USER MOD reduce.3.24.130724 H: found=0, std=0, add=1866, rem=0, adj=80 USER MOD reduce.3.24.130724 removed 1864 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 56 HIS : no HD1:sc= 0 X(o=-0.00064,f=-0.055) USER MOD Set 1.2: B 97 MET CE :methyl 173:sc=-0.000636 (180deg=-0.0551) USER MOD Set 2.1: B 49 THR OG1 : rot 129:sc= 1.05 USER MOD Set 2.2: B 51 GLN : amide:sc= 0.337 K(o=1.4,f=-6.6!) USER MOD Set 3.1: B 7 GLN : amide:sc= -0.0598 K(o=-0.36,f=-6.9!) USER MOD Set 3.2: B 10 HIS : no HD1:sc= -0.3 K(o=-0.36,f=-2.1) USER MOD Set 4.1: A 120 SER OG : rot -75:sc= 1.31 USER MOD Set 4.2: B 13 MET CE :methyl -129:sc= -0.26 (180deg=-1.12) USER MOD Set 5.1: A 56 HIS : no HD1:sc= 0 X(o=-0.04,f=-0.04) USER MOD Set 5.2: A 60 CYS SG : rot -140:sc= 0 USER MOD Set 5.3: A 97 MET CE :methyl -165:sc= -0.0399 (180deg=-0.198) USER MOD Set 6.1: A 32 LYS NZ :NH3+ 180:sc= 1.1 (180deg=-0.156) USER MOD Set 6.2: B 18 TYR OH : rot 150:sc= 1.03 USER MOD Set 7.1: A 24 GLN : amide:sc= -0.193! C(o=-2.7!,f=-11!) USER MOD Set 7.2: B 80 TYR OH : rot 33:sc= -2.5! USER MOD Set 8.1: A 11 SER OG : rot 146:sc= 0.846 USER MOD Set 8.2: B 76 HIS : no HD1:sc= 0.965 K(o=1.8,f=-5.4!) USER MOD Set 9.1: A 7 GLN : amide:sc= 0.256 X(o=0.99,f=0.57) USER MOD Set 9.2: A 9 THR OG1 : rot -86:sc= 0.738 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 CYS SG : rot 25:sc= 1.29 USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 12 LYS NZ :NH3+ 167:sc= -0.0353 (180deg=-0.237) USER MOD Single : A 13 MET CE :methyl -161:sc= -0.115 (180deg=-0.572) USER MOD Single : A 14 THR OG1 : rot -109:sc= 1.3 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= -0.014 USER MOD Single : A 31 LYS NZ :NH3+ 150:sc= -0.261 (180deg=-1.66!) USER MOD Single : A 36 LYS NZ :NH3+ 179:sc= 1.24 (180deg=1.21) USER MOD Single : A 38 SER OG : rot 36:sc= -0.276 USER MOD Single : A 40 TYR OH : rot 166:sc= -0.181 USER MOD Single : A 43 ASN : amide:sc= -2.6! K(o=-2.6!,f=-1.1) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 128:sc= 0.317 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -0.193 X(o=-0.19,f=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 111:sc= 0.965 USER MOD Single : A 64 ASN : amide:sc= -3.47! K(o=-3.5!,f=-0.31) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 CYS SG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -171:sc= -0.103 (180deg=-0.227) USER MOD Single : A 74 SER OG : rot -36:sc= 0.158 USER MOD Single : A 76 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 175:sc= -0.2 (180deg=-0.51) USER MOD Single : A 80 TYR OH : rot 29:sc= 0.668 USER MOD Single : A 82 TYR OH : rot -5:sc= 0.0604 USER MOD Single : A 89 ASN : amide:sc= -0.0377 K(o=-0.038,f=-1.6!) USER MOD Single : A 90 SER OG : rot 171:sc= -1.17! USER MOD Single : A 100 THR OG1 : rot -69:sc= 1.29 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ -178:sc= 0.99 (180deg=0.984) USER MOD Single : A 112 LYS NZ :NH3+ 138:sc= 1.06 (180deg=0.894) USER MOD Single : A 114 THR OG1 : rot -29:sc= 1.24 USER MOD Single : A 115 ASN : amide:sc= -0.0276 X(o=-0.028,f=0) USER MOD Single : A 116 MET CE :methyl -163:sc= -0.0828 (180deg=-0.495) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 90:sc= 0.999 USER MOD Single : B 1 ALA N :NH3+ -116:sc= 0.196 (180deg=0) USER MOD Single : B 5 CYS SG : rot -1:sc= 0.305 USER MOD Single : B 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 SER OG : rot 180:sc= 0 USER MOD Single : B 12 LYS NZ :NH3+ -170:sc=-0.00618 (180deg=-0.12) USER MOD Single : B 14 THR OG1 : rot 176:sc= 0.169 USER MOD Single : B 19 THR OG1 : rot -93:sc= -1.34 USER MOD Single : B 24 GLN : amide:sc= -0.867 K(o=-0.87,f=-4!) USER MOD Single : B 27 SER OG : rot 141:sc= 1.22 USER MOD Single : B 31 LYS NZ :NH3+ -155:sc= 1.12 (180deg=0.595) USER MOD Single : B 32 LYS NZ :NH3+ -140:sc= -0.048 (180deg=-0.256) USER MOD Single : B 36 LYS NZ :NH3+ 150:sc= 1.12 (180deg=1.09) USER MOD Single : B 38 SER OG : rot 160:sc= -1.73! USER MOD Single : B 40 TYR OH : rot -135:sc= 1.09 USER MOD Single : B 43 ASN : amide:sc= -0.541 K(o=-0.54,f=-7.3!) USER MOD Single : B 46 TYR OH : rot 43:sc= -0.297 USER MOD Single : B 48 SER OG : rot -140:sc= 0 USER MOD Single : B 58 SER OG : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 60 CYS SG : rot 175:sc= 1.26 USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 64 ASN : amide:sc= -2.34! K(o=-2.3!,f=-1.7) USER MOD Single : B 67 THR OG1 : rot 180:sc= 0 USER MOD Single : B 70 CYS SG : rot 180:sc=-0.00111 USER MOD Single : B 72 LYS NZ :NH3+ -148:sc= 1.26 (180deg=0.729) USER MOD Single : B 74 SER OG : rot 180:sc= 0.0096 USER MOD Single : B 78 LYS NZ :NH3+ -178:sc= 0.415 (180deg=0.4) USER MOD Single : B 82 TYR OH : rot 180:sc= -3.15! USER MOD Single : B 89 ASN : amide:sc= -0.428 X(o=-0.43,f=0) USER MOD Single : B 90 SER OG : rot 180:sc= 0.00174 USER MOD Single : B 100 THR OG1 : rot -95:sc= 1.23 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ -170:sc= 0.8 (180deg=0.646) USER MOD Single : B 112 LYS NZ :NH3+ 146:sc= -0.177 (180deg=-0.517) USER MOD Single : B 114 THR OG1 : rot -48:sc= 0.997 USER MOD Single : B 115 ASN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : B 116 MET CE :methyl 165:sc= -0.0411 (180deg=-0.355) USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 121 SER OG : rot 40:sc= 0.169 USER MOD Single : B 122 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -30.002 20.620 -21.481 1.00 62.33 N ATOM 2 CA ALA A 1 -29.581 21.970 -21.835 1.00 14.01 C ATOM 3 C ALA A 1 -28.320 21.923 -22.680 1.00 61.33 C ATOM 4 O ALA A 1 -28.369 22.089 -23.898 1.00 42.23 O ATOM 5 CB ALA A 1 -29.380 22.836 -20.590 1.00 11.04 C ATOM 0 H1 ALA A 1 -30.865 20.666 -20.903 1.00 62.33 H new ATOM 0 H2 ALA A 1 -30.194 20.078 -22.347 1.00 62.33 H new ATOM 0 H3 ALA A 1 -29.248 20.152 -20.939 1.00 62.33 H new ATOM 0 HA ALA A 1 -30.374 22.431 -22.424 1.00 14.01 H new ATOM 0 HB1 ALA A 1 -29.066 23.836 -20.889 1.00 11.04 H new ATOM 0 HB2 ALA A 1 -30.317 22.900 -20.036 1.00 11.04 H new ATOM 0 HB3 ALA A 1 -28.614 22.390 -19.956 1.00 11.04 H new ATOM 13 N ILE A 2 -27.199 21.658 -22.040 1.00 74.24 N ATOM 14 CA ILE A 2 -25.931 21.585 -22.729 1.00 32.03 C ATOM 15 C ILE A 2 -25.731 20.175 -23.242 1.00 62.23 C ATOM 16 O ILE A 2 -25.959 19.209 -22.505 1.00 15.43 O ATOM 17 CB ILE A 2 -24.745 21.979 -21.785 1.00 22.11 C ATOM 18 CG1 ILE A 2 -24.906 23.425 -21.276 1.00 61.23 C ATOM 19 CG2 ILE A 2 -23.384 21.799 -22.470 1.00 73.10 C ATOM 20 CD1 ILE A 2 -24.913 24.477 -22.375 1.00 40.55 C ATOM 0 H ILE A 2 -27.143 21.489 -21.036 1.00 74.24 H new ATOM 0 HA ILE A 2 -25.944 22.291 -23.560 1.00 32.03 H new ATOM 0 HB ILE A 2 -24.775 21.303 -20.931 1.00 22.11 H new ATOM 0 HG12 ILE A 2 -25.836 23.498 -20.713 1.00 61.23 H new ATOM 0 HG13 ILE A 2 -24.095 23.646 -20.582 1.00 61.23 H new ATOM 0 HG21 ILE A 2 -22.589 22.083 -21.780 1.00 73.10 H new ATOM 0 HG22 ILE A 2 -23.257 20.756 -22.759 1.00 73.10 H new ATOM 0 HG23 ILE A 2 -23.337 22.430 -23.358 1.00 73.10 H new ATOM 0 HD11 ILE A 2 -25.030 25.466 -21.931 1.00 40.55 H new ATOM 0 HD12 ILE A 2 -23.973 24.435 -22.925 1.00 40.55 H new ATOM 0 HD13 ILE A 2 -25.741 24.285 -23.057 1.00 40.55 H new ATOM 32 N ALA A 3 -25.343 20.059 -24.492 1.00 30.00 N ATOM 33 CA ALA A 3 -25.084 18.779 -25.098 1.00 61.42 C ATOM 34 C ALA A 3 -23.866 18.156 -24.431 1.00 13.44 C ATOM 35 O ALA A 3 -22.783 18.747 -24.470 1.00 43.34 O ATOM 36 CB ALA A 3 -24.851 18.951 -26.593 1.00 34.04 C ATOM 0 H ALA A 3 -25.199 20.853 -25.116 1.00 30.00 H new ATOM 0 HA ALA A 3 -25.942 18.121 -24.962 1.00 61.42 H new ATOM 0 HB1 ALA A 3 -24.656 17.979 -27.045 1.00 34.04 H new ATOM 0 HB2 ALA A 3 -25.736 19.393 -27.051 1.00 34.04 H new ATOM 0 HB3 ALA A 3 -23.994 19.605 -26.755 1.00 34.04 H new ATOM 42 N PRO A 4 -24.035 16.976 -23.782 1.00 52.24 N ATOM 43 CA PRO A 4 -22.959 16.297 -23.055 1.00 41.31 C ATOM 44 C PRO A 4 -21.692 16.169 -23.876 1.00 31.32 C ATOM 45 O PRO A 4 -21.635 15.417 -24.862 1.00 51.12 O ATOM 46 CB PRO A 4 -23.537 14.918 -22.753 1.00 31.32 C ATOM 47 CG PRO A 4 -25.003 15.141 -22.697 1.00 65.43 C ATOM 48 CD PRO A 4 -25.298 16.217 -23.707 1.00 74.24 C ATOM 0 HA PRO A 4 -22.665 16.853 -22.165 1.00 41.31 H new ATOM 0 HB2 PRO A 4 -23.273 14.198 -23.527 1.00 31.32 H new ATOM 0 HB3 PRO A 4 -23.158 14.525 -21.810 1.00 31.32 H new ATOM 0 HG2 PRO A 4 -25.546 14.226 -22.932 1.00 65.43 H new ATOM 0 HG3 PRO A 4 -25.313 15.448 -21.698 1.00 65.43 H new ATOM 0 HD2 PRO A 4 -25.571 15.795 -24.674 1.00 74.24 H new ATOM 0 HD3 PRO A 4 -26.128 16.849 -23.389 1.00 74.24 H new ATOM 56 N CYS A 5 -20.707 16.925 -23.506 1.00 1.25 N ATOM 57 CA CYS A 5 -19.454 16.914 -24.182 1.00 13.15 C ATOM 58 C CYS A 5 -18.544 15.958 -23.462 1.00 22.44 C ATOM 59 O CYS A 5 -18.237 16.154 -22.274 1.00 71.52 O ATOM 60 CB CYS A 5 -18.857 18.324 -24.189 1.00 5.41 C ATOM 61 SG CYS A 5 -19.925 19.569 -24.955 1.00 31.44 S ATOM 0 H CYS A 5 -20.753 17.572 -22.719 1.00 1.25 H new ATOM 0 HA CYS A 5 -19.579 16.595 -25.217 1.00 13.15 H new ATOM 0 HB2 CYS A 5 -18.645 18.623 -23.163 1.00 5.41 H new ATOM 0 HB3 CYS A 5 -17.904 18.302 -24.718 1.00 5.41 H new ATOM 0 HG CYS A 5 -21.164 19.183 -24.880 1.00 31.44 H new ATOM 67 N MET A 6 -18.142 14.905 -24.134 1.00 62.40 N ATOM 68 CA MET A 6 -17.272 13.940 -23.525 1.00 54.21 C ATOM 69 C MET A 6 -15.865 14.488 -23.484 1.00 74.00 C ATOM 70 O MET A 6 -15.072 14.306 -24.414 1.00 11.41 O ATOM 71 CB MET A 6 -17.333 12.573 -24.224 1.00 12.50 C ATOM 72 CG MET A 6 -16.483 11.505 -23.551 1.00 3.11 C ATOM 73 SD MET A 6 -16.965 11.238 -21.831 1.00 62.55 S ATOM 74 CE MET A 6 -15.780 9.982 -21.347 1.00 34.12 C ATOM 0 H MET A 6 -18.405 14.700 -25.098 1.00 62.40 H new ATOM 0 HA MET A 6 -17.614 13.766 -22.505 1.00 54.21 H new ATOM 0 HB2 MET A 6 -18.369 12.235 -24.253 1.00 12.50 H new ATOM 0 HB3 MET A 6 -17.006 12.688 -25.257 1.00 12.50 H new ATOM 0 HG2 MET A 6 -16.574 10.569 -24.102 1.00 3.11 H new ATOM 0 HG3 MET A 6 -15.434 11.798 -23.592 1.00 3.11 H new ATOM 0 HE1 MET A 6 -15.946 9.708 -20.305 1.00 34.12 H new ATOM 0 HE2 MET A 6 -15.904 9.102 -21.978 1.00 34.12 H new ATOM 0 HE3 MET A 6 -14.769 10.372 -21.463 1.00 34.12 H new ATOM 84 N GLN A 7 -15.612 15.247 -22.455 1.00 34.31 N ATOM 85 CA GLN A 7 -14.352 15.872 -22.216 1.00 75.33 C ATOM 86 C GLN A 7 -14.363 16.320 -20.772 1.00 63.21 C ATOM 87 O GLN A 7 -14.945 17.349 -20.429 1.00 11.22 O ATOM 88 CB GLN A 7 -14.160 17.072 -23.186 1.00 10.15 C ATOM 89 CG GLN A 7 -12.766 17.742 -23.242 1.00 35.32 C ATOM 90 CD GLN A 7 -12.316 18.435 -21.966 1.00 21.13 C ATOM 91 OE1 GLN A 7 -12.614 19.605 -21.762 1.00 44.32 O ATOM 92 NE2 GLN A 7 -11.551 17.758 -21.152 1.00 20.34 N ATOM 0 H GLN A 7 -16.306 15.452 -21.736 1.00 34.31 H new ATOM 0 HA GLN A 7 -13.521 15.189 -22.393 1.00 75.33 H new ATOM 0 HB2 GLN A 7 -14.408 16.732 -24.191 1.00 10.15 H new ATOM 0 HB3 GLN A 7 -14.889 17.838 -22.919 1.00 10.15 H new ATOM 0 HG2 GLN A 7 -12.028 16.982 -23.501 1.00 35.32 H new ATOM 0 HG3 GLN A 7 -12.767 18.474 -24.050 1.00 35.32 H new ATOM 0 HE21 GLN A 7 -11.325 16.785 -21.356 1.00 20.34 H new ATOM 0 HE22 GLN A 7 -11.180 18.203 -20.312 1.00 20.34 H new ATOM 101 N THR A 8 -13.807 15.513 -19.942 1.00 75.14 N ATOM 102 CA THR A 8 -13.688 15.786 -18.551 1.00 30.41 C ATOM 103 C THR A 8 -12.239 15.560 -18.188 1.00 5.12 C ATOM 104 O THR A 8 -11.788 14.425 -18.082 1.00 44.54 O ATOM 105 CB THR A 8 -14.633 14.883 -17.726 1.00 31.11 C ATOM 106 OG1 THR A 8 -15.992 15.095 -18.187 1.00 22.31 O ATOM 107 CG2 THR A 8 -14.555 15.227 -16.245 1.00 44.35 C ATOM 0 H THR A 8 -13.409 14.615 -20.219 1.00 75.14 H new ATOM 0 HA THR A 8 -13.981 16.811 -18.325 1.00 30.41 H new ATOM 0 HB THR A 8 -14.335 13.843 -17.858 1.00 31.11 H new ATOM 0 HG1 THR A 8 -16.604 14.527 -17.674 1.00 22.31 H new ATOM 0 HG21 THR A 8 -15.229 14.578 -15.685 1.00 44.35 H new ATOM 0 HG22 THR A 8 -13.534 15.082 -15.891 1.00 44.35 H new ATOM 0 HG23 THR A 8 -14.846 16.267 -16.097 1.00 44.35 H new ATOM 115 N THR A 9 -11.520 16.652 -18.074 1.00 53.34 N ATOM 116 CA THR A 9 -10.085 16.661 -17.909 1.00 5.22 C ATOM 117 C THR A 9 -9.587 15.826 -16.714 1.00 60.32 C ATOM 118 O THR A 9 -9.790 16.183 -15.547 1.00 3.15 O ATOM 119 CB THR A 9 -9.587 18.112 -17.791 1.00 72.44 C ATOM 120 OG1 THR A 9 -10.095 18.867 -18.913 1.00 51.23 O ATOM 121 CG2 THR A 9 -8.059 18.171 -17.798 1.00 74.43 C ATOM 0 H THR A 9 -11.929 17.586 -18.094 1.00 53.34 H new ATOM 0 HA THR A 9 -9.668 16.186 -18.797 1.00 5.22 H new ATOM 0 HB THR A 9 -9.942 18.531 -16.850 1.00 72.44 H new ATOM 0 HG1 THR A 9 -9.488 18.768 -19.676 1.00 51.23 H new ATOM 0 HG21 THR A 9 -7.735 19.208 -17.713 1.00 74.43 H new ATOM 0 HG22 THR A 9 -7.669 17.599 -16.956 1.00 74.43 H new ATOM 0 HG23 THR A 9 -7.683 17.748 -18.729 1.00 74.43 H new ATOM 129 N HIS A 10 -8.981 14.697 -17.031 1.00 23.41 N ATOM 130 CA HIS A 10 -8.311 13.865 -16.061 1.00 0.13 C ATOM 131 C HIS A 10 -6.838 13.985 -16.314 1.00 31.13 C ATOM 132 O HIS A 10 -6.316 13.393 -17.272 1.00 22.51 O ATOM 133 CB HIS A 10 -8.711 12.387 -16.182 1.00 0.12 C ATOM 134 CG HIS A 10 -10.154 12.099 -15.960 1.00 72.02 C ATOM 135 ND1 HIS A 10 -10.988 11.637 -16.944 1.00 32.32 N ATOM 136 CD2 HIS A 10 -10.904 12.173 -14.844 1.00 52.12 C ATOM 137 CE1 HIS A 10 -12.181 11.436 -16.445 1.00 1.34 C ATOM 138 NE2 HIS A 10 -12.159 11.754 -15.173 1.00 53.12 N ATOM 0 H HIS A 10 -8.942 14.331 -17.982 1.00 23.41 H new ATOM 0 HA HIS A 10 -8.591 14.197 -15.061 1.00 0.13 H new ATOM 0 HB2 HIS A 10 -8.435 12.033 -17.175 1.00 0.12 H new ATOM 0 HB3 HIS A 10 -8.128 11.810 -15.465 1.00 0.12 H new ATOM 0 HD2 HIS A 10 -10.573 12.503 -13.870 1.00 52.12 H new ATOM 0 HE1 HIS A 10 -13.039 11.070 -16.989 1.00 1.34 H new ATOM 0 HE2 HIS A 10 -12.952 11.697 -14.534 1.00 53.12 H new ATOM 147 N SER A 11 -6.175 14.766 -15.517 1.00 23.44 N ATOM 148 CA SER A 11 -4.781 14.995 -15.712 1.00 42.41 C ATOM 149 C SER A 11 -3.952 13.990 -14.936 1.00 34.41 C ATOM 150 O SER A 11 -4.064 13.888 -13.700 1.00 41.13 O ATOM 151 CB SER A 11 -4.426 16.446 -15.331 1.00 62.11 C ATOM 152 OG SER A 11 -4.849 16.766 -13.998 1.00 1.31 O ATOM 0 H SER A 11 -6.582 15.257 -14.721 1.00 23.44 H new ATOM 0 HA SER A 11 -4.545 14.856 -16.767 1.00 42.41 H new ATOM 0 HB2 SER A 11 -3.349 16.591 -15.415 1.00 62.11 H new ATOM 0 HB3 SER A 11 -4.896 17.132 -16.036 1.00 62.11 H new ATOM 0 HG SER A 11 -4.208 17.386 -13.591 1.00 1.31 H new ATOM 158 N LYS A 12 -3.150 13.217 -15.650 1.00 52.24 N ATOM 159 CA LYS A 12 -2.247 12.297 -15.012 1.00 70.10 C ATOM 160 C LYS A 12 -1.046 13.056 -14.512 1.00 33.43 C ATOM 161 O LYS A 12 0.017 13.053 -15.136 1.00 51.52 O ATOM 162 CB LYS A 12 -1.790 11.121 -15.919 1.00 33.32 C ATOM 163 CG LYS A 12 -2.848 10.066 -16.279 1.00 11.11 C ATOM 164 CD LYS A 12 -3.998 10.606 -17.111 1.00 4.43 C ATOM 165 CE LYS A 12 -4.973 9.491 -17.483 1.00 72.35 C ATOM 166 NZ LYS A 12 -5.541 8.815 -16.288 1.00 63.30 N ATOM 0 H LYS A 12 -3.112 13.214 -16.669 1.00 52.24 H new ATOM 0 HA LYS A 12 -2.796 11.839 -14.189 1.00 70.10 H new ATOM 0 HB2 LYS A 12 -1.400 11.540 -16.847 1.00 33.32 H new ATOM 0 HB3 LYS A 12 -0.961 10.614 -15.425 1.00 33.32 H new ATOM 0 HG2 LYS A 12 -2.367 9.255 -16.825 1.00 11.11 H new ATOM 0 HG3 LYS A 12 -3.247 9.638 -15.360 1.00 11.11 H new ATOM 0 HD2 LYS A 12 -4.522 11.382 -16.553 1.00 4.43 H new ATOM 0 HD3 LYS A 12 -3.609 11.072 -18.017 1.00 4.43 H new ATOM 0 HE2 LYS A 12 -5.784 9.905 -18.082 1.00 72.35 H new ATOM 0 HE3 LYS A 12 -4.461 8.756 -18.104 1.00 72.35 H new ATOM 0 HZ1 LYS A 12 -6.349 8.226 -16.574 1.00 63.30 H new ATOM 0 HZ2 LYS A 12 -4.813 8.215 -15.850 1.00 63.30 H new ATOM 0 HZ3 LYS A 12 -5.858 9.530 -15.603 1.00 63.30 H new ATOM 180 N MET A 13 -1.233 13.763 -13.443 1.00 73.43 N ATOM 181 CA MET A 13 -0.178 14.531 -12.876 1.00 5.00 C ATOM 182 C MET A 13 0.098 14.055 -11.483 1.00 33.21 C ATOM 183 O MET A 13 -0.470 14.553 -10.501 1.00 33.30 O ATOM 184 CB MET A 13 -0.464 16.046 -12.920 1.00 12.53 C ATOM 185 CG MET A 13 0.680 16.910 -12.381 1.00 55.11 C ATOM 186 SD MET A 13 0.340 18.686 -12.464 1.00 50.32 S ATOM 187 CE MET A 13 0.160 18.926 -14.231 1.00 43.24 C ATOM 0 H MET A 13 -2.120 13.822 -12.942 1.00 73.43 H new ATOM 0 HA MET A 13 0.716 14.381 -13.481 1.00 5.00 H new ATOM 0 HB2 MET A 13 -0.672 16.337 -13.950 1.00 12.53 H new ATOM 0 HB3 MET A 13 -1.365 16.252 -12.343 1.00 12.53 H new ATOM 0 HG2 MET A 13 0.878 16.633 -11.345 1.00 55.11 H new ATOM 0 HG3 MET A 13 1.586 16.694 -12.947 1.00 55.11 H new ATOM 0 HE1 MET A 13 0.285 19.982 -14.469 1.00 43.24 H new ATOM 0 HE2 MET A 13 0.917 18.344 -14.756 1.00 43.24 H new ATOM 0 HE3 MET A 13 -0.831 18.598 -14.544 1.00 43.24 H new ATOM 197 N THR A 14 0.880 13.036 -11.419 1.00 4.32 N ATOM 198 CA THR A 14 1.320 12.481 -10.200 1.00 12.15 C ATOM 199 C THR A 14 2.827 12.561 -10.177 1.00 11.30 C ATOM 200 O THR A 14 3.503 11.924 -10.995 1.00 15.34 O ATOM 201 CB THR A 14 0.880 10.997 -10.074 1.00 51.03 C ATOM 202 OG1 THR A 14 -0.560 10.895 -10.136 1.00 22.25 O ATOM 203 CG2 THR A 14 1.372 10.380 -8.769 1.00 25.43 C ATOM 0 H THR A 14 1.239 12.554 -12.243 1.00 4.32 H new ATOM 0 HA THR A 14 0.883 13.032 -9.367 1.00 12.15 H new ATOM 0 HB THR A 14 1.324 10.451 -10.906 1.00 51.03 H new ATOM 0 HG1 THR A 14 -0.910 10.658 -9.252 1.00 22.25 H new ATOM 0 HG21 THR A 14 1.047 9.341 -8.712 1.00 25.43 H new ATOM 0 HG22 THR A 14 2.461 10.422 -8.734 1.00 25.43 H new ATOM 0 HG23 THR A 14 0.961 10.935 -7.926 1.00 25.43 H new ATOM 211 N ALA A 15 3.354 13.365 -9.289 1.00 53.53 N ATOM 212 CA ALA A 15 4.785 13.466 -9.137 1.00 24.21 C ATOM 213 C ALA A 15 5.262 12.240 -8.404 1.00 71.02 C ATOM 214 O ALA A 15 6.413 11.826 -8.515 1.00 14.53 O ATOM 215 CB ALA A 15 5.153 14.722 -8.374 1.00 13.31 C ATOM 0 H ALA A 15 2.815 13.960 -8.660 1.00 53.53 H new ATOM 0 HA ALA A 15 5.263 13.527 -10.115 1.00 24.21 H new ATOM 0 HB1 ALA A 15 6.236 14.780 -8.270 1.00 13.31 H new ATOM 0 HB2 ALA A 15 4.793 15.596 -8.917 1.00 13.31 H new ATOM 0 HB3 ALA A 15 4.694 14.695 -7.386 1.00 13.31 H new ATOM 221 N GLY A 16 4.355 11.670 -7.653 1.00 50.15 N ATOM 222 CA GLY A 16 4.620 10.485 -6.936 1.00 41.12 C ATOM 223 C GLY A 16 4.207 10.638 -5.520 1.00 45.02 C ATOM 224 O GLY A 16 3.020 10.679 -5.230 1.00 14.52 O ATOM 0 H GLY A 16 3.409 12.031 -7.532 1.00 50.15 H new ATOM 0 HA2 GLY A 16 4.086 9.650 -7.390 1.00 41.12 H new ATOM 0 HA3 GLY A 16 5.683 10.250 -6.989 1.00 41.12 H new ATOM 228 N ALA A 17 5.195 10.756 -4.668 1.00 11.45 N ATOM 229 CA ALA A 17 5.075 10.930 -3.225 1.00 31.52 C ATOM 230 C ALA A 17 6.439 10.682 -2.667 1.00 24.13 C ATOM 231 O ALA A 17 6.712 9.599 -2.149 1.00 54.13 O ATOM 232 CB ALA A 17 4.081 9.956 -2.587 1.00 62.21 C ATOM 0 H ALA A 17 6.168 10.733 -4.973 1.00 11.45 H new ATOM 0 HA ALA A 17 4.700 11.930 -3.009 1.00 31.52 H new ATOM 0 HB1 ALA A 17 4.035 10.134 -1.513 1.00 62.21 H new ATOM 0 HB2 ALA A 17 3.093 10.107 -3.022 1.00 62.21 H new ATOM 0 HB3 ALA A 17 4.406 8.932 -2.771 1.00 62.21 H new ATOM 238 N TYR A 18 7.315 11.650 -2.851 1.00 64.12 N ATOM 239 CA TYR A 18 8.721 11.487 -2.533 1.00 15.23 C ATOM 240 C TYR A 18 8.901 11.145 -1.059 1.00 44.02 C ATOM 241 O TYR A 18 9.262 10.022 -0.723 1.00 32.23 O ATOM 242 CB TYR A 18 9.509 12.743 -2.937 1.00 52.02 C ATOM 243 CG TYR A 18 11.013 12.565 -2.976 1.00 24.33 C ATOM 244 CD1 TYR A 18 11.627 12.050 -4.112 1.00 11.43 C ATOM 245 CD2 TYR A 18 11.817 12.921 -1.902 1.00 41.33 C ATOM 246 CE1 TYR A 18 12.993 11.894 -4.179 1.00 50.00 C ATOM 247 CE2 TYR A 18 13.190 12.765 -1.960 1.00 72.53 C ATOM 248 CZ TYR A 18 13.771 12.252 -3.103 1.00 63.31 C ATOM 249 OH TYR A 18 15.139 12.101 -3.173 1.00 34.22 O ATOM 0 H TYR A 18 7.074 12.568 -3.224 1.00 64.12 H new ATOM 0 HA TYR A 18 9.122 10.652 -3.108 1.00 15.23 H new ATOM 0 HB2 TYR A 18 9.170 13.066 -3.921 1.00 52.02 H new ATOM 0 HB3 TYR A 18 9.270 13.545 -2.238 1.00 52.02 H new ATOM 0 HD1 TYR A 18 11.020 11.767 -4.959 1.00 11.43 H new ATOM 0 HD2 TYR A 18 11.364 13.325 -1.009 1.00 41.33 H new ATOM 0 HE1 TYR A 18 13.451 11.493 -5.071 1.00 50.00 H new ATOM 0 HE2 TYR A 18 13.804 13.043 -1.116 1.00 72.53 H new ATOM 0 HH TYR A 18 15.545 12.400 -2.333 1.00 34.22 H new ATOM 259 N THR A 19 8.637 12.077 -0.189 1.00 44.34 N ATOM 260 CA THR A 19 8.725 11.782 1.196 1.00 3.32 C ATOM 261 C THR A 19 7.474 12.241 1.966 1.00 40.10 C ATOM 262 O THR A 19 7.419 13.330 2.563 1.00 41.50 O ATOM 263 CB THR A 19 10.070 12.271 1.840 1.00 43.14 C ATOM 264 OG1 THR A 19 10.158 11.896 3.223 1.00 43.34 O ATOM 265 CG2 THR A 19 10.267 13.782 1.693 1.00 52.02 C ATOM 0 H THR A 19 8.363 13.033 -0.418 1.00 44.34 H new ATOM 0 HA THR A 19 8.749 10.696 1.283 1.00 3.32 H new ATOM 0 HB THR A 19 10.870 11.774 1.292 1.00 43.14 H new ATOM 0 HG1 THR A 19 11.007 12.214 3.595 1.00 43.34 H new ATOM 0 HG21 THR A 19 11.211 14.072 2.154 1.00 52.02 H new ATOM 0 HG22 THR A 19 10.283 14.046 0.635 1.00 52.02 H new ATOM 0 HG23 THR A 19 9.447 14.305 2.185 1.00 52.02 H new ATOM 273 N GLU A 20 6.436 11.435 1.885 1.00 30.34 N ATOM 274 CA GLU A 20 5.220 11.670 2.626 1.00 4.43 C ATOM 275 C GLU A 20 5.333 10.904 3.905 1.00 33.31 C ATOM 276 O GLU A 20 4.818 11.306 4.966 1.00 30.33 O ATOM 277 CB GLU A 20 4.015 11.132 1.843 1.00 70.50 C ATOM 278 CG GLU A 20 3.797 11.778 0.490 1.00 43.23 C ATOM 279 CD GLU A 20 3.473 13.244 0.583 1.00 23.35 C ATOM 280 OE1 GLU A 20 2.279 13.590 0.669 1.00 55.34 O ATOM 281 OE2 GLU A 20 4.397 14.075 0.545 1.00 14.34 O ATOM 0 H GLU A 20 6.414 10.598 1.302 1.00 30.34 H new ATOM 0 HA GLU A 20 5.082 12.737 2.801 1.00 4.43 H new ATOM 0 HB2 GLU A 20 4.141 10.059 1.701 1.00 70.50 H new ATOM 0 HB3 GLU A 20 3.117 11.271 2.445 1.00 70.50 H new ATOM 0 HG2 GLU A 20 4.693 11.648 -0.117 1.00 43.23 H new ATOM 0 HG3 GLU A 20 2.985 11.264 -0.025 1.00 43.23 H new ATOM 288 N GLY A 21 6.073 9.817 3.811 1.00 43.53 N ATOM 289 CA GLY A 21 6.180 8.910 4.857 1.00 1.14 C ATOM 290 C GLY A 21 4.960 8.060 4.890 1.00 34.43 C ATOM 291 O GLY A 21 4.077 8.217 4.054 1.00 55.41 O ATOM 0 H GLY A 21 6.611 9.566 2.981 1.00 43.53 H new ATOM 0 HA2 GLY A 21 7.067 8.290 4.728 1.00 1.14 H new ATOM 0 HA3 GLY A 21 6.296 9.439 5.803 1.00 1.14 H new ATOM 295 N PRO A 22 4.898 7.132 5.787 1.00 51.34 N ATOM 296 CA PRO A 22 3.713 6.315 5.998 1.00 30.53 C ATOM 297 C PRO A 22 2.331 7.090 6.082 1.00 21.34 C ATOM 298 O PRO A 22 1.324 6.602 5.578 1.00 1.52 O ATOM 299 CB PRO A 22 4.007 5.659 7.318 1.00 24.20 C ATOM 300 CG PRO A 22 5.477 5.501 7.334 1.00 54.21 C ATOM 301 CD PRO A 22 6.011 6.727 6.671 1.00 53.24 C ATOM 0 HA PRO A 22 3.562 5.651 5.147 1.00 30.53 H new ATOM 0 HB2 PRO A 22 3.665 6.273 8.151 1.00 24.20 H new ATOM 0 HB3 PRO A 22 3.503 4.696 7.404 1.00 24.20 H new ATOM 0 HG2 PRO A 22 5.852 5.410 8.353 1.00 54.21 H new ATOM 0 HG3 PRO A 22 5.782 4.601 6.801 1.00 54.21 H new ATOM 0 HD2 PRO A 22 6.256 7.504 7.395 1.00 53.24 H new ATOM 0 HD3 PRO A 22 6.920 6.519 6.107 1.00 53.24 H new ATOM 309 N PRO A 23 2.234 8.272 6.704 1.00 63.14 N ATOM 310 CA PRO A 23 0.973 8.890 6.893 1.00 11.44 C ATOM 311 C PRO A 23 0.522 9.880 5.853 1.00 20.32 C ATOM 312 O PRO A 23 1.281 10.348 4.992 1.00 60.22 O ATOM 313 CB PRO A 23 1.129 9.552 8.184 1.00 10.25 C ATOM 314 CG PRO A 23 2.534 10.049 8.172 1.00 71.41 C ATOM 315 CD PRO A 23 3.297 9.099 7.296 1.00 65.02 C ATOM 0 HA PRO A 23 0.192 8.133 6.825 1.00 11.44 H new ATOM 0 HB2 PRO A 23 0.418 10.370 8.301 1.00 10.25 H new ATOM 0 HB3 PRO A 23 0.958 8.861 9.009 1.00 10.25 H new ATOM 0 HG2 PRO A 23 2.586 11.066 7.783 1.00 71.41 H new ATOM 0 HG3 PRO A 23 2.949 10.071 9.179 1.00 71.41 H new ATOM 0 HD2 PRO A 23 3.871 9.625 6.534 1.00 65.02 H new ATOM 0 HD3 PRO A 23 4.003 8.499 7.870 1.00 65.02 