USER MOD reduce.3.24.130724 H: found=0, std=0, add=1806, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 1802 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 35 THR OG1 : rot -110:sc= -0.62 USER MOD Set 1.2: B 53 HIS : no HD1:sc= -1.88 X(o=-2.5,f=-2.7!) USER MOD Set 2.1: B 19 GLN : amide:sc= -0.141 K(o=0.37,f=-6.4!) USER MOD Set 2.2: B 22 LYS NZ :NH3+ 173:sc= 0.514 (180deg=0) USER MOD Set 3.1: B 21 TYR OH : rot -163:sc= 0.852 USER MOD Set 3.2: B 113 HIS : no HD1:sc= 1.6 K(o=2.4,f=-11!) USER MOD Set 4.1: A 43 ASN : amide:sc= -0.261 K(o=-0.26,f=-5.6!) USER MOD Set 4.2: B 3 HIS : no HD1:sc= 0.00257 X(o=-0.26,f=-0.41) USER MOD Set 5.1: A 81 THR OG1 : rot 79:sc= 2.18 USER MOD Set 5.2: B 1 MET CE :methyl -121:sc= 0 (180deg=-0.063) USER MOD Set 5.3: B 2 THR OG1 : rot 175:sc= 0.0451 USER MOD Set 6.1: A 35 THR OG1 : rot 83:sc= -0.421 USER MOD Set 6.2: A 53 HIS : no HD1:sc= -1.18 K(o=-1.6,f=-0.85) USER MOD Set 7.1: A 21 TYR OH : rot 1:sc= 0.45 USER MOD Set 7.2: A 113 HIS : no HD1:sc= 0.932 K(o=1.4,f=-11!) USER MOD Set 8.1: A 19 GLN : amide:sc= 0.123 K(o=0.48,f=-4.2!) USER MOD Set 8.2: A 22 LYS NZ :NH3+ 174:sc= 0.357 (180deg=0) USER MOD Set 9.1: A 7 THR OG1 : rot 36:sc= 0.215 USER MOD Set 9.2: B 7 THR OG1 : rot 165:sc= 0.139 USER MOD Set10.1: A 1 MET CE :methyl -166:sc= -0.014 (180deg=-0.197) USER MOD Set10.2: A 2 THR OG1 : rot -175:sc= 1.2 USER MOD Set10.3: B 81 THR OG1 : rot 96:sc= 2.25 USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 10 TYR OH : rot 25:sc= -0.613 USER MOD Single : A 13 ASN : amide:sc= -0.0962 K(o=-0.096,f=-2.4!) USER MOD Single : A 17 SER OG : rot 92:sc= 0.153 USER MOD Single : A 18 THR OG1 : rot 89:sc= 0.923 USER MOD Single : A 32 SER OG : rot 30:sc= 0.0545 USER MOD Single : A 33 SER OG : rot 140:sc= 0 USER MOD Single : A 37 SER OG : rot -130:sc= 0 USER MOD Single : A 45 MET CE :methyl 147:sc= -0.116 (180deg=-0.864) USER MOD Single : A 46 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.244) USER MOD Single : A 51 SER OG : rot -92:sc= -0.516 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -115:sc= 0.998 (180deg=-0.353) USER MOD Single : A 60 SER OG : rot 47:sc= 0.133 USER MOD Single : A 62 THR OG1 : rot 121:sc= 0.387 USER MOD Single : A 74 ASN : amide:sc= -1.13 K(o=-1.1,f=-1.9) USER MOD Single : A 77 GLN : amide:sc= -0.0122 K(o=-0.012,f=-1.4) USER MOD Single : A 86 LYS NZ :NH3+ 154:sc= -0.0512 (180deg=-0.995) USER MOD Single : A 88 SER OG : rot -22:sc= 0.183 USER MOD Single : A 92 MET CE :methyl -120:sc= -1.49 (180deg=-3.4!) USER MOD Single : A 94 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.46) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 134:sc= -0.627 (180deg=-2.26!) USER MOD Single : A 99 MET CE :methyl -125:sc= -1.63 (180deg=-2.19) USER MOD Single : A 103 TYR OH : rot -39:sc= -0.016 USER MOD Single : A 104 THR OG1 : rot 172:sc= -0.084 USER MOD Single : A 106 THR OG1 : rot 142:sc= -0.0404 USER MOD Single : A 112 SER OG : rot -3:sc= 1.04 USER MOD Single : A 118 TYR OH : rot -24:sc= 1.11 USER MOD Single : B 1 MET N :NH3+ -170:sc= 1.17 (180deg=0.76) USER MOD Single : B 10 TYR OH : rot 62:sc= 0.272 USER MOD Single : B 13 ASN : amide:sc= -1.19 K(o=-1.2,f=-5.5!) USER MOD Single : B 17 SER OG : rot 93:sc= 0.294 USER MOD Single : B 18 THR OG1 : rot 89:sc= 0.982 USER MOD Single : B 32 SER OG : rot 180:sc= -0.504 USER MOD Single : B 33 SER OG : rot 140:sc= 0 USER MOD Single : B 37 SER OG : rot -96:sc=-0.00101 USER MOD Single : B 43 ASN : amide:sc= -1.17 K(o=-1.2,f=-1.7) USER MOD Single : B 45 MET CE :methyl 148:sc= -0.114 (180deg=-0.812) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 SER OG : rot -90:sc= -0.583 USER MOD Single : B 54 THR OG1 : rot 180:sc= 0 USER MOD Single : B 58 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.011) USER MOD Single : B 60 SER OG : rot 48:sc= 0.158 USER MOD Single : B 62 THR OG1 : rot 178:sc= 0.328 USER MOD Single : B 74 ASN : amide:sc= -1.46 K(o=-1.5,f=-3!) USER MOD Single : B 77 GLN : amide:sc= -0.017 X(o=-0.017,f=-0.2) USER MOD Single : B 86 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.129) USER MOD Single : B 88 SER OG : rot -32:sc= 0.0675 USER MOD Single : B 92 MET CE :methyl -125:sc= -1.8 (180deg=-5.2!) USER MOD Single : B 94 GLN : amide:sc= -0.0912 X(o=-0.091,f=-0.24) USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 98 LYS NZ :NH3+ 139:sc= -0.686 (180deg=-2.06!) USER MOD Single : B 99 MET CE :methyl -121:sc= -0.523 (180deg=-0.762) USER MOD Single : B 103 TYR OH : rot 180:sc= -0.0868 USER MOD Single : B 104 THR OG1 : rot -90:sc= -0.0982 USER MOD Single : B 106 THR OG1 : rot 140:sc= 0 USER MOD Single : B 112 SER OG : rot -41:sc= 0.567 USER MOD Single : B 118 TYR OH : rot -28:sc= 0.369 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.372 18.533 -7.805 1.00 0.00 N ATOM 2 CA MET A 1 5.686 17.853 -7.869 1.00 0.00 C ATOM 3 C MET A 1 5.535 16.319 -7.752 1.00 0.00 C ATOM 4 O MET A 1 5.749 15.599 -8.736 1.00 0.00 O ATOM 5 CB MET A 1 6.687 18.437 -6.805 1.00 0.00 C ATOM 6 CG MET A 1 6.119 18.623 -5.386 1.00 0.00 C ATOM 7 SD MET A 1 7.397 18.976 -4.153 1.00 0.00 S ATOM 8 CE MET A 1 8.192 17.373 -3.995 1.00 0.00 C ATOM 0 H1 MET A 1 4.509 19.561 -7.886 1.00 0.00 H new ATOM 0 H2 MET A 1 3.771 18.201 -8.586 1.00 0.00 H new ATOM 0 H3 MET A 1 3.912 18.316 -6.898 1.00 0.00 H new ATOM 0 HA MET A 1 6.116 18.053 -8.850 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.552 17.777 -6.747 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.046 19.402 -7.162 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.395 19.438 -5.394 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.580 17.721 -5.095 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.823 17.366 -3.106 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.432 16.597 -3.906 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.804 17.182 -4.876 1.00 0.00 H new ATOM 18 N THR A 2 5.116 15.812 -6.573 1.00 0.00 N ATOM 19 CA THR A 2 5.218 14.376 -6.247 1.00 0.00 C ATOM 20 C THR A 2 3.968 13.881 -5.491 1.00 0.00 C ATOM 21 O THR A 2 3.643 14.390 -4.409 1.00 0.00 O ATOM 22 CB THR A 2 6.506 14.142 -5.401 1.00 0.00 C ATOM 23 OG1 THR A 2 7.624 14.700 -6.099 1.00 0.00 O ATOM 24 CG2 THR A 2 6.781 12.665 -5.124 1.00 0.00 C ATOM 0 H THR A 2 4.704 16.378 -5.831 1.00 0.00 H new ATOM 0 HA THR A 2 5.279 13.804 -7.173 1.00 0.00 H new ATOM 0 HB THR A 2 6.353 14.627 -4.437 1.00 0.00 H new ATOM 0 HG1 THR A 2 8.450 14.491 -5.614 1.00 0.00 H new ATOM 0 HG21 THR A 2 7.691 12.569 -4.531 1.00 0.00 H new ATOM 0 HG22 THR A 2 5.943 12.236 -4.575 1.00 0.00 H new ATOM 0 HG23 THR A 2 6.906 12.135 -6.068 1.00 0.00 H new ATOM 32 N HIS A 3 3.264 12.889 -6.081 1.00 0.00 N ATOM 33 CA HIS A 3 2.063 12.260 -5.490 1.00 0.00 C ATOM 34 C HIS A 3 2.135 10.720 -5.653 1.00 0.00 C ATOM 35 O HIS A 3 2.483 10.229 -6.734 1.00 0.00 O ATOM 36 CB HIS A 3 0.760 12.787 -6.153 1.00 0.00 C ATOM 37 CG HIS A 3 0.475 14.250 -5.939 1.00 0.00 C ATOM 38 ND1 HIS A 3 0.604 15.193 -6.935 1.00 0.00 N ATOM 39 CD2 HIS A 3 0.021 14.921 -4.850 1.00 0.00 C ATOM 40 CE1 HIS A 3 0.238 16.370 -6.476 1.00 0.00 C ATOM 41 NE2 HIS A 3 -0.116 16.235 -5.212 1.00 0.00 N ATOM 0 H HIS A 3 3.517 12.499 -6.989 1.00 0.00 H new ATOM 0 HA HIS A 3 2.040 12.520 -4.432 1.00 0.00 H new ATOM 0 HB2 HIS A 3 0.815 12.598 -7.225 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -0.082 12.210 -5.770 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -0.192 14.498 -3.879 1.00 0.00 H new ATOM 0 HE1 HIS A 3 0.229 17.292 -7.039 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -0.439 16.987 -4.603 1.00 0.00 H new ATOM 50 N PRO A 4 1.831 9.938 -4.569 1.00 0.00 N ATOM 51 CA PRO A 4 1.739 8.472 -4.631 1.00 0.00 C ATOM 52 C PRO A 4 0.304 7.967 -4.934 1.00 0.00 C ATOM 53 O PRO A 4 -0.582 7.999 -4.074 1.00 0.00 O ATOM 54 CB PRO A 4 2.208 8.068 -3.215 1.00 0.00 C ATOM 55 CG PRO A 4 1.685 9.161 -2.319 1.00 0.00 C ATOM 56 CD PRO A 4 1.596 10.420 -3.180 1.00 0.00 C ATOM 0 HA PRO A 4 2.330 8.038 -5.438 1.00 0.00 H new ATOM 0 HB2 PRO A 4 1.810 7.095 -2.928 1.00 0.00 H new ATOM 0 HB3 PRO A 4 3.294 7.997 -3.162 1.00 0.00 H new ATOM 0 HG2 PRO A 4 0.708 8.897 -1.915 1.00 0.00 H new ATOM 0 HG3 PRO A 4 2.350 9.318 -1.469 1.00 0.00 H new ATOM 0 HD2 PRO A 4 0.621 10.898 -3.085 1.00 0.00 H new ATOM 0 HD3 PRO A 4 2.342 11.157 -2.884 1.00 0.00 H new ATOM 64 N ASP A 5 0.075 7.538 -6.179 1.00 0.00 N ATOM 65 CA ASP A 5 -1.141 6.770 -6.556 1.00 0.00 C ATOM 66 C ASP A 5 -0.823 5.264 -6.575 1.00 0.00 C ATOM 67 O ASP A 5 -1.630 4.432 -7.018 1.00 0.00 O ATOM 68 CB ASP A 5 -1.676 7.233 -7.935 1.00 0.00 C ATOM 69 CG ASP A 5 -0.722 6.893 -9.101 1.00 0.00 C ATOM 70 OD1 ASP A 5 0.387 7.472 -9.159 1.00 0.00 O ATOM 71 OD2 ASP A 5 -1.063 6.026 -9.944 1.00 0.00 O ATOM 0 H ASP A 5 0.714 7.706 -6.956 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.918 6.956 -5.814 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -2.644 6.766 -8.118 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -1.841 8.310 -7.911 1.00 0.00 H new ATOM 76 N PHE A 6 0.349 4.940 -6.011 1.00 0.00 N ATOM 77 CA PHE A 6 0.984 3.638 -6.111 1.00 0.00 C ATOM 78 C PHE A 6 1.360 3.185 -4.688 1.00 0.00 C ATOM 79 O PHE A 6 1.955 3.943 -3.918 1.00 0.00 O ATOM 80 CB PHE A 6 2.228 3.759 -7.051 1.00 0.00 C ATOM 81 CG PHE A 6 2.957 2.462 -7.447 1.00 0.00 C ATOM 82 CD1 PHE A 6 2.407 1.202 -7.244 1.00 0.00 C ATOM 83 CD2 PHE A 6 4.210 2.526 -8.059 1.00 0.00 C ATOM 84 CE1 PHE A 6 3.078 0.067 -7.633 1.00 0.00 C ATOM 85 CE2 PHE A 6 4.878 1.385 -8.439 1.00 0.00 C ATOM 86 CZ PHE A 6 4.313 0.158 -8.227 1.00 0.00 C ATOM 0 H PHE A 6 0.890 5.604 -5.458 1.00 0.00 H new ATOM 0 HA PHE A 6 0.320 2.889 -6.543 1.00 0.00 H new ATOM 0 HB2 PHE A 6 1.909 4.257 -7.967 1.00 0.00 H new ATOM 0 HB3 PHE A 6 2.951 4.415 -6.567 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.439 1.113 -6.774 1.00 0.00 H new ATOM 0 HD2 PHE A 6 4.664 3.490 -8.238 1.00 0.00 H new ATOM 0 HE1 PHE A 6 2.631 -0.903 -7.470 1.00 0.00 H new ATOM 0 HE2 PHE A 6 5.849 1.458 -8.905 1.00 0.00 H new ATOM 0 HZ PHE A 6 4.837 -0.738 -8.526 1.00 0.00 H new ATOM 96 N THR A 7 0.954 1.959 -4.354 1.00 0.00 N ATOM 97 CA THR A 7 1.280 1.300 -3.082 1.00 0.00 C ATOM 98 C THR A 7 1.813 -0.100 -3.388 1.00 0.00 C ATOM 99 O THR A 7 1.302 -0.779 -4.277 1.00 0.00 O ATOM 100 CB THR A 7 0.032 1.223 -2.129 1.00 0.00 C ATOM 101 OG1 THR A 7 0.375 0.576 -0.888 1.00 0.00 O ATOM 102 CG2 THR A 7 -1.167 0.489 -2.768 1.00 0.00 C ATOM 0 H THR A 7 0.379 1.383 -4.969 1.00 0.00 H new ATOM 0 HA THR A 7 2.037 1.886 -2.560 1.00 0.00 H new ATOM 0 HB THR A 7 -0.269 2.254 -1.942 1.00 0.00 H new ATOM 0 HG1 THR A 7 1.292 0.815 -0.637 1.00 0.00 H new ATOM 0 HG21 THR A 7 -1.998 0.468 -2.063 1.00 0.00 H new ATOM 0 HG22 THR A 7 -1.473 1.012 -3.674 1.00 0.00 H new ATOM 0 HG23 THR A 7 -0.877 -0.531 -3.019 1.00 0.00 H new ATOM 110 N ILE A 8 2.868 -0.505 -2.680 1.00 0.00 N ATOM 111 CA ILE A 8 3.531 -1.806 -2.880 1.00 0.00 C ATOM 112 C ILE A 8 3.548 -2.553 -1.536 1.00 0.00 C ATOM 113 O ILE A 8 3.704 -1.928 -0.491 1.00 0.00 O ATOM 114 CB ILE A 8 5.015 -1.623 -3.403 1.00 0.00 C ATOM 115 CG1 ILE A 8 5.083 -0.686 -4.649 1.00 0.00 C ATOM 116 CG2 ILE A 8 5.681 -2.987 -3.715 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.496 -0.404 -5.157 1.00 0.00 C ATOM 0 H ILE A 8 3.294 0.060 -1.945 1.00 0.00 H new ATOM 0 HA ILE A 8 2.981 -2.372 -3.631 1.00 0.00 H new ATOM 0 HB ILE A 8 5.573 -1.147 -2.597 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.504 -1.134 -5.456 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.604 0.261 -4.401 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.698 -2.822 -4.071 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.707 -3.594 -2.810 1.00 0.00 H new ATOM 0 HG23 ILE A 8 5.107 -3.505 -4.483 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.446 0.255 -6.024 1.00 0.00 H new ATOM 0 HD12 ILE A 8 7.077 0.076 -4.369 1.00 0.00 H new ATOM 0 HD13 ILE A 8 6.974 -1.341 -5.441 1.00 0.00 H new ATOM 129 N LEU A 9 3.346 -3.877 -1.565 1.00 0.00 N ATOM 130 CA LEU A 9 3.445 -4.736 -0.370 1.00 0.00 C ATOM 131 C LEU A 9 4.655 -5.672 -0.547 1.00 0.00 C ATOM 132 O LEU A 9 4.834 -6.277 -1.611 1.00 0.00 O ATOM 133 CB LEU A 9 2.115 -5.528 -0.131 1.00 0.00 C ATOM 134 CG LEU A 9 0.925 -4.710 0.513 1.00 0.00 C ATOM 135 CD1 LEU A 9 0.335 -3.648 -0.441 1.00 0.00 C ATOM 136 CD2 LEU A 9 -0.184 -5.641 1.045 1.00 0.00 C ATOM 0 H LEU A 9 3.109 -4.386 -2.416 1.00 0.00 H new ATOM 0 HA LEU A 9 3.595 -4.124 0.520 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.778 -5.929 -1.087 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.334 -6.380 0.513 1.00 0.00 H new ATOM 0 HG LEU A 9 1.357 -4.172 1.357 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -0.477 -3.121 0.059 1.00 0.00 H new ATOM 0 HD12 LEU A 9 1.113 -2.936 -0.719 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.047 -4.136 -1.337 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.984 -5.042 1.480 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -0.582 -6.238 0.225 1.00 0.00 H new ATOM 0 HD23 LEU A 9 0.230 -6.302 1.807 1.00 0.00 H new ATOM 148 N TYR A 10 5.494 -5.748 0.509 1.00 0.00 N ATOM 149 CA TYR A 10 6.661 -6.651 0.570 1.00 0.00 C ATOM 150 C TYR A 10 6.234 -8.117 0.731 1.00 0.00 C ATOM 151 O TYR A 10 5.600 -8.453 1.721 1.00 0.00 O ATOM 152 CB TYR A 10 7.599 -6.312 1.774 1.00 0.00 C ATOM 153 CG TYR A 10 8.483 -5.077 1.656 1.00 0.00 C ATOM 154 CD1 TYR A 10 9.071 -4.730 0.446 1.00 0.00 C ATOM 155 CD2 TYR A 10 8.757 -4.278 2.774 1.00 0.00 C ATOM 156 CE1 TYR A 10 9.885 -3.629 0.352 1.00 0.00 C ATOM 157 CE2 TYR A 10 9.573 -3.173 2.682 1.00 0.00 C ATOM 158 CZ TYR A 10 10.135 -2.847 1.472 1.00 0.00 C ATOM 159 OH TYR A 10 10.944 -1.735 1.369 1.00 0.00 O ATOM 0 H TYR A 10 5.378 -5.180 1.348 1.00 0.00 H new ATOM 0 HA TYR A 10 7.190 -6.508 -0.372 1.00 0.00 H new ATOM 0 HB2 TYR A 10 6.977 -6.196 2.662 1.00 0.00 H new ATOM 0 HB3 TYR A 10 8.246 -7.172 1.948 1.00 0.00 H new ATOM 0 HD1 TYR A 10 8.885 -5.333 -0.430 1.00 0.00 H new ATOM 0 HD2 TYR A 10 8.319 -4.534 3.727 1.00 0.00 H new ATOM 0 HE1 TYR A 10 10.333 -3.370 -0.596 1.00 0.00 H new ATOM 0 HE2 TYR A 10 9.770 -2.567 3.554 1.00 0.00 H new ATOM 0 HH TYR A 10 10.934 -1.408 0.445 1.00 0.00 H new ATOM 169 N VAL A 11 6.615 -8.970 -0.225 1.00 0.00 N ATOM 170 CA VAL A 11 6.359 -10.425 -0.178 1.00 0.00 C ATOM 171 C VAL A 11 7.709 -11.152 -0.153 1.00 0.00 C ATOM 172 O VAL A 11 8.741 -10.561 -0.461 1.00 0.00 O ATOM 173 CB VAL A 11 5.481 -10.917 -1.398 1.00 0.00 C ATOM 174 CG1 VAL A 11 4.102 -10.211 -1.413 1.00 0.00 C ATOM 175 CG2 VAL A 11 6.203 -10.741 -2.762 1.00 0.00 C ATOM 0 H VAL A 11 7.115 -8.674 -1.063 1.00 0.00 H new ATOM 0 HA VAL A 11 5.789 -10.653 0.722 1.00 0.00 H new ATOM 0 HB VAL A 11 5.323 -11.986 -1.257 1.00 0.00 H new ATOM 0 HG11 VAL A 11 3.520 -10.568 -2.262 1.00 0.00 H new ATOM 0 HG12 VAL A 11 3.569 -10.433 -0.488 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.246 -9.134 -1.499 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.556 -11.094 -3.565 1.00 0.00 H new ATOM 0 HG22 VAL A 11 6.433 -9.687 -2.919 1.00 0.00 H new ATOM 0 HG23 VAL A 11 7.128 -11.318 -2.761 1.00 0.00 H new ATOM 185 N ASP A 12 7.705 -12.420 0.268 1.00 0.00 N ATOM 186 CA ASP A 12 8.942 -13.216 0.382 1.00 0.00 C ATOM 187 C ASP A 12 9.098 -14.121 -0.848 1.00 0.00 C ATOM 188 O ASP A 12 10.131 -14.088 -1.524 1.00 0.00 O ATOM 189 CB ASP A 12 8.923 -14.047 1.688 1.00 0.00 C ATOM 190 CG ASP A 12 10.278 -14.680 2.042 1.00 0.00 C ATOM 191 OD1 ASP A 12 11.239 -13.929 2.304 1.00 0.00 O ATOM 192 OD2 ASP A 12 10.393 -15.924 2.069 1.00 0.00 O ATOM 0 H ASP A 12 6.860 -12.923 0.537 1.00 0.00 H new ATOM 0 HA ASP A 12 9.799 -12.544 0.422 1.00 0.00 H new ATOM 0 HB2 ASP A 12 8.606 -13.406 2.511 1.00 0.00 H new ATOM 0 HB3 ASP A 12 8.177 -14.837 1.594 1.00 0.00 H new ATOM 197 N ASN A 13 8.052 -14.929 -1.127 1.00 0.00 N ATOM 198 CA ASN A 13 8.032 -15.882 -2.261 1.00 0.00 C ATOM 199 C ASN A 13 7.343 -15.224 -3.479 1.00 0.00 C ATOM 200 O ASN A 13 6.111 -15.102 -3.488 1.00 0.00 O ATOM 201 CB ASN A 13 7.305 -17.199 -1.836 1.00 0.00 C ATOM 202 CG ASN A 13 8.051 -17.980 -0.744 1.00 0.00 C ATOM 203 OD1 ASN A 13 8.798 -17.413 0.046 1.00 0.00 O ATOM 204 ND2 ASN A 13 7.829 -19.282 -0.661 1.00 0.00 N ATOM 0 H ASN A 13 7.196 -14.940 -0.572 1.00 0.00 H new ATOM 0 HA ASN A 13 9.052 -16.139 -2.545 1.00 0.00 H new ATOM 0 HB2 ASN A 13 6.305 -16.954 -1.479 1.00 0.00 H new ATOM 0 HB3 ASN A 13 7.184 -17.837 -2.711 1.00 0.00 H new ATOM 0 HD21 ASN A 13 8.283 -19.831 0.069 1.00 0.00 H new ATOM 0 HD22 ASN A 13 7.204 -19.736 -1.327 1.00 0.00 H new ATOM 211 N PRO A 14 8.139 -14.771 -4.520 1.00 0.00 N ATOM 212 CA PRO A 14 7.604 -13.995 -5.669 1.00 0.00 C ATOM 213 C PRO A 14 6.445 -14.704 -6.448 1.00 0.00 C ATOM 214 O PRO A 14 5.363 -14.119 -6.499 1.00 0.00 O ATOM 215 CB PRO A 14 8.852 -13.691 -6.556 1.00 0.00 C ATOM 216 CG PRO A 14 10.028 -13.884 -5.638 1.00 0.00 C ATOM 217 CD PRO A 14 9.615 -14.953 -4.648 1.00 0.00 C ATOM 0 HA PRO A 14 7.114 -13.083 -5.327 1.00 0.00 H new ATOM 0 HB2 PRO A 14 8.903 -14.364 -7.412 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.820 -12.675 -6.950 1.00 0.00 H new ATOM 0 HG2 PRO A 14 10.912 -14.190 -6.196 1.00 0.00 H new ATOM 0 HG3 PRO A 14 10.280 -12.955 -5.126 1.00 0.00 H new ATOM 0 HD2 PRO A 14 9.865 -15.951 -5.009 1.00 0.00 H new ATOM 0 HD3 PRO A 14 10.118 -14.826 -3.689 1.00 0.00 H new ATOM 225 N PRO A 15 6.591 -15.970 -7.033 1.00 0.00 N ATOM 226 CA PRO A 15 5.495 -16.607 -7.830 1.00 0.00 C ATOM 227 C PRO A 15 4.197 -16.745 -7.012 1.00 0.00 C ATOM 228 O PRO A 15 3.166 -16.179 -7.373 1.00 0.00 O ATOM 229 CB PRO A 15 6.069 -17.996 -8.235 1.00 0.00 C ATOM 230 CG PRO A 15 7.549 -17.822 -8.135 1.00 0.00 C ATOM 231 CD PRO A 15 7.767 -16.883 -6.969 1.00 0.00 C ATOM 0 HA PRO A 15 5.217 -16.007 -8.696 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.714 -18.783 -7.570 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.768 -18.273 -9.245 1.00 0.00 H new ATOM 0 HG2 PRO A 15 8.046 -18.777 -7.968 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.959 -17.406 -9.056 1.00 0.00 H new ATOM 0 HD2 PRO A 15 7.806 -17.421 -6.022 1.00 0.00 H new ATOM 0 HD3 PRO A 15 8.705 -16.336 -7.064 1.00 0.00 H new ATOM 239 N ALA A 16 4.314 -17.442 -5.869 1.00 0.00 N ATOM 240 CA ALA A 16 3.163 -17.886 -5.056 1.00 0.00 C ATOM 241 C ALA A 16 2.305 -16.702 -4.581 1.00 0.00 C ATOM 242 O ALA A 16 1.077 -16.716 -4.728 1.00 0.00 O ATOM 243 CB ALA A 16 3.643 -18.722 -3.860 1.00 0.00 C ATOM 0 H ALA A 16 5.215 -17.716 -5.478 1.00 0.00 H new ATOM 0 HA ALA A 16 2.532 -18.508 -5.691 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.783 -19.041 -3.271 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.181 -19.598 -4.221 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.306 -18.120 -3.238 1.00 0.00 H new ATOM 249 N SER A 17 2.972 -15.655 -4.071 1.00 0.00 N ATOM 250 CA SER A 17 2.294 -14.490 -3.493 1.00 0.00 C ATOM 251 C SER A 17 1.767 -13.547 -4.594 1.00 0.00 C ATOM 252 O SER A 17 0.782 -12.828 -4.371 1.00 0.00 O ATOM 253 CB SER A 17 3.263 -13.737 -2.562 1.00 0.00 C ATOM 254 OG SER A 17 3.793 -14.599 -1.562 1.00 0.00 O ATOM 0 H SER A 17 3.990 -15.594 -4.049 1.00 0.00 H new ATOM 0 HA SER A 17 1.437 -14.840 -2.917 1.00 0.00 H new ATOM 0 HB2 SER A 17 4.078 -13.312 -3.148 1.00 0.00 H new ATOM 0 HB3 SER A 17 2.743 -12.904 -2.089 1.00 0.00 H new ATOM 0 HG SER A 17 4.637 -14.985 -1.877 1.00 0.00 H new ATOM 260 N THR A 18 2.380 -13.589 -5.797 1.00 0.00 N ATOM 261 CA THR A 18 1.926 -12.779 -6.939 1.00 0.00 C ATOM 262 C THR A 18 0.622 -13.305 -7.559 1.00 0.00 C ATOM 263 O THR A 18 -0.324 -12.548 -7.780 1.00 0.00 O ATOM 264 CB THR A 18 3.039 -12.654 -8.046 1.00 0.00 C ATOM 265 OG1 THR A 18 4.133 -11.864 -7.547 1.00 0.00 O ATOM 266 CG2 THR A 18 2.534 -12.025 -9.369 1.00 0.00 C ATOM 0 H THR A 18 3.190 -14.176 -5.998 1.00 0.00 H new ATOM 0 HA THR A 18 1.723 -11.787 -6.536 1.00 0.00 H new ATOM 0 HB THR A 18 3.356 -13.672 -8.274 1.00 0.00 H new ATOM 0 HG1 THR A 18 4.775 -12.446 -7.090 1.00 0.00 H new ATOM 0 HG21 THR A 18 3.356 -11.971 -10.083 1.00 0.00 H new ATOM 0 HG22 THR A 18 1.734 -12.639 -9.782 1.00 0.00 H new ATOM 0 HG23 THR A 18 2.157 -11.021 -9.174 1.00 0.00 H new ATOM 274 N GLN A 19 0.569 -14.653 -7.712 1.00 0.00 N ATOM 275 CA GLN A 19 -0.616 -15.377 -8.230 1.00 0.00 C ATOM 276 C GLN A 19 -1.760 -15.291 -7.206 1.00 0.00 C ATOM 277 O GLN A 19 -2.939 -15.322 -7.587 1.00 0.00 O ATOM 278 CB GLN A 19 -0.280 -16.863 -8.530 1.00 0.00 C ATOM 279 CG GLN A 19 0.959 -17.095 -9.419 1.00 0.00 C ATOM 280 CD GLN A 19 0.859 -16.533 -10.836 1.00 0.00 C ATOM 281 OE1 GLN A 19 -0.213 -16.485 -11.442 1.00 0.00 O ATOM 282 NE2 GLN A 19 1.984 -16.104 -11.379 1.00 0.00 N ATOM 0 H GLN A 19 1.349 -15.267 -7.479 1.00 0.00 H new ATOM 0 HA GLN A 19 -0.925 -14.908 -9.164 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -0.129 -17.382 -7.583 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -1.143 -17.323 -9.012 1.00 0.00 H new ATOM 0 HG2 GLN A 19 1.826 -16.650 -8.930 1.00 0.00 H new ATOM 0 HG3 GLN A 19 1.144 -18.167 -9.483 1.00 0.00 H new ATOM 0 HE21 GLN A 19 2.856 -16.156 -10.853 1.00 0.00 H new ATOM 0 HE22 GLN A 19 1.980 -15.720 -12.324 1.00 0.00 H new ATOM 291 N PHE A 20 -1.391 -15.196 -5.910 1.00 0.00 N ATOM 292 CA PHE A 20 -2.355 -15.026 -4.816 1.00 0.00 C ATOM 293 C PHE A 20 -3.126 -13.715 -5.009 1.00 0.00 C ATOM 294 O PHE A 20 -4.352 -13.732 -5.009 1.00 0.00 O ATOM 295 CB PHE A 20 -1.638 -15.025 -3.430 1.00 0.00 C ATOM 296 CG PHE A 20 -2.584 -14.827 -2.232 1.00 0.00 C ATOM 297 CD1 PHE A 20 -2.924 -13.544 -1.786 1.00 0.00 C ATOM 298 CD2 PHE A 20 -3.159 -15.919 -1.578 1.00 0.00 C ATOM 299 CE1 PHE A 20 -3.799 -13.364 -0.740 1.00 0.00 C ATOM 300 CE2 PHE A 20 -4.037 -15.731 -0.527 1.00 0.00 C ATOM 301 CZ PHE A 20 -4.355 -14.456 -0.113 1.00 0.00 C ATOM 0 H PHE A 20 -0.420 -15.235 -5.600 1.00 0.00 H new ATOM 0 HA PHE A 20 -3.050 -15.865 -4.835 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -1.107 -15.969 -3.307 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -0.888 -14.234 -3.422 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -2.492 -12.681 -2.271 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -2.915 -16.922 -1.897 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -4.050 -12.366 -0.411 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -4.474 -16.584 -0.030 1.00 0.00 H new ATOM 0 HZ PHE A 20 -5.043 -14.313 0.707 1.00 0.00 H new ATOM 311 N TYR A 21 -2.399 -12.593 -5.225 1.00 0.00 N ATOM 312 CA TYR A 21 -3.031 -11.275 -5.458 1.00 0.00 C ATOM 313 C TYR A 21 -3.760 -11.257 -6.809 1.00 0.00 C ATOM 314 O TYR A 21 -4.762 -10.550 -6.939 1.00 0.00 O ATOM 315 CB TYR A 21 -1.998 -10.130 -5.331 1.00 0.00 C ATOM 316 CG TYR A 21 -1.758 -9.702 -3.871 1.00 0.00 C ATOM 317 CD1 TYR A 21 -0.785 -10.310 -3.075 1.00 0.00 C ATOM 318 CD2 TYR A 21 -2.537 -8.698 -3.286 1.00 0.00 C ATOM 319 CE1 TYR A 21 -0.596 -9.929 -1.759 1.00 0.00 C ATOM 320 CE2 TYR A 21 -2.348 -8.318 -1.976 1.00 0.00 C ATOM 321 CZ TYR A 21 -1.381 -8.933 -1.220 1.00 0.00 C ATOM 322 OH TYR A 21 -1.203 -8.548 0.081 1.00 0.00 O ATOM 0 H TYR A 21 -1.379 -12.575 -5.242 1.00 0.00 H new ATOM 0 HA TYR A 21 -3.780 -11.107 -4.684 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.053 -10.449 -5.771 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.343 -9.270 -5.905 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -0.169 -11.092 -3.495 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -3.302 -8.211 -3.873 1.00 0.00 H new ATOM 0 HE1 TYR A 21 0.162 -10.409 -1.158 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -2.959 -7.539 -1.545 1.00 0.00 H new ATOM 0 HH TYR A 21 -0.473 -9.067 0.479 1.00 0.00 H new ATOM 332 N LYS A 22 -3.255 -12.003 -7.810 1.00 0.00 N ATOM 333 CA LYS A 22 -3.872 -12.042 -9.152 1.00 0.00 C ATOM 334 C LYS A 22 -5.342 -12.491 -9.112 1.00 0.00 C ATOM 335 O LYS A 22 -6.217 -11.860 -9.701 1.00 0.00 O ATOM 336 CB LYS A 22 -3.057 -12.933 -10.119 1.00 0.00 C ATOM 337 CG LYS A 22 -1.720 -12.311 -10.570 1.00 0.00 C ATOM 338 CD LYS A 22 -0.886 -13.263 -11.452 1.00 0.00 C ATOM 339 CE LYS A 22 -1.606 -13.657 -12.756 1.00 0.00 C ATOM 340 NZ LYS A 22 -0.757 -14.480 -13.656 1.00 0.00 N ATOM 0 H LYS A 22 -2.423 -12.586 -7.716 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.858 -11.019 -9.528 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -2.856 -13.888 -9.634 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -3.663 -13.144 -11.000 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -1.920 -11.393 -11.122 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.138 -12.034 -9.691 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.063 -12.786 -11.697 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.653 -14.164 -10.885 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.513 -14.211 -12.512 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.916 -12.754 -13.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -1.322 -14.801 -14.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 0.044 -13.910 -13.