9.505 1.00 0.00 C ATOM 755 C VAL A 49 12.649 2.656 9.992 1.00 0.00 C ATOM 756 O VAL A 49 13.644 3.164 9.471 1.00 0.00 O ATOM 757 CB VAL A 49 10.661 1.867 8.666 1.00 0.00 C ATOM 758 CG1 VAL A 49 11.694 1.291 7.707 1.00 0.00 C ATOM 759 CG2 VAL A 49 10.092 0.778 9.562 1.00 0.00 C ATOM 0 H VAL A 49 12.106 4.327 8.102 1.00 0.00 H new ATOM 0 HA VAL A 49 10.598 3.192 10.362 1.00 0.00 H new ATOM 0 HB VAL A 49 9.846 2.278 8.070 1.00 0.00 H new ATOM 0 HG11 VAL A 49 11.246 0.479 7.134 1.00 0.00 H new ATOM 0 HG12 VAL A 49 12.033 2.071 7.026 1.00 0.00 H new ATOM 0 HG13 VAL A 49 12.544 0.910 8.273 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.684 -0.024 8.946 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.883 0.381 10.199 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.301 1.196 10.184 1.00 0.00 H new ATOM 769 N ALA A 50 12.721 1.793 10.996 1.00 0.00 N ATOM 770 CA ALA A 50 13.999 1.310 11.499 1.00 0.00 C ATOM 771 C ALA A 50 14.574 0.260 10.555 1.00 0.00 C ATOM 772 O ALA A 50 13.825 -0.502 9.940 1.00 0.00 O ATOM 773 CB ALA A 50 13.831 0.733 12.899 1.00 0.00 C ATOM 0 H ALA A 50 11.907 1.412 11.479 1.00 0.00 H new ATOM 0 HA ALA A 50 14.695 2.148 11.551 1.00 0.00 H new ATOM 0 HB1 ALA A 50 14.794 0.375 13.263 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.454 1.506 13.568 1.00 0.00 H new ATOM 0 HB3 ALA A 50 13.124 -0.096 12.868 1.00 0.00 H new ATOM 779 N ALA A 51 15.896 0.222 10.448 1.00 0.00 N ATOM 780 CA ALA A 51 16.576 -0.724 9.570 1.00 0.00 C ATOM 781 C ALA A 51 16.187 -2.163 9.891 1.00 0.00 C ATOM 782 O ALA A 51 15.940 -2.966 8.994 1.00 0.00 O ATOM 783 CB ALA A 51 18.085 -0.548 9.673 1.00 0.00 C ATOM 0 H ALA A 51 16.524 0.840 10.962 1.00 0.00 H new ATOM 0 HA ALA A 51 16.262 -0.515 8.547 1.00 0.00 H new ATOM 0 HB1 ALA A 51 18.580 -1.260 9.013 1.00 0.00 H new ATOM 0 HB2 ALA A 51 18.354 0.467 9.379 1.00 0.00 H new ATOM 0 HB3 ALA A 51 18.403 -0.725 10.701 1.00 0.00 H new ATOM 789 N SER A 52 16.109 -2.474 11.176 1.00 0.00 N ATOM 790 CA SER A 52 15.762 -3.816 11.621 1.00 0.00 C ATOM 791 C SER A 52 14.256 -4.075 11.499 1.00 0.00 C ATOM 792 O SER A 52 13.781 -5.177 11.775 1.00 0.00 O ATOM 793 CB SER A 52 16.208 -4.005 13.071 1.00 0.00 C ATOM 794 OG SER A 52 17.574 -3.647 13.231 1.00 0.00 O ATOM 0 H SER A 52 16.282 -1.812 11.932 1.00 0.00 H new ATOM 0 HA SER A 52 16.277 -4.532 10.980 1.00 0.00 H new ATOM 0 HB2 SER A 52 15.588 -3.395 13.729 1.00 0.00 H new ATOM 0 HB3 SER A 52 16.063 -5.044 13.368 1.00 0.00 H new ATOM 0 HG SER A 52 17.838 -3.774 14.166 1.00 0.00 H new ATOM 800 N GLN A 53 13.505 -3.063 11.077 1.00 0.00 N ATOM 801 CA GLN A 53 12.057 -3.184 10.993 1.00 0.00 C ATOM 802 C GLN A 53 11.586 -3.287 9.543 1.00 0.00 C ATOM 803 O GLN A 53 10.482 -3.751 9.292 1.00 0.00 O ATOM 804 CB GLN A 53 11.381 -1.985 11.672 1.00 0.00 C ATOM 805 CG GLN A 53 9.879 -2.150 11.881 1.00 0.00 C ATOM 806 CD GLN A 53 9.512 -3.136 12.985 1.00 0.00 C ATOM 807 OE1 GLN A 53 8.476 -2.992 13.632 1.00 0.00 O ATOM 808 NE2 GLN A 53 10.346 -4.142 13.212 1.00 0.00 N ATOM 0 H GLN A 53 13.873 -2.156 10.790 1.00 0.00 H new ATOM 0 HA GLN A 53 11.774 -4.101 11.509 1.00 0.00 H new ATOM 0 HB2 GLN A 53 11.855 -1.815 12.639 1.00 0.00 H new ATOM 0 HB3 GLN A 53 11.557 -1.094 11.070 1.00 0.00 H new ATOM 0 HG2 GLN A 53 9.446 -1.178 12.117 1.00 0.00 H new ATOM 0 HG3 GLN A 53 9.427 -2.482 10.946 1.00 0.00 H new ATOM 0 HE21 GLN A 53 11.197 -4.234 12.658 1.00 0.00 H new ATOM 0 HE22 GLN A 53 10.136 -4.824 13.941 1.00 0.00 H new ATOM 817 N ARG A 54 12.445 -2.881 8.604 1.00 0.00 N ATOM 818 CA ARG A 54 12.062 -2.749 7.189 1.00 0.00 C ATOM 819 C ARG A 54 11.310 -3.976 6.666 1.00 0.00 C ATOM 820 O ARG A 54 10.145 -3.886 6.288 1.00 0.00 O ATOM 821 CB ARG A 54 13.297 -2.519 6.308 1.00 0.00 C ATOM 822 CG ARG A 54 14.204 -1.389 6.771 1.00 0.00 C ATOM 823 CD ARG A 54 15.275 -1.082 5.734 1.00 0.00 C ATOM 824 NE ARG A 54 16.412 -0.352 6.302 1.00 0.00 N ATOM 825 CZ ARG A 54 16.523 0.981 6.318 1.00 0.00 C ATOM 826 NH1 ARG A 54 15.542 1.740 5.861 1.00 0.00 N ATOM 827 NH2 ARG A 54 17.618 1.553 6.806 1.00 0.00 N ATOM 0 H ARG A 54 13.416 -2.636 8.796 1.00 0.00 H new ATOM 0 HA ARG A 54 11.395 -1.888 7.136 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.877 -3.441 6.271 1.00 0.00 H new ATOM 0 HB3 ARG A 54 12.967 -2.309 5.291 1.00 0.00 H new ATOM 0 HG2 ARG A 54 13.609 -0.495 6.958 1.00 0.00 H new ATOM 0 HG3 ARG A 54 14.676 -1.662 7.715 1.00 0.00 H new ATOM 0 HD2 ARG A 54 15.629 -2.015 5.295 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.837 -0.495 4.927 1.00 0.00 H new ATOM 0 HE ARG A 54 17.170 -0.897 6.713 1.00 0.00 H new ATOM 0 HH11 ARG A 54 14.693 1.310 5.493 1.00 0.00 H new ATOM 0 HH12 ARG A 54 15.634 2.756 5.876 1.00 0.00 H new ATOM 0 HH21 ARG A 54 18.376 0.976 7.169 1.00 0.00 H new ATOM 0 HH22 ARG A 54 17.701 2.570 6.817 1.00 0.00 H new ATOM 841 N LYS A 55 11.982 -5.119 6.656 1.00 0.00 N ATOM 842 CA LYS A 55 11.416 -6.327 6.073 1.00 0.00 C ATOM 843 C LYS A 55 10.252 -6.844 6.917 1.00 0.00 C ATOM 844 O LYS A 55 9.264 -7.342 6.386 1.00 0.00 O ATOM 845 CB LYS A 55 12.510 -7.394 5.932 1.00 0.00 C ATOM 846 CG LYS A 55 12.266 -8.405 4.817 1.00 0.00 C ATOM 847 CD LYS A 55 11.297 -9.502 5.231 1.00 0.00 C ATOM 848 CE LYS A 55 11.060 -10.488 4.096 1.00 0.00 C ATOM 849 NZ LYS A 55 10.292 -9.879 2.975 1.00 0.00 N ATOM 0 H LYS A 55 12.918 -5.235 7.044 1.00 0.00 H new ATOM 0 HA LYS A 55 11.025 -6.093 5.083 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.464 -6.897 5.753 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.602 -7.929 6.877 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.873 -7.888 3.941 1.00 0.00 H new ATOM 0 HG3 LYS A 55 13.215 -8.854 4.523 1.00 0.00 H new ATOM 0 HD2 LYS A 55 11.692 -10.031 6.098 1.00 0.00 H new ATOM 0 HD3 LYS A 55 10.349 -9.058 5.533 1.00 0.00 H new ATOM 0 HE2 LYS A 55 12.019 -10.849 3.724 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.519 -11.355 4.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.110 -10.599 2.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 9.387 -9.512 3.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 10.842 -9.100 2.560 1.00 0.00 H new ATOM 863 N LEU A 56 10.362 -6.692 8.229 1.00 0.00 N ATOM 864 CA LEU A 56 9.337 -7.183 9.146 1.00 0.00 C ATOM 865 C LEU A 56 8.037 -6.410 8.997 1.00 0.00 C ATOM 866 O LEU A 56 6.963 -7.002 8.897 1.00 0.00 O ATOM 867 CB LEU A 56 9.816 -7.102 10.594 1.00 0.00 C ATOM 868 CG LEU A 56 10.874 -8.131 10.980 1.00 0.00 C ATOM 869 CD1 LEU A 56 11.232 -7.990 12.450 1.00 0.00 C ATOM 870 CD2 LEU A 56 10.370 -9.534 10.676 1.00 0.00 C ATOM 0 H LEU A 56 11.150 -6.233 8.685 1.00 0.00 H new ATOM 0 HA LEU A 56 9.151 -8.226 8.888 1.00 0.00 H new ATOM 0 HB2 LEU A 56 10.218 -6.105 10.773 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.956 -7.222 11.253 1.00 0.00 H new ATOM 0 HG LEU A 56 11.775 -7.954 10.393 1.00 0.00 H new ATOM 0 HD11 LEU A 56 11.988 -8.730 12.713 1.00 0.00 H new ATOM 0 HD12 LEU A 56 11.624 -6.990 12.635 1.00 0.00 H new ATOM 0 HD13 LEU A 56 10.342 -8.149 13.058 1.00 0.00 H new ATOM 0 HD21 LEU A 56 11.131 -10.262 10.955 1.00 0.00 H new ATOM 0 HD22 LEU A 56 9.460 -9.725 11.245 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.157 -9.621 9.611 1.00 0.00 H new ATOM 882 N ILE A 57 8.137 -5.088 8.976 1.00 0.00 N ATOM 883 CA ILE A 57 6.960 -4.243 8.878 1.00 0.00 C ATOM 884 C ILE A 57 6.315 -4.402 7.502 1.00 0.00 C ATOM 885 O ILE A 57 5.105 -4.239 7.350 1.00 0.00 O ATOM 886 CB ILE A 57 7.300 -2.757 9.168 1.00 0.00 C ATOM 887 CG1 ILE A 57 6.032 -1.948 9.441 1.00 0.00 C ATOM 888 CG2 ILE A 57 8.083 -2.139 8.020 1.00 0.00 C ATOM 889 CD1 ILE A 57 6.316 -0.540 9.915 1.00 0.00 C ATOM 0 H ILE A 57 9.020 -4.580 9.026 1.00 0.00 H new ATOM 0 HA ILE A 57 6.246 -4.562 9.637 1.00 0.00 H new ATOM 0 HB ILE A 57 7.925 -2.731 10.061 1.00 0.00 H new ATOM 0 HG12 ILE A 57 5.433 -1.905 8.531 1.00 0.00 H new ATOM 0 HG13 ILE A 57 5.434 -2.464 10.192 1.00 0.00 H new ATOM 0 HG21 ILE A 57 8.307 -1.098 8.251 1.00 0.00 H new ATOM 0 HG22 ILE A 57 9.014 -2.688 7.878 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.490 -2.188 7.107 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.375 -0.019 10.091 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.889 -0.577 10.841 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.889 -0.009 9.155 1.00 0.00 H new ATOM 901 N ALA A 58 7.132 -4.753 6.509 1.00 0.00 N ATOM 902 CA ALA A 58 6.627 -5.054 5.178 1.00 0.00 C ATOM 903 C ALA A 58 5.806 -6.341 5.189 1.00 0.00 C ATOM 904 O ALA A 58 4.760 -6.425 4.544 1.00 0.00 O ATOM 905 CB ALA A 58 7.775 -5.159 4.187 1.00 0.00 C ATOM 0 H ALA A 58 8.144 -4.835 6.605 1.00 0.00 H new ATOM 0 HA ALA A 58 5.974 -4.239 4.866 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.381 -5.385 3.196 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.316 -4.213 4.156 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.452 -5.955 4.498 1.00 0.00 H new ATOM 911 N GLU A 59 6.280 -7.340 5.934 1.00 0.00 N ATOM 912 CA GLU A 59 5.546 -8.593 6.083 1.00 0.00 C ATOM 913 C GLU A 59 4.224 -8.346 6.796 1.00 0.00 C ATOM 914 O GLU A 59 3.178 -8.826 6.366 1.00 0.00 O ATOM 915 CB GLU A 59 6.362 -9.627 6.865 1.00 0.00 C ATOM 916 CG GLU A 59 7.644 -10.057 6.176 1.00 0.00 C ATOM 917 CD GLU A 59 7.402 -10.669 4.812 1.00 0.00 C ATOM 918 OE1 GLU A 59 6.809 -11.764 4.739 1.00 0.00 O ATOM 919 OE2 GLU A 59 7.825 -10.070 3.807 1.00 0.00 O ATOM 0 H GLU A 59 7.165 -7.305 6.441 1.00 0.00 H new ATOM 0 HA GLU A 59 5.356 -8.987 5.084 1.00 0.00 H new ATOM 0 HB2 GLU A 59 6.609 -9.214 7.843 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.743 -10.507 7.038 1.00 0.00 H new ATOM 0 HG2 GLU A 59 8.301 -9.194 6.070 1.00 0.00 H new ATOM 0 HG3 GLU A 59 8.165 -10.779 6.805 1.00 0.00 H new ATOM 926 N LYS A 60 4.286 -7.592 7.893 1.00 0.00 N ATOM 927 CA LYS A 60 3.088 -7.210 8.640 1.00 0.00 C ATOM 928 C LYS A 60 2.073 -6.542 7.714 1.00 0.00 C ATOM 929 O LYS A 60 0.886 -6.870 7.731 1.00 0.00 O ATOM 930 CB LYS A 60 3.455 -6.257 9.782 1.00 0.00 C ATOM 931 CG LYS A 60 4.440 -6.843 10.785 1.00 0.00 C ATOM 932 CD LYS A 60 4.932 -5.789 11.769 1.00 0.00 C ATOM 933 CE LYS A 60 3.837 -5.334 12.720 1.00 0.00 C ATOM 934 NZ LYS A 60 3.566 -6.337 13.782 1.00 0.00 N ATOM 0 H LYS A 60 5.156 -7.233 8.285 1.00 0.00 H new ATOM 0 HA LYS A 60 2.642 -8.112 9.060 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.881 -5.347 9.359 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.545 -5.969 10.308 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.963 -7.657 11.331 1.00 0.00 H new ATOM 0 HG3 LYS A 60 5.290 -7.271 10.254 1.00 0.00 H new ATOM 0 HD2 LYS A 60 5.765 -6.193 12.344 1.00 0.00 H new ATOM 0 HD3 LYS A 60 5.312 -4.929 11.217 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.127 -4.389 13.180 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.923 -5.147 12.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.813 -5.986 14.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.264 -7.232 13.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.431 -6.497 14.337 1.00 0.00 H new ATOM 948 N PHE A 61 2.565 -5.612 6.900 1.00 0.00 N ATOM 949 CA PHE A 61 1.741 -4.910 5.922 1.00 0.00 C ATOM 950 C PHE A 61 1.099 -5.890 4.941 1.00 0.00 C ATOM 951 O PHE A 61 -0.114 -5.861 4.722 1.00 0.00 O ATOM 952 CB PHE A 61 2.600 -3.892 5.166 1.00 0.00 C ATOM 953 CG PHE A 61 1.896 -3.207 4.027 1.00 0.00 C ATOM 954 CD1 PHE A 61 1.057 -2.133 4.259 1.00 0.00 C ATOM 955 CD2 PHE A 61 2.084 -3.636 2.724 1.00 0.00 C ATOM 956 CE1 PHE A 61 0.418 -1.500 3.216 1.00 0.00 C ATOM 957 CE2 PHE A 61 1.447 -3.006 1.675 1.00 0.00 C ATOM 958 CZ PHE A 61 0.613 -1.935 1.922 1.00 0.00 C ATOM 0 H PHE A 61 3.544 -5.325 6.900 1.00 0.00 H new ATOM 0 HA PHE A 61 0.941 -4.391 6.450 1.00 0.00 H new ATOM 0 HB2 PHE A 61 2.948 -3.135 5.869 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.484 -4.398 4.779 1.00 0.00 H new ATOM 0 HD1 PHE A 61 0.901 -1.786 5.270 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.737 -4.473 2.527 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.236 -0.663 3.412 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.601 -3.350 0.663 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.114 -1.438 1.103 1.00 0.00 H new ATOM 968 N ALA A 62 1.919 -6.757 4.359 1.00 0.00 N ATOM 969 CA ALA A 62 1.445 -7.725 3.378 1.00 0.00 C ATOM 970 C ALA A 62 0.398 -8.656 3.979 1.00 0.00 C ATOM 971 O ALA A 62 -0.632 -8.923 3.363 1.00 0.00 O ATOM 972 CB ALA A 62 2.612 -8.529 2.826 1.00 0.00 C ATOM 0 H ALA A 62 2.919 -6.809 4.551 1.00 0.00 H new ATOM 0 HA ALA A 62 0.975 -7.175 2.563 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.244 -9.248 2.094 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.323 -7.856 2.347 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.106 -9.060 3.640 1.00 0.00 H new ATOM 978 N GLN A 63 0.660 -9.137 5.191 1.00 0.00 N ATOM 979 CA GLN A 63 -0.262 -10.034 5.878 1.00 0.00 C ATOM 980 C GLN A 63 -1.610 -9.361 6.110 1.00 0.00 C ATOM 981 O GLN A 63 -2.660 -9.986 5.952 1.00 0.00 O ATOM 982 CB GLN A 63 0.330 -10.497 7.213 1.00 0.00 C ATOM 983 CG GLN A 63 1.494 -11.465 7.061 1.00 0.00 C ATOM 984 CD GLN A 63 1.067 -12.821 6.529 1.00 0.00 C ATOM 985 OE1 GLN A 63 1.820 -13.489 5.823 1.00 0.00 O ATOM 986 NE2 GLN A 63 -0.138 -13.242 6.881 1.00 0.00 N ATOM 0 H GLN A 63 1.506 -8.919 5.718 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.417 -10.904 5.240 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.665 -9.625 7.774 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -0.453 -10.974 7.802 1.00 0.00 H new ATOM 0 HG2 GLN A 63 2.234 -11.033 6.388 1.00 0.00 H new ATOM 0 HG3 GLN A 63 1.980 -11.596 8.028 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -0.731 -12.656 7.468 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -0.473 -14.152 6.565 