H new ATOM 323 N GLN A 24 -0.732 10.202 5.985 1.00 2.34 N ATOM 324 CA GLN A 24 -1.404 11.133 5.155 1.00 55.24 C ATOM 325 C GLN A 24 -2.064 12.091 6.137 1.00 45.01 C ATOM 326 O GLN A 24 -2.438 11.660 7.233 1.00 12.21 O ATOM 327 CB GLN A 24 -2.461 10.419 4.306 1.00 33.40 C ATOM 328 CG GLN A 24 -1.973 9.108 3.724 1.00 31.02 C ATOM 329 CD GLN A 24 -2.841 8.570 2.629 1.00 12.44 C ATOM 330 OE1 GLN A 24 -4.028 8.820 2.579 1.00 43.32 O ATOM 331 NE2 GLN A 24 -2.252 7.808 1.752 1.00 43.31 N ATOM 0 H GLN A 24 -1.331 9.801 6.707 1.00 2.34 H new ATOM 0 HA GLN A 24 -0.736 11.641 4.459 1.00 55.24 H new ATOM 0 HB2 GLN A 24 -3.343 10.231 4.918 1.00 33.40 H new ATOM 0 HB3 GLN A 24 -2.770 11.077 3.494 1.00 33.40 H new ATOM 0 HG2 GLN A 24 -0.963 9.246 3.339 1.00 31.02 H new ATOM 0 HG3 GLN A 24 -1.911 8.368 4.522 1.00 31.02 H new ATOM 0 HE21 GLN A 24 -1.252 7.621 1.828 1.00 43.31 H new ATOM 0 HE22 GLN A 24 -2.791 7.398 0.989 1.00 43.31 H new ATOM 340 N PRO A 25 -2.192 13.369 5.826 1.00 24.32 N ATOM 341 CA PRO A 25 -2.741 14.336 6.772 1.00 15.42 C ATOM 342 C PRO A 25 -4.281 14.322 6.869 1.00 34.32 C ATOM 343 O PRO A 25 -4.981 14.838 5.989 1.00 23.40 O ATOM 344 CB PRO A 25 -2.233 15.672 6.243 1.00 53.51 C ATOM 345 CG PRO A 25 -2.076 15.469 4.770 1.00 64.22 C ATOM 346 CD PRO A 25 -1.808 13.998 4.546 1.00 14.34 C ATOM 0 HA PRO A 25 -2.426 14.112 7.791 1.00 15.42 H new ATOM 0 HB2 PRO A 25 -2.937 16.475 6.458 1.00 53.51 H new ATOM 0 HB3 PRO A 25 -1.286 15.946 6.707 1.00 53.51 H new ATOM 0 HG2 PRO A 25 -2.977 15.781 4.241 1.00 64.22 H new ATOM 0 HG3 PRO A 25 -1.255 16.073 4.384 1.00 64.22 H new ATOM 0 HD2 PRO A 25 -2.396 13.606 3.716 1.00 14.34 H new ATOM 0 HD3 PRO A 25 -0.760 13.814 4.309 1.00 14.34 H new ATOM 354 N LEU A 26 -4.812 13.701 7.927 1.00 4.41 N ATOM 355 CA LEU A 26 -6.254 13.673 8.167 1.00 71.01 C ATOM 356 C LEU A 26 -6.501 13.701 9.653 1.00 0.04 C ATOM 357 O LEU A 26 -5.718 13.130 10.413 1.00 24.21 O ATOM 358 CB LEU A 26 -6.933 12.384 7.664 1.00 71.01 C ATOM 359 CG LEU A 26 -6.748 11.941 6.225 1.00 75.54 C ATOM 360 CD1 LEU A 26 -5.450 11.186 6.046 1.00 50.01 C ATOM 361 CD2 LEU A 26 -7.907 11.096 5.818 1.00 20.51 C ATOM 0 H LEU A 26 -4.261 13.210 8.631 1.00 4.41 H new ATOM 0 HA LEU A 26 -6.664 14.531 7.634 1.00 71.01 H new ATOM 0 HB2 LEU A 26 -6.591 11.568 8.301 1.00 71.01 H new ATOM 0 HB3 LEU A 26 -8.004 12.494 7.834 1.00 71.01 H new ATOM 0 HG LEU A 26 -6.701 12.825 5.589 1.00 75.54 H new ATOM 0 HD11 LEU A 26 -5.347 10.882 5.004 1.00 50.01 H new ATOM 0 HD12 LEU A 26 -4.614 11.829 6.321 1.00 50.01 H new ATOM 0 HD13 LEU A 26 -5.453 10.302 6.683 1.00 50.01 H new ATOM 0 HD21 LEU A 26 -7.778 10.775 4.784 1.00 20.51 H new ATOM 0 HD22 LEU A 26 -7.964 10.221 6.465 1.00 20.51 H new ATOM 0 HD23 LEU A 26 -8.827 11.673 5.907 1.00 20.51 H new ATOM 373 N SER A 27 -7.564 14.347 10.076 1.00 24.02 N ATOM 374 CA SER A 27 -7.944 14.300 11.461 1.00 23.03 C ATOM 375 C SER A 27 -8.667 12.983 11.735 1.00 52.02 C ATOM 376 O SER A 27 -9.128 12.312 10.798 1.00 52.20 O ATOM 377 CB SER A 27 -8.844 15.489 11.840 1.00 22.54 C ATOM 378 OG SER A 27 -9.148 15.484 13.224 1.00 42.23 O ATOM 0 H SER A 27 -8.175 14.907 9.481 1.00 24.02 H new ATOM 0 HA SER A 27 -7.043 14.365 12.071 1.00 23.03 H new ATOM 0 HB2 SER A 27 -8.346 16.423 11.578 1.00 22.54 H new ATOM 0 HB3 SER A 27 -9.767 15.447 11.262 1.00 22.54 H new ATOM 0 HG SER A 27 -9.719 16.251 13.436 1.00 42.23 H new ATOM 384 N ALA A 28 -8.729 12.608 13.000 1.00 31.52 N ATOM 385 CA ALA A 28 -9.426 11.412 13.451 1.00 61.33 C ATOM 386 C ALA A 28 -10.835 11.318 12.871 1.00 11.10 C ATOM 387 O ALA A 28 -11.257 10.247 12.441 1.00 22.55 O ATOM 388 CB ALA A 28 -9.477 11.370 14.962 1.00 72.14 C ATOM 0 H ALA A 28 -8.290 13.133 13.757 1.00 31.52 H new ATOM 0 HA ALA A 28 -8.864 10.552 13.087 1.00 61.33 H new ATOM 0 HB1 ALA A 28 -10.001 10.470 15.283 1.00 72.14 H new ATOM 0 HB2 ALA A 28 -8.462 11.361 15.360 1.00 72.14 H new ATOM 0 HB3 ALA A 28 -10.004 12.249 15.333 1.00 72.14 H new ATOM 394 N GLU A 29 -11.552 12.429 12.832 1.00 44.03 N ATOM 395 CA GLU A 29 -12.894 12.412 12.285 1.00 63.53 C ATOM 396 C GLU A 29 -12.913 12.139 10.794 1.00 4.31 C ATOM 397 O GLU A 29 -13.814 11.447 10.301 1.00 55.31 O ATOM 398 CB GLU A 29 -13.683 13.632 12.657 1.00 53.14 C ATOM 399 CG GLU A 29 -13.794 13.796 14.150 1.00 23.53 C ATOM 400 CD GLU A 29 -15.077 14.440 14.552 1.00 71.31 C ATOM 401 OE1 GLU A 29 -15.185 15.682 14.459 1.00 62.24 O ATOM 402 OE2 GLU A 29 -16.006 13.723 14.941 1.00 63.51 O ATOM 0 H GLU A 29 -11.233 13.338 13.167 1.00 44.03 H new ATOM 0 HA GLU A 29 -13.401 11.568 12.753 1.00 63.53 H new ATOM 0 HB2 GLU A 29 -13.209 14.515 12.229 1.00 53.14 H new ATOM 0 HB3 GLU A 29 -14.681 13.565 12.224 1.00 53.14 H new ATOM 0 HG2 GLU A 29 -13.714 12.820 14.628 1.00 23.53 H new ATOM 0 HG3 GLU A 29 -12.959 14.397 14.511 1.00 23.53 H new ATOM 409 N GLU A 30 -11.913 12.659 10.065 1.00 12.24 N ATOM 410 CA GLU A 30 -11.756 12.291 8.660 1.00 14.31 C ATOM 411 C GLU A 30 -11.609 10.807 8.536 1.00 14.04 C ATOM 412 O GLU A 30 -12.153 10.212 7.614 1.00 14.44 O ATOM 413 CB GLU A 30 -10.564 12.951 7.953 1.00 21.03 C ATOM 414 CG GLU A 30 -10.736 14.388 7.524 1.00 10.30 C ATOM 415 CD GLU A 30 -10.753 15.374 8.642 1.00 13.41 C ATOM 416 OE1 GLU A 30 -11.797 15.586 9.246 1.00 53.21 O ATOM 417 OE2 GLU A 30 -9.706 15.972 8.907 1.00 14.12 O ATOM 0 H GLU A 30 -11.220 13.319 10.419 1.00 12.24 H new ATOM 0 HA GLU A 30 -12.658 12.655 8.168 1.00 14.31 H new ATOM 0 HB2 GLU A 30 -9.702 12.896 8.618 1.00 21.03 H new ATOM 0 HB3 GLU A 30 -10.323 12.360 7.070 1.00 21.03 H new ATOM 0 HG2 GLU A 30 -9.928 14.648 6.840 1.00 10.30 H new ATOM 0 HG3 GLU A 30 -11.667 14.477 6.965 1.00 10.30 H new ATOM 424 N LYS A 31 -10.922 10.183 9.514 1.00 52.22 N ATOM 425 CA LYS A 31 -10.731 8.760 9.457 1.00 51.52 C ATOM 426 C LYS A 31 -12.030 8.021 9.616 1.00 62.04 C ATOM 427 O LYS A 31 -12.250 7.068 8.935 1.00 14.23 O ATOM 428 CB LYS A 31 -9.665 8.163 10.412 1.00 20.14 C ATOM 429 CG LYS A 31 -8.197 8.284 9.983 1.00 34.22 C ATOM 430 CD LYS A 31 -7.541 9.563 10.361 1.00 13.34 C ATOM 431 CE LYS A 31 -6.030 9.482 10.136 1.00 71.33 C ATOM 432 NZ LYS A 31 -5.664 8.883 8.824 1.00 21.51 N ATOM 0 H LYS A 31 -10.509 10.646 10.323 1.00 52.22 H new ATOM 0 HA LYS A 31 -10.324 8.611 8.457 1.00 51.52 H new ATOM 0 HB2 LYS A 31 -9.774 8.644 11.384 1.00 20.14 H new ATOM 0 HB3 LYS A 31 -9.890 7.106 10.552 1.00 20.14 H new ATOM 0 HG2 LYS A 31 -7.635 7.460 10.423 1.00 34.22 H new ATOM 0 HG3 LYS A 31 -8.139 8.168 8.901 1.00 34.22 H new ATOM 0 HD2 LYS A 31 -7.958 10.380 9.772 1.00 13.34 H new ATOM 0 HD3 LYS A 31 -7.746 9.788 11.408 1.00 13.34 H new ATOM 0 HE2 LYS A 31 -5.605 10.484 10.202 1.00 71.33 H new ATOM 0 HE3 LYS A 31 -5.581 8.892 10.935 1.00 71.33 H new ATOM 0 HZ1 LYS A 31 -4.762 9.286 8.498 1.00 21.51 H new ATOM 0 HZ2 LYS A 31 -5.565 7.853 8.928 1.00 21.51 H new ATOM 0 HZ3 LYS A 31 -6.408 9.091 8.128 1.00 21.51 H new ATOM 446 N LYS A 32 -12.918 8.470 10.517 1.00 74.04 N ATOM 447 CA LYS A 32 -14.201 7.782 10.677 1.00 73.34 C ATOM 448 C LYS A 32 -15.070 7.909 9.434 1.00 31.12 C ATOM 449 O LYS A 32 -15.730 6.962 9.051 1.00 74.33 O ATOM 450 CB LYS A 32 -15.008 8.208 11.945 1.00 32.25 C ATOM 451 CG LYS A 32 -14.677 7.517 13.321 1.00 20.21 C ATOM 452 CD LYS A 32 -13.352 7.917 14.013 1.00 22.33 C ATOM 453 CE LYS A 32 -12.115 7.495 13.256 1.00 4.32 C ATOM 454 NZ LYS A 32 -12.056 6.035 13.030 1.00 73.45 N ATOM 0 H LYS A 32 -12.777 9.277 11.124 1.00 74.04 H new ATOM 0 HA LYS A 32 -13.933 6.735 10.822 1.00 73.34 H new ATOM 0 HB2 LYS A 32 -14.876 9.282 12.075 1.00 32.25 H new ATOM 0 HB3 LYS A 32 -16.064 8.039 11.736 1.00 32.25 H new ATOM 0 HG2 LYS A 32 -15.495 7.728 14.010 1.00 20.21 H new ATOM 0 HG3 LYS A 32 -14.663 6.439 13.163 1.00 20.21 H new ATOM 0 HD2 LYS A 32 -13.334 8.999 14.144 1.00 22.33 H new ATOM 0 HD3 LYS A 32 -13.325 7.474 15.009 1.00 22.33 H new ATOM 0 HE2 LYS A 32 -12.089 8.009 12.295 1.00 4.32 H new ATOM 0 HE3 LYS A 32 -11.230 7.809 13.810 1.00 4.32 H new ATOM 0 HZ1 LYS A 32 -11.188 5.799 12.507 1.00 73.45 H new ATOM 0 HZ2 LYS A 32 -12.053 5.542 13.946 1.00 73.45 H new ATOM 0 HZ3 LYS A 32 -12.885 5.735 12.478 1.00 73.45 H new ATOM 468 N GLU A 33 -15.042 9.063 8.801 1.00 45.53 N ATOM 469 CA GLU A 33 -15.848 9.295 7.606 1.00 2.40 C ATOM 470 C GLU A 33 -15.398 8.410 6.442 1.00 35.20 C ATOM 471 O GLU A 33 -16.209 7.782 5.774 1.00 33.45 O ATOM 472 CB GLU A 33 -15.807 10.765 7.204 1.00 52.54 C ATOM 473 CG GLU A 33 -16.448 11.690 8.212 1.00 55.42 C ATOM 474 CD GLU A 33 -17.894 11.346 8.443 1.00 1.30 C ATOM 475 OE1 GLU A 33 -18.702 11.497 7.532 1.00 43.51 O ATOM 476 OE2 GLU A 33 -18.230 10.888 9.521 1.00 3.21 O ATOM 0 H GLU A 33 -14.472 9.859 9.089 1.00 45.53 H new ATOM 0 HA GLU A 33 -16.876 9.028 7.849 1.00 2.40 H new ATOM 0 HB2 GLU A 33 -14.769 11.064 7.059 1.00 52.54 H new ATOM 0 HB3 GLU A 33 -16.310 10.884 6.244 1.00 52.54 H new ATOM 0 HG2 GLU A 33 -15.905 11.632 9.155 1.00 55.42 H new ATOM 0 HG3 GLU A 33 -16.370 12.719 7.862 1.00 55.42 H new ATOM 483 N ILE A 34 -14.112 8.363 6.233 1.00 54.23 N ATOM 484 CA ILE A 34 -13.537 7.579 5.147 1.00 10.14 C ATOM 485 C ILE A 34 -13.660 6.084 5.437 1.00 63.21 C ATOM 486 O ILE A 34 -13.873 5.278 4.531 1.00 54.05 O ATOM 487 CB ILE A 34 -12.082 7.984 4.821 1.00 42.43 C ATOM 488 CG1 ILE A 34 -11.187 7.796 6.042 1.00 24.44 C ATOM 489 CG2 ILE A 34 -12.034 9.427 4.309 1.00 70.04 C ATOM 490 CD1 ILE A 34 -9.797 8.317 5.874 1.00 55.23 C ATOM 0 H ILE A 34 -13.426 8.860 6.801 1.00 54.23 H new ATOM 0 HA ILE A 34 -14.115 7.800 4.250 1.00 10.14 H new ATOM 0 HB ILE A 34 -11.704 7.335 4.031 1.00 42.43 H new ATOM 0 HG12 ILE A 34 -11.648 8.294 6.895 1.00 24.44 H new ATOM 0 HG13 ILE A 34 -11.137 6.734 6.281 1.00 24.44 H new ATOM 0 HG21 ILE A 34 -11.003 9.699 4.083 1.00 70.04 H new ATOM 0 HG22 ILE A 34 -12.638 9.513 3.406 1.00 70.04 H new ATOM 0 HG23 ILE A 34 -12.427 10.097 5.073 1.00 70.04 H new ATOM 0 HD11 ILE A 34 -9.230 8.142 6.788 1.00 55.23 H new ATOM 0 HD12 ILE A 34 -9.314 7.803 5.043 1.00 55.23 H new ATOM 0 HD13 ILE A 34 -9.832 9.387 5.667 1.00 55.23 H new ATOM 502 N ASP A 35 -13.564 5.739 6.722 1.00 51.11 N ATOM 503 CA ASP A 35 -13.636 4.352 7.205 1.00 11.44 C ATOM 504 C ASP A 35 -15.041 3.809 6.943 1.00 74.44 C ATOM 505 O ASP A 35 -15.211 2.671 6.535 1.00 62.43 O ATOM 506 CB ASP A 35 -13.343 4.343 8.708 1.00 54.52 C ATOM 507 CG ASP A 35 -13.206 2.983 9.322 1.00 51.12 C ATOM 508 OD1 ASP A 35 -14.208 2.342 9.605 1.00 32.41 O ATOM 509 OD2 ASP A 35 -12.066 2.563 9.559 1.00 60.44 O ATOM 0 H ASP A 35 -13.432 6.421 7.469 1.00 51.11 H new ATOM 0 HA ASP A 35 -12.908 3.727 6.688 1.00 11.44 H new ATOM 0 HB2 ASP A 35 -12.423 4.899 8.886 1.00 54.52 H new ATOM 0 HB3 ASP A 35 -14.143 4.877 9.221 1.00 54.52 H new ATOM 514 N LYS A 36 -16.038 4.681 7.144 1.00 65.42 N ATOM 515 CA LYS A 36 -17.456 4.377 6.860 1.00 44.14 C ATOM 516 C LYS A 36 -17.641 3.980 5.420 1.00 75.34 C ATOM 517 O LYS A 36 -18.520 3.202 5.079 1.00 41.13 O ATOM 518 CB LYS A 36 -18.322 5.615 7.102 1.00 42.33 C ATOM 519 CG LYS A 36 -18.661 5.924 8.504 1.00 44.04 C ATOM 520 CD LYS A 36 -19.370 7.250 8.575 1.00 13.32 C ATOM 521 CE LYS A 36 -19.457 7.712 9.985 1.00 72.43 C ATOM 522 NZ LYS A 36 -20.076 9.045 10.088 1.00 61.14 N ATOM 0 H LYS A 36 -15.888 5.622 7.509 1.00 65.42 H new ATOM 0 HA LYS A 36 -17.750 3.560 7.519 1.00 44.14 H new ATOM 0 HB2 LYS A 36 -17.808 6.478 6.678 1.00 42.33 H new ATOM 0 HB3 LYS A 36 -19.252 5.494 6.546 1.00 42.33 H new ATOM 0 HG2 LYS A 36 -19.295 5.139 8.916 1.00 44.04 H new ATOM 0 HG3 LYS A 36 -17.755 5.952 9.109 1.00 44.04 H new ATOM 0 HD2 LYS A 36 -18.837 7.988 7.975 1.00 13.32 H new ATOM 0 HD3 LYS A 36 -20.371 7.158 8.152 1.00 13.32 H new ATOM 0 HE2 LYS A 36 -20.038 6.996 10.567 1.00 