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -0.398 -15.306 -13.136 1.00 0.00 H new ATOM 354 N ALA A 23 -5.580 -13.591 -8.382 1.00 0.00 N ATOM 355 CA ALA A 23 -6.931 -14.141 -8.165 1.00 0.00 C ATOM 356 C ALA A 23 -7.705 -13.312 -7.119 1.00 0.00 C ATOM 357 O ALA A 23 -8.916 -13.153 -7.228 1.00 0.00 O ATOM 358 CB ALA A 23 -6.826 -15.608 -7.719 1.00 0.00 C ATOM 0 H ALA A 23 -4.842 -14.126 -7.924 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.483 -14.090 -9.104 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -7.826 -16.012 -7.559 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -6.319 -16.188 -8.491 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.258 -15.666 -6.790 1.00 0.00 H new ATOM 364 N LEU A 24 -6.974 -12.806 -6.109 1.00 0.00 N ATOM 365 CA LEU A 24 -7.536 -12.037 -4.965 1.00 0.00 C ATOM 366 C LEU A 24 -8.256 -10.748 -5.405 1.00 0.00 C ATOM 367 O LEU A 24 -9.276 -10.358 -4.826 1.00 0.00 O ATOM 368 CB LEU A 24 -6.382 -11.644 -4.003 1.00 0.00 C ATOM 369 CG LEU A 24 -6.788 -11.063 -2.615 1.00 0.00 C ATOM 370 CD1 LEU A 24 -7.291 -12.184 -1.696 1.00 0.00 C ATOM 371 CD2 LEU A 24 -5.635 -10.264 -1.965 1.00 0.00 C ATOM 0 H LEU A 24 -5.961 -12.917 -6.057 1.00 0.00 H new ATOM 0 HA LEU A 24 -8.269 -12.680 -4.477 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.766 -12.527 -3.834 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.755 -10.909 -4.508 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.604 -10.357 -2.770 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -7.571 -11.764 -0.730 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.159 -12.664 -2.149 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.501 -12.922 -1.556 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.960 -9.876 -0.999 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.774 -10.918 -1.823 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -5.357 -9.434 -2.614 1.00 0.00 H new ATOM 383 N LEU A 25 -7.695 -10.102 -6.433 1.00 0.00 N ATOM 384 CA LEU A 25 -8.260 -8.879 -7.037 1.00 0.00 C ATOM 385 C LEU A 25 -9.048 -9.259 -8.307 1.00 0.00 C ATOM 386 O LEU A 25 -10.034 -8.597 -8.651 1.00 0.00 O ATOM 387 CB LEU A 25 -7.111 -7.881 -7.343 1.00 0.00 C ATOM 388 CG LEU A 25 -6.074 -7.665 -6.187 1.00 0.00 C ATOM 389 CD1 LEU A 25 -5.000 -6.639 -6.583 1.00 0.00 C ATOM 390 CD2 LEU A 25 -6.755 -7.269 -4.870 1.00 0.00 C ATOM 0 H LEU A 25 -6.830 -10.411 -6.876 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.950 -8.392 -6.348 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.576 -8.231 -8.226 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.550 -6.916 -7.598 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.580 -8.622 -6.021 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.297 -6.512 -5.760 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.466 -6.993 -7.465 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.474 -5.683 -6.805 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.999 -7.130 -4.097 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -7.306 -6.339 -5.011 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.444 -8.057 -4.566 1.00 0.00 H new ATOM 402 N GLY A 26 -8.596 -10.328 -8.993 1.00 0.00 N ATOM 403 CA GLY A 26 -9.146 -10.724 -10.295 1.00 0.00 C ATOM 404 C GLY A 26 -8.477 -9.981 -11.448 1.00 0.00 C ATOM 405 O GLY A 26 -9.103 -9.717 -12.478 1.00 0.00 O ATOM 0 H GLY A 26 -7.846 -10.933 -8.660 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.017 -11.798 -10.432 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.218 -10.528 -10.311 1.00 0.00 H new ATOM 409 N VAL A 27 -7.180 -9.650 -11.258 1.00 0.00 N ATOM 410 CA VAL A 27 -6.370 -8.871 -12.220 1.00 0.00 C ATOM 411 C VAL A 27 -5.099 -9.654 -12.620 1.00 0.00 C ATOM 412 O VAL A 27 -4.816 -10.727 -12.074 1.00 0.00 O ATOM 413 CB VAL A 27 -5.963 -7.470 -11.620 1.00 0.00 C ATOM 414 CG1 VAL A 27 -7.203 -6.644 -11.200 1.00 0.00 C ATOM 415 CG2 VAL A 27 -4.962 -7.620 -10.438 1.00 0.00 C ATOM 0 H VAL A 27 -6.661 -9.920 -10.422 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.982 -8.704 -13.106 1.00 0.00 H new ATOM 0 HB VAL A 27 -5.456 -6.920 -12.413 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -6.881 -5.686 -10.792 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.838 -6.473 -12.069 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -7.765 -7.191 -10.443 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.705 -6.634 -10.051 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.420 -8.212 -9.646 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.058 -8.119 -10.788 1.00 0.00 H new ATOM 425 N ASP A 28 -4.336 -9.099 -13.575 1.00 0.00 N ATOM 426 CA ASP A 28 -3.041 -9.655 -14.021 1.00 0.00 C ATOM 427 C ASP A 28 -1.986 -8.525 -14.061 1.00 0.00 C ATOM 428 O ASP A 28 -2.325 -7.388 -14.422 1.00 0.00 O ATOM 429 CB ASP A 28 -3.181 -10.345 -15.406 1.00 0.00 C ATOM 430 CG ASP A 28 -3.582 -9.394 -16.550 1.00 0.00 C ATOM 431 OD1 ASP A 28 -4.791 -9.108 -16.707 1.00 0.00 O ATOM 432 OD2 ASP A 28 -2.696 -8.940 -17.301 1.00 0.00 O ATOM 0 H ASP A 28 -4.600 -8.244 -14.066 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.715 -10.417 -13.313 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -2.233 -10.820 -15.660 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -3.925 -11.138 -15.330 1.00 0.00 H new ATOM 437 N PRO A 29 -0.692 -8.814 -13.689 1.00 0.00 N ATOM 438 CA PRO A 29 0.369 -7.792 -13.640 1.00 0.00 C ATOM 439 C PRO A 29 0.747 -7.252 -15.039 1.00 0.00 C ATOM 440 O PRO A 29 0.927 -8.026 -15.987 1.00 0.00 O ATOM 441 CB PRO A 29 1.560 -8.528 -12.971 1.00 0.00 C ATOM 442 CG PRO A 29 1.339 -9.970 -13.308 1.00 0.00 C ATOM 443 CD PRO A 29 -0.163 -10.158 -13.315 1.00 0.00 C ATOM 0 HA PRO A 29 0.052 -6.905 -13.091 1.00 0.00 H new ATOM 0 HB2 PRO A 29 2.515 -8.171 -13.356 1.00 0.00 H new ATOM 0 HB3 PRO A 29 1.571 -8.369 -11.893 1.00 0.00 H new ATOM 0 HG2 PRO A 29 1.770 -10.217 -14.278 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.813 -10.622 -12.574 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -0.467 -10.920 -14.032 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -0.530 -10.474 -12.339 1.00 0.00 H new ATOM 451 N VAL A 30 0.834 -5.910 -15.145 1.00 0.00 N ATOM 452 CA VAL A 30 1.348 -5.221 -16.338 1.00 0.00 C ATOM 453 C VAL A 30 2.873 -5.431 -16.450 1.00 0.00 C ATOM 454 O VAL A 30 3.407 -5.637 -17.543 1.00 0.00 O ATOM 455 CB VAL A 30 0.989 -3.682 -16.318 1.00 0.00 C ATOM 456 CG1 VAL A 30 1.569 -2.951 -15.075 1.00 0.00 C ATOM 457 CG2 VAL A 30 1.417 -2.993 -17.638 1.00 0.00 C ATOM 0 H VAL A 30 0.547 -5.275 -14.400 1.00 0.00 H new ATOM 0 HA VAL A 30 0.867 -5.652 -17.216 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.096 -3.609 -16.238 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.293 -1.897 -15.111 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.166 -3.401 -14.168 1.00 0.00 H new ATOM 0 HG13 VAL A 30 2.655 -3.042 -15.074 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.158 -1.935 -17.597 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.494 -3.098 -17.771 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.901 -3.460 -18.476 1.00 0.00 H new ATOM 467 N GLU A 31 3.548 -5.405 -15.289 1.00 0.00 N ATOM 468 CA GLU A 31 4.996 -5.615 -15.169 1.00 0.00 C ATOM 469 C GLU A 31 5.227 -6.856 -14.310 1.00 0.00 C ATOM 470 O GLU A 31 4.606 -7.006 -13.250 1.00 0.00 O ATOM 471 CB GLU A 31 5.684 -4.381 -14.515 1.00 0.00 C ATOM 472 CG GLU A 31 5.557 -3.063 -15.295 1.00 0.00 C ATOM 473 CD GLU A 31 6.179 -3.138 -16.697 1.00 0.00 C ATOM 474 OE1 GLU A 31 7.421 -3.151 -16.797 1.00 0.00 O ATOM 475 OE2 GLU A 31 5.435 -3.189 -17.699 1.00 0.00 O ATOM 0 H GLU A 31 3.092 -5.234 -14.393 1.00 0.00 H new ATOM 0 HA GLU A 31 5.429 -5.750 -16.160 1.00 0.00 H new ATOM 0 HB2 GLU A 31 5.262 -4.236 -13.520 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.743 -4.604 -14.383 1.00 0.00 H new ATOM 0 HG2 GLU A 31 4.503 -2.799 -15.384 1.00 0.00 H new ATOM 0 HG3 GLU A 31 6.039 -2.265 -14.731 1.00 0.00 H new ATOM 482 N SER A 32 6.123 -7.728 -14.766 1.00 0.00 N ATOM 483 CA SER A 32 6.416 -9.002 -14.108 1.00 0.00 C ATOM 484 C SER A 32 7.925 -9.274 -14.182 1.00 0.00 C ATOM 485 O SER A 32 8.523 -9.237 -15.265 1.00 0.00 O ATOM 486 CB SER A 32 5.596 -10.135 -14.771 1.00 0.00 C ATOM 487 OG SER A 32 5.786 -10.174 -16.181 1.00 0.00 O ATOM 0 H SER A 32 6.672 -7.570 -15.611 1.00 0.00 H new ATOM 0 HA SER A 32 6.129 -8.958 -13.057 1.00 0.00 H new ATOM 0 HB2 SER A 32 5.886 -11.093 -14.339 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.538 -9.993 -14.551 1.00 0.00 H new ATOM 0 HG SER A 32 6.685 -9.850 -16.399 1.00 0.00 H new ATOM 493 N SER A 33 8.524 -9.522 -13.015 1.00 0.00 N ATOM 494 CA SER A 33 9.974 -9.698 -12.837 1.00 0.00 C ATOM 495 C SER A 33 10.228 -10.840 -11.822 1.00 0.00 C ATOM 496 O SER A 33 9.336 -11.145 -11.020 1.00 0.00 O ATOM 497 CB SER A 33 10.583 -8.362 -12.334 1.00 0.00 C ATOM 498 OG SER A 33 10.347 -7.301 -13.249 1.00 0.00 O ATOM 0 H SER A 33 8.003 -9.609 -12.142 1.00 0.00 H new ATOM 0 HA SER A 33 10.446 -9.966 -13.782 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.154 -8.109 -11.364 1.00 0.00 H new ATOM 0 HB3 SER A 33 11.656 -8.484 -12.186 1.00 0.00 H new ATOM 0 HG SER A 33 10.128 -6.484 -12.754 1.00 0.00 H new ATOM 504 N PRO A 34 11.440 -11.499 -11.833 1.00 0.00 N ATOM 505 CA PRO A 34 11.758 -12.625 -10.910 1.00 0.00 C ATOM 506 C PRO A 34 11.695 -12.241 -9.407 1.00 0.00 C ATOM 507 O PRO A 34 11.492 -13.113 -8.564 1.00 0.00 O ATOM 508 CB PRO A 34 13.198 -13.052 -11.336 1.00 0.00 C ATOM 509 CG PRO A 34 13.756 -11.856 -12.049 1.00 0.00 C ATOM 510 CD PRO A 34 12.578 -11.235 -12.760 1.00 0.00 C ATOM 0 HA PRO A 34 11.024 -13.426 -10.993 1.00 0.00 H new ATOM 0 HB2 PRO A 34 13.805 -13.315 -10.470 1.00 0.00 H new ATOM 0 HB3 PRO A 34 13.175 -13.926 -11.987 1.00 0.00 H new ATOM 0 HG2 PRO A 34 14.207 -11.154 -11.348 1.00 0.00 H new ATOM 0 HG3 PRO A 34 14.534 -12.146 -12.755 1.00 0.00 H new ATOM 0 HD2 PRO A 34 12.724 -10.167 -12.924 1.00 0.00 H new ATOM 0 HD3 PRO A 34 12.414 -11.688 -13.738 1.00 0.00 H new ATOM 518 N THR A 35 11.875 -10.944 -9.079 1.00 0.00 N ATOM 519 CA THR A 35 11.841 -10.463 -7.677 1.00 0.00 C ATOM 520 C THR A 35 10.853 -9.286 -7.474 1.00 0.00 C ATOM 521 O THR A 35 10.858 -8.629 -6.421 1.00 0.00 O ATOM 522 CB THR A 35 13.284 -10.073 -7.189 1.00 0.00 C ATOM 523 OG1 THR A 35 13.285 -9.860 -5.764 1.00 0.00 O ATOM 524 CG2 THR A 35 13.833 -8.818 -7.906 1.00 0.00 C ATOM 0 H THR A 35 12.046 -10.209 -9.765 1.00 0.00 H new ATOM 0 HA THR A 35 11.474 -11.289 -7.067 1.00 0.00 H new ATOM 0 HB THR A 35 13.941 -10.905 -7.440 1.00 0.00 H new ATOM 0 HG1 THR A 35 13.371 -10.721 -5.305 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.832 -8.593 -7.532 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.881 -9.004 -8.979 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.174 -7.971 -7.713 1.00 0.00 H new ATOM 532 N PHE A 36 9.975 -9.039 -8.464 1.00 0.00 N ATOM 533 CA PHE A 36 9.032 -7.902 -8.414 1.00 0.00 C ATOM 534 C PHE A 36 7.805 -8.182 -9.303 1.00 0.00 C ATOM 535 O PHE A 36 7.876 -8.955 -10.253 1.00 0.00 O ATOM 536 CB PHE A 36 9.757 -6.588 -8.845 1.00 0.00 C ATOM 537 CG PHE A 36 8.924 -5.305 -8.718 1.00 0.00 C ATOM 538 CD1 PHE A 36 8.691 -4.728 -7.470 1.00 0.00 C ATOM 539 CD2 PHE A 36 8.360 -4.687 -9.843 1.00 0.00 C ATOM 540 CE1 PHE A 36 7.926 -3.581 -7.346 1.00 0.00 C ATOM 541 CE2 PHE A 36 7.601 -3.537 -9.716 1.00 0.00 C ATOM 542 CZ PHE A 36 7.383 -2.985 -8.468 1.00 0.00 C ATOM 0 H PHE A 36 9.898 -9.609 -9.307 1.00 0.00 H new ATOM 0 HA PHE A 36 8.679 -7.776 -7.391 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.659 -6.477 -8.243 1.00 0.00 H new ATOM 0 HB3 PHE A 36 10.076 -6.693 -9.882 1.00 0.00 H new ATOM 0 HD1 PHE A 36 9.114 -5.183 -6.587 1.00 0.00 H new ATOM 0 HD2 PHE A 36 8.520 -5.114 -10.822 1.00 0.00 H new ATOM 0 HE1 PHE A 36 7.753 -3.151 -6.370 1.00 0.00 H new ATOM 0 HE2 PHE A 36 7.178 -3.070 -10.593 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.789 -2.089 -8.370 1.00 0.00 H new ATOM 552 N SER A 37 6.683 -7.546 -8.964 1.00 0.00 N ATOM 553 CA SER A 37 5.433 -7.612 -9.733 1.00 0.00 C ATOM 554 C SER A 37 4.742 -6.247 -9.651 1.00 0.00 C ATOM 555 O SER A 37 5.005 -5.465 -8.727 1.00 0.00 O ATOM 556 CB SER A 37 4.512 -8.729 -9.185 1.00 0.00 C ATOM 557 OG SER A 37 3.359 -8.895 -10.000 1.00 0.00 O ATOM 0 H SER A 37 6.613 -6.959 -8.133 1.00 0.00 H new ATOM 0 HA SER A 37 5.651 -7.852 -10.774 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.064 -9.668 -9.137 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.208 -8.486 -8.167 1.00 0.00 H new ATOM 0 HG SER A 37 2.557 -8.891 -9.437 1.00 0.00 H new ATOM 563 N LEU A 38 3.871 -5.961 -10.621 1.00 0.00 N ATOM 564 CA LEU A 38 3.149 -4.685 -10.692 1.00 0.00 C ATOM 565 C LEU A 38 1.846 -4.931 -11.468 1.00 0.00 C ATOM 566 O LEU A 38 1.897 -5.260 -12.647 1.00 0.00 O ATOM 567 CB LEU A 38 4.044 -3.600 -11.371 1.00 0.00 C ATOM 568 CG LEU A 38 3.791 -2.108 -10.975 1.00 0.00 C ATOM 569 CD1 LEU A 38 4.814 -1.170 -11.658 1.00 0.00 C ATOM 570 CD2 LEU A 38 2.343 -1.657 -11.263 1.00 0.00 C ATOM 0 H LEU A 38 3.645 -6.605 -11.379 1.00 0.00 H new ATOM 0 HA LEU A 38 2.907 -4.311 -9.697 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.085 -3.835 -11.150 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.920 -3.688 -12.450 1.00 0.00 H new ATOM 0 HG LEU A 38 3.932 -2.040 -9.896 1.00 0.00 H new ATOM 0 HD11 LEU A 38 4.615 -0.139 -11.365 1.00 0.00 H new ATOM 0 HD12 LEU A 38 5.823 -1.446 -11.350 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.727 -1.263 -12.741 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.222 -0.614 -10.970 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.134 -1.761 -12.328 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.649 -2.277 -10.695 1.00 0.00 H new ATOM 582 N PHE A 39 0.704 -4.715 -10.810 1.00 0.00 N ATOM 583 CA PHE A 39 -0.645 -4.777 -11.414 1.00 0.00 C ATOM 584 C PHE A 39 -1.394 -3.462 -11.113 1.00 0.00 C ATOM 585 O PHE A 39 -1.365 -2.950 -9.993 1.00 0.00 O ATOM 586 CB PHE A 39 -1.432 -6.033 -10.907 1.00 0.00 C ATOM 587 CG PHE A 39 -1.105 -6.464 -9.472 1.00 0.00 C ATOM 588 CD1 PHE A 39 -1.812 -5.963 -8.382 1.00 0.00 C ATOM 589 CD2 PHE A 39 -0.070 -7.372 -9.218 1.00 0.00 C ATOM 590 CE1 PHE A 39 -1.498 -6.352 -7.097 1.00 0.00 C ATOM 591 CE2 PHE A 39 0.235 -7.752 -7.934 1.00 0.00 C ATOM 592 CZ PHE A 39 -0.479 -7.242 -6.874 1.00 0.00 C ATOM 0 H PHE A 39 0.683 -4.486 -9.816 1.00 0.00 H new ATOM 0 HA PHE A 39 -0.556 -4.885 -12.495 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.500 -5.826 -10.974 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.226 -6.868 -11.577 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.616 -5.261 -8.545 1.00 0.00 H new ATOM 0 HD2 PHE A 39 0.496 -7.779 -10.043 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -2.057 -5.954 -6.263 1.00 0.00 H new ATOM 0 HE2 PHE A 39 1.037 -8.453 -7.756 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.237 -7.543 -5.866 1.00 0.00 H new ATOM 602 N VAL A 40 -2.066 -2.931 -12.148 1.00 0.00 N ATOM 603 CA VAL A 40 -2.764 -1.631 -12.107 1.00 0.00 C ATOM 604 C VAL A 40 -4.270 -1.868 -12.295 1.00 0.00 C ATOM 605 O VAL A 40 -4.679 -2.501 -13.278 1.00 0.00 O ATOM 606 CB VAL A 40 -2.252 -0.661 -13.248 1.00 0.00 C ATOM 607 CG1 VAL A 40 -2.794 0.782 -13.055 1.00 0.00 C ATOM 608 CG2 VAL A 40 -0.710 -0.663 -13.339 1.00 0.00 C ATOM 0 H VAL A 40 -2.142 -3.398 -13.051 1.00 0.00 H new ATOM 0 HA VAL A 40 -2.560 -1.164 -11.143 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.643 -1.039 -14.192 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.422 1.421 -13.856 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.884 0.768 -13.078 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.457 1.172 -12.095 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.391 0.013 -14.132 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -0.289 -0.332 -12.389 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.360 -1.671 -13.560 1.00 0.00 H new ATOM 618 N LEU A 41 -5.088 -1.354 -11.366 1.00 0.00 N ATOM 619 CA LEU A 41 -6.530 -1.676 -11.303 1.00 0.00 C ATOM 620 C LEU A 41 -7.333 -0.679 -12.143 1.00 0.00 C ATOM 621 O LEU A 41 -6.926 0.478 -12.307 1.00 0.00 O ATOM 622 CB LEU A 41 -7.048 -1.703 -9.827 1.00 0.00 C ATOM 623 CG LEU A 41 -6.711 -2.993 -8.993 1.00 0.00 C ATOM 624 CD1 LEU A 41 -5.192 -3.205 -8.798 1.00 0.00 C ATOM 625 CD2 LEU A 41 -7.454 -2.979 -7.640 1.00 0.00 C ATOM 0 H LEU A 41 -4.777 -0.708 -10.640 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.670 -2.675 -11.716 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.636 -0.840 -9.304 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -8.131 -1.579 -9.842 1.00 0.00 H new ATOM 0 HG LEU A 41 -7.064 -3.845 -9.574 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -5.023 -4.110 -8.215 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.711 -3.304 -9.771 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -4.770 -2.350 -8.270 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.206 -3.880 -7.080 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -7.152 -2.102 -7.068 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.529 -2.945 -7.816 1.00 0.00 H new ATOM 637 N ALA A 42 -8.498 -1.144 -12.643 1.00 0.00 N ATOM 638 CA ALA A 42 -9.450 -0.321 -13.424 1.00 0.00 C ATOM 639 C ALA A 42 -10.084 0.795 -12.560 1.00 0.00 C ATOM 640 O ALA A 42 -10.694 1.731 -13.087 1.00 0.00 O ATOM 641 CB ALA A 42 -10.535 -1.224 -14.033 1.00 0.00 C ATOM 0 H ALA A 42 -8.808 -2.108 -12.516 1.00 0.00 H new ATOM 0 HA ALA A 42 -8.900 0.170 -14.227 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -11.234 -0.616 -14.607 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -10.070 -1.960 -14.689 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -11.071 -1.737 -13.235 1.00 0.00 H new ATOM 647 N ASN A 43 -9.923 0.668 -11.229 1.00 0.00 N ATOM 648 CA ASN A 43 -10.349 1.680 -10.238 1.00 0.00 C ATOM 649 C ASN A 43 -9.549 2.992 -10.379 1.00 0.00 C ATOM 650 O ASN A 43 -10.019 4.052 -9.952 1.00 0.00 O ATOM 651 CB ASN A 43 -10.156 1.121 -8.807 1.00 0.00 C ATOM 652 CG ASN A 43 -10.937 -0.158 -8.568 1.00 0.00 C ATOM 653 OD1 ASN A 43 -10.472 -1.249 -8.900 1.00 0.00 O ATOM 654 ND2 ASN A 43 -12.120 -0.039 -7.986 1.00 0.00 N ATOM 0 H ASN A 43 -9.488 -0.151 -10.804 1.00 0.00 H new ATOM 0 HA ASN A 43 -11.401 1.900 -10.422 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.096 0.932 -8.635 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.468 1.873 -8.082 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -12.681 -0.869 -7.797 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.470 0.883 -7.726 1.00 0.00 H new ATOM 661 N GLY A 44 -8.348 2.905 -10.981 1.00 0.00 N ATOM 662 CA GLY A 44 -7.471 4.065 -11.165 1.00 0.00 C ATOM 663 C GLY A 44 -6.274 4.074 -10.219 1.00 0.00 C ATOM 664 O GLY A 44 -5.466 5.012 -10.257 1.00 0.00 O ATOM 0 H GLY A 44 -7.965 2.034 -11.349 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -7.112 4.080 -12.194 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -8.050 4.976 -11.016 1.00 0.00 H new ATOM 668 N MET A 45 -6.153 3.036 -9.367 1.00 0.00 N ATOM 669 CA MET A 45 -5.020 2.891 -8.424 1.00 0.00 C ATOM 670 C MET A 45 -3.938 1.993 -9.042 1.00 0.00 C ATOM 671 O MET A 45 -4.172 1.345 -10.074 1.00 0.00 O ATOM 672 CB MET A 45 -5.526 2.307 -7.074 1.00 0.00 C ATOM 673 CG MET A 45 -5.926 0.809 -7.110 1.00 0.00 C ATOM 674 SD MET A 45 -4.536 -0.312 -6.827 1.00 0.00 S ATOM 675 CE MET A 45 -4.103 0.065 -5.123 1.00 0.00 C ATOM 0 H MET A 45 -6.833 2.277 -9.311 1.00 0.00 H new ATOM 0 HA MET A 45 -4.582 3.870 -8.230 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.746 2.440 -6.324 1.00 0.00 H new ATOM 0 HB3 MET A 45 -6.387 2.889 -6.745 1.00 0.00 H new ATOM 0 HG2 MET A 45 -6.690 0.626 -6.355 1.00 0.00 H new ATOM 0 HG3 MET A 45 -6.374 0.583 -8.078 1.00 0.00 H new ATOM 0 HE1 MET A 45 -3.736 -0.837 -4.633 1.00 0.00 H new ATOM 0 HE2 MET A 45 -3.326 0.829 -5.106 1.00 0.00 H new ATOM 0 HE3 MET A 45 -4.984 0.432 -4.596 1.00 0.00 H new ATOM 685 N LYS A 46 -2.772 1.942 -8.393 1.00 0.00 N ATOM 686 CA LYS A 46 -1.623 1.153 -8.862 1.00 0.00 C ATOM 687 C LYS A 46 -1.047 0.367 -7.667 1.00 0.00 C ATOM 688 O LYS A 46 -0.906 0.926 -6.570 1.00 0.00 O ATOM 689 CB LYS A 46 -0.596 2.125 -9.502 1.00 0.00 C ATOM 690 CG LYS A 46 0.505 1.470 -10.352 1.00 0.00 C ATOM 691 CD LYS A 46 1.307 2.516 -11.168 1.00 0.00 C ATOM 692 CE LYS A 46 2.355 1.880 -12.089 1.00 0.00 C ATOM 693 NZ LYS A 46 3.014 2.879 -12.963 1.00 0.00 N ATOM 0 H LYS A 46 -2.595 2.447 -7.525 1.00 0.00 H new ATOM 0 HA LYS A 46 -1.906 0.425 -9.622 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -1.137 2.835 -10.127 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.121 2.698 -8.706 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.185 0.918 -9.703 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.056 0.746 -11.032 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.616 3.109 -11.767 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.803 3.202 -10.481 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.109 1.376 -11.485 1.00 0.00 H new ATOM 0 HE3 LYS A 46 1.879 1.118 -12.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.503 2.391 -13.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 2.298 3.524 -13.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 3.704 3.424 -12.408 1.00 0.00 H new ATOM 707 N LEU A 47 -0.724 -0.924 -7.876 1.00 0.00 N ATOM 708 CA LEU A 47 -0.351 -1.850 -6.777 1.00 0.00 C ATOM 709 C LEU A 47 0.859 -2.722 -7.205 1.00 0.00 C ATOM 710 O LEU A 47 0.813 -3.383 -8.236 1.00 0.00 O ATOM 711 CB LEU A 47 -1.600 -2.723 -6.397 1.00 0.00 C ATOM 712 CG LEU A 47 -1.798 -3.101 -4.887 1.00 0.00 C ATOM 713 CD1 LEU A 47 -3.128 -3.861 -4.699 1.00 0.00 C ATOM 714 CD2 LEU A 47 -0.610 -3.906 -4.307 1.00 0.00 C ATOM 0 H LEU A 47 -0.713 -1.356 -8.800 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.047 -1.287 -5.895 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.493 -2.193 -6.729 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -1.548 -3.649 -6.970 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.837 -2.168 -4.324 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.255 -4.118 -3.647 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.956 -3.230 -5.021 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.114 -4.773 -5.296 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -0.805 -4.138 -3.260 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -0.490 -4.833 -4.868 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.302 -3.315 -4.384 1.00 0.00 H new ATOM 726 N GLY A 48 1.940 -2.682 -6.407 1.00 0.00 N ATOM 727 CA GLY A 48 3.136 -3.508 -6.629 1.00 0.00 C ATOM 728 C GLY A 48 3.211 -4.660 -5.636 1.00 0.00 C ATOM 729 O GLY A 48 2.519 -4.658 -4.614 1.00 0.00 O ATOM 0 H GLY A 48 2.008 -2.075 -5.590 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.124 -3.902 -7.645 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.029 -2.889 -6.538 1.00 0.00 H new ATOM 733 N LEU A 49 4.119 -5.611 -5.915 1.00 0.00 N ATOM 734 CA LEU A 49 4.624 -6.591 -4.937 1.00 0.00 C ATOM 735 C LEU A 49 6.149 -6.629 -5.081 1.00 0.00 C ATOM 736 O LEU A 49 6.657 -7.071 -6.114 1.00 0.00 O ATOM 737 CB LEU A 49 4.036 -8.013 -5.171 1.00 0.00 C ATOM 738 CG LEU A 49 2.494 -8.169 -5.006 1.00 0.00 C ATOM 739 CD1 LEU A 49 2.061 -9.621 -5.255 1.00 0.00 C ATOM 740 CD2 LEU A 49 1.997 -7.667 -3.630 1.00 0.00 C ATOM 0 H LEU A 49 4.530 -5.722 -6.842 1.00 0.00 H new ATOM 0 HA LEU A 49 4.321 -6.289 -3.935 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.304 -8.330 -6.179 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.523 -8.701 -4.480 1.00 0.00 H new ATOM 0 HG LEU A 49 2.026 -7.537 -5.760 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.981 -9.704 -5.134 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.336 -9.914 -6.268 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.558 -10.277 -4.540 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.917 -7.797 -3.564 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.480 -8.239 -2.838 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.243 -6.611 -3.517 1.00 0.00 H new ATOM 752 N TRP A 50 6.874 -6.147 -4.062 1.00 0.00 N ATOM 753 CA TRP A 50 8.347 -6.142 -4.065 1.00 0.00 C ATOM 754 C TRP A 50 8.817 -7.272 -3.147 1.00 0.00 C ATOM 755 O TRP A 50 8.416 -7.329 -1.988 1.00 0.00 O ATOM 756 CB TRP A 50 8.897 -4.764 -3.587 1.00 0.00 C ATOM 757 CG TRP A 50 10.376 -4.527 -3.857 1.00 0.00 C ATOM 758 CD1 TRP A 50 11.431 -5.298 -3.451 1.00 0.00 C ATOM 759 CD2 TRP A 50 10.957 -3.428 -4.579 1.00 0.00 C ATOM 760 NE1 TRP A 50 12.607 -4.763 -3.889 1.00 0.00 N ATOM 761 CE2 TRP A 50 12.353 -3.609 -4.569 1.00 0.00 C ATOM 762 CE3 TRP A 50 10.427 -2.320 -5.241 1.00 0.00 C ATOM 763 CZ2 TRP A 50 13.232 -2.710 -5.176 1.00 0.00 C ATOM 764 CZ3 TRP A 50 11.291 -1.432 -5.849 1.00 0.00 C ATOM 765 CH2 TRP A 50 12.679 -1.632 -5.814 1.00 0.00 C ATOM 0 H TRP A 50 6.461 -5.752 -3.217 1.00 0.00 H new ATOM 0 HA TRP A 50 8.725 -6.300 -5.075 1.00 0.00 H new ATOM 0 HB2 TRP A 50 8.324 -3.974 -4.073 1.00 0.00 H new ATOM 0 HB3 TRP A 50 8.721 -4.672 -2.515 1.00 0.00 H new ATOM 0 HD1 TRP A 50 11.345 -6.202 -2.867 1.00 0.00 H new ATOM 0 HE1 TRP A 50 13.532 -5.164 -3.732 1.00 0.00 H new ATOM 0 HE3 TRP A 50 9.360 -2.160 -5.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 14.301 -2.858 -5.144 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 10.892 -0.569 -6.360 1.00 0.00 H new ATOM 0 HH2 TRP A 50 13.327 -0.919 -6.302 1.00 0.00 H new ATOM 776 N SER A 51 9.655 -8.172 -3.673 1.00 0.00 N ATOM 777 CA SER A 51 10.165 -9.300 -2.900 1.00 0.00 C ATOM 778 C SER A 51 11.329 -8.826 -2.005 1.00 0.00 C ATOM 779 O SER A 51 12.425 -8.516 -2.493 1.00 0.00 O ATOM 780 CB SER A 51 10.574 -10.443 -3.835 1.00 0.00 C ATOM 781 OG SER A 51 9.490 -10.808 -4.673 1.00 0.00 O ATOM 0 H SER A 51 9.993 -8.137 -4.635 1.00 0.00 H new ATOM 0 HA SER A 51 9.383 -9.689 -2.248 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.425 -10.137 -4.443 1.00 0.00 H new ATOM 0 HB3 SER A 51 10.895 -11.304 -3.249 1.00 0.00 H new ATOM 0 HG SER A 51 8.980 -11.531 -4.252 1.00 0.00 H new ATOM 787 N ARG A 52 11.058 -8.789 -0.687 1.00 0.00 N ATOM 788 CA ARG A 52 11.911 -8.130 0.323 1.00 0.00 C ATOM 789 C ARG A 52 13.274 -8.823 0.528 1.00 0.00 C ATOM 790 O ARG A 52 14.150 -8.253 1.181 1.00 0.00 O ATOM 791 CB ARG A 52 11.144 -8.055 1.669 1.00 0.00 C ATOM 792 CG ARG A 52 10.851 -9.434 2.308 1.00 0.00 C ATOM 793 CD ARG A 52 10.104 -9.332 3.649 1.00 0.00 C ATOM 794 NE ARG A 52 9.920 -10.661 4.260 1.00 0.00 N ATOM 795 CZ ARG A 52 8.791 -11.377 4.211 1.00 0.00 C ATOM 796 NH1 ARG A 52 7.723 -10.905 3.595 1.00 0.00 N ATOM 797 NH2 ARG A 52 8.754 -12.578 4.756 1.00 0.00 N ATOM 0 H ARG A 52 10.227 -9.223 -0.286 1.00 0.00 H new ATOM 0 HA ARG A 52 12.133 -7.131 -0.051 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.724 -7.457 2.372 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.201 -7.533 1.509 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.259 -10.031 1.614 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.791 -9.963 2.462 1.00 0.00 H new ATOM 0 HD2 ARG A 52 10.661 -8.690 4.331 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.132 -8.863 3.492 1.00 0.00 H new ATOM 0 HE ARG A 52 10.713 -11.065 4.758 1.00 0.00 H new ATOM 0 HH11 ARG A 52 7.754 -9.987 3.151 1.00 0.00 H new ATOM 0 HH12 ARG A 52 6.867 -11.458 3.563 1.00 0.00 H new ATOM 0 HH21 ARG A 52 9.584 -12.957 5.212 1.00 0.00 H new ATOM 0 HH22 ARG A 52 7.895 -13.128 4.721 1.00 0.00 H new ATOM 811 N HIS A 53 13.447 -10.044 -0.031 1.00 0.00 N ATOM 812 CA HIS A 53 14.723 -10.799 0.057 1.00 0.00 C ATOM 813 C HIS A 53 15.859 -10.077 -0.712 1.00 0.00 C ATOM 814 O HIS A 53 17.034 -10.376 -0.506 1.00 0.00 O ATOM 815 CB HIS A 53 14.559 -12.261 -0.443 1.00 0.00 C ATOM 816 CG HIS A 53 14.335 -12.417 -1.926 1.00 0.00 C ATOM 817 ND1 HIS A 53 15.364 -12.600 -2.824 1.00 0.00 N ATOM 818 CD2 HIS A 53 13.202 -12.402 -2.665 1.00 0.00 C ATOM 819 CE1 HIS A 53 14.874 -12.691 -4.043 1.00 0.00 C ATOM 820 NE2 HIS A 53 13.565 -12.575 -3.975 1.00 0.00 N ATOM 0 H HIS A 53 12.716 -10.530 -0.550 1.00 0.00 H new ATOM 0 HA HIS A 53 15.001 -10.839 1.110 1.00 0.00 H new ATOM 0 HB2 HIS A 53 15.451 -12.824 -0.166 1.00 0.00 H new ATOM 0 HB3 HIS A 53 13.720 -12.715 0.084 1.00 0.00 H new ATOM 0 HD2 HIS A 53 12.196 -12.277 -2.291 1.00 0.00 H new ATOM 0 HE1 HIS A 53 15.449 -12.836 -4.946 1.00 0.00 H new ATOM 0 HE2 HIS A 53 12.925 -12.608 -4.768 1.00 0.00 H new ATOM 829 N THR A 54 15.482 -9.147 -1.613 1.00 0.00 N ATOM 830 CA THR A 54 16.415 -8.199 -2.246 1.00 0.00 C ATOM 831 C THR A 54 15.675 -6.870 -2.528 1.00 0.00 C ATOM 832 O THR A 54 15.205 -6.582 -3.639 1.00 0.00 O ATOM 833 CB THR A 54 17.121 -8.797 -3.522 1.00 0.00 C ATOM 834 OG1 THR A 54 17.998 -7.831 -4.129 1.00 0.00 O ATOM 835 CG2 THR A 54 16.134 -9.328 -4.570 1.00 0.00 C ATOM 0 H THR A 54 14.516 -9.034 -1.922 1.00 0.00 H new ATOM 0 HA THR A 54 17.232 -7.997 -1.554 1.00 0.00 H new ATOM 0 HB THR A 54 17.702 -9.647 -3.166 1.00 0.00 H new ATOM 0 HG1 THR A 54 18.425 -8.227 -4.917 1.00 0.00 H new ATOM 0 HG21 THR A 54 16.686 -9.725 -5.422 1.00 0.00 H new ATOM 0 HG22 THR A 54 15.527 -10.119 -4.130 1.00 0.00 H new ATOM 0 HG23 THR A 54 15.486 -8.517 -4.904 1.00 0.00 H new ATOM 843 N VAL A 55 15.493 -6.095 -1.451 1.00 0.00 N ATOM 844 CA VAL A 55 14.928 -4.737 -1.508 1.00 0.00 C ATOM 845 C VAL A 55 15.992 -3.708 -1.106 1.00 0.00 C ATOM 846 O VAL A 55 16.953 -4.039 -0.416 1.00 0.00 O ATOM 847 CB VAL A 55 13.648 -4.583 -0.601 1.00 0.00 C ATOM 848 CG1 VAL A 55 13.941 -4.925 0.872 1.00 0.00 C ATOM 849 CG2 VAL A 55 13.031 -3.168 -0.760 1.00 0.00 C ATOM 0 H VAL A 55 15.735 -6.394 -0.506 1.00 0.00 H new ATOM 0 HA VAL A 55 14.616 -4.556 -2.537 1.00 0.00 H new ATOM 0 HB VAL A 55 12.908 -5.307 -0.942 1.00 0.00 H new ATOM 0 HG11 VAL A 55 13.032 -4.805 1.461 1.00 0.00 H new ATOM 0 HG12 VAL A 55 14.287 -5.956 0.944 1.00 0.00 H new ATOM 0 HG13 VAL A 55 14.712 -4.256 1.255 1.00 0.00 H new ATOM 0 HG21 VAL A 55 12.149 -3.082 -0.126 1.00 0.00 H new ATOM 0 HG22 VAL A 55 13.764 -2.416 -0.466 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.747 -3.010 -1.800 1.00 0.00 H new ATOM 859 N GLU A 56 15.852 -2.484 -1.625 1.00 0.00 N ATOM 860 CA GLU A 56 16.642 -1.323 -1.202 1.00 0.00 C ATOM 861 C GLU A 56 15.720 -0.278 -0.523 1.00 0.00 C ATOM 862 O GLU A 56 14.878 0.305 -1.201 1.00 0.00 O ATOM 863 CB GLU A 56 17.383 -0.742 -2.423 1.00 0.00 C ATOM 864 CG GLU A 56 18.604 -1.582 -2.847 1.00 0.00 C ATOM 865 CD GLU A 56 19.474 -0.920 -3.922 1.00 0.00 C ATOM 866 OE1 GLU A 56 19.942 0.222 -3.694 1.00 0.00 O ATOM 867 OE2 GLU A 56 19.732 -1.546 -4.976 1.00 0.00 O ATOM 0 H GLU A 56 15.178 -2.269 -2.360 1.00 0.00 H new ATOM 0 HA GLU A 56 17.390 -1.620 -0.466 1.00 0.00 H new ATOM 0 HB2 GLU A 56 16.690 -0.671 -3.261 1.00 0.00 H new ATOM 0 HB3 GLU A 56 17.710 0.272 -2.193 1.00 0.00 H new ATOM 0 HG2 GLU A 56 19.218 -1.780 -1.969 1.00 0.00 H new ATOM 0 HG3 GLU A 56 18.257 -2.547 -3.218 1.00 0.00 H new ATOM 874 N PRO A 57 15.842 -0.019 0.828 1.00 0.00 N ATOM 875 CA PRO A 57 16.845 -0.656 1.726 1.00 0.00 C ATOM 876 C PRO A 57 16.422 -2.077 2.169 1.00 0.00 C ATOM 877 O PRO A 57 15.226 -2.336 2.369 1.00 0.00 O ATOM 878 CB PRO A 57 16.890 0.322 2.925 1.00 0.00 C ATOM 879 CG PRO A 57 15.488 0.856 3.020 1.00 0.00 C ATOM 880 CD PRO A 57 14.986 0.944 1.584 1.00 0.00 C ATOM 0 HA PRO A 57 17.811 -0.805 1.244 1.00 0.00 H new ATOM 0 HB2 PRO A 57 17.185 -0.187 3.843 1.00 0.00 H new ATOM 0 HB3 PRO A 57 17.611 1.123 2.759 1.00 0.00 H new ATOM 0 HG2 PRO A 57 14.857 0.197 3.616 1.00 0.00 H new ATOM 0 HG3 PRO A 57 15.473 1.834 3.501 1.00 0.00 H new ATOM 0 HD2 PRO A 57 13.932 0.676 1.515 1.00 0.00 H new ATOM 0 HD3 PRO A 57 15.084 1.956 1.191 1.00 0.00 H new ATOM 888 N LYS A 58 17.418 -2.989 2.254 1.00 0.00 N ATOM 889 CA LYS A 58 17.234 -4.375 2.746 1.00 0.00 C ATOM 890 C LYS A 58 16.472 -4.410 4.085 1.00 0.00 C ATOM 891 O LYS A 58 16.974 -3.976 5.127 1.00 0.00 O ATOM 892 CB LYS A 58 18.614 -5.097 2.850 1.00 0.00 C ATOM 893 CG LYS A 58 19.157 -5.631 1.495 1.00 0.00 C ATOM 894 CD LYS A 58 18.554 -7.006 1.091 1.00 0.00 C ATOM 895 CE LYS A 58 19.069 -8.151 1.989 1.00 0.00 C ATOM 896 NZ LYS A 58 18.521 -9.473 1.600 1.00 0.00 N ATOM 0 H LYS A 58 18.379 -2.783 1.981 1.00 0.00 H new ATOM 0 HA LYS A 58 16.620 -4.913 2.024 1.00 0.00 H new ATOM 0 HB2 LYS A 58 19.342 -4.405 3.273 1.00 0.00 H new ATOM 0 HB3 LYS A 58 18.524 -5.931 3.546 1.00 0.00 H new ATOM 0 HG2 LYS A 58 18.941 -4.903 0.713 1.00 0.00 H new ATOM 0 HG3 LYS A 58 20.242 -5.721 1.556 1.00 0.00 H new ATOM 0 HD2 LYS A 58 17.467 -6.957 1.154 1.00 0.00 H new ATOM 0 HD3 LYS A 58 18.804 -7.220 0.052 1.00 0.00 H new ATOM 0 HE2 LYS A 58 20.157 -8.185 1.940 1.00 0.00 H new ATOM 0 HE3 LYS A 58 18.803 -7.942 3.