1.00 0.00 H new ATOM 995 N ALA A 64 -1.577 -8.087 6.480 1.00 0.00 N ATOM 996 CA ALA A 64 -2.797 -7.324 6.696 1.00 0.00 C ATOM 997 C ALA A 64 -3.544 -7.121 5.384 1.00 0.00 C ATOM 998 O ALA A 64 -4.773 -7.151 5.344 1.00 0.00 O ATOM 999 CB ALA A 64 -2.479 -5.986 7.344 1.00 0.00 C ATOM 0 H ALA A 64 -0.717 -7.561 6.637 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.441 -7.889 7.370 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.402 -5.428 7.499 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.991 -6.154 8.304 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.815 -5.416 6.694 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.791 -6.934 4.308 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.378 -6.723 2.994 1.00 0.00 C ATOM 1007 C LEU A 65 -4.029 -8.008 2.480 1.00 0.00 C ATOM 1008 O LEU A 65 -5.122 -7.976 1.920 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.307 -6.228 2.014 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.845 -5.642 0.704 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.824 -4.521 0.996 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.708 -5.121 -0.163 1.00 0.00 C ATOM 0 H LEU A 65 -1.771 -6.924 4.321 1.00 0.00 H new ATOM 0 HA LEU A 65 -4.154 -5.962 3.076 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.704 -5.469 2.512 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.642 -7.059 1.776 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.359 -6.436 0.162 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.200 -4.112 0.058 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.657 -4.909 1.582 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.320 -3.735 1.558 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.114 -4.710 -1.087 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.168 -4.341 0.375 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.026 -5.938 -0.398 1.00 0.00 H new ATOM 1024 N MET A 66 -3.368 -9.141 2.703 1.00 0.00 N ATOM 1025 CA MET A 66 -3.874 -10.430 2.233 1.00 0.00 C ATOM 1026 C MET A 66 -5.105 -10.867 3.017 1.00 0.00 C ATOM 1027 O MET A 66 -5.984 -11.540 2.482 1.00 0.00 O ATOM 1028 CB MET A 66 -2.794 -11.511 2.335 1.00 0.00 C ATOM 1029 CG MET A 66 -1.546 -11.191 1.532 1.00 0.00 C ATOM 1030 SD MET A 66 -1.884 -10.932 -0.218 1.00 0.00 S ATOM 1031 CE MET A 66 -0.329 -10.214 -0.734 1.00 0.00 C ATOM 0 H MET A 66 -2.482 -9.194 3.205 1.00 0.00 H new ATOM 0 HA MET A 66 -4.156 -10.301 1.188 1.00 0.00 H new ATOM 0 HB2 MET A 66 -2.520 -11.643 3.382 1.00 0.00 H new ATOM 0 HB3 MET A 66 -3.206 -12.460 1.991 1.00 0.00 H new ATOM 0 HG2 MET A 66 -1.076 -10.297 1.942 1.00 0.00 H new ATOM 0 HG3 MET A 66 -0.831 -12.006 1.642 1.00 0.00 H new ATOM 0 HE1 MET A 66 -0.367 -9.991 -1.800 1.00 0.00 H new ATOM 0 HE2 MET A 66 -0.150 -9.294 -0.177 1.00 0.00 H new ATOM 0 HE3 MET A 66 0.480 -10.919 -0.539 1.00 0.00 H new ATOM 1041 N SER A 67 -5.169 -10.485 4.284 1.00 0.00 N ATOM 1042 CA SER A 67 -6.309 -10.840 5.118 1.00 0.00 C ATOM 1043 C SER A 67 -7.497 -9.925 4.832 1.00 0.00 C ATOM 1044 O SER A 67 -8.647 -10.293 5.061 1.00 0.00 O ATOM 1045 CB SER A 67 -5.924 -10.792 6.598 1.00 0.00 C ATOM 1046 OG SER A 67 -5.173 -9.627 6.892 1.00 0.00 O ATOM 0 H SER A 67 -4.452 -9.934 4.755 1.00 0.00 H new ATOM 0 HA SER A 67 -6.608 -11.860 4.876 1.00 0.00 H new ATOM 0 HB2 SER A 67 -6.824 -10.813 7.212 1.00 0.00 H new ATOM 0 HB3 SER A 67 -5.343 -11.678 6.855 1.00 0.00 H new ATOM 0 HG SER A 67 -4.235 -9.772 6.648 1.00 0.00 H new ATOM 1052 N SER A 68 -7.213 -8.736 4.315 1.00 0.00 N ATOM 1053 CA SER A 68 -8.263 -7.802 3.933 1.00 0.00 C ATOM 1054 C SER A 68 -8.644 -8.008 2.467 1.00 0.00 C ATOM 1055 O SER A 68 -9.536 -7.344 1.939 1.00 0.00 O ATOM 1056 CB SER A 68 -7.790 -6.367 4.167 1.00 0.00 C ATOM 1057 OG SER A 68 -7.250 -6.220 5.474 1.00 0.00 O ATOM 0 H SER A 68 -6.265 -8.397 4.151 1.00 0.00 H new ATOM 0 HA SER A 68 -9.145 -7.985 4.547 1.00 0.00 H new ATOM 0 HB2 SER A 68 -7.036 -6.102 3.425 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.624 -5.678 4.034 1.00 0.00 H new ATOM 0 HG SER A 68 -6.323 -6.538 5.483 1.00 0.00 H new ATOM 1063 N LEU A 69 -7.960 -8.946 1.817 1.00 0.00 N ATOM 1064 CA LEU A 69 -8.217 -9.264 0.423 1.00 0.00 C ATOM 1065 C LEU A 69 -9.523 -10.038 0.290 1.00 0.00 C ATOM 1066 O LEU A 69 -9.646 -11.159 0.791 1.00 0.00 O ATOM 1067 CB LEU A 69 -7.056 -10.082 -0.148 1.00 0.00 C ATOM 1068 CG LEU A 69 -7.190 -10.482 -1.617 1.00 0.00 C ATOM 1069 CD1 LEU A 69 -7.191 -9.251 -2.508 1.00 0.00 C ATOM 1070 CD2 LEU A 69 -6.068 -11.430 -2.010 1.00 0.00 C ATOM 0 H LEU A 69 -7.218 -9.501 2.242 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.305 -8.335 -0.140 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.137 -9.508 -0.029 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.945 -10.988 0.448 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.140 -10.999 -1.751 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.287 -9.556 -3.550 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.029 -8.608 -2.239 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.257 -8.705 -2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.176 -11.707 -3.059 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.107 -10.938 -1.862 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -6.116 -12.326 -1.392 1.00 0.00 H new ATOM 1082 N GLU A 70 -10.497 -9.431 -0.369 1.00 0.00 N ATOM 1083 CA GLU A 70 -11.802 -10.049 -0.545 1.00 0.00 C ATOM 1084 C GLU A 70 -11.825 -10.947 -1.779 1.00 0.00 C ATOM 1085 O GLU A 70 -11.897 -10.467 -2.914 1.00 0.00 O ATOM 1086 CB GLU A 70 -12.884 -8.974 -0.652 1.00 0.00 C ATOM 1087 CG GLU A 70 -14.286 -9.540 -0.783 1.00 0.00 C ATOM 1088 CD GLU A 70 -15.342 -8.462 -0.870 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -15.815 -8.002 0.189 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -15.712 -8.074 -1.995 1.00 0.00 O ATOM 0 H GLU A 70 -10.408 -8.507 -0.792 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.003 -10.671 0.328 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.839 -8.335 0.230 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -12.673 -8.342 -1.515 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.339 -10.168 -1.672 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.496 -10.181 0.073 1.00 0.00 H new ATOM 1097 N THR A 71 -11.746 -12.248 -1.549 1.00 0.00 N ATOM 1098 CA THR A 71 -11.845 -13.222 -2.622 1.00 0.00 C ATOM 1099 C THR A 71 -12.933 -14.243 -2.293 1.00 0.00 C ATOM 1100 O THR A 71 -12.700 -15.194 -1.542 1.00 0.00 O ATOM 1101 CB THR A 71 -10.503 -13.943 -2.857 1.00 0.00 C ATOM 1102 OG1 THR A 71 -9.428 -12.993 -2.834 1.00 0.00 O ATOM 1103 CG2 THR A 71 -10.508 -14.672 -4.192 1.00 0.00 C ATOM 0 H THR A 71 -11.613 -12.655 -0.623 1.00 0.00 H new ATOM 0 HA THR A 71 -12.104 -12.690 -3.538 1.00 0.00 H new ATOM 0 HB THR A 71 -10.363 -14.674 -2.060 1.00 0.00 H new ATOM 0 HG1 THR A 71 -8.578 -13.457 -2.982 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.551 -15.173 -4.336 1.00 0.00 H new ATOM 0 HG22 THR A 71 -11.310 -15.411 -4.200 1.00 0.00 H new ATOM 0 HG23 THR A 71 -10.667 -13.955 -4.997 1.00 0.00 H new ATOM 1111 N PRO A 72 -14.145 -14.040 -2.839 1.00 0.00 N ATOM 1112 CA PRO A 72 -15.319 -14.866 -2.540 1.00 0.00 C ATOM 1113 C PRO A 72 -15.337 -16.183 -3.314 1.00 0.00 C ATOM 1114 O PRO A 72 -16.306 -16.498 -4.006 1.00 0.00 O ATOM 1115 CB PRO A 72 -16.506 -13.978 -2.964 1.00 0.00 C ATOM 1116 CG PRO A 72 -15.916 -12.687 -3.439 1.00 0.00 C ATOM 1117 CD PRO A 72 -14.486 -12.978 -3.789 1.00 0.00 C ATOM 0 HA PRO A 72 -15.339 -15.161 -1.491 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -17.085 -14.455 -3.755 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -17.185 -13.811 -2.128 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -16.458 -12.308 -4.305 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.978 -11.923 -2.664 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -14.379 -13.307 -4.823 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.850 -12.101 -3.665 1.00 0.00 H new ATOM 1125 N LYS A 73 -14.282 -16.968 -3.166 1.00 0.00 N ATOM 1126 CA LYS A 73 -14.190 -18.257 -3.844 1.00 0.00 C ATOM 1127 C LYS A 73 -14.817 -19.366 -2.997 1.00 0.00 C ATOM 1128 O LYS A 73 -14.555 -20.552 -3.204 1.00 0.00 O ATOM 1129 CB LYS A 73 -12.729 -18.590 -4.161 1.00 0.00 C ATOM 1130 CG LYS A 73 -11.812 -18.603 -2.944 1.00 0.00 C ATOM 1131 CD LYS A 73 -10.408 -19.076 -3.302 1.00 0.00 C ATOM 1132 CE LYS A 73 -9.782 -18.209 -4.385 1.00 0.00 C ATOM 1133 NZ LYS A 73 -8.412 -18.662 -4.743 1.00 0.00 N ATOM 0 H LYS A 73 -13.477 -16.738 -2.584 1.00 0.00 H new ATOM 0 HA LYS A 73 -14.745 -18.189 -4.780 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -12.687 -19.566 -4.644 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -12.350 -17.863 -4.879 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -11.761 -17.602 -2.516 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -12.232 -19.256 -2.179 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -9.779 -19.057 -2.412 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -10.448 -20.111 -3.642 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -10.413 -18.228 -5.273 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -9.743 -17.175 -4.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -8.024 -18.043 -5.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -7.802 -18.620 -3.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -8.450 -19.640 -5.094 1.00 0.00 H new ATOM 1147 N THR A 74 -15.671 -18.971 -2.064 1.00 0.00 N ATOM 1148 CA THR A 74 -16.308 -19.909 -1.151 1.00 0.00 C ATOM 1149 C THR A 74 -17.481 -20.634 -1.812 1.00 0.00 C ATOM 1150 O THR A 74 -17.974 -21.635 -1.294 1.00 0.00 O ATOM 1151 CB THR A 74 -16.794 -19.189 0.122 1.00 0.00 C ATOM 1152 OG1 THR A 74 -17.585 -18.042 -0.226 1.00 0.00 O ATOM 1153 CG2 THR A 74 -15.614 -18.751 0.973 1.00 0.00 C ATOM 0 H THR A 74 -15.941 -17.998 -1.919 1.00 0.00 H new ATOM 0 HA THR A 74 -15.557 -20.651 -0.879 1.00 0.00 H new ATOM 0 HB THR A 74 -17.404 -19.888 0.695 1.00 0.00 H new ATOM 0 HG1 THR A 74 -17.889 -17.594 0.591 1.00 0.00 H new ATOM 0 HG21 THR A 74 -15.978 -18.245 1.867 1.00 0.00 H new ATOM 0 HG22 THR A 74 -15.030 -19.625 1.263 1.00 0.00 H new ATOM 0 HG23 THR A 74 -14.986 -18.069 0.400 1.00 0.00 H new ATOM 1161 N HIS A 75 -17.927 -20.125 -2.954 1.00 0.00 N ATOM 1162 CA HIS A 75 -19.015 -20.758 -3.697 1.00 0.00 C ATOM 1163 C HIS A 75 -18.539 -21.215 -5.068 1.00 0.00 C ATOM 1164 O HIS A 75 -19.308 -21.783 -5.846 1.00 0.00 O ATOM 1165 CB HIS A 75 -20.199 -19.798 -3.859 1.00 0.00 C ATOM 1166 CG HIS A 75 -20.903 -19.480 -2.578 1.00 0.00 C ATOM 1167 ND1 HIS A 75 -21.259 -18.198 -2.214 1.00 0.00 N ATOM 1168 CD2 HIS A 75 -21.335 -20.287 -1.580 1.00 0.00 C ATOM 1169 CE1 HIS A 75 -21.875 -18.231 -1.047 1.00 0.00 C ATOM 1170 NE2 HIS A 75 -21.934 -19.486 -0.644 1.00 0.00 N ATOM 0 H HIS A 75 -17.555 -19.279 -3.386 1.00 0.00 H new ATOM 0 HA HIS A 75 -19.341 -21.627 -3.126 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -19.843 -18.870 -4.306 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -20.914 -20.234 -4.556 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -21.227 -21.361 -1.531 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -22.264 -17.377 -0.513 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -22.358 -19.808 0.226 1.00 0.00 H new ATOM 1179 N LEU A 76 -17.268 -20.972 -5.358 1.00 0.00 N ATOM 1180 CA LEU A 76 -16.714 -21.292 -6.664 1.00 0.00 C ATOM 1181 C LEU A 76 -15.197 -21.350 -6.609 1.00 0.00 C ATOM 1182 O LEU A 76 -14.543 -20.357 -6.291 1.00 0.00 O ATOM 1183 CB LEU A 76 -17.150 -20.243 -7.695 1.00 0.00 C ATOM 1184 CG LEU A 76 -16.613 -20.447 -9.114 1.00 0.00 C ATOM 1185 CD1 LEU A 76 -17.166 -21.726 -9.721 1.00 0.00 C ATOM 1186 CD2 LEU A 76 -16.955 -19.253 -9.988 1.00 0.00 C ATOM 0 H LEU A 76 -16.603 -20.555 -4.707 1.00 0.00 H new ATOM 0 HA LEU A 76 -17.091 -22.271 -6.960 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -18.239 -20.231 -7.736 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -16.833 -19.261 -7.344 1.00 0.00 H new ATOM 0 HG LEU A 76 -15.528 -20.537 -9.059 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -16.771 -21.851 -10.729 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -16.870 -22.577 -9.108 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -18.254 -21.669 -9.762 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -16.566 -19.415 -10.993 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -18.037 -19.133 -10.033 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -16.507 -18.353 -9.566 1.00 0.00 H new ATOM 1198 N GLU A 77 -14.641 -22.512 -6.905 1.00 0.00 N ATOM 1199 CA GLU A 77 -13.199 -22.648 -7.011 1.00 0.00 C ATOM 1200 C GLU A 77 -12.776 -22.493 -8.464 1.00 0.00 C ATOM 1201 O GLU A 77 -13.590 -22.651 -9.373 1.00 0.00 O ATOM 1202 CB GLU A 77 -12.721 -23.988 -6.426 1.00 0.00 C ATOM 1203 CG GLU A 77 -13.514 -25.213 -6.877 1.00 0.00 C ATOM 1204 CD GLU A 77 -13.163 -25.696 -8.275 1.00 0.00 C ATOM 1205 OE1 GLU A 77 -11.993 -26.072 -8.510 1.00 0.00 O ATOM 1206 OE2 GLU A 77 -14.071 -25.745 -9.126 1.00 0.00 O ATOM 0 H GLU A 77 -15.163 -23.371 -7.076 1.00 0.00 H new ATOM 0 HA GLU A 77 -12.727 -21.859 -6.425 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -11.675 -24.132 -6.697 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -12.763 -23.927 -5.339 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -13.343 -26.024 -6.170 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.578 -24.978 -6.841 1.00 0.00 H new ATOM 1213 N HIS A 78 -11.520 -22.152 -8.683 1.00 0.00 N ATOM 1214 CA HIS A 78 -11.015 -22.033 -10.034 1.00 0.00 C ATOM 1215 C HIS A 78 -10.683 -23.427 -10.544 1.00 0.00 C ATOM 1216 O HIS A 78 -9.856 -24.127 -9.956 1.00 0.00 O