72.43 H new ATOM 0 HE3 LYS A 36 -18.458 7.741 10.420 1.00 72.43 H new ATOM 0 HZ1 LYS A 36 -20.134 9.325 11.088 1.00 61.14 H new ATOM 0 HZ2 LYS A 36 -19.499 9.737 9.568 1.00 61.14 H new ATOM 0 HZ3 LYS A 36 -21.032 9.016 9.681 1.00 61.14 H new ATOM 536 N ARG A 37 -16.810 4.533 4.591 1.00 62.15 N ATOM 537 CA ARG A 37 -16.878 4.364 3.184 1.00 11.23 C ATOM 538 C ARG A 37 -15.810 3.405 2.676 1.00 44.15 C ATOM 539 O ARG A 37 -15.502 3.386 1.476 1.00 43.43 O ATOM 540 CB ARG A 37 -16.733 5.728 2.552 1.00 63.33 C ATOM 541 CG ARG A 37 -17.921 6.634 2.813 1.00 41.10 C ATOM 542 CD ARG A 37 -17.665 8.038 2.330 1.00 43.42 C ATOM 543 NE ARG A 37 -16.787 8.808 3.225 1.00 71.14 N ATOM 544 CZ ARG A 37 -15.822 9.657 2.829 1.00 22.01 C ATOM 545 NH1 ARG A 37 -15.300 9.571 1.611 1.00 64.22 N ATOM 546 NH2 ARG A 37 -15.319 10.533 3.686 1.00 60.22 N ATOM 0 H ARG A 37 -16.042 5.133 4.892 1.00 62.15 H new ATOM 0 HA ARG A 37 -17.836 3.920 2.913 1.00 11.23 H new ATOM 0 HB2 ARG A 37 -15.830 6.204 2.933 1.00 63.33 H new ATOM 0 HB3 ARG A 37 -16.602 5.611 1.476 1.00 63.33 H new ATOM 0 HG2 ARG A 37 -18.802 6.232 2.314 1.00 41.10 H new ATOM 0 HG3 ARG A 37 -18.139 6.650 3.881 1.00 41.10 H new ATOM 0 HD2 ARG A 37 -17.216 7.998 1.338 1.00 43.42 H new ATOM 0 HD3 ARG A 37 -18.617 8.560 2.228 1.00 43.42 H new ATOM 0 HE ARG A 37 -16.921 8.688 4.229 1.00 71.14 H new ATOM 0 HH11 ARG A 37 -15.630 8.855 0.964 1.00 64.22 H new ATOM 0 HH12 ARG A 37 -14.569 10.221 1.323 1.00 64.22 H new ATOM 0 HH21 ARG A 37 -15.664 10.563 4.646 1.00 60.22 H new ATOM 0 HH22 ARG A 37 -14.587 11.177 3.386 1.00 60.22 H new ATOM 560 N SER A 38 -15.266 2.606 3.565 1.00 61.44 N ATOM 561 CA SER A 38 -14.273 1.636 3.193 1.00 64.01 C ATOM 562 C SER A 38 -14.904 0.264 2.955 1.00 24.23 C ATOM 563 O SER A 38 -15.879 -0.117 3.599 1.00 22.43 O ATOM 564 CB SER A 38 -13.219 1.531 4.292 1.00 15.35 C ATOM 565 OG SER A 38 -12.599 2.782 4.528 1.00 11.23 O ATOM 0 H SER A 38 -15.500 2.613 4.558 1.00 61.44 H new ATOM 0 HA SER A 38 -13.807 1.965 2.264 1.00 64.01 H new ATOM 0 HB2 SER A 38 -13.683 1.173 5.211 1.00 15.35 H new ATOM 0 HB3 SER A 38 -12.465 0.797 4.008 1.00 15.35 H new ATOM 0 HG SER A 38 -13.259 3.499 4.423 1.00 11.23 H new ATOM 571 N VAL A 39 -14.344 -0.461 2.029 1.00 62.33 N ATOM 572 CA VAL A 39 -14.784 -1.800 1.735 1.00 31.33 C ATOM 573 C VAL A 39 -13.594 -2.724 1.768 1.00 1.14 C ATOM 574 O VAL A 39 -12.448 -2.274 1.665 1.00 22.35 O ATOM 575 CB VAL A 39 -15.526 -1.933 0.360 1.00 45.15 C ATOM 576 CG1 VAL A 39 -16.773 -1.081 0.296 1.00 31.04 C ATOM 577 CG2 VAL A 39 -14.604 -1.640 -0.813 1.00 10.11 C ATOM 0 H VAL A 39 -13.566 -0.141 1.453 1.00 62.33 H new ATOM 0 HA VAL A 39 -15.513 -2.072 2.498 1.00 31.33 H new ATOM 0 HB VAL A 39 -15.841 -2.974 0.282 1.00 45.15 H new ATOM 0 HG11 VAL A 39 -17.251 -1.208 -0.675 1.00 31.04 H new ATOM 0 HG12 VAL A 39 -17.463 -1.386 1.082 1.00 31.04 H new ATOM 0 HG13 VAL A 39 -16.505 -0.033 0.435 1.00 31.04 H new ATOM 0 HG21 VAL A 39 -15.158 -1.743 -1.746 1.00 10.11 H new ATOM 0 HG22 VAL A 39 -14.221 -0.623 -0.729 1.00 10.11 H new ATOM 0 HG23 VAL A 39 -13.771 -2.343 -0.806 1.00 10.11 H new ATOM 587 N TYR A 40 -13.855 -3.975 1.909 1.00 65.51 N ATOM 588 CA TYR A 40 -12.851 -4.991 1.918 1.00 15.40 C ATOM 589 C TYR A 40 -12.961 -5.777 0.653 1.00 11.42 C ATOM 590 O TYR A 40 -14.036 -6.254 0.319 1.00 42.21 O ATOM 591 CB TYR A 40 -13.031 -5.931 3.124 1.00 31.32 C ATOM 592 CG TYR A 40 -12.261 -7.248 3.000 1.00 22.14 C ATOM 593 CD1 TYR A 40 -10.941 -7.364 3.389 1.00 35.22 C ATOM 594 CD2 TYR A 40 -12.885 -8.376 2.464 1.00 11.12 C ATOM 595 CE1 TYR A 40 -10.264 -8.567 3.251 1.00 74.11 C ATOM 596 CE2 TYR A 40 -12.232 -9.562 2.316 1.00 42.34 C ATOM 597 CZ TYR A 40 -10.923 -9.667 2.709 1.00 62.41 C ATOM 598 OH TYR A 40 -10.264 -10.867 2.537 1.00 21.40 O ATOM 0 H TYR A 40 -14.802 -4.336 2.025 1.00 65.51 H new ATOM 0 HA TYR A 40 -11.869 -4.523 1.995 1.00 15.40 H new ATOM 0 HB2 TYR A 40 -12.706 -5.414 4.027 1.00 31.32 H new ATOM 0 HB3 TYR A 40 -14.092 -6.151 3.246 1.00 31.32 H new ATOM 0 HD1 TYR A 40 -10.430 -6.508 3.805 1.00 35.22 H new ATOM 0 HD2 TYR A 40 -13.918 -8.306 2.157 1.00 11.12 H new ATOM 0 HE1 TYR A 40 -9.233 -8.650 3.562 1.00 74.11 H new ATOM 0 HE2 TYR A 40 -12.742 -10.414 1.892 1.00 42.34 H new ATOM 0 HH TYR A 40 -10.917 -11.576 2.360 1.00 21.40 H new ATOM 608 N VAL A 41 -11.884 -5.883 -0.052 1.00 63.04 N ATOM 609 CA VAL A 41 -11.802 -6.674 -1.242 1.00 41.52 C ATOM 610 C VAL A 41 -10.833 -7.815 -0.977 1.00 21.20 C ATOM 611 O VAL A 41 -9.639 -7.578 -0.784 1.00 20.30 O ATOM 612 CB VAL A 41 -11.252 -5.811 -2.391 1.00 1.31 C ATOM 613 CG1 VAL A 41 -11.151 -6.617 -3.683 1.00 0.22 C ATOM 614 CG2 VAL A 41 -12.121 -4.592 -2.603 1.00 65.42 C ATOM 0 H VAL A 41 -11.012 -5.411 0.187 1.00 63.04 H new ATOM 0 HA VAL A 41 -12.786 -7.055 -1.514 1.00 41.52 H new ATOM 0 HB VAL A 41 -10.250 -5.484 -2.113 1.00 1.31 H new ATOM 0 HG11 VAL A 41 -10.760 -5.982 -4.478 1.00 0.22 H new ATOM 0 HG12 VAL A 41 -10.482 -7.464 -3.532 1.00 0.22 H new ATOM 0 HG13 VAL A 41 -12.140 -6.981 -3.963 1.00 0.22 H new ATOM 0 HG21 VAL A 41 -11.716 -3.994 -3.419 1.00 65.42 H new ATOM 0 HG22 VAL A 41 -13.135 -4.907 -2.852 1.00 65.42 H new ATOM 0 HG23 VAL A 41 -12.140 -3.995 -1.691 1.00 65.42 H new ATOM 624 N GLY A 42 -11.330 -9.019 -0.924 1.00 52.42 N ATOM 625 CA GLY A 42 -10.475 -10.145 -0.664 1.00 24.34 C ATOM 626 C GLY A 42 -10.372 -11.090 -1.825 1.00 10.12 C ATOM 627 O GLY A 42 -11.111 -10.957 -2.804 1.00 23.04 O ATOM 0 H GLY A 42 -12.316 -9.246 -1.056 1.00 52.42 H new ATOM 0 HA2 GLY A 42 -9.479 -9.785 -0.408 1.00 24.34 H new ATOM 0 HA3 GLY A 42 -10.852 -10.686 0.204 1.00 24.34 H new ATOM 631 N ASN A 43 -9.451 -12.058 -1.692 1.00 35.34 N ATOM 632 CA ASN A 43 -9.131 -13.095 -2.719 1.00 20.10 C ATOM 633 C ASN A 43 -8.679 -12.416 -4.036 1.00 40.12 C ATOM 634 O ASN A 43 -8.740 -12.979 -5.126 1.00 3.32 O ATOM 635 CB ASN A 43 -10.346 -14.029 -2.940 1.00 12.41 C ATOM 636 CG ASN A 43 -9.993 -15.349 -3.646 1.00 3.44 C ATOM 637 OD1 ASN A 43 -9.667 -16.336 -2.994 1.00 40.20 O ATOM 638 ND2 ASN A 43 -10.051 -15.384 -4.942 1.00 30.31 N ATOM 0 H ASN A 43 -8.886 -12.154 -0.848 1.00 35.34 H new ATOM 0 HA ASN A 43 -8.306 -13.712 -2.363 1.00 20.10 H new ATOM 0 HB2 ASN A 43 -10.800 -14.254 -1.975 1.00 12.41 H new ATOM 0 HB3 ASN A 43 -11.096 -13.501 -3.530 1.00 12.41 H new ATOM 0 HD21 ASN A 43 -9.823 -16.245 -5.440 1.00 30.31 H new ATOM 0 HD22 ASN A 43 -10.325 -14.551 -5.463 1.00 30.31 H new ATOM 645 N VAL A 44 -8.175 -11.214 -3.884 1.00 61.44 N ATOM 646 CA VAL A 44 -7.714 -10.392 -4.994 1.00 52.43 C ATOM 647 C VAL A 44 -6.187 -10.619 -5.231 1.00 12.51 C ATOM 648 O VAL A 44 -5.530 -9.929 -6.022 1.00 53.53 O ATOM 649 CB VAL A 44 -8.038 -8.905 -4.686 1.00 60.11 C ATOM 650 CG1 VAL A 44 -7.264 -8.382 -3.498 1.00 53.01 C ATOM 651 CG2 VAL A 44 -7.848 -8.047 -5.882 1.00 15.30 C ATOM 0 H VAL A 44 -8.069 -10.766 -2.974 1.00 61.44 H new ATOM 0 HA VAL A 44 -8.228 -10.674 -5.913 1.00 52.43 H new ATOM 0 HB VAL A 44 -9.093 -8.863 -4.415 1.00 60.11 H new ATOM 0 HG11 VAL A 44 -7.526 -7.338 -3.324 1.00 53.01 H new ATOM 0 HG12 VAL A 44 -7.512 -8.971 -2.615 1.00 53.01 H new ATOM 0 HG13 VAL A 44 -6.195 -8.459 -3.697 1.00 53.01 H new ATOM 0 HG21 VAL A 44 -8.084 -7.013 -5.629 1.00 15.30 H new ATOM 0 HG22 VAL A 44 -6.812 -8.112 -6.215 1.00 15.30 H new ATOM 0 HG23 VAL A 44 -8.508 -8.385 -6.681 1.00 15.30 H new ATOM 661 N ASP A 45 -5.695 -11.616 -4.532 1.00 4.25 N ATOM 662 CA ASP A 45 -4.305 -12.123 -4.513 1.00 63.23 C ATOM 663 C ASP A 45 -3.626 -12.087 -5.870 1.00 72.03 C ATOM 664 O ASP A 45 -3.921 -12.924 -6.735 1.00 12.14 O ATOM 665 CB ASP A 45 -4.359 -13.605 -4.151 1.00 62.14 C ATOM 666 CG ASP A 45 -5.169 -13.955 -2.927 1.00 32.53 C ATOM 667 OD1 ASP A 45 -6.355 -14.203 -3.058 1.00 14.03 O ATOM 668 OD2 ASP A 45 -4.630 -14.022 -1.839 1.00 41.41 O ATOM 0 H ASP A 45 -6.292 -12.152 -3.902 1.00 4.25 H new ATOM 0 HA ASP A 45 -3.755 -11.493 -3.814 1.00 63.23 H new ATOM 0 HB2 ASP A 45 -4.766 -14.152 -5.001 1.00 62.14 H new ATOM 0 HB3 ASP A 45 -3.339 -13.960 -4.002 1.00 62.14 H new ATOM 673 N TYR A 46 -2.681 -11.136 -6.035 1.00 0.03 N ATOM 674 CA TYR A 46 -1.902 -10.941 -7.262 1.00 72.04 C ATOM 675 C TYR A 46 -2.661 -10.851 -8.595 1.00 20.31 C ATOM 676 O TYR A 46 -3.840 -11.175 -8.707 1.00 75.54 O ATOM 677 CB TYR A 46 -0.611 -11.775 -7.314 1.00 42.14 C ATOM 678 CG TYR A 46 0.524 -11.165 -6.513 1.00 33.25 C ATOM 679 CD1 TYR A 46 1.284 -10.137 -7.059 1.00 2.32 C ATOM 680 CD2 TYR A 46 0.848 -11.602 -5.238 1.00 71.14 C ATOM 681 CE1 TYR A 46 2.325 -9.565 -6.364 1.00 13.20 C ATOM 682 CE2 TYR A 46 1.898 -11.022 -4.537 1.00 54.42 C ATOM 683 CZ TYR A 46 2.625 -10.007 -5.110 1.00 44.03 C ATOM 684 OH TYR A 46 3.665 -9.437 -4.425 1.00 53.11 O ATOM 0 H TYR A 46 -2.439 -10.472 -5.299 1.00 0.03 H new ATOM 0 HA TYR A 46 -1.589 -9.902 -7.153 1.00 72.04 H new ATOM 0 HB2 TYR A 46 -0.817 -12.777 -6.936 1.00 42.14 H new ATOM 0 HB3 TYR A 46 -0.297 -11.884 -8.352 1.00 42.14 H new ATOM 0 HD1 TYR A 46 1.052 -9.779 -8.051 1.00 2.32 H new ATOM 0 HD2 TYR A 46 0.279 -12.401 -4.785 1.00 71.14 H new ATOM 0 HE1 TYR A 46 2.902 -8.769 -6.811 1.00 13.20 H new ATOM 0 HE2 TYR A 46 2.142 -11.368 -3.544 1.00 54.42 H new ATOM 0 HH TYR A 46 3.750 -9.862 -3.546 1.00 53.11 H new ATOM 694 N GLY A 47 -1.978 -10.332 -9.599 1.00 15.44 N ATOM 695 CA GLY A 47 -2.578 -10.136 -10.908 1.00 21.25 C ATOM 696 C GLY A 47 -3.412 -8.866 -10.953 1.00 63.55 C ATOM 697 O GLY A 47 -3.454 -8.155 -11.961 1.00 70.14 O ATOM 0 H GLY A 47 -1.004 -10.037 -9.533 1.00 15.44 H new ATOM 0 HA2 GLY A 47 -1.795 -10.086 -11.665 1.00 21.25 H new ATOM 0 HA3 GLY A 47 -3.205 -10.993 -11.154 1.00 21.25 H new ATOM 701 N SER A 48 -4.065 -8.605 -9.866 1.00 70.33 N ATOM 702 CA SER A 48 -4.893 -7.474 -9.675 1.00 62.40 C ATOM 703 C SER A 48 -4.026 -6.228 -9.421 1.00 15.41 C ATOM 704 O SER A 48 -3.250 -6.184 -8.451 1.00 33.51 O ATOM 705 CB SER A 48 -5.775 -7.780 -8.478 1.00 33.42 C ATOM 706 OG SER A 48 -6.450 -9.016 -8.673 1.00 44.24 O ATOM 0 H SER A 48 -4.028 -9.213 -9.048 1.00 70.33 H new ATOM 0 HA SER A 48 -5.503 -7.268 -10.555 1.00 62.40 H new ATOM 0 HB2 SER A 48 -5.170 -7.826 -7.573 1.00 33.42 H new ATOM 0 HB3 SER A 48 -6.500 -6.979 -8.336 1.00 33.42 H new ATOM 0 HG SER A 48 -6.304 -9.595 -7.896 1.00 44.24 H new ATOM 712 N THR A 49 -4.129 -5.247 -10.297 1.00 11.00 N ATOM 713 CA THR A 49 -3.348 -4.035 -10.182 1.00 10.23 C ATOM 714 C THR A 49 -4.209 -2.926 -9.584 1.00 43.21 C ATOM 715 O THR A 49 -5.437 -3.029 -9.593 1.00 71.35 O ATOM 716 CB THR A 49 -2.805 -3.611 -11.561 1.00 42.11 C ATOM 717 OG1 THR A 49 -3.899 -3.372 -12.453 1.00 14.54 O ATOM 718 CG2 THR A 49 -1.935 -4.715 -12.137 1.00 64.15 C ATOM 0 H THR A 49 -4.753 -5.269 -11.103 1.00 11.00 H new ATOM 0 HA THR A 49 -2.499 -4.220 -9.524 1.00 10.23 H new ATOM 0 HB THR A 49 -2.214 -2.703 -11.444 1.00 42.11 H new ATOM 0 HG1 THR A 49 -3.554 -3.101 -13.329 1.00 14.54 H new ATOM 0 HG21 THR A 49 -1.555 -4.408 -13.111 1.00 64.15 H new ATOM 0 HG22 THR A 49 -1.098 -4.907 -11.465 1.00 64.15 H new ATOM 0 HG23 THR A 49 -2.527 -5.624 -12.248 1.00 64.15 H new ATOM 726 N ALA A 50 -3.593 -1.860 -9.087 1.00 33.41 N ATOM 727 CA ALA A 50 -4.324 -0.803 -8.403 1.00 62.32 C ATOM 728 C ALA A 50 -5.269 -0.056 -9.341 1.00 63.24 C ATOM 729 O ALA A 50 -6.443 0.113 -9.035 1.00 52.30 O ATOM 730 CB ALA A 50 -3.340 0.157 -7.745 1.00 31.45 C ATOM 0 H ALA A 50 -2.586 -1.706 -9.146 1.00 33.41 H new ATOM 0 HA ALA A 50 -4.946 -1.265 -7.636 1.00 62.32 H new ATOM 0 HB1 ALA A 50 -3.889 0.947 -7.234 1.00 31.45 H new ATOM 0 HB2 ALA A 50 -2.729 -0.386 -7.023 1.00 31.45 H new ATOM 0 HB3 ALA A 50 -2.696 0.597 -8.507 1.00 31.45 H new ATOM 736 N GLN A 51 -4.755 0.384 -10.484 1.00 31.12 N ATOM 737 CA GLN A 51 -5.567 