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 17.920 -9.839 2.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 17.955 -9.373 0.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 19.303 -10.136 1.428 1.00 0.00 H new ATOM 910 N ALA A 59 15.244 -4.927 4.003 1.00 0.00 N ATOM 911 CA ALA A 59 14.298 -4.974 5.110 1.00 0.00 C ATOM 912 C ALA A 59 13.471 -6.257 4.976 1.00 0.00 C ATOM 913 O ALA A 59 12.627 -6.362 4.079 1.00 0.00 O ATOM 914 CB ALA A 59 13.391 -3.721 5.081 1.00 0.00 C ATOM 0 H ALA A 59 14.875 -5.333 3.143 1.00 0.00 H new ATOM 0 HA ALA A 59 14.824 -4.979 6.065 1.00 0.00 H new ATOM 0 HB1 ALA A 59 12.686 -3.763 5.911 1.00 0.00 H new ATOM 0 HB2 ALA A 59 14.005 -2.825 5.171 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.842 -3.691 4.140 1.00 0.00 H new ATOM 920 N SER A 60 13.735 -7.240 5.849 1.00 0.00 N ATOM 921 CA SER A 60 13.001 -8.511 5.861 1.00 0.00 C ATOM 922 C SER A 60 12.186 -8.620 7.157 1.00 0.00 C ATOM 923 O SER A 60 12.648 -9.161 8.164 1.00 0.00 O ATOM 924 CB SER A 60 13.987 -9.693 5.677 1.00 0.00 C ATOM 925 OG SER A 60 15.071 -9.606 6.584 1.00 0.00 O ATOM 0 H SER A 60 14.460 -7.176 6.563 1.00 0.00 H new ATOM 0 HA SER A 60 12.299 -8.549 5.028 1.00 0.00 H new ATOM 0 HB2 SER A 60 13.460 -10.635 5.826 1.00 0.00 H new ATOM 0 HB3 SER A 60 14.365 -9.698 4.655 1.00 0.00 H new ATOM 0 HG SER A 60 14.730 -9.421 7.484 1.00 0.00 H new ATOM 931 N VAL A 61 10.977 -8.037 7.111 1.00 0.00 N ATOM 932 CA VAL A 61 9.987 -8.100 8.198 1.00 0.00 C ATOM 933 C VAL A 61 8.604 -7.705 7.641 1.00 0.00 C ATOM 934 O VAL A 61 8.484 -6.699 6.934 1.00 0.00 O ATOM 935 CB VAL A 61 10.387 -7.188 9.437 1.00 0.00 C ATOM 936 CG1 VAL A 61 10.605 -5.710 9.034 1.00 0.00 C ATOM 937 CG2 VAL A 61 9.360 -7.311 10.592 1.00 0.00 C ATOM 0 H VAL A 61 10.655 -7.501 6.305 1.00 0.00 H new ATOM 0 HA VAL A 61 9.955 -9.123 8.573 1.00 0.00 H new ATOM 0 HB VAL A 61 11.344 -7.562 9.802 1.00 0.00 H new ATOM 0 HG11 VAL A 61 10.876 -5.129 9.915 1.00 0.00 H new ATOM 0 HG12 VAL A 61 11.406 -5.648 8.298 1.00 0.00 H new ATOM 0 HG13 VAL A 61 9.686 -5.311 8.605 1.00 0.00 H new ATOM 0 HG21 VAL A 61 9.667 -6.673 11.421 1.00 0.00 H new ATOM 0 HG22 VAL A 61 8.377 -7.000 10.239 1.00 0.00 H new ATOM 0 HG23 VAL A 61 9.313 -8.347 10.929 1.00 0.00 H new ATOM 947 N THR A 62 7.592 -8.548 7.904 1.00 0.00 N ATOM 948 CA THR A 62 6.166 -8.254 7.628 1.00 0.00 C ATOM 949 C THR A 62 5.300 -8.878 8.741 1.00 0.00 C ATOM 950 O THR A 62 5.730 -9.823 9.418 1.00 0.00 O ATOM 951 CB THR A 62 5.687 -8.793 6.225 1.00 0.00 C ATOM 952 OG1 THR A 62 6.050 -10.169 6.076 1.00 0.00 O ATOM 953 CG2 THR A 62 6.247 -7.983 5.036 1.00 0.00 C ATOM 0 H THR A 62 7.738 -9.468 8.320 1.00 0.00 H new ATOM 0 HA THR A 62 6.055 -7.170 7.607 1.00 0.00 H new ATOM 0 HB THR A 62 4.603 -8.681 6.207 1.00 0.00 H new ATOM 0 HG1 THR A 62 5.243 -10.707 5.934 1.00 0.00 H new ATOM 0 HG21 THR A 62 5.879 -8.407 4.102 1.00 0.00 H new ATOM 0 HG22 THR A 62 5.922 -6.946 5.117 1.00 0.00 H new ATOM 0 HG23 THR A 62 7.336 -8.024 5.049 1.00 0.00 H new ATOM 961 N GLY A 63 4.088 -8.336 8.925 1.00 0.00 N ATOM 962 CA GLY A 63 3.156 -8.799 9.959 1.00 0.00 C ATOM 963 C GLY A 63 2.190 -7.698 10.342 1.00 0.00 C ATOM 964 O GLY A 63 0.990 -7.922 10.502 1.00 0.00 O ATOM 0 H GLY A 63 3.728 -7.566 8.362 1.00 0.00 H new ATOM 0 HA2 GLY A 63 2.602 -9.665 9.595 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.713 -9.123 10.838 1.00 0.00 H new ATOM 968 N GLY A 64 2.741 -6.491 10.489 1.00 0.00 N ATOM 969 CA GLY A 64 1.968 -5.279 10.737 1.00 0.00 C ATOM 970 C GLY A 64 2.618 -4.081 10.071 1.00 0.00 C ATOM 971 O GLY A 64 3.849 -4.038 9.933 1.00 0.00 O ATOM 0 H GLY A 64 3.747 -6.329 10.438 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.954 -5.405 10.359 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.889 -5.106 11.810 1.00 0.00 H new ATOM 975 N GLY A 65 1.798 -3.102 9.677 1.00 0.00 N ATOM 976 CA GLY A 65 2.263 -1.949 8.910 1.00 0.00 C ATOM 977 C GLY A 65 1.898 -2.099 7.445 1.00 0.00 C ATOM 978 O GLY A 65 2.273 -3.095 6.822 1.00 0.00 O ATOM 0 H GLY A 65 0.799 -3.089 9.881 1.00 0.00 H new ATOM 0 HA2 GLY A 65 1.819 -1.037 9.309 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.344 -1.849 9.013 1.00 0.00 H new ATOM 982 N GLY A 66 1.121 -1.133 6.916 1.00 0.00 N ATOM 983 CA GLY A 66 0.741 -1.120 5.509 1.00 0.00 C ATOM 984 C GLY A 66 -0.335 -2.147 5.184 1.00 0.00 C ATOM 985 O GLY A 66 -0.030 -3.301 4.841 1.00 0.00 O ATOM 0 H GLY A 66 0.748 -0.352 7.455 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.382 -0.126 5.243 1.00 0.00 H new ATOM 0 HA3 GLY A 66 1.621 -1.315 4.897 1.00 0.00 H new ATOM 989 N GLU A 67 -1.598 -1.726 5.301 1.00 0.00 N ATOM 990 CA GLU A 67 -2.759 -2.567 4.991 1.00 0.00 C ATOM 991 C GLU A 67 -3.335 -2.179 3.626 1.00 0.00 C ATOM 992 O GLU A 67 -3.051 -1.098 3.087 1.00 0.00 O ATOM 993 CB GLU A 67 -3.854 -2.444 6.088 1.00 0.00 C ATOM 994 CG GLU A 67 -4.306 -1.016 6.395 1.00 0.00 C ATOM 995 CD GLU A 67 -5.732 -0.912 6.958 1.00 0.00 C ATOM 996 OE1 GLU A 67 -6.686 -0.905 6.148 1.00 0.00 O ATOM 997 OE2 GLU A 67 -5.911 -0.810 8.193 1.00 0.00 O ATOM 0 H GLU A 67 -1.845 -0.788 5.615 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.428 -3.605 4.962 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.723 -3.025 5.779 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.479 -2.895 7.006 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -3.612 -0.573 7.110 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.244 -0.423 5.482 1.00 0.00 H new ATOM 1004 N LEU A 68 -4.174 -3.065 3.088 1.00 0.00 N ATOM 1005 CA LEU A 68 -4.765 -2.918 1.768 1.00 0.00 C ATOM 1006 C LEU A 68 -6.289 -2.905 1.932 1.00 0.00 C ATOM 1007 O LEU A 68 -6.877 -3.964 2.158 1.00 0.00 O ATOM 1008 CB LEU A 68 -4.284 -4.074 0.849 1.00 0.00 C ATOM 1009 CG LEU A 68 -4.689 -3.961 -0.652 1.00 0.00 C ATOM 1010 CD1 LEU A 68 -4.140 -2.663 -1.292 1.00 0.00 C ATOM 1011 CD2 LEU A 68 -4.259 -5.218 -1.441 1.00 0.00 C ATOM 0 H LEU A 68 -4.463 -3.917 3.569 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.455 -1.985 1.296 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.197 -4.132 0.909 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.676 -5.012 1.242 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.776 -3.903 -0.699 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.442 -2.618 -2.338 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.539 -1.799 -0.761 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.052 -2.657 -1.227 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.554 -5.111 -2.485 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -3.177 -5.333 -1.380 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.742 -6.098 -1.015 1.00 0.00 H new ATOM 1023 N ALA A 69 -6.918 -1.730 1.882 1.00 0.00 N ATOM 1024 CA ALA A 69 -8.344 -1.582 2.235 1.00 0.00 C ATOM 1025 C ALA A 69 -9.253 -1.810 1.000 1.00 0.00 C ATOM 1026 O ALA A 69 -9.290 -0.993 0.075 1.00 0.00 O ATOM 1027 CB ALA A 69 -8.581 -0.206 2.883 1.00 0.00 C ATOM 0 H ALA A 69 -6.467 -0.860 1.600 1.00 0.00 H new ATOM 0 HA ALA A 69 -8.611 -2.348 2.963 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.635 -0.102 3.141 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.976 -0.120 3.785 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.300 0.580 2.182 1.00 0.00 H new ATOM 1033 N PHE A 70 -9.970 -2.951 1.002 1.00 0.00 N ATOM 1034 CA PHE A 70 -10.922 -3.358 -0.043 1.00 0.00 C ATOM 1035 C PHE A 70 -12.299 -2.747 0.265 1.00 0.00 C ATOM 1036 O PHE A 70 -12.900 -3.049 1.304 1.00 0.00 O ATOM 1037 CB PHE A 70 -11.053 -4.909 -0.055 1.00 0.00 C ATOM 1038 CG PHE A 70 -9.803 -5.687 -0.452 1.00 0.00 C ATOM 1039 CD1 PHE A 70 -8.680 -5.705 0.371 1.00 0.00 C ATOM 1040 CD2 PHE A 70 -9.757 -6.413 -1.639 1.00 0.00 C ATOM 1041 CE1 PHE A 70 -7.552 -6.414 0.018 1.00 0.00 C ATOM 1042 CE2 PHE A 70 -8.632 -7.122 -1.990 1.00 0.00 C ATOM 1043 CZ PHE A 70 -7.526 -7.122 -1.163 1.00 0.00 C ATOM 0 H PHE A 70 -9.898 -3.634 1.756 1.00 0.00 H new ATOM 0 HA PHE A 70 -10.565 -3.012 -1.013 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -11.358 -5.235 0.939 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -11.857 -5.180 -0.740 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -8.693 -5.155 1.300 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -10.616 -6.420 -2.293 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -6.689 -6.414 0.667 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -8.613 -7.680 -2.914 1.00 0.00 H new ATOM 0 HZ PHE A 70 -6.642 -7.676 -1.442 1.00 0.00 H new ATOM 1053 N ARG A 71 -12.774 -1.868 -0.622 1.00 0.00 N ATOM 1054 CA ARG A 71 -14.074 -1.200 -0.464 1.00 0.00 C ATOM 1055 C ARG A 71 -15.192 -1.921 -1.236 1.00 0.00 C ATOM 1056 O ARG A 71 -15.066 -2.209 -2.430 1.00 0.00 O ATOM 1057 CB ARG A 71 -13.983 0.261 -0.956 1.00 0.00 C ATOM 1058 CG ARG A 71 -12.930 1.133 -0.215 1.00 0.00 C ATOM 1059 CD ARG A 71 -13.494 2.510 0.173 1.00 0.00 C ATOM 1060 NE ARG A 71 -13.981 3.266 -0.992 1.00 0.00 N ATOM 1061 CZ ARG A 71 -13.210 3.762 -1.960 1.00 0.00 C ATOM 1062 NH1 ARG A 71 -11.894 3.658 -1.894 1.00 0.00 N ATOM 1063 NH2 ARG A 71 -13.765 4.365 -2.999 1.00 0.00 N ATOM 0 H ARG A 71 -12.272 -1.598 -1.468 1.00 0.00 H new ATOM 0 HA ARG A 71 -14.321 -1.226 0.597 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -13.747 0.257 -2.020 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.962 0.728 -0.848 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -12.595 0.613 0.682 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -12.056 1.266 -0.852 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -14.310 2.378 0.884 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -12.720 3.087 0.679 1.00 0.00 H new ATOM 0 HE ARG A 71 -14.986 3.423 -1.064 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -11.458 3.194 -1.097 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -11.314 4.041 -2.640 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -14.780 4.449 -3.058 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -13.178 4.746 -3.741 1.00 0.00 H new ATOM 1077 N VAL A 72 -16.272 -2.229 -0.497 1.00 0.00 N ATOM 1078 CA VAL A 72 -17.493 -2.884 -1.018 1.00 0.00 C ATOM 1079 C VAL A 72 -18.725 -1.995 -0.772 1.00 0.00 C ATOM 1080 O VAL A 72 -18.681 -1.070 0.049 1.00 0.00 O ATOM 1081 CB VAL A 72 -17.750 -4.279 -0.327 1.00 0.00 C ATOM 1082 CG1 VAL A 72 -16.632 -5.296 -0.637 1.00 0.00 C ATOM 1083 CG2 VAL A 72 -17.953 -4.127 1.202 1.00 0.00 C ATOM 0 H VAL A 72 -16.325 -2.027 0.501 1.00 0.00 H new ATOM 0 HA VAL A 72 -17.337 -3.037 -2.086 1.00 0.00 H new ATOM 0 HB VAL A 72 -18.673 -4.673 -0.751 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -16.852 -6.241 -0.140 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -16.575 -5.457 -1.714 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -15.679 -4.910 -0.276 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -18.128 -5.107 1.645 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -17.062 -3.682 1.645 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -18.813 -3.484 1.393 1.00 0.00 H new ATOM 1093 N GLU A 73 -19.810 -2.283 -1.513 1.00 0.00 N ATOM 1094 CA GLU A 73 -21.043 -1.473 -1.481 1.00 0.00 C ATOM 1095 C GLU A 73 -21.750 -1.481 -0.100 1.00 0.00 C ATOM 1096 O GLU A 73 -22.255 -0.432 0.325 1.00 0.00 O ATOM 1097 CB GLU A 73 -22.022 -1.901 -2.609 1.00 0.00 C ATOM 1098 CG GLU A 73 -22.399 -3.385 -2.625 1.00 0.00 C ATOM 1099 CD GLU A 73 -23.489 -3.727 -3.651 1.00 0.00 C ATOM 1100 OE1 GLU A 73 -23.199 -3.710 -4.865 1.00 0.00 O ATOM 1101 OE2 GLU A 73 -24.638 -4.003 -3.251 1.00 0.00 O ATOM 0 H GLU A 73 -19.858 -3.080 -2.148 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.732 -0.443 -1.658 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -22.935 -1.313 -2.517 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -21.575 -1.647 -3.570 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -21.509 -3.976 -2.841 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -22.741 -3.676 -1.632 1.00 0.00 H new ATOM 1108 N ASN A 74 -21.778 -2.642 0.605 1.00 0.00 N ATOM 1109 CA ASN A 74 -22.441 -2.743 1.935 1.00 0.00 C ATOM 1110 C ASN A 74 -22.009 -4.005 2.700 1.00 0.00 C ATOM 1111 O ASN A 74 -21.196 -4.798 2.209 1.00 0.00 O ATOM 1112 CB ASN A 74 -23.994 -2.714 1.786 1.00 0.00 C ATOM 1113 CG ASN A 74 -24.568 -3.984 1.153 1.00 0.00 C ATOM 1114 OD1 ASN A 74 -24.961 -4.921 1.851 1.00 0.00 O ATOM 1115 ND2 ASN A 74 -24.616 -4.030 -0.167 1.00 0.00 N ATOM 0 H ASN A 74 -21.355 -3.512 0.281 1.00 0.00 H new ATOM 0 HA ASN A 74 -22.123 -1.876 2.514 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -24.443 -2.572 2.769 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -24.277 -1.854 1.179 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -24.986 -4.857 -0.635 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -24.283 -3.238 -0.717 1.00 0.00 H new ATOM 1122 N ASP A 75 -22.584 -4.158 3.914 1.00 0.00 N ATOM 1123 CA ASP A 75 -22.131 -5.113 4.951 1.00 0.00 C ATOM 1124 C ASP A 75 -22.166 -6.570 4.467 1.00 0.00 C ATOM 1125 O ASP A 75 -21.360 -7.398 4.902 1.00 0.00 O ATOM 1126 CB ASP A 75 -22.987 -4.948 6.230 1.00 0.00 C ATOM 1127 CG ASP A 75 -24.458 -5.357 6.021 1.00 0.00 C ATOM 1128 OD1 ASP A 75 -25.226 -4.553 5.453 1.00 0.00 O ATOM 1129 OD2 ASP A 75 -24.848 -6.484 6.412 1.00 0.00 O ATOM 0 H ASP A 75 -23.393 -3.610 4.206 1.00 0.00 H new ATOM 0 HA ASP A 75 -21.090 -4.880 5.174 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -22.557 -5.551 7.030 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -22.946 -3.909 6.557 1.00 0.00 H new ATOM 1134 N ALA A 76 -23.143 -6.859 3.583 1.00 0.00 N ATOM 1135 CA ALA A 76 -23.357 -8.196 3.018 1.00 0.00 C ATOM 1136 C ALA A 76 -22.120 -8.637 2.232 1.00 0.00 C ATOM 1137 O ALA A 76 -21.583 -9.713 2.454 1.00 0.00 O ATOM 1138 CB ALA A 76 -24.606 -8.199 2.120 1.00 0.00 C ATOM 0 H ALA A 76 -23.807 -6.163 3.243 1.00 0.00 H new ATOM 0 HA ALA A 76 -23.519 -8.904 3.830 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -24.754 -9.197 1.706 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -25.479 -7.917 2.709 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -24.471 -7.486 1.307 1.00 0.00 H new ATOM 1144 N GLN A 77 -21.644 -7.719 1.369 1.00 0.00 N ATOM 1145 CA GLN A 77 -20.498 -7.933 0.465 1.00 0.00 C ATOM 1146 C GLN A 77 -19.170 -8.131 1.215 1.00 0.00 C ATOM 1147 O GLN A 77 -18.222 -8.681 0.656 1.00 0.00 O ATOM 1148 CB GLN A 77 -20.385 -6.744 -0.518 1.00 0.00 C ATOM 1149 CG GLN A 77 -21.562 -6.607 -1.499 1.00 0.00 C ATOM 1150 CD GLN A 77 -21.492 -7.553 -2.705 1.00 0.00 C ATOM 1151 OE1 GLN A 77 -20.406 -7.863 -3.206 1.00 0.00 O ATOM 1152 NE2 GLN A 77 -22.641 -8.028 -3.173 1.00 0.00 N ATOM 0 H GLN A 77 -22.054 -6.789 1.279 1.00 0.00 H new ATOM 0 HA GLN A 77 -20.686 -8.857 -0.082 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -20.300 -5.822 0.057 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -19.463 -6.850 -1.090 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -22.492 -6.792 -0.961 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -21.601 -5.579 -1.860 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -23.522 -7.753 -2.738 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -22.643 -8.667 -3.968 1.00 0.00 H new ATOM 1161 N VAL A 78 -19.119 -7.675 2.481 1.00 0.00 N ATOM 1162 CA VAL A 78 -17.972 -7.931 3.378 1.00 0.00 C ATOM 1163 C VAL A 78 -17.900 -9.440 3.726 1.00 0.00 C ATOM 1164 O VAL A 78 -16.830 -10.062 3.680 1.00 0.00 O ATOM 1165 CB VAL A 78 -18.075 -7.092 4.713 1.00 0.00 C ATOM 1166 CG1 VAL A 78 -16.858 -7.324 5.641 1.00 0.00 C ATOM 1167 CG2 VAL A 78 -18.248 -5.588 4.422 1.00 0.00 C ATOM 0 H VAL A 78 -19.863 -7.124 2.909 1.00 0.00 H new ATOM 0 HA VAL A 78 -17.068 -7.625 2.852 1.00 0.00 H new ATOM 0 HB VAL A 78 -18.964 -7.446 5.235 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -16.972 -6.727 6.546 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -16.799 -8.379 5.907 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -15.945 -7.029 5.124 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -18.315 -5.041 5.362 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -17.392 -5.227 3.853 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -19.159 -5.432 3.845 1.00 0.00 H new ATOM 1177 N ASP A 79 -19.095 -10.012 4.018 1.00 0.00 N ATOM 1178 CA ASP A 79 -19.282 -11.430 4.387 1.00 0.00 C ATOM 1179 C ASP A 79 -19.124 -12.343 3.161 1.00 0.00 C ATOM 1180 O ASP A 79 -18.678 -13.490 3.274 1.00 0.00 O ATOM 1181 CB ASP A 79 -20.687 -11.619 5.026 1.00 0.00 C ATOM 1182 CG ASP A 79 -20.966 -13.071 5.470 1.00 0.00 C ATOM 1183 OD1 ASP A 79 -20.408 -13.500 6.503 1.00 0.00 O ATOM 1184 OD2 ASP A 79 -21.741 -13.788 4.798 1.00 0.00 O ATOM 0 H ASP A 79 -19.969 -9.487 4.002 1.00 0.00 H new ATOM 0 HA ASP A 79 -18.516 -11.708 5.111 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -20.778 -10.959 5.889 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -21.449 -11.313 4.309 1.00 0.00 H new ATOM 1189 N GLU A 80 -19.500 -11.810 1.995 1.00 0.00 N ATOM 1190 CA GLU A 80 -19.392 -12.521 0.712 1.00 0.00 C ATOM 1191 C GLU A 80 -17.917 -12.728 0.346 1.00 0.00 C ATOM 1192 O GLU A 80 -17.499 -13.825 -0.045 1.00 0.00 O ATOM 1193 CB GLU A 80 -20.165 -11.734 -0.374 1.00 0.00 C ATOM 1194 CG GLU A 80 -21.660 -11.552 -0.013 1.00 0.00 C ATOM 1195 CD GLU A 80 -22.525 -10.937 -1.117 1.00 0.00 C ATOM 1196 OE1 GLU A 80 -22.589 -11.519 -2.218 1.00 0.00 O ATOM 1197 OE2 GLU A 80 -23.166 -9.890 -0.881 1.00 0.00 O ATOM 0 H GLU A 80 -19.889 -10.871 1.911 1.00 0.00 H new ATOM 0 HA GLU A 80 -19.841 -13.511 0.790 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -19.704 -10.756 -0.508 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -20.084 -12.258 -1.326 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -22.075 -12.524 0.253 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -21.729 -10.923 0.874 1.00 0.00 H new ATOM 1204 N THR A 81 -17.143 -11.650 0.516 1.00 0.00 N ATOM 1205 CA THR A 81 -15.695 -11.640 0.278 1.00 0.00 C ATOM 1206 C THR A 81 -14.956 -12.478 1.345 1.00 0.00 C ATOM 1207 O THR A 81 -13.938 -13.105 1.049 1.00 0.00 O ATOM 1208 CB THR A 81 -15.176 -10.172 0.259 1.00 0.00 C ATOM 1209 OG1 THR A 81 -15.956 -9.419 -0.679 1.00 0.00 O ATOM 1210 CG2 THR A 81 -13.699 -10.063 -0.141 1.00 0.00 C ATOM 0 H THR A 81 -17.509 -10.750 0.826 1.00 0.00 H new ATOM 0 HA THR A 81 -15.493 -12.094 -0.692 1.00 0.00 H new ATOM 0 HB THR A 81 -15.272 -9.783 1.273 1.00 0.00 H new ATOM 0 HG1 THR A 81 -16.816 -9.182 -0.273 1.00 0.00 H new ATOM 0 HG21 THR A 81 -13.397 -9.016 -0.136 1.00 0.00 H new ATOM 0 HG22 THR A 81 -13.088 -10.621 0.569 1.00 0.00 H new ATOM 0 HG23 THR A 81 -13.561 -10.475 -1.141 1.00 0.00 H new ATOM 1218 N PHE A 82 -15.512 -12.494 2.579 1.00 0.00 N ATOM 1219 CA PHE A 82 -15.032 -13.346 3.690 1.00 0.00 C ATOM 1220 C PHE A 82 -15.039 -14.821 3.244 1.00 0.00 C ATOM 1221 O PHE A 82 -14.009 -15.489 3.215 1.00 0.00 O ATOM 1222 CB PHE A 82 -15.939 -13.116 4.944 1.00 0.00 C ATOM 1223 CG PHE A 82 -15.607 -13.921 6.213 1.00 0.00 C ATOM 1224 CD1 PHE A 82 -16.128 -15.196 6.420 1.00 0.00 C ATOM 1225 CD2 PHE A 82 -14.803 -13.383 7.214 1.00 0.00 C ATOM 1226 CE1 PHE A 82 -15.859 -15.899 7.577 1.00 0.00 C ATOM 1227 CE2 PHE A 82 -14.528 -14.089 8.370 1.00 0.00 C ATOM 1228 CZ PHE A 82 -15.057 -15.346 8.550 1.00 0.00 C ATOM 0 H PHE A 82 -16.311 -11.912 2.832 1.00 0.00 H new ATOM 0 HA PHE A 82 -14.009 -13.082 3.959 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -15.902 -12.057 5.197 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -16.968 -13.340 4.662 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -16.754 -15.643 5.662 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -14.386 -12.395 7.085 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -16.278 -16.884 7.719 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -13.898 -13.654 9.132 1.00 0.00 H new ATOM 0 HZ PHE A 82 -14.844 -15.898 9.453 1.00 0.00 H new ATOM 1238 N ALA A 83 -16.242 -15.267 2.832 1.00 0.00 N ATOM 1239 CA ALA A 83 -16.535 -16.663 2.468 1.00 0.00 C ATOM 1240 C ALA A 83 -15.678 -17.163 1.291 1.00 0.00 C ATOM 1241 O ALA A 83 -15.117 -18.262 1.347 1.00 0.00 O ATOM 1242 CB ALA A 83 -18.030 -16.804 2.139 1.00 0.00 C ATOM 0 H ALA A 83 -17.052 -14.653 2.742 1.00 0.00 H new ATOM 0 HA ALA A 83 -16.281 -17.286 3.325 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -18.247 -17.838 1.869 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -18.622 -16.524 3.010 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -18.282 -16.151 1.304 1.00 0.00 H new ATOM 1248 N GLY A 84 -15.589 -16.331 0.242 1.00 0.00 N ATOM 1249 CA GLY A 84 -14.832 -16.665 -0.965 1.00 0.00 C ATOM 1250 C GLY A 84 -13.324 -16.798 -0.740 1.00 0.00 C ATOM 1251 O GLY A 84 -12.704 -17.753 -1.230 1.00 0.00 O ATOM 0 H GLY A 84 -16.038 -15.415 0.210 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -15.212 -17.602 -1.371 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -15.010 -15.896 -1.717 1.00 0.00 H new ATOM 1255 N TRP A 85 -12.742 -15.848 0.016 1.00 0.00 N ATOM 1256 CA TRP A 85 -11.310 -15.877 0.402 1.00 0.00 C ATOM 1257 C TRP A 85 -11.028 -17.113 1.269 1.00 0.00 C ATOM 1258 O TRP A 85 -10.002 -17.778 1.087 1.00 0.00 O ATOM 1259 CB TRP A 85 -10.947 -14.582 1.154 1.00 0.00 C ATOM 1260 CG TRP A 85 -10.855 -13.351 0.281 1.00 0.00 C ATOM 1261 CD1 TRP A 85 -11.290 -13.188 -1.013 1.00 0.00 C ATOM 1262 CD2 TRP A 85 -10.287 -12.102 0.665 1.00 0.00 C ATOM 1263 NE1 TRP A 85 -11.014 -11.917 -1.443 1.00 0.00 N ATOM 1264 CE2 TRP A 85 -10.399 -11.233 -0.431 1.00 0.00 C ATOM 1265 CE3 TRP A 85 -9.688 -11.644 1.834 1.00 0.00 C ATOM 1266 CZ2 TRP A 85 -9.936 -9.929 -0.387 1.00 0.00 C ATOM 1267 CZ3 TRP A 85 -9.229 -10.349 1.877 1.00 0.00 C ATOM 1268 CH2 TRP A 85 -9.352 -9.506 0.773 1.00 0.00 C ATOM 0 H TRP A 85 -13.246 -15.039 0.378 1.00 0.00 H new ATOM 0 HA TRP A 85 -10.692 -15.939 -0.494 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -11.693 -14.406 1.929 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -9.991 -14.726 1.658 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -11.777 -13.950 -1.603 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -11.231 -11.542 -2.366 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -9.586 -12.293 2.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -10.033 -9.271 -1.238 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -8.766 -9.979 2.780 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -8.977 -8.495 0.837 1.00 0.00 H new ATOM 1279 N LYS A 86 -11.929 -17.376 2.228 1.00 0.00 N ATOM 1280 CA LYS A 86 -11.839 -18.535 3.142 1.00 0.00 C ATOM 1281 C LYS A 86 -11.756 -19.843 2.342 1.00 0.00 C ATOM 1282 O LYS A 86 -10.893 -20.688 2.597 1.00 0.00 O ATOM 1283 CB LYS A 86 -13.057 -18.526 4.104 1.00 0.00 C ATOM 1284 CG LYS A 86 -13.345 -19.849 4.853 1.00 0.00 C ATOM 1285 CD LYS A 86 -14.467 -19.706 5.913 1.00 0.00 C ATOM 1286 CE LYS A 86 -15.704 -18.957 5.388 1.00 0.00 C ATOM 1287 NZ LYS A 86 -16.798 -18.904 6.385 1.00 0.00 N ATOM 0 H LYS A 86 -12.747 -16.790 2.396 1.00 0.00 H new ATOM 0 HA LYS A 86 -10.930 -18.463 3.739 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -12.904 -17.740 4.843 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -13.944 -18.256 3.531 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -13.628 -20.616 4.132 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -12.432 -20.192 5.340 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -14.767 -20.698 6.251 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -14.072 -19.179 6.782 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -15.420 -17.942 5.110 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -16.064 -19.446 4.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -17.394 -18.072 6.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -17.375 -19.766 6.