ATOM 1217 CB HIS A 78 -9.784 -21.122 -10.079 1.00 0.00 C ATOM 1218 CG HIS A 78 -9.540 -20.521 -11.428 1.00 0.00 C ATOM 1219 ND1 HIS A 78 -8.321 -20.554 -12.066 1.00 0.00 N ATOM 1220 CD2 HIS A 78 -10.373 -19.844 -12.253 1.00 0.00 C ATOM 1221 CE1 HIS A 78 -8.417 -19.928 -13.224 1.00 0.00 C ATOM 1222 NE2 HIS A 78 -9.652 -19.485 -13.362 1.00 0.00 N ATOM 0 H HIS A 78 -10.838 -21.955 -7.950 1.00 0.00 H new ATOM 0 HA HIS A 78 -11.772 -21.579 -10.674 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -9.906 -20.322 -9.349 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -8.906 -21.695 -9.780 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -11.415 -19.627 -12.071 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -7.618 -19.800 -13.939 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -10.011 -18.962 -14.161 1.00 0.00 H new ATOM 1231 N HIS A 79 -11.338 -23.827 -11.625 1.00 0.00 N ATOM 1232 CA HIS A 79 -11.290 -25.207 -12.092 1.00 0.00 C ATOM 1233 C HIS A 79 -9.916 -25.608 -12.609 1.00 0.00 C ATOM 1234 O HIS A 79 -9.613 -25.490 -13.797 1.00 0.00 O ATOM 1235 CB HIS A 79 -12.357 -25.463 -13.157 1.00 0.00 C ATOM 1236 CG HIS A 79 -13.714 -25.736 -12.584 1.00 0.00 C ATOM 1237 ND1 HIS A 79 -14.213 -27.009 -12.427 1.00 0.00 N ATOM 1238 CD2 HIS A 79 -14.675 -24.898 -12.130 1.00 0.00 C ATOM 1239 CE1 HIS A 79 -15.423 -26.944 -11.906 1.00 0.00 C ATOM 1240 NE2 HIS A 79 -15.729 -25.674 -11.714 1.00 0.00 N ATOM 0 H HIS A 79 -11.913 -23.211 -12.199 1.00 0.00 H new ATOM 0 HA HIS A 79 -11.499 -25.832 -11.224 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -12.417 -24.597 -13.817 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -12.052 -26.311 -13.770 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -14.623 -23.820 -12.100 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -16.057 -27.788 -11.675 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -16.604 -25.327 -11.321 1.00 0.00 H new ATOM 1249 N HIS A 80 -9.085 -26.051 -11.683 1.00 0.00 N ATOM 1250 CA HIS A 80 -7.829 -26.697 -12.009 1.00 0.00 C ATOM 1251 C HIS A 80 -7.955 -28.176 -11.653 1.00 0.00 C ATOM 1252 O HIS A 80 -6.983 -28.930 -11.633 1.00 0.00 O ATOM 1253 CB HIS A 80 -6.678 -26.035 -11.237 1.00 0.00 C ATOM 1254 CG HIS A 80 -5.319 -26.528 -11.630 1.00 0.00 C ATOM 1255 ND1 HIS A 80 -4.435 -27.088 -10.733 1.00 0.00 N ATOM 1256 CD2 HIS A 80 -4.693 -26.539 -12.829 1.00 0.00 C ATOM 1257 CE1 HIS A 80 -3.326 -27.423 -11.365 1.00 0.00 C ATOM 1258 NE2 HIS A 80 -3.458 -27.103 -12.638 1.00 0.00 N ATOM 0 H HIS A 80 -9.264 -25.972 -10.682 1.00 0.00 H new ATOM 0 HA HIS A 80 -7.608 -26.595 -13.072 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -6.722 -24.957 -11.393 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -6.822 -26.209 -10.171 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -5.092 -26.172 -13.763 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -2.457 -27.882 -10.916 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -2.755 -27.251 -13.362 1.00 0.00 H new ATOM 1267 N HIS A 81 -9.193 -28.570 -11.382 1.00 0.00 N ATOM 1268 CA HIS A 81 -9.512 -29.930 -10.988 1.00 0.00 C ATOM 1269 C HIS A 81 -9.763 -30.802 -12.210 1.00 0.00 C ATOM 1270 O HIS A 81 -9.821 -30.295 -13.332 1.00 0.00 O ATOM 1271 CB HIS A 81 -10.737 -29.942 -10.071 1.00 0.00 C ATOM 1272 CG HIS A 81 -10.423 -29.579 -8.655 1.00 0.00 C ATOM 1273 ND1 HIS A 81 -10.790 -28.384 -8.066 1.00 0.00 N ATOM 1274 CD2 HIS A 81 -9.764 -30.275 -7.704 1.00 0.00 C ATOM 1275 CE1 HIS A 81 -10.367 -28.368 -6.818 1.00 0.00 C ATOM 1276 NE2 HIS A 81 -9.741 -29.504 -6.573 1.00 0.00 N ATOM 0 H HIS A 81 -10.003 -27.952 -11.430 1.00 0.00 H new ATOM 0 HA HIS A 81 -8.659 -30.337 -10.445 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -11.480 -29.246 -10.460 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -11.188 -30.934 -10.092 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -11.306 -27.633 -8.525 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -9.334 -31.259 -7.815 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -10.509 -27.561 -6.114 1.00 0.00 H new ATOM 1285 N HIS A 82 -9.930 -32.102 -11.969 1.00 0.00 N ATOM 1286 CA HIS A 82 -10.121 -33.098 -13.024 1.00 0.00 C ATOM 1287 C HIS A 82 -8.822 -33.350 -13.783 1.00 0.00 C ATOM 1288 O HIS A 82 -8.382 -32.532 -14.589 1.00 0.00 O ATOM 1289 CB HIS A 82 -11.236 -32.695 -13.998 1.00 0.00 C ATOM 1290 CG HIS A 82 -11.566 -33.763 -14.993 1.00 0.00 C ATOM 1291 ND1 HIS A 82 -11.004 -33.823 -16.249 1.00 0.00 N ATOM 1292 CD2 HIS A 82 -12.390 -34.831 -14.902 1.00 0.00 C ATOM 1293 CE1 HIS A 82 -11.465 -34.882 -16.883 1.00 0.00 C ATOM 1294 NE2 HIS A 82 -12.307 -35.510 -16.090 1.00 0.00 N ATOM 0 H HIS A 82 -9.937 -32.497 -11.029 1.00 0.00 H new ATOM 0 HA HIS A 82 -10.425 -34.023 -12.535 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -12.133 -32.447 -13.430 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -10.936 -31.792 -14.530 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -13.000 -35.099 -14.052 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -11.197 -35.184 -17.885 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -12.815 -36.363 -16.322 1.00 0.00 H new ATOM 1303 N HIS A 83 -8.217 -34.494 -13.518 1.00 0.00 N ATOM 1304 CA HIS A 83 -6.982 -34.885 -14.178 1.00 0.00 C ATOM 1305 C HIS A 83 -7.040 -36.359 -14.550 1.00 0.00 C ATOM 1306 O HIS A 83 -7.179 -37.195 -13.642 1.00 0.00 O ATOM 1307 CB HIS A 83 -5.756 -34.584 -13.296 1.00 0.00 C ATOM 1308 CG HIS A 83 -5.844 -35.128 -11.898 1.00 0.00 C ATOM 1309 ND1 HIS A 83 -6.334 -34.394 -10.841 1.00 0.00 N ATOM 1310 CD2 HIS A 83 -5.500 -36.335 -11.386 1.00 0.00 C ATOM 1311 CE1 HIS A 83 -6.293 -35.125 -9.744 1.00 0.00 C ATOM 1312 NE2 HIS A 83 -5.792 -36.306 -10.044 1.00 0.00 N ATOM 1313 OXT HIS A 83 -6.963 -36.676 -15.752 1.00 0.00 O ATOM 0 H HIS A 83 -8.565 -35.175 -12.843 1.00 0.00 H new ATOM 0 HA HIS A 83 -6.875 -34.297 -15.090 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -4.869 -34.996 -13.777 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -5.618 -33.504 -13.244 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -5.075 -37.165 -11.931 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -6.616 -34.808 -8.763 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -5.645 -37.073 -9.388 1.00 0.00 H new TER 1322 HIS A 83 ATOM 1323 N MET B 1 1.457 -3.933 -21.365 1.00 0.00 N ATOM 1324 CA MET B 1 1.043 -4.861 -20.293 1.00 0.00 C ATOM 1325 C MET B 1 0.664 -4.068 -19.053 1.00 0.00 C ATOM 1326 O MET B 1 1.116 -2.935 -18.890 1.00 0.00 O ATOM 1327 CB MET B 1 2.180 -5.834 -19.962 1.00 0.00 C ATOM 1328 CG MET B 1 2.591 -6.711 -21.130 1.00 0.00 C ATOM 1329 SD MET B 1 1.212 -7.668 -21.783 1.00 0.00 S ATOM 1330 CE MET B 1 2.024 -8.578 -23.092 1.00 0.00 C ATOM 0 H1 MET B 1 0.936 -4.155 -22.237 1.00 0.00 H new ATOM 0 H2 MET B 1 1.249 -2.955 -21.077 1.00 0.00 H new ATOM 0 H3 MET B 1 2.478 -4.034 -21.537 1.00 0.00 H new ATOM 0 HA MET B 1 0.182 -5.435 -20.634 1.00 0.00 H new ATOM 0 HB2 MET B 1 3.046 -5.265 -19.624 1.00 0.00 H new ATOM 0 HB3 MET B 1 1.872 -6.470 -19.132 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.005 -6.087 -21.922 1.00 0.00 H new ATOM 0 HG3 MET B 1 3.383 -7.389 -20.812 1.00 0.00 H new ATOM 0 HE1 MET B 1 1.299 -9.219 -23.594 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.449 -7.879 -23.812 1.00 0.00 H new ATOM 0 HE3 MET B 1 2.819 -9.192 -22.669 1.00 0.00 H new ATOM 1339 N PRO B 2 -0.184 -4.637 -18.177 1.00 0.00 N ATOM 1340 CA PRO B 2 -0.637 -3.960 -16.955 1.00 0.00 C ATOM 1341 C PRO B 2 0.496 -3.702 -15.966 1.00 0.00 C ATOM 1342 O PRO B 2 0.732 -4.486 -15.044 1.00 0.00 O ATOM 1343 CB PRO B 2 -1.664 -4.925 -16.350 1.00 0.00 C ATOM 1344 CG PRO B 2 -2.014 -5.867 -17.452 1.00 0.00 C ATOM 1345 CD PRO B 2 -0.785 -5.972 -18.308 1.00 0.00 C ATOM 0 HA PRO B 2 -1.045 -2.975 -17.180 1.00 0.00 H new ATOM 0 HB2 PRO B 2 -1.248 -5.457 -15.495 1.00 0.00 H new ATOM 0 HB3 PRO B 2 -2.545 -4.390 -15.995 1.00 0.00 H new ATOM 0 HG2 PRO B 2 -2.299 -6.842 -17.057 1.00 0.00 H new ATOM 0 HG3 PRO B 2 -2.861 -5.496 -18.029 1.00 0.00 H new ATOM 0 HD2 PRO B 2 -0.113 -6.755 -17.957 1.00 0.00 H new ATOM 0 HD3 PRO B 2 -1.032 -6.205 -19.344 1.00 0.00 H new ATOM 1353 N ILE B 3 1.212 -2.614 -16.195 1.00 0.00 N ATOM 1354 CA ILE B 3 2.268 -2.170 -15.304 1.00 0.00 C ATOM 1355 C ILE B 3 2.125 -0.676 -15.069 1.00 0.00 C ATOM 1356 O ILE B 3 1.868 0.079 -16.009 1.00 0.00 O ATOM 1357 CB ILE B 3 3.681 -2.466 -15.871 1.00 0.00 C ATOM 1358 CG1 ILE B 3 3.903 -3.976 -16.002 1.00 0.00 C ATOM 1359 CG2 ILE B 3 4.761 -1.848 -14.987 1.00 0.00 C ATOM 1360 CD1 ILE B 3 5.318 -4.348 -16.391 1.00 0.00 C ATOM 0 H ILE B 3 1.076 -2.012 -17.007 1.00 0.00 H new ATOM 0 HA ILE B 3 2.167 -2.722 -14.369 1.00 0.00 H new ATOM 0 HB ILE B 3 3.748 -2.016 -16.862 1.00 0.00 H new ATOM 0 HG12 ILE B 3 3.658 -4.455 -15.054 1.00 0.00 H new ATOM 0 HG13 ILE B 3 3.214 -4.373 -16.747 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.743 -2.069 -15.405 1.00 0.00 H new ATOM 0 HG22 ILE B 3 4.620 -0.768 -14.942 1.00 0.00 H new ATOM 0 HG23 ILE B 3 4.692 -2.265 -13.982 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.402 -5.432 -16.465 1.00 0.00 H new ATOM 0 HD12 ILE B 3 5.561 -3.899 -17.354 1.00 0.00 H new ATOM 0 HD13 ILE B 3 6.012 -3.981 -15.634 1.00 0.00 H new ATOM 1372 N THR B 4 2.278 -0.261 -13.820 1.00 0.00 N ATOM 1373 CA THR B 4 2.170 1.140 -13.456 1.00 0.00 C ATOM 1374 C THR B 4 3.310 1.962 -14.070 1.00 0.00 C ATOM 1375 O THR B 4 4.374 2.154 -13.476 1.00 0.00 O ATOM 1376 CB THR B 4 2.127 1.312 -11.923 1.00 0.00 C ATOM 1377 OG1 THR B 4 2.184 2.697 -11.575 1.00 0.00 O ATOM 1378 CG2 THR B 4 3.267 0.555 -11.251 1.00 0.00 C ATOM 0 H THR B 4 2.479 -0.883 -13.037 1.00 0.00 H new ATOM 0 HA THR B 4 1.232 1.517 -13.863 1.00 0.00 H new ATOM 0 HB THR B 4 1.185 0.895 -11.566 1.00 0.00 H new ATOM 0 HG1 THR B 4 3.048 2.894 -11.155 1.00 0.00 H new ATOM 0 HG21 THR B 4 3.210 0.695 -10.172 1.00 0.00 H new ATOM 0 HG22 THR B 4 3.186 -0.507 -11.484 1.00 0.00 H new ATOM 0 HG23 THR B 4 4.221 0.935 -11.617 1.00 0.00 H new ATOM 1386 N SER B 5 3.075 2.403 -15.292 1.00 0.00 N ATOM 1387 CA SER B 5 4.008 3.219 -16.047 1.00 0.00 C ATOM 1388 C SER B 5 3.239 3.924 -17.152 1.00 0.00 C ATOM 1389 O SER B 5 2.007 3.891 -17.142 1.00 0.00 O ATOM 1390 CB SER B 5 5.122 2.351 -16.640 1.00 0.00 C ATOM 1391 OG SER B 5 5.946 1.803 -15.623 1.00 0.00 O ATOM 0 H SER B 5 2.213 2.200 -15.798 1.00 0.00 H new ATOM 0 HA SER B 5 4.474 3.954 -15.391 1.00 0.00 H new ATOM 0 HB2 SER B 5 4.684 1.545 -17.229 1.00 0.00 H new ATOM 0 HB3 SER B 5 5.729 2.949 -17.320 1.00 0.00 H new ATOM 0 HG SER B 5 5.646 2.127 -14.748 1.00 0.00 H new ATOM 1397 N LYS B 6 3.950 4.565 -18.089 1.00 0.00 N ATOM 1398 CA LYS B 6 3.308 5.281 -19.194 1.00 0.00 C ATOM 1399 C LYS B 6 2.710 6.594 -18.671 1.00 0.00 C ATOM 1400 O LYS B 6 1.952 7.286 -19.352 1.00 0.00 O ATOM 1401 CB LYS B 6 2.248 4.368 -19.841 1.00 0.00 C ATOM 1402 CG LYS B 6 1.416 4.980 -20.958 1.00 0.00 C ATOM 1403 CD LYS B 6 0.226 4.088 -21.276 1.00 0.00 C ATOM 1404 CE LYS B 6 -0.592 3.799 -20.022 1.00 0.00 C ATOM 1405 NZ LYS B 6 -1.653 2.783 -20.249 1.00 0.00 N ATOM 0 H LYS B 6 4.969 4.601 -18.102 1.00 0.00 H new ATOM 0 HA LYS B 6 4.036 5.538 -19.963 1.00 0.00 H new ATOM 0 HB2 LYS B 6 2.752 3.486 -20.235 1.00 0.00 H new ATOM 0 HB3 LYS B 6 1.570 4.025 -19.059 1.00 0.00 H new ATOM 0 HG2 LYS B 6 1.069 5.970 -20.662 1.00 0.00 H new ATOM 0 HG3 LYS B 6 2.030 5.111 -21.849 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.405 4.570 -22.023 1.00 0.00 H new ATOM 0 HD3 LYS B 6 0.575 3.151 -21.710 1.00 0.00 H new ATOM 0 HE2 LYS B 6 0.073 3.453 -19.231 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -1.050 4.724 -19.671 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.178 2.625 -19.365 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -2.307 3.122 -20.984 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -1.218 1.890 -20.557 1.00 0.00 H new ATOM 1419 N TYR B 7 3.095 6.940 -17.448 1.00 0.00 N ATOM 1420 CA TYR B 7 2.651 8.174 -16.818 1.00 0.00 C ATOM 1421 C TYR B 7 3.842 9.109 -16.656 1.00 0.00 C ATOM 1422 O TYR B 7 4.993 8.665 -16.690 1.00 0.00 O ATOM 1423 CB TYR B 7 2.036 7.894 -15.438 1.00 0.00 C ATOM 1424 CG TYR B 7 1.102 6.703 -15.398 1.00 0.00 C ATOM 1425 CD1 TYR B 7 -0.048 6.664 -16.175 1.00 0.00 C ATOM 1426 CD2 TYR B 7 1.377 5.613 -14.576 1.00 0.00 C ATOM 1427 CE1 TYR B 7 -0.899 5.576 -16.135 1.00 0.00 C ATOM 1428 CE2 TYR B 7 0.533 4.524 -14.533 1.00 0.00 C ATOM 1429 CZ TYR B 7 -0.602 4.509 -15.316 1.00 0.00 C ATOM 1430 OH TYR B 7 -1.451 3.423 -15.273 1.00 0.00 O ATOM 0 H TYR B 7 3.719 6.377 -16.870 1.00 0.00 H new ATOM 0 HA TYR B 7 1.891 8.634 -17.450 1.00 0.00 H new ATOM 0 HB2 TYR B 7 2.841 7.733 -14.721 1.00 0.00 H new ATOM 0 HB3 TYR B 7 1.490 8.779 -15.111 1.00 0.00 H new ATOM 0 HD1 TYR B 7 -0.281 7.497 -16.821 1.00 0.00 H new ATOM 0 HD2 TYR B 7 2.266 5.621 -13.962 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -1.792 5.562 -16.742 1.00 0.00 H new ATOM 0 HE2 TYR B 7 0.759 3.687 -13.889 1.00 0.00 H new ATOM 0 HH TYR B 7 -0.935 2.599 -15.394 1.00 0.00 H new ATOM 1440 N THR B 8 3.575 10.395 -16.487 1.00 0.00 N ATOM 1441 CA THR B 8 4.632 11.357 -16.211 1.00 0.00 C ATOM 1442 C THR B 8 5.306 11.028 -14.877 1.00 0.00 C ATOM 1443 O THR B 8 4.677 11.117 -13.823 1.00 0.00 O ATOM 1444 CB THR B 8 4.069 12.791 -16.156 1.00 0.00 C ATOM 1445 OG1 THR B 8 3.210 13.022 -17.280 1.00 0.00 O ATOM 1446 CG2 THR B 8 5.192 13.819 -16.149 1.00 0.00 C ATOM 0 H THR B 8 2.638 10.796 -16.536 1.00 0.00 H new ATOM 0 HA THR B 8 5.363 11.296 -17.017 1.00 0.00 H new ATOM 0 HB THR B 8 3.499 12.897 -15.233 1.00 0.00 H new ATOM 0 HG1 THR B 8 2.854 13.934 -17.238 1.00 0.00 H new ATOM 0 HG21 THR B 8 4.767 14.822 -16.110 1.00 0.00 H new ATOM 0 HG22 THR B 8 5.826 