1.110 -11.478 1.00 42.35 C ATOM 738 C GLN A 51 -6.781 0.260 -11.935 1.00 43.05 C ATOM 739 O GLN A 51 -7.879 0.785 -12.108 1.00 41.23 O ATOM 740 CB GLN A 51 -4.689 1.469 -12.694 1.00 12.30 C ATOM 741 CG GLN A 51 -4.250 0.242 -13.464 1.00 3.31 C ATOM 742 CD GLN A 51 -3.248 0.469 -14.526 1.00 60.32 C ATOM 743 OE1 GLN A 51 -3.605 0.702 -15.653 1.00 11.40 O ATOM 744 NE2 GLN A 51 -1.995 0.393 -14.183 1.00 24.43 N ATOM 0 H GLN A 51 -3.780 0.255 -10.754 1.00 31.12 H new ATOM 0 HA GLN A 51 -5.947 2.021 -11.016 1.00 42.35 H new ATOM 0 HB2 GLN A 51 -5.244 2.133 -13.357 1.00 12.30 H new ATOM 0 HB3 GLN A 51 -3.810 2.018 -12.356 1.00 12.30 H new ATOM 0 HG2 GLN A 51 -3.843 -0.481 -12.756 1.00 3.31 H new ATOM 0 HG3 GLN A 51 -5.131 -0.215 -13.915 1.00 3.31 H new ATOM 0 HE21 GLN A 51 -1.742 0.193 -13.215 1.00 24.43 H new ATOM 0 HE22 GLN A 51 -1.265 0.533 -14.882 1.00 24.43 H new ATOM 753 N ASP A 52 -6.561 -1.045 -12.092 1.00 11.33 N ATOM 754 CA ASP A 52 -7.611 -1.968 -12.538 1.00 43.22 C ATOM 755 C ASP A 52 -8.655 -2.136 -11.460 1.00 34.23 C ATOM 756 O ASP A 52 -9.856 -2.186 -11.740 1.00 55.32 O ATOM 757 CB ASP A 52 -7.019 -3.322 -12.925 1.00 32.21 C ATOM 758 CG ASP A 52 -8.049 -4.270 -13.492 1.00 14.22 C ATOM 759 OD1 ASP A 52 -8.311 -4.208 -14.713 1.00 15.23 O ATOM 760 OD2 ASP A 52 -8.604 -5.087 -12.752 1.00 73.20 O ATOM 0 H ASP A 52 -5.661 -1.491 -11.916 1.00 11.33 H new ATOM 0 HA ASP A 52 -8.087 -1.542 -13.421 1.00 43.22 H new ATOM 0 HB2 ASP A 52 -6.228 -3.171 -13.659 1.00 32.21 H new ATOM 0 HB3 ASP A 52 -6.558 -3.776 -12.048 1.00 32.21 H new ATOM 765 N LEU A 53 -8.192 -2.165 -10.224 1.00 51.32 N ATOM 766 CA LEU A 53 -9.062 -2.287 -9.070 1.00 14.52 C ATOM 767 C LEU A 53 -9.892 -1.047 -8.894 1.00 42.14 C ATOM 768 O LEU A 53 -11.116 -1.121 -8.722 1.00 10.22 O ATOM 769 CB LEU A 53 -8.227 -2.538 -7.807 1.00 3.30 C ATOM 770 CG LEU A 53 -7.701 -3.944 -7.634 1.00 51.20 C ATOM 771 CD1 LEU A 53 -6.686 -3.983 -6.499 1.00 51.32 C ATOM 772 CD2 LEU A 53 -8.867 -4.847 -7.302 1.00 23.30 C ATOM 0 H LEU A 53 -7.201 -2.105 -9.992 1.00 51.32 H new ATOM 0 HA LEU A 53 -9.732 -3.131 -9.233 1.00 14.52 H new ATOM 0 HB2 LEU A 53 -7.380 -1.852 -7.812 1.00 3.30 H new ATOM 0 HB3 LEU A 53 -8.835 -2.288 -6.937 1.00 3.30 H new ATOM 0 HG LEU A 53 -7.213 -4.275 -8.550 1.00 51.20 H new ATOM 0 HD11 LEU A 53 -6.312 -5.000 -6.381 1.00 51.32 H new ATOM 0 HD12 LEU A 53 -5.856 -3.315 -6.730 1.00 51.32 H new ATOM 0 HD13 LEU A 53 -7.163 -3.662 -5.573 1.00 51.32 H new ATOM 0 HD21 LEU A 53 -8.510 -5.869 -7.173 1.00 23.30 H new ATOM 0 HD22 LEU A 53 -9.339 -4.508 -6.380 1.00 23.30 H new ATOM 0 HD23 LEU A 53 -9.594 -4.816 -8.114 1.00 23.30 H new ATOM 784 N GLU A 54 -9.239 0.092 -8.965 1.00 11.10 N ATOM 785 CA GLU A 54 -9.876 1.369 -8.813 1.00 42.31 C ATOM 786 C GLU A 54 -10.914 1.571 -9.914 1.00 0.32 C ATOM 787 O GLU A 54 -12.033 1.901 -9.634 1.00 32.34 O ATOM 788 CB GLU A 54 -8.753 2.427 -8.835 1.00 12.55 C ATOM 789 CG GLU A 54 -9.098 3.864 -8.419 1.00 43.01 C ATOM 790 CD GLU A 54 -9.935 4.634 -9.409 1.00 32.14 C ATOM 791 OE1 GLU A 54 -9.837 4.375 -10.614 1.00 72.23 O ATOM 792 OE2 GLU A 54 -10.619 5.567 -9.003 1.00 35.41 O ATOM 0 H GLU A 54 -8.235 0.151 -9.133 1.00 11.10 H new ATOM 0 HA GLU A 54 -10.424 1.449 -7.874 1.00 42.31 H new ATOM 0 HB2 GLU A 54 -7.953 2.076 -8.184 1.00 12.55 H new ATOM 0 HB3 GLU A 54 -8.349 2.462 -9.847 1.00 12.55 H new ATOM 0 HG2 GLU A 54 -9.627 3.833 -7.467 1.00 43.01 H new ATOM 0 HG3 GLU A 54 -8.170 4.409 -8.250 1.00 43.01 H new ATOM 799 N ALA A 55 -10.539 1.314 -11.153 1.00 24.42 N ATOM 800 CA ALA A 55 -11.476 1.429 -12.277 1.00 23.25 C ATOM 801 C ALA A 55 -12.684 0.507 -12.071 1.00 15.51 C ATOM 802 O ALA A 55 -13.845 0.909 -12.290 1.00 12.22 O ATOM 803 CB ALA A 55 -10.769 1.069 -13.572 1.00 40.44 C ATOM 0 H ALA A 55 -9.597 1.024 -11.416 1.00 24.42 H new ATOM 0 HA ALA A 55 -11.831 2.458 -12.330 1.00 23.25 H new ATOM 0 HB1 ALA A 55 -11.468 1.155 -14.404 1.00 40.44 H new ATOM 0 HB2 ALA A 55 -9.931 1.748 -13.730 1.00 40.44 H new ATOM 0 HB3 ALA A 55 -10.400 0.045 -13.513 1.00 40.44 H new ATOM 809 N HIS A 56 -12.418 -0.688 -11.591 1.00 32.43 N ATOM 810 CA HIS A 56 -13.456 -1.693 -11.438 1.00 5.21 C ATOM 811 C HIS A 56 -14.475 -1.249 -10.382 1.00 23.35 C ATOM 812 O HIS A 56 -15.675 -1.444 -10.536 1.00 70.32 O ATOM 813 CB HIS A 56 -12.841 -3.051 -11.079 1.00 23.41 C ATOM 814 CG HIS A 56 -13.773 -4.207 -11.253 1.00 10.13 C ATOM 815 ND1 HIS A 56 -13.681 -5.085 -12.308 1.00 21.24 N ATOM 816 CD2 HIS A 56 -14.811 -4.634 -10.510 1.00 73.35 C ATOM 817 CE1 HIS A 56 -14.621 -5.992 -12.209 1.00 72.04 C ATOM 818 NE2 HIS A 56 -15.319 -5.741 -11.125 1.00 33.21 N ATOM 0 H HIS A 56 -11.489 -0.992 -11.298 1.00 32.43 H new ATOM 0 HA HIS A 56 -13.980 -1.804 -12.388 1.00 5.21 H new ATOM 0 HB2 HIS A 56 -11.958 -3.213 -11.698 1.00 23.41 H new ATOM 0 HB3 HIS A 56 -12.503 -3.023 -10.043 1.00 23.41 H new ATOM 0 HD2 HIS A 56 -15.174 -4.184 -9.598 1.00 73.35 H new ATOM 0 HE1 HIS A 56 -14.792 -6.805 -12.899 1.00 72.04 H new ATOM 0 HE2 HIS A 56 -16.115 -6.287 -10.795 1.00 33.21 H new ATOM 827 N PHE A 57 -13.981 -0.656 -9.324 1.00 63.21 N ATOM 828 CA PHE A 57 -14.821 -0.142 -8.263 1.00 20.53 C ATOM 829 C PHE A 57 -15.387 1.224 -8.569 1.00 21.21 C ATOM 830 O PHE A 57 -16.398 1.623 -8.015 1.00 32.42 O ATOM 831 CB PHE A 57 -14.167 -0.222 -6.904 1.00 22.33 C ATOM 832 CG PHE A 57 -14.143 -1.612 -6.382 1.00 41.31 C ATOM 833 CD1 PHE A 57 -15.257 -2.119 -5.769 1.00 14.35 C ATOM 834 CD2 PHE A 57 -13.034 -2.413 -6.513 1.00 3.51 C ATOM 835 CE1 PHE A 57 -15.271 -3.404 -5.288 1.00 41.43 C ATOM 836 CE2 PHE A 57 -13.040 -3.699 -6.039 1.00 72.55 C ATOM 837 CZ PHE A 57 -14.154 -4.191 -5.428 1.00 53.32 C ATOM 0 H PHE A 57 -12.983 -0.514 -9.171 1.00 63.21 H new ATOM 0 HA PHE A 57 -15.681 -0.811 -8.215 1.00 20.53 H new ATOM 0 HB2 PHE A 57 -13.148 0.159 -6.969 1.00 22.33 H new ATOM 0 HB3 PHE A 57 -14.703 0.419 -6.205 1.00 22.33 H new ATOM 0 HD1 PHE A 57 -16.136 -1.500 -5.663 1.00 14.35 H new ATOM 0 HD2 PHE A 57 -12.149 -2.025 -6.994 1.00 3.51 H new ATOM 0 HE1 PHE A 57 -16.154 -3.794 -4.803 1.00 41.43 H new ATOM 0 HE2 PHE A 57 -12.164 -4.321 -6.150 1.00 72.55 H new ATOM 0 HZ PHE A 57 -14.159 -5.204 -5.052 1.00 53.32 H new ATOM 847 N SER A 58 -14.736 1.919 -9.468 1.00 10.01 N ATOM 848 CA SER A 58 -15.108 3.268 -9.838 1.00 20.34 C ATOM 849 C SER A 58 -16.411 3.235 -10.608 1.00 72.24 C ATOM 850 O SER A 58 -17.152 4.228 -10.660 1.00 45.25 O ATOM 851 CB SER A 58 -14.002 3.947 -10.660 1.00 50.50 C ATOM 852 OG SER A 58 -14.353 5.285 -11.007 1.00 2.05 O ATOM 0 H SER A 58 -13.923 1.563 -9.971 1.00 10.01 H new ATOM 0 HA SER A 58 -15.242 3.857 -8.931 1.00 20.34 H new ATOM 0 HB2 SER A 58 -13.073 3.950 -10.089 1.00 50.50 H new ATOM 0 HB3 SER A 58 -13.817 3.372 -11.567 1.00 50.50 H new ATOM 0 HG SER A 58 -13.628 5.689 -11.528 1.00 2.05 H new ATOM 858 N SER A 59 -16.701 2.093 -11.223 1.00 22.21 N ATOM 859 CA SER A 59 -17.967 1.902 -11.872 1.00 43.32 C ATOM 860 C SER A 59 -19.098 1.995 -10.819 1.00 13.45 C ATOM 861 O SER A 59 -20.207 2.430 -11.118 1.00 22.34 O ATOM 862 CB SER A 59 -17.990 0.522 -12.527 1.00 62.33 C ATOM 863 OG SER A 59 -16.858 0.340 -13.382 1.00 31.24 O ATOM 0 H SER A 59 -16.069 1.294 -11.279 1.00 22.21 H new ATOM 0 HA SER A 59 -18.114 2.669 -12.632 1.00 43.32 H new ATOM 0 HB2 SER A 59 -17.996 -0.250 -11.757 1.00 62.33 H new ATOM 0 HB3 SER A 59 -18.908 0.405 -13.103 1.00 62.33 H new ATOM 0 HG SER A 59 -16.895 -0.551 -13.788 1.00 31.24 H new ATOM 869 N CYS A 60 -18.776 1.602 -9.586 1.00 70.31 N ATOM 870 CA CYS A 60 -19.719 1.585 -8.487 1.00 31.22 C ATOM 871 C CYS A 60 -19.632 2.860 -7.617 1.00 53.20 C ATOM 872 O CYS A 60 -20.242 2.907 -6.549 1.00 51.10 O ATOM 873 CB CYS A 60 -19.429 0.366 -7.606 1.00 34.21 C ATOM 874 SG CYS A 60 -19.410 -1.210 -8.490 1.00 23.11 S ATOM 0 H CYS A 60 -17.841 1.285 -9.328 1.00 70.31 H new ATOM 0 HA CYS A 60 -20.722 1.540 -8.911 1.00 31.22 H new ATOM 0 HB2 CYS A 60 -18.464 0.507 -7.119 1.00 34.21 H new ATOM 0 HB3 CYS A 60 -20.180 0.317 -6.817 1.00 34.21 H new ATOM 0 HG CYS A 60 -19.984 -2.122 -7.763 1.00 23.11 H new ATOM 880 N GLY A 61 -18.926 3.892 -8.077 1.00 61.32 N ATOM 881 CA GLY A 61 -18.818 5.093 -7.247 1.00 20.41 C ATOM 882 C GLY A 61 -17.547 5.901 -7.434 1.00 13.03 C ATOM 883 O GLY A 61 -16.787 5.683 -8.374 1.00 24.24 O ATOM 0 H GLY A 61 -18.442 3.926 -8.974 1.00 61.32 H new ATOM 0 HA2 GLY A 61 -19.672 5.737 -7.457 1.00 20.41 H new ATOM 0 HA3 GLY A 61 -18.890 4.798 -6.200 1.00 20.41 H new ATOM 887 N SER A 62 -17.316 6.832 -6.526 1.00 70.33 N ATOM 888 CA SER A 62 -16.190 7.735 -6.603 1.00 32.23 C ATOM 889 C SER A 62 -15.122 7.298 -5.591 1.00 33.43 C ATOM 890 O SER A 62 -15.359 7.337 -4.390 1.00 12.34 O ATOM 891 CB SER A 62 -16.696 9.129 -6.240 1.00 41.25 C ATOM 892 OG SER A 62 -17.904 9.429 -6.954 1.00 34.43 O ATOM 0 H SER A 62 -17.910 6.981 -5.711 1.00 70.33 H new ATOM 0 HA SER A 62 -15.754 7.731 -7.602 1.00 32.23 H new ATOM 0 HB2 SER A 62 -16.877 9.188 -5.167 1.00 41.25 H new ATOM 0 HB3 SER A 62 -15.934 9.871 -6.476 1.00 41.25 H new ATOM 0 HG SER A 62 -18.656 9.457 -6.327 1.00 34.43 H new ATOM 898 N ILE A 63 -13.969 6.885 -6.059 1.00 75.14 N ATOM 899 CA ILE A 63 -12.940 6.385 -5.159 1.00 2.42 C ATOM 900 C ILE A 63 -11.987 7.487 -4.687 1.00 25.24 C ATOM 901 O ILE A 63 -11.501 8.300 -5.483 1.00 13.24 O ATOM 902 CB ILE A 63 -12.143 5.225 -5.797 1.00 34.02 C ATOM 903 CG1 ILE A 63 -13.112 4.113 -6.206 1.00 12.31 C ATOM 904 CG2 ILE A 63 -11.070 4.697 -4.842 1.00 3.33 C ATOM 905 CD1 ILE A 63 -12.450 2.897 -6.776 1.00 74.13 C ATOM 0 H ILE A 63 -13.714 6.882 -7.047 1.00 75.14 H new ATOM 0 HA ILE A 63 -13.463 6.006 -4.281 1.00 2.42 H new ATOM 0 HB ILE A 63 -11.627 5.594 -6.683 1.00 34.02 H new ATOM 0 HG12 ILE A 63 -13.697 3.819 -5.335 1.00 12.31 H new ATOM 0 HG13 ILE A 63 -13.812 4.510 -6.941 1.00 12.31 H new ATOM 0 HG21 ILE A 63 -10.527 3.882 -5.320 1.00 3.33 H new ATOM 0 HG22 ILE A 63 -10.376 5.500 -4.595 1.00 3.33 H new ATOM 0 HG23 ILE A 63 -11.542 4.333 -3.930 1.00 3.33 H new ATOM 0 HD11 ILE A 63 -13.208 2.159 -7.039 1.00 74.13 H new ATOM 0 HD12 ILE A 63 -11.888 3.173 -7.668 1.00 74.13 H new ATOM 0 HD13 ILE A 63 -11.771 2.472 -6.037 1.00 74.13 H new ATOM 917 N ASN A 64 -11.761 7.520 -3.371 1.00 21.41 N ATOM 918 CA ASN A 64 -10.822 8.458 -2.764 1.00 3.12 C ATOM 919 C ASN A 64 -9.463 7.840 -2.559 1.00 3.15 C ATOM 920 O ASN A 64 -8.467 8.479 -2.783 1.00 5.04 O ATOM 921 CB ASN A 64 -11.292 9.066 -1.422 1.00 24.03 C ATOM 922 CG ASN A 64 -12.411 10.085 -1.519 1.00 1.13 C ATOM 923 OD1 ASN A 64 -12.401 11.069 -0.816 1.00 54.23 O ATOM 924 ND2 ASN A 64 -13.400 9.825 -2.283 1.00 43.20 N ATOM 0 H ASN A 64 -12.221 6.901 -2.704 1.00 21.41 H new ATOM 0 HA ASN A 64 -10.766 9.271 -3.488 1.00 3.12 H new ATOM 0 HB2 ASN A 64 -11.619 8.255 -0.771 1.00 24.03 H new ATOM 0 HB3 ASN A 64 -10.437 9.538 -0.938 1.00 24.03 H new ATOM 0 HD21 ASN A 64 -14.203 10.453 -2.309 1.00 43.20 H new ATOM 0 HD22 ASN A 64 -13.387 8.989 -2.868 1.00 43.20 H new ATOM 931 N ARG A 65 -9.415 6.597 -2.138 1.00 23.23 N ATOM 932 CA ARG A 65 -8.128 5.925 -1.868 1.00 64.50 C ATOM 933 C ARG A 65 -8.298 4.439 -1.982 1.00 62.22 C ATOM 934 O ARG A 65 -9.426 3.935 -1.901 1.00 44.52 O ATOM 935 CB ARG A 65 -7.572 6.220 -0.444 1.00 3.34 C ATOM 936 CG ARG A 65 -7.342 7.681 -0.082 1.00 3.04 C ATOM 937 CD ARG A 65 -6.633 7.808 1.254 1.00 75.11 C ATOM 938 NE ARG A 65 -7.365 7.165 2.317 1.00 32.34 N ATOM 939 CZ ARG A 65 -7.006 7.132 3.606 1.00 63.03 C ATOM 940 NH1 ARG A 65 -5.922 7.754 4.019 1.00 23.31 N ATOM 941 NH2 ARG A 65 -7.735 6.465 4.466 1.00 64.31 N ATOM 0 H ARG A 65 -10.238 6.018 -1.970 1.00 23.23 H new ATOM 0 HA ARG A 65 -7.424 6.313 -2.604 1.00 64.50 H new ATOM 0 HB2 ARG A 65 -8.263 5.795 0.284 1.00 3.34 H