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -16.394 -18.837 7.341 1.00 0.00 H new ATOM 1301 N ALA A 87 -12.642 -19.951 1.342 1.00 0.00 N ATOM 1302 CA ALA A 87 -12.747 -21.128 0.470 1.00 0.00 C ATOM 1303 C ALA A 87 -11.508 -21.283 -0.437 1.00 0.00 C ATOM 1304 O ALA A 87 -11.156 -22.394 -0.842 1.00 0.00 O ATOM 1305 CB ALA A 87 -14.031 -21.031 -0.371 1.00 0.00 C ATOM 0 H ALA A 87 -13.312 -19.216 1.114 1.00 0.00 H new ATOM 0 HA ALA A 87 -12.793 -22.017 1.099 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -14.109 -21.905 -1.018 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -14.897 -20.991 0.290 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -13.999 -20.129 -0.982 1.00 0.00 H new ATOM 1311 N SER A 88 -10.856 -20.144 -0.735 1.00 0.00 N ATOM 1312 CA SER A 88 -9.688 -20.077 -1.641 1.00 0.00 C ATOM 1313 C SER A 88 -8.342 -20.182 -0.884 1.00 0.00 C ATOM 1314 O SER A 88 -7.288 -20.369 -1.502 1.00 0.00 O ATOM 1315 CB SER A 88 -9.749 -18.742 -2.438 1.00 0.00 C ATOM 1316 OG SER A 88 -8.655 -18.591 -3.340 1.00 0.00 O ATOM 0 H SER A 88 -11.124 -19.237 -0.353 1.00 0.00 H new ATOM 0 HA SER A 88 -9.735 -20.931 -2.317 1.00 0.00 H new ATOM 0 HB2 SER A 88 -10.684 -18.699 -2.996 1.00 0.00 H new ATOM 0 HB3 SER A 88 -9.757 -17.906 -1.739 1.00 0.00 H new ATOM 0 HG SER A 88 -7.908 -19.152 -3.045 1.00 0.00 H new ATOM 1322 N GLY A 89 -8.401 -20.093 0.463 1.00 0.00 N ATOM 1323 CA GLY A 89 -7.250 -20.387 1.328 1.00 0.00 C ATOM 1324 C GLY A 89 -6.489 -19.149 1.793 1.00 0.00 C ATOM 1325 O GLY A 89 -5.295 -19.000 1.510 1.00 0.00 O ATOM 0 H GLY A 89 -9.241 -19.818 0.972 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -7.597 -20.937 2.203 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.564 -21.042 0.792 1.00 0.00 H new ATOM 1329 N VAL A 90 -7.196 -18.235 2.480 1.00 0.00 N ATOM 1330 CA VAL A 90 -6.577 -17.088 3.191 1.00 0.00 C ATOM 1331 C VAL A 90 -6.576 -17.378 4.716 1.00 0.00 C ATOM 1332 O VAL A 90 -7.529 -17.990 5.211 1.00 0.00 O ATOM 1333 CB VAL A 90 -7.350 -15.751 2.854 1.00 0.00 C ATOM 1334 CG1 VAL A 90 -6.696 -14.519 3.511 1.00 0.00 C ATOM 1335 CG2 VAL A 90 -7.459 -15.552 1.319 1.00 0.00 C ATOM 0 H VAL A 90 -8.212 -18.265 2.562 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.546 -16.959 2.861 1.00 0.00 H new ATOM 0 HB VAL A 90 -8.353 -15.848 3.270 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -7.262 -13.625 3.251 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -6.692 -14.644 4.594 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.671 -14.417 3.153 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -7.994 -14.626 1.109 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.460 -15.499 0.887 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -8.000 -16.391 0.881 1.00 0.00 H new ATOM 1345 N ALA A 91 -5.508 -16.952 5.445 1.00 0.00 N ATOM 1346 CA ALA A 91 -5.340 -17.229 6.903 1.00 0.00 C ATOM 1347 C ALA A 91 -6.481 -16.613 7.728 1.00 0.00 C ATOM 1348 O ALA A 91 -7.105 -17.311 8.540 1.00 0.00 O ATOM 1349 CB ALA A 91 -3.978 -16.727 7.409 1.00 0.00 C ATOM 0 H ALA A 91 -4.743 -16.410 5.043 1.00 0.00 H new ATOM 0 HA ALA A 91 -5.377 -18.311 7.034 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -3.883 -16.942 8.473 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -3.179 -17.231 6.865 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -3.904 -15.651 7.248 1.00 0.00 H new ATOM 1355 N MET A 92 -6.725 -15.299 7.521 1.00 0.00 N ATOM 1356 CA MET A 92 -7.963 -14.624 7.974 1.00 0.00 C ATOM 1357 C MET A 92 -8.103 -14.584 9.519 1.00 0.00 C ATOM 1358 O MET A 92 -8.718 -15.473 10.122 1.00 0.00 O ATOM 1359 CB MET A 92 -9.204 -15.280 7.292 1.00 0.00 C ATOM 1360 CG MET A 92 -10.563 -14.689 7.659 1.00 0.00 C ATOM 1361 SD MET A 92 -11.917 -15.556 6.834 1.00 0.00 S ATOM 1362 CE MET A 92 -11.560 -15.228 5.112 1.00 0.00 C ATOM 0 H MET A 92 -6.074 -14.680 7.038 1.00 0.00 H new ATOM 0 HA MET A 92 -7.902 -13.581 7.664 1.00 0.00 H new ATOM 0 HB2 MET A 92 -9.079 -15.209 6.212 1.00 0.00 H new ATOM 0 HB3 MET A 92 -9.212 -16.341 7.542 1.00 0.00 H new ATOM 0 HG2 MET A 92 -10.702 -14.741 8.739 1.00 0.00 H new ATOM 0 HG3 MET A 92 -10.587 -13.634 7.385 1.00 0.00 H new ATOM 0 HE1 MET A 92 -12.397 -14.694 4.662 1.00 0.00 H new ATOM 0 HE2 MET A 92 -10.659 -14.619 5.037 1.00 0.00 H new ATOM 0 HE3 MET A 92 -11.406 -16.170 4.586 1.00 0.00 H new ATOM 1372 N LEU A 93 -7.458 -13.588 10.168 1.00 0.00 N ATOM 1373 CA LEU A 93 -7.586 -13.385 11.632 1.00 0.00 C ATOM 1374 C LEU A 93 -8.245 -12.016 11.950 1.00 0.00 C ATOM 1375 O LEU A 93 -7.565 -11.021 12.233 1.00 0.00 O ATOM 1376 CB LEU A 93 -6.218 -13.600 12.403 1.00 0.00 C ATOM 1377 CG LEU A 93 -4.852 -13.282 11.683 1.00 0.00 C ATOM 1378 CD1 LEU A 93 -4.488 -14.351 10.630 1.00 0.00 C ATOM 1379 CD2 LEU A 93 -4.820 -11.861 11.081 1.00 0.00 C ATOM 0 H LEU A 93 -6.847 -12.915 9.706 1.00 0.00 H new ATOM 0 HA LEU A 93 -8.254 -14.160 12.008 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.257 -12.994 13.308 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -6.184 -14.643 12.719 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.085 -13.315 12.457 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -3.540 -14.091 10.160 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.398 -15.323 11.115 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.269 -14.395 9.871 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -3.858 -11.693 10.597 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.619 -11.759 10.346 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.961 -11.127 11.874 1.00 0.00 H new ATOM 1391 N GLN A 94 -9.594 -12.021 11.909 1.00 0.00 N ATOM 1392 CA GLN A 94 -10.474 -10.915 12.340 1.00 0.00 C ATOM 1393 C GLN A 94 -11.925 -11.313 12.074 1.00 0.00 C ATOM 1394 O GLN A 94 -12.281 -11.644 10.935 1.00 0.00 O ATOM 1395 CB GLN A 94 -10.164 -9.553 11.637 1.00 0.00 C ATOM 1396 CG GLN A 94 -11.115 -8.381 12.006 1.00 0.00 C ATOM 1397 CD GLN A 94 -11.100 -7.998 13.492 1.00 0.00 C ATOM 1398 OE1 GLN A 94 -10.081 -8.123 14.170 1.00 0.00 O ATOM 1399 NE2 GLN A 94 -12.232 -7.536 14.008 1.00 0.00 N ATOM 0 H GLN A 94 -10.119 -12.824 11.562 1.00 0.00 H new ATOM 0 HA GLN A 94 -10.293 -10.755 13.403 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -9.143 -9.261 11.882 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.202 -9.703 10.558 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -10.841 -7.507 11.415 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.132 -8.651 11.723 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -13.060 -7.444 13.420 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -12.274 -7.273 14.993 1.00 0.00 H new ATOM 1408 N GLN A 95 -12.745 -11.303 13.127 1.00 0.00 N ATOM 1409 CA GLN A 95 -14.186 -11.489 13.018 1.00 0.00 C ATOM 1410 C GLN A 95 -14.817 -10.145 12.584 1.00 0.00 C ATOM 1411 O GLN A 95 -14.630 -9.140 13.279 1.00 0.00 O ATOM 1412 CB GLN A 95 -14.748 -12.003 14.371 1.00 0.00 C ATOM 1413 CG GLN A 95 -14.118 -13.348 14.810 1.00 0.00 C ATOM 1414 CD GLN A 95 -14.674 -13.893 16.124 1.00 0.00 C ATOM 1415 OE1 GLN A 95 -14.160 -13.595 17.200 1.00 0.00 O ATOM 1416 NE2 GLN A 95 -15.719 -14.702 16.046 1.00 0.00 N ATOM 0 H GLN A 95 -12.421 -11.164 14.084 1.00 0.00 H new ATOM 0 HA GLN A 95 -14.433 -12.240 12.267 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.568 -11.254 15.142 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -15.828 -12.123 14.289 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -14.279 -14.087 14.025 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -13.040 -13.218 14.909 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -16.122 -14.929 15.137 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -16.122 -15.098 16.895 1.00 0.00 H new ATOM 1425 N PRO A 96 -15.497 -10.099 11.382 1.00 0.00 N ATOM 1426 CA PRO A 96 -16.148 -8.877 10.844 1.00 0.00 C ATOM 1427 C PRO A 96 -17.060 -8.178 11.877 1.00 0.00 C ATOM 1428 O PRO A 96 -18.160 -8.654 12.174 1.00 0.00 O ATOM 1429 CB PRO A 96 -16.956 -9.393 9.622 1.00 0.00 C ATOM 1430 CG PRO A 96 -16.233 -10.629 9.186 1.00 0.00 C ATOM 1431 CD PRO A 96 -15.655 -11.242 10.446 1.00 0.00 C ATOM 0 HA PRO A 96 -15.417 -8.113 10.579 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -17.988 -9.613 9.894 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -16.987 -8.650 8.825 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -16.911 -11.323 8.690 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -15.445 -10.389 8.472 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -16.319 -12.002 10.857 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -14.699 -11.727 10.248 1.00 0.00 H new ATOM 1439 N ALA A 97 -16.549 -7.082 12.455 1.00 0.00 N ATOM 1440 CA ALA A 97 -17.216 -6.335 13.538 1.00 0.00 C ATOM 1441 C ALA A 97 -17.724 -4.988 13.018 1.00 0.00 C ATOM 1442 O ALA A 97 -17.051 -4.339 12.210 1.00 0.00 O ATOM 1443 CB ALA A 97 -16.235 -6.133 14.705 1.00 0.00 C ATOM 0 H ALA A 97 -15.651 -6.682 12.183 1.00 0.00 H new ATOM 0 HA ALA A 97 -18.073 -6.906 13.894 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -16.729 -5.581 15.504 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.912 -7.104 15.081 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -15.368 -5.571 14.358 1.00 0.00 H new ATOM 1449 N LYS A 98 -18.915 -4.578 13.474 1.00 0.00 N ATOM 1450 CA LYS A 98 -19.491 -3.274 13.135 1.00 0.00 C ATOM 1451 C LYS A 98 -18.768 -2.186 13.957 1.00 0.00 C ATOM 1452 O LYS A 98 -19.042 -2.015 15.149 1.00 0.00 O ATOM 1453 CB LYS A 98 -21.038 -3.262 13.409 1.00 0.00 C ATOM 1454 CG LYS A 98 -21.932 -2.775 12.244 1.00 0.00 C ATOM 1455 CD LYS A 98 -21.411 -1.494 11.558 1.00 0.00 C ATOM 1456 CE LYS A 98 -22.445 -0.870 10.610 1.00 0.00 C ATOM 1457 NZ LYS A 98 -22.871 -1.801 9.528 1.00 0.00 N ATOM 0 H LYS A 98 -19.504 -5.141 14.087 1.00 0.00 H new ATOM 0 HA LYS A 98 -19.352 -3.073 12.073 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -21.346 -4.272 13.679 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -21.228 -2.628 14.275 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -22.010 -3.569 11.501 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -22.938 -2.591 12.621 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -21.135 -0.765 12.320 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -20.505 -1.728 10.999 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -23.319 -0.563 11.184 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -22.025 0.031 10.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -23.907 -1.778 9.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -22.439 -1.509 8.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -22.565 -2.767 9.761 1.00 0.00 H new ATOM 1471 N MET A 99 -17.821 -1.497 13.311 1.00 0.00 N ATOM 1472 CA MET A 99 -17.053 -0.394 13.927 1.00 0.00 C ATOM 1473 C MET A 99 -17.694 0.954 13.538 1.00 0.00 C ATOM 1474 O MET A 99 -18.479 1.011 12.588 1.00 0.00 O ATOM 1475 CB MET A 99 -15.564 -0.487 13.474 1.00 0.00 C ATOM 1476 CG MET A 99 -14.596 0.487 14.161 1.00 0.00 C ATOM 1477 SD MET A 99 -12.870 0.177 13.739 1.00 0.00 S ATOM 1478 CE MET A 99 -12.646 -1.492 14.353 1.00 0.00 C ATOM 0 H MET A 99 -17.560 -1.684 12.343 1.00 0.00 H new ATOM 0 HA MET A 99 -17.076 -0.471 15.014 1.00 0.00 H new ATOM 0 HB2 MET A 99 -15.213 -1.504 13.650 1.00 0.00 H new ATOM 0 HB3 MET A 99 -15.519 -0.316 12.398 1.00 0.00 H new ATOM 0 HG2 MET A 99 -14.856 1.508 13.880 1.00 0.00 H new ATOM 0 HG3 MET A 99 -14.720 0.412 15.241 1.00 0.00 H new ATOM 0 HE1 MET A 99 -11.802 -1.516 15.043 1.00 0.00 H new ATOM 0 HE2 MET A 99 -13.549 -1.813 14.873 1.00 0.00 H new ATOM 0 HE3 MET A 99 -12.450 -2.164 13.517 1.00 0.00 H new ATOM 1488 N GLU A 100 -17.366 2.024 14.291 1.00 0.00 N ATOM 1489 CA GLU A 100 -17.871 3.399 14.045 1.00 0.00 C ATOM 1490 C GLU A 100 -17.474 3.933 12.649 1.00 0.00 C ATOM 1491 O GLU A 100 -18.192 4.750 12.061 1.00 0.00 O ATOM 1492 CB GLU A 100 -17.349 4.334 15.167 1.00 0.00 C ATOM 1493 CG GLU A 100 -17.875 3.946 16.565 1.00 0.00 C ATOM 1494 CD GLU A 100 -17.228 4.741 17.710 1.00 0.00 C ATOM 1495 OE1 GLU A 100 -17.681 5.867 17.995 1.00 0.00 O ATOM 1496 OE2 GLU A 100 -16.265 4.240 18.332 1.00 0.00 O ATOM 0 H GLU A 100 -16.739 1.962 15.093 1.00 0.00 H new ATOM 0 HA GLU A 100 -18.961 3.373 14.061 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -16.259 4.310 15.175 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -17.644 5.360 14.945 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -18.954 4.098 16.593 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -17.699 2.883 16.728 1.00 0.00 H new ATOM 1503 N PHE A 101 -16.333 3.447 12.130 1.00 0.00 N ATOM 1504 CA PHE A 101 -15.843 3.785 10.772 1.00 0.00 C ATOM 1505 C PHE A 101 -16.621 2.987 9.701 1.00 0.00 C ATOM 1506 O PHE A 101 -16.723 3.413 8.546 1.00 0.00 O ATOM 1507 CB PHE A 101 -14.315 3.502 10.674 1.00 0.00 C ATOM 1508 CG PHE A 101 -13.509 4.182 11.784 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -13.488 5.571 11.894 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -12.815 3.436 12.742 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -12.794 6.188 12.915 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -12.127 4.057 13.766 1.00 0.00 C ATOM 1513 CZ PHE A 101 -12.118 5.433 13.852 1.00 0.00 C ATOM 0 H PHE A 101 -15.720 2.808 12.637 1.00 0.00 H new ATOM 0 HA PHE A 101 -16.012 4.846 10.589 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -14.147 2.426 10.717 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -13.949 3.843 9.706 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -14.021 6.172 11.172 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -12.817 2.358 12.680 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -12.780 7.266 12.981 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -11.597 3.466 14.498 1.00 0.00 H new ATOM 0 HZ PHE A 101 -11.582 5.920 14.653 1.00 0.00 H new ATOM 1523 N GLY A 102 -17.169 1.831 10.118 1.00 0.00 N ATOM 1524 CA GLY A 102 -17.970 0.963 9.259 1.00 0.00 C ATOM 1525 C GLY A 102 -17.834 -0.504 9.650 1.00 0.00 C ATOM 1526 O GLY A 102 -17.040 -0.841 10.536 1.00 0.00 O ATOM 0 H GLY A 102 -17.063 1.477 11.069 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -19.017 1.259 9.319 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -17.661 1.093 8.222 1.00 0.00 H new ATOM 1530 N TYR A 103 -18.601 -1.380 8.971 1.00 0.00 N ATOM 1531 CA TYR A 103 -18.564 -2.830 9.214 1.00 0.00 C ATOM 1532 C TYR A 103 -17.265 -3.389 8.613 1.00 0.00 C ATOM 1533 O TYR A 103 -17.181 -3.597 7.404 1.00 0.00 O ATOM 1534 CB TYR A 103 -19.807 -3.504 8.569 1.00 0.00 C ATOM 1535 CG TYR A 103 -19.957 -4.988 8.925 1.00 0.00 C ATOM 1536 CD1 TYR A 103 -20.249 -5.362 10.227 1.00 0.00 C ATOM 1537 CD2 TYR A 103 -19.818 -6.001 7.974 1.00 0.00 C ATOM 1538 CE1 TYR A 103 -20.401 -6.675 10.582 1.00 0.00 C ATOM 1539 CE2 TYR A 103 -19.966 -7.328 8.322 1.00 0.00 C ATOM 1540 CZ TYR A 103 -20.260 -7.660 9.629 1.00 0.00 C ATOM 1541 OH TYR A 103 -20.417 -8.980 9.988 1.00 0.00 O ATOM 0 H TYR A 103 -19.259 -1.101 8.243 1.00 0.00 H new ATOM 0 HA TYR A 103 -18.586 -3.038 10.284 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -20.704 -2.971 8.885 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -19.742 -3.404 7.486 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -20.360 -4.597 10.981 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -19.591 -5.742 6.950 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -20.630 -6.938 11.604 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -19.853 -8.101 7.577 1.00 0.00 H new ATOM 0 HH TYR A 103 -20.017 -9.129 10.870 1.00 0.00 H new ATOM 1551 N THR A 104 -16.256 -3.636 9.461 1.00 0.00 N ATOM 1552 CA THR A 104 -14.877 -3.876 9.013 1.00 0.00 C ATOM 1553 C THR A 104 -14.450 -5.328 9.264 1.00 0.00 C ATOM 1554 O THR A 104 -14.879 -5.967 10.229 1.00 0.00 O ATOM 1555 CB THR A 104 -13.876 -2.889 9.715 1.00 0.00 C ATOM 1556 OG1 THR A 104 -12.541 -3.101 9.218 1.00 0.00 O ATOM 1557 CG2 THR A 104 -13.881 -3.036 11.251 1.00 0.00 C ATOM 0 H THR A 104 -16.373 -3.675 10.474 1.00 0.00 H new ATOM 0 HA THR A 104 -14.850 -3.694 7.939 1.00 0.00 H new ATOM 0 HB THR A 104 -14.209 -1.878 9.479 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.949 -2.400 9.562 1.00 0.00 H new ATOM 0 HG21 THR A 104 -13.172 -2.331 11.686 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.880 -2.828 11.633 1.00 0.00 H new ATOM 0 HG23 THR A 104 -13.594 -4.052 11.520 1.00 0.00 H new ATOM 1565 N PHE A 105 -13.596 -5.821 8.366 1.00 0.00 N ATOM 1566 CA PHE A 105 -13.027 -7.168 8.410 1.00 0.00 C ATOM 1567 C PHE A 105 -11.579 -7.128 7.898 1.00 0.00 C ATOM 1568 O PHE A 105 -11.281 -6.351 6.988 1.00 0.00 O ATOM 1569 CB PHE A 105 -13.907 -8.136 7.552 1.00 0.00 C ATOM 1570 CG PHE A 105 -13.201 -9.391 7.021 1.00 0.00 C ATOM 1571 CD1 PHE A 105 -12.658 -10.334 7.890 1.00 0.00 C ATOM 1572 CD2 PHE A 105 -13.045 -9.598 5.647 1.00 0.00 C ATOM 1573 CE1 PHE A 105 -11.990 -11.432 7.402 1.00 0.00 C ATOM 1574 CE2 PHE A 105 -12.374 -10.697 5.164 1.00 0.00 C ATOM 1575 CZ PHE A 105 -11.847 -11.612 6.039 1.00 0.00 C ATOM 0 H PHE A 105 -13.272 -5.278 7.565 1.00 0.00 H new ATOM 0 HA PHE A 105 -13.017 -7.537 9.436 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.760 -8.450 8.154 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -14.303 -7.579 6.703 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -12.763 -10.202 8.957 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -13.459 -8.882 4.953 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -11.575 -12.157 8.087 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -12.262 -10.839 4.099 1.00 0.00 H new ATOM 0 HZ PHE A 105 -11.319 -12.475 5.662 1.00 0.00 H new ATOM 1585 N THR A 106 -10.688 -7.941 8.482 1.00 0.00 N ATOM 1586 CA THR A 106 -9.284 -8.014 8.056 1.00 0.00 C ATOM 1587 C THR A 106 -8.844 -9.482 7.909 1.00 0.00 C ATOM 1588 O THR A 106 -9.031 -10.299 8.812 1.00 0.00 O ATOM 1589 CB THR A 106 -8.351 -7.300 9.084 1.00 0.00 C ATOM 1590 OG1 THR A 106 -8.886 -6.013 9.419 1.00 0.00 O ATOM 1591 CG2 THR A 106 -6.908 -7.138 8.562 1.00 0.00 C ATOM 0 H THR A 106 -10.918 -8.562 9.258 1.00 0.00 H new ATOM 0 HA THR A 106 -9.202 -7.510 7.093 1.00 0.00 H new ATOM 0 HB THR A 106 -8.310 -7.933 9.970 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.738 -5.835 10.371 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.302 -6.636 9.316 1.00 0.00 H new ATOM 0 HG22 THR A 106 -6.485 -8.120 8.352 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.916 -6.543 7.648 1.00 0.00 H new ATOM 1599 N ALA A 107 -8.278 -9.800 6.751 1.00 0.00 N ATOM 1600 CA ALA A 107 -7.705 -11.112 6.457 1.00 0.00 C ATOM 1601 C ALA A 107 -6.176 -11.031 6.468 1.00 0.00 C ATOM 1602 O ALA A 107 -5.604 -9.941 6.608 1.00 0.00 O ATOM 1603 CB ALA A 107 -8.226 -11.619 5.110 1.00 0.00 C ATOM 0 H ALA A 107 -8.202 -9.143 5.975 1.00 0.00 H new ATOM 0 HA ALA A 107 -8.010 -11.821 7.226 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -7.795 -12.597 4.898 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -9.312 -11.702 5.148 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -7.943 -10.919 4.324 1.00 0.00 H new ATOM 1609 N ALA A 108 -5.515 -12.183 6.335 1.00 0.00 N ATOM 1610 CA ALA A 108 -4.051 -12.253 6.243 1.00 0.00 C ATOM 1611 C ALA A 108 -3.667 -13.280 5.190 1.00 0.00 C ATOM 1612 O ALA A 108 -4.086 -14.431 5.272 1.00 0.00 O ATOM 1613 CB ALA A 108 -3.434 -12.609 7.602 1.00 0.00 C ATOM 0 H ALA A 108 -5.976 -13.092 6.288 1.00 0.00 H new ATOM 0 HA ALA A 108 -3.663 -11.277 5.953 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -2.349 -12.655 7.508 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -3.703 -11.848 8.334 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.811 -13.578 7.930 1.00 0.00 H new ATOM 1619 N ASP A 109 -2.905 -12.844 4.187 1.00 0.00 N ATOM 1620 CA ASP A 109 -2.317 -13.734 3.170 1.00 0.00 C ATOM 1621 C ASP A 109 -1.162 -14.575 3.820 1.00 0.00 C ATOM 1622 O ASP A 109 -0.874 -14.381 5.011 1.00 0.00 O ATOM 1623 CB ASP A 109 -1.840 -12.858 1.966 1.00 0.00 C ATOM 1624 CG ASP A 109 -0.508 -12.130 2.172 1.00 0.00 C ATOM 1625 OD1 ASP A 109 -0.296 -11.570 3.259 1.00 0.00 O ATOM 1626 OD2 ASP A 109 0.319 -12.098 1.234 1.00 0.00 O ATOM 0 H ASP A 109 -2.674 -11.860 4.051 1.00 0.00 H new ATOM 0 HA ASP A 109 -3.047 -14.449 2.790 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -1.754 -13.495 1.086 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -2.610 -12.118 1.749 1.00 0.00 H new ATOM 1631 N PRO A 110 -0.493 -15.549 3.095 1.00 0.00 N ATOM 1632 CA PRO A 110 0.655 -16.331 3.669 1.00 0.00 C ATOM 1633 C PRO A 110 1.861 -15.454 4.115 1.00 0.00 C ATOM 1634 O PRO A 110 2.755 -15.938 4.820 1.00 0.00 O ATOM 1635 CB PRO A 110 1.053 -17.300 2.514 1.00 0.00 C ATOM 1636 CG PRO A 110 0.493 -16.663 1.280 1.00 0.00 C ATOM 1637 CD PRO A 110 -0.804 -16.026 1.715 1.00 0.00 C ATOM 0 HA PRO A 110 0.362 -16.839 4.588 1.00 0.00 H new ATOM 0 HB2 PRO A 110 2.135 -17.413 2.446 1.00 0.00 H new ATOM 0 HB3 PRO A 110 0.638 -18.296 2.670 1.00 0.00 H new ATOM 0 HG2 PRO A 110 1.180 -15.920 0.875 1.00 0.00 H new ATOM 0 HG3 PRO A 110 0.325 -17.403 0.497 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -1.091 -15.205 1.058 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -1.627 -16.741 1.710 1.00 0.00 H new ATOM 1645 N ASP A 111 1.872 -14.171 3.708 1.00 0.00 N ATOM 1646 CA ASP A 111 2.953 -13.221 4.054 1.00 0.00 C ATOM 1647 C ASP A 111 2.576 -12.345 5.276 1.00 0.00 C ATOM 1648 O ASP A 111 3.342 -11.453 5.663 1.00 0.00 O ATOM 1649 CB ASP A 111 3.273 -12.327 2.830 1.00 0.00 C ATOM 1650 CG ASP A 111 4.706 -11.798 2.849 1.00 0.00 C ATOM 1651 OD1 ASP A 111 5.624 -12.534 2.426 1.00 0.00 O ATOM 1652 OD2 ASP A 111 4.932 -10.669 3.322 1.00 0.00 O ATOM 0 H ASP A 111 1.136 -13.762 3.132 1.00 0.00 H new ATOM 0 HA ASP A 111 3.837 -13.798 4.326 1.00 0.00 H new ATOM 0 HB2 ASP A 111 3.112 -12.898 1.916 1.00 0.00 H new ATOM 0 HB3 ASP A 111 2.579 -11.486 2.807 1.00 0.00 H new ATOM 1657 N SER A 112 1.372 -12.591 5.831 1.00 0.00 N ATOM 1658 CA SER A 112 0.850 -11.981 7.079 1.00 0.00 C ATOM 1659 C SER A 112 0.605 -10.458 6.946 1.00 0.00 C ATOM 1660 O SER A 112 0.737 -9.705 7.918 1.00 0.00 O ATOM 1661 CB SER A 112 1.737 -12.339 8.322 1.00 0.00 C ATOM 1662 OG SER A 112 3.045 -11.772 8.281 1.00 0.00 O ATOM 0 H SER A 112 0.710 -13.243 5.410 1.00 0.00 H new ATOM 0 HA SER A 112 -0.130 -12.426 7.253 1.00 0.00 H new ATOM 0 HB2 SER A 112 1.232 -11.999 9.226 1.00 0.00 H new ATOM 0 HB3 SER A 112 1.824 -13.423 8.394 1.00 0.00 H new ATOM 0 HG SER A 112 3.163 -11.283 7.440 1.00 0.00 H new ATOM 1668 N HIS A 113 0.204 -10.015 5.737 1.00 0.00 N ATOM 1669 CA HIS A 113 -0.256 -8.625 5.506 1.00 0.00 C ATOM 1670 C HIS A 113 -1.675 -8.451 6.104 1.00 0.00 C ATOM 1671 O HIS A 113 -2.306 -9.423 6.539 1.00 0.00 O ATOM 1672 CB HIS A 113 -0.309 -8.267 3.991 1.00 0.00 C ATOM 1673 CG HIS A 113 0.909 -8.608 3.165 1.00 0.00 C ATOM 1674 ND1 HIS A 113 0.803 -9.120 1.894 1.00 0.00 N ATOM 1675 CD2 HIS A 113 2.235 -8.463 3.383 1.00 0.00 C ATOM 1676 CE1 HIS A 113 1.992 -9.247 1.366 1.00 0.00 C ATOM 1677 NE2 HIS A 113 2.887 -8.862 2.243 1.00 0.00 N ATOM 0 H HIS A 113 0.189 -10.600 4.901 1.00 0.00 H new ATOM 0 HA HIS A 113 0.459 -7.959 5.988 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -1.169 -8.774 3.553 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -0.490 -7.196 3.902 1.00 0.00 H new ATOM 0 HD2 HIS A 113 2.697 -8.100 4.289 1.00 0.00 H new ATOM 0 HE1 HIS A 113 2.202 -9.610 0.371 1.00 0.00 H new ATOM 0 HE2 HIS A 113 3.897 -8.859 2.102 1.00 0.00 H new ATOM 1686 N ARG A 114 -2.176 -7.208 6.103 1.00 0.00 N ATOM 1687 CA ARG A 114 -3.541 -6.891 6.560 1.00 0.00 C ATOM 1688 C ARG A 114 -4.404 -6.527 5.340 1.00 0.00 C ATOM 1689 O ARG A 114 -4.229 -5.468 4.750 1.00 0.00 O ATOM 1690 CB ARG A 114 -3.494 -5.736 7.604 1.00 0.00 C ATOM 1691 CG ARG A 114 -2.665 -6.071 8.869 1.00 0.00 C ATOM 1692 CD ARG A 114 -3.248 -7.264 9.662 1.00 0.00 C ATOM 1693 NE ARG A 114 -2.224 -7.945 10.480 1.00 0.00 N ATOM 1694 CZ ARG A 114 -1.867 -9.237 10.351 1.00 0.00 C ATOM 1695 NH1 ARG A 114 -2.416 -10.006 9.419 1.00 0.00 N ATOM 1696 NH2 ARG A 114 -0.940 -9.740 11.142 1.00 0.00 N ATOM 0 H ARG A 114 -1.650 -6.394 5.786 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.989 -7.755 7.050 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -3.075 -4.848 7.131 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -4.512 -5.487 7.903 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -1.640 -6.299 8.577 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -2.625 -5.194 9.516 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -4.051 -6.910 10.309 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -3.690 -7.979 8.967 1.00 0.00 H new ATOM 0 HE ARG A 114 -1.751 -7.395 11.197 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -3.119 -9.620 8.788 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -2.135 -10.983 9.333 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -0.497 -9.151 11.847 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -0.666 -10.718 11.049 1.00 0.00 H new ATOM 1710 N LEU A 115 -5.286 -7.449 4.925 1.00 0.00 N ATOM 1711 CA LEU A 115 -6.202 -7.239 3.788 1.00 0.00 C ATOM 1712 C LEU A 115 -7.589 -6.859 4.340 1.00 0.00 C ATOM 1713 O LEU A 115 -8.354 -7.728 4.748 1.00 0.00 O ATOM 1714 CB LEU A 115 -6.269 -8.549 2.951 1.00 0.00 C ATOM 1715 CG LEU A 115 -4.895 -9.106 2.447 1.00 0.00 C ATOM 1716 CD1 LEU A 115 -5.057 -10.495 1.788 1.00 0.00 C ATOM 1717 CD2 LEU A 115 -4.198 -8.101 1.493 1.00 0.00 C ATOM 0 H LEU A 115 -5.386 -8.363 5.367 1.00 0.00 H new ATOM 0 HA LEU A 115 -5.850 -6.434 3.143 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.753 -9.318 3.553 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.908 -8.373 2.086 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.251 -9.233 3.317 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -4.085 -10.853 1.449 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.469 -11.196 2.514 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -5.732 -10.417 0.936 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -3.247 -8.516 1.160 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.836 -7.917 0.629 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -4.021 -7.163 2.019 1.00 0.00 H new ATOM 1729 N ARG A 116 -7.914 -5.562 4.337 1.00 0.00 N ATOM 1730 CA ARG A 116 -9.076 -5.027 5.075 1.00 0.00 C ATOM 1731 C ARG A 116 -10.318 -4.820 4.185 1.00 0.00 C ATOM 1732 O ARG A 116 -10.470 -3.770 3.576 1.00 0.00 O ATOM 1733 CB ARG A 116 -8.679 -3.688 5.768 1.00 0.00 C ATOM 1734 CG ARG A 116 -8.000 -3.818 7.164 1.00 0.00 C ATOM 1735 CD ARG A 116 -8.759 -3.035 8.263 1.00 0.00 C ATOM 1736 NE ARG A 116 -8.907 -1.612 7.895 1.00 0.00 N ATOM 1737 CZ ARG A 116 -10.015 -1.027 7.392 1.00 0.00 C ATOM 1738 NH1 ARG A 116 -11.153 -1.697 7.275 1.00 0.00 N ATOM 1739 NH2 ARG A 116 -9.972 0.239 7.044 1.00 0.00 N ATOM 0 H ARG A 116 -7.386 -4.853 3.828 1.00 0.00 H new ATOM 0 HA ARG A 116 -9.354 -5.771 5.821 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -8.004 -3.146 5.106 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -9.576 -3.078 5.877 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -7.946 -4.870 7.443 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -6.975 -3.452 7.102 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -9.743 -3.479 8.416 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -8.222 -3.116 9.208 1.00 0.00 H new ATOM 0 HE ARG A 116 -8.093 -1.013 8.034 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -11.203 -2.673 7.568 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -11.979 -1.237 6.892 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -9.108 0.769 7.155 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -10.803 0.692 6.663 1.00 0.00 H new ATOM 1753 N VAL A 117 -11.239 -5.795 4.179 1.00 0.00 N ATOM 1754 CA VAL A 117 -12.532 -5.656 3.479 1.00 