13.659 -15.277 1.00 0.00 H new ATOM 0 HG23 THR B 8 5.788 13.713 -17.055 1.00 0.00 H new ATOM 1454 N ASP B 9 6.577 10.634 -14.930 1.00 0.00 N ATOM 1455 CA ASP B 9 7.312 10.231 -13.727 1.00 0.00 C ATOM 1456 C ASP B 9 7.341 11.356 -12.701 1.00 0.00 C ATOM 1457 O ASP B 9 7.056 11.143 -11.520 1.00 0.00 O ATOM 1458 CB ASP B 9 8.743 9.819 -14.081 1.00 0.00 C ATOM 1459 CG ASP B 9 9.517 9.324 -12.874 1.00 0.00 C ATOM 1460 OD1 ASP B 9 9.408 8.125 -12.548 1.00 0.00 O ATOM 1461 OD2 ASP B 9 10.242 10.129 -12.252 1.00 0.00 O ATOM 0 H ASP B 9 7.121 10.584 -15.791 1.00 0.00 H new ATOM 0 HA ASP B 9 6.792 9.377 -13.293 1.00 0.00 H new ATOM 0 HB2 ASP B 9 8.716 9.035 -14.838 1.00 0.00 H new ATOM 0 HB3 ASP B 9 9.265 10.669 -14.520 1.00 0.00 H new ATOM 1466 N GLU B 10 7.671 12.552 -13.168 1.00 0.00 N ATOM 1467 CA GLU B 10 7.692 13.734 -12.317 1.00 0.00 C ATOM 1468 C GLU B 10 6.328 13.955 -11.677 1.00 0.00 C ATOM 1469 O GLU B 10 6.227 14.280 -10.496 1.00 0.00 O ATOM 1470 CB GLU B 10 8.081 14.961 -13.137 1.00 0.00 C ATOM 1471 CG GLU B 10 8.148 16.247 -12.333 1.00 0.00 C ATOM 1472 CD GLU B 10 7.487 17.400 -13.054 1.00 0.00 C ATOM 1473 OE1 GLU B 10 8.065 17.904 -14.038 1.00 0.00 O ATOM 1474 OE2 GLU B 10 6.383 17.807 -12.636 1.00 0.00 O ATOM 0 H GLU B 10 7.930 12.730 -14.138 1.00 0.00 H new ATOM 0 HA GLU B 10 8.429 13.579 -11.529 1.00 0.00 H new ATOM 0 HB2 GLU B 10 9.052 14.783 -13.599 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.361 15.088 -13.946 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.664 16.097 -11.368 1.00 0.00 H new ATOM 0 HG3 GLU B 10 9.190 16.495 -12.131 1.00 0.00 H new ATOM 1481 N GLN B 11 5.278 13.756 -12.468 1.00 0.00 N ATOM 1482 CA GLN B 11 3.916 13.940 -11.990 1.00 0.00 C ATOM 1483 C GLN B 11 3.613 12.947 -10.875 1.00 0.00 C ATOM 1484 O GLN B 11 2.930 13.276 -9.909 1.00 0.00 O ATOM 1485 CB GLN B 11 2.912 13.757 -13.126 1.00 0.00 C ATOM 1486 CG GLN B 11 1.505 14.199 -12.759 1.00 0.00 C ATOM 1487 CD GLN B 11 0.483 13.907 -13.833 1.00 0.00 C ATOM 1488 OE1 GLN B 11 -0.696 13.716 -13.540 1.00 0.00 O ATOM 1489 NE2 GLN B 11 0.917 13.869 -15.081 1.00 0.00 N ATOM 0 H GLN B 11 5.347 13.467 -13.444 1.00 0.00 H new ATOM 0 HA GLN B 11 3.826 14.956 -11.605 1.00 0.00 H new ATOM 0 HB2 GLN B 11 3.249 14.323 -13.994 1.00 0.00 H new ATOM 0 HB3 GLN B 11 2.891 12.707 -13.418 1.00 0.00 H new ATOM 0 HG2 GLN B 11 1.205 13.700 -11.837 1.00 0.00 H new ATOM 0 HG3 GLN B 11 1.510 15.270 -12.555 1.00 0.00 H new ATOM 0 HE21 GLN B 11 1.903 14.033 -15.283 1.00 0.00 H new ATOM 0 HE22 GLN B 11 0.266 13.676 -15.842 1.00 0.00 H new ATOM 1498 N VAL B 12 4.131 11.731 -11.016 1.00 0.00 N ATOM 1499 CA VAL B 12 3.990 10.714 -9.981 1.00 0.00 C ATOM 1500 C VAL B 12 4.579 11.221 -8.669 1.00 0.00 C ATOM 1501 O VAL B 12 3.956 11.105 -7.611 1.00 0.00 O ATOM 1502 CB VAL B 12 4.684 9.391 -10.378 1.00 0.00 C ATOM 1503 CG1 VAL B 12 4.600 8.375 -9.248 1.00 0.00 C ATOM 1504 CG2 VAL B 12 4.072 8.820 -11.650 1.00 0.00 C ATOM 0 H VAL B 12 4.653 11.426 -11.838 1.00 0.00 H new ATOM 0 HA VAL B 12 2.925 10.515 -9.859 1.00 0.00 H new ATOM 0 HB VAL B 12 5.735 9.608 -10.568 1.00 0.00 H new ATOM 0 HG11 VAL B 12 5.095 7.452 -9.551 1.00 0.00 H new ATOM 0 HG12 VAL B 12 5.091 8.776 -8.361 1.00 0.00 H new ATOM 0 HG13 VAL B 12 3.554 8.168 -9.022 1.00 0.00 H new ATOM 0 HG21 VAL B 12 4.576 7.889 -11.910 1.00 0.00 H new ATOM 0 HG22 VAL B 12 3.012 8.626 -11.488 1.00 0.00 H new ATOM 0 HG23 VAL B 12 4.189 9.536 -12.463 1.00 0.00 H new ATOM 1514 N GLU B 13 5.768 11.808 -8.751 1.00 0.00 N ATOM 1515 CA GLU B 13 6.422 12.367 -7.577 1.00 0.00 C ATOM 1516 C GLU B 13 5.616 13.544 -7.027 1.00 0.00 C ATOM 1517 O GLU B 13 5.546 13.749 -5.815 1.00 0.00 O ATOM 1518 CB GLU B 13 7.845 12.817 -7.912 1.00 0.00 C ATOM 1519 CG GLU B 13 8.651 13.219 -6.688 1.00 0.00 C ATOM 1520 CD GLU B 13 10.019 13.764 -7.034 1.00 0.00 C ATOM 1521 OE1 GLU B 13 10.935 12.961 -7.295 1.00 0.00 O ATOM 1522 OE2 GLU B 13 10.185 15.004 -7.040 1.00 0.00 O ATOM 0 H GLU B 13 6.297 11.908 -9.618 1.00 0.00 H new ATOM 0 HA GLU B 13 6.475 11.589 -6.815 1.00 0.00 H new ATOM 0 HB2 GLU B 13 8.362 12.009 -8.430 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.799 13.660 -8.602 1.00 0.00 H new ATOM 0 HG2 GLU B 13 8.098 13.972 -6.126 1.00 0.00 H new ATOM 0 HG3 GLU B 13 8.765 12.354 -6.035 1.00 0.00 H new ATOM 1529 N LYS B 14 5.006 14.313 -7.923 1.00 0.00 N ATOM 1530 CA LYS B 14 4.166 15.437 -7.522 1.00 0.00 C ATOM 1531 C LYS B 14 2.942 14.946 -6.753 1.00 0.00 C ATOM 1532 O LYS B 14 2.585 15.510 -5.721 1.00 0.00 O ATOM 1533 CB LYS B 14 3.732 16.255 -8.742 1.00 0.00 C ATOM 1534 CG LYS B 14 4.890 16.896 -9.491 1.00 0.00 C ATOM 1535 CD LYS B 14 5.688 17.824 -8.589 1.00 0.00 C ATOM 1536 CE LYS B 14 6.858 18.466 -9.323 1.00 0.00 C ATOM 1537 NZ LYS B 14 6.409 19.288 -10.476 1.00 0.00 N ATOM 0 H LYS B 14 5.077 14.179 -8.932 1.00 0.00 H new ATOM 0 HA LYS B 14 4.754 16.080 -6.867 1.00 0.00 H new ATOM 0 HB2 LYS B 14 3.182 15.608 -9.426 1.00 0.00 H new ATOM 0 HB3 LYS B 14 3.043 17.036 -8.419 1.00 0.00 H new ATOM 0 HG2 LYS B 14 5.544 16.119 -9.886 1.00 0.00 H new ATOM 0 HG3 LYS B 14 4.508 17.456 -10.345 1.00 0.00 H new ATOM 0 HD2 LYS B 14 5.033 18.603 -8.200 1.00 0.00 H new ATOM 0 HD3 LYS B 14 6.061 17.264 -7.732 1.00 0.00 H new ATOM 0 HE2 LYS B 14 7.422 19.091 -8.630 1.00 0.00 H new ATOM 0 HE3 LYS B 14 7.536 17.688 -9.675 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 7.193 19.889 -10.800 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 6.109 18.664 -11.251 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 5.610 19.887 -10.185 1.00 0.00 H new ATOM 1551 N ILE B 15 2.319 13.883 -7.253 1.00 0.00 N ATOM 1552 CA ILE B 15 1.179 13.276 -6.576 1.00 0.00 C ATOM 1553 C ILE B 15 1.599 12.789 -5.196 1.00 0.00 C ATOM 1554 O ILE B 15 0.917 13.042 -4.201 1.00 0.00 O ATOM 1555 CB ILE B 15 0.600 12.088 -7.376 1.00 0.00 C ATOM 1556 CG1 ILE B 15 0.167 12.543 -8.771 1.00 0.00 C ATOM 1557 CG2 ILE B 15 -0.575 11.465 -6.633 1.00 0.00 C ATOM 1558 CD1 ILE B 15 -0.289 11.411 -9.668 1.00 0.00 C ATOM 0 H ILE B 15 2.585 13.425 -8.125 1.00 0.00 H new ATOM 0 HA ILE B 15 0.405 14.039 -6.490 1.00 0.00 H new ATOM 0 HB ILE B 15 1.380 11.334 -7.484 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -0.643 13.265 -8.672 1.00 0.00 H new ATOM 0 HG13 ILE B 15 0.999 13.061 -9.249 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -0.970 10.630 -7.212 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -0.241 11.106 -5.660 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -1.356 12.213 -6.496 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -0.580 11.811 -10.639 1.00 0.00 H new ATOM 0 HD12 ILE B 15 0.526 10.699 -9.798 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -1.142 10.907 -9.213 1.00 0.00 H new ATOM 1570 N LEU B 16 2.739 12.107 -5.147 1.00 0.00 N ATOM 1571 CA LEU B 16 3.298 11.634 -3.889 1.00 0.00 C ATOM 1572 C LEU B 16 3.518 12.796 -2.931 1.00 0.00 C ATOM 1573 O LEU B 16 3.210 12.703 -1.744 1.00 0.00 O ATOM 1574 CB LEU B 16 4.626 10.918 -4.129 1.00 0.00 C ATOM 1575 CG LEU B 16 4.524 9.584 -4.858 1.00 0.00 C ATOM 1576 CD1 LEU B 16 5.904 9.082 -5.237 1.00 0.00 C ATOM 1577 CD2 LEU B 16 3.805 8.562 -3.991 1.00 0.00 C ATOM 0 H LEU B 16 3.295 11.870 -5.969 1.00 0.00 H new ATOM 0 HA LEU B 16 2.588 10.935 -3.447 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.277 11.578 -4.702 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.109 10.751 -3.166 1.00 0.00 H new ATOM 0 HG LEU B 16 3.947 9.730 -5.771 1.00 0.00 H new ATOM 0 HD11 LEU B 16 5.814 8.128 -5.757 1.00 0.00 H new ATOM 0 HD12 LEU B 16 6.388 9.807 -5.891 1.00 0.00 H new ATOM 0 HD13 LEU B 16 6.503 8.949 -4.336 1.00 0.00 H new ATOM 0 HD21 LEU B 16 3.739 7.614 -4.525 1.00 0.00 H new ATOM 0 HD22 LEU B 16 4.358 8.419 -3.063 1.00 0.00 H new ATOM 0 HD23 LEU B 16 2.801 8.920 -3.763 1.00 0.00 H new ATOM 1589 N ALA B 17 4.055 13.888 -3.464 1.00 0.00 N ATOM 1590 CA ALA B 17 4.310 15.088 -2.682 1.00 0.00 C ATOM 1591 C ALA B 17 3.015 15.649 -2.113 1.00 0.00 C ATOM 1592 O ALA B 17 2.948 15.981 -0.931 1.00 0.00 O ATOM 1593 CB ALA B 17 5.019 16.135 -3.529 1.00 0.00 C ATOM 0 H ALA B 17 4.324 13.965 -4.445 1.00 0.00 H new ATOM 0 HA ALA B 17 4.959 14.820 -1.848 1.00 0.00 H new ATOM 0 HB1 ALA B 17 5.202 17.026 -2.928 1.00 0.00 H new ATOM 0 HB2 ALA B 17 5.969 15.734 -3.883 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.394 16.395 -4.384 1.00 0.00 H new ATOM 1599 N GLU B 18 1.986 15.741 -2.952 1.00 0.00 N ATOM 1600 CA GLU B 18 0.683 16.232 -2.513 1.00 0.00 C ATOM 1601 C GLU B 18 0.131 15.360 -1.390 1.00 0.00 C ATOM 1602 O GLU B 18 -0.337 15.872 -0.372 1.00 0.00 O ATOM 1603 CB GLU B 18 -0.306 16.276 -3.678 1.00 0.00 C ATOM 1604 CG GLU B 18 0.010 17.347 -4.706 1.00 0.00 C ATOM 1605 CD GLU B 18 -0.979 17.369 -5.856 1.00 0.00 C ATOM 1606 OE1 GLU B 18 -2.164 17.689 -5.624 1.00 0.00 O ATOM 1607 OE2 GLU B 18 -0.570 17.087 -7.003 1.00 0.00 O ATOM 0 H GLU B 18 2.029 15.482 -3.938 1.00 0.00 H new ATOM 0 HA GLU B 18 0.817 17.246 -2.137 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.317 15.304 -4.171 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -1.309 16.446 -3.286 1.00 0.00 H new ATOM 0 HG2 GLU B 18 0.015 18.322 -4.218 1.00 0.00 H new ATOM 0 HG3 GLU B 18 1.013 17.182 -5.099 1.00 0.00 H new ATOM 1614 N VAL B 19 0.199 14.045 -1.574 1.00 0.00 N ATOM 1615 CA VAL B 19 -0.258 13.103 -0.556 1.00 0.00 C ATOM 1616 C VAL B 19 0.558 13.254 0.727 1.00 0.00 C ATOM 1617 O VAL B 19 0.000 13.324 1.826 1.00 0.00 O ATOM 1618 CB VAL B 19 -0.172 11.643 -1.058 1.00 0.00 C ATOM 1619 CG1 VAL B 19 -0.565 10.659 0.036 1.00 0.00 C ATOM 1620 CG2 VAL B 19 -1.052 11.446 -2.285 1.00 0.00 C ATOM 0 H VAL B 19 0.566 13.607 -2.419 1.00 0.00 H new ATOM 0 HA VAL B 19 -1.302 13.335 -0.345 1.00 0.00 H new ATOM 0 HB VAL B 19 0.864 11.447 -1.334 1.00 0.00 H new ATOM 0 HG11 VAL B 19 -0.494 9.641 -0.348 1.00 0.00 H new ATOM 0 HG12 VAL B 19 0.107 10.773 0.887 1.00 0.00 H new ATOM 0 HG13 VAL B 19 -1.589 10.857 0.353 1.00 0.00 H new ATOM 0 HG21 VAL B 19 -0.978 10.413 -2.624 1.00 0.00 H new ATOM 0 HG22 VAL B 19 -2.088 11.671 -2.030 1.00 0.00 H new ATOM 0 HG23 VAL B 19 -0.721 12.113 -3.081 1.00 0.00 H new ATOM 1630 N ALA B 20 1.877 13.325 0.578 1.00 0.00 N ATOM 1631 CA ALA B 20 2.776 13.491 1.716 1.00 0.00 C ATOM 1632 C ALA B 20 2.492 14.792 2.456 1.00 0.00 C ATOM 1633 O ALA B 20 2.590 14.856 3.684 1.00 0.00 O ATOM 1634 CB ALA B 20 4.225 13.453 1.257 1.00 0.00 C ATOM 0 H ALA B 20 2.349 13.270 -0.324 1.00 0.00 H new ATOM 0 HA ALA B 20 2.602 12.664 2.405 1.00 0.00 H new ATOM 0 HB1 ALA B 20 4.883 13.578 2.117 1.00 0.00 H new ATOM 0 HB2 ALA B 20 4.430 12.495 0.780 1.00 0.00 H new ATOM 0 HB3 ALA B 20 4.402 14.259 0.545 1.00 0.00 H new ATOM 1640 N LEU B 21 2.136 15.831 1.710 1.00 0.00 N ATOM 1641 CA LEU B 21 1.800 17.111 2.311 1.00 0.00 C ATOM 1642 C LEU B 21 0.482 17.029 3.065 1.00 0.00 C ATOM 1643 O LEU B 21 0.303 17.703 4.074 1.00 0.00 O ATOM 1644 CB LEU B 21 1.735 18.216 1.258 1.00 0.00 C ATOM 1645 CG LEU B 21 3.079 18.586 0.626 1.00 0.00 C ATOM 1646 CD1 LEU B 21 2.914 19.764 -0.316 1.00 0.00 C ATOM 1647 CD2 LEU B 21 4.108 18.907 1.704 1.00 0.00 C ATOM 0 H LEU B 21 2.073 15.810 0.692 1.00 0.00 H new ATOM 0 HA LEU B 21 2.591 17.358 3.019 1.00 0.00 H new ATOM 0 HB2 LEU B 21 1.052 17.904 0.468 1.00 0.00 H new ATOM 0 HB3 LEU B 21 1.307 19.108 1.715 1.00 0.00 H new ATOM 0 HG LEU B 21 3.437 17.731 0.053 1.00 0.00 H new ATOM 0 HD11 LEU B 21 3.879 20.015 -0.757 1.00 0.00 H new ATOM 0 HD12 LEU B 21 2.210 19.502 -1.106 1.00 0.00 H new ATOM 0 HD13 LEU B 21 2.534 20.622 0.238 1.00 0.00 H new ATOM 0 HD21 LEU B 21 5.057 19.168 1.235 1.00 0.00 H new ATOM 0 HD22 LEU B 21 3.757 19.747 2.304 1.00 0.00 H new ATOM 0 HD23 LEU B 21 4.247 18.036 2.345 1.00 0.00 H new ATOM 1659 N VAL B 22 -0.435 16.199 2.582 1.00 0.00 N ATOM 1660 CA VAL B 22 -1.686 15.963 3.293 1.00 0.00 C ATOM 1661 C VAL B 22 -1.393 15.292 4.628 1.00 0.00 C ATOM 1662 O VAL B 22 -1.985 15.625 5.657 1.00 0.00 O ATOM 1663 CB VAL B 22 -2.659 15.083 2.476 1.00 0.00 C ATOM 1664 CG1 VAL B 22 -3.900 14.752 3.290 1.00 0.00 C ATOM 1665 CG2 VAL B 22 -3.045 15.778 1.177 1.00 0.00 C ATOM 0 H VAL B 22 -0.338 15.682 1.708 1.00 0.00 H new ATOM 0 HA VAL B 22 -2.165 16.929 3.452 1.00 0.00 H new ATOM 0 HB VAL B 22 -2.151 14.150 2.232 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.571 14.132 2.695 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.610 14.212 4.191 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -4.410 15.675 3.568 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.730 15.144 0.615 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -3.531 16.727 1.403 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -2.150 15.961 0.583 1.00 0.00 H new ATOM 1675 N LEU B 23 -0.454 14.358 4.600 1.00 0.00 N ATOM 1676 CA LEU B 23 0.000 13.684 5.805 1.00 0.00 C ATOM 1677 C LEU B 23 0.628 14.690 6.764 1.00 0.00 C ATOM 1678 O LEU B 23 0.244 14.778 7.932 1.00 0.00 O ATOM 1679 CB LEU B 23 1.023 12.596 5.453 1.00 0.00 C ATOM 1680 CG LEU B 23 0.559 11.569 4.418 1.00 0.00 C ATOM 1681 CD1 LEU B 23 1.679 10.593 4.094 1.00 0.00 C ATOM 1682 CD2 LEU B 23 -0.668 10.826 4.916 1.00 0.00 C ATOM 0 H LEU B 23 0.011 14.048 3.747 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.860 13.219 6.287 1.00 0.00 H new ATOM 0 HB2 LEU B 23 1.927 13.078 5.081 1.00 0.00 H new ATOM 0 HB3 LEU B 23 1.296 12.068 6.367 1.00 0.00 H new ATOM 0 HG LEU B 23 0.291 12.100 3.504 1.00 0.00 H new ATOM 0 HD11 LEU B 23 1.330 9.870 3.356 1.00 0.00 H new ATOM 0 HD12 LEU B 23 2.532 11.139 3.692 1.00 0.00 H new ATOM 0 HD13 LEU B 23 1.979 10.069 5.002 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -0.983 10.100 4.166 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.428 10.308 5.844 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -1.475 