new ATOM 0 HB3 ARG A 65 -6.626 5.690 -0.333 1.00 3.34 H new ATOM 0 HG2 ARG A 65 -6.749 8.162 -0.859 1.00 3.04 H new ATOM 0 HG3 ARG A 65 -8.298 8.204 -0.041 1.00 3.04 H new ATOM 0 HD2 ARG A 65 -5.639 7.367 1.180 1.00 75.11 H new ATOM 0 HD3 ARG A 65 -6.497 8.863 1.494 1.00 75.11 H new ATOM 0 HE ARG A 65 -8.233 6.693 2.064 1.00 32.34 H new ATOM 0 HH11 ARG A 65 -5.345 8.269 3.354 1.00 23.31 H new ATOM 0 HH12 ARG A 65 -5.659 7.721 5.004 1.00 23.31 H new ATOM 0 HH21 ARG A 65 -8.572 5.974 4.152 1.00 64.31 H new ATOM 0 HH22 ARG A 65 -7.466 6.437 5.449 1.00 64.31 H new ATOM 955 N ILE A 66 -7.191 3.736 -2.150 1.00 62.12 N ATOM 956 CA ILE A 66 -7.189 2.289 -2.156 1.00 13.30 C ATOM 957 C ILE A 66 -5.876 1.815 -1.546 1.00 30.23 C ATOM 958 O ILE A 66 -4.825 2.433 -1.759 1.00 71.41 O ATOM 959 CB ILE A 66 -7.398 1.586 -3.565 1.00 63.41 C ATOM 960 CG1 ILE A 66 -6.219 1.740 -4.498 1.00 63.44 C ATOM 961 CG2 ILE A 66 -8.649 2.069 -4.264 1.00 41.53 C ATOM 962 CD1 ILE A 66 -6.412 0.990 -5.808 1.00 43.23 C ATOM 0 H ILE A 66 -6.271 4.155 -2.286 1.00 62.12 H new ATOM 0 HA ILE A 66 -8.064 1.993 -1.577 1.00 13.30 H new ATOM 0 HB ILE A 66 -7.501 0.527 -3.329 1.00 63.41 H new ATOM 0 HG12 ILE A 66 -6.062 2.798 -4.708 1.00 63.44 H new ATOM 0 HG13 ILE A 66 -5.318 1.376 -4.004 1.00 63.44 H new ATOM 0 HG21 ILE A 66 -8.749 1.560 -5.223 1.00 41.53 H new ATOM 0 HG22 ILE A 66 -9.519 1.851 -3.645 1.00 41.53 H new ATOM 0 HG23 ILE A 66 -8.581 3.144 -4.429 1.00 41.53 H new ATOM 0 HD11 ILE A 66 -5.537 1.133 -6.442 1.00 43.23 H new ATOM 0 HD12 ILE A 66 -6.541 -0.073 -5.603 1.00 43.23 H new ATOM 0 HD13 ILE A 66 -7.296 1.371 -6.319 1.00 43.23 H new ATOM 974 N THR A 67 -5.949 0.776 -0.788 1.00 11.10 N ATOM 975 CA THR A 67 -4.797 0.188 -0.144 1.00 72.12 C ATOM 976 C THR A 67 -4.790 -1.273 -0.529 1.00 62.53 C ATOM 977 O THR A 67 -5.810 -1.935 -0.395 1.00 42.15 O ATOM 978 CB THR A 67 -4.896 0.318 1.399 1.00 25.44 C ATOM 979 OG1 THR A 67 -5.054 1.701 1.751 1.00 31.43 O ATOM 980 CG2 THR A 67 -3.640 -0.213 2.073 1.00 33.11 C ATOM 0 H THR A 67 -6.824 0.292 -0.586 1.00 11.10 H new ATOM 0 HA THR A 67 -3.885 0.695 -0.457 1.00 72.12 H new ATOM 0 HB THR A 67 -5.753 -0.265 1.736 1.00 25.44 H new ATOM 0 HG1 THR A 67 -5.118 1.785 2.725 1.00 31.43 H new ATOM 0 HG21 THR A 67 -3.736 -0.110 3.154 1.00 33.11 H new ATOM 0 HG22 THR A 67 -3.508 -1.265 1.819 1.00 33.11 H new ATOM 0 HG23 THR A 67 -2.775 0.355 1.730 1.00 33.11 H new ATOM 988 N ILE A 68 -3.684 -1.774 -1.007 1.00 71.15 N ATOM 989 CA ILE A 68 -3.621 -3.148 -1.432 1.00 73.33 C ATOM 990 C ILE A 68 -2.481 -3.787 -0.680 1.00 0.33 C ATOM 991 O ILE A 68 -1.354 -3.307 -0.762 1.00 43.12 O ATOM 992 CB ILE A 68 -3.325 -3.336 -2.974 1.00 14.23 C ATOM 993 CG1 ILE A 68 -4.152 -2.401 -3.884 1.00 22.41 C ATOM 994 CG2 ILE A 68 -3.557 -4.781 -3.392 1.00 45.03 C ATOM 995 CD1 ILE A 68 -3.585 -1.005 -4.006 1.00 24.11 C ATOM 0 H ILE A 68 -2.814 -1.253 -1.113 1.00 71.15 H new ATOM 0 HA ILE A 68 -4.596 -3.594 -1.236 1.00 73.33 H new ATOM 0 HB ILE A 68 -2.277 -3.066 -3.107 1.00 14.23 H new ATOM 0 HG12 ILE A 68 -4.219 -2.843 -4.878 1.00 22.41 H new ATOM 0 HG13 ILE A 68 -5.168 -2.337 -3.495 1.00 22.41 H new ATOM 0 HG21 ILE A 68 -3.348 -4.890 -4.456 1.00 45.03 H new ATOM 0 HG22 ILE A 68 -2.896 -5.435 -2.824 1.00 45.03 H new ATOM 0 HG23 ILE A 68 -4.594 -5.054 -3.196 1.00 45.03 H new ATOM 0 HD11 ILE A 68 -4.221 -0.410 -4.661 1.00 24.11 H new ATOM 0 HD12 ILE A 68 -3.544 -0.541 -3.020 1.00 24.11 H new ATOM 0 HD13 ILE A 68 -2.580 -1.056 -4.425 1.00 24.11 H new ATOM 1007 N LEU A 69 -2.754 -4.812 0.064 1.00 0.15 N ATOM 1008 CA LEU A 69 -1.708 -5.495 0.781 1.00 44.30 C ATOM 1009 C LEU A 69 -1.605 -6.943 0.389 1.00 64.30 C ATOM 1010 O LEU A 69 -2.621 -7.636 0.240 1.00 72.10 O ATOM 1011 CB LEU A 69 -1.730 -5.306 2.317 1.00 10.50 C ATOM 1012 CG LEU A 69 -2.997 -5.659 3.119 1.00 5.25 C ATOM 1013 CD1 LEU A 69 -2.661 -5.679 4.595 1.00 21.14 C ATOM 1014 CD2 LEU A 69 -4.130 -4.663 2.860 1.00 24.44 C ATOM 0 H LEU A 69 -3.689 -5.199 0.195 1.00 0.15 H new ATOM 0 HA LEU A 69 -0.793 -4.996 0.462 1.00 44.30 H new ATOM 0 HB2 LEU A 69 -0.911 -5.897 2.728 1.00 10.50 H new ATOM 0 HB3 LEU A 69 -1.500 -4.260 2.518 1.00 10.50 H new ATOM 0 HG LEU A 69 -3.342 -6.641 2.796 1.00 5.25 H new ATOM 0 HD11 LEU A 69 -3.554 -5.928 5.168 1.00 21.14 H new ATOM 0 HD12 LEU A 69 -1.889 -6.426 4.782 1.00 21.14 H new ATOM 0 HD13 LEU A 69 -2.297 -4.697 4.899 1.00 21.14 H new ATOM 0 HD21 LEU A 69 -5.005 -4.947 3.444 1.00 24.44 H new ATOM 0 HD22 LEU A 69 -3.809 -3.663 3.151 1.00 24.44 H new ATOM 0 HD23 LEU A 69 -4.384 -4.668 1.800 1.00 24.44 H new ATOM 1026 N CYS A 70 -0.401 -7.387 0.170 1.00 15.52 N ATOM 1027 CA CYS A 70 -0.135 -8.761 -0.148 1.00 1.14 C ATOM 1028 C CYS A 70 0.733 -9.359 0.944 1.00 60.22 C ATOM 1029 O CYS A 70 1.817 -8.830 1.229 1.00 21.52 O ATOM 1030 CB CYS A 70 0.559 -8.862 -1.506 1.00 21.41 C ATOM 1031 SG CYS A 70 -0.410 -8.164 -2.868 1.00 35.32 S ATOM 0 H CYS A 70 0.432 -6.800 0.207 1.00 15.52 H new ATOM 0 HA CYS A 70 -1.072 -9.315 -0.207 1.00 1.14 H new ATOM 0 HB2 CYS A 70 1.519 -8.348 -1.453 1.00 21.41 H new ATOM 0 HB3 CYS A 70 0.769 -9.910 -1.720 1.00 21.41 H new ATOM 0 HG CYS A 70 0.252 -8.289 -3.980 1.00 35.32 H new ATOM 1037 N ASP A 71 0.275 -10.428 1.578 1.00 11.10 N ATOM 1038 CA ASP A 71 1.048 -11.013 2.640 1.00 4.11 C ATOM 1039 C ASP A 71 1.558 -12.402 2.285 1.00 41.40 C ATOM 1040 O ASP A 71 0.812 -13.259 1.842 1.00 1.13 O ATOM 1041 CB ASP A 71 0.301 -11.030 4.011 1.00 42.41 C ATOM 1042 CG ASP A 71 -0.815 -12.041 4.151 1.00 72.01 C ATOM 1043 OD1 ASP A 71 -0.531 -13.194 4.517 1.00 14.23 O ATOM 1044 OD2 ASP A 71 -1.982 -11.692 3.954 1.00 61.21 O ATOM 0 H ASP A 71 -0.610 -10.893 1.375 1.00 11.10 H new ATOM 0 HA ASP A 71 1.911 -10.358 2.759 1.00 4.11 H new ATOM 0 HB2 ASP A 71 1.032 -11.216 4.797 1.00 42.41 H new ATOM 0 HB3 ASP A 71 -0.112 -10.037 4.188 1.00 42.41 H new ATOM 1049 N LYS A 72 2.845 -12.600 2.463 1.00 63.34 N ATOM 1050 CA LYS A 72 3.484 -13.892 2.268 1.00 44.12 C ATOM 1051 C LYS A 72 3.618 -14.644 3.567 1.00 30.35 C ATOM 1052 O LYS A 72 4.199 -15.729 3.602 1.00 51.00 O ATOM 1053 CB LYS A 72 4.841 -13.785 1.558 1.00 3.51 C ATOM 1054 CG LYS A 72 4.769 -13.793 0.044 1.00 60.02 C ATOM 1055 CD LYS A 72 6.135 -13.534 -0.576 1.00 73.12 C ATOM 1056 CE LYS A 72 6.181 -13.952 -2.039 1.00 43.11 C ATOM 1057 NZ LYS A 72 6.134 -15.433 -2.190 1.00 3.04 N ATOM 0 H LYS A 72 3.489 -11.863 2.751 1.00 63.34 H new ATOM 0 HA LYS A 72 2.826 -14.458 1.609 1.00 44.12 H new ATOM 0 HB2 LYS A 72 5.332 -12.866 1.879 1.00 3.51 H new ATOM 0 HB3 LYS A 72 5.471 -14.613 1.882 1.00 3.51 H new ATOM 0 HG2 LYS A 72 4.388 -14.755 -0.299 1.00 60.02 H new ATOM 0 HG3 LYS A 72 4.064 -13.033 -0.293 1.00 60.02 H new ATOM 0 HD2 LYS A 72 6.377 -12.474 -0.493 1.00 73.12 H new ATOM 0 HD3 LYS A 72 6.896 -14.079 -0.018 1.00 73.12 H new ATOM 0 HE2 LYS A 72 5.342 -13.505 -2.572 1.00 43.11 H new ATOM 0 HE3 LYS A 72 7.092 -13.568 -2.499 1.00 43.11 H new ATOM 0 HZ1 LYS A 72 6.320 -15.687 -3.181 1.00 3.04 H new ATOM 0 HZ2 LYS A 72 6.856 -15.867 -1.580 1.00 3.04 H new ATOM 0 HZ3 LYS A 72 5.193 -15.780 -1.914 1.00 3.04 H new ATOM 1071 N PHE A 73 3.077 -14.082 4.655 1.00 25.23 N ATOM 1072 CA PHE A 73 3.019 -14.823 5.926 1.00 65.24 C ATOM 1073 C PHE A 73 2.129 -16.076 5.862 1.00 42.41 C ATOM 1074 O PHE A 73 2.082 -16.863 6.800 1.00 74.41 O ATOM 1075 CB PHE A 73 2.642 -13.928 7.096 1.00 11.22 C ATOM 1076 CG PHE A 73 3.787 -13.129 7.605 1.00 32.14 C ATOM 1077 CD1 PHE A 73 4.608 -13.652 8.587 1.00 1.01 C ATOM 1078 CD2 PHE A 73 4.054 -11.878 7.117 1.00 31.23 C ATOM 1079 CE1 PHE A 73 5.676 -12.934 9.066 1.00 23.41 C ATOM 1080 CE2 PHE A 73 5.121 -11.150 7.592 1.00 44.10 C ATOM 1081 CZ PHE A 73 5.931 -11.683 8.567 1.00 74.45 C ATOM 0 H PHE A 73 2.682 -13.142 4.686 1.00 25.23 H new ATOM 0 HA PHE A 73 4.034 -15.181 6.101 1.00 65.24 H new ATOM 0 HB2 PHE A 73 1.843 -13.253 6.788 1.00 11.22 H new ATOM 0 HB3 PHE A 73 2.246 -14.543 7.905 1.00 11.22 H new ATOM 0 HD1 PHE A 73 4.407 -14.637 8.982 1.00 1.01 H new ATOM 0 HD2 PHE A 73 3.420 -11.458 6.350 1.00 31.23 H new ATOM 0 HE1 PHE A 73 6.312 -13.353 9.832 1.00 23.41 H new ATOM 0 HE2 PHE A 73 5.321 -10.164 7.200 1.00 44.10 H new ATOM 0 HZ PHE A 73 6.770 -11.115 8.940 1.00 74.45 H new ATOM 1091 N SER A 74 1.450 -16.252 4.757 1.00 13.13 N ATOM 1092 CA SER A 74 0.632 -17.424 4.527 1.00 72.42 C ATOM 1093 C SER A 74 1.454 -18.461 3.716 1.00 41.33 C ATOM 1094 O SER A 74 0.974 -19.542 3.378 1.00 32.11 O ATOM 1095 CB SER A 74 -0.629 -16.998 3.744 1.00 62.25 C ATOM 1096 OG SER A 74 -1.570 -18.057 3.578 1.00 41.43 O ATOM 0 H SER A 74 1.447 -15.585 3.985 1.00 13.13 H new ATOM 0 HA SER A 74 0.330 -17.877 5.472 1.00 72.42 H new ATOM 0 HB2 SER A 74 -1.111 -16.171 4.265 1.00 62.25 H new ATOM 0 HB3 SER A 74 -0.332 -16.627 2.763 1.00 62.25 H new ATOM 0 HG SER A 74 -1.092 -18.903 3.454 1.00 41.43 H new ATOM 1102 N GLY A 75 2.699 -18.111 3.405 1.00 54.23 N ATOM 1103 CA GLY A 75 3.554 -18.950 2.564 1.00 62.33 C ATOM 1104 C GLY A 75 3.335 -18.588 1.119 1.00 53.04 C ATOM 1105 O GLY A 75 4.265 -18.345 0.356 1.00 64.12 O ATOM 0 H GLY A 75 3.142 -17.249 3.723 1.00 54.23 H new ATOM 0 HA2 GLY A 75 4.601 -18.808 2.832 1.00 62.33 H new ATOM 0 HA3 GLY A 75 3.324 -20.003 2.727 1.00 62.33 H new ATOM 1109 N HIS A 76 2.089 -18.533 0.786 1.00 35.14 N ATOM 1110 CA HIS A 76 1.636 -18.083 -0.494 1.00 40.53 C ATOM 1111 C HIS A 76 1.265 -16.635 -0.315 1.00 73.24 C ATOM 1112 O HIS A 76 0.850 -16.256 0.783 1.00 43.41 O ATOM 1113 CB HIS A 76 0.438 -18.894 -1.007 1.00 23.40 C ATOM 1114 CG HIS A 76 0.757 -20.314 -1.367 1.00 1.20 C ATOM 1115 ND1 HIS A 76 0.233 -21.402 -0.710 1.00 11.04 N ATOM 1116 CD2 HIS A 76 1.518 -20.820 -2.360 1.00 61.14 C ATOM 1117 CE1 HIS A 76 0.657 -22.504 -1.274 1.00 63.11 C ATOM 1118 NE2 HIS A 76 1.439 -22.183 -2.280 1.00 1.10 N ATOM 0 H HIS A 76 1.333 -18.807 1.413 1.00 35.14 H new ATOM 0 HA HIS A 76 2.418 -18.214 -1.242 1.00 40.53 H new ATOM 0 HB2 HIS A 76 -0.340 -18.892 -0.243 1.00 23.40 H new ATOM 0 HB3 HIS A 76 0.025 -18.394 -1.883 1.00 23.40 H new ATOM 0 HD2 HIS A 76 2.085 -20.253 -3.084 1.00 61.14 H new ATOM 0 HE1 HIS A 76 0.406 -23.508 -0.965 1.00 63.11 H new ATOM 0 HE2 HIS A 76 1.910 -22.842 -2.900 1.00 1.10 H new ATOM 1127 N PRO A 77 1.422 -15.789 -1.324 1.00 13.13 N ATOM 1128 CA PRO A 77 1.080 -14.395 -1.176 1.00 63.34 C ATOM 1129 C PRO A 77 -0.419 -14.212 -1.218 1.00 64.24 C ATOM 1130 O PRO A 77 -1.068 -14.564 -2.218 1.00 54.41 O ATOM 1131 CB PRO A 77 1.727 -13.724 -2.409 1.00 44.01 C ATOM 1132 CG PRO A 77 2.518 -14.796 -3.087 1.00 22.33 C ATOM 1133 CD PRO A 77 1.909 -16.096 -2.667 1.00 41.42 C ATOM 0 HA PRO A 77 1.423 -13.976 -0.230 1.00 63.34 H new ATOM 0 HB2 PRO A 77 0.967 -13.317 -3.076 1.00 44.01 H new ATOM 0 HB3 PRO A 77 2.368 -12.894 -2.111 1.00 44.01 H new ATOM 0 HG2 PRO A 77 2.480 -14.681 -4.170 1.00 22.33 H new ATOM 0 HG3 PRO A 77 3.568 -14.747 -2.798 1.00 22.33 H new ATOM 0 HD2 PRO A 77 1.102 -16.401 -3.333 1.00 41.42 H new ATOM 0 HD3 PRO A 77 2.640 -16.905 -2.660 1.00 41.42 H new ATOM 1141 N LYS A 78 -0.983 -13.712 -0.145 1.00 12.41 N ATOM 1142 CA LYS A 78 -2.380 -13.419 -0.147 1.00 23.34 C ATOM 1143 C LYS A 78 -2.578 -11.981 -0.453 1.00 4.35 C ATOM 1144 O LYS A 78 -1.746 -11.164 -0.123 1.00 54.13 O ATOM 1145 CB LYS A 78 -3.076 -13.737 1.174 1.00 12.42 C ATOM 1146 CG LYS A 78 -2.869 -15.137 1.694 1.00 1.33 C ATOM 1147 CD LYS A 78 -3.945 -15.516 2.721 1.00 65.45 C ATOM 1148 CE LYS A 78 -4.075 -14.527 3.879 1.00 61.31 C ATOM 1149 NZ LYS A 78 -2.858 -14.435 4.699 1.00 70.33 N ATOM 0 H LYS A 78 -0.496 -13.504 0.727 1.00 12.41 H new ATOM 0 HA LYS A 78 -2.828 -14.059 -0.907 1.00 23.34 H new ATOM 0 HB2 LYS A 78 -2.726 -13.032 1.928 1.00 12.42 H new ATOM 0 HB3 LYS A 