0.00 C ATOM 1755 C VAL A 117 -13.514 -4.979 4.431 1.00 0.00 C ATOM 1756 O VAL A 117 -13.788 -5.523 5.505 1.00 0.00 O ATOM 1757 CB VAL A 117 -13.117 -7.038 3.021 1.00 0.00 C ATOM 1758 CG1 VAL A 117 -14.394 -6.857 2.149 1.00 0.00 C ATOM 1759 CG2 VAL A 117 -12.044 -7.871 2.288 1.00 0.00 C ATOM 0 H VAL A 117 -11.115 -6.691 4.651 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.375 -5.062 2.578 1.00 0.00 H new ATOM 0 HB VAL A 117 -13.415 -7.588 3.914 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.772 -7.835 1.850 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.157 -6.334 2.725 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -14.148 -6.275 1.260 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.472 -8.825 1.980 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.699 -7.327 1.409 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.203 -8.050 2.957 1.00 0.00 H new ATOM 1769 N TYR A 118 -14.042 -3.798 4.065 1.00 0.00 N ATOM 1770 CA TYR A 118 -14.940 -3.054 4.962 1.00 0.00 C ATOM 1771 C TYR A 118 -16.127 -2.413 4.216 1.00 0.00 C ATOM 1772 O TYR A 118 -16.061 -2.205 2.996 1.00 0.00 O ATOM 1773 CB TYR A 118 -14.151 -2.012 5.812 1.00 0.00 C ATOM 1774 CG TYR A 118 -13.867 -0.670 5.135 1.00 0.00 C ATOM 1775 CD1 TYR A 118 -12.862 -0.531 4.173 1.00 0.00 C ATOM 1776 CD2 TYR A 118 -14.624 0.467 5.457 1.00 0.00 C ATOM 1777 CE1 TYR A 118 -12.629 0.685 3.564 1.00 0.00 C ATOM 1778 CE2 TYR A 118 -14.389 1.675 4.853 1.00 0.00 C ATOM 1779 CZ TYR A 118 -13.399 1.785 3.912 1.00 0.00 C ATOM 1780 OH TYR A 118 -13.185 3.002 3.306 1.00 0.00 O ATOM 0 H TYR A 118 -13.866 -3.345 3.168 1.00 0.00 H new ATOM 0 HA TYR A 118 -15.374 -3.779 5.650 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -14.710 -1.823 6.729 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -13.200 -2.457 6.105 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -12.260 -1.386 3.903 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -15.408 0.389 6.196 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -11.851 0.780 2.821 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -14.982 2.538 5.118 1.00 0.00 H new ATOM 0 HH TYR A 118 -12.267 3.041 2.965 1.00 0.00 H new ATOM 1790 N ALA A 119 -17.173 -2.068 4.967 1.00 0.00 N ATOM 1791 CA ALA A 119 -18.337 -1.330 4.470 1.00 0.00 C ATOM 1792 C ALA A 119 -18.452 -0.053 5.294 1.00 0.00 C ATOM 1793 O ALA A 119 -18.732 -0.126 6.482 1.00 0.00 O ATOM 1794 CB ALA A 119 -19.607 -2.181 4.611 1.00 0.00 C ATOM 0 H ALA A 119 -17.237 -2.298 5.959 1.00 0.00 H new ATOM 0 HA ALA A 119 -18.219 -1.091 3.413 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -20.464 -1.620 4.238 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -19.495 -3.099 4.035 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -19.764 -2.428 5.661 1.00 0.00 H new ATOM 1800 N PHE A 120 -18.232 1.103 4.662 1.00 0.00 N ATOM 1801 CA PHE A 120 -18.140 2.402 5.348 1.00 0.00 C ATOM 1802 C PHE A 120 -19.512 2.827 5.902 1.00 0.00 C ATOM 1803 O PHE A 120 -20.548 2.596 5.263 1.00 0.00 O ATOM 1804 CB PHE A 120 -17.596 3.466 4.355 1.00 0.00 C ATOM 1805 CG PHE A 120 -17.258 4.829 4.966 1.00 0.00 C ATOM 1806 CD1 PHE A 120 -16.084 5.008 5.700 1.00 0.00 C ATOM 1807 CD2 PHE A 120 -18.097 5.930 4.787 1.00 0.00 C ATOM 1808 CE1 PHE A 120 -15.764 6.240 6.235 1.00 0.00 C ATOM 1809 CE2 PHE A 120 -17.777 7.158 5.325 1.00 0.00 C ATOM 1810 CZ PHE A 120 -16.612 7.313 6.047 1.00 0.00 C ATOM 0 H PHE A 120 -18.111 1.168 3.651 1.00 0.00 H new ATOM 0 HA PHE A 120 -17.456 2.313 6.192 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -16.699 3.068 3.880 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -18.335 3.614 3.568 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -15.417 4.172 5.851 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -19.009 5.818 4.219 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -14.852 6.364 6.800 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -18.439 7.999 5.181 1.00 0.00 H new ATOM 0 HZ PHE A 120 -16.363 8.276 6.466 1.00 0.00 H new ATOM 1820 N ALA A 121 -19.498 3.422 7.105 1.00 0.00 N ATOM 1821 CA ALA A 121 -20.704 3.909 7.781 1.00 0.00 C ATOM 1822 C ALA A 121 -21.181 5.222 7.139 1.00 0.00 C ATOM 1823 O ALA A 121 -20.639 6.298 7.423 1.00 0.00 O ATOM 1824 CB ALA A 121 -20.424 4.093 9.278 1.00 0.00 C ATOM 0 H ALA A 121 -18.642 3.578 7.637 1.00 0.00 H new ATOM 0 HA ALA A 121 -21.501 3.173 7.670 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -21.324 4.455 9.775 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -20.129 3.138 9.713 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -19.620 4.817 9.411 1.00 0.00 H new ATOM 1830 N GLY A 122 -22.180 5.110 6.250 1.00 0.00 N ATOM 1831 CA GLY A 122 -22.758 6.258 5.552 1.00 0.00 C ATOM 1832 C GLY A 122 -24.280 6.183 5.554 1.00 0.00 C ATOM 1833 O GLY A 122 -24.905 6.690 6.509 1.00 0.00 O ATOM 1834 OXT GLY A 122 -24.862 5.582 4.625 1.00 0.00 O ATOM 0 H GLY A 122 -22.607 4.218 5.998 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -22.434 7.182 6.032 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -22.392 6.287 4.526 1.00 0.00 H new TER 1838 GLY A 122 ATOM 1839 N MET B 1 -16.328 -8.475 -7.437 1.00 0.00 N ATOM 1840 CA MET B 1 -17.286 -7.815 -6.515 1.00 0.00 C ATOM 1841 C MET B 1 -16.562 -6.823 -5.580 1.00 0.00 C ATOM 1842 O MET B 1 -17.191 -5.932 -5.005 1.00 0.00 O ATOM 1843 CB MET B 1 -18.050 -8.891 -5.687 1.00 0.00 C ATOM 1844 CG MET B 1 -17.217 -9.592 -4.589 1.00 0.00 C ATOM 1845 SD MET B 1 -15.718 -10.381 -5.215 1.00 0.00 S ATOM 1846 CE MET B 1 -14.962 -11.006 -3.709 1.00 0.00 C ATOM 0 H1 MET B 1 -16.853 -9.004 -8.162 1.00 0.00 H new ATOM 0 H2 MET B 1 -15.735 -7.754 -7.896 1.00 0.00 H new ATOM 0 H3 MET B 1 -15.724 -9.129 -6.900 1.00 0.00 H new ATOM 0 HA MET B 1 -18.004 -7.249 -7.109 1.00 0.00 H new ATOM 0 HB2 MET B 1 -18.915 -8.420 -5.219 1.00 0.00 H new ATOM 0 HB3 MET B 1 -18.431 -9.649 -6.371 1.00 0.00 H new ATOM 0 HG2 MET B 1 -16.943 -8.860 -3.829 1.00 0.00 H new ATOM 0 HG3 MET B 1 -17.836 -10.343 -4.099 1.00 0.00 H new ATOM 0 HE1 MET B 1 -13.969 -10.571 -3.593 1.00 0.00 H new ATOM 0 HE2 MET B 1 -15.579 -10.735 -2.852 1.00 0.00 H new ATOM 0 HE3 MET B 1 -14.878 -12.091 -3.767 1.00 0.00 H new ATOM 1856 N THR B 2 -15.229 -6.986 -5.443 1.00 0.00 N ATOM 1857 CA THR B 2 -14.416 -6.296 -4.427 1.00 0.00 C ATOM 1858 C THR B 2 -13.041 -5.889 -5.001 1.00 0.00 C ATOM 1859 O THR B 2 -12.271 -6.747 -5.457 1.00 0.00 O ATOM 1860 CB THR B 2 -14.235 -7.232 -3.191 1.00 0.00 C ATOM 1861 OG1 THR B 2 -15.521 -7.594 -2.680 1.00 0.00 O ATOM 1862 CG2 THR B 2 -13.427 -6.591 -2.062 1.00 0.00 C ATOM 0 H THR B 2 -14.685 -7.607 -6.042 1.00 0.00 H new ATOM 0 HA THR B 2 -14.930 -5.385 -4.122 1.00 0.00 H new ATOM 0 HB THR B 2 -13.681 -8.104 -3.537 1.00 0.00 H new ATOM 0 HG1 THR B 2 -15.413 -8.240 -1.951 1.00 0.00 H new ATOM 0 HG21 THR B 2 -13.338 -7.294 -1.234 1.00 0.00 H new ATOM 0 HG22 THR B 2 -12.433 -6.333 -2.427 1.00 0.00 H new ATOM 0 HG23 THR B 2 -13.933 -5.689 -1.719 1.00 0.00 H new ATOM 1870 N HIS B 3 -12.740 -4.574 -4.977 1.00 0.00 N ATOM 1871 CA HIS B 3 -11.446 -4.017 -5.437 1.00 0.00 C ATOM 1872 C HIS B 3 -10.929 -2.960 -4.433 1.00 0.00 C ATOM 1873 O HIS B 3 -11.705 -2.110 -3.976 1.00 0.00 O ATOM 1874 CB HIS B 3 -11.573 -3.390 -6.850 1.00 0.00 C ATOM 1875 CG HIS B 3 -11.680 -4.388 -7.975 1.00 0.00 C ATOM 1876 ND1 HIS B 3 -12.571 -4.264 -9.016 1.00 0.00 N ATOM 1877 CD2 HIS B 3 -10.970 -5.515 -8.227 1.00 0.00 C ATOM 1878 CE1 HIS B 3 -12.408 -5.268 -9.851 1.00 0.00 C ATOM 1879 NE2 HIS B 3 -11.442 -6.042 -9.396 1.00 0.00 N ATOM 0 H HIS B 3 -13.389 -3.864 -4.637 1.00 0.00 H new ATOM 0 HA HIS B 3 -10.730 -4.837 -5.493 1.00 0.00 H new ATOM 0 HB2 HIS B 3 -12.452 -2.746 -6.869 1.00 0.00 H new ATOM 0 HB3 HIS B 3 -10.707 -2.753 -7.029 1.00 0.00 H new ATOM 0 HD2 HIS B 3 -10.177 -5.921 -7.616 1.00 0.00 H new ATOM 0 HE1 HIS B 3 -12.971 -5.431 -10.758 1.00 0.00 H new ATOM 0 HE2 HIS B 3 -11.103 -6.894 -9.843 1.00 0.00 H new ATOM 1888 N PRO B 4 -9.610 -3.016 -4.055 1.00 0.00 N ATOM 1889 CA PRO B 4 -8.967 -1.996 -3.212 1.00 0.00 C ATOM 1890 C PRO B 4 -8.316 -0.853 -4.034 1.00 0.00 C ATOM 1891 O PRO B 4 -7.261 -1.029 -4.650 1.00 0.00 O ATOM 1892 CB PRO B 4 -7.916 -2.834 -2.447 1.00 0.00 C ATOM 1893 CG PRO B 4 -7.468 -3.875 -3.440 1.00 0.00 C ATOM 1894 CD PRO B 4 -8.655 -4.118 -4.368 1.00 0.00 C ATOM 0 HA PRO B 4 -9.669 -1.468 -2.567 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -7.081 -2.217 -2.115 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -8.346 -3.293 -1.557 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -6.600 -3.529 -4.001 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -7.175 -4.795 -2.934 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -8.351 -4.094 -5.415 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -9.105 -5.095 -4.189 1.00 0.00 H new ATOM 1902 N ASP B 5 -8.975 0.316 -4.066 1.00 0.00 N ATOM 1903 CA ASP B 5 -8.349 1.575 -4.546 1.00 0.00 C ATOM 1904 C ASP B 5 -7.863 2.408 -3.351 1.00 0.00 C ATOM 1905 O ASP B 5 -7.467 3.574 -3.490 1.00 0.00 O ATOM 1906 CB ASP B 5 -9.333 2.385 -5.421 1.00 0.00 C ATOM 1907 CG ASP B 5 -10.527 2.932 -4.641 1.00 0.00 C ATOM 1908 OD1 ASP B 5 -11.393 2.126 -4.247 1.00 0.00 O ATOM 1909 OD2 ASP B 5 -10.598 4.163 -4.401 1.00 0.00 O ATOM 0 H ASP B 5 -9.944 0.424 -3.766 1.00 0.00 H new ATOM 0 HA ASP B 5 -7.490 1.321 -5.167 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -8.799 3.215 -5.883 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -9.696 1.750 -6.229 1.00 0.00 H new ATOM 1914 N PHE B 6 -7.832 1.740 -2.193 1.00 0.00 N ATOM 1915 CA PHE B 6 -7.635 2.348 -0.891 1.00 0.00 C ATOM 1916 C PHE B 6 -6.510 1.577 -0.174 1.00 0.00 C ATOM 1917 O PHE B 6 -6.528 0.344 -0.114 1.00 0.00 O ATOM 1918 CB PHE B 6 -8.983 2.304 -0.102 1.00 0.00 C ATOM 1919 CG PHE B 6 -9.054 3.092 1.214 1.00 0.00 C ATOM 1920 CD1 PHE B 6 -8.080 4.015 1.579 1.00 0.00 C ATOM 1921 CD2 PHE B 6 -10.136 2.921 2.074 1.00 0.00 C ATOM 1922 CE1 PHE B 6 -8.187 4.726 2.746 1.00 0.00 C ATOM 1923 CE2 PHE B 6 -10.228 3.637 3.247 1.00 0.00 C ATOM 1924 CZ PHE B 6 -9.258 4.536 3.579 1.00 0.00 C ATOM 0 H PHE B 6 -7.948 0.728 -2.145 1.00 0.00 H new ATOM 0 HA PHE B 6 -7.339 3.394 -0.971 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -9.771 2.673 -0.759 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -9.212 1.261 0.116 1.00 0.00 H new ATOM 0 HD1 PHE B 6 -7.228 4.174 0.934 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -10.914 2.217 1.818 1.00 0.00 H new ATOM 0 HE1 PHE B 6 -7.422 5.441 3.011 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -11.071 3.486 3.906 1.00 0.00 H new ATOM 0 HZ PHE B 6 -9.334 5.098 4.498 1.00 0.00 H new ATOM 1934 N THR B 7 -5.526 2.328 0.320 1.00 0.00 N ATOM 1935 CA THR B 7 -4.404 1.804 1.111 1.00 0.00 C ATOM 1936 C THR B 7 -4.271 2.656 2.374 1.00 0.00 C ATOM 1937 O THR B 7 -4.426 3.876 2.323 1.00 0.00 O ATOM 1938 CB THR B 7 -3.061 1.804 0.297 1.00 0.00 C ATOM 1939 OG1 THR B 7 -1.984 1.305 1.106 1.00 0.00 O ATOM 1940 CG2 THR B 7 -2.686 3.201 -0.246 1.00 0.00 C ATOM 0 H THR B 7 -5.482 3.338 0.181 1.00 0.00 H new ATOM 0 HA THR B 7 -4.607 0.766 1.373 1.00 0.00 H new ATOM 0 HB THR B 7 -3.222 1.150 -0.560 1.00 0.00 H new ATOM 0 HG1 THR B 7 -1.222 1.078 0.533 1.00 0.00 H new ATOM 0 HG21 THR B 7 -1.749 3.137 -0.799 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.475 3.558 -0.908 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.569 3.895 0.586 1.00 0.00 H new ATOM 1948 N ILE B 8 -4.028 2.005 3.515 1.00 0.00 N ATOM 1949 CA ILE B 8 -3.910 2.677 4.821 1.00 0.00 C ATOM 1950 C ILE B 8 -2.563 2.288 5.453 1.00 0.00 C ATOM 1951 O ILE B 8 -2.113 1.154 5.301 1.00 0.00 O ATOM 1952 CB ILE B 8 -5.102 2.287 5.781 1.00 0.00 C ATOM 1953 CG1 ILE B 8 -6.486 2.564 5.108 1.00 0.00 C ATOM 1954 CG2 ILE B 8 -4.997 2.982 7.158 1.00 0.00 C ATOM 1955 CD1 ILE B 8 -7.704 2.323 5.986 1.00 0.00 C ATOM 0 H ILE B 8 -3.906 0.993 3.564 1.00 0.00 H new ATOM 0 HA ILE B 8 -3.956 3.756 4.672 1.00 0.00 H new ATOM 0 HB ILE B 8 -5.025 1.215 5.962 1.00 0.00 H new ATOM 0 HG12 ILE B 8 -6.504 3.600 4.769 1.00 0.00 H new ATOM 0 HG13 ILE B 8 -6.570 1.937 4.221 1.00 0.00 H new ATOM 0 HG21 ILE B 8 -5.839 2.682 7.782 1.00 0.00 H new ATOM 0 HG22 ILE B 8 -4.065 2.691 7.642 1.00 0.00 H new ATOM 0 HG23 ILE B 8 -5.013 4.063 7.022 1.00 0.00 H new ATOM 0 HD11 ILE B 8 -8.609 2.545 5.421 1.00 0.00 H new ATOM 0 HD12 ILE B 8 -7.722 1.281 6.305 1.00 0.00 H new ATOM 0 HD13 ILE B 8 -7.655 2.970 6.862 1.00 0.00 H new ATOM 1967 N LEU B 9 -1.908 3.241 6.124 1.00 0.00 N ATOM 1968 CA LEU B 9 -0.658 2.997 6.865 1.00 0.00 C ATOM 1969 C LEU B 9 -0.941 3.178 8.362 1.00 0.00 C ATOM 1970 O LEU B 9 -1.596 4.144 8.773 1.00 0.00 O ATOM 1971 CB LEU B 9 0.441 3.969 6.359 1.00 0.00 C ATOM 1972 CG LEU B 9 0.758 3.868 4.825 1.00 0.00 C ATOM 1973 CD1 LEU B 9 1.674 5.008 4.360 1.00 0.00 C ATOM 1974 CD2 LEU B 9 1.354 2.488 4.459 1.00 0.00 C ATOM 0 H LEU B 9 -2.228 4.208 6.171 1.00 0.00 H new ATOM 0 HA LEU B 9 -0.296 1.982 6.701 1.00 0.00 H new ATOM 0 HB2 LEU B 9 0.134 4.990 6.585 1.00 0.00 H new ATOM 0 HB3 LEU B 9 1.358 3.780 6.918 1.00 0.00 H new ATOM 0 HG LEU B 9 -0.188 3.971 4.294 1.00 0.00 H new ATOM 0 HD11 LEU B 9 1.871 4.904 3.293 1.00 0.00 H new ATOM 0 HD12 LEU B 9 1.188 5.965 4.548 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.615 4.965 4.909 1.00 0.00 H new ATOM 0 HD21 LEU B 9 1.561 2.453 3.389 1.00 0.00 H new ATOM 0 HD22 LEU B 9 2.280 2.333 5.013 1.00 0.00 H new ATOM 0 HD23 LEU B 9 0.641 1.704 4.716 1.00 0.00 H new ATOM 1986 N TYR B 10 -0.446 2.219 9.160 1.00 0.00 N ATOM 1987 CA TYR B 10 -0.589 2.225 10.626 1.00 0.00 C ATOM 1988 C TYR B 10 0.381 3.222 11.266 1.00 0.00 C ATOM 1989 O TYR B 10 1.583 3.087 11.097 1.00 0.00 O ATOM 1990 CB TYR B 10 -0.342 0.806 11.207 1.00 0.00 C ATOM 1991 CG TYR B 10 -1.403 -0.215 10.762 1.00 0.00 C ATOM 1992 CD1 TYR B 10 -2.721 -0.106 11.197 1.00 0.00 C ATOM 1993 CD2 TYR B 10 -1.090 -1.278 9.913 1.00 0.00 C ATOM 1994 CE1 TYR B 10 -3.678 -1.014 10.804 1.00 0.00 C ATOM 1995 CE2 TYR B 10 -2.044 -2.190 9.517 1.00 0.00 C ATOM 1996 CZ TYR B 10 -3.339 -2.056 9.967 1.00 0.00 C ATOM 1997 OH TYR B 10 -4.299 -2.968 9.574 1.00 0.00 O ATOM 0 H TYR B 10 0.068 1.413 8.805 1.00 0.00 H new ATOM 0 HA TYR B 10 -1.609 2.531 10.859 1.00 0.00 H new ATOM 0 HB2 TYR B 10 0.643 0.458 10.896 1.00 0.00 H new ATOM 0 HB3 TYR B 10 -0.332 0.861 12.296 1.00 0.00 H new ATOM 0 HD1 TYR B 10 -2.997 0.705 11.854 1.00 0.00 H new ATOM 0 HD2 TYR B 10 -0.076 -1.388 9.558 1.00 0.00 H new ATOM 0 HE1 TYR B 10 -4.695 -0.910 11.152 1.00 0.00 H new ATOM 0 HE2 TYR B 10 -1.778 -3.004 8.859 1.00 0.00 H new ATOM 0 HH TYR B 10 -5.000 -2.507 9.068 1.00 0.00 H new ATOM 2007 N VAL B 11 -0.155 4.206 12.001 1.00 0.00 N ATOM 2008 CA VAL B 11 0.639 5.221 12.724 1.00 0.00 C ATOM 2009 C VAL B 11 0.353 5.074 14.224 1.00 0.00 C ATOM 2010 O VAL B 11 -0.622 4.436 14.614 1.00 0.00 O ATOM 2011 CB VAL B 11 0.328 6.690 12.231 1.00 0.00 C ATOM 2012 CG1 VAL B 11 0.666 6.859 10.730 1.00 0.00 C ATOM 2013 CG2 VAL B 11 -1.137 7.106 12.513 1.00 0.00 C ATOM 0 H VAL B 11 -1.162 4.325 12.114 1.00 0.00 H new ATOM 0 HA VAL B 11 1.697 5.052 12.521 1.00 0.00 H new ATOM 0 HB VAL B 11 0.970 7.357 12.806 1.00 0.00 H new ATOM 0 HG11 VAL B 11 0.442 7.879 10.419 1.00 0.00 H new ATOM 0 HG12 VAL B 11 1.725 6.655 10.570 1.00 0.00 H new ATOM 0 HG13 VAL B 11 0.070 6.161 10.142 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -1.302 8.123 12.156 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.814 6.426 11.996 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.328 7.062 13.585 1.00 0.00 H new ATOM 2023 N ASP B 12 1.242 5.612 15.066 1.00 0.00 N ATOM 2024 CA ASP B 12 1.098 5.519 16.534 1.00 0.00 C ATOM 2025 C ASP B 12 0.479 6.804 17.093 1.00 0.00 C ATOM 2026 O ASP B 12 -0.530 6.754 17.801 1.00 0.00 O ATOM 2027 CB ASP B 12 2.470 5.232 17.197 1.00 0.00 C ATOM 2028 CG ASP B 12 2.388 5.158 18.739 1.00 0.00 C ATOM 2029 OD1 ASP B 12 1.910 4.133 19.271 1.00 0.00 O ATOM 2030 OD2 ASP B 12 2.774 6.137 19.423 1.00 0.00 O ATOM 0 H ASP B 12 2.073 6.119 14.761 1.00 0.00 H new ATOM 0 HA ASP B 12 0.429 4.690 16.766 1.00 0.00 H new ATOM 0 HB2 ASP B 12 2.864 4.291 16.813 1.00 0.00 H new ATOM 0 HB3 ASP B 12 3.176 6.012 16.913 1.00 0.00 H new ATOM 2035 N ASN B 13 1.108 7.954 16.781 1.00 0.00 N ATOM 2036 CA ASN B 13 0.665 9.287 17.243 1.00 0.00 C ATOM 2037 C ASN B 13 -0.250 9.924 16.169 1.00 0.00 C ATOM 2038 O ASN B 13 0.259 10.389 15.139 1.00 0.00 O ATOM 2039 CB ASN B 13 1.923 10.165 17.544 1.00 0.00 C ATOM 2040 CG ASN B 13 1.631 11.582 18.072 1.00 0.00 C ATOM 2041 OD1 ASN B 13 0.656 12.232 17.698 1.00 0.00 O ATOM 2042 ND2 ASN B 13 2.476 12.071 18.963 1.00 0.00 N ATOM 0 H ASN B 13 1.944 7.986 16.197 1.00 0.00 H new ATOM 0 HA ASN B 13 0.085 9.206 18.162 1.00 0.00 H new ATOM 0 HB2 ASN B 13 2.542 9.644 18.275 1.00 0.00 H new ATOM 0 HB3 ASN B 13 2.512 10.250 16.631 1.00 0.00 H new ATOM 0 HD21 ASN B 13 2.325 13.002 19.352 1.00 0.00 H new ATOM 0 HD22 ASN B 13 3.279 11.518 19.262 1.00 0.00 H new ATOM 2049 N PRO B 14 -1.617 9.936 16.386 1.00 0.00 N ATOM 2050 CA PRO B 14 -2.597 10.406 15.376 1.00 0.00 C ATOM 2051 C PRO B 14 -2.352 11.864 14.858 1.00 0.00 C ATOM 2052 O PRO B 14 -2.149 12.004 13.655 1.00 0.00 O ATOM 2053 CB PRO B 14 -3.987 10.216 16.061 1.00 0.00 C ATOM 2054 CG PRO B 14 -3.733 9.228 17.164 1.00 0.00 C ATOM 2055 CD PRO B 14 -2.308 9.462 17.616 1.00 0.00 C ATOM 0 HA PRO B 14 -2.511 9.831 14.454 1.00 0.00 H new ATOM 0 HB2 PRO B 14 -4.368 11.159 16.453 1.00 0.00 H new ATOM 0 HB3 PRO B 14 -4.729 9.841 15.356 1.00 0.00 H new ATOM 0 HG2 PRO B 14 -4.432 9.375 17.987 1.00 0.00 H new ATOM 0 HG3 PRO B 14 -3.867 8.206 16.810 1.00 0.00 H new ATOM 0 HD2 PRO B 14 -2.258 10.203 18.413 1.00 0.00 H new ATOM 0 HD3 PRO B 14 -1.856 8.548 18.002 1.00 0.00 H new ATOM 2063 N PRO B 15 -2.327 12.979 15.711 1.00 0.00 N ATOM 2064 CA PRO B 15 -2.143 14.368 15.191 1.00 0.00 C ATOM 2065 C PRO B 15 -0.850 14.511 14.365 1.00 0.00 C ATOM 2066 O PRO B 15 -0.898 14.835 13.179 1.00 0.00 O ATOM 2067 CB PRO B 15 -2.111 15.253 16.470 1.00 0.00 C ATOM 2068 CG PRO B 15 -2.844 14.442 17.491 1.00 0.00 C ATOM 2069 CD PRO B 15 -2.472 13.005 17.197 1.00 0.00 C ATOM 0 HA PRO B 15 -2.939 14.657 14.505 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -1.089 15.462 16.785 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -2.595 16.215 16.302 1.00 0.00 H new ATOM 0 HG2 PRO B 15 -2.552 14.725 18.502 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -3.921 14.594 17.415 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -1.546 12.720 17.696 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -3.243 12.313 17.537 1.00 0.00 H new ATOM 2077 N ALA B 16 0.285 14.185 15.011 1.00 0.00 N ATOM 2078 CA ALA B 16 1.633 14.473 14.485 1.00 0.00 C ATOM 2079 C ALA B 16 1.871 13.798 13.124 1.00 0.00 C ATOM 2080 O ALA B 16 2.338 14.441 12.174 1.00 0.00 O ATOM 2081 CB ALA B 16 2.704 14.042 15.503 1.00 0.00 C ATOM 0 H ALA B 16 0.293 13.713 15.915 1.00 0.00 H new ATOM 0 HA ALA B 16 1.707 15.549 14.329 1.00 0.00 H new ATOM 0 HB1 ALA B 16 3.694 14.260 15.103 1.00 0.00 H new ATOM 0 HB2 ALA B 16 2.561 14.588 16.435 1.00 0.00 H new ATOM 0 HB3 ALA B 16 2.616 12.972 15.692 1.00 0.00 H new ATOM 2087 N SER B 17 1.497 12.514 13.028 1.00 0.00 N ATOM 2088 CA SER B 17 1.744 11.702 11.828 1.00 0.00 C ATOM 2089 C SER B 17 0.731 12.025 10.714 1.00 0.00 C ATOM 2090 O SER B 17 1.042 11.863 9.528 1.00 0.00 O ATOM 2091 CB SER B 17 1.682 10.205 12.188 1.00 0.00 C ATOM 2092 OG SER B 17 2.544 9.906 13.273 1.00 0.00 O ATOM 0 H SER B 17 1.018 12.012 13.775 1.00 0.00 H new ATOM 0 HA SER B 17 2.739 11.942 11.453 1.00 0.00 H new ATOM 0 HB2 SER B 17 0.659 9.932 12.446 1.00 0.00 H new ATOM 0 HB3 SER B 17 1.963 9.607 11.321 1.00 0.00 H new ATOM 0 HG SER B 17 2.045 9.968 14.114 1.00 0.00 H new ATOM 2098 N THR B 18 -0.461 12.530 11.091 1.00 0.00 N ATOM 2099 CA THR B 18 -1.481 12.939 10.116 1.00 0.00 C ATOM 2100 C THR B 18 -1.131 14.246 9.383 1.00 0.00 C ATOM 2101 O THR B 18 -1.200 14.323 8.156 1.00 0.00 O ATOM 2102 CB THR B 18 -2.903 13.057 10.778 1.00 0.00 C ATOM 2103 OG1 THR B 18 -3.348 11.749 11.182 1.00 0.00 O ATOM 2104 CG2 THR B 18 -3.963 13.676 9.846 1.00 0.00 C ATOM 0 H THR B 18 -0.737 12.663 12.064 1.00 0.00 H new ATOM 0 HA THR B 18 -1.503 12.146 9.369 1.00 0.00 H new ATOM 0 HB THR B 18 -2.796 13.725 11.633 1.00 0.00 H new ATOM 0 HG1 THR B 18 -3.037 11.564 12.093 1.00 0.00 H new ATOM 0 HG21 THR B 18 -4.919 13.727 10.366 1.00 0.00 H new ATOM 0 HG22 THR B 18 -3.652 14.680 9.558 1.00 0.00 H new ATOM 0 HG23 THR B 18 -4.068 13.059 8.954 1.00 0.00 H new ATOM 2112 N GLN B 19 -0.625 15.222 10.177 1.00 0.00 N ATOM 2113 CA GLN B 19 -0.158 16.535 9.676 1.00 0.00 C ATOM 2114 C GLN B 19 1.124 16.344 8.847 1.00 0.00 C ATOM 2115 O GLN B 19 1.386 17.127 7.924 1.00 0.00 O ATOM 2116 CB GLN B 19 0.097 17.519 10.853 1.00 0.00 C ATOM 2117 CG GLN B 19 -1.081 17.651 11.844 1.00 0.00 C ATOM 2118 CD GLN B 19 -2.378 18.194 11.239 1.00 0.00 C ATOM 2119 OE1 GLN B 19 -2.364 19.035 10.346 1.00 0.00 O ATOM 2120 NE2 GLN B 19 -3.514 17.700 11.711 1.00 0.00 N ATOM 0 H GLN B 19 -0.530 15.118 11.187 1.00 0.00 H new ATOM 0 HA GLN B 19 -0.934 16.965 9.043 1.00 0.00 H new ATOM 0 HB2 GLN B 19 0.980 17.190 11.400 1.00 0.00 H new ATOM 0 HB3 GLN B 19 0.324 18.504 10.444 1.00 0.00 H new ATOM 0 HG2 GLN B 19 -1.282 16.672 12.278 1.00 0.00 H new ATOM 0 HG3 GLN B 19 -0.777 18.305 12.661 1.00 0.00 H new ATOM 0 HE21 GLN B 19 -3.497 17.001 12.454 1.00 0.00 H new ATOM 0 HE22 GLN B 19 -4.405 18.018 11.331 1.00 0.00 H new ATOM 2129 N PHE B 20 1.910 15.300 9.197 1.00 0.00 N ATOM 2130 CA PHE B 20 3.125 14.930 8.458 1.00 0.00 C ATOM 2131 C PHE B 20 2.756 14.552 7.018 1.00 0.00 C ATOM 2132 O PHE B 20 3.328 15.109 6.087 1.00 0.00 O ATOM 2133 CB PHE B 20 3.872 13.744 9.145 1.00 0.00 C ATOM 2134 CG PHE B 20 5.207 13.356 8.470 1.00 0.00 C ATOM 2135 CD1 PHE B 20 5.246 12.468 7.385 1.00 0.00 C ATOM 2136 CD2 PHE B 20 6.417 13.909 8.899 1.00 0.00 C ATOM 2137 CE1 PHE B 20 6.439 12.160 6.759 1.00 0.00 C ATOM 2138 CE2 PHE B 20 7.612 13.587 8.274 1.00 0.00 C ATOM 2139 CZ PHE B 20 7.620 12.717 7.205 1.00 0.00 C ATOM 0 H PHE B 20 1.716 14.697 9.997 1.00 0.00 H new ATOM 0 HA PHE B 20 3.796 15.789 8.453 1.00 0.00 H new ATOM 0 HB2 PHE B 20 4.067 14.006 10.185 1.00 0.00 H new ATOM 0 HB3 PHE B 20 3.216 12.873 9.154 1.00 0.00 H new ATOM 0 HD1 PHE B 20 4.329 12.018 7.033 1.00 0.00 H new ATOM 0 HD2 PHE B 20 6.421 14.598 9.731 1.00 0.00 H new ATOM 0 HE1 PHE B 20 6.447 11.482 5.919 1.00 0.00 H new ATOM 0 HE2 PHE B 20 8.538 14.018 8.625 1.00 0.00 H new ATOM 0 HZ PHE B 20 8.551 12.471 6.716 1.00 0.00 H new ATOM 2149 N TYR B 21 1.760 13.650 6.848 1.00 0.00 N ATOM 2150 CA TYR B 21 1.286 13.238 5.504 1.00 0.00 C ATOM 2151 C TYR B 21 0.577 14.402 4.796 1.00 0.00 C ATOM 2152 O TYR B 21 0.630 14.475 3.566 1.00 0.00 O ATOM 2153 CB TYR B 21 0.394 11.976 5.587 1.00 0.00 C ATOM 2154 CG TYR B 21 1.208 10.679 5.651 1.00 0.00 C ATOM 2155 CD1 TYR B 21 1.598 10.029 4.478 1.00 0.00 C ATOM 2156 CD2 TYR B 21 1.613 10.126 6.866 1.00 0.00 C ATOM 2157 CE1 TYR B 21 2.354 8.885 4.517 1.00 0.00 C ATOM 2158 CE2 TYR B 21 2.368 8.973 6.906 1.00 0.00 C ATOM 2159 CZ TYR B 21 2.737 8.362 5.728 1.00 0.00 C ATOM 2160 OH TYR B 21 3.490 7.227 5.759 1.00 0.00 O ATOM 0 H TYR B 21 1.271 13.196 7.620 1.00 0.00 H new ATOM 0 HA TYR B 21 2.154 12.972 4.901 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -0.243 12.044 6.469 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -0.265 11.944 4.719 1.00 0.00 H new ATOM 0 HD1 TYR B 21 1.299 10.434 3.523 1.00 0.00 H new ATOM 0 HD2 TYR B 21 1.331 10.609 7.790 1.00 0.00 H new ATOM 0 HE1 TYR B 21 2.647 8.397 3.599 1.00 0.00 H new ATOM 0 HE2 TYR B 21 2.668 8.552 7.854 1.00 0.00 H new ATOM 0 HH TYR B 21 3.455 6.836 6.657 1.00 0.00 H new ATOM 2170 N LYS B 22 -0.099 15.285 5.556 1.00 0.00 N ATOM 2171 CA LYS B 22 -0.830 16.430 4.972 1.00 0.00 C ATOM 2172 C LYS B 22 0.078 17.336 4.124 1.00 0.00 C ATOM 2173 O LYS B 22 -0.252 17.694 2.997 1.00 0.00 O ATOM 2174 CB LYS B 22 -1.539 17.258 6.066 1.00 0.00 C ATOM 2175 CG LYS B 22 -2.786 16.593 6.660 1.00 0.00 C ATOM 2176 CD LYS B 22 -3.418 17.424 7.793 1.00 0.00 C ATOM 2177 CE LYS B 22 -3.830 18.843 7.346 1.00 0.00 C ATOM 2178 NZ LYS B 22 -4.543 19.588 8.410 1.00 0.00 N ATOM 0 H LYS B 22 -0.155 15.229 6.573 1.00 0.00 H new ATOM 0 HA LYS B 22 -1.584 16.007 4.307 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -0.830 17.456 6.870 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -1.823 18.223 5.647 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -3.523 16.441 5.871 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -2.520 15.607 7.042 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -4.295 16.901 8.174 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -2.710 17.501 8.618 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -2.941 19.400 7.050 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -4.469 18.772 6.466 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -4.693 20.571 8.105 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -5.463 19.138 8.592 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -3.974 19.579 9.281 1.00 0.00 H new ATOM 2192 N ALA B 23 1.235 17.685 4.706 1.00 0.00 N ATOM 2193 CA ALA B 23 2.267 18.502 4.039 1.00 0.00 C ATOM 2194 C ALA B 23 3.070 17.656 3.025 1.00 0.00 C ATOM 2195 O ALA B 23 3.475 18.155 1.973 1.00 0.00 O ATOM 2196 CB ALA B 23 3.201 19.115 5.097 1.00 0.00 C ATOM 0 H ALA B 23 1.485 17.409 5.656 1.00 0.00 H new ATOM 0 HA ALA B 23 1.779 19.305 3.486 1.00 0.00 H new ATOM 0 HB1 ALA B 23 3.963 19.718 4.604 1.00 0.00 H new ATOM 0 HB2 ALA B 23 2.622 19.744 5.773 1.00 0.00 H new ATOM 0 HB3 ALA B 23 3.681 18.318 5.665 1.00 0.00 H new ATOM 2202 N LEU B 24 3.288 16.374 3.374 1.00 0.00 N ATOM 2203 CA LEU B 24 4.089 15.411 2.573 1.00 0.00 C ATOM 2204 C LEU B 24 3.514 15.180 1.160 1.00 0.00 C ATOM 2205 O LEU B 24 4.257 15.020 0.185 1.00 0.00 O ATOM 2206 CB LEU B 24 4.119 14.042 3.311 1.00 0.00 C ATOM 2207 CG LEU B 24 5.101 12.965 2.769 1.00 0.00 C ATOM 2208 CD1 LEU B 24 6.547 13.333 3.124 1.00 0.00 C ATOM 2209 CD2 LEU B 24 4.735 11.549 3.270 1.00 0.00 C ATOM 0 H LEU B 24 2.911 15.967 4.230 1.00 0.00 H new ATOM 0 HA LEU B 24 5.086 15.838 2.464 1.00 0.00 H new ATOM 0 HB2 LEU B 24 4.364 14.227 4.357 1.00 0.00 H new ATOM 0 HB3 LEU B 24 3.113 13.624 3.289 1.00 0.00 H new ATOM 0 HG LEU B 24 5.011 12.945 1.683 1.00 0.00 H new ATOM 0 HD11 LEU B 24 7.222 12.569 2.738 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.797 14.297 2.680 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.651 13.395 4.207 1.00 0.00 H new ATOM 0 HD21 LEU B 24 5.445 10.826 2.869 1.00 0.00 H new ATOM 0 HD22 LEU B 24 4.772 11.528 4.359 1.00 0.00 H new ATOM 0 HD23 LEU B 24 3.729 11.293 2.936 1.00 0.00 H new ATOM 2221 N LEU B 25 2.178 15.170 1.081 1.00 0.00 N ATOM 2222 CA LEU B 25 1.434 15.013 -0.182 1.00 0.00 C ATOM 2223 C LEU B 25 0.982 16.401 -0.678 1.00 0.00 C ATOM 2224 O LEU B 25 0.884 16.629 -1.891 1.00 0.00 O ATOM 2225 CB LEU B 25 0.230 14.059 0.041 1.00 0.00 C ATOM 2226 CG LEU B 25 0.551 12.733 0.819 1.00 0.00 C ATOM 2227 CD1 LEU B 25 -0.696 11.847 0.959 1.00 0.00 C ATOM 2228 CD2 LEU B 25 1.711 11.958 0.178 1.00 0.00 C ATOM 0 H LEU B 25 1.574 15.271 1.897 1.00 0.00 H new ATOM 0 HA LEU B 25 2.071 14.570 -0.948 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -0.544 14.600 0.585 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -0.188 