11.536 5.095 1.00 0.00 H new ATOM 1694 N GLU B 24 1.575 15.462 6.245 1.00 0.00 N ATOM 1695 CA GLU B 24 2.293 16.458 7.030 1.00 0.00 C ATOM 1696 C GLU B 24 1.338 17.522 7.567 1.00 0.00 C ATOM 1697 O GLU B 24 1.507 18.024 8.678 1.00 0.00 O ATOM 1698 CB GLU B 24 3.381 17.095 6.165 1.00 0.00 C ATOM 1699 CG GLU B 24 4.325 18.001 6.930 1.00 0.00 C ATOM 1700 CD GLU B 24 5.539 18.378 6.116 1.00 0.00 C ATOM 1701 OE1 GLU B 24 6.525 17.615 6.137 1.00 0.00 O ATOM 1702 OE2 GLU B 24 5.512 19.427 5.440 1.00 0.00 O ATOM 0 H GLU B 24 1.867 15.415 5.269 1.00 0.00 H new ATOM 0 HA GLU B 24 2.756 15.969 7.887 1.00 0.00 H new ATOM 0 HB2 GLU B 24 3.960 16.305 5.687 1.00 0.00 H new ATOM 0 HB3 GLU B 24 2.908 17.670 5.369 1.00 0.00 H new ATOM 0 HG2 GLU B 24 3.795 18.905 7.229 1.00 0.00 H new ATOM 0 HG3 GLU B 24 4.644 17.501 7.845 1.00 0.00 H new ATOM 1709 N LYS B 25 0.322 17.835 6.776 1.00 0.00 N ATOM 1710 CA LYS B 25 -0.706 18.800 7.154 1.00 0.00 C ATOM 1711 C LYS B 25 -1.422 18.379 8.437 1.00 0.00 C ATOM 1712 O LYS B 25 -1.836 19.219 9.233 1.00 0.00 O ATOM 1713 CB LYS B 25 -1.710 18.935 6.007 1.00 0.00 C ATOM 1714 CG LYS B 25 -2.895 19.836 6.304 1.00 0.00 C ATOM 1715 CD LYS B 25 -2.459 21.253 6.622 1.00 0.00 C ATOM 1716 CE LYS B 25 -3.659 22.169 6.741 1.00 0.00 C ATOM 1717 NZ LYS B 25 -4.343 22.361 5.437 1.00 0.00 N ATOM 0 H LYS B 25 0.185 17.427 5.851 1.00 0.00 H new ATOM 0 HA LYS B 25 -0.230 19.761 7.346 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -1.189 19.320 5.130 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -2.081 17.943 5.748 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -3.568 19.846 5.446 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -3.458 19.431 7.145 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -1.893 21.264 7.554 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -1.793 21.618 5.840 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -4.363 21.753 7.462 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -3.340 23.136 7.129 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -4.975 23.185 5.495 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -3.634 22.520 4.693 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -4.900 21.513 5.209 1.00 0.00 H new ATOM 1731 N HIS B 26 -1.560 17.077 8.635 1.00 0.00 N ATOM 1732 CA HIS B 26 -2.254 16.562 9.808 1.00 0.00 C ATOM 1733 C HIS B 26 -1.263 15.970 10.804 1.00 0.00 C ATOM 1734 O HIS B 26 -1.662 15.342 11.782 1.00 0.00 O ATOM 1735 CB HIS B 26 -3.285 15.506 9.401 1.00 0.00 C ATOM 1736 CG HIS B 26 -4.421 16.040 8.578 1.00 0.00 C ATOM 1737 ND1 HIS B 26 -5.723 16.086 9.029 1.00 0.00 N ATOM 1738 CD2 HIS B 26 -4.452 16.520 7.311 1.00 0.00 C ATOM 1739 CE1 HIS B 26 -6.501 16.563 8.077 1.00 0.00 C ATOM 1740 NE2 HIS B 26 -5.756 16.836 7.025 1.00 0.00 N ATOM 0 H HIS B 26 -1.203 16.360 8.003 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.773 17.392 10.287 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.781 14.721 8.838 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -3.689 15.043 10.301 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.606 16.633 6.649 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -7.569 16.706 8.148 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -6.094 17.220 6.142 1.00 0.00 H new ATOM 1749 N ALA B 27 0.028 16.181 10.536 1.00 0.00 N ATOM 1750 CA ALA B 27 1.105 15.696 11.400 1.00 0.00 C ATOM 1751 C ALA B 27 1.094 14.173 11.498 1.00 0.00 C ATOM 1752 O ALA B 27 1.436 13.603 12.537 1.00 0.00 O ATOM 1753 CB ALA B 27 1.009 16.326 12.786 1.00 0.00 C ATOM 0 H ALA B 27 0.355 16.692 9.716 1.00 0.00 H new ATOM 0 HA ALA B 27 2.052 15.994 10.951 1.00 0.00 H new ATOM 0 HB1 ALA B 27 1.819 15.952 13.413 1.00 0.00 H new ATOM 0 HB2 ALA B 27 1.088 17.410 12.699 1.00 0.00 H new ATOM 0 HB3 ALA B 27 0.051 16.067 13.238 1.00 0.00 H new ATOM 1759 N ALA B 28 0.733 13.523 10.396 1.00 0.00 N ATOM 1760 CA ALA B 28 0.640 12.071 10.349 1.00 0.00 C ATOM 1761 C ALA B 28 1.987 11.418 10.635 1.00 0.00 C ATOM 1762 O ALA B 28 3.006 11.777 10.041 1.00 0.00 O ATOM 1763 CB ALA B 28 0.115 11.621 8.995 1.00 0.00 C ATOM 0 H ALA B 28 0.499 13.985 9.517 1.00 0.00 H new ATOM 0 HA ALA B 28 -0.057 11.755 11.125 1.00 0.00 H new ATOM 0 HB1 ALA B 28 0.050 10.533 8.973 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -0.874 12.047 8.829 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.792 11.960 8.211 1.00 0.00 H new ATOM 1769 N SER B 29 1.979 10.467 11.556 1.00 0.00 N ATOM 1770 CA SER B 29 3.176 9.725 11.919 1.00 0.00 C ATOM 1771 C SER B 29 3.556 8.749 10.806 1.00 0.00 C ATOM 1772 O SER B 29 2.745 8.472 9.919 1.00 0.00 O ATOM 1773 CB SER B 29 2.912 8.960 13.217 1.00 0.00 C ATOM 1774 OG SER B 29 1.780 8.114 13.073 1.00 0.00 O ATOM 0 H SER B 29 1.144 10.188 12.072 1.00 0.00 H new ATOM 0 HA SER B 29 4.003 10.421 12.062 1.00 0.00 H new ATOM 0 HB2 SER B 29 3.787 8.365 13.480 1.00 0.00 H new ATOM 0 HB3 SER B 29 2.747 9.663 14.033 1.00 0.00 H new ATOM 0 HG SER B 29 1.532 7.748 13.947 1.00 0.00 H new ATOM 1780 N PRO B 30 4.793 8.216 10.827 1.00 0.00 N ATOM 1781 CA PRO B 30 5.211 7.168 9.891 1.00 0.00 C ATOM 1782 C PRO B 30 4.267 5.968 9.936 1.00 0.00 C ATOM 1783 O PRO B 30 3.986 5.344 8.910 1.00 0.00 O ATOM 1784 CB PRO B 30 6.606 6.776 10.387 1.00 0.00 C ATOM 1785 CG PRO B 30 7.100 7.976 11.116 1.00 0.00 C ATOM 1786 CD PRO B 30 5.886 8.607 11.740 1.00 0.00 C ATOM 0 HA PRO B 30 5.203 7.509 8.856 1.00 0.00 H new ATOM 0 HB2 PRO B 30 6.563 5.905 11.041 1.00 0.00 H new ATOM 0 HB3 PRO B 30 7.264 6.519 9.557 1.00 0.00 H new ATOM 0 HG2 PRO B 30 7.830 7.698 11.876 1.00 0.00 H new ATOM 0 HG3 PRO B 30 7.595 8.670 10.436 1.00 0.00 H new ATOM 0 HD2 PRO B 30 5.716 8.239 12.752 1.00 0.00 H new ATOM 0 HD3 PRO B 30 5.986 9.690 11.808 1.00 0.00 H new ATOM 1794 N GLU B 31 3.768 5.673 11.134 1.00 0.00 N ATOM 1795 CA GLU B 31 2.796 4.605 11.329 1.00 0.00 C ATOM 1796 C GLU B 31 1.538 4.875 10.515 1.00 0.00 C ATOM 1797 O GLU B 31 1.093 4.032 9.735 1.00 0.00 O ATOM 1798 CB GLU B 31 2.427 4.494 12.807 1.00 0.00 C ATOM 1799 CG GLU B 31 3.605 4.195 13.715 1.00 0.00 C ATOM 1800 CD GLU B 31 3.233 4.269 15.182 1.00 0.00 C ATOM 1801 OE1 GLU B 31 2.383 3.472 15.628 1.00 0.00 O ATOM 1802 OE2 GLU B 31 3.781 5.135 15.897 1.00 0.00 O ATOM 0 H GLU B 31 4.025 6.165 11.990 1.00 0.00 H new ATOM 0 HA GLU B 31 3.244 3.669 10.995 1.00 0.00 H new ATOM 0 HB2 GLU B 31 1.963 5.427 13.126 1.00 0.00 H new ATOM 0 HB3 GLU B 31 1.680 3.709 12.927 1.00 0.00 H new ATOM 0 HG2 GLU B 31 3.991 3.201 13.490 1.00 0.00 H new ATOM 0 HG3 GLU B 31 4.408 4.903 13.510 1.00 0.00 H new ATOM 1809 N LEU B 32 0.974 6.067 10.693 1.00 0.00 N ATOM 1810 CA LEU B 32 -0.230 6.463 9.973 1.00 0.00 C ATOM 1811 C LEU B 32 0.055 6.565 8.476 1.00 0.00 C ATOM 1812 O LEU B 32 -0.796 6.241 7.649 1.00 0.00 O ATOM 1813 CB LEU B 32 -0.756 7.798 10.509 1.00 0.00 C ATOM 1814 CG LEU B 32 -2.046 8.305 9.860 1.00 0.00 C ATOM 1815 CD1 LEU B 32 -3.156 7.280 10.006 1.00 0.00 C ATOM 1816 CD2 LEU B 32 -2.465 9.629 10.477 1.00 0.00 C ATOM 0 H LEU B 32 1.334 6.776 11.332 1.00 0.00 H new ATOM 0 HA LEU B 32 -0.994 5.702 10.129 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -0.924 7.698 11.581 1.00 0.00 H new ATOM 0 HB3 LEU B 32 0.018 8.554 10.376 1.00 0.00 H new ATOM 0 HG LEU B 32 -1.858 8.460 8.798 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -4.065 7.659 9.538 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -2.859 6.350 9.521 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -3.343 7.094 11.064 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -3.384 9.976 10.005 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -2.634 9.495 11.545 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -1.678 10.367 10.324 1.00 0.00 H new ATOM 1828 N THR B 33 1.265 7.000 8.146 1.00 0.00 N ATOM 1829 CA THR B 33 1.701 7.100 6.759 1.00 0.00 C ATOM 1830 C THR B 33 1.547 5.758 6.038 1.00 0.00 C ATOM 1831 O THR B 33 0.880 5.667 5.004 1.00 0.00 O ATOM 1832 CB THR B 33 3.173 7.556 6.679 1.00 0.00 C ATOM 1833 OG1 THR B 33 3.329 8.841 7.296 1.00 0.00 O ATOM 1834 CG2 THR B 33 3.648 7.621 5.237 1.00 0.00 C ATOM 0 H THR B 33 1.967 7.291 8.827 1.00 0.00 H new ATOM 0 HA THR B 33 1.069 7.841 6.270 1.00 0.00 H new ATOM 0 HB THR B 33 3.780 6.823 7.211 1.00 0.00 H new ATOM 0 HG1 THR B 33 3.286 8.744 8.270 1.00 0.00 H new ATOM 0 HG21 THR B 33 4.688 7.945 5.211 1.00 0.00 H new ATOM 0 HG22 THR B 33 3.564 6.634 4.781 1.00 0.00 H new ATOM 0 HG23 THR B 33 3.033 8.330 4.683 1.00 0.00 H new ATOM 1842 N LEU B 34 2.142 4.717 6.606 1.00 0.00 N ATOM 1843 CA LEU B 34 2.110 3.399 5.991 1.00 0.00 C ATOM 1844 C LEU B 34 0.720 2.778 6.131 1.00 0.00 C ATOM 1845 O LEU B 34 0.270 2.032 5.260 1.00 0.00 O ATOM 1846 CB LEU B 34 3.190 2.504 6.613 1.00 0.00 C ATOM 1847 CG LEU B 34 3.474 1.200 5.861 1.00 0.00 C ATOM 1848 CD1 LEU B 34 4.946 0.835 5.965 1.00 0.00 C ATOM 1849 CD2 LEU B 34 2.618 0.067 6.405 1.00 0.00 C ATOM 0 H LEU B 34 2.651 4.761 7.489 1.00 0.00 H new ATOM 0 HA LEU B 34 2.322 3.496 4.926 1.00 0.00 H new ATOM 0 HB2 LEU B 34 4.116 3.074 6.680 1.00 0.00 H new ATOM 0 HB3 LEU B 34 2.892 2.259 7.632 1.00 0.00 H new ATOM 0 HG LEU B 34 3.222 1.353 4.812 1.00 0.00 H new ATOM 0 HD11 LEU B 34 5.130 -0.094 5.425 1.00 0.00 H new ATOM 0 HD12 LEU B 34 5.550 1.632 5.532 1.00 0.00 H new ATOM 0 HD13 LEU B 34 5.215 0.705 7.013 1.00 0.00 H new ATOM 0 HD21 LEU B 34 2.836 -0.849 5.857 1.00 0.00 H new ATOM 0 HD22 LEU B 34 2.840 -0.081 7.462 1.00 0.00 H new ATOM 0 HD23 LEU B 34 1.564 0.318 6.287 1.00 0.00 H new ATOM 1861 N MET B 35 0.040 3.112 7.224 1.00 0.00 N ATOM 1862 CA MET B 35 -1.331 2.662 7.448 1.00 0.00 C ATOM 1863 C MET B 35 -2.225 3.122 6.302 1.00 0.00 C ATOM 1864 O MET B 35 -3.044 2.363 5.782 1.00 0.00 O ATOM 1865 CB MET B 35 -1.865 3.233 8.762 1.00 0.00 C ATOM 1866 CG MET B 35 -3.225 2.681 9.164 1.00 0.00 C ATOM 1867 SD MET B 35 -4.053 3.687 10.412 1.00 0.00 S ATOM 1868 CE MET B 35 -2.729 3.951 11.589 1.00 0.00 C ATOM 0 H MET B 35 0.417 3.695 7.971 1.00 0.00 H new ATOM 0 HA MET B 35 -1.335 1.573 7.499 1.00 0.00 H new ATOM 0 HB2 MET B 35 -1.149 3.023 9.556 1.00 0.00 H new ATOM 0 HB3 MET B 35 -1.935 4.317 8.674 1.00 0.00 H new ATOM 0 HG2 MET B 35 -3.859 2.614 8.280 1.00 0.00 H new ATOM 0 HG3 MET B 35 -3.101 1.668 9.546 1.00 0.00 H new ATOM 0 HE1 MET B 35 -3.117 3.846 12.602 1.00 0.00 H new ATOM 0 HE2 MET B 35 -1.943 3.215 11.423 1.00 0.00 H new ATOM 0 HE3 MET B 35 -2.321 4.953 11.459 1.00 0.00 H new ATOM 1878 N ILE B 36 -2.056 4.378 5.918 1.00 0.00 N ATOM 1879 CA ILE B 36 -2.822 4.973 4.837 1.00 0.00 C ATOM 1880 C ILE B 36 -2.476 4.329 3.495 1.00 0.00 C ATOM 1881 O ILE B 36 -3.358 4.101 2.666 1.00 0.00 O ATOM 1882 CB ILE B 36 -2.597 6.500 4.807 1.00 0.00 C ATOM 1883 CG1 ILE B 36 -3.382 7.133 5.958 1.00 0.00 C ATOM 1884 CG2 ILE B 36 -2.988 7.108 3.465 1.00 0.00 C ATOM 1885 CD1 ILE B 36 -3.098 8.599 6.177 1.00 0.00 C ATOM 0 H ILE B 36 -1.383 5.013 6.348 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.881 4.787 5.017 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.534 6.705 4.933 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -4.448 7.007 5.767 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -3.156 6.591 6.876 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.813 8.184 3.488 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -2.387 6.660 2.674 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -4.043 6.916 3.272 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -3.697 8.965 7.011 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -2.040 8.735 6.402 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -3.352 9.157 5.276 1.00 0.00 H new ATOM 1897 N ALA B 37 -1.203 4.004 3.297 1.00 0.00 N ATOM 1898 CA ALA B 37 -0.780 3.286 2.098 1.00 0.00 C ATOM 1899 C ALA B 37 -1.521 1.956 1.980 1.00 0.00 C ATOM 1900 O ALA B 37 -1.962 1.568 0.897 1.00 0.00 O ATOM 1901 CB ALA B 37 0.725 3.054 2.117 1.00 0.00 C ATOM 0 H ALA B 37 -0.449 4.225 3.947 1.00 0.00 H new ATOM 0 HA ALA B 37 -1.025 3.897 1.229 1.00 0.00 H new ATOM 0 HB1 ALA B 37 1.022 2.518 1.216 1.00 0.00 H new ATOM 0 HB2 ALA B 37 1.241 4.014 2.155 1.00 0.00 H new ATOM 0 HB3 ALA B 37 0.991 2.464 2.994 1.00 0.00 H new ATOM 1907 N GLY B 38 -1.667 1.273 3.112 1.00 0.00 N ATOM 1908 CA GLY B 38 -2.418 0.033 3.147 1.00 0.00 C ATOM 1909 C GLY B 38 -3.883 0.247 2.831 1.00 0.00 C ATOM 1910 O GLY B 38 -4.491 -0.540 2.102 1.00 0.00 O ATOM 0 H GLY B 38 -1.276 1.559 4.009 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -1.992 -0.669 2.431 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.323 -0.421 4.133 1.00 0.00 H new ATOM 1914 N ASN B 39 -4.444 1.321 3.377 1.00 0.00 N ATOM 1915 CA ASN B 39 -5.829 1.694 3.102 1.00 0.00 C ATOM 1916 C ASN B 39 -6.036 1.919 1.609 1.00 0.00 C ATOM 1917 O ASN B 39 -7.055 1.518 1.050 1.00 0.00 O ATOM 1918 CB ASN B 39 -6.222 2.959 3.874 1.00 0.00 C ATOM 1919 CG ASN B 39 -6.683 2.671 5.293 1.00 0.00 C ATOM 1920 OD1 ASN B 39 -7.869 2.456 5.536 1.00 0.00 O ATOM 1921 ND2 ASN B 39 -5.757 2.667 6.241 1.00 0.00 N ATOM 0 H ASN B 39 -3.959 1.952 4.015 1.00 0.00 H new ATOM 0 HA ASN B 39 -6.466 0.873 3.431 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -5.370 3.638 3.906 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.019 3.473 3.336 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -6.019 2.481 7.209 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -4.782 2.850 6.003 1.00 0.00 H new ATOM 1928 N ILE B 40 -5.056 2.555 0.971 1.00 0.00 N ATOM 1929 CA ILE B 40 -5.105 2.798 -0.464 1.00 0.00 C ATOM 1930 C ILE B 40 -5.186 1.481 -1.228 1.00 0.00 C ATOM 1931 O ILE B 40 -6.134 1.258 -1.977 1.00 0.00 O ATOM 1932 CB ILE B 40 -3.880 3.604 -0.954 1.00 0.00 C ATOM 1933 CG1 ILE B 40 -3.844 4.979 -0.279 1.00 0.00 C ATOM 1934 CG2 ILE B 40 -3.912 3.755 -2.471 1.00 0.00 