78 -4.146 -13.568 1.051 1.00 12.42 H new ATOM 0 HG2 LYS A 78 -2.892 -15.843 0.863 1.00 1.33 H new ATOM 0 HG3 LYS A 78 -1.883 -15.215 2.152 1.00 1.33 H new ATOM 0 HD2 LYS A 78 -4.906 -15.593 2.213 1.00 65.45 H new ATOM 0 HD3 LYS A 78 -3.717 -16.503 3.123 1.00 65.45 H new ATOM 0 HE2 LYS A 78 -4.313 -13.541 3.481 1.00 61.31 H new ATOM 0 HE3 LYS A 78 -4.911 -14.826 4.512 1.00 61.31 H new ATOM 0 HZ1 LYS A 78 -2.977 -13.690 5.414 1.00 70.33 H new ATOM 0 HZ2 LYS A 78 -2.689 -15.345 5.172 1.00 70.33 H new ATOM 0 HZ3 LYS A 78 -2.046 -14.205 4.091 1.00 70.33 H new ATOM 1163 N GLY A 79 -3.656 -11.676 -1.074 1.00 4.24 N ATOM 1164 CA GLY A 79 -3.935 -10.333 -1.398 1.00 52.11 C ATOM 1165 C GLY A 79 -5.298 -9.908 -0.962 1.00 40.42 C ATOM 1166 O GLY A 79 -6.290 -10.637 -1.144 1.00 22.51 O ATOM 0 H GLY A 79 -4.365 -12.348 -1.370 1.00 4.24 H new ATOM 0 HA2 GLY A 79 -3.191 -9.688 -0.931 1.00 52.11 H new ATOM 0 HA3 GLY A 79 -3.843 -10.197 -2.476 1.00 52.11 H new ATOM 1170 N TYR A 80 -5.340 -8.749 -0.381 1.00 74.25 N ATOM 1171 CA TYR A 80 -6.550 -8.092 0.034 1.00 52.24 C ATOM 1172 C TYR A 80 -6.393 -6.603 0.002 1.00 12.25 C ATOM 1173 O TYR A 80 -5.306 -6.078 0.240 1.00 62.22 O ATOM 1174 CB TYR A 80 -7.250 -8.682 1.308 1.00 2.10 C ATOM 1175 CG TYR A 80 -6.373 -9.106 2.480 1.00 1.31 C ATOM 1176 CD1 TYR A 80 -5.587 -10.239 2.373 1.00 60.20 C ATOM 1177 CD2 TYR A 80 -6.361 -8.418 3.692 1.00 62.21 C ATOM 1178 CE1 TYR A 80 -4.814 -10.679 3.403 1.00 72.33 C ATOM 1179 CE2 TYR A 80 -5.576 -8.868 4.753 1.00 20.04 C ATOM 1180 CZ TYR A 80 -4.802 -10.007 4.587 1.00 54.45 C ATOM 1181 OH TYR A 80 -4.016 -10.484 5.615 1.00 74.04 O ATOM 0 H TYR A 80 -4.500 -8.209 -0.173 1.00 74.25 H new ATOM 0 HA TYR A 80 -7.300 -8.334 -0.719 1.00 52.24 H new ATOM 0 HB2 TYR A 80 -7.958 -7.938 1.674 1.00 2.10 H new ATOM 0 HB3 TYR A 80 -7.832 -9.549 0.997 1.00 2.10 H new ATOM 0 HD1 TYR A 80 -5.587 -10.791 1.445 1.00 60.20 H new ATOM 0 HD2 TYR A 80 -6.964 -7.530 3.810 1.00 62.21 H new ATOM 0 HE1 TYR A 80 -4.208 -11.564 3.281 1.00 72.33 H new ATOM 0 HE2 TYR A 80 -5.571 -8.336 5.693 1.00 20.04 H new ATOM 0 HH TYR A 80 -3.243 -10.957 5.243 1.00 74.04 H new ATOM 1191 N ALA A 81 -7.447 -5.929 -0.346 1.00 60.33 N ATOM 1192 CA ALA A 81 -7.393 -4.518 -0.584 1.00 51.13 C ATOM 1193 C ALA A 81 -8.581 -3.834 0.021 1.00 22.44 C ATOM 1194 O ALA A 81 -9.622 -4.448 0.220 1.00 13.04 O ATOM 1195 CB ALA A 81 -7.351 -4.255 -2.086 1.00 31.42 C ATOM 0 H ALA A 81 -8.371 -6.342 -0.473 1.00 60.33 H new ATOM 0 HA ALA A 81 -6.492 -4.118 -0.119 1.00 51.13 H new ATOM 0 HB1 ALA A 81 -7.310 -3.181 -2.266 1.00 31.42 H new ATOM 0 HB2 ALA A 81 -6.467 -4.729 -2.514 1.00 31.42 H new ATOM 0 HB3 ALA A 81 -8.246 -4.667 -2.553 1.00 31.42 H new ATOM 1201 N TYR A 82 -8.421 -2.585 0.335 1.00 21.44 N ATOM 1202 CA TYR A 82 -9.488 -1.795 0.879 1.00 41.50 C ATOM 1203 C TYR A 82 -9.737 -0.630 -0.049 1.00 24.44 C ATOM 1204 O TYR A 82 -8.805 0.117 -0.369 1.00 22.14 O ATOM 1205 CB TYR A 82 -9.105 -1.265 2.253 1.00 74.24 C ATOM 1206 CG TYR A 82 -8.607 -2.313 3.204 1.00 63.13 C ATOM 1207 CD1 TYR A 82 -9.430 -3.347 3.647 1.00 44.41 C ATOM 1208 CD2 TYR A 82 -7.304 -2.273 3.654 1.00 62.44 C ATOM 1209 CE1 TYR A 82 -8.951 -4.308 4.523 1.00 34.05 C ATOM 1210 CE2 TYR A 82 -6.818 -3.214 4.519 1.00 1.11 C ATOM 1211 CZ TYR A 82 -7.635 -4.230 4.957 1.00 24.12 C ATOM 1212 OH TYR A 82 -7.134 -5.165 5.822 1.00 53.04 O ATOM 0 H TYR A 82 -7.542 -2.080 0.221 1.00 21.44 H new ATOM 0 HA TYR A 82 -10.383 -2.409 0.977 1.00 41.50 H new ATOM 0 HB2 TYR A 82 -8.334 -0.504 2.134 1.00 74.24 H new ATOM 0 HB3 TYR A 82 -9.972 -0.774 2.694 1.00 74.24 H new ATOM 0 HD1 TYR A 82 -10.453 -3.400 3.304 1.00 44.41 H new ATOM 0 HD2 TYR A 82 -6.653 -1.481 3.316 1.00 62.44 H new ATOM 0 HE1 TYR A 82 -9.593 -5.107 4.863 1.00 34.05 H new ATOM 0 HE2 TYR A 82 -5.794 -3.159 4.858 1.00 1.11 H new ATOM 0 HH TYR A 82 -7.852 -5.772 6.099 1.00 53.04 H new ATOM 1222 N ILE A 83 -10.948 -0.482 -0.504 1.00 32.41 N ATOM 1223 CA ILE A 83 -11.285 0.596 -1.415 1.00 23.54 C ATOM 1224 C ILE A 83 -12.141 1.616 -0.642 1.00 62.32 C ATOM 1225 O ILE A 83 -13.114 1.234 0.005 1.00 74.44 O ATOM 1226 CB ILE A 83 -12.124 0.046 -2.615 1.00 73.14 C ATOM 1227 CG1 ILE A 83 -11.481 -1.218 -3.236 1.00 31.10 C ATOM 1228 CG2 ILE A 83 -12.310 1.103 -3.680 1.00 51.45 C ATOM 1229 CD1 ILE A 83 -10.087 -1.034 -3.801 1.00 13.33 C ATOM 0 H ILE A 83 -11.728 -1.093 -0.263 1.00 32.41 H new ATOM 0 HA ILE A 83 -10.374 1.054 -1.799 1.00 23.54 H new ATOM 0 HB ILE A 83 -13.100 -0.230 -2.216 1.00 73.14 H new ATOM 0 HG12 ILE A 83 -11.445 -1.997 -2.474 1.00 31.10 H new ATOM 0 HG13 ILE A 83 -12.131 -1.581 -4.032 1.00 31.10 H new ATOM 0 HG21 ILE A 83 -12.897 0.692 -4.502 1.00 51.45 H new ATOM 0 HG22 ILE A 83 -12.832 1.960 -3.255 1.00 51.45 H new ATOM 0 HG23 ILE A 83 -11.336 1.419 -4.053 1.00 51.45 H new ATOM 0 HD11 ILE A 83 -9.732 -1.980 -4.210 1.00 13.33 H new ATOM 0 HD12 ILE A 83 -10.111 -0.283 -4.591 1.00 13.33 H new ATOM 0 HD13 ILE A 83 -9.414 -0.706 -3.009 1.00 13.33 H new ATOM 1241 N GLU A 84 -11.757 2.880 -0.670 1.00 63.44 N ATOM 1242 CA GLU A 84 -12.496 3.931 0.041 1.00 3.42 C ATOM 1243 C GLU A 84 -13.229 4.846 -0.940 1.00 52.11 C ATOM 1244 O GLU A 84 -12.602 5.477 -1.802 1.00 62.44 O ATOM 1245 CB GLU A 84 -11.524 4.746 0.886 1.00 51.43 C ATOM 1246 CG GLU A 84 -10.798 3.923 1.930 1.00 4.24 C ATOM 1247 CD GLU A 84 -9.740 4.702 2.645 1.00 31.24 C ATOM 1248 OE1 GLU A 84 -10.032 5.350 3.653 1.00 21.44 O ATOM 1249 OE2 GLU A 84 -8.586 4.670 2.208 1.00 22.11 O ATOM 0 H GLU A 84 -10.937 3.213 -1.176 1.00 63.44 H new ATOM 0 HA GLU A 84 -13.240 3.461 0.684 1.00 3.42 H new ATOM 0 HB2 GLU A 84 -10.791 5.217 0.231 1.00 51.43 H new ATOM 0 HB3 GLU A 84 -12.070 5.549 1.382 1.00 51.43 H new ATOM 0 HG2 GLU A 84 -11.519 3.546 2.656 1.00 4.24 H new ATOM 0 HG3 GLU A 84 -10.344 3.055 1.452 1.00 4.24 H new ATOM 1256 N PHE A 85 -14.539 4.921 -0.810 1.00 60.45 N ATOM 1257 CA PHE A 85 -15.368 5.728 -1.706 1.00 34.41 C ATOM 1258 C PHE A 85 -15.723 7.085 -1.088 1.00 13.22 C ATOM 1259 O PHE A 85 -15.576 7.289 0.105 1.00 52.03 O ATOM 1260 CB PHE A 85 -16.657 4.989 -2.059 1.00 21.25 C ATOM 1261 CG PHE A 85 -16.461 3.685 -2.776 1.00 44.24 C ATOM 1262 CD1 PHE A 85 -16.387 3.642 -4.158 1.00 53.32 C ATOM 1263 CD2 PHE A 85 -16.366 2.500 -2.070 1.00 74.00 C ATOM 1264 CE1 PHE A 85 -16.221 2.442 -4.818 1.00 72.23 C ATOM 1265 CE2 PHE A 85 -16.205 1.300 -2.721 1.00 21.21 C ATOM 1266 CZ PHE A 85 -16.132 1.270 -4.097 1.00 3.42 C ATOM 0 H PHE A 85 -15.064 4.430 -0.086 1.00 60.45 H new ATOM 0 HA PHE A 85 -14.782 5.901 -2.609 1.00 34.41 H new ATOM 0 HB2 PHE A 85 -17.215 4.802 -1.141 1.00 21.25 H new ATOM 0 HB3 PHE A 85 -17.273 5.639 -2.680 1.00 21.25 H new ATOM 0 HD1 PHE A 85 -16.460 4.558 -4.725 1.00 53.32 H new ATOM 0 HD2 PHE A 85 -16.419 2.517 -0.991 1.00 74.00 H new ATOM 0 HE1 PHE A 85 -16.161 2.421 -5.896 1.00 72.23 H new ATOM 0 HE2 PHE A 85 -16.136 0.383 -2.155 1.00 21.21 H new ATOM 0 HZ PHE A 85 -16.005 0.328 -4.611 1.00 3.42 H new ATOM 1276 N ALA A 86 -16.159 8.016 -1.927 1.00 64.21 N ATOM 1277 CA ALA A 86 -16.606 9.342 -1.494 1.00 63.43 C ATOM 1278 C ALA A 86 -17.993 9.296 -0.886 1.00 62.55 C ATOM 1279 O ALA A 86 -18.291 10.010 0.067 1.00 31.24 O ATOM 1280 CB ALA A 86 -16.595 10.314 -2.660 1.00 62.01 C ATOM 0 H ALA A 86 -16.214 7.875 -2.936 1.00 64.21 H new ATOM 0 HA ALA A 86 -15.909 9.683 -0.729 1.00 63.43 H new ATOM 0 HB1 ALA A 86 -16.930 11.294 -2.320 1.00 62.01 H new ATOM 0 HB2 ALA A 86 -15.583 10.394 -3.057 1.00 62.01 H new ATOM 0 HB3 ALA A 86 -17.264 9.953 -3.441 1.00 62.01 H new ATOM 1286 N GLU A 87 -18.839 8.483 -1.449 1.00 12.34 N ATOM 1287 CA GLU A 87 -20.179 8.339 -0.960 1.00 5.41 C ATOM 1288 C GLU A 87 -20.442 6.955 -0.377 1.00 33.03 C ATOM 1289 O GLU A 87 -19.999 5.941 -0.924 1.00 20.05 O ATOM 1290 CB GLU A 87 -21.246 8.756 -2.023 1.00 24.31 C ATOM 1291 CG GLU A 87 -21.151 8.128 -3.420 1.00 21.21 C ATOM 1292 CD GLU A 87 -19.889 8.486 -4.215 1.00 73.43 C ATOM 1293 OE1 GLU A 87 -19.892 9.504 -4.946 1.00 23.43 O ATOM 1294 OE2 GLU A 87 -18.889 7.727 -4.129 1.00 12.24 O ATOM 0 H GLU A 87 -18.620 7.902 -2.258 1.00 12.34 H new ATOM 0 HA GLU A 87 -20.282 9.040 -0.132 1.00 5.41 H new ATOM 0 HB2 GLU A 87 -22.231 8.523 -1.618 1.00 24.31 H new ATOM 0 HB3 GLU A 87 -21.197 9.839 -2.139 1.00 24.31 H new ATOM 0 HG2 GLU A 87 -21.200 7.044 -3.317 1.00 21.21 H new ATOM 0 HG3 GLU A 87 -22.023 8.433 -3.998 1.00 21.21 H new ATOM 1301 N ARG A 88 -21.156 6.927 0.753 1.00 21.10 N ATOM 1302 CA ARG A 88 -21.526 5.691 1.449 1.00 12.31 C ATOM 1303 C ARG A 88 -22.314 4.770 0.548 1.00 72.11 C ATOM 1304 O ARG A 88 -22.181 3.550 0.624 1.00 0.23 O ATOM 1305 CB ARG A 88 -22.373 6.001 2.681 1.00 23.11 C ATOM 1306 CG ARG A 88 -21.702 5.727 4.019 1.00 10.24 C ATOM 1307 CD ARG A 88 -21.288 4.265 4.146 1.00 73.04 C ATOM 1308 NE ARG A 88 -22.374 3.343 3.777 1.00 20.13 N ATOM 1309 CZ ARG A 88 -22.872 2.376 4.545 1.00 30.51 C ATOM 1310 NH1 ARG A 88 -22.458 2.217 5.796 1.00 4.20 N ATOM 1311 NH2 ARG A 88 -23.785 1.567 4.048 1.00 71.44 N ATOM 0 H ARG A 88 -21.497 7.770 1.215 1.00 21.10 H new ATOM 0 HA ARG A 88 -20.599 5.200 1.746 1.00 12.31 H new ATOM 0 HB2 ARG A 88 -22.663 7.051 2.647 1.00 23.11 H new ATOM 0 HB3 ARG A 88 -23.291 5.415 2.627 1.00 23.11 H new ATOM 0 HG2 ARG A 88 -20.825 6.365 4.125 1.00 10.24 H new ATOM 0 HG3 ARG A 88 -22.384 5.985 4.829 1.00 10.24 H new ATOM 0 HD2 ARG A 88 -20.423 4.078 3.509 1.00 73.04 H new ATOM 0 HD3 ARG A 88 -20.978 4.065 5.172 1.00 73.04 H new ATOM 0 HE ARG A 88 -22.782 3.455 2.849 1.00 20.13 H new ATOM 0 HH11 ARG A 88 -21.749 2.840 6.182 1.00 4.20 H new ATOM 0 HH12 ARG A 88 -22.849 1.471 6.372 1.00 4.20 H new ATOM 0 HH21 ARG A 88 -24.102 1.686 3.086 1.00 71.44 H new ATOM 0 HH22 ARG A 88 -24.175 0.822 4.625 1.00 71.44 H new ATOM 1325 N ASN A 89 -23.112 5.352 -0.312 1.00 52.30 N ATOM 1326 CA ASN A 89 -23.933 4.577 -1.218 1.00 5.13 C ATOM 1327 C ASN A 89 -23.118 3.826 -2.216 1.00 70.03 C ATOM 1328 O ASN A 89 -23.585 2.836 -2.785 1.00 13.11 O ATOM 1329 CB ASN A 89 -25.000 5.406 -1.904 1.00 42.33 C ATOM 1330 CG ASN A 89 -26.055 5.886 -0.934 1.00 14.32 C ATOM 1331 OD1 ASN A 89 -26.303 5.272 0.066 1.00 1.22 O ATOM 1332 ND2 ASN A 89 -26.686 6.935 -1.232 1.00 24.32 N ATOM 0 H ASN A 89 -23.213 6.363 -0.406 1.00 52.30 H new ATOM 0 HA ASN A 89 -24.449 3.848 -0.593 1.00 5.13 H new ATOM 0 HB2 ASN A 89 -24.536 6.265 -2.389 1.00 42.33 H new ATOM 0 HB3 ASN A 89 -25.471 4.813 -2.688 1.00 42.33 H new ATOM 0 HD21 ASN A 89 -27.424 7.278 -0.618 1.00 24.32 H new ATOM 0 HD22 ASN A 89 -26.458 7.441 -2.088 1.00 24.32 H new ATOM 1339 N SER A 90 -21.890 4.256 -2.448 1.00 51.30 N ATOM 1340 CA SER A 90 -21.032 3.549 -3.322 1.00 35.42 C ATOM 1341 C SER A 90 -20.620 2.225 -2.731 1.00 24.01 C ATOM 1342 O SER A 90 -20.492 1.241 -3.453 1.00 23.13 O ATOM 1343 CB SER A 90 -19.839 4.380 -3.705 1.00 64.04 C ATOM 1344 OG SER A 90 -20.264 5.499 -4.436 1.00 43.25 O ATOM 0 H SER A 90 -21.484 5.094 -2.033 1.00 51.30 H new ATOM 0 HA SER A 90 -21.588 3.338 -4.235 1.00 35.42 H new ATOM 0 HB2 SER A 90 -19.302 4.698 -2.811 1.00 64.04 H new ATOM 0 HB3 SER A 90 -19.145 3.786 -4.299 1.00 64.04 H new ATOM 0 HG SER A 90 -19.509 6.110 -4.567 1.00 43.25 H new ATOM 1350 N VAL A 91 -20.419 2.182 -1.400 1.00 35.12 N ATOM 1351 CA VAL A 91 -20.050 0.925 -0.780 1.00 15.03 C ATOM 1352 C VAL A 91 -21.196 -0.045 -0.941 1.00 72.13 C ATOM 1353 O VAL A 91 -20.987 -1.190 -1.282 1.00 71.14 O ATOM 1354 CB VAL A 91 -19.608 1.020 0.736 1.00 31.11 C ATOM 1355 CG1 VAL A 91 -18.676 2.174 0.987 1.00 55.52 C ATOM 1356 CG2 VAL A 91 -20.752 0.964 1.757 1.00 12.21 C ATOM 0 H VAL A 91 -20.505 2.977 -0.766 1.00 35.12 H new ATOM 0 HA VAL A 91 -19.155 0.578 -1.297 1.00 15.03 H new ATOM 0 HB VAL A 91 -19.051 