13.797 -0.931 1.00 0.00 H new ATOM 0 HG LEU B 25 0.869 13.022 1.821 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.437 10.938 1.502 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -1.468 12.389 1.505 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -1.069 11.584 -0.031 1.00 0.00 H new ATOM 0 HD21 LEU B 25 1.899 11.048 0.748 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.451 11.697 -0.848 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.607 12.578 0.178 1.00 0.00 H new ATOM 2240 N GLY B 26 0.724 17.319 0.273 1.00 0.00 N ATOM 2241 CA GLY B 26 0.150 18.635 -0.029 1.00 0.00 C ATOM 2242 C GLY B 26 -1.374 18.589 -0.097 1.00 0.00 C ATOM 2243 O GLY B 26 -1.997 19.344 -0.855 1.00 0.00 O ATOM 0 H GLY B 26 0.908 17.166 1.265 1.00 0.00 H new ATOM 0 HA2 GLY B 26 0.458 19.349 0.735 1.00 0.00 H new ATOM 0 HA3 GLY B 26 0.545 18.994 -0.979 1.00 0.00 H new ATOM 2247 N VAL B 27 -1.974 17.689 0.713 1.00 0.00 N ATOM 2248 CA VAL B 27 -3.438 17.451 0.751 1.00 0.00 C ATOM 2249 C VAL B 27 -3.985 17.622 2.184 1.00 0.00 C ATOM 2250 O VAL B 27 -3.223 17.816 3.133 1.00 0.00 O ATOM 2251 CB VAL B 27 -3.806 16.012 0.214 1.00 0.00 C ATOM 2252 CG1 VAL B 27 -3.332 15.834 -1.246 1.00 0.00 C ATOM 2253 CG2 VAL B 27 -3.260 14.895 1.146 1.00 0.00 C ATOM 0 H VAL B 27 -1.454 17.102 1.365 1.00 0.00 H new ATOM 0 HA VAL B 27 -3.900 18.192 0.099 1.00 0.00 H new ATOM 0 HB VAL B 27 -4.892 15.918 0.220 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -3.596 14.836 -1.595 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -3.815 16.579 -1.879 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -2.251 15.961 -1.296 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -3.533 13.920 0.744 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -2.174 14.971 1.208 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -3.689 15.010 2.141 1.00 0.00 H new ATOM 2263 N ASP B 28 -5.317 17.548 2.319 1.00 0.00 N ATOM 2264 CA ASP B 28 -6.019 17.613 3.619 1.00 0.00 C ATOM 2265 C ASP B 28 -7.032 16.448 3.707 1.00 0.00 C ATOM 2266 O ASP B 28 -7.662 16.114 2.696 1.00 0.00 O ATOM 2267 CB ASP B 28 -6.736 18.980 3.768 1.00 0.00 C ATOM 2268 CG ASP B 28 -7.527 19.127 5.084 1.00 0.00 C ATOM 2269 OD1 ASP B 28 -6.919 19.458 6.125 1.00 0.00 O ATOM 2270 OD2 ASP B 28 -8.758 18.906 5.089 1.00 0.00 O ATOM 0 H ASP B 28 -5.947 17.440 1.524 1.00 0.00 H new ATOM 0 HA ASP B 28 -5.299 17.519 4.432 1.00 0.00 H new ATOM 0 HB2 ASP B 28 -5.995 19.777 3.709 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -7.417 19.116 2.928 1.00 0.00 H new ATOM 2275 N PRO B 29 -7.164 15.769 4.895 1.00 0.00 N ATOM 2276 CA PRO B 29 -8.120 14.656 5.093 1.00 0.00 C ATOM 2277 C PRO B 29 -9.599 15.043 4.893 1.00 0.00 C ATOM 2278 O PRO B 29 -10.062 16.054 5.425 1.00 0.00 O ATOM 2279 CB PRO B 29 -7.844 14.191 6.551 1.00 0.00 C ATOM 2280 CG PRO B 29 -6.440 14.626 6.805 1.00 0.00 C ATOM 2281 CD PRO B 29 -6.329 15.956 6.105 1.00 0.00 C ATOM 0 HA PRO B 29 -7.969 13.876 4.346 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -8.538 14.650 7.255 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -7.953 13.111 6.654 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -6.240 14.720 7.872 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -5.723 13.907 6.409 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -6.698 16.771 6.727 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -5.296 16.192 5.850 1.00 0.00 H new ATOM 2289 N VAL B 30 -10.313 14.215 4.107 1.00 0.00 N ATOM 2290 CA VAL B 30 -11.772 14.297 3.945 1.00 0.00 C ATOM 2291 C VAL B 30 -12.480 13.825 5.239 1.00 0.00 C ATOM 2292 O VAL B 30 -13.481 14.408 5.664 1.00 0.00 O ATOM 2293 CB VAL B 30 -12.248 13.448 2.699 1.00 0.00 C ATOM 2294 CG1 VAL B 30 -11.860 11.949 2.827 1.00 0.00 C ATOM 2295 CG2 VAL B 30 -13.763 13.620 2.437 1.00 0.00 C ATOM 0 H VAL B 30 -9.887 13.465 3.563 1.00 0.00 H new ATOM 0 HA VAL B 30 -12.043 15.337 3.762 1.00 0.00 H new ATOM 0 HB VAL B 30 -11.718 13.840 1.831 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -12.208 11.407 1.948 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -10.776 11.859 2.904 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -12.323 11.528 3.720 1.00 0.00 H new ATOM 0 HG21 VAL B 30 -14.053 13.022 1.573 1.00 0.00 H new ATOM 0 HG22 VAL B 30 -14.323 13.290 3.312 1.00 0.00 H new ATOM 0 HG23 VAL B 30 -13.981 14.670 2.241 1.00 0.00 H new ATOM 2305 N GLU B 31 -11.893 12.797 5.885 1.00 0.00 N ATOM 2306 CA GLU B 31 -12.401 12.195 7.120 1.00 0.00 C ATOM 2307 C GLU B 31 -11.301 12.330 8.170 1.00 0.00 C ATOM 2308 O GLU B 31 -10.128 12.041 7.891 1.00 0.00 O ATOM 2309 CB GLU B 31 -12.765 10.694 6.915 1.00 0.00 C ATOM 2310 CG GLU B 31 -13.878 10.416 5.880 1.00 0.00 C ATOM 2311 CD GLU B 31 -15.245 10.972 6.308 1.00 0.00 C ATOM 2312 OE1 GLU B 31 -15.854 10.398 7.234 1.00 0.00 O ATOM 2313 OE2 GLU B 31 -15.721 11.970 5.724 1.00 0.00 O ATOM 0 H GLU B 31 -11.035 12.358 5.550 1.00 0.00 H new ATOM 0 HA GLU B 31 -13.313 12.703 7.434 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -11.866 10.158 6.609 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -13.073 10.278 7.874 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -13.596 10.856 4.924 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -13.962 9.340 5.724 1.00 0.00 H new ATOM 2320 N SER B 32 -11.676 12.782 9.363 1.00 0.00 N ATOM 2321 CA SER B 32 -10.738 13.050 10.450 1.00 0.00 C ATOM 2322 C SER B 32 -11.373 12.615 11.781 1.00 0.00 C ATOM 2323 O SER B 32 -12.497 13.014 12.106 1.00 0.00 O ATOM 2324 CB SER B 32 -10.370 14.545 10.447 1.00 0.00 C ATOM 2325 OG SER B 32 -9.759 14.935 9.217 1.00 0.00 O ATOM 0 H SER B 32 -12.648 12.974 9.605 1.00 0.00 H new ATOM 0 HA SER B 32 -9.818 12.481 10.315 1.00 0.00 H new ATOM 0 HB2 SER B 32 -11.267 15.141 10.613 1.00 0.00 H new ATOM 0 HB3 SER B 32 -9.691 14.754 11.273 1.00 0.00 H new ATOM 0 HG SER B 32 -9.540 15.890 9.249 1.00 0.00 H new ATOM 2331 N SER B 33 -10.646 11.771 12.516 1.00 0.00 N ATOM 2332 CA SER B 33 -11.104 11.131 13.761 1.00 0.00 C ATOM 2333 C SER B 33 -9.934 11.108 14.780 1.00 0.00 C ATOM 2334 O SER B 33 -8.768 11.191 14.369 1.00 0.00 O ATOM 2335 CB SER B 33 -11.592 9.691 13.447 1.00 0.00 C ATOM 2336 OG SER B 33 -12.694 9.695 12.551 1.00 0.00 O ATOM 0 H SER B 33 -9.696 11.503 12.259 1.00 0.00 H new ATOM 0 HA SER B 33 -11.933 11.692 14.193 1.00 0.00 H new ATOM 0 HB2 SER B 33 -10.774 9.115 13.015 1.00 0.00 H new ATOM 0 HB3 SER B 33 -11.878 9.193 14.374 1.00 0.00 H new ATOM 0 HG SER B 33 -12.594 8.963 11.907 1.00 0.00 H new ATOM 2342 N PRO B 34 -10.214 11.012 16.129 1.00 0.00 N ATOM 2343 CA PRO B 34 -9.157 10.999 17.182 1.00 0.00 C ATOM 2344 C PRO B 34 -8.134 9.836 17.041 1.00 0.00 C ATOM 2345 O PRO B 34 -7.007 9.950 17.527 1.00 0.00 O ATOM 2346 CB PRO B 34 -9.963 10.898 18.515 1.00 0.00 C ATOM 2347 CG PRO B 34 -11.310 10.379 18.109 1.00 0.00 C ATOM 2348 CD PRO B 34 -11.571 10.971 16.743 1.00 0.00 C ATOM 0 HA PRO B 34 -8.530 11.888 17.118 1.00 0.00 H new ATOM 0 HB2 PRO B 34 -9.476 10.226 19.222 1.00 0.00 H new ATOM 0 HB3 PRO B 34 -10.044 11.869 19.003 1.00 0.00 H new ATOM 0 HG2 PRO B 34 -11.317 9.290 18.073 1.00 0.00 H new ATOM 0 HG3 PRO B 34 -12.078 10.680 18.821 1.00 0.00 H new ATOM 0 HD2 PRO B 34 -12.258 10.356 16.162 1.00 0.00 H new ATOM 0 HD3 PRO B 34 -12.013 11.965 16.812 1.00 0.00 H new ATOM 2356 N THR B 35 -8.533 8.723 16.391 1.00 0.00 N ATOM 2357 CA THR B 35 -7.650 7.544 16.201 1.00 0.00 C ATOM 2358 C THR B 35 -7.564 7.108 14.715 1.00 0.00 C ATOM 2359 O THR B 35 -7.046 6.022 14.407 1.00 0.00 O ATOM 2360 CB THR B 35 -8.116 6.352 17.111 1.00 0.00 C ATOM 2361 OG1 THR B 35 -7.171 5.271 17.045 1.00 0.00 O ATOM 2362 CG2 THR B 35 -9.525 5.837 16.740 1.00 0.00 C ATOM 0 H THR B 35 -9.463 8.612 15.986 1.00 0.00 H new ATOM 0 HA THR B 35 -6.645 7.840 16.502 1.00 0.00 H new ATOM 0 HB THR B 35 -8.166 6.736 18.130 1.00 0.00 H new ATOM 0 HG1 THR B 35 -7.570 4.517 16.563 1.00 0.00 H new ATOM 0 HG21 THR B 35 -9.797 5.013 17.400 1.00 0.00 H new ATOM 0 HG22 THR B 35 -10.248 6.645 16.851 1.00 0.00 H new ATOM 0 HG23 THR B 35 -9.525 5.489 15.707 1.00 0.00 H new ATOM 2370 N PHE B 36 -8.026 7.962 13.787 1.00 0.00 N ATOM 2371 CA PHE B 36 -8.053 7.620 12.349 1.00 0.00 C ATOM 2372 C PHE B 36 -8.047 8.900 11.494 1.00 0.00 C ATOM 2373 O PHE B 36 -8.471 9.960 11.939 1.00 0.00 O ATOM 2374 CB PHE B 36 -9.300 6.732 12.044 1.00 0.00 C ATOM 2375 CG PHE B 36 -9.379 6.161 10.620 1.00 0.00 C ATOM 2376 CD1 PHE B 36 -8.600 5.067 10.249 1.00 0.00 C ATOM 2377 CD2 PHE B 36 -10.225 6.725 9.659 1.00 0.00 C ATOM 2378 CE1 PHE B 36 -8.664 4.552 8.966 1.00 0.00 C ATOM 2379 CE2 PHE B 36 -10.286 6.210 8.376 1.00 0.00 C ATOM 2380 CZ PHE B 36 -9.504 5.125 8.031 1.00 0.00 C ATOM 0 H PHE B 36 -8.385 8.892 14.002 1.00 0.00 H new ATOM 0 HA PHE B 36 -7.159 7.051 12.094 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -9.313 5.902 12.750 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -10.197 7.322 12.229 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -7.937 4.615 10.972 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -10.839 7.574 9.922 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -8.056 3.701 8.695 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -10.944 6.656 7.645 1.00 0.00 H new ATOM 0 HZ PHE B 36 -9.549 4.724 7.029 1.00 0.00 H new ATOM 2390 N SER B 37 -7.549 8.773 10.265 1.00 0.00 N ATOM 2391 CA SER B 37 -7.526 9.852 9.269 1.00 0.00 C ATOM 2392 C SER B 37 -7.746 9.238 7.884 1.00 0.00 C ATOM 2393 O SER B 37 -7.501 8.039 7.684 1.00 0.00 O ATOM 2394 CB SER B 37 -6.180 10.614 9.325 1.00 0.00 C ATOM 2395 OG SER B 37 -6.132 11.665 8.373 1.00 0.00 O ATOM 0 H SER B 37 -7.142 7.902 9.924 1.00 0.00 H new ATOM 0 HA SER B 37 -8.318 10.570 9.481 1.00 0.00 H new ATOM 0 HB2 SER B 37 -6.034 11.022 10.325 1.00 0.00 H new ATOM 0 HB3 SER B 37 -5.360 9.919 9.142 1.00 0.00 H new ATOM 0 HG SER B 37 -5.674 11.353 7.565 1.00 0.00 H new ATOM 2401 N LEU B 38 -8.221 10.054 6.940 1.00 0.00 N ATOM 2402 CA LEU B 38 -8.498 9.606 5.572 1.00 0.00 C ATOM 2403 C LEU B 38 -8.383 10.825 4.647 1.00 0.00 C ATOM 2404 O LEU B 38 -9.170 11.755 4.774 1.00 0.00 O ATOM 2405 CB LEU B 38 -9.915 8.951 5.506 1.00 0.00 C ATOM 2406 CG LEU B 38 -10.164 7.875 4.403 1.00 0.00 C ATOM 2407 CD1 LEU B 38 -11.607 7.318 4.483 1.00 0.00 C ATOM 2408 CD2 LEU B 38 -9.839 8.394 2.987 1.00 0.00 C ATOM 0 H LEU B 38 -8.424 11.041 7.101 1.00 0.00 H new ATOM 0 HA LEU B 38 -7.783 8.849 5.251 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -10.119 8.493 6.474 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -10.647 9.747 5.370 1.00 0.00 H new ATOM 0 HG LEU B 38 -9.473 7.055 4.599 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -11.752 6.571 3.703 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -11.767 6.860 5.459 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -12.319 8.131 4.343 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -10.030 7.606 2.258 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -10.467 9.256 2.762 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -8.790 8.687 2.939 1.00 0.00 H new ATOM 2420 N PHE B 39 -7.444 10.776 3.696 1.00 0.00 N ATOM 2421 CA PHE B 39 -7.256 11.793 2.635 1.00 0.00 C ATOM 2422 C PHE B 39 -7.258 11.094 1.256 1.00 0.00 C ATOM 2423 O PHE B 39 -6.633 10.050 1.069 1.00 0.00 O ATOM 2424 CB PHE B 39 -5.946 12.619 2.873 1.00 0.00 C ATOM 2425 CG PHE B 39 -4.805 11.840 3.540 1.00 0.00 C ATOM 2426 CD1 PHE B 39 -4.693 11.796 4.933 1.00 0.00 C ATOM 2427 CD2 PHE B 39 -3.861 11.144 2.790 1.00 0.00 C ATOM 2428 CE1 PHE B 39 -3.683 11.090 5.541 1.00 0.00 C ATOM 2429 CE2 PHE B 39 -2.849 10.436 3.411 1.00 0.00 C ATOM 2430 CZ PHE B 39 -2.762 10.409 4.779 1.00 0.00 C ATOM 0 H PHE B 39 -6.772 10.011 3.634 1.00 0.00 H new ATOM 0 HA PHE B 39 -8.081 12.505 2.663 1.00 0.00 H new ATOM 0 HB2 PHE B 39 -5.595 13.000 1.914 1.00 0.00 H new ATOM 0 HB3 PHE B 39 -6.186 13.484 3.491 1.00 0.00 H new ATOM 0 HD1 PHE B 39 -5.412 12.325 5.541 1.00 0.00 H new ATOM 0 HD2 PHE B 39 -3.920 11.157 1.712 1.00 0.00 H new ATOM 0 HE1 PHE B 39 -3.612 11.070 6.618 1.00 0.00 H new ATOM 0 HE2 PHE B 39 -2.123 9.902 2.816 1.00 0.00 H new ATOM 0 HZ PHE B 39 -1.970 9.853 5.259 1.00 0.00 H new ATOM 2440 N VAL B 40 -7.990 11.697 0.306 1.00 0.00 N ATOM 2441 CA VAL B 40 -8.203 11.156 -1.050 1.00 0.00 C ATOM 2442 C VAL B 40 -7.537 12.090 -2.073 1.00 0.00 C ATOM 2443 O VAL B 40 -7.814 13.300 -2.076 1.00 0.00 O ATOM 2444 CB VAL B 40 -9.744 11.047 -1.394 1.00 0.00 C ATOM 2445 CG1 VAL B 40 -9.978 10.269 -2.719 1.00 0.00 C ATOM 2446 CG2 VAL B 40 -10.542 10.424 -0.228 1.00 0.00 C ATOM 0 H VAL B 40 -8.459 12.590 0.459 1.00 0.00 H new ATOM 0 HA VAL B 40 -7.767 10.158 -1.090 1.00 0.00 H new ATOM 0 HB VAL B 40 -10.116 12.061 -1.540 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -11.047 10.213 -2.924 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -9.478 10.786 -3.538 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -9.574 9.261 -2.625 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -11.596 10.365 -0.499 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -10.163 9.423 -0.022 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -10.431 11.044 0.661 1.00 0.00 H new ATOM 2456 N LEU B 41 -6.669 11.534 -2.936 1.00 0.00 N ATOM 2457 CA LEU B 41 -5.811 12.342 -3.829 1.00 0.00 C ATOM 2458 C LEU B 41 -6.527 12.594 -5.165 1.00 0.00 C ATOM 2459 O LEU B 41 -7.357 11.780 -5.600 1.00 0.00 O ATOM 2460 CB LEU B 41 -4.430 11.654 -4.087 1.00 0.00 C ATOM 2461 CG LEU B 41 -3.602 11.189 -2.833 1.00 0.00 C ATOM 2462 CD1 LEU B 41 -2.153 10.816 -3.226 1.00 0.00 C ATOM 2463 CD2 LEU B 41 -3.612 12.229 -1.701 1.00 0.00 C ATOM 0 H LEU B 41 -6.541 10.527 -3.036 1.00 0.00 H new ATOM 0 HA LEU B 41 -5.622 13.293 -3.331 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -4.602 10.782 -4.718 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -3.812 12.345 -4.660 1.00 0.00 H new ATOM 0 HG LEU B 41 -4.095 10.296 -2.448 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -1.606 10.499 -2.338 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -2.171 10.003 -3.952 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -1.660 11.683 -3.665 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -3.026 11.857 -0.860 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -3.179 13.162 -2.061 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -4.638 12.405 -1.378 1.00 0.00 H new ATOM 2475 N ALA B 42 -6.165 13.719 -5.820 1.00 0.00 N ATOM 2476 CA ALA B 42 -6.692 14.107 -7.151 1.00 0.00 C ATOM 2477 C ALA B 42 -6.219 13.131 -8.256 1.00 0.00 C ATOM 2478 O ALA B 42 -6.752 13.131 -9.370 1.00 0.00 O ATOM 2479 CB ALA B 42 -6.271 15.552 -7.474 1.00 0.00 C ATOM 0 H ALA B 42 -5.496 14.388 -5.440 1.00 0.00 H new ATOM 0 HA ALA B 42 -7.780 14.053 -7.121 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -6.660 15.834 -8.452 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -6.672 16.226 -6.716 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -5.183 15.621 -7.482 1.00 0.00 H new ATOM 2485 N ASN B 43 -5.214 12.299 -7.915 1.00 0.00 N ATOM 2486 CA ASN B 43 -4.704 11.213 -8.779 1.00 0.00 C ATOM 2487 C ASN B 43 -5.760 10.114 -9.007 1.00 0.00 C ATOM 2488 O ASN B 43 -5.674 9.374 -9.989 1.00 0.00 O ATOM 2489 CB ASN B 43 -3.432 10.581 -8.141 1.00 0.00 C ATOM 2490 CG ASN B 43 -2.162 11.451 -8.195 1.00 0.00 C ATOM 2491 OD1 ASN B 43 -1.053 10.924 -8.242 1.00 0.00 O ATOM 2492 ND2 ASN B 43 -2.298 12.773 -8.163 1.00 0.00 N ATOM 0 H ASN B 43 -4.727 12.363 -7.021 1.00 0.00 H new ATOM 0 HA ASN B 43 -4.460 11.653 -9.746 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -3.647 10.347 -7.098 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -3.226 9.636 -8.643 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -1.472 13.371 -8.177 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -3.228 13.189 -8.124 1.00 0.00 H new ATOM 2499 N GLY B 44 -6.745 10.019 -8.091 1.00 0.00 N ATOM 2500 CA GLY B 44 -7.807 9.012 -8.167 1.00 0.00 C ATOM 2501 C GLY B 44 -7.628 7.875 -7.164 1.00 0.00 C ATOM 2502 O GLY B 44 -8.437 6.944 -7.143 1.00 0.00 O ATOM 0 H GLY B 44 -6.821 10.638 -7.284 1.00 0.00 H new ATOM 0 HA2 GLY B 44 -8.769 9.494 -7.993 1.00 0.00 H new ATOM 0 HA3 GLY B 44 -7.835 8.598 -9.175 1.00 0.00 H new ATOM 2506 N MET B 45 -6.574 7.947 -6.328 1.00 0.00 N ATOM 2507 CA MET B 45 -6.310 6.941 -5.274 1.00 0.00 C ATOM 2508 C MET B 45 -6.888 7.424 -3.937 1.00 0.00 C ATOM 2509 O MET B 45 -7.286 8.595 -3.807 1.00 0.00 O ATOM 2510 CB MET B 45 -4.779 6.671 -5.162 1.00 0.00 C ATOM 2511 CG MET B 45 -3.953 7.799 -4.505 1.00 0.00 C ATOM 2512 SD MET B 45 -3.907 7.694 -2.699 1.00 0.00 S ATOM 2513 CE MET B 45 -2.954 6.192 -2.444 1.00 0.00 C ATOM 0 H MET B 45 -5.884 8.698 -6.361 1.00 0.00 H new ATOM 0 HA MET B 45 -6.798 6.003 -5.538 1.00 0.00 H new ATOM 0 HB2 MET B 45 -4.630 5.755 -4.591 1.00 0.00 H new ATOM 0 HB3 MET B 45 -4.385 6.491 -6.162 1.00 0.00 H new ATOM 0 HG2 MET B 45 -2.934 7.765 -4.890 1.00 0.00 H new ATOM 0 HG3 MET B 45 -4.371 8.763 -4.795 1.00 0.00 H new ATOM 0 HE1 MET B 45 -2.375 6.280 -1.525 1.00 0.00 H new ATOM 0 HE2 MET B 45 -3.630 5.341 -2.367 1.00 0.00 H new ATOM 0 HE3 MET B 45 -2.278 6.043 -3.286 1.00 0.00 H new ATOM 2523 N LYS B 46 -6.910 6.530 -2.943 1.00 0.00 N ATOM 2524 CA LYS B 46 -7.442 6.828 -1.609 1.00 0.00 C ATOM 2525 C LYS B 46 -6.443 6.322 -0.549 1.00 0.00 C ATOM 2526 O LYS B 46 -5.915 5.210 -0.681 1.00 0.00 O ATOM 2527 CB LYS B 46 -8.842 6.173 -1.470 1.00 0.00 C ATOM 2528 CG LYS B 46 -9.667 6.689 -0.278 1.00 0.00 C ATOM 2529 CD LYS B 46 -11.115 6.166 -0.294 1.00 0.00 C ATOM 2530 CE LYS B 46 -12.025 6.847 0.734 1.00 0.00 C ATOM 2531 NZ LYS B 46 -13.444 6.479 0.551 1.00 0.00 N ATOM 0 H LYS B 46 -6.559 5.577 -3.041 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.564 7.901 -1.460 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -9.404 6.346 -2.388 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.718 5.095 -1.371 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -9.185 6.387 0.652 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -9.677 7.779 -0.292 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -11.534 6.311 -1.290 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -11.107 5.093 -0.105 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -11.706 6.571 1.739 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -11.918 7.929 0.652 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -14.023 6.962 1.267 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -13.757 6.766 -0.398 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -13.552 5.450 0.655 1.00 0.00 H new ATOM 2545 N LEU B 47 -6.188 7.134 0.496 1.00 0.00 N ATOM 2546 CA LEU B 47 -5.109 6.868 1.480 1.00 0.00 C ATOM 2547 C LEU B 47 -5.613 7.161 2.917 1.00 0.00 C ATOM 2548 O LEU B 47 -6.097 8.253 3.197 1.00 0.00 O ATOM 2549 CB LEU B 47 -3.850 7.733 1.114 1.00 0.00 C ATOM 2550 CG LEU B 47 -2.433 7.094 1.340 1.00 0.00 C ATOM 2551 CD1 LEU B 47 -1.332 8.051 0.834 1.00 0.00 C ATOM 2552 CD2 LEU B 47 -2.180 6.692 2.814 1.00 0.00 C ATOM 0 H LEU B 47 -6.716 7.986 0.685 1.00 0.00 H new ATOM 0 HA LEU B 47 -4.823 5.817 1.445 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -3.928 8.011 0.063 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -3.898 8.656 1.692 1.00 0.00 H new ATOM 0 HG LEU B 47 -2.402 6.170 0.762 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -0.354 7.598 0.996 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.474 8.238 -0.230 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -1.390 8.993 1.379 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -1.185 6.257 2.907 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -2.250 7.575 3.449 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.926 5.961 3.125 1.00 0.00 H new ATOM 2564 N GLY B 48 -5.519 6.155 3.805 1.00 0.00 N ATOM 2565 CA GLY B 48 -5.880 6.293 5.223 1.00 0.00 C ATOM 2566 C GLY B 48 -4.646 6.371 6.109 1.00 0.00 C ATOM 2567 O GLY B 48 -3.540 6.028 5.680 1.00 0.00 O ATOM 0 H GLY B 48 -5.190 5.222 3.556 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -6.484 7.190 5.360 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -6.494 5.445 5.527 1.00 0.00 H new ATOM 2571 N LEU B 49 -4.862 6.750 7.380 1.00 0.00 N ATOM 2572 CA LEU B 49 -3.913 6.538 8.486 1.00 0.00 C ATOM 2573 C LEU B 49 -4.712 5.978 9.668 1.00 0.00 C ATOM 2574 O LEU B 49 -5.549 6.685 10.232 1.00 0.00 O ATOM 2575 CB LEU B 49 -3.195 7.850 8.911 1.00 0.00 C ATOM 2576 CG LEU B 49 -2.291 8.529 7.841 1.00 0.00 C ATOM 2577 CD1 LEU B 49 -1.649 9.806 8.400 1.00 0.00 C ATOM 2578 CD2 LEU B 49 -1.221 7.566 7.275 1.00 0.00 C ATOM 0 H LEU B 49 -5.718 7.221 7.673 1.00 0.00 H new ATOM 0 HA LEU B 49 -3.134 5.849 8.161 1.00 0.00 H new ATOM 0 HB2 LEU B 49 -3.954 8.568 9.221 1.00 0.00 H new ATOM 0 HB3 LEU B 49 -2.583 7.635 9.787 1.00 0.00 H new ATOM 0 HG LEU B 49 -2.935 8.805 7.006 1.00 0.00 H new ATOM 0 HD11 LEU B 49 -1.022 10.263 7.635 1.00 0.00 H new ATOM 0 HD12 LEU B 49 -2.430 10.507 8.695 1.00 0.00 H new ATOM 0 HD13 LEU B 49 -1.038 9.556 9.268 1.00 0.00 H new ATOM 0 HD21 LEU B 49 -0.617 8.089 6.533 1.00 0.00 H new ATOM 0 HD22 LEU B 49 -0.580 7.218 8.085 1.00 0.00 H new ATOM 0 HD23 LEU B 49 -1.711 6.712 6.808 1.00 0.00 H new ATOM 2590 N TRP B 50 -4.478 4.708 10.021 1.00 0.00 N ATOM 2591 CA TRP B 50 -5.161 4.056 11.155 1.00 0.00 C ATOM 2592 C TRP B 50 -4.170 3.993 12.315 1.00 0.00 C ATOM 2593 O TRP B 50 -3.067 3.475 12.158 1.00 0.00 O ATOM 2594 CB TRP B 50 -5.667 2.628 10.764 1.00 0.00 C ATOM 2595 CG TRP B 50 -6.621 1.974 11.768 1.00 0.00 C ATOM 2596 CD1 TRP B 50 -6.455 1.846 13.122 1.00 0.00 C ATOM 2597 CD2 TRP B 50 -7.876 1.328 11.479 1.00 0.00 C ATOM 2598 NE1 TRP B 50 -7.521 1.209 13.679 1.00 0.00 N ATOM 2599 CE2 TRP B 50 -8.401 0.862 12.702 1.00 0.00 C ATOM 2600 CE3 TRP B 50 -8.610 1.113 10.317 1.00 0.00 C ATOM 2601 CZ2 TRP B 50 -9.608 0.171 12.789 1.00 0.00 C ATOM 2602 CZ3 TRP B 50 -9.812 0.435 10.408 1.00 0.00 C ATOM 2603 CH2 TRP B 50 -10.300 -0.026 11.632 1.00 0.00 C ATOM 0 H TRP B 50 -3.815 4.104 9.535 1.00 0.00 H new ATOM 0 HA TRP B 50 -6.042 4.628 11.444 1.00 0.00 H new ATOM 0 HB2 TRP B 50 -6.169 2.690 9.798 1.00 0.00 H new ATOM 0 HB3 TRP B 50 -4.802 1.977 10.633 1.00 0.00 H new ATOM 0 HD1 TRP B 50 -5.596 2.202 13.672 1.00 0.00 H new ATOM 0 HE1 TRP B 50 -7.641 1.021 14.674 1.00 0.00 H new ATOM 0 HE3 TRP B 50 -8.249 1.468 9.363 1.00 0.00 H new ATOM 0 HZ2 TRP B 50 -9.980 -0.194 13.735 1.00 0.00 H new ATOM 0 HZ3 TRP B 50 -10.387 0.258 9.511 1.00 0.00 H new ATOM 0 HH2 TRP B 50 -11.244 -0.549 11.662 1.00 0.00 H new ATOM 2614 N SER B 51 -4.568 4.526 13.480 1.00 0.00 N ATOM 2615 CA SER B 51 -3.712 4.532 14.662 1.00 0.00 C ATOM 2616 C SER B 51 -3.767 3.152 15.347 1.00 0.00 C ATOM 2617 O SER B 51 -4.789 2.779 15.944 1.00 0.00 O ATOM 2618 CB SER B 51 -4.120 5.669 15.605 1.00 0.00 C ATOM 2619 OG SER B 51 -4.119 6.906 14.913 1.00 0.00 O ATOM 0 H SER B 51 -5.481 4.958 13.623 1.00 0.00 H new ATOM 0 HA SER B 51 -2.678 4.715 14.371 1.00 0.00 H new ATOM 0 HB2 SER B 51 -5.112 5.474 16.013 1.00 0.00 H new ATOM 0 HB3 SER B 51 -3.431 5.716 16.449 1.00 0.00 H new ATOM 0 HG SER B 51 -3.234 7.320 14.984 1.00 0.00 H new ATOM 2625 N ARG B 52 -2.646 2.416 15.252 1.00 0.00 N ATOM 2626 CA ARG B 52 -2.559 0.981 15.594 1.00 0.00 C ATOM 2627 C ARG B 52 -2.711 0.691 17.102 1.00 0.00 C ATOM 2628 O ARG B 52 -2.858 -0.475 17.488 1.00 0.00 O ATOM 2629 CB ARG B 52 -1.219 0.403 15.073 1.00 0.00 C ATOM 2630 CG ARG B 52 0.052 1.009 15.713 1.00 0.00 C ATOM 2631 CD ARG B 52 1.346 0.357 15.186 1.00 0.00 C ATOM 2632 NE ARG B 52 2.549 1.025 15.708 1.00 0.00 N ATOM 2633 CZ ARG B 52 3.107 2.101 15.151 1.00 0.00 C ATOM 2634 NH1 ARG B 52 2.549 2.665 14.099 1.00 0.00 N ATOM 2635 NH2 ARG B 52 4.194 2.634 15.673 1.00 0.00 N ATOM 0 H ARG B 52 -1.760 2.805 14.931 1.00 0.00 H new ATOM 0 HA ARG B 52 -3.402 0.492 15.106 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -1.215 -0.673 15.244 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -1.171 0.554 13.995 1.00 0.00 H new ATOM 0 HG2 ARG B 52 0.081 2.080 15.512 1.00 0.00 H new ATOM 0 HG3 ARG B 52 0.003 0.889 16.795 1.00 0.00 H new ATOM 0 HD2 ARG B 52 1.364 -0.695 15.469 1.00 0.00 H new ATOM 0 HD3 ARG B 52 1.354 0.394 14.097 1.00 0.00 H new ATOM 0 HE ARG B 52 2.983 0.641 16.548 1.00 0.00 H new ATOM 0 HH11 ARG B 52 1.689 2.279 13.709 1.00 0.00 H new ATOM 0 HH12 ARG B 52 2.977 3.488 13.674 1.00 0.00 H new ATOM 0 HH21 ARG B 52 4.613 2.224 16.507 1.00 0.00 H new ATOM 0 HH22 ARG B 52 4.616 3.457 15.242 1.00 0.00 H new ATOM 2649 N HIS B 53 -2.688 1.751 17.945 1.00 0.00 N ATOM 2650 CA HIS B 53 -2.887 1.615 19.412 1.00 0.00 C ATOM 2651 C HIS B 53 -4.321 1.136 19.748 1.00 0.00 C ATOM 2652 O HIS B 53 -4.577 0.672 20.860 1.00 0.00 O ATOM 2653 CB HIS B 53 -2.543 2.935 20.157 1.00 0.00 C ATOM 2654 CG HIS B 53 -3.360 4.147 19.773 1.00 0.00 C ATOM 2655 ND1 HIS B 53 -4.668 4.326 20.155 1.00 0.00 N ATOM 2656 CD2 HIS B 53 -3.031 5.254 19.066 1.00 0.00 C ATOM 2657 CE1 HIS B 53 -5.104 5.487 19.702 1.00 0.00 C ATOM 2658 NE2 HIS B 53 -4.131 6.073 19.039 1.00 0.00 N ATOM 0 H HIS B 53 -2.534 2.711 17.636 1.00 0.00 H new ATOM 0 HA HIS B 53 -2.195 0.850 19.764 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -2.662 2.766 21.227 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -1.491 3.162 19.985 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -2.075 5.456 18.606 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -6.095 5.889 19.851 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -4.185 6.983 18.582 1.00 0.00 H new ATOM 2667 N THR B 54 -5.249 1.281 18.780 1.00 0.00 N ATOM 2668 CA THR B 54 -6.583 0.661 18.833 1.00 0.00 C ATOM 2669 C THR B 54 -7.038 0.315 17.395 1.00 0.00 C ATOM 2670 O THR B 54 -7.802 1.039 16.747 1.00 0.00 O ATOM 2671 CB THR B 54 -7.634 1.536 19.617 1.00 0.00 C ATOM 2672 OG1 THR B 54 -8.944 0.940 19.559 1.00 0.00 O ATOM 2673 CG2 THR B 54 -7.710 2.982 19.108 1.00 0.00 C ATOM 0 H THR B 54 -5.091 1.834 17.938 1.00 0.00 H new ATOM 0 HA THR B 54 -6.516 -0.263 19.407 1.00 0.00 H new ATOM 0 HB THR B 54 -7.287 1.568 20.650 1.00 0.00 H new ATOM 0 HG1 THR B 54 -9.580 1.499 20.053 1.00 0.00 H new ATOM 0 HG21 THR B 54 -8.451 3.533 19.687 1.00 0.00 H new ATOM 0 HG22 THR B 54 -6.736 3.458 19.218 1.00 0.00 H new ATOM 0 HG23 THR B 54 -7.998 2.983 18.057 1.00 0.00 H new ATOM 2681 N VAL B 55 -6.471 -0.777 16.871 1.00 0.00 N ATOM 2682 CA VAL B 55 -6.843 -1.360 15.567 1.00 0.00 C ATOM 2683 C VAL B 55 -7.488 -2.735 15.772 1.00 0.00 C ATOM 2684 O VAL B 55 -7.260 -3.390 16.785 1.00 0.00 O ATOM 2685 CB VAL B 55 -5.597 -1.461 14.600 1.00 0.00 C ATOM 2686 CG1 VAL B 55 -4.455 -2.291 15.224 1.00 0.00 C ATOM 2687 CG2 VAL B 55 -5.992 -2.004 13.199 1.00 0.00 C ATOM 0 H VAL B 55 -5.729 -1.292 17.344 1.00 0.00 H new ATOM 0 HA VAL B 55 -7.568 -0.698 15.093 1.00 0.00 H new ATOM 0 HB VAL B 55 -5.224 -0.447 14.459 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -3.617 -2.337 14.529 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -4.130 -1.823 16.153 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -4.810 -3.300 15.431 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -5.106 -2.057 12.566 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -6.424 -2.999 13.303 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -6.724 -1.337 12.743 1.00 0.00 H new ATOM 2697 N GLU B 56 -8.360 -3.131 14.844 1.00 0.00 N ATOM 2698 CA GLU B 56 -8.905 -4.490 14.768 