C ATOM 1935 CD1 ILE B 40 -2.637 5.816 -0.652 1.00 0.00 C ATOM 0 H ILE B 40 -4.217 2.911 1.429 1.00 0.00 H new ATOM 0 HA ILE B 40 -6.001 3.388 -0.658 1.00 0.00 H new ATOM 0 HB ILE B 40 -2.975 3.060 -0.682 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -4.749 5.526 -0.543 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -3.859 4.842 0.802 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -3.042 4.325 -2.798 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -3.895 2.769 -2.935 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -4.821 4.279 -2.765 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -2.684 6.774 -0.134 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -1.727 5.291 -0.362 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -2.631 5.986 -1.729 1.00 0.00 H new ATOM 1947 N ALA B 41 -4.202 0.605 -1.015 1.00 0.00 N ATOM 1948 CA ALA B 41 -4.166 -0.686 -1.688 1.00 0.00 C ATOM 1949 C ALA B 41 -5.456 -1.468 -1.459 1.00 0.00 C ATOM 1950 O ALA B 41 -6.014 -2.041 -2.393 1.00 0.00 O ATOM 1951 CB ALA B 41 -2.963 -1.488 -1.214 1.00 0.00 C ATOM 0 H ALA B 41 -3.421 0.770 -0.380 1.00 0.00 H new ATOM 0 HA ALA B 41 -4.074 -0.508 -2.759 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -2.945 -2.452 -1.723 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -2.048 -0.940 -1.441 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -3.033 -1.647 -0.138 1.00 0.00 H new ATOM 1957 N THR B 42 -5.937 -1.469 -0.220 1.00 0.00 N ATOM 1958 CA THR B 42 -7.150 -2.193 0.129 1.00 0.00 C ATOM 1959 C THR B 42 -8.374 -1.601 -0.575 1.00 0.00 C ATOM 1960 O THR B 42 -9.188 -2.331 -1.139 1.00 0.00 O ATOM 1961 CB THR B 42 -7.380 -2.193 1.655 1.00 0.00 C ATOM 1962 OG1 THR B 42 -6.195 -2.647 2.324 1.00 0.00 O ATOM 1963 CG2 THR B 42 -8.548 -3.095 2.032 1.00 0.00 C ATOM 0 H THR B 42 -5.503 -0.975 0.559 1.00 0.00 H new ATOM 0 HA THR B 42 -7.016 -3.221 -0.207 1.00 0.00 H new ATOM 0 HB THR B 42 -7.614 -1.174 1.963 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.472 -2.000 2.185 1.00 0.00 H new ATOM 0 HG21 THR B 42 -8.688 -3.076 3.113 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.455 -2.740 1.542 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.338 -4.115 1.711 1.00 0.00 H new ATOM 1971 N ASN B 43 -8.482 -0.275 -0.571 1.00 0.00 N ATOM 1972 CA ASN B 43 -9.632 0.397 -1.168 1.00 0.00 C ATOM 1973 C ASN B 43 -9.640 0.197 -2.681 1.00 0.00 C ATOM 1974 O ASN B 43 -10.701 0.117 -3.301 1.00 0.00 O ATOM 1975 CB ASN B 43 -9.625 1.890 -0.834 1.00 0.00 C ATOM 1976 CG ASN B 43 -10.945 2.565 -1.168 1.00 0.00 C ATOM 1977 OD1 ASN B 43 -11.145 3.055 -2.279 1.00 0.00 O ATOM 1978 ND2 ASN B 43 -11.855 2.597 -0.201 1.00 0.00 N ATOM 0 H ASN B 43 -7.790 0.353 -0.163 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.536 -0.045 -0.750 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.411 2.021 0.227 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -8.821 2.379 -1.384 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -12.759 3.040 -0.366 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -11.650 2.179 0.706 1.00 0.00 H new ATOM 1985 N VAL B 44 -8.451 0.116 -3.272 1.00 0.00 N ATOM 1986 CA VAL B 44 -8.332 -0.220 -4.684 1.00 0.00 C ATOM 1987 C VAL B 44 -8.856 -1.629 -4.922 1.00 0.00 C ATOM 1988 O VAL B 44 -9.613 -1.865 -5.860 1.00 0.00 O ATOM 1989 CB VAL B 44 -6.873 -0.121 -5.183 1.00 0.00 C ATOM 1990 CG1 VAL B 44 -6.752 -0.604 -6.623 1.00 0.00 C ATOM 1991 CG2 VAL B 44 -6.369 1.306 -5.065 1.00 0.00 C ATOM 0 H VAL B 44 -7.563 0.278 -2.797 1.00 0.00 H new ATOM 0 HA VAL B 44 -8.925 0.502 -5.245 1.00 0.00 H new ATOM 0 HB VAL B 44 -6.258 -0.766 -4.555 1.00 0.00 H new ATOM 0 HG11 VAL B 44 -5.715 -0.523 -6.948 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -7.072 -1.644 -6.686 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -7.383 0.009 -7.267 1.00 0.00 H new ATOM 0 HG21 VAL B 44 -5.340 1.359 -5.420 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -6.995 1.964 -5.667 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -6.409 1.621 -4.022 1.00 0.00 H new ATOM 2001 N LEU B 45 -8.474 -2.550 -4.044 1.00 0.00 N ATOM 2002 CA LEU B 45 -8.945 -3.927 -4.122 1.00 0.00 C ATOM 2003 C LEU B 45 -10.463 -3.988 -3.969 1.00 0.00 C ATOM 2004 O LEU B 45 -11.128 -4.828 -4.578 1.00 0.00 O ATOM 2005 CB LEU B 45 -8.273 -4.788 -3.049 1.00 0.00 C ATOM 2006 CG LEU B 45 -6.752 -4.906 -3.164 1.00 0.00 C ATOM 2007 CD1 LEU B 45 -6.184 -5.696 -1.997 1.00 0.00 C ATOM 2008 CD2 LEU B 45 -6.370 -5.561 -4.481 1.00 0.00 C ATOM 0 H LEU B 45 -7.838 -2.367 -3.268 1.00 0.00 H new ATOM 0 HA LEU B 45 -8.679 -4.320 -5.103 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -8.516 -4.375 -2.070 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -8.703 -5.789 -3.088 1.00 0.00 H new ATOM 0 HG LEU B 45 -6.328 -3.902 -3.137 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -5.101 -5.768 -2.099 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -6.428 -5.191 -1.063 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -6.615 -6.697 -1.991 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -5.285 -5.638 -4.548 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -6.808 -6.558 -4.532 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -6.743 -4.958 -5.309 1.00 0.00 H new ATOM 2020 N ASN B 46 -10.998 -3.087 -3.155 1.00 0.00 N ATOM 2021 CA ASN B 46 -12.436 -3.015 -2.920 1.00 0.00 C ATOM 2022 C ASN B 46 -13.163 -2.429 -4.122 1.00 0.00 C ATOM 2023 O ASN B 46 -14.138 -3.000 -4.604 1.00 0.00 O ATOM 2024 CB ASN B 46 -12.748 -2.167 -1.682 1.00 0.00 C ATOM 2025 CG ASN B 46 -12.234 -2.782 -0.394 1.00 0.00 C ATOM 2026 OD1 ASN B 46 -11.857 -2.071 0.538 1.00 0.00 O ATOM 2027 ND2 ASN B 46 -12.222 -4.104 -0.326 1.00 0.00 N ATOM 0 H ASN B 46 -10.455 -2.392 -2.643 1.00 0.00 H new ATOM 0 HA ASN B 46 -12.785 -4.034 -2.756 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -12.308 -1.178 -1.806 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.827 -2.028 -1.606 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -11.892 -4.568 0.520 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -12.543 -4.658 -1.120 1.00 0.00 H new ATOM 2034 N GLN B 47 -12.690 -1.288 -4.606 1.00 0.00 N ATOM 2035 CA GLN B 47 -13.403 -0.560 -5.649 1.00 0.00 C ATOM 2036 C GLN B 47 -12.668 -0.591 -6.987 1.00 0.00 C ATOM 2037 O GLN B 47 -13.135 -1.206 -7.943 1.00 0.00 O ATOM 2038 CB GLN B 47 -13.631 0.897 -5.233 1.00 0.00 C ATOM 2039 CG GLN B 47 -14.271 1.057 -3.865 1.00 0.00 C ATOM 2040 CD GLN B 47 -14.725 2.480 -3.598 1.00 0.00 C ATOM 2041 OE1 GLN B 47 -15.871 2.838 -3.870 1.00 0.00 O ATOM 2042 NE2 GLN B 47 -13.829 3.303 -3.080 1.00 0.00 N ATOM 0 H GLN B 47 -11.823 -0.849 -4.297 1.00 0.00 H new ATOM 0 HA GLN B 47 -14.361 -1.063 -5.778 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -12.674 1.419 -5.238 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -14.263 1.382 -5.977 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -15.126 0.386 -3.787 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -13.559 0.756 -3.097 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -12.889 2.967 -2.869 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -14.077 4.274 -2.892 1.00 0.00 H new ATOM 2051 N ARG B 48 -11.510 0.059 -7.044 1.00 0.00 N ATOM 2052 CA ARG B 48 -10.828 0.317 -8.315 1.00 0.00 C ATOM 2053 C ARG B 48 -9.989 -0.870 -8.795 1.00 0.00 C ATOM 2054 O ARG B 48 -8.833 -0.696 -9.175 1.00 0.00 O ATOM 2055 CB ARG B 48 -9.944 1.565 -8.197 1.00 0.00 C ATOM 2056 CG ARG B 48 -10.732 2.859 -8.082 1.00 0.00 C ATOM 2057 CD ARG B 48 -9.819 4.079 -8.037 1.00 0.00 C ATOM 2058 NE ARG B 48 -10.586 5.323 -8.068 1.00 0.00 N ATOM 2059 CZ ARG B 48 -10.077 6.541 -7.876 1.00 0.00 C ATOM 2060 NH1 ARG B 48 -8.781 6.710 -7.633 1.00 0.00 N ATOM 2061 NH2 ARG B 48 -10.879 7.594 -7.932 1.00 0.00 N ATOM 0 H ARG B 48 -11.020 0.419 -6.225 1.00 0.00 H new ATOM 0 HA ARG B 48 -11.607 0.480 -9.060 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -9.300 1.463 -7.324 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -9.292 1.622 -9.069 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -11.413 2.946 -8.929 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.346 2.831 -7.182 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -9.212 4.047 -7.132 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -9.132 4.052 -8.883 1.00 0.00 H new ATOM 0 HE ARG B 48 -11.587 5.254 -8.250 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -8.160 5.902 -7.591 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -8.407 7.648 -7.488 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -11.874 7.468 -8.120 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -10.502 8.531 -7.787 1.00 0.00 H new ATOM 2075 N VAL B 49 -10.573 -2.060 -8.805 1.00 0.00 N ATOM 2076 CA VAL B 49 -9.899 -3.229 -9.352 1.00 0.00 C ATOM 2077 C VAL B 49 -10.915 -4.337 -9.614 1.00 0.00 C ATOM 2078 O VAL B 49 -12.038 -4.290 -9.110 1.00 0.00 O ATOM 2079 CB VAL B 49 -8.785 -3.749 -8.410 1.00 0.00 C ATOM 2080 CG1 VAL B 49 -9.332 -4.742 -7.398 1.00 0.00 C ATOM 2081 CG2 VAL B 49 -7.644 -4.361 -9.205 1.00 0.00 C ATOM 0 H VAL B 49 -11.509 -2.241 -8.442 1.00 0.00 H new ATOM 0 HA VAL B 49 -9.427 -2.931 -10.288 1.00 0.00 H new ATOM 0 HB VAL B 49 -8.395 -2.894 -7.858 1.00 0.00 H new ATOM 0 HG11 VAL B 49 -8.524 -5.087 -6.753 1.00 0.00 H new ATOM 0 HG12 VAL B 49 -10.099 -4.259 -6.792 1.00 0.00 H new ATOM 0 HG13 VAL B 49 -9.766 -5.593 -7.922 1.00 0.00 H new ATOM 0 HG21 VAL B 49 -6.875 -4.719 -8.521 1.00 0.00 H new ATOM 0 HG22 VAL B 49 -8.020 -5.196 -9.797 1.00 0.00 H new ATOM 0 HG23 VAL B 49 -7.218 -3.608 -9.868 1.00 0.00 H new ATOM 2091 N ALA B 50 -10.519 -5.325 -10.400 1.00 0.00 N ATOM 2092 CA ALA B 50 -11.386 -6.452 -10.701 1.00 0.00 C ATOM 2093 C ALA B 50 -11.125 -7.592 -9.728 1.00 0.00 C ATOM 2094 O ALA B 50 -9.990 -7.785 -9.292 1.00 0.00 O ATOM 2095 CB ALA B 50 -11.168 -6.915 -12.132 1.00 0.00 C ATOM 0 H ALA B 50 -9.601 -5.369 -10.842 1.00 0.00 H new ATOM 0 HA ALA B 50 -12.423 -6.135 -10.593 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.823 -7.760 -12.345 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.395 -6.098 -12.817 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.130 -7.220 -12.262 1.00 0.00 H new ATOM 2101 N ALA B 51 -12.167 -8.346 -9.394 1.00 0.00 N ATOM 2102 CA ALA B 51 -12.044 -9.478 -8.479 1.00 0.00 C ATOM 2103 C ALA B 51 -10.999 -10.477 -8.967 1.00 0.00 C ATOM 2104 O ALA B 51 -10.224 -11.016 -8.177 1.00 0.00 O ATOM 2105 CB ALA B 51 -13.390 -10.164 -8.306 1.00 0.00 C ATOM 0 H ALA B 51 -13.112 -8.193 -9.745 1.00 0.00 H new ATOM 0 HA ALA B 51 -11.714 -9.094 -7.514 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -13.284 -11.006 -7.622 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -14.110 -9.454 -7.899 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -13.742 -10.524 -9.273 1.00 0.00 H new ATOM 2111 N SER B 52 -10.971 -10.698 -10.276 1.00 0.00 N ATOM 2112 CA SER B 52 -10.014 -11.613 -10.890 1.00 0.00 C ATOM 2113 C SER B 52 -8.587 -11.073 -10.771 1.00 0.00 C ATOM 2114 O SER B 52 -7.616 -11.825 -10.861 1.00 0.00 O ATOM 2115 CB SER B 52 -10.381 -11.828 -12.365 1.00 0.00 C ATOM 2116 OG SER B 52 -9.481 -12.717 -13.007 1.00 0.00 O ATOM 0 H SER B 52 -11.606 -10.252 -10.938 1.00 0.00 H new ATOM 0 HA SER B 52 -10.057 -12.567 -10.365 1.00 0.00 H new ATOM 0 HB2 SER B 52 -11.394 -12.224 -12.434 1.00 0.00 H new ATOM 0 HB3 SER B 52 -10.378 -10.869 -12.884 1.00 0.00 H new ATOM 0 HG SER B 52 -9.746 -12.831 -13.943 1.00 0.00 H new ATOM 2122 N GLN B 53 -8.463 -9.773 -10.542 1.00 0.00 N ATOM 2123 CA GLN B 53 -7.162 -9.132 -10.491 1.00 0.00 C ATOM 2124 C GLN B 53 -6.686 -8.981 -9.051 1.00 0.00 C ATOM 2125 O GLN B 53 -5.495 -8.815 -8.808 1.00 0.00 O ATOM 2126 CB GLN B 53 -7.225 -7.753 -11.152 1.00 0.00 C ATOM 2127 CG GLN B 53 -5.916 -7.325 -11.792 1.00 0.00 C ATOM 2128 CD GLN B 53 -5.613 -8.113 -13.051 1.00 0.00 C ATOM 2129 OE1 GLN B 53 -5.997 -7.716 -14.149 1.00 0.00 O ATOM 2130 NE2 GLN B 53 -4.933 -9.238 -12.902 1.00 0.00 N ATOM 0 H GLN B 53 -9.250 -9.143 -10.389 1.00 0.00 H new ATOM 0 HA GLN B 53 -6.456 -9.763 -11.031 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -8.006 -7.759 -11.912 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -7.513 -7.014 -10.404 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -5.960 -6.263 -12.032 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -5.103 -7.457 -11.078 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -4.632 -9.533 -11.973 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -4.710 -9.810 -13.716 1.00 0.00 H new ATOM 2139 N ARG B 54 -7.624 -9.067 -8.106 1.00 0.00 N ATOM 2140 CA ARG B 54 -7.354 -8.767 -6.696 1.00 0.00 C ATOM 2141 C ARG B 54 -6.139 -9.517 -6.155 1.00 0.00 C ATOM 2142 O ARG B 54 -5.183 -8.895 -5.693 1.00 0.00 O ATOM 2143 CB ARG B 54 -8.586 -9.068 -5.837 1.00 0.00 C ATOM 2144 CG ARG B 54 -9.718 -8.073 -6.035 1.00 0.00 C ATOM 2145 CD ARG B 54 -10.925 -8.399 -5.168 1.00 0.00 C ATOM 2146 NE ARG B 54 -12.021 -7.451 -5.377 1.00 0.00 N ATOM 2147 CZ ARG B 54 -13.303 -7.715 -5.125 1.00 0.00 C ATOM 2148 NH1 ARG B 54 -13.658 -8.878 -4.594 1.00 0.00 N ATOM 2149 NH2 ARG B 54 -14.229 -6.804 -5.392 1.00 0.00 N ATOM 0 H ARG B 54 -8.587 -9.345 -8.293 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.124 -7.703 -6.641 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -8.947 -10.069 -6.071 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -8.295 -9.072 -4.787 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.363 -7.070 -5.799 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -10.016 -8.068 -7.083 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -11.271 -9.408 -5.392 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.631 -8.388 -4.118 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.788 -6.527 -5.740 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -12.948 -9.577 -4.376 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -14.641 -9.073 -4.404 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -13.959 -5.904 -5.789 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -15.211 -7.003 -5.200 1.00 0.00 H new ATOM 2163 N LYS B 55 -6.163 -10.843 -6.217 1.00 0.00 N ATOM 2164 CA LYS B 55 -5.058 -11.638 -5.685 1.00 0.00 C ATOM 2165 C LYS B 55 -3.764 -11.348 -6.440 1.00 0.00 C ATOM 2166 O LYS B 55 -2.714 -11.152 -5.830 1.00 0.00 O ATOM 2167 CB LYS B 55 -5.369 -13.140 -5.744 1.00 0.00 C ATOM 2168 CG LYS B 55 -4.209 -14.012 -5.267 1.00 0.00 C ATOM 2169 CD LYS B 55 -3.865 -13.747 -3.807 1.00 0.00 C ATOM 2170 CE LYS B 55 -2.383 -13.970 -3.522 1.00 0.00 C ATOM 2171 NZ LYS B 55 -1.935 -15.350 -3.849 1.00 0.00 N ATOM 0 H LYS B 55 -6.924 -11.387 -6.624 1.00 0.00 H new ATOM 0 HA LYS B 55 -4.929 -11.353 -4.641 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -6.247 -13.347 -5.132 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -5.623 -13.412 -6.768 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -4.468 -15.063 -5.394 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -3.333 -13.822 -5.887 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -4.134 -12.722 -3.551 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -4.460 -14.401 -3.169 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -1.795 -13.256 -4.099 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -2.186 -13.769 -2.469 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -0.902 -15.412 -3.749 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -2.387 -16.025 -3.199 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -2.203 -15.579 -4.827 1.00 0.00 H new ATOM 2185 N LEU B 56 -3.852 -11.301 -7.764 1.00 0.00 N ATOM 2186 CA LEU B 56 -2.673 -11.121 -8.601 1.00 0.00 C ATOM 2187 C LEU B 56 -2.013 -9.772 -8.323 1.00 0.00 C ATOM 2188 O LEU B 56 -0.810 -9.703 -8.076 1.00 0.00 O ATOM 2189 CB LEU B 56 -3.061 -11.231 -10.086 1.00 0.00 C ATOM 2190 CG LEU B 56 -1.926 -11.602 -11.059 1.00 0.00 C ATOM 2191 CD1 LEU B 56 -2.486 -11.866 -12.448 1.00 0.00 C ATOM 2192 CD2 LEU B 56 -0.867 -10.511 -11.133 1.00 0.00 C ATOM 0 H LEU B 56 -4.728 -11.385 -8.281 1.00 0.00 H new ATOM 0 HA LEU B 56 -1.955 -11.906 -8.363 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -3.850 -11.977 -10.180 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -3.485 -10.277 -10.401 1.00 0.00 H new ATOM 0 HG LEU B 56 -1.453 -12.507 -10.678 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -1.672 -12.127 -13.125 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -3.199 -12.690 -12.403 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -2.989 -10.971 -12.814 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -0.084 -10.811 -11.830 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -1.324 -9.583 -11.478 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -0.434 -10.357 -10.145 1.00 0.00 H new ATOM 2204 N ILE B 57 -2.804 -8.709 -8.341 1.00 0.00 N ATOM 2205 CA ILE B 57 -2.265 -7.360 -8.247 1.00 0.00 C ATOM 2206 C ILE B 57 -1.716 -7.075 -6.846 1.00 0.00 C ATOM 2207 O ILE B 57 -0.746 -6.333 -6.697 1.00 0.00 O ATOM 2208 CB ILE B 57 -3.322 -6.301 -8.654 1.00 0.00 C ATOM 2209 CG1 ILE B 57 -2.649 -4.958 -8.944 1.00 0.00 C ATOM 2210 CG2 ILE B 57 -4.386 -6.137 -7.573 1.00 0.00 C ATOM 2211 CD1 ILE B 57 -3.550 -3.971 -9.654 1.00 0.00 C ATOM 0 H ILE B 57 -3.820 -8.754 -8.420 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.435 -7.291 -8.950 1.00 0.00 H new ATOM 0 HB ILE B 57 -3.814 -6.652 -9.561 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -2.312 -4.519 -8.005 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -1.761 -5.130 -9.552 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -5.112 -5.388 -7.888 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -4.892 -7.089 -7.414 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -3.914 -5.817 -6.644 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -3.007 -3.042 -9.827 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.867 -4.389 -10.609 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -4.426 -3.770 -9.038 1.00 0.00 H new ATOM 2223 N ALA B 58 -2.309 -7.696 -5.830 1.00 0.00 N ATOM 2224 CA ALA B 58 -1.833 -7.542 -4.459 1.00 0.00 C ATOM 2225 C ALA B 58 -0.550 -8.339 -4.248 1.00 0.00 C ATOM 2226 O ALA B 58 0.395 -7.867 -3.609 1.00 0.00 O ATOM 2227 CB ALA B 58 -2.904 -7.980 -3.469 1.00 0.00 C ATOM 0 H ALA B 58 -3.118 -8.309 -5.930 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.616 -6.488 -4.285 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.531 -7.858 -2.452 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -3.796 -7.369 -3.604 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.152 -9.027 -3.641 1.00 0.00 H new ATOM 2233 N GLU B 59 -0.518 -9.544 -4.801 1.00 0.00 N ATOM 2234 CA GLU B 59 0.655 -10.404 -4.718 1.00 0.00 C ATOM 2235 C GLU B 59 1.812 -9.792 -5.507 1.00 0.00 C ATOM 2236 O GLU B 59 2.958 -9.774 -5.050 1.00 0.00 O ATOM 2237 CB GLU B 59 0.300 -11.793 -5.254 1.00 0.00 C ATOM 2238 CG GLU B 59 1.384 -12.838 -5.080 1.00 0.00 C ATOM 2239 CD GLU B 59 0.884 -14.229 -5.410 1.00 0.00 C ATOM 2240 OE1 GLU B 59 0.696 -14.536 -6.605 1.00 0.00 O ATOM 2241 OE2 GLU B 59 0.646 -15.019 -4.470 1.00 0.00 O ATOM 0 H GLU B 59 -1.299 -9.951 -5.316 1.00 0.00 H new ATOM 0 HA GLU B 59 0.970 -10.498 -3.679 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -0.604 -12.140 -4.753 1.00 0.00 H new ATOM 0 HB3 GLU B 59 0.064 -11.708 -6.315 1.00 0.00 H new ATOM 0 HG2 GLU B 59 2.230 -12.594 -5.722 1.00 0.00 H new ATOM 0 HG3 GLU B 59 1.747 -12.817 -4.053 1.00 0.00 H new ATOM 2248 N LYS B 60 1.493 -9.260 -6.682 1.00 0.00 N ATOM 2249 CA LYS B 60 2.477 -8.602 -7.531 1.00 0.00 C ATOM 2250 C LYS B 60 2.975 -7.321 -6.870 1.00 0.00 C ATOM 2251 O LYS B 60 4.107 -6.886 -7.096 1.00 0.00 O ATOM 2252 CB LYS B 60 1.864 -8.262 -8.890 1.00 0.00 C ATOM 2253 CG LYS B 60 2.896 -8.005 -9.972 1.00 0.00 C ATOM 2254 CD LYS B 60 2.424 -6.958 -10.969 1.00 0.00 C ATOM 2255 CE LYS B 60 2.588 -5.550 -10.411 1.00 0.00 C ATOM 2256 NZ LYS B 60 3.963 -5.313 -9.882 1.00 0.00 N ATOM 0 H LYS B 60 0.550 -9.273 -7.070 1.00 0.00 H new ATOM 0 HA LYS B 60 3.315 -9.284 -7.673 1.00 0.00 H new ATOM 0 HB2 LYS B 60 1.217 -9.082 -9.203 1.00 0.00 H new ATOM 0 HB3 LYS B 60 1.232 -7.380 -8.784 1.00 0.00 H new ATOM 0 HG2 LYS B 60 3.828 -7.675 -9.513 1.00 0.00 H new ATOM 0 HG3 LYS B 60 3.111 -8.936 -10.497 1.00 0.00 H new ATOM 0 HD2 LYS B 60 2.991 -7.053 -11.895 1.00 0.00 H new ATOM 0 HD3 LYS B 60 1.377 -7.134 -11.216 1.00 0.00 H new ATOM 0 HE2 LYS B 60 2.371 -4.823 -11.193 1.00 0.00 H new ATOM 0 HE3 LYS B 60 1.861 -5.389 -9.615 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 4.162 -4.292 -9.877 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 4.031 -5.684 -8.913 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 4.656 -5.798 -10.487 1.00 0.00 H new ATOM 2270 N PHE B 61 2.106 -6.709 -6.075 1.00 0.00 N ATOM 2271 CA PHE B 61 2.448 -5.503 -5.337 1.00 0.00 C ATOM 2272 C PHE B 61 3.479 -5.819 -4.263 1.00 0.00 C ATOM 2273 O PHE B 61 4.503 -5.143 -4.156 1.00 0.00 O ATOM 2274 CB PHE B 61 1.193 -4.893 -4.705 1.00 0.00 C ATOM 2275 CG PHE B 61 1.467 -3.701 -3.835 1.00 0.00 C ATOM 2276 CD1 PHE B 61 1.767 -2.471 -4.394 1.00 0.00 C ATOM 2277 CD2 PHE B 61 1.418 -3.812 -2.457 1.00 0.00 C ATOM 2278 CE1 PHE B 61 2.014 -1.374 -3.594 1.00 0.00 C ATOM 2279 CE2 PHE B 61 1.666 -2.719 -1.651 1.00 0.00 C ATOM 2280 CZ PHE B 61 1.963 -1.498 -2.221 1.00 0.00 C ATOM 0 H PHE B 61 1.151 -7.033 -5.925 1.00 0.00 H new ATOM 0 HA PHE B 61 2.876 -4.779 -6.030 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.504 -4.601 -5.498 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.690 -5.656 -4.111 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.808 -2.369 -5.468 1.00 0.00 H new ATOM 0 HD2 PHE B 61 1.183 -4.765 -2.006 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.247 -0.419 -4.042 1.00 0.00 H new ATOM 0 HE2 PHE B 61 1.628 -2.819 -0.576 1.00 0.00 H new ATOM 0 HZ PHE B 61 2.155 -0.641 -1.593 1.00 0.00 H new ATOM 2290 N ALA B 62 3.211 -6.861 -3.483 1.00 0.00 N ATOM 2291 CA ALA B 62 4.120 -7.287 -2.427 1.00 0.00 C ATOM 2292 C ALA B 62 5.491 -7.631 -3.001 1.00 0.00 C ATOM 2293 O ALA B 62 6.521 -7.289 -2.423 1.00 0.00 O ATOM 2294 CB ALA B 62 3.541 -8.481 -1.684 1.00 0.00 C ATOM 0 H ALA B 62 2.367 -7.428 -3.564 1.00 0.00 H new ATOM 0 HA ALA B 62 4.242 -6.463 -1.724 1.00 0.00 H new ATOM 0 HB1 ALA B 62 4.230 -8.789 -0.898 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.584 -8.205 -1.240 1.00 0.00 H new ATOM 0 HB3 ALA B 62 3.393 -9.306 -2.381 1.00 0.00 H new ATOM 2300 N GLN B 63 5.491 -8.295 -4.154 1.00 0.00 N ATOM 2301 CA GLN B 63 6.731 -8.646 -4.846 1.00 0.00 C ATOM 2302 C GLN B 63 7.535 -7.388 -5.180 1.00 0.00 C ATOM 2303 O GLN B 63 8.741 -7.309 -4.914 1.00 0.00 O ATOM 2304 CB GLN B 63 6.418 -9.399 -6.140 1.00 0.00 C ATOM 2305 CG GLN B 63 7.648 -9.918 -6.868 1.00 0.00 C ATOM 2306 CD GLN B 63 7.339 -10.349 -8.288 1.00 0.00 C ATOM 2307 OE1 GLN B 63 7.427 -9.553 -9.220 1.00 0.00 O ATOM 2308 NE2 GLN B 63 6.964 -11.605 -8.463 1.00 0.00 N ATOM 0 H GLN B 63 4.644 -8.602 -4.631 1.00 0.00 H new ATOM 0 HA GLN B 63 7.320 -9.283 -4.185 1.00 0.00 H new ATOM 0 HB2 GLN B 63 5.763 -10.240 -5.910 1.00 0.00 H new ATOM 0 HB3 GLN B 63 5.865 -8.738 -6.808 1.00 0.00 H new ATOM 0 HG2 GLN B 63 8.412 -9.141 -6.885 1.00 0.00 H new ATOM 0 HG3 GLN B 63 8.064 -10.762 -6.317 1.00 0.00 H new ATOM 0 HE21 GLN B 63 6.903 -12.235 -7.663 1.00 0.00 H new ATOM 0 HE22 GLN B 63 6.736 -11.944 -9.398 1.00 0.00 H new ATOM 2317 N ALA B 64 6.848 -6.409 -5.761 1.00 0.00 N ATOM 2318 CA ALA B 64 7.473 -5.159 -6.168 1.00 0.00 C ATOM 2319 C ALA B 64 7.943 -4.365 -4.958 1.00 0.00 C ATOM 2320 O ALA B 64 8.985 -3.713 -5.001 1.00 0.00 O ATOM 2321 CB ALA B 64 6.507 -4.332 -7.003 1.00 0.00 C ATOM 0 H ALA B 64 5.849 -6.461 -5.961 1.00 0.00 H new ATOM 0 HA ALA B 64 8.346 -5.398 -6.776 1.00 0.00 H new ATOM 0 HB1 ALA B 64 6.988 -3.400 -7.300 1.00 0.00 H new ATOM 0 HB2 ALA B 64 6.223 -4.893 -7.893 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.617 -4.109 -6.415 1.00 0.00 H new ATOM 2327 N LEU B 65 7.175 -4.431 -3.877 1.00 0.00 N ATOM 2328 CA LEU B 65 7.519 -3.724 -2.651 1.00 0.00 C ATOM 2329 C LEU B 65 8.785 -4.313 -2.036 1.00 0.00 C ATOM 2330 O LEU B 65 9.598 -3.595 -1.461 1.00 0.00 O ATOM 2331 CB LEU B 65 6.358 -3.781 -1.651 1.00 0.00 C ATOM 2332 CG LEU B 65 6.524 -2.904 -0.408 1.00 0.00 C ATOM 2333 CD1 LEU B 65 6.745 -1.453 -0.807 1.00 0.00 C ATOM 2334 CD2 LEU B 65 5.306 -3.022 0.495 1.00 0.00 C ATOM 0 H LEU B 65 6.309 -4.968 -3.825 1.00 0.00 H new ATOM 0 HA LEU B 65 7.707 -2.679 -2.897 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.443 -3.486 -2.164 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.225 -4.815 -1.331 1.00 0.00 H new ATOM 0 HG LEU B 65 7.398 -3.251 0.142 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.861 -0.843 0.089 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.645 -1.376 -1.417 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.888 -1.098 -1.379 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.442 -2.392 1.374 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.418 -2.700 -0.048 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.184 -4.059 0.808 1.00 0.00 H new ATOM 2346 N MET B 66 8.962 -5.624 -2.178 1.00 0.00 N ATOM 2347 CA MET B 66 10.169 -6.285 -1.695 1.00 0.00 C ATOM 2348 C MET B 66 11.341 -5.956 -2.604 1.00 0.00 C ATOM 2349 O MET B 66 12.501 -6.006 -2.190 1.00 0.00 O ATOM 2350 CB MET B 66 9.970 -7.801 -1.629 1.00 0.00 C ATOM 2351 CG MET B 66 8.858 -8.219 -0.689 1.00 0.00 C ATOM 2352 SD MET B 66 9.125 -7.638 0.995 1.00 0.00 S ATOM 2353 CE MET B 66 7.481 -7.855 1.666 1.00 0.00 C ATOM 0 H MET B 66 8.287 -6.247 -2.622 1.00 0.00 H new ATOM 0 HA MET B 66 10.380 -5.921 -0.689 1.00 0.00 H new ATOM 0 HB2 MET B 66 9.751 -8.176 -2.629 1.00 0.00 H new ATOM 0 HB3 MET B 66 10.901 -8.269 -1.310 1.00 0.00 H new ATOM 0 HG2 MET B 66 7.909 -7.830 -1.058 1.00 0.00 H new ATOM 0 HG3 MET B 66 8.778 -9.306 -0.687 1.00 0.00 H new ATOM 0 HE1 MET B 66 7.500 -7.677 2.741 1.00 0.00 H new ATOM 0 HE2 MET B 66 6.799 -7.148 1.193 1.00 0.00 H new ATOM 0 HE3 MET B 66 7.141 -8.872 1.473 1.00 0.00 H new ATOM 2363 N SER B 67 11.026 -5.618 -3.845 1.00 0.00 N ATOM 2364 CA SER B 67 12.035 -5.254 -4.819 1.00 0.00 C ATOM 2365 C SER B 67 12.592 -3.859 -4.512 1.00 0.00 C ATOM 2366 O SER B 67 13.789 -3.606 -4.675 1.00 0.00 O ATOM 2367 CB SER B 67 11.435 -5.304 -6.232 1.00 0.00 C ATOM 2368 OG SER B 67 12.432 -5.131 -7.224 1.00 0.00 O ATOM 0 H SER B 67 10.070 -5.589 -4.200 1.00 0.00 H new ATOM 0 HA SER B 67 12.858 -5.966 -4.765 1.00 0.00 H new ATOM 0 HB2 SER B 67 10.933 -6.260 -6.382 1.00 0.00 H new ATOM 0 HB3 SER B 67 10.678 -4.526 -6.335 1.00 0.00 H new ATOM 0 HG SER B 67 12.020 -5.169 -8.112 1.00 0.00 H new ATOM 2374 N SER B 68 11.721 -2.965 -4.046 1.00 0.00 N ATOM 2375 CA SER B 68 12.116 -1.601 -3.706 1.00 0.00 C ATOM 2376 C SER B 68 12.523 -1.497 -2.235 1.00 0.00 C ATOM 2377 O SER B 68 13.021 -0.463 -1.783 1.00 0.00 O ATOM 2378 CB SER B 68 10.967 -0.638 -4.022 1.00 0.00 C ATOM 2379 OG SER B 68 9.745 -1.094 -3.463 1.00 0.00 O ATOM 0 H SER B 68 10.732 -3.164 -3.895 1.00 0.00 H new ATOM 0 HA SER B 68 12.983 -1.328 -4.307 1.00 0.00 H new ATOM 0 HB2 SER B 68 11.201 0.352 -3.631 1.00 0.00 H new ATOM 0 HB3 SER B 68 10.860 -0.537 -5.102 1.00 0.00 H new ATOM 0 HG SER B 68 9.298 -0.352 -3.004 1.00 0.00 H new ATOM 2385 N LEU B 69 12.313 -2.579 -1.495 1.00 0.00 N ATOM 2386 CA LEU B 69 12.678 -2.633 -0.085 1.00 0.00 C ATOM 2387 C LEU B 69 14.190 -2.499 0.073 1.00 0.00 