1.00 0.00 C ATOM 2699 C GLU B 56 -8.422 -5.177 13.462 1.00 0.00 C ATOM 2700 O GLU B 56 -8.815 -4.750 12.372 1.00 0.00 O ATOM 2701 CB GLU B 56 -10.443 -4.441 14.871 1.00 0.00 C ATOM 2702 CG GLU B 56 -10.945 -4.222 16.314 1.00 0.00 C ATOM 2703 CD GLU B 56 -12.466 -4.308 16.474 1.00 0.00 C ATOM 2704 OE1 GLU B 56 -13.067 -5.293 15.995 1.00 0.00 O ATOM 2705 OE2 GLU B 56 -13.063 -3.418 17.115 1.00 0.00 O ATOM 0 H GLU B 56 -8.713 -2.511 14.115 1.00 0.00 H new ATOM 0 HA GLU B 56 -8.541 -5.087 15.604 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -10.819 -3.639 14.236 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -10.857 -5.373 14.486 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -10.481 -4.964 16.964 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -10.610 -3.243 16.658 1.00 0.00 H new ATOM 2712 N PRO B 57 -7.546 -6.249 13.536 1.00 0.00 N ATOM 2713 CA PRO B 57 -7.039 -6.849 14.800 1.00 0.00 C ATOM 2714 C PRO B 57 -5.877 -6.037 15.416 1.00 0.00 C ATOM 2715 O PRO B 57 -5.059 -5.462 14.683 1.00 0.00 O ATOM 2716 CB PRO B 57 -6.570 -8.251 14.343 1.00 0.00 C ATOM 2717 CG PRO B 57 -6.079 -8.037 12.942 1.00 0.00 C ATOM 2718 CD PRO B 57 -6.974 -6.952 12.355 1.00 0.00 C ATOM 0 HA PRO B 57 -7.793 -6.873 15.587 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -5.780 -8.636 14.987 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -7.386 -8.973 14.373 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.034 -7.728 12.936 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -6.144 -8.956 12.359 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -6.405 -6.268 11.725 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -7.759 -7.381 11.732 1.00 0.00 H new ATOM 2726 N LYS B 58 -5.867 -5.963 16.768 1.00 0.00 N ATOM 2727 CA LYS B 58 -4.806 -5.296 17.549 1.00 0.00 C ATOM 2728 C LYS B 58 -3.406 -5.772 17.123 1.00 0.00 C ATOM 2729 O LYS B 58 -3.023 -6.925 17.351 1.00 0.00 O ATOM 2730 CB LYS B 58 -5.023 -5.507 19.079 1.00 0.00 C ATOM 2731 CG LYS B 58 -6.166 -4.667 19.699 1.00 0.00 C ATOM 2732 CD LYS B 58 -5.921 -3.141 19.584 1.00 0.00 C ATOM 2733 CE LYS B 58 -4.651 -2.662 20.306 1.00 0.00 C ATOM 2734 NZ LYS B 58 -4.699 -2.927 21.767 1.00 0.00 N ATOM 0 H LYS B 58 -6.601 -6.368 17.348 1.00 0.00 H new ATOM 0 HA LYS B 58 -4.868 -4.228 17.340 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -5.229 -6.562 19.260 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -4.095 -5.270 19.599 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -7.104 -4.918 19.204 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -6.278 -4.934 20.750 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -5.852 -2.872 18.530 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -6.782 -2.612 19.993 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -3.782 -3.161 19.877 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -4.521 -1.593 20.137 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -3.837 -2.557 22.216 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -5.532 -2.458 22.178 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -4.762 -3.952 21.932 1.00 0.00 H new ATOM 2748 N ALA B 59 -2.672 -4.849 16.501 1.00 0.00 N ATOM 2749 CA ALA B 59 -1.364 -5.100 15.913 1.00 0.00 C ATOM 2750 C ALA B 59 -0.518 -3.835 16.075 1.00 0.00 C ATOM 2751 O ALA B 59 -0.771 -2.829 15.400 1.00 0.00 O ATOM 2752 CB ALA B 59 -1.519 -5.477 14.420 1.00 0.00 C ATOM 0 H ALA B 59 -2.982 -3.883 16.392 1.00 0.00 H new ATOM 0 HA ALA B 59 -0.872 -5.933 16.415 1.00 0.00 H new ATOM 0 HB1 ALA B 59 -0.536 -5.663 13.988 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -2.130 -6.376 14.333 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -2.001 -4.658 13.886 1.00 0.00 H new ATOM 2758 N SER B 60 0.470 -3.876 16.980 1.00 0.00 N ATOM 2759 CA SER B 60 1.373 -2.746 17.220 1.00 0.00 C ATOM 2760 C SER B 60 2.800 -3.132 16.799 1.00 0.00 C ATOM 2761 O SER B 60 3.603 -3.630 17.601 1.00 0.00 O ATOM 2762 CB SER B 60 1.289 -2.311 18.703 1.00 0.00 C ATOM 2763 OG SER B 60 1.482 -3.404 19.579 1.00 0.00 O ATOM 0 H SER B 60 0.664 -4.690 17.563 1.00 0.00 H new ATOM 0 HA SER B 60 1.074 -1.888 16.617 1.00 0.00 H new ATOM 0 HB2 SER B 60 2.041 -1.548 18.902 1.00 0.00 H new ATOM 0 HB3 SER B 60 0.317 -1.858 18.895 1.00 0.00 H new ATOM 0 HG SER B 60 2.267 -3.917 19.294 1.00 0.00 H new ATOM 2769 N VAL B 61 3.064 -2.945 15.497 1.00 0.00 N ATOM 2770 CA VAL B 61 4.388 -3.146 14.883 1.00 0.00 C ATOM 2771 C VAL B 61 4.421 -2.439 13.512 1.00 0.00 C ATOM 2772 O VAL B 61 3.484 -2.577 12.718 1.00 0.00 O ATOM 2773 CB VAL B 61 4.771 -4.682 14.743 1.00 0.00 C ATOM 2774 CG1 VAL B 61 3.724 -5.484 13.934 1.00 0.00 C ATOM 2775 CG2 VAL B 61 6.196 -4.872 14.159 1.00 0.00 C ATOM 0 H VAL B 61 2.353 -2.645 14.830 1.00 0.00 H new ATOM 0 HA VAL B 61 5.137 -2.708 15.542 1.00 0.00 H new ATOM 0 HB VAL B 61 4.770 -5.088 15.754 1.00 0.00 H new ATOM 0 HG11 VAL B 61 4.035 -6.527 13.869 1.00 0.00 H new ATOM 0 HG12 VAL B 61 2.756 -5.424 14.432 1.00 0.00 H new ATOM 0 HG13 VAL B 61 3.642 -5.067 12.930 1.00 0.00 H new ATOM 0 HG21 VAL B 61 6.418 -5.936 14.080 1.00 0.00 H new ATOM 0 HG22 VAL B 61 6.248 -4.416 13.170 1.00 0.00 H new ATOM 0 HG23 VAL B 61 6.925 -4.397 14.816 1.00 0.00 H new ATOM 2785 N THR B 62 5.470 -1.634 13.288 1.00 0.00 N ATOM 2786 CA THR B 62 5.783 -1.000 11.989 1.00 0.00 C ATOM 2787 C THR B 62 7.318 -0.917 11.832 1.00 0.00 C ATOM 2788 O THR B 62 8.057 -0.922 12.828 1.00 0.00 O ATOM 2789 CB THR B 62 5.158 0.439 11.845 1.00 0.00 C ATOM 2790 OG1 THR B 62 5.446 1.215 13.017 1.00 0.00 O ATOM 2791 CG2 THR B 62 3.631 0.418 11.607 1.00 0.00 C ATOM 0 H THR B 62 6.142 -1.397 14.018 1.00 0.00 H new ATOM 0 HA THR B 62 5.343 -1.616 11.205 1.00 0.00 H new ATOM 0 HB THR B 62 5.614 0.890 10.964 1.00 0.00 H new ATOM 0 HG1 THR B 62 5.088 2.120 12.906 1.00 0.00 H new ATOM 0 HG21 THR B 62 3.263 1.440 11.517 1.00 0.00 H new ATOM 0 HG22 THR B 62 3.413 -0.129 10.689 1.00 0.00 H new ATOM 0 HG23 THR B 62 3.139 -0.072 12.447 1.00 0.00 H new ATOM 2799 N GLY B 63 7.782 -0.847 10.575 1.00 0.00 N ATOM 2800 CA GLY B 63 9.211 -0.791 10.257 1.00 0.00 C ATOM 2801 C GLY B 63 9.468 -1.302 8.851 1.00 0.00 C ATOM 2802 O GLY B 63 10.248 -0.719 8.087 1.00 0.00 O ATOM 0 H GLY B 63 7.176 -0.828 9.755 1.00 0.00 H new ATOM 0 HA2 GLY B 63 9.569 0.235 10.348 1.00 0.00 H new ATOM 0 HA3 GLY B 63 9.772 -1.389 10.975 1.00 0.00 H new ATOM 2806 N GLY B 64 8.797 -2.412 8.529 1.00 0.00 N ATOM 2807 CA GLY B 64 8.814 -3.006 7.196 1.00 0.00 C ATOM 2808 C GLY B 64 7.469 -3.637 6.869 1.00 0.00 C ATOM 2809 O GLY B 64 6.773 -4.125 7.773 1.00 0.00 O ATOM 0 H GLY B 64 8.222 -2.926 9.196 1.00 0.00 H new ATOM 0 HA2 GLY B 64 9.052 -2.242 6.456 1.00 0.00 H new ATOM 0 HA3 GLY B 64 9.598 -3.761 7.139 1.00 0.00 H new ATOM 2813 N GLY B 65 7.118 -3.643 5.578 1.00 0.00 N ATOM 2814 CA GLY B 65 5.811 -4.107 5.113 1.00 0.00 C ATOM 2815 C GLY B 65 4.909 -2.931 4.791 1.00 0.00 C ATOM 2816 O GLY B 65 4.689 -2.075 5.656 1.00 0.00 O ATOM 0 H GLY B 65 7.733 -3.326 4.829 1.00 0.00 H new ATOM 0 HA2 GLY B 65 5.935 -4.730 4.227 1.00 0.00 H new ATOM 0 HA3 GLY B 65 5.347 -4.729 5.878 1.00 0.00 H new ATOM 2820 N GLY B 66 4.442 -2.855 3.531 1.00 0.00 N ATOM 2821 CA GLY B 66 3.511 -1.817 3.101 1.00 0.00 C ATOM 2822 C GLY B 66 4.205 -0.477 2.892 1.00 0.00 C ATOM 2823 O GLY B 66 4.314 0.340 3.820 1.00 0.00 O ATOM 0 H GLY B 66 4.702 -3.510 2.794 1.00 0.00 H new ATOM 0 HA2 GLY B 66 3.029 -2.124 2.173 1.00 0.00 H new ATOM 0 HA3 GLY B 66 2.724 -1.705 3.847 1.00 0.00 H new ATOM 2827 N GLU B 67 4.681 -0.261 1.662 1.00 0.00 N ATOM 2828 CA GLU B 67 5.380 0.960 1.258 1.00 0.00 C ATOM 2829 C GLU B 67 4.420 1.848 0.453 1.00 0.00 C ATOM 2830 O GLU B 67 3.396 1.375 -0.069 1.00 0.00 O ATOM 2831 CB GLU B 67 6.634 0.637 0.382 1.00 0.00 C ATOM 2832 CG GLU B 67 7.454 -0.608 0.805 1.00 0.00 C ATOM 2833 CD GLU B 67 6.864 -1.954 0.324 1.00 0.00 C ATOM 2834 OE1 GLU B 67 7.086 -2.301 -0.849 1.00 0.00 O ATOM 2835 OE2 GLU B 67 6.210 -2.674 1.118 1.00 0.00 O ATOM 0 H GLU B 67 4.589 -0.942 0.908 1.00 0.00 H new ATOM 0 HA GLU B 67 5.715 1.475 2.158 1.00 0.00 H new ATOM 0 HB2 GLU B 67 6.307 0.500 -0.649 1.00 0.00 H new ATOM 0 HB3 GLU B 67 7.294 1.504 0.394 1.00 0.00 H new ATOM 0 HG2 GLU B 67 8.468 -0.510 0.416 1.00 0.00 H new ATOM 0 HG3 GLU B 67 7.530 -0.626 1.892 1.00 0.00 H new ATOM 2842 N LEU B 68 4.791 3.120 0.314 1.00 0.00 N ATOM 2843 CA LEU B 68 3.982 4.122 -0.370 1.00 0.00 C ATOM 2844 C LEU B 68 4.803 4.684 -1.536 1.00 0.00 C ATOM 2845 O LEU B 68 5.712 5.476 -1.298 1.00 0.00 O ATOM 2846 CB LEU B 68 3.561 5.227 0.635 1.00 0.00 C ATOM 2847 CG LEU B 68 2.536 6.271 0.105 1.00 0.00 C ATOM 2848 CD1 LEU B 68 1.214 5.594 -0.332 1.00 0.00 C ATOM 2849 CD2 LEU B 68 2.299 7.392 1.141 1.00 0.00 C ATOM 0 H LEU B 68 5.671 3.485 0.678 1.00 0.00 H new ATOM 0 HA LEU B 68 3.066 3.684 -0.768 1.00 0.00 H new ATOM 0 HB2 LEU B 68 3.138 4.747 1.518 1.00 0.00 H new ATOM 0 HB3 LEU B 68 4.457 5.757 0.959 1.00 0.00 H new ATOM 0 HG LEU B 68 2.961 6.737 -0.784 1.00 0.00 H new ATOM 0 HD11 LEU B 68 0.520 6.352 -0.697 1.00 0.00 H new ATOM 0 HD12 LEU B 68 1.418 4.876 -1.126 1.00 0.00 H new ATOM 0 HD13 LEU B 68 0.771 5.077 0.519 1.00 0.00 H new ATOM 0 HD21 LEU B 68 1.579 8.108 0.744 1.00 0.00 H new ATOM 0 HD22 LEU B 68 1.911 6.959 2.063 1.00 0.00 H new ATOM 0 HD23 LEU B 68 3.240 7.901 1.348 1.00 0.00 H new ATOM 2861 N ALA B 69 4.542 4.240 -2.767 1.00 0.00 N ATOM 2862 CA ALA B 69 5.407 4.561 -3.920 1.00 0.00 C ATOM 2863 C ALA B 69 4.973 5.881 -4.599 1.00 0.00 C ATOM 2864 O ALA B 69 3.917 5.952 -5.237 1.00 0.00 O ATOM 2865 CB ALA B 69 5.421 3.384 -4.907 1.00 0.00 C ATOM 0 H ALA B 69 3.739 3.656 -2.998 1.00 0.00 H new ATOM 0 HA ALA B 69 6.425 4.715 -3.563 1.00 0.00 H new ATOM 0 HB1 ALA B 69 6.061 3.628 -5.755 1.00 0.00 H new ATOM 0 HB2 ALA B 69 5.804 2.494 -4.407 1.00 0.00 H new ATOM 0 HB3 ALA B 69 4.408 3.193 -5.260 1.00 0.00 H new ATOM 2871 N PHE B 70 5.811 6.924 -4.439 1.00 0.00 N ATOM 2872 CA PHE B 70 5.623 8.263 -5.015 1.00 0.00 C ATOM 2873 C PHE B 70 6.227 8.287 -6.427 1.00 0.00 C ATOM 2874 O PHE B 70 7.438 8.091 -6.596 1.00 0.00 O ATOM 2875 CB PHE B 70 6.359 9.319 -4.139 1.00 0.00 C ATOM 2876 CG PHE B 70 5.816 9.533 -2.728 1.00 0.00 C ATOM 2877 CD1 PHE B 70 5.906 8.529 -1.767 1.00 0.00 C ATOM 2878 CD2 PHE B 70 5.234 10.746 -2.359 1.00 0.00 C ATOM 2879 CE1 PHE B 70 5.428 8.724 -0.490 1.00 0.00 C ATOM 2880 CE2 PHE B 70 4.757 10.938 -1.081 1.00 0.00 C ATOM 2881 CZ PHE B 70 4.851 9.925 -0.147 1.00 0.00 C ATOM 0 H PHE B 70 6.665 6.851 -3.886 1.00 0.00 H new ATOM 0 HA PHE B 70 4.559 8.496 -5.053 1.00 0.00 H new ATOM 0 HB2 PHE B 70 7.406 9.027 -4.061 1.00 0.00 H new ATOM 0 HB3 PHE B 70 6.333 10.274 -4.663 1.00 0.00 H new ATOM 0 HD1 PHE B 70 6.358 7.583 -2.027 1.00 0.00 H new ATOM 0 HD2 PHE B 70 5.157 11.543 -3.083 1.00 0.00 H new ATOM 0 HE1 PHE B 70 5.506 7.934 0.242 1.00 0.00 H new ATOM 0 HE2 PHE B 70 4.309 11.882 -0.809 1.00 0.00 H new ATOM 0 HZ PHE B 70 4.472 10.076 0.853 1.00 0.00 H new ATOM 2891 N ARG B 71 5.376 8.497 -7.437 1.00 0.00 N ATOM 2892 CA ARG B 71 5.800 8.531 -8.846 1.00 0.00 C ATOM 2893 C ARG B 71 6.048 9.978 -9.328 1.00 0.00 C ATOM 2894 O ARG B 71 5.193 10.863 -9.172 1.00 0.00 O ATOM 2895 CB ARG B 71 4.714 7.881 -9.748 1.00 0.00 C ATOM 2896 CG ARG B 71 4.147 6.513 -9.247 1.00 0.00 C ATOM 2897 CD ARG B 71 4.181 5.406 -10.325 1.00 0.00 C ATOM 2898 NE ARG B 71 3.747 5.867 -11.659 1.00 0.00 N ATOM 2899 CZ ARG B 71 2.481 6.004 -12.080 1.00 0.00 C ATOM 2900 NH1 ARG B 71 1.465 5.837 -11.261 1.00 0.00 N ATOM 2901 NH2 ARG B 71 2.248 6.344 -13.330 1.00 0.00 N ATOM 0 H ARG B 71 4.376 8.648 -7.304 1.00 0.00 H new ATOM 0 HA ARG B 71 6.733 7.972 -8.919 1.00 0.00 H new ATOM 0 HB2 ARG B 71 3.885 8.582 -9.850 1.00 0.00 H new ATOM 0 HB3 ARG B 71 5.133 7.737 -10.744 1.00 0.00 H new ATOM 0 HG2 ARG B 71 4.721 6.185 -8.381 1.00 0.00 H new ATOM 0 HG3 ARG B 71 3.119 6.654 -8.913 1.00 0.00 H new ATOM 0 HD2 ARG B 71 5.195 5.012 -10.398 1.00 0.00 H new ATOM 0 HD3 ARG B 71 3.541 4.582 -10.008 1.00 0.00 H new ATOM 0 HE ARG B 71 4.482 6.104 -12.325 1.00 0.00 H new ATOM 0 HH11 ARG B 71 1.632 5.598 -10.283 1.00 0.00 H new ATOM 0 HH12 ARG B 71 0.510 5.946 -11.604 1.00 0.00 H new ATOM 0 HH21 ARG B 71 3.027 6.501 -13.970 1.00 0.00 H new ATOM 0 HH22 ARG B 71 1.288 6.451 -13.659 1.00 0.00 H new ATOM 2915 N VAL B 72 7.261 10.192 -9.877 1.00 0.00 N ATOM 2916 CA VAL B 72 7.701 11.475 -10.461 1.00 0.00 C ATOM 2917 C VAL B 72 8.066 11.294 -11.946 1.00 0.00 C ATOM 2918 O VAL B 72 8.274 10.162 -12.413 1.00 0.00 O ATOM 2919 CB VAL B 72 8.966 12.050 -9.714 1.00 0.00 C ATOM 2920 CG1 VAL B 72 8.663 12.400 -8.244 1.00 0.00 C ATOM 2921 CG2 VAL B 72 10.174 11.082 -9.813 1.00 0.00 C ATOM 0 H VAL B 72 7.975 9.465 -9.928 1.00 0.00 H new ATOM 0 HA VAL B 72 6.870 12.172 -10.354 1.00 0.00 H new ATOM 0 HB VAL B 72 9.233 12.977 -10.221 1.00 0.00 H new ATOM 0 HG11 VAL B 72 9.563 12.792 -7.770 1.00 0.00 H new ATOM 0 HG12 VAL B 72 7.875 13.152 -8.204 1.00 0.00 H new ATOM 0 HG13 VAL B 72 8.336 11.504 -7.716 1.00 0.00 H new ATOM 0 HG21 VAL B 72 11.027 11.510 -9.287 1.00 0.00 H new ATOM 0 HG22 VAL B 72 9.912 10.126 -9.361 1.00 0.00 H new ATOM 0 HG23 VAL B 72 10.433 10.929 -10.861 1.00 0.00 H new ATOM 2931 N GLU B 73 8.127 12.426 -12.674 1.00 0.00 N ATOM 2932 CA GLU B 73 8.364 12.433 -14.130 1.00 0.00 C ATOM 2933 C GLU B 73 9.759 11.881 -14.528 1.00 0.00 C ATOM 2934 O GLU B 73 9.861 11.161 -15.531 1.00 0.00 O ATOM 2935 CB GLU B 73 8.153 13.857 -14.716 1.00 0.00 C ATOM 2936 CG GLU B 73 9.103 14.934 -14.164 1.00 0.00 C ATOM 2937 CD GLU B 73 8.934 16.305 -14.834 1.00 0.00 C ATOM 2938 OE1 GLU B 73 8.011 17.051 -14.450 1.00 0.00 O ATOM 2939 OE2 GLU B 73 9.719 16.634 -15.749 1.00 0.00 O ATOM 0 H GLU B 73 8.014 13.356 -12.272 1.00 0.00 H new ATOM 0 HA GLU B 73 7.628 11.754 -14.562 1.00 0.00 H new ATOM 0 HB2 GLU B 73 8.272 13.809 -15.798 1.00 0.00 H new ATOM 0 HB3 GLU B 73 7.126 14.165 -14.521 1.00 0.00 H new ATOM 0 HG2 GLU B 73 8.935 15.040 -13.092 1.00 0.00 H new ATOM 0 HG3 GLU B 73 10.132 14.600 -14.294 1.00 0.00 H new ATOM 2946 N ASN B 74 10.826 12.195 -13.743 1.00 0.00 N ATOM 2947 CA ASN B 74 12.199 11.721 -14.054 1.00 0.00 C ATOM 2948 C ASN B 74 13.146 11.850 -12.845 1.00 0.00 C ATOM 2949 O ASN B 74 12.742 12.303 -11.767 1.00 0.00 O ATOM 2950 CB ASN B 74 12.798 12.484 -15.279 1.00 0.00 C ATOM 2951 CG ASN B 74 13.179 13.941 -14.981 1.00 0.00 C ATOM 2952 OD1 ASN B 74 14.296 14.225 -14.553 1.00 0.00 O ATOM 2953 ND2 ASN B 74 12.269 14.871 -15.210 1.00 0.00 N ATOM 0 H ASN B 74 10.761 12.767 -12.901 1.00 0.00 H new ATOM 0 HA ASN B 74 12.112 10.663 -14.303 1.00 0.00 H new ATOM 0 HB2 ASN B 74 13.683 11.952 -15.628 1.00 0.00 H new ATOM 0 HB3 ASN B 74 12.074 12.468 -16.094 1.00 0.00 H new ATOM 0 HD21 ASN B 74 12.486 15.852 -15.032 1.00 0.00 H new ATOM 0 HD22 ASN B 74 11.350 14.608 -15.565 1.00 0.00 H new ATOM 2960 N ASP B 75 14.413 11.429 -13.067 1.00 0.00 N ATOM 2961 CA ASP B 75 15.430 11.192 -12.014 1.00 0.00 C ATOM 2962 C ASP B 75 15.719 12.441 -11.176 1.00 0.00 C ATOM 2963 O ASP B 75 16.041 12.343 -9.984 1.00 0.00 O ATOM 2964 CB ASP B 75 16.733 10.648 -12.653 1.00 0.00 C ATOM 2965 CG ASP B 75 17.350 11.617 -13.683 1.00 0.00 C ATOM 2966 OD1 ASP B 75 16.878 11.647 -14.840 1.00 0.00 O ATOM 2967 OD2 ASP B 75 18.306 12.344 -13.346 1.00 0.00 O ATOM 0 H ASP B 75 14.765 11.240 -14.005 1.00 0.00 H new ATOM 0 HA ASP B 75 15.021 10.449 -11.329 1.00 0.00 H new ATOM 0 HB2 ASP B 75 17.462 10.450 -11.867 1.00 0.00 H new ATOM 0 HB3 ASP B 75 16.522 9.696 -13.139 1.00 0.00 H new ATOM 2972 N ALA B 76 15.610 13.610 -11.831 1.00 0.00 N ATOM 2973 CA ALA B 76 15.858 14.917 -11.207 1.00 0.00 C ATOM 2974 C ALA B 76 14.875 15.151 -10.057 1.00 0.00 C ATOM 2975 O ALA B 76 15.265 15.487 -8.945 1.00 0.00 O ATOM 2976 CB ALA B 76 15.745 16.040 -12.256 1.00 0.00 C ATOM 0 H ALA B 76 15.346 13.673 -12.814 1.00 0.00 H new ATOM 0 HA ALA B 76 16.870 14.926 -10.802 1.00 0.00 H new ATOM 0 HB1 ALA B 76 15.931 17.003 -11.780 1.00 0.00 H new ATOM 0 HB2 ALA B 76 16.480 15.877 -13.044 1.00 0.00 H new ATOM 0 HB3 ALA B 76 14.744 16.036 -12.687 1.00 0.00 H new ATOM 2982 N GLN B 77 13.593 14.884 -10.356 1.00 0.00 N ATOM 2983 CA GLN B 77 12.467 15.091 -9.432 1.00 0.00 C ATOM 2984 C GLN B 77 12.507 14.162 -8.213 1.00 0.00 C ATOM 2985 O GLN B 77 11.871 14.442 -7.199 1.00 0.00 O ATOM 2986 CB GLN B 77 11.134 14.937 -10.198 1.00 0.00 C ATOM 2987 CG GLN B 77 10.991 15.901 -11.382 1.00 0.00 C ATOM 2988 CD GLN B 77 11.035 17.383 -10.995 1.00 0.00 C ATOM 2989 OE1 GLN B 77 10.601 17.778 -9.912 1.00 0.00 O ATOM 2990 NE2 GLN B 77 11.564 18.212 -11.880 1.00 0.00 N ATOM 0 H GLN B 77 13.306 14.512 -11.261 1.00 0.00 H new ATOM 0 HA GLN B 77 12.552 16.104 -9.039 1.00 0.00 H new ATOM 0 HB2 GLN B 77 11.050 13.913 -10.562 1.00 0.00 H new ATOM 0 HB3 GLN B 77 10.307 15.099 -9.507 1.00 0.00 H new ATOM 0 HG2 GLN B 77 11.788 15.700 -12.098 1.00 0.00 H new ATOM 0 HG3 GLN B 77 10.048 15.698 -11.890 1.00 0.00 H new ATOM 0 HE21 GLN B 77 11.915 17.854 -12.768 1.00 0.00 H new ATOM 0 HE22 GLN B 77 11.621 19.209 -11.674 1.00 0.00 H new ATOM 2999 N VAL B 78 13.262 13.060 -8.329 1.00 0.00 N ATOM 3000 CA VAL B 78 13.528 12.144 -7.198 1.00 0.00 C ATOM 3001 C VAL B 78 14.430 12.855 -6.153 1.00 0.00 C ATOM 3002 O VAL B 78 14.173 12.811 -4.944 1.00 0.00 O ATOM 3003 CB VAL B 78 14.231 10.813 -7.672 1.00 0.00 C ATOM 3004 CG1 VAL B 78 14.471 9.834 -6.497 1.00 0.00 C ATOM 3005 CG2 VAL B 78 13.430 10.124 -8.793 1.00 0.00 C ATOM 0 H VAL B 78 13.706 12.775 -9.202 1.00 0.00 H new ATOM 0 HA VAL B 78 12.568 11.879 -6.754 1.00 0.00 H new ATOM 0 HB VAL B 78 15.205 11.097 -8.071 1.00 0.00 H new ATOM 0 HG11 VAL B 78 14.957 8.932 -6.869 1.00 0.00 H new ATOM 0 HG12 VAL B 78 15.109 10.309 -5.752 1.00 0.00 H new ATOM 0 HG13 VAL B 78 13.516 9.571 -6.042 1.00 0.00 H new ATOM 0 HG21 VAL B 78 13.941 9.210 -9.097 1.00 0.00 H new ATOM 0 HG22 VAL B 78 12.433 9.878 -8.429 1.00 0.00 H new ATOM 0 HG23 VAL B 78 13.349 10.796 -9.648 1.00 0.00 H new ATOM 3015 N ASP B 79 15.469 13.537 -6.684 1.00 0.00 N ATOM 3016 CA ASP B 79 16.464 14.322 -5.906 1.00 0.00 C ATOM 3017 C ASP B 79 15.837 15.605 -5.325 1.00 0.00 C ATOM 3018 O ASP B 79 16.215 16.061 -4.240 1.00 0.00 O ATOM 3019 CB ASP B 79 17.655 14.673 -6.845 1.00 0.00 C ATOM 3020 CG ASP B 79 18.820 15.439 -6.179 1.00 0.00 C ATOM 3021 OD1 ASP B 79 18.735 16.671 -6.006 1.00 0.00 O ATOM 3022 OD2 ASP B 79 19.845 14.814 -5.853 1.00 0.00 O ATOM 0 H ASP B 79 15.647 13.560 -7.688 1.00 0.00 H new ATOM 0 HA ASP B 79 16.814 13.726 -5.063 1.00 0.00 H new ATOM 0 HB2 ASP B 79 18.046 13.748 -7.269 1.00 0.00 H new ATOM 0 HB3 ASP B 79 17.277 15.270 -7.675 1.00 0.00 H new ATOM 3027 N GLU B 80 14.887 16.175 -6.075 1.00 0.00 N ATOM 3028 CA GLU B 80 14.149 17.387 -5.672 1.00 0.00 C ATOM 3029 C GLU B 80 13.293 17.090 -4.428 1.00 0.00 C ATOM 3030 O GLU B 80 13.289 17.842 -3.447 1.00 0.00 O ATOM 3031 CB GLU B 80 13.259 17.854 -6.847 1.00 0.00 C ATOM 3032 CG GLU B 80 14.026 18.256 -8.134 1.00 0.00 C ATOM 3033 CD GLU B 80 14.526 19.709 -8.121 1.00 0.00 C ATOM 3034 OE1 GLU B 80 13.709 20.626 -8.358 1.00 0.00 O ATOM 3035 OE2 GLU B 80 15.730 19.947 -7.872 1.00 0.00 O ATOM 0 H GLU B 80 14.604 15.810 -6.984 1.00 0.00 H new ATOM 0 HA GLU B 80 14.853 18.181 -5.422 1.00 0.00 H new ATOM 0 HB2 GLU B 80 12.561 17.054 -7.094 1.00 0.00 H new ATOM 0 HB3 GLU B 80 12.664 18.706 -6.516 1.00 0.00 H new ATOM 0 HG2 GLU B 80 14.878 17.588 -8.263 1.00 0.00 H new ATOM 0 HG3 GLU B 80 13.374 18.112 -8.996 1.00 0.00 H new ATOM 3042 N THR B 81 12.580 15.955 -4.502 1.00 0.00 N ATOM 3043 CA THR B 81 11.724 15.455 -3.422 1.00 0.00 C ATOM 3044 C THR B 81 12.570 14.990 -2.219 1.00 0.00 C ATOM 3045 O THR B 81 12.147 15.132 -1.068 1.00 0.00 O ATOM 3046 CB THR B 81 10.831 14.299 -3.955 1.00 0.00 C ATOM 3047 OG1 THR B 81 10.158 14.749 -5.135 1.00 0.00 O ATOM 3048 CG2 THR B 81 9.781 13.838 -2.940 1.00 0.00 C ATOM 0 H THR B 81 12.584 15.353 -5.326 1.00 0.00 H new ATOM 0 HA THR B 81 11.082 16.265 -3.077 1.00 0.00 H new ATOM 0 HB THR B 81 11.484 13.450 -4.158 1.00 0.00 H new ATOM 0 HG1 THR B 81 10.662 14.466 -5.927 1.00 0.00 H new ATOM 0 HG21 THR B 81 9.189 13.030 -3.370 1.00 0.00 H new ATOM 0 HG22 THR B 81 10.279 13.483 -2.038 1.00 0.00 H new ATOM 0 HG23 THR B 81 9.127 14.673 -2.689 1.00 0.00 H new ATOM 3056 N PHE B 82 13.787 14.469 -2.509 1.00 0.00 N ATOM 3057 CA PHE B 82 14.786 14.104 -1.482 1.00 0.00 C ATOM 3058 C PHE B 82 15.086 15.334 -0.604 1.00 0.00 C ATOM 3059 O PHE B 82 14.879 15.326 0.606 1.00 0.00 O ATOM 3060 CB PHE B 82 16.084 13.568 -2.164 1.00 0.00 C ATOM 3061 CG PHE B 82 17.219 13.116 -1.217 1.00 0.00 C ATOM 3062 CD1 PHE B 82 18.030 14.039 -0.547 1.00 0.00 C ATOM 3063 CD2 PHE B 82 17.493 11.766 -1.020 1.00 0.00 C ATOM 3064 CE1 PHE B 82 19.056 13.626 0.277 1.00 0.00 C ATOM 3065 CE2 PHE B 82 18.525 11.355 -0.197 1.00 0.00 C ATOM 3066 CZ PHE B 82 19.305 12.286 0.451 1.00 0.00 C ATOM 0 H PHE B 82 14.101 14.291 -3.463 1.00 0.00 H new ATOM 0 HA PHE B 82 14.390 13.311 -0.848 1.00 0.00 H new ATOM 0 HB2 PHE B 82 15.813 12.725 -2.800 1.00 0.00 H new ATOM 0 HB3 PHE B 82 16.474 14.348 -2.818 1.00 0.00 H new ATOM 0 HD1 PHE B 82 17.849 15.096 -0.678 1.00 0.00 H new ATOM 0 HD2 PHE B 82 16.887 11.025 -1.520 1.00 0.00 H new ATOM 0 HE1 PHE B 82 19.665 14.358 0.787 1.00 0.00 H new ATOM 0 HE2 PHE B 82 18.720 10.301 -0.062 1.00 0.00 H new ATOM 0 HZ PHE B 82 20.110 11.964 1.094 1.00 0.00 H new ATOM 3076 N ALA B 83 15.529 16.403 -1.287 1.00 0.00 N ATOM 3077 CA ALA B 83 16.002 17.648 -0.663 1.00 0.00 C ATOM 3078 C ALA B 83 14.919 18.332 0.190 1.00 0.00 C ATOM 3079 O ALA B 83 15.188 18.758 1.319 1.00 0.00 O ATOM 3080 CB ALA B 83 16.501 18.604 -1.757 1.00 0.00 C ATOM 0 H ALA B 83 15.569 16.425 -2.306 1.00 0.00 H new ATOM 0 HA ALA B 83 16.817 17.392 0.014 1.00 0.00 H new ATOM 0 HB1 ALA B 83 16.853 19.529 -1.299 1.00 0.00 H new ATOM 0 HB2 ALA B 83 17.319 18.136 -2.304 1.00 0.00 H new ATOM 0 HB3 ALA B 83 15.685 18.827 -2.445 1.00 0.00 H new ATOM 3086 N GLY B 84 13.704 18.428 -0.373 1.00 0.00 N ATOM 3087 CA GLY B 84 12.569 19.074 0.296 1.00 0.00 C ATOM 3088 C GLY B 84 12.102 18.348 1.560 1.00 0.00 C ATOM 3089 O GLY B 84 11.863 18.984 2.593 1.00 0.00 O ATOM 0 H GLY B 84 13.484 18.062 -1.299 1.00 0.00 H new ATOM 0 HA2 GLY B 84 12.846 20.095 0.556 1.00 0.00 H new ATOM 0 HA3 GLY B 84 11.736 19.138 -0.404 1.00 0.00 H new ATOM 3093 N TRP B 85 12.000 17.007 1.479 1.00 0.00 N ATOM 3094 CA TRP B 85 11.648 16.148 2.636 1.00 0.00 C ATOM 3095 C TRP B 85 12.727 16.266 3.722 1.00 0.00 C ATOM 3096 O TRP B 85 12.403 16.341 4.914 1.00 0.00 O ATOM 3097 CB TRP B 85 11.491 14.690 2.175 1.00 0.00 C ATOM 3098 CG TRP B 85 10.256 14.401 1.362 1.00 0.00 C ATOM 3099 CD1 TRP B 85 9.405 15.291 0.753 1.00 0.00 C ATOM 3100 CD2 TRP B 85 9.743 13.104 1.072 1.00 0.00 C ATOM 3101 NE1 TRP B 85 8.400 14.616 0.120 1.00 0.00 N ATOM 3102 CE2 TRP B 85 8.589 13.273 0.297 1.00 0.00 C ATOM 3103 CE3 TRP B 85 10.155 11.816 1.395 1.00 0.00 C ATOM 3104 CZ2 TRP B 85 7.838 12.202 -0.152 1.00 0.00 C ATOM 3105 CZ3 TRP B 85 9.410 10.752 0.948 1.00 0.00 C ATOM 3106 CH2 TRP B 85 8.265 10.949 0.182 1.00 0.00 C ATOM 0 H TRP B 85 12.158 16.487 0.616 1.00 0.00 H new ATOM 0 HA TRP B 85 10.699 16.479 3.058 1.00 0.00 H new ATOM 0 HB2 TRP B 85 12.366 14.416 1.586 1.00 0.00 H new ATOM 0 HB3 TRP B 85 11.485 14.047 3.055 1.00 0.00 H new ATOM 0 HD1 TRP B 85 9.514 16.365 0.772 1.00 0.00 H new ATOM 0 HE1 TRP B 85 7.634 15.044 -0.400 1.00 0.00 H new ATOM 0 HE3 TRP B 85 11.044 11.655 1.986 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 6.947 12.351 -0.744 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 9.718 9.747 1.195 1.00 0.00 H new ATOM 0 HH2 TRP B 85 7.702 10.092 -0.156 1.00 0.00 H new ATOM 3117 N LYS B 86 13.999 16.231 3.294 1.00 0.00 N ATOM 3118 CA LYS B 86 15.167 16.341 4.189 1.00 0.00 C ATOM 3119 C LYS B 86 15.097 17.644 5.000 1.00 0.00 C ATOM 3120 O LYS B 86 15.262 17.638 6.225 1.00 0.00 O ATOM 3121 CB LYS B 86 16.460 16.271 3.344 1.00 0.00 C ATOM 3122 CG LYS B 86 17.782 16.450 4.113 1.00 0.00 C ATOM 3123 CD LYS B 86 19.026 16.279 3.203 1.00 0.00 C ATOM 3124 CE LYS B 86 18.919 17.076 1.882 1.00 0.00 C ATOM 3125 NZ LYS B 86 20.178 17.052 1.107 1.00 0.00 N ATOM 0 H LYS B 86 14.250 16.125 2.311 1.00 0.00 H new ATOM 0 HA LYS B 86 15.168 15.514 4.899 1.00 0.00 H new ATOM 0 HB2 LYS B 86 16.486 15.307 2.836 1.00 0.00 H new ATOM 0 HB3 LYS B 86 16.406 17.037 2.571 1.00 0.00 H new ATOM 0 HG2 LYS B 86 17.802 17.440 4.569 1.00 0.00 H new ATOM 0 HG3 LYS B 86 17.827 15.724 4.925 1.00 0.00 H new ATOM 0 HD2 LYS B 86 19.914 16.602 3.746 1.00 0.00 H new ATOM 0 HD3 LYS B 86 19.160 15.222 2.974 1.00 0.00 H new ATOM 0 HE2 LYS B 86 18.114 16.662 1.275 1.00 0.00 H new ATOM 0 HE3 LYS B 86 18.652 18.109 2.104 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 19.987 17.338 0.126 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 20.861 17.711 1.533 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 20.573 16.090 1.116 1.00 0.00 H new ATOM 3139 N ALA B 87 14.786 18.737 4.286 1.00 0.00 N ATOM 3140 CA ALA B 87 14.680 20.085 4.860 1.00 0.00 C ATOM 3141 C ALA B 87 13.478 20.210 5.815 1.00 0.00 C ATOM 3142 O ALA B 87 13.495 21.015 6.749 1.00 0.00 O ATOM 3143 CB ALA B 87 14.585 21.115 3.726 1.00 0.00 C ATOM 0 H ALA B 87 14.599 18.708 3.284 1.00 0.00 H new ATOM 0 HA ALA B 87 15.575 20.277 5.452 1.00 0.00 H new ATOM 0 HB1 ALA B 87 14.506 22.116 4.150 1.00 0.00 H new ATOM 0 HB2 ALA B 87 15.477 21.054 3.103 1.00 0.00 H new ATOM 0 HB3 ALA B 87 13.704 20.908 3.119 1.00 0.00 H new ATOM 3149 N SER B 88 12.444 19.381 5.571 1.00 0.00 N ATOM 3150 CA SER B 88 11.175 19.402 6.329 1.00 0.00 C ATOM 3151 C SER B 88 11.180 18.394 7.511 1.00 0.00 C ATOM 3152 O SER B 88 10.298 18.435 8.378 1.00 0.00 O ATOM 3153 CB SER B 88 9.999 19.097 5.357 1.00 0.00 C ATOM 3154 OG SER B 88 8.730 19.276 5.970 1.00 0.00 O ATOM 0 H SER B 88 12.465 18.673 4.837 1.00 0.00 H new ATOM 0 HA SER B 88 11.053 20.394 6.764 1.00 0.00 H new ATOM 0 HB2 SER B 88 10.074 19.747 4.485 1.00 0.00 H new ATOM 0 HB3 SER B 88 10.085 18.071 4.998 1.00 0.00 H new ATOM 0 HG SER B 88 8.793 19.056 6.923 1.00 0.00 H new ATOM 3160 N GLY B 89 12.211 17.517 7.545 1.00 0.00 N ATOM 3161 CA GLY B 89 12.472 16.644 8.698 1.00 0.00 C ATOM 3162 C GLY B 89 11.930 15.226 8.541 1.00 0.00 C ATOM 3163 O GLY B 89 11.096 14.783 9.335 1.00 0.00 O ATOM 0 H GLY B 89 12.875 17.400 6.779 1.00 0.00 H new ATOM 0 HA2 GLY B 89 13.548 16.594 8.866 1.00 0.00 H new ATOM 0 HA3 GLY B 89 12.031 17.094 9.588 1.00 0.00 H new ATOM 3167 N VAL B 90 12.387 14.520 7.492 1.00 0.00 N ATOM 3168 CA VAL B 90 12.140 13.065 7.326 1.00 0.00 C ATOM 3169 C VAL B 90 13.443 12.288 7.670 1.00 0.00 C ATOM 3170 O VAL B 90 14.541 12.790 7.389 1.00 0.00 O ATOM 3171 CB VAL B 90 11.633 12.733 5.862 1.00 0.00 C ATOM 3172 CG1 VAL B 90 12.771 12.764 4.824 1.00 0.00 C ATOM 3173 CG2 VAL B 90 10.874 11.384 5.801 1.00 0.00 C ATOM 0 H VAL B 90 12.935 14.932 6.737 1.00 0.00 H new ATOM 0 HA VAL B 90 11.350 12.752 8.009 1.00 0.00 H new ATOM 0 HB VAL B 90 10.931 13.525 5.602 1.00 0.00 H new ATOM 0 HG11 VAL B 90 12.370 12.530 3.838 1.00 0.00 H new ATOM 0 HG12 VAL B 90 13.221 13.757 4.807 1.00 0.00 H new ATOM 0 HG13 VAL B 90 13.528 12.027 5.092 1.00 0.00 H new ATOM 0 HG21 VAL B 90 10.545 11.198 4.779 1.00 0.00 H new ATOM 0 HG22 VAL B 90 11.536 10.579 6.122 1.00 0.00 H new ATOM 0 HG23 VAL B 90 10.006 11.425 6.460 1.00 0.00 H new ATOM 3183 N ALA B 91 13.322 11.083 8.282 1.00 0.00 N ATOM 3184 CA ALA B 91 14.492 