C ATOM 2388 O LEU B 69 14.958 -3.251 -0.534 1.00 0.00 O ATOM 2389 CB LEU B 69 12.167 -3.943 0.538 1.00 0.00 C ATOM 2390 CG LEU B 69 12.442 -4.126 2.034 1.00 0.00 C ATOM 2391 CD1 LEU B 69 11.238 -4.757 2.709 1.00 0.00 C ATOM 2392 CD2 LEU B 69 13.668 -5.000 2.248 1.00 0.00 C ATOM 0 H LEU B 69 11.889 -3.436 -1.851 1.00 0.00 H new ATOM 0 HA LEU B 69 12.211 -1.800 0.441 1.00 0.00 H new ATOM 0 HB2 LEU B 69 11.091 -4.004 0.376 1.00 0.00 H new ATOM 0 HB3 LEU B 69 12.618 -4.778 0.001 1.00 0.00 H new ATOM 0 HG LEU B 69 12.629 -3.146 2.474 1.00 0.00 H new ATOM 0 HD11 LEU B 69 11.442 -4.884 3.772 1.00 0.00 H new ATOM 0 HD12 LEU B 69 10.369 -4.112 2.580 1.00 0.00 H new ATOM 0 HD13 LEU B 69 11.037 -5.730 2.260 1.00 0.00 H new ATOM 0 HD21 LEU B 69 13.848 -5.119 3.316 1.00 0.00 H new ATOM 0 HD22 LEU B 69 13.501 -5.978 1.797 1.00 0.00 H new ATOM 0 HD23 LEU B 69 14.535 -4.530 1.784 1.00 0.00 H new ATOM 2404 N GLU B 70 14.609 -1.524 0.873 1.00 0.00 N ATOM 2405 CA GLU B 70 16.025 -1.258 1.085 1.00 0.00 C ATOM 2406 C GLU B 70 16.630 -2.301 2.016 1.00 0.00 C ATOM 2407 O GLU B 70 15.993 -2.736 2.978 1.00 0.00 O ATOM 2408 CB GLU B 70 16.220 0.148 1.654 1.00 0.00 C ATOM 2409 CG GLU B 70 17.213 0.991 0.866 1.00 0.00 C ATOM 2410 CD GLU B 70 18.649 0.524 1.021 1.00 0.00 C ATOM 2411 OE1 GLU B 70 19.034 -0.480 0.379 1.00 0.00 O ATOM 2412 OE2 GLU B 70 19.404 1.172 1.777 1.00 0.00 O ATOM 0 H GLU B 70 13.984 -0.903 1.387 1.00 0.00 H new ATOM 0 HA GLU B 70 16.538 -1.318 0.125 1.00 0.00 H new ATOM 0 HB2 GLU B 70 15.258 0.659 1.675 1.00 0.00 H new ATOM 0 HB3 GLU B 70 16.561 0.069 2.686 1.00 0.00 H new ATOM 0 HG2 GLU B 70 16.942 0.968 -0.190 1.00 0.00 H new ATOM 0 HG3 GLU B 70 17.138 2.028 1.192 1.00 0.00 H new ATOM 2419 N THR B 71 17.862 -2.684 1.736 1.00 0.00 N ATOM 2420 CA THR B 71 18.510 -3.766 2.456 1.00 0.00 C ATOM 2421 C THR B 71 19.576 -3.246 3.418 1.00 0.00 C ATOM 2422 O THR B 71 20.244 -2.247 3.137 1.00 0.00 O ATOM 2423 CB THR B 71 19.149 -4.762 1.471 1.00 0.00 C ATOM 2424 OG1 THR B 71 19.929 -4.047 0.501 1.00 0.00 O ATOM 2425 CG2 THR B 71 18.082 -5.587 0.767 1.00 0.00 C ATOM 0 H THR B 71 18.438 -2.259 1.010 1.00 0.00 H new ATOM 0 HA THR B 71 17.741 -4.272 3.039 1.00 0.00 H new ATOM 0 HB THR B 71 19.793 -5.440 2.032 1.00 0.00 H new ATOM 0 HG1 THR B 71 20.336 -4.683 -0.124 1.00 0.00 H new ATOM 0 HG21 THR B 71 18.557 -6.283 0.076 1.00 0.00 H new ATOM 0 HG22 THR B 71 17.507 -6.145 1.506 1.00 0.00 H new ATOM 0 HG23 THR B 71 17.416 -4.925 0.214 1.00 0.00 H new ATOM 2433 N PRO B 72 19.739 -3.909 4.574 1.00 0.00 N ATOM 2434 CA PRO B 72 20.770 -3.561 5.551 1.00 0.00 C ATOM 2435 C PRO B 72 22.165 -3.917 5.047 1.00 0.00 C ATOM 2436 O PRO B 72 22.679 -5.003 5.309 1.00 0.00 O ATOM 2437 CB PRO B 72 20.414 -4.395 6.793 1.00 0.00 C ATOM 2438 CG PRO B 72 19.058 -4.963 6.522 1.00 0.00 C ATOM 2439 CD PRO B 72 18.928 -5.045 5.028 1.00 0.00 C ATOM 0 HA PRO B 72 20.793 -2.490 5.753 1.00 0.00 H new ATOM 0 HB2 PRO B 72 21.145 -5.187 6.956 1.00 0.00 H new ATOM 0 HB3 PRO B 72 20.408 -3.777 7.691 1.00 0.00 H new ATOM 0 HG2 PRO B 72 18.951 -5.948 6.977 1.00 0.00 H new ATOM 0 HG3 PRO B 72 18.279 -4.330 6.946 1.00 0.00 H new ATOM 0 HD2 PRO B 72 19.303 -5.992 4.640 1.00 0.00 H new ATOM 0 HD3 PRO B 72 17.890 -4.957 4.706 1.00 0.00 H new ATOM 2447 N LYS B 73 22.762 -2.994 4.308 1.00 0.00 N ATOM 2448 CA LYS B 73 24.087 -3.193 3.726 1.00 0.00 C ATOM 2449 C LYS B 73 25.173 -2.719 4.690 1.00 0.00 C ATOM 2450 O LYS B 73 26.264 -2.337 4.276 1.00 0.00 O ATOM 2451 CB LYS B 73 24.170 -2.438 2.399 1.00 0.00 C ATOM 2452 CG LYS B 73 23.158 -2.926 1.377 1.00 0.00 C ATOM 2453 CD LYS B 73 22.864 -1.881 0.315 1.00 0.00 C ATOM 2454 CE LYS B 73 22.321 -0.603 0.938 1.00 0.00 C ATOM 2455 NZ LYS B 73 21.635 0.261 -0.057 1.00 0.00 N ATOM 0 H LYS B 73 22.346 -2.088 4.094 1.00 0.00 H new ATOM 0 HA LYS B 73 24.247 -4.256 3.543 1.00 0.00 H new ATOM 0 HB2 LYS B 73 24.011 -1.375 2.581 1.00 0.00 H new ATOM 0 HB3 LYS B 73 25.174 -2.545 1.988 1.00 0.00 H new ATOM 0 HG2 LYS B 73 23.534 -3.831 0.899 1.00 0.00 H new ATOM 0 HG3 LYS B 73 22.232 -3.195 1.885 1.00 0.00 H new ATOM 0 HD2 LYS B 73 23.774 -1.659 -0.243 1.00 0.00 H new ATOM 0 HD3 LYS B 73 22.141 -2.277 -0.399 1.00 0.00 H new ATOM 0 HE2 LYS B 73 21.624 -0.858 1.736 1.00 0.00 H new ATOM 0 HE3 LYS B 73 23.140 -0.048 1.395 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 21.569 1.231 0.313 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 22.176 0.265 -0.945 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 20.679 -0.107 -0.236 1.00 0.00 H new ATOM 2469 N THR B 74 24.854 -2.792 5.982 1.00 0.00 N ATOM 2470 CA THR B 74 25.735 -2.374 7.074 1.00 0.00 C ATOM 2471 C THR B 74 26.277 -0.953 6.888 1.00 0.00 C ATOM 2472 O THR B 74 25.629 0.019 7.281 1.00 0.00 O ATOM 2473 CB THR B 74 26.898 -3.369 7.318 1.00 0.00 C ATOM 2474 OG1 THR B 74 27.646 -3.605 6.116 1.00 0.00 O ATOM 2475 CG2 THR B 74 26.364 -4.686 7.854 1.00 0.00 C ATOM 0 H THR B 74 23.956 -3.151 6.306 1.00 0.00 H new ATOM 0 HA THR B 74 25.105 -2.374 7.964 1.00 0.00 H new ATOM 0 HB THR B 74 27.565 -2.922 8.055 1.00 0.00 H new ATOM 0 HG1 THR B 74 27.209 -3.152 5.365 1.00 0.00 H new ATOM 0 HG21 THR B 74 27.193 -5.374 8.020 1.00 0.00 H new ATOM 0 HG22 THR B 74 25.843 -4.511 8.795 1.00 0.00 H new ATOM 0 HG23 THR B 74 25.672 -5.119 7.132 1.00 0.00 H new ATOM 2483 N HIS B 75 27.459 -0.826 6.300 1.00 0.00 N ATOM 2484 CA HIS B 75 28.075 0.477 6.106 1.00 0.00 C ATOM 2485 C HIS B 75 28.847 0.523 4.803 1.00 0.00 C ATOM 2486 O HIS B 75 29.642 -0.371 4.516 1.00 0.00 O ATOM 2487 CB HIS B 75 29.062 0.815 7.237 1.00 0.00 C ATOM 2488 CG HIS B 75 28.458 0.924 8.601 1.00 0.00 C ATOM 2489 ND1 HIS B 75 28.006 2.110 9.133 1.00 0.00 N ATOM 2490 CD2 HIS B 75 28.271 -0.010 9.560 1.00 0.00 C ATOM 2491 CE1 HIS B 75 27.570 1.901 10.360 1.00 0.00 C ATOM 2492 NE2 HIS B 75 27.720 0.619 10.647 1.00 0.00 N ATOM 0 H HIS B 75 28.009 -1.610 5.950 1.00 0.00 H new ATOM 0 HA HIS B 75 27.260 1.201 6.096 1.00 0.00 H new ATOM 0 HB2 HIS B 75 29.837 0.049 7.261 1.00 0.00 H new ATOM 0 HB3 HIS B 75 29.553 1.758 6.999 1.00 0.00 H new ATOM 0 HD2 HIS B 75 28.512 -1.060 9.484 1.00 0.00 H new ATOM 0 HE1 HIS B 75 27.159 2.651 11.020 1.00 0.00 H new ATOM 0 HE2 HIS B 75 27.468 0.173 11.529 1.00 0.00 H new ATOM 2501 N LEU B 76 28.595 1.555 4.014 1.00 0.00 N ATOM 2502 CA LEU B 76 29.531 1.946 2.979 1.00 0.00 C ATOM 2503 C LEU B 76 30.626 2.727 3.683 1.00 0.00 C ATOM 2504 O LEU B 76 30.461 3.914 3.963 1.00 0.00 O ATOM 2505 CB LEU B 76 28.852 2.798 1.902 1.00 0.00 C ATOM 2506 CG LEU B 76 29.741 3.170 0.710 1.00 0.00 C ATOM 2507 CD1 LEU B 76 30.188 1.919 -0.030 1.00 0.00 C ATOM 2508 CD2 LEU B 76 29.004 4.114 -0.227 1.00 0.00 C ATOM 0 H LEU B 76 27.756 2.132 4.071 1.00 0.00 H new ATOM 0 HA LEU B 76 29.931 1.074 2.462 1.00 0.00 H new ATOM 0 HB2 LEU B 76 27.980 2.259 1.531 1.00 0.00 H new ATOM 0 HB3 LEU B 76 28.487 3.716 2.363 1.00 0.00 H new ATOM 0 HG LEU B 76 30.628 3.682 1.084 1.00 0.00 H new ATOM 0 HD11 LEU B 76 30.818 2.201 -0.873 1.00 0.00 H new ATOM 0 HD12 LEU B 76 30.753 1.278 0.647 1.00 0.00 H new ATOM 0 HD13 LEU B 76 29.314 1.380 -0.395 1.00 0.00 H new ATOM 0 HD21 LEU B 76 29.649 4.369 -1.068 1.00 0.00 H new ATOM 0 HD22 LEU B 76 28.101 3.628 -0.596 1.00 0.00 H new ATOM 0 HD23 LEU B 76 28.733 5.023 0.311 1.00 0.00 H new ATOM 2520 N GLU B 77 31.709 2.026 3.996 1.00 0.00 N ATOM 2521 CA GLU B 77 32.672 2.453 5.010 1.00 0.00 C ATOM 2522 C GLU B 77 33.096 3.914 4.877 1.00 0.00 C ATOM 2523 O GLU B 77 33.957 4.266 4.065 1.00 0.00 O ATOM 2524 CB GLU B 77 33.900 1.545 4.999 1.00 0.00 C ATOM 2525 CG GLU B 77 34.712 1.626 6.278 1.00 0.00 C ATOM 2526 CD GLU B 77 33.910 1.221 7.501 1.00 0.00 C ATOM 2527 OE1 GLU B 77 33.243 2.086 8.101 1.00 0.00 O ATOM 2528 OE2 GLU B 77 33.943 0.031 7.878 1.00 0.00 O ATOM 0 H GLU B 77 31.947 1.139 3.552 1.00 0.00 H new ATOM 0 HA GLU B 77 32.158 2.368 5.967 1.00 0.00 H new ATOM 0 HB2 GLU B 77 33.581 0.514 4.843 1.00 0.00 H new ATOM 0 HB3 GLU B 77 34.535 1.813 4.155 1.00 0.00 H new ATOM 0 HG2 GLU B 77 35.587 0.981 6.191 1.00 0.00 H new ATOM 0 HG3 GLU B 77 35.078 2.644 6.408 1.00 0.00 H new ATOM 2535 N HIS B 78 32.451 4.746 5.686 1.00 0.00 N ATOM 2536 CA HIS B 78 32.786 6.152 5.844 1.00 0.00 C ATOM 2537 C HIS B 78 32.412 6.562 7.257 1.00 0.00 C ATOM 2538 O HIS B 78 31.280 6.324 7.672 1.00 0.00 O ATOM 2539 CB HIS B 78 32.029 7.042 4.849 1.00 0.00 C ATOM 2540 CG HIS B 78 32.411 6.852 3.415 1.00 0.00 C ATOM 2541 ND1 HIS B 78 33.651 7.177 2.916 1.00 0.00 N ATOM 2542 CD2 HIS B 78 31.700 6.376 2.367 1.00 0.00 C ATOM 2543 CE1 HIS B 78 33.683 6.916 1.624 1.00 0.00 C ATOM 2544 NE2 HIS B 78 32.510 6.427 1.262 1.00 0.00 N ATOM 0 H HIS B 78 31.663 4.453 6.263 1.00 0.00 H new ATOM 0 HA HIS B 78 33.851 6.281 5.653 1.00 0.00 H new ATOM 0 HB2 HIS B 78 30.961 6.851 4.953 1.00 0.00 H new ATOM 0 HB3 HIS B 78 32.194 8.085 5.119 1.00 0.00 H new ATOM 0 HD2 HIS B 78 30.681 6.021 2.396 1.00 0.00 H new ATOM 0 HE1 HIS B 78 34.528 7.075 0.970 1.00 0.00 H new ATOM 0 HE2 HIS B 78 32.251 6.136 0.319 1.00 0.00 H new ATOM 2553 N HIS B 79 33.362 7.168 7.970 1.00 0.00 N ATOM 2554 CA HIS B 79 33.210 7.567 9.380 1.00 0.00 C ATOM 2555 C HIS B 79 32.636 6.444 10.257 1.00 0.00 C ATOM 2556 O HIS B 79 31.441 6.149 10.238 1.00 0.00 O ATOM 2557 CB HIS B 79 32.415 8.886 9.553 1.00 0.00 C ATOM 2558 CG HIS B 79 31.002 8.902 9.037 1.00 0.00 C ATOM 2559 ND1 HIS B 79 29.918 8.504 9.791 1.00 0.00 N ATOM 2560 CD2 HIS B 79 30.496 9.315 7.849 1.00 0.00 C ATOM 2561 CE1 HIS B 79 28.813 8.667 9.092 1.00 0.00 C ATOM 2562 NE2 HIS B 79 29.132 9.159 7.910 1.00 0.00 N ATOM 0 H HIS B 79 34.276 7.402 7.582 1.00 0.00 H new ATOM 0 HA HIS B 79 34.222 7.762 9.735 1.00 0.00 H new ATOM 0 HB2 HIS B 79 32.391 9.131 10.615 1.00 0.00 H new ATOM 0 HB3 HIS B 79 32.967 9.683 9.055 1.00 0.00 H new ATOM 0 HD1 HIS B 79 29.964 8.140 10.743 1.00 0.00 H new ATOM 0 HD2 HIS B 79 31.060 9.696 7.010 1.00 0.00 H new ATOM 0 HE1 HIS B 79 27.813 8.436 9.430 1.00 0.00 H new ATOM 2571 N HIS B 80 33.512 5.827 11.042 1.00 0.00 N ATOM 2572 CA HIS B 80 33.117 4.754 11.950 1.00 0.00 C ATOM 2573 C HIS B 80 32.050 5.243 12.929 1.00 0.00 C ATOM 2574 O HIS B 80 31.190 4.473 13.362 1.00 0.00 O ATOM 2575 CB HIS B 80 34.338 4.231 12.711 1.00 0.00 C ATOM 2576 CG HIS B 80 34.034 3.108 13.654 1.00 0.00 C ATOM 2577 ND1 HIS B 80 33.975 1.789 13.260 1.00 0.00 N ATOM 2578 CD2 HIS B 80 33.766 3.116 14.979 1.00 0.00 C ATOM 2579 CE1 HIS B 80 33.683 1.035 14.305 1.00 0.00 C ATOM 2580 NE2 HIS B 80 33.553 1.816 15.361 1.00 0.00 N ATOM 0 H HIS B 80 34.506 6.053 11.068 1.00 0.00 H new ATOM 0 HA HIS B 80 32.695 3.940 11.361 1.00 0.00 H new ATOM 0 HB2 HIS B 80 35.085 3.895 11.992 1.00 0.00 H new ATOM 0 HB3 HIS B 80 34.783 5.053 13.272 1.00 0.00 H new ATOM 0 HD2 HIS B 80 33.727 3.985 15.619 1.00 0.00 H new ATOM 0 HE1 HIS B 80 33.570 -0.039 14.297 1.00 0.00 H new ATOM 0 HE2 HIS B 80 33.331 1.504 16.306 1.00 0.00 H new ATOM 2589 N HIS B 81 32.120 6.525 13.275 1.00 0.00 N ATOM 2590 CA HIS B 81 31.125 7.148 14.132 1.00 0.00 C ATOM 2591 C HIS B 81 29.747 7.048 13.482 1.00 0.00 C ATOM 2592 O HIS B 81 29.543 7.529 12.366 1.00 0.00 O ATOM 2593 CB HIS B 81 31.494 8.613 14.393 1.00 0.00 C ATOM 2594 CG HIS B 81 30.589 9.307 15.365 1.00 0.00 C ATOM 2595 ND1 HIS B 81 30.856 9.383 16.713 1.00 0.00 N ATOM 2596 CD2 HIS B 81 29.415 9.954 15.179 1.00 0.00 C ATOM 2597 CE1 HIS B 81 29.886 10.046 17.314 1.00 0.00 C ATOM 2598 NE2 HIS B 81 29.000 10.404 16.406 1.00 0.00 N ATOM 0 H HIS B 81 32.863 7.154 12.971 1.00 0.00 H new ATOM 0 HA HIS B 81 31.099 6.626 15.088 1.00 0.00 H new ATOM 0 HB2 HIS B 81 32.516 8.658 14.769 1.00 0.00 H new ATOM 0 HB3 HIS B 81 31.478 9.155 13.447 1.00 0.00 H new ATOM 0 HD2 HIS B 81 28.901 10.090 14.239 1.00 0.00 H new ATOM 0 HE1 HIS B 81 29.828 10.259 18.371 1.00 0.00 H new ATOM 0 HE2 HIS B 81 28.145 10.930 16.587 1.00 0.00 H new ATOM 2607 N HIS B 82 28.813 6.424 14.190 1.00 0.00 N ATOM 2608 CA HIS B 82 27.484 6.148 13.647 1.00 0.00 C ATOM 2609 C HIS B 82 26.632 7.407 13.639 1.00 0.00 C ATOM 2610 O HIS B 82 26.314 7.954 12.583 1.00 0.00 O ATOM 2611 CB HIS B 82 26.768 5.068 14.472 1.00 0.00 C ATOM 2612 CG HIS B 82 27.507 3.770 14.577 1.00 0.00 C ATOM 2613 ND1 HIS B 82 26.991 2.573 14.142 1.00 0.00 N ATOM 2614 CD2 HIS B 82 28.713 3.482 15.114 1.00 0.00 C ATOM 2615 CE1 HIS B 82 27.846 1.607 14.410 1.00 0.00 C ATOM 2616 NE2 HIS B 82 28.903 2.130 15.003 1.00 0.00 N ATOM 0 H HIS B 82 28.951 6.097 15.146 1.00 0.00 H new ATOM 0 HA HIS B 82 27.617 5.793 12.625 1.00 0.00 H new ATOM 0 HB2 HIS B 82 26.593 5.453 15.476 1.00 0.00 H new ATOM 0 HB3 HIS B 82 25.790 4.879 14.028 1.00 0.00 H new ATOM 0 HD2 HIS B 82 29.402 4.189 15.551 1.00 0.00 H new ATOM 0 HE1 HIS B 82 27.705 0.561 14.182 1.00 0.00 H new ATOM 0 HE2 HIS B 82 29.723 1.615 15.324 1.00 0.00 H new ATOM 2625 N HIS B 83 26.264 7.850 14.831 1.00 0.00 N ATOM 2626 CA HIS B 83 25.416 9.020 15.001 1.00 0.00 C ATOM 2627 C HIS B 83 25.700 9.684 16.338 1.00 0.00 C ATOM 2628 O HIS B 83 25.299 9.118 17.375 1.00 0.00 O ATOM 2629 CB HIS B 83 23.934 8.643 14.919 1.00 0.00 C ATOM 2630 CG HIS B 83 23.358 8.726 13.542 1.00 0.00 C ATOM 2631 ND1 HIS B 83 22.655 7.700 12.951 1.00 0.00 N ATOM 2632 CD2 HIS B 83 23.351 9.744 12.654 1.00 0.00 C ATOM 2633 CE1 HIS B 83 22.247 8.083 11.758 1.00 0.00 C ATOM 2634 NE2 HIS B 83 22.649 9.324 11.550 1.00 0.00 N ATOM 2635 OXT HIS B 83 26.324 10.765 16.347 1.00 0.00 O ATOM 0 H HIS B 83 26.544 7.409 15.707 1.00 0.00 H new ATOM 0 HA HIS B 83 25.641 9.717 14.194 1.00 0.00 H new ATOM 0 HB2 HIS B 83 23.807 7.627 15.293 1.00 0.00 H new ATOM 0 HB3 HIS B 83 23.366 9.299 15.579 1.00 0.00 H new ATOM 0 HD2 HIS B 83 23.813 10.711 12.787 1.00 0.00 H new ATOM 0 HE1 HIS B 83 21.678 7.482 11.065 1.00 0.00 H new ATOM 0 HE2 HIS B 83 22.469 9.877 10.712 1.00 0.00 H new TER 2644 HIS B 83