10.273 8.733 1.00 0.00 C ATOM 3185 C ALA B 91 15.385 9.871 7.549 1.00 0.00 C ATOM 3186 O ALA B 91 16.601 10.088 7.593 1.00 0.00 O ATOM 3187 CB ALA B 91 14.036 9.034 9.513 1.00 0.00 C ATOM 0 H ALA B 91 12.422 10.645 8.477 1.00 0.00 H new ATOM 0 HA ALA B 91 15.085 10.898 9.401 1.00 0.00 H new ATOM 0 HB1 ALA B 91 14.908 8.462 9.830 1.00 0.00 H new ATOM 0 HB2 ALA B 91 13.468 9.345 10.390 1.00 0.00 H new ATOM 0 HB3 ALA B 91 13.407 8.413 8.875 1.00 0.00 H new ATOM 3193 N MET B 92 14.762 9.263 6.511 1.00 0.00 N ATOM 3194 CA MET B 92 15.384 9.090 5.178 1.00 0.00 C ATOM 3195 C MET B 92 16.618 8.153 5.201 1.00 0.00 C ATOM 3196 O MET B 92 17.759 8.613 5.352 1.00 0.00 O ATOM 3197 CB MET B 92 15.735 10.476 4.565 1.00 0.00 C ATOM 3198 CG MET B 92 16.450 10.430 3.215 1.00 0.00 C ATOM 3199 SD MET B 92 17.011 12.053 2.691 1.00 0.00 S ATOM 3200 CE MET B 92 15.461 12.866 2.346 1.00 0.00 C ATOM 0 H MET B 92 13.819 8.881 6.574 1.00 0.00 H new ATOM 0 HA MET B 92 14.649 8.598 4.542 1.00 0.00 H new ATOM 0 HB2 MET B 92 14.814 11.048 4.451 1.00 0.00 H new ATOM 0 HB3 MET B 92 16.362 11.019 5.272 1.00 0.00 H new ATOM 0 HG2 MET B 92 17.304 9.756 3.281 1.00 0.00 H new ATOM 0 HG3 MET B 92 15.777 10.019 2.463 1.00 0.00 H new ATOM 0 HE1 MET B 92 15.471 13.252 1.327 1.00 0.00 H new ATOM 0 HE2 MET B 92 14.644 12.153 2.456 1.00 0.00 H new ATOM 0 HE3 MET B 92 15.319 13.691 3.044 1.00 0.00 H new ATOM 3210 N LEU B 93 16.386 6.827 5.129 1.00 0.00 N ATOM 3211 CA LEU B 93 17.485 5.833 5.058 1.00 0.00 C ATOM 3212 C LEU B 93 17.432 5.046 3.723 1.00 0.00 C ATOM 3213 O LEU B 93 16.887 3.937 3.649 1.00 0.00 O ATOM 3214 CB LEU B 93 17.534 4.888 6.331 1.00 0.00 C ATOM 3215 CG LEU B 93 16.214 4.597 7.140 1.00 0.00 C ATOM 3216 CD1 LEU B 93 15.758 5.815 7.972 1.00 0.00 C ATOM 3217 CD2 LEU B 93 15.080 4.066 6.238 1.00 0.00 C ATOM 0 H LEU B 93 15.452 6.417 5.118 1.00 0.00 H new ATOM 0 HA LEU B 93 18.427 6.381 5.071 1.00 0.00 H new ATOM 0 HB2 LEU B 93 17.936 3.928 6.008 1.00 0.00 H new ATOM 0 HB3 LEU B 93 18.254 5.317 7.027 1.00 0.00 H new ATOM 0 HG LEU B 93 16.457 3.802 7.846 1.00 0.00 H new ATOM 0 HD11 LEU B 93 14.844 5.566 8.512 1.00 0.00 H new ATOM 0 HD12 LEU B 93 16.539 6.082 8.684 1.00 0.00 H new ATOM 0 HD13 LEU B 93 15.568 6.659 7.308 1.00 0.00 H new ATOM 0 HD21 LEU B 93 14.192 3.881 6.842 1.00 0.00 H new ATOM 0 HD22 LEU B 93 14.849 4.805 5.470 1.00 0.00 H new ATOM 0 HD23 LEU B 93 15.397 3.137 5.764 1.00 0.00 H new ATOM 3229 N GLN B 94 18.033 5.663 2.684 1.00 0.00 N ATOM 3230 CA GLN B 94 18.273 5.072 1.348 1.00 0.00 C ATOM 3231 C GLN B 94 18.916 6.140 0.458 1.00 0.00 C ATOM 3232 O GLN B 94 18.340 7.222 0.275 1.00 0.00 O ATOM 3233 CB GLN B 94 16.976 4.525 0.671 1.00 0.00 C ATOM 3234 CG GLN B 94 17.106 4.021 -0.794 1.00 0.00 C ATOM 3235 CD GLN B 94 18.036 2.821 -0.991 1.00 0.00 C ATOM 3236 OE1 GLN B 94 18.220 1.996 -0.097 1.00 0.00 O ATOM 3237 NE2 GLN B 94 18.606 2.703 -2.186 1.00 0.00 N ATOM 0 H GLN B 94 18.377 6.621 2.754 1.00 0.00 H new ATOM 0 HA GLN B 94 18.932 4.213 1.477 1.00 0.00 H new ATOM 0 HB2 GLN B 94 16.596 3.704 1.280 1.00 0.00 H new ATOM 0 HB3 GLN B 94 16.224 5.313 0.693 1.00 0.00 H new ATOM 0 HG2 GLN B 94 16.114 3.755 -1.159 1.00 0.00 H new ATOM 0 HG3 GLN B 94 17.464 4.843 -1.414 1.00 0.00 H new ATOM 0 HE21 GLN B 94 18.432 3.405 -2.905 1.00 0.00 H new ATOM 0 HE22 GLN B 94 19.217 1.910 -2.384 1.00 0.00 H new ATOM 3246 N GLN B 95 20.112 5.843 -0.063 1.00 0.00 N ATOM 3247 CA GLN B 95 20.770 6.666 -1.071 1.00 0.00 C ATOM 3248 C GLN B 95 20.123 6.366 -2.446 1.00 0.00 C ATOM 3249 O GLN B 95 20.122 5.205 -2.871 1.00 0.00 O ATOM 3250 CB GLN B 95 22.298 6.386 -1.093 1.00 0.00 C ATOM 3251 CG GLN B 95 23.021 6.676 0.238 1.00 0.00 C ATOM 3252 CD GLN B 95 24.543 6.524 0.139 1.00 0.00 C ATOM 3253 OE1 GLN B 95 25.092 5.446 0.367 1.00 0.00 O ATOM 3254 NE2 GLN B 95 25.234 7.600 -0.217 1.00 0.00 N ATOM 0 H GLN B 95 20.649 5.019 0.208 1.00 0.00 H new ATOM 0 HA GLN B 95 20.641 7.722 -0.834 1.00 0.00 H new ATOM 0 HB2 GLN B 95 22.459 5.341 -1.359 1.00 0.00 H new ATOM 0 HB3 GLN B 95 22.754 6.989 -1.878 1.00 0.00 H new ATOM 0 HG2 GLN B 95 22.783 7.689 0.561 1.00 0.00 H new ATOM 0 HG3 GLN B 95 22.643 6.000 1.005 1.00 0.00 H new ATOM 0 HE21 GLN B 95 24.750 8.479 -0.399 1.00 0.00 H new ATOM 0 HE22 GLN B 95 26.249 7.547 -0.308 1.00 0.00 H new ATOM 3263 N PRO B 96 19.506 7.396 -3.122 1.00 0.00 N ATOM 3264 CA PRO B 96 18.850 7.240 -4.448 1.00 0.00 C ATOM 3265 C PRO B 96 19.764 6.544 -5.484 1.00 0.00 C ATOM 3266 O PRO B 96 20.705 7.146 -6.003 1.00 0.00 O ATOM 3267 CB PRO B 96 18.509 8.694 -4.865 1.00 0.00 C ATOM 3268 CG PRO B 96 18.401 9.444 -3.577 1.00 0.00 C ATOM 3269 CD PRO B 96 19.383 8.789 -2.626 1.00 0.00 C ATOM 0 HA PRO B 96 17.971 6.598 -4.397 1.00 0.00 H new ATOM 0 HB2 PRO B 96 19.285 9.115 -5.504 1.00 0.00 H new ATOM 0 HB3 PRO B 96 17.576 8.736 -5.427 1.00 0.00 H new ATOM 0 HG2 PRO B 96 18.640 10.498 -3.719 1.00 0.00 H new ATOM 0 HG3 PRO B 96 17.386 9.397 -3.183 1.00 0.00 H new ATOM 0 HD2 PRO B 96 20.346 9.300 -2.635 1.00 0.00 H new ATOM 0 HD3 PRO B 96 19.018 8.814 -1.599 1.00 0.00 H new ATOM 3277 N ALA B 97 19.491 5.251 -5.726 1.00 0.00 N ATOM 3278 CA ALA B 97 20.305 4.387 -6.595 1.00 0.00 C ATOM 3279 C ALA B 97 19.549 4.076 -7.892 1.00 0.00 C ATOM 3280 O ALA B 97 18.330 3.873 -7.865 1.00 0.00 O ATOM 3281 CB ALA B 97 20.657 3.093 -5.840 1.00 0.00 C ATOM 0 H ALA B 97 18.689 4.771 -5.318 1.00 0.00 H new ATOM 0 HA ALA B 97 21.228 4.902 -6.861 1.00 0.00 H new ATOM 0 HB1 ALA B 97 21.260 2.450 -6.481 1.00 0.00 H new ATOM 0 HB2 ALA B 97 21.220 3.339 -4.940 1.00 0.00 H new ATOM 0 HB3 ALA B 97 19.740 2.572 -5.564 1.00 0.00 H new ATOM 3287 N LYS B 98 20.270 4.060 -9.024 1.00 0.00 N ATOM 3288 CA LYS B 98 19.692 3.695 -10.320 1.00 0.00 C ATOM 3289 C LYS B 98 19.512 2.163 -10.373 1.00 0.00 C ATOM 3290 O LYS B 98 20.481 1.427 -10.579 1.00 0.00 O ATOM 3291 CB LYS B 98 20.591 4.203 -11.506 1.00 0.00 C ATOM 3292 CG LYS B 98 19.836 4.910 -12.668 1.00 0.00 C ATOM 3293 CD LYS B 98 18.499 4.228 -13.045 1.00 0.00 C ATOM 3294 CE LYS B 98 17.894 4.780 -14.342 1.00 0.00 C ATOM 3295 NZ LYS B 98 17.652 6.247 -14.280 1.00 0.00 N ATOM 0 H LYS B 98 21.261 4.298 -9.064 1.00 0.00 H new ATOM 0 HA LYS B 98 18.720 4.176 -10.430 1.00 0.00 H new ATOM 0 HB2 LYS B 98 21.333 4.894 -11.106 1.00 0.00 H new ATOM 0 HB3 LYS B 98 21.136 3.352 -11.915 1.00 0.00 H new ATOM 0 HG2 LYS B 98 19.640 5.944 -12.386 1.00 0.00 H new ATOM 0 HG3 LYS B 98 20.481 4.936 -13.546 1.00 0.00 H new ATOM 0 HD2 LYS B 98 18.661 3.156 -13.153 1.00 0.00 H new ATOM 0 HD3 LYS B 98 17.786 4.362 -12.231 1.00 0.00 H new ATOM 0 HE2 LYS B 98 18.564 4.561 -15.173 1.00 0.00 H new ATOM 0 HE3 LYS B 98 16.954 4.268 -14.547 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 17.920 6.682 -15.186 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 16.644 6.425 -14.096 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 18.222 6.661 -13.515 1.00 0.00 H new ATOM 3309 N MET B 99 18.278 1.707 -10.146 1.00 0.00 N ATOM 3310 CA MET B 99 17.918 0.276 -10.192 1.00 0.00 C ATOM 3311 C MET B 99 17.320 -0.057 -11.576 1.00 0.00 C ATOM 3312 O MET B 99 16.925 0.853 -12.317 1.00 0.00 O ATOM 3313 CB MET B 99 16.928 -0.042 -9.028 1.00 0.00 C ATOM 3314 CG MET B 99 16.619 -1.532 -8.818 1.00 0.00 C ATOM 3315 SD MET B 99 15.560 -1.848 -7.395 1.00 0.00 S ATOM 3316 CE MET B 99 16.613 -1.389 -6.024 1.00 0.00 C ATOM 0 H MET B 99 17.492 2.318 -9.923 1.00 0.00 H new ATOM 0 HA MET B 99 18.801 -0.348 -10.056 1.00 0.00 H new ATOM 0 HB2 MET B 99 17.340 0.361 -8.103 1.00 0.00 H new ATOM 0 HB3 MET B 99 15.992 0.483 -9.216 1.00 0.00 H new ATOM 0 HG2 MET B 99 16.139 -1.926 -9.714 1.00 0.00 H new ATOM 0 HG3 MET B 99 17.555 -2.076 -8.693 1.00 0.00 H new ATOM 0 HE1 MET B 99 16.744 -2.246 -5.363 1.00 0.00 H new ATOM 0 HE2 MET B 99 17.584 -1.070 -6.402 1.00 0.00 H new ATOM 0 HE3 MET B 99 16.153 -0.571 -5.470 1.00 0.00 H new ATOM 3326 N GLU B 100 17.274 -1.361 -11.920 1.00 0.00 N ATOM 3327 CA GLU B 100 16.715 -1.866 -13.201 1.00 0.00 C ATOM 3328 C GLU B 100 15.223 -1.487 -13.373 1.00 0.00 C ATOM 3329 O GLU B 100 14.738 -1.321 -14.496 1.00 0.00 O ATOM 3330 CB GLU B 100 16.880 -3.405 -13.261 1.00 0.00 C ATOM 3331 CG GLU B 100 18.329 -3.903 -13.110 1.00 0.00 C ATOM 3332 CD GLU B 100 18.417 -5.425 -12.906 1.00 0.00 C ATOM 3333 OE1 GLU B 100 18.395 -6.177 -13.905 1.00 0.00 O ATOM 3334 OE2 GLU B 100 18.489 -5.881 -11.745 1.00 0.00 O ATOM 0 H GLU B 100 17.626 -2.103 -11.314 1.00 0.00 H new ATOM 0 HA GLU B 100 17.265 -1.397 -14.017 1.00 0.00 H new ATOM 0 HB2 GLU B 100 16.272 -3.853 -12.475 1.00 0.00 H new ATOM 0 HB3 GLU B 100 16.485 -3.762 -14.212 1.00 0.00 H new ATOM 0 HG2 GLU B 100 18.898 -3.626 -13.998 1.00 0.00 H new ATOM 0 HG3 GLU B 100 18.795 -3.400 -12.263 1.00 0.00 H new ATOM 3341 N PHE B 101 14.509 -1.360 -12.240 1.00 0.00 N ATOM 3342 CA PHE B 101 13.086 -0.941 -12.214 1.00 0.00 C ATOM 3343 C PHE B 101 12.971 0.586 -12.422 1.00 0.00 C ATOM 3344 O PHE B 101 11.942 1.089 -12.886 1.00 0.00 O ATOM 3345 CB PHE B 101 12.434 -1.367 -10.868 1.00 0.00 C ATOM 3346 CG PHE B 101 12.635 -2.853 -10.544 1.00 0.00 C ATOM 3347 CD1 PHE B 101 12.023 -3.837 -11.312 1.00 0.00 C ATOM 3348 CD2 PHE B 101 13.460 -3.261 -9.496 1.00 0.00 C ATOM 3349 CE1 PHE B 101 12.230 -5.174 -11.047 1.00 0.00 C ATOM 3350 CE2 PHE B 101 13.662 -4.599 -9.223 1.00 0.00 C ATOM 3351 CZ PHE B 101 13.051 -5.558 -10.002 1.00 0.00 C ATOM 0 H PHE B 101 14.897 -1.544 -11.315 1.00 0.00 H new ATOM 0 HA PHE B 101 12.555 -1.434 -13.028 1.00 0.00 H new ATOM 0 HB2 PHE B 101 12.854 -0.766 -10.062 1.00 0.00 H new ATOM 0 HB3 PHE B 101 11.366 -1.151 -10.904 1.00 0.00 H new ATOM 0 HD1 PHE B 101 11.376 -3.550 -12.128 1.00 0.00 H new ATOM 0 HD2 PHE B 101 13.950 -2.516 -8.887 1.00 0.00 H new ATOM 0 HE1 PHE B 101 11.749 -5.924 -11.657 1.00 0.00 H new ATOM 0 HE2 PHE B 101 14.297 -4.894 -8.401 1.00 0.00 H new ATOM 0 HZ PHE B 101 13.213 -6.606 -9.797 1.00 0.00 H new ATOM 3361 N GLY B 102 14.048 1.303 -12.062 1.00 0.00 N ATOM 3362 CA GLY B 102 14.143 2.750 -12.223 1.00 0.00 C ATOM 3363 C GLY B 102 15.024 3.385 -11.156 1.00 0.00 C ATOM 3364 O GLY B 102 15.495 2.694 -10.244 1.00 0.00 O ATOM 0 H GLY B 102 14.881 0.884 -11.648 1.00 0.00 H new ATOM 0 HA2 GLY B 102 14.546 2.980 -13.210 1.00 0.00 H new ATOM 0 HA3 GLY B 102 13.145 3.186 -12.176 1.00 0.00 H new ATOM 3368 N TYR B 103 15.236 4.711 -11.259 1.00 0.00 N ATOM 3369 CA TYR B 103 16.049 5.466 -10.295 1.00 0.00 C ATOM 3370 C TYR B 103 15.235 5.627 -9.000 1.00 0.00 C ATOM 3371 O TYR B 103 14.356 6.486 -8.926 1.00 0.00 O ATOM 3372 CB TYR B 103 16.421 6.849 -10.894 1.00 0.00 C ATOM 3373 CG TYR B 103 17.416 7.635 -10.044 1.00 0.00 C ATOM 3374 CD1 TYR B 103 18.749 7.262 -10.014 1.00 0.00 C ATOM 3375 CD2 TYR B 103 17.026 8.724 -9.267 1.00 0.00 C ATOM 3376 CE1 TYR B 103 19.662 7.933 -9.256 1.00 0.00 C ATOM 3377 CE2 TYR B 103 17.939 9.407 -8.500 1.00 0.00 C ATOM 3378 CZ TYR B 103 19.260 9.009 -8.496 1.00 0.00 C ATOM 3379 OH TYR B 103 20.183 9.688 -7.734 1.00 0.00 O ATOM 0 H TYR B 103 14.850 5.283 -12.010 1.00 0.00 H new ATOM 0 HA TYR B 103 16.976 4.936 -10.075 1.00 0.00 H new ATOM 0 HB2 TYR B 103 16.841 6.704 -11.889 1.00 0.00 H new ATOM 0 HB3 TYR B 103 15.513 7.440 -11.015 1.00 0.00 H new ATOM 0 HD1 TYR B 103 19.073 6.419 -10.606 1.00 0.00 H new ATOM 0 HD2 TYR B 103 15.992 9.036 -9.268 1.00 0.00 H new ATOM 0 HE1 TYR B 103 20.696 7.622 -9.251 1.00 0.00 H new ATOM 0 HE2 TYR B 103 17.624 10.251 -7.904 1.00 0.00 H new ATOM 0 HH TYR B 103 19.739 10.421 -7.258 1.00 0.00 H new ATOM 3389 N THR B 104 15.537 4.812 -7.980 1.00 0.00 N ATOM 3390 CA THR B 104 14.655 4.635 -6.818 1.00 0.00 C ATOM 3391 C THR B 104 15.283 5.213 -5.543 1.00 0.00 C ATOM 3392 O THR B 104 16.508 5.197 -5.368 1.00 0.00 O ATOM 3393 CB THR B 104 14.294 3.118 -6.615 1.00 0.00 C ATOM 3394 OG1 THR B 104 13.315 2.969 -5.573 1.00 0.00 O ATOM 3395 CG2 THR B 104 15.531 2.248 -6.295 1.00 0.00 C ATOM 0 H THR B 104 16.394 4.260 -7.937 1.00 0.00 H new ATOM 0 HA THR B 104 13.736 5.186 -7.018 1.00 0.00 H new ATOM 0 HB THR B 104 13.883 2.766 -7.561 1.00 0.00 H new ATOM 0 HG1 THR B 104 13.769 2.856 -4.712 1.00 0.00 H new ATOM 0 HG21 THR B 104 15.222 1.211 -6.165 1.00 0.00 H new ATOM 0 HG22 THR B 104 16.245 2.314 -7.116 1.00 0.00 H new ATOM 0 HG23 THR B 104 15.999 2.605 -5.378 1.00 0.00 H new ATOM 3403 N PHE B 105 14.415 5.717 -4.665 1.00 0.00 N ATOM 3404 CA PHE B 105 14.781 6.300 -3.373 1.00 0.00 C ATOM 3405 C PHE B 105 13.701 5.960 -2.337 1.00 0.00 C ATOM 3406 O PHE B 105 12.521 5.899 -2.689 1.00 0.00 O ATOM 3407 CB PHE B 105 14.956 7.849 -3.525 1.00 0.00 C ATOM 3408 CG PHE B 105 14.775 8.675 -2.244 1.00 0.00 C ATOM 3409 CD1 PHE B 105 15.616 8.503 -1.149 1.00 0.00 C ATOM 3410 CD2 PHE B 105 13.728 9.596 -2.129 1.00 0.00 C ATOM 3411 CE1 PHE B 105 15.421 9.223 0.006 1.00 0.00 C ATOM 3412 CE2 PHE B 105 13.533 10.312 -0.971 1.00 0.00 C ATOM 3413 CZ PHE B 105 14.378 10.127 0.096 1.00 0.00 C ATOM 0 H PHE B 105 13.410 5.731 -4.838 1.00 0.00 H new ATOM 0 HA PHE B 105 15.729 5.884 -3.030 1.00 0.00 H new ATOM 0 HB2 PHE B 105 15.952 8.045 -3.922 1.00 0.00 H new ATOM 0 HB3 PHE B 105 14.241 8.204 -4.267 1.00 0.00 H new ATOM 0 HD1 PHE B 105 16.431 7.796 -1.207 1.00 0.00 H new ATOM 0 HD2 PHE B 105 13.061 9.747 -2.965 1.00 0.00 H new ATOM 0 HE1 PHE B 105 16.085 9.082 0.846 1.00 0.00 H new ATOM 0 HE2 PHE B 105 12.718 11.017 -0.901 1.00 0.00 H new ATOM 0 HZ PHE B 105 14.228 10.688 1.006 1.00 0.00 H new ATOM 3423 N THR B 106 14.091 5.717 -1.081 1.00 0.00 N ATOM 3424 CA THR B 106 13.146 5.409 -0.002 1.00 0.00 C ATOM 3425 C THR B 106 13.477 6.241 1.251 1.00 0.00 C ATOM 3426 O THR B 106 14.617 6.275 1.716 1.00 0.00 O ATOM 3427 CB THR B 106 13.171 3.885 0.348 1.00 0.00 C ATOM 3428 OG1 THR B 106 12.963 3.107 -0.846 1.00 0.00 O ATOM 3429 CG2 THR B 106 12.097 3.514 1.389 1.00 0.00 C ATOM 0 H THR B 106 15.067 5.728 -0.784 1.00 0.00 H new ATOM 0 HA THR B 106 12.145 5.666 -0.347 1.00 0.00 H new ATOM 0 HB THR B 106 14.148 3.664 0.778 1.00 0.00 H new ATOM 0 HG1 THR B 106 13.552 2.324 -0.833 1.00 0.00 H new ATOM 0 HG21 THR B 106 12.150 2.446 1.602 1.00 0.00 H new ATOM 0 HG22 THR B 106 12.270 4.076 2.306 1.00 0.00 H new ATOM 0 HG23 THR B 106 11.110 3.756 0.995 1.00 0.00 H new ATOM 3437 N ALA B 107 12.464 6.930 1.771 1.00 0.00 N ATOM 3438 CA ALA B 107 12.549 7.696 3.012 1.00 0.00 C ATOM 3439 C ALA B 107 11.815 6.962 4.138 1.00 0.00 C ATOM 3440 O ALA B 107 11.181 5.927 3.899 1.00 0.00 O ATOM 3441 CB ALA B 107 11.980 9.102 2.807 1.00 0.00 C ATOM 0 H ALA B 107 11.544 6.972 1.333 1.00 0.00 H new ATOM 0 HA ALA B 107 13.596 7.794 3.298 1.00 0.00 H new ATOM 0 HB1 ALA B 107 12.049 9.662 3.739 1.00 0.00 H new ATOM 0 HB2 ALA B 107 12.549 9.615 2.032 1.00 0.00 H new ATOM 0 HB3 ALA B 107 10.936 9.031 2.503 1.00 0.00 H new ATOM 3447 N ALA B 108 11.913 7.486 5.359 1.00 0.00 N ATOM 3448 CA ALA B 108 11.200 6.941 6.518 1.00 0.00 C ATOM 3449 C ALA B 108 10.668 8.095 7.357 1.00 0.00 C ATOM 3450 O ALA B 108 11.433 8.958 7.775 1.00 0.00 O ATOM 3451 CB ALA B 108 12.113 6.033 7.355 1.00 0.00 C ATOM 0 H ALA B 108 12.488 8.300 5.575 1.00 0.00 H new ATOM 0 HA ALA B 108 10.368 6.329 6.171 1.00 0.00 H new ATOM 0 HB1 ALA B 108 11.556 5.644 8.208 1.00 0.00 H new ATOM 0 HB2 ALA B 108 12.463 5.203 6.741 1.00 0.00 H new ATOM 0 HB3 ALA B 108 12.969 6.607 7.712 1.00 0.00 H new ATOM 3457 N ASP B 109 9.352 8.128 7.548 1.00 0.00 N ATOM 3458 CA ASP B 109 8.683 9.056 8.483 1.00 0.00 C ATOM 3459 C ASP B 109 9.018 8.666 9.964 1.00 0.00 C ATOM 3460 O ASP B 109 9.717 7.665 10.179 1.00 0.00 O ATOM 3461 CB ASP B 109 7.152 9.044 8.174 1.00 0.00 C ATOM 3462 CG ASP B 109 6.556 7.646 8.001 1.00 0.00 C ATOM 3463 OD1 ASP B 109 6.532 6.869 8.975 1.00 0.00 O ATOM 3464 OD2 ASP B 109 6.133 7.317 6.876 1.00 0.00 O ATOM 0 H ASP B 109 8.705 7.510 7.058 1.00 0.00 H new ATOM 0 HA ASP B 109 9.045 10.076 8.352 1.00 0.00 H new ATOM 0 HB2 ASP B 109 6.626 9.553 8.982 1.00 0.00 H new ATOM 0 HB3 ASP B 109 6.972 9.618 7.265 1.00 0.00 H new ATOM 3469 N PRO B 110 8.570 9.443 11.025 1.00 0.00 N ATOM 3470 CA PRO B 110 8.831 9.076 12.456 1.00 0.00 C ATOM 3471 C PRO B 110 8.232 7.708 12.873 1.00 0.00 C ATOM 3472 O PRO B 110 8.568 7.183 13.939 1.00 0.00 O ATOM 3473 CB PRO B 110 8.195 10.252 13.258 1.00 0.00 C ATOM 3474 CG PRO B 110 7.207 10.852 12.312 1.00 0.00 C ATOM 3475 CD PRO B 110 7.841 10.741 10.950 1.00 0.00 C ATOM 0 HA PRO B 110 9.897 8.948 12.644 1.00 0.00 H new ATOM 0 HB2 PRO B 110 7.710 9.897 14.167 1.00 0.00 H new ATOM 0 HB3 PRO B 110 8.948 10.980 13.561 1.00 0.00 H new ATOM 0 HG2 PRO B 110 6.256 10.321 12.347 1.00 0.00 H new ATOM 0 HG3 PRO B 110 7.001 11.892 12.566 1.00 0.00 H new ATOM 0 HD2 PRO B 110 7.094 10.739 10.156 1.00 0.00 H new ATOM 0 HD3 PRO B 110 8.517 11.573 10.750 1.00 0.00 H new ATOM 3483 N ASP B 111 7.357 7.138 12.024 1.00 0.00 N ATOM 3484 CA ASP B 111 6.704 5.843 12.287 1.00 0.00 C ATOM 3485 C ASP B 111 7.439 4.680 11.565 1.00 0.00 C ATOM 3486 O ASP B 111 7.012 3.519 11.642 1.00 0.00 O ATOM 3487 CB ASP B 111 5.217 5.909 11.857 1.00 0.00 C ATOM 3488 CG ASP B 111 4.359 4.905 12.614 1.00 0.00 C ATOM 3489 OD1 ASP B 111 3.926 5.207 13.748 1.00 0.00 O ATOM 3490 OD2 ASP B 111 4.137 3.799 12.106 1.00 0.00 O ATOM 0 H ASP B 111 7.083 7.562 11.138 1.00 0.00 H new ATOM 0 HA ASP B 111 6.755 5.642 13.357 1.00 0.00 H new ATOM 0 HB2 ASP B 111 4.834 6.915 12.029 1.00 0.00 H new ATOM 0 HB3 ASP B 111 5.140 5.717 10.787 1.00 0.00 H new ATOM 3495 N SER B 112 8.529 5.030 10.844 1.00 0.00 N ATOM 3496 CA SER B 112 9.464 4.083 10.192 1.00 0.00 C ATOM 3497 C SER B 112 8.797 3.307 9.031 1.00 0.00 C ATOM 3498 O SER B 112 9.152 2.151 8.745 1.00 0.00 O ATOM 3499 CB SER B 112 10.117 3.136 11.248 1.00 0.00 C ATOM 3500 OG SER B 112 11.114 2.291 10.684 1.00 0.00 O ATOM 0 H SER B 112 8.790 6.005 10.695 1.00 0.00 H new ATOM 0 HA SER B 112 10.265 4.666 9.737 1.00 0.00 H new ATOM 0 HB2 SER B 112 10.561 3.736 12.043 1.00 0.00 H new ATOM 0 HB3 SER B 112 9.343 2.522 11.707 1.00 0.00 H new ATOM 0 HG SER B 112 10.806 1.955 9.817 1.00 0.00 H new ATOM 3506 N HIS B 113 7.860 3.967 8.322 1.00 0.00 N ATOM 3507 CA HIS B 113 7.291 3.414 7.072 1.00 0.00 C ATOM 3508 C HIS B 113 8.324 3.560 5.931 1.00 0.00 C ATOM 3509 O HIS B 113 9.379 4.182 6.104 1.00 0.00 O ATOM 3510 CB HIS B 113 5.974 4.122 6.652 1.00 0.00 C ATOM 3511 CG HIS B 113 4.920 4.271 7.719 1.00 0.00 C ATOM 3512 ND1 HIS B 113 4.059 5.337 7.736 1.00 0.00 N ATOM 3513 CD2 HIS B 113 4.538 3.484 8.747 1.00 0.00 C ATOM 3514 CE1 HIS B 113 3.204 5.212 8.711 1.00 0.00 C ATOM 3515 NE2 HIS B 113 3.463 4.094 9.344 1.00 0.00 N ATOM 0 H HIS B 113 7.482 4.876 8.589 1.00 0.00 H new ATOM 0 HA HIS B 113 7.059 2.365 7.258 1.00 0.00 H new ATOM 0 HB2 HIS B 113 6.225 5.115 6.279 1.00 0.00 H new ATOM 0 HB3 HIS B 113 5.540 3.569 5.819 1.00 0.00 H new ATOM 0 HD2 HIS B 113 4.993 2.550 9.044 1.00 0.00 H new ATOM 0 HE1 HIS B 113 2.417 5.910 8.956 1.00 0.00 H new ATOM 0 HE2 HIS B 113 2.949 3.736 10.149 1.00 0.00 H new ATOM 3524 N ARG B 114 8.013 2.983 4.767 1.00 0.00 N ATOM 3525 CA ARG B 114 8.850 3.090 3.560 1.00 0.00 C ATOM 3526 C ARG B 114 8.144 4.013 2.544 1.00 0.00 C ATOM 3527 O ARG B 114 7.150 3.626 1.943 1.00 0.00 O ATOM 3528 CB ARG B 114 9.126 1.666 2.967 1.00 0.00 C ATOM 3529 CG ARG B 114 10.465 1.005 3.388 1.00 0.00 C ATOM 3530 CD ARG B 114 10.667 0.862 4.906 1.00 0.00 C ATOM 3531 NE ARG B 114 12.034 0.387 5.205 1.00 0.00 N ATOM 3532 CZ ARG B 114 12.744 0.679 6.307 1.00 0.00 C ATOM 3533 NH1 ARG B 114 12.235 1.424 7.291 1.00 0.00 N ATOM 3534 NH2 ARG B 114 13.978 0.214 6.418 1.00 0.00 N ATOM 0 H ARG B 114 7.170 2.425 4.631 1.00 0.00 H new ATOM 0 HA ARG B 114 9.818 3.527 3.807 1.00 0.00 H new ATOM 0 HB2 ARG B 114 8.309 1.007 3.261 1.00 0.00 H new ATOM 0 HB3 ARG B 114 9.104 1.736 1.879 1.00 0.00 H new ATOM 0 HG2 ARG B 114 10.524 0.016 2.933 1.00 0.00 H new ATOM 0 HG3 ARG B 114 11.288 1.593 2.980 1.00 0.00 H new ATOM 0 HD2 ARG B 114 10.495 1.822 5.393 1.00 0.00 H new ATOM 0 HD3 ARG B 114 9.936 0.163 5.312 1.00 0.00 H new ATOM 0 HE ARG B 114 12.478 -0.216 4.513 1.00 0.00 H new ATOM 0 HH11 ARG B 114 11.285 1.787 7.217 1.00 0.00 H new ATOM 0 HH12 ARG B 114 12.797 1.630 8.117 1.00 0.00 H new ATOM 0 HH21 ARG B 114 14.377 -0.357 5.673 1.00 0.00 H new ATOM 0 HH22 ARG B 114 14.530 0.427 7.249 1.00 0.00 H new ATOM 3548 N LEU B 115 8.640 5.253 2.403 1.00 0.00 N ATOM 3549 CA LEU B 115 8.091 6.239 1.448 1.00 0.00 C ATOM 3550 C LEU B 115 8.986 6.259 0.194 1.00 0.00 C ATOM 3551 O LEU B 115 10.042 6.891 0.192 1.00 0.00 O ATOM 3552 CB LEU B 115 8.063 7.636 2.131 1.00 0.00 C ATOM 3553 CG LEU B 115 7.254 7.730 3.464 1.00 0.00 C ATOM 3554 CD1 LEU B 115 7.446 9.106 4.138 1.00 0.00 C ATOM 3555 CD2 LEU B 115 5.756 7.414 3.227 1.00 0.00 C ATOM 0 H LEU B 115 9.430 5.603 2.944 1.00 0.00 H new ATOM 0 HA LEU B 115 7.076 5.974 1.153 1.00 0.00 H new ATOM 0 HB2 LEU B 115 9.090 7.942 2.330 1.00 0.00 H new ATOM 0 HB3 LEU B 115 7.647 8.355 1.425 1.00 0.00 H new ATOM 0 HG LEU B 115 7.644 6.977 4.149 1.00 0.00 H new ATOM 0 HD11 LEU B 115 6.871 9.141 5.063 1.00 0.00 H new ATOM 0 HD12 LEU B 115 8.502 9.258 4.361 1.00 0.00 H new ATOM 0 HD13 LEU B 115 7.101 9.892 3.466 1.00 0.00 H new ATOM 0 HD21 LEU B 115 5.215 7.486 4.171 1.00 0.00 H new ATOM 0 HD22 LEU B 115 5.342 8.128 2.516 1.00 0.00 H new ATOM 0 HD23 LEU B 115 5.656 6.405 2.828 1.00 0.00 H new ATOM 3567 N ARG B 116 8.547 5.577 -0.882 1.00 0.00 N ATOM 3568 CA ARG B 116 9.424 5.272 -2.023 1.00 0.00 C ATOM 3569 C ARG B 116 9.266 6.259 -3.197 1.00 0.00 C ATOM 3570 O ARG B 116 8.402 6.049 -4.042 1.00 0.00 O ATOM 3571 CB ARG B 116 9.213 3.803 -2.486 1.00 0.00 C ATOM 3572 CG ARG B 116 10.350 3.284 -3.390 1.00 0.00 C ATOM 3573 CD ARG B 116 10.273 1.776 -3.672 1.00 0.00 C ATOM 3574 NE ARG B 116 11.590 1.268 -4.095 1.00 0.00 N ATOM 3575 CZ ARG B 116 12.518 0.765 -3.263 1.00 0.00 C ATOM 3576 NH1 ARG B 116 12.218 0.482 -1.998 1.00 0.00 N ATOM 3577 NH2 ARG B 116 13.728 0.496 -3.725 1.00 0.00 N ATOM 0 H ARG B 116 7.593 5.229 -0.982 1.00 0.00 H new ATOM 0 HA ARG B 116 10.450 5.392 -1.674 1.00 0.00 H new ATOM 0 HB2 ARG B 116 9.132 3.160 -1.609 1.00 0.00 H new ATOM 0 HB3 ARG B 116 8.268 3.730 -3.023 1.00 0.00 H new ATOM 0 HG2 ARG B 116 10.325 3.824 -4.337 1.00 0.00 H new ATOM 0 HG3 ARG B 116 11.308 3.509 -2.920 1.00 0.00 H new ATOM 0 HD2 ARG B 116 9.942 1.248 -2.778 1.00 0.00 H new ATOM 0 HD3 ARG B 116 9.534 1.581 -4.449 1.00 0.00 H new ATOM 0 HE ARG B 116 11.813 1.300 -5.090 1.00 0.00 H new ATOM 0 HH11 ARG B 116 11.274 0.646 -1.649 1.00 0.00 H new ATOM 0 HH12 ARG B 116 12.932 0.101 -1.378 1.00 0.00 H new ATOM 0 HH21 ARG B 116 13.950 0.671 -4.705 1.00 0.00 H new ATOM 0 HH22 ARG B 116 14.439 0.114 -3.101 1.00 0.00 H new ATOM 3591 N VAL B 117 10.109 7.293 -3.287 1.00 0.00 N ATOM 3592 CA VAL B 117 10.098 8.218 -4.441 1.00 0.00 C ATOM 3593 C VAL B 117 10.984 7.623 -5.533 1.00 0.00 C ATOM 3594 O VAL B 117 12.177 7.413 -5.293 1.00 0.00 O ATOM 3595 CB VAL B 117 10.620 9.650 -4.067 1.00 0.00 C ATOM 3596 CG1 VAL B 117 10.467 10.644 -5.256 1.00 0.00 C ATOM 3597 CG2 VAL B 117 9.919 10.170 -2.795 1.00 0.00 C ATOM 0 H VAL B 117 10.809 7.516 -2.579 1.00 0.00 H new ATOM 0 HA VAL B 117 9.069 8.333 -4.780 1.00 0.00 H new ATOM 0 HB VAL B 117 11.686 9.574 -3.854 1.00 0.00 H new ATOM 0 HG11 VAL B 117 10.839 11.625 -4.960 1.00 0.00 H new ATOM 0 HG12 VAL B 117 11.040 10.281 -6.110 1.00 0.00 H new ATOM 0 HG13 VAL B 117 9.415 10.722 -5.532 1.00 0.00 H new ATOM 0 HG21 VAL B 117 10.295 11.164 -2.553 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.844 10.221 -2.967 1.00 0.00 H new ATOM 0 HG23 VAL B 117 10.122 9.493 -1.965 1.00 0.00 H new ATOM 3607 N TYR B 118 10.425 7.333 -6.720 1.00 0.00 N ATOM 3608 CA TYR B 118 11.200 6.685 -7.791 1.00 0.00 C ATOM 3609 C TYR B 118 10.897 7.273 -9.183 1.00 0.00 C ATOM 3610 O TYR B 118 9.834 7.881 -9.385 1.00 0.00 O ATOM 3611 CB TYR B 118 11.019 5.134 -7.752 1.00 0.00 C ATOM 3612 CG TYR B 118 9.788 4.585 -8.479 1.00 0.00 C ATOM 3613 CD1 TYR B 118 8.494 4.786 -7.988 1.00 0.00 C ATOM 3614 CD2 TYR B 118 9.928 3.861 -9.670 1.00 0.00 C ATOM 3615 CE1 TYR B 118 7.395 4.285 -8.661 1.00 0.00 C ATOM 3616 CE2 TYR B 118 8.834 3.366 -10.339 1.00 0.00 C ATOM 3617 CZ TYR B 118 7.571 3.577 -9.838 1.00 0.00 C ATOM 3618 OH TYR B 118 6.484 3.074 -10.521 1.00 0.00 O ATOM 0 H TYR B 118 9.454 7.533 -6.960 1.00 0.00 H new ATOM 0 HA TYR B 118 12.252 6.900 -7.602 1.00 0.00 H new ATOM 0 HB2 TYR B 118 11.907 4.673 -8.184 1.00 0.00 H new ATOM 0 HB3 TYR B 118 10.971 4.819 -6.709 1.00 0.00 H new ATOM 0 HD1 TYR B 118 8.351 5.339 -7.072 1.00 0.00 H new ATOM 0 HD2 TYR B 118 10.916 3.688 -10.071 1.00 0.00 H new ATOM 0 HE1 TYR B 118 6.401 4.446 -8.270 1.00 0.00 H new ATOM 0 HE2 TYR B 118 8.966 2.812 -11.257 1.00 0.00 H new ATOM 0 HH TYR B 118 5.756 2.895 -9.890 1.00 0.00 H new ATOM 3628 N ALA B 119 11.802 7.043 -10.129 1.00 0.00 N ATOM 3629 CA ALA B 119 11.631 7.402 -11.541 1.00 0.00 C ATOM 3630 C ALA B 119 11.755 6.118 -12.352 1.00 0.00 C ATOM 3631 O ALA B 119 12.835 5.542 -12.403 1.00 0.00 O ATOM 3632 CB ALA B 119 12.706 8.415 -11.964 1.00 0.00 C ATOM 0 H ALA B 119 12.696 6.592 -9.936 1.00 0.00 H new ATOM 0 HA ALA B 119 10.659 7.866 -11.709 1.00 0.00 H new ATOM 0 HB1 ALA B 119 12.569 8.674 -13.014 1.00 0.00 H new ATOM 0 HB2 ALA B 119 12.619 9.314 -11.354 1.00 0.00 H new ATOM 0 HB3 ALA B 119 13.694 7.977 -11.824 1.00 0.00 H new ATOM 3638 N PHE B 120 10.651 5.674 -12.976 1.00 0.00 N ATOM 3639 CA PHE B 120 10.582 4.368 -13.659 1.00 0.00 C ATOM 3640 C PHE B 120 11.479 4.382 -14.914 1.00 0.00 C ATOM 3641 O PHE B 120 11.530 5.387 -15.630 1.00 0.00 O ATOM 3642 CB PHE B 120 9.109 4.043 -14.035 1.00 0.00 C ATOM 3643 CG PHE B 120 8.884 2.615 -14.569 1.00 0.00 C ATOM 3644 CD1 PHE B 120 8.720 1.539 -13.690 1.00 0.00 C ATOM 3645 CD2 PHE B 120 8.838 2.349 -15.943 1.00 0.00 C ATOM 3646 CE1 PHE B 120 8.520 0.253 -14.164 1.00 0.00 C ATOM 3647 CE2 PHE B 120 8.640 1.061 -16.412 1.00 0.00 C ATOM 3648 CZ PHE B 120 8.479 0.016 -15.524 1.00 0.00 C ATOM 0 H PHE B 120 9.783 6.207 -13.022 1.00 0.00 H new ATOM 0 HA PHE B 120 10.944 3.590 -12.987 1.00 0.00 H new ATOM 0 HB2 PHE B 120 8.482 4.191 -13.156 1.00 0.00 H new ATOM 0 HB3 PHE B 120 8.774 4.756 -14.789 1.00 0.00 H new ATOM 0 HD1 PHE B 120 8.750 1.714 -12.625 1.00 0.00 H new ATOM 0 HD2 PHE B 120 8.959 3.159 -16.647 1.00 0.00 H new ATOM 0 HE1 PHE B 120 8.396 -0.565 -13.470 1.00 0.00 H new ATOM 0 HE2 PHE B 120 8.611 0.873 -17.475 1.00 0.00 H new ATOM 0 HZ PHE B 120 8.321 -0.987 -15.893 1.00 0.00 H new ATOM 3658 N ALA B 121 12.212 3.276 -15.147 1.00 0.00 N ATOM 3659 CA ALA B 121 13.105 3.139 -16.310 1.00 0.00 C ATOM 3660 C ALA B 121 12.273 3.052 -17.607 1.00 0.00 C ATOM 3661 O ALA B 121 11.726 1.995 -17.938 1.00 0.00 O ATOM 3662 CB ALA B 121 14.023 1.917 -16.140 1.00 0.00 C ATOM 0 H ALA B 121 12.201 2.458 -14.538 1.00 0.00 H new ATOM 0 HA ALA B 121 13.743 4.020 -16.380 1.00 0.00 H new ATOM 0 HB1 ALA B 121 14.677 1.830 -17.008 1.00 0.00 H new ATOM 0 HB2 ALA B 121 14.627 2.038 -15.241 1.00 0.00 H new ATOM 0 HB3 ALA B 121 13.416 1.016 -16.051 1.00 0.00 H new ATOM 3668 N GLY B 122 12.142 4.196 -18.291 1.00 0.00 N ATOM 3669 CA GLY B 122 11.371 4.296 -19.525 1.00 0.00 C ATOM 3670 C GLY B 122 11.550 5.668 -20.175 1.00 0.00 C ATOM 3671 O GLY B 122 12.500 5.842 -20.969 1.00 0.00 O ATOM 3672 OXT GLY B 122 10.764 6.587 -19.876 1.00 0.00 O ATOM 0 H GLY B 122 12.570 5.075 -18.000 1.00 0.00 H new ATOM 0 HA2 GLY B 122 11.687 3.517 -20.219 1.00 0.00 H new ATOM 0 HA3 GLY B 122 10.316 4.125 -19.313 1.00 0.00 H new TER 3676 GLY B 122