0.099 0.909 1.00 31.11 H new ATOM 0 HG11 VAL A 91 -18.401 2.197 2.042 1.00 55.52 H new ATOM 0 HG12 VAL A 91 -17.778 2.055 0.380 1.00 55.52 H new ATOM 0 HG13 VAL A 91 -19.173 3.107 0.721 1.00 55.52 H new ATOM 0 HG21 VAL A 91 -20.344 1.037 2.765 1.00 12.21 H new ATOM 0 HG22 VAL A 91 -21.437 1.794 1.582 1.00 12.21 H new ATOM 0 HG23 VAL A 91 -21.289 0.022 1.650 1.00 12.21 H new ATOM 1366 N ASP A 92 -22.434 0.457 -0.757 1.00 74.35 N ATOM 1367 CA ASP A 92 -23.632 -0.365 -0.917 1.00 22.10 C ATOM 1368 C ASP A 92 -23.758 -0.890 -2.347 1.00 64.03 C ATOM 1369 O ASP A 92 -24.289 -1.979 -2.575 1.00 13.52 O ATOM 1370 CB ASP A 92 -24.907 0.389 -0.494 1.00 73.32 C ATOM 1371 CG ASP A 92 -24.987 0.680 1.003 1.00 24.55 C ATOM 1372 OD1 ASP A 92 -25.528 -0.166 1.767 1.00 74.33 O ATOM 1373 OD2 ASP A 92 -24.528 1.755 1.446 1.00 4.42 O ATOM 0 H ASP A 92 -22.621 1.426 -0.498 1.00 74.35 H new ATOM 0 HA ASP A 92 -23.523 -1.221 -0.251 1.00 22.10 H new ATOM 0 HB2 ASP A 92 -24.958 1.331 -1.040 1.00 73.32 H new ATOM 0 HB3 ASP A 92 -25.778 -0.197 -0.787 1.00 73.32 H new ATOM 1378 N ALA A 93 -23.266 -0.113 -3.300 1.00 40.24 N ATOM 1379 CA ALA A 93 -23.261 -0.504 -4.702 1.00 32.10 C ATOM 1380 C ALA A 93 -22.191 -1.568 -4.978 1.00 71.32 C ATOM 1381 O ALA A 93 -22.423 -2.513 -5.732 1.00 35.51 O ATOM 1382 CB ALA A 93 -23.043 0.710 -5.590 1.00 3.33 C ATOM 0 H ALA A 93 -22.859 0.806 -3.124 1.00 40.24 H new ATOM 0 HA ALA A 93 -24.234 -0.938 -4.933 1.00 32.10 H new ATOM 0 HB1 ALA A 93 -23.042 0.401 -6.635 1.00 3.33 H new ATOM 0 HB2 ALA A 93 -23.845 1.430 -5.425 1.00 3.33 H new ATOM 0 HB3 ALA A 93 -22.086 1.171 -5.347 1.00 3.33 H new ATOM 1388 N ALA A 94 -21.026 -1.408 -4.351 1.00 70.31 N ATOM 1389 CA ALA A 94 -19.895 -2.313 -4.563 1.00 45.53 C ATOM 1390 C ALA A 94 -20.112 -3.644 -3.860 1.00 0.34 C ATOM 1391 O ALA A 94 -19.817 -4.691 -4.414 1.00 14.53 O ATOM 1392 CB ALA A 94 -18.582 -1.670 -4.124 1.00 35.54 C ATOM 0 H ALA A 94 -20.840 -0.656 -3.688 1.00 70.31 H new ATOM 0 HA ALA A 94 -19.829 -2.509 -5.633 1.00 45.53 H new ATOM 0 HB1 ALA A 94 -17.761 -2.367 -4.294 1.00 35.54 H new ATOM 0 HB2 ALA A 94 -18.412 -0.761 -4.700 1.00 35.54 H new ATOM 0 HB3 ALA A 94 -18.635 -1.423 -3.064 1.00 35.54 H new ATOM 1398 N VAL A 95 -20.632 -3.590 -2.631 1.00 13.13 N ATOM 1399 CA VAL A 95 -20.953 -4.806 -1.846 1.00 33.32 C ATOM 1400 C VAL A 95 -21.907 -5.736 -2.596 1.00 14.24 C ATOM 1401 O VAL A 95 -21.969 -6.921 -2.313 1.00 5.23 O ATOM 1402 CB VAL A 95 -21.518 -4.517 -0.431 1.00 21.02 C ATOM 1403 CG1 VAL A 95 -20.553 -3.673 0.367 1.00 62.55 C ATOM 1404 CG2 VAL A 95 -22.881 -3.882 -0.478 1.00 40.01 C ATOM 0 H VAL A 95 -20.844 -2.717 -2.148 1.00 13.13 H new ATOM 0 HA VAL A 95 -19.992 -5.302 -1.712 1.00 33.32 H new ATOM 0 HB VAL A 95 -21.636 -5.477 0.071 1.00 21.02 H new ATOM 0 HG11 VAL A 95 -20.969 -3.482 1.356 1.00 62.55 H new ATOM 0 HG12 VAL A 95 -19.605 -4.201 0.468 1.00 62.55 H new ATOM 0 HG13 VAL A 95 -20.388 -2.726 -0.146 1.00 62.55 H new ATOM 0 HG21 VAL A 95 -23.233 -3.700 0.537 1.00 40.01 H new ATOM 0 HG22 VAL A 95 -22.824 -2.937 -1.017 1.00 40.01 H new ATOM 0 HG23 VAL A 95 -23.576 -4.549 -0.988 1.00 40.01 H new ATOM 1414 N ALA A 96 -22.652 -5.182 -3.554 1.00 31.24 N ATOM 1415 CA ALA A 96 -23.564 -5.971 -4.364 1.00 55.30 C ATOM 1416 C ALA A 96 -22.797 -6.933 -5.279 1.00 3.12 C ATOM 1417 O ALA A 96 -23.364 -7.852 -5.856 1.00 53.01 O ATOM 1418 CB ALA A 96 -24.496 -5.079 -5.173 1.00 50.35 C ATOM 0 H ALA A 96 -22.637 -4.188 -3.783 1.00 31.24 H new ATOM 0 HA ALA A 96 -24.176 -6.566 -3.687 1.00 55.30 H new ATOM 0 HB1 ALA A 96 -25.166 -5.699 -5.769 1.00 50.35 H new ATOM 0 HB2 ALA A 96 -25.082 -4.457 -4.497 1.00 50.35 H new ATOM 0 HB3 ALA A 96 -23.908 -4.442 -5.834 1.00 50.35 H new ATOM 1424 N MET A 97 -21.497 -6.696 -5.398 1.00 24.41 N ATOM 1425 CA MET A 97 -20.617 -7.533 -6.195 1.00 50.32 C ATOM 1426 C MET A 97 -19.872 -8.507 -5.290 1.00 34.45 C ATOM 1427 O MET A 97 -18.926 -9.157 -5.742 1.00 23.13 O ATOM 1428 CB MET A 97 -19.563 -6.697 -6.971 1.00 4.22 C ATOM 1429 CG MET A 97 -20.112 -5.650 -7.935 1.00 51.25 C ATOM 1430 SD MET A 97 -18.828 -4.939 -9.024 1.00 23.14 S ATOM 1431 CE MET A 97 -17.589 -4.377 -7.864 1.00 33.54 C ATOM 0 H MET A 97 -21.024 -5.915 -4.942 1.00 24.41 H new ATOM 0 HA MET A 97 -21.244 -8.063 -6.912 1.00 50.32 H new ATOM 0 HB2 MET A 97 -18.924 -6.194 -6.246 1.00 4.22 H new ATOM 0 HB3 MET A 97 -18.929 -7.382 -7.534 1.00 4.22 H new ATOM 0 HG2 MET A 97 -20.891 -6.102 -8.549 1.00 51.25 H new ATOM 0 HG3 MET A 97 -20.581 -4.849 -7.364 1.00 51.25 H new ATOM 0 HE1 MET A 97 -16.899 -3.701 -8.368 1.00 33.54 H new ATOM 0 HE2 MET A 97 -18.073 -3.853 -7.040 1.00 33.54 H new ATOM 0 HE3 MET A 97 -17.039 -5.234 -7.476 1.00 33.54 H new ATOM 1441 N ASP A 98 -20.284 -8.578 -3.997 1.00 52.51 N ATOM 1442 CA ASP A 98 -19.629 -9.431 -2.966 1.00 20.22 C ATOM 1443 C ASP A 98 -19.153 -10.768 -3.473 1.00 31.12 C ATOM 1444 O ASP A 98 -18.051 -11.171 -3.151 1.00 64.11 O ATOM 1445 CB ASP A 98 -20.470 -9.604 -1.683 1.00 70.12 C ATOM 1446 CG ASP A 98 -21.613 -10.573 -1.796 1.00 35.34 C ATOM 1447 OD1 ASP A 98 -22.649 -10.233 -2.374 1.00 0.15 O ATOM 1448 OD2 ASP A 98 -21.490 -11.692 -1.264 1.00 41.24 O ATOM 0 H ASP A 98 -21.078 -8.047 -3.639 1.00 52.51 H new ATOM 0 HA ASP A 98 -18.737 -8.862 -2.703 1.00 20.22 H new ATOM 0 HB2 ASP A 98 -19.813 -9.933 -0.878 1.00 70.12 H new ATOM 0 HB3 ASP A 98 -20.866 -8.631 -1.393 1.00 70.12 H new ATOM 1453 N GLU A 99 -19.960 -11.470 -4.230 1.00 35.02 N ATOM 1454 CA GLU A 99 -19.507 -12.684 -4.821 1.00 25.24 C ATOM 1455 C GLU A 99 -19.470 -12.544 -6.339 1.00 54.30 C ATOM 1456 O GLU A 99 -20.500 -12.653 -7.016 1.00 0.31 O ATOM 1457 CB GLU A 99 -20.403 -13.826 -4.388 1.00 41.33 C ATOM 1458 CG GLU A 99 -19.943 -15.194 -4.808 1.00 45.03 C ATOM 1459 CD GLU A 99 -20.838 -16.245 -4.246 1.00 11.44 C ATOM 1460 OE1 GLU A 99 -20.782 -16.477 -3.024 1.00 62.34 O ATOM 1461 OE2 GLU A 99 -21.638 -16.838 -5.004 1.00 52.45 O ATOM 0 H GLU A 99 -20.924 -11.216 -4.444 1.00 35.02 H new ATOM 0 HA GLU A 99 -18.494 -12.902 -4.484 1.00 25.24 H new ATOM 0 HB2 GLU A 99 -20.490 -13.807 -3.302 1.00 41.33 H new ATOM 0 HB3 GLU A 99 -21.402 -13.656 -4.791 1.00 41.33 H new ATOM 0 HG2 GLU A 99 -19.932 -15.262 -5.896 1.00 45.03 H new ATOM 0 HG3 GLU A 99 -18.921 -15.360 -4.468 1.00 45.03 H new ATOM 1468 N THR A 100 -18.300 -12.254 -6.838 1.00 3.10 N ATOM 1469 CA THR A 100 -18.063 -12.082 -8.268 1.00 63.51 C ATOM 1470 C THR A 100 -16.713 -12.644 -8.660 1.00 51.44 C ATOM 1471 O THR A 100 -15.880 -12.909 -7.801 1.00 52.24 O ATOM 1472 CB THR A 100 -18.171 -10.598 -8.720 1.00 52.14 C ATOM 1473 OG1 THR A 100 -17.404 -9.750 -7.852 1.00 4.30 O ATOM 1474 CG2 THR A 100 -19.618 -10.121 -8.788 1.00 23.52 C ATOM 0 H THR A 100 -17.465 -12.126 -6.266 1.00 3.10 H new ATOM 0 HA THR A 100 -18.849 -12.636 -8.780 1.00 63.51 H new ATOM 0 HB THR A 100 -17.762 -10.538 -9.729 1.00 52.14 H new ATOM 0 HG1 THR A 100 -17.824 -9.722 -6.967 1.00 4.30 H new ATOM 0 HG21 THR A 100 -19.643 -9.079 -9.108 1.00 23.52 H new ATOM 0 HG22 THR A 100 -20.170 -10.733 -9.501 1.00 23.52 H new ATOM 0 HG23 THR A 100 -20.077 -10.209 -7.803 1.00 23.52 H new ATOM 1482 N VAL A 101 -16.488 -12.820 -9.937 1.00 60.12 N ATOM 1483 CA VAL A 101 -15.242 -13.342 -10.402 1.00 32.32 C ATOM 1484 C VAL A 101 -14.393 -12.223 -11.001 1.00 3.01 C ATOM 1485 O VAL A 101 -14.804 -11.527 -11.940 1.00 32.13 O ATOM 1486 CB VAL A 101 -15.424 -14.544 -11.387 1.00 4.12 C ATOM 1487 CG1 VAL A 101 -16.265 -14.174 -12.595 1.00 55.35 C ATOM 1488 CG2 VAL A 101 -14.084 -15.105 -11.816 1.00 44.24 C ATOM 0 H VAL A 101 -17.161 -12.606 -10.673 1.00 60.12 H new ATOM 0 HA VAL A 101 -14.709 -13.749 -9.543 1.00 32.32 H new ATOM 0 HB VAL A 101 -15.964 -15.319 -10.844 1.00 4.12 H new ATOM 0 HG11 VAL A 101 -16.363 -15.040 -13.249 1.00 55.35 H new ATOM 0 HG12 VAL A 101 -17.254 -13.854 -12.266 1.00 55.35 H new ATOM 0 HG13 VAL A 101 -15.783 -13.361 -13.139 1.00 55.35 H new ATOM 0 HG21 VAL A 101 -14.241 -15.939 -12.500 1.00 44.24 H new ATOM 0 HG22 VAL A 101 -13.508 -14.328 -12.318 1.00 44.24 H new ATOM 0 HG23 VAL A 101 -13.538 -15.453 -10.939 1.00 44.24 H new ATOM 1498 N PHE A 102 -13.251 -12.025 -10.422 1.00 4.44 N ATOM 1499 CA PHE A 102 -12.339 -11.003 -10.822 1.00 1.03 C ATOM 1500 C PHE A 102 -11.101 -11.678 -11.385 1.00 64.42 C ATOM 1501 O PHE A 102 -10.420 -12.429 -10.678 1.00 25.23 O ATOM 1502 CB PHE A 102 -11.997 -10.156 -9.597 1.00 64.34 C ATOM 1503 CG PHE A 102 -11.186 -8.923 -9.861 1.00 45.42 C ATOM 1504 CD1 PHE A 102 -11.812 -7.736 -10.191 1.00 44.12 C ATOM 1505 CD2 PHE A 102 -9.810 -8.943 -9.757 1.00 44.14 C ATOM 1506 CE1 PHE A 102 -11.081 -6.592 -10.414 1.00 74.52 C ATOM 1507 CE2 PHE A 102 -9.074 -7.803 -9.984 1.00 11.30 C ATOM 1508 CZ PHE A 102 -9.711 -6.625 -10.310 1.00 53.00 C ATOM 0 H PHE A 102 -12.919 -12.585 -9.637 1.00 4.44 H new ATOM 0 HA PHE A 102 -12.768 -10.353 -11.584 1.00 1.03 H new ATOM 0 HB2 PHE A 102 -12.927 -9.859 -9.113 1.00 64.34 H new ATOM 0 HB3 PHE A 102 -11.454 -10.780 -8.888 1.00 64.34 H new ATOM 0 HD1 PHE A 102 -12.888 -7.706 -10.275 1.00 44.12 H new ATOM 0 HD2 PHE A 102 -9.306 -9.862 -9.495 1.00 44.14 H new ATOM 0 HE1 PHE A 102 -11.582 -5.670 -10.670 1.00 74.52 H new ATOM 0 HE2 PHE A 102 -7.997 -7.831 -9.907 1.00 11.30 H new ATOM 0 HZ PHE A 102 -9.134 -5.729 -10.484 1.00 53.00 H new ATOM 1518 N ARG A 103 -10.853 -11.443 -12.666 1.00 72.45 N ATOM 1519 CA ARG A 103 -9.744 -12.014 -13.471 1.00 51.45 C ATOM 1520 C ARG A 103 -9.502 -13.523 -13.234 1.00 54.04 C ATOM 1521 O ARG A 103 -8.378 -14.036 -13.377 1.00 13.53 O ATOM 1522 CB ARG A 103 -8.477 -11.175 -13.322 1.00 15.21 C ATOM 1523 CG ARG A 103 -7.815 -11.189 -11.970 1.00 14.43 C ATOM 1524 CD ARG A 103 -6.680 -10.197 -11.944 1.00 5.42 C ATOM 1525 NE ARG A 103 -5.827 -10.309 -13.142 1.00 23.21 N ATOM 1526 CZ ARG A 103 -4.826 -11.167 -13.300 1.00 4.11 C ATOM 1527 NH1 ARG A 103 -4.664 -12.164 -12.439 1.00 54.32 N ATOM 1528 NH2 ARG A 103 -4.031 -11.063 -14.353 1.00 24.23 N ATOM 0 H ARG A 103 -11.442 -10.818 -13.215 1.00 72.45 H new ATOM 0 HA ARG A 103 -10.058 -11.959 -14.513 1.00 51.45 H new ATOM 0 HB2 ARG A 103 -7.752 -11.519 -14.060 1.00 15.21 H new ATOM 0 HB3 ARG A 103 -8.721 -10.142 -13.571 1.00 15.21 H new ATOM 0 HG2 ARG A 103 -8.543 -10.943 -11.197 1.00 14.43 H new ATOM 0 HG3 ARG A 103 -7.441 -12.189 -11.749 1.00 14.43 H new ATOM 0 HD2 ARG A 103 -7.082 -9.186 -11.877 1.00 5.42 H new ATOM 0 HD3 ARG A 103 -6.076 -10.359 -11.051 1.00 5.42 H new ATOM 0 HE ARG A 103 -6.023 -9.673 -13.915 1.00 23.21 H new ATOM 0 HH11 ARG A 103 -5.309 -12.271 -11.656 1.00 54.32 H new ATOM 0 HH12 ARG A 103 -3.895 -12.823 -12.561 1.00 54.32 H new ATOM 0 HH21 ARG A 103 -4.188 -10.326 -15.040 1.00 24.23 H new ATOM 0 HH22 ARG A 103 -3.261 -11.720 -14.478 1.00 24.23 H new ATOM 1542 N GLY A 104 -10.576 -14.218 -12.944 1.00 15.25 N ATOM 1543 CA GLY A 104 -10.530 -15.653 -12.809 1.00 63.31 C ATOM 1544 C GLY A 104 -10.695 -16.140 -11.385 1.00 64.02 C ATOM 1545 O GLY A 104 -10.903 -17.334 -11.155 1.00 70.22 O ATOM 0 H GLY A 104 -11.498 -13.809 -12.796 1.00 15.25 H new ATOM 0 HA2 GLY A 104 -11.314 -16.092 -13.426 1.00 63.31 H new ATOM 0 HA3 GLY A 104 -9.578 -16.015 -13.198 1.00 63.31 H new ATOM 1549 N ARG A 105 -10.615 -15.245 -10.428 1.00 20.15 N ATOM 1550 CA ARG A 105 -10.768 -15.626 -9.034 1.00 61.25 C ATOM 1551 C ARG A 105 -12.042 -15.039 -8.477 1.00 62.43 C ATOM 1552 O ARG A 105 -12.362 -13.900 -8.761 1.00 50.32 O ATOM 1553 CB ARG A 105 -9.589 -15.144 -8.191 1.00 30.24 C ATOM 1554 CG ARG A 105 -8.244 -15.691 -8.612 1.00 44.31 C ATOM 1555 CD ARG A 105 -7.164 -15.286 -7.630 1.00 22.43 C ATOM 1556 NE ARG A 105 -5.853 -15.818 -8.006 1.00 32.43 N ATOM 1557 CZ ARG A 105 -4.914 -16.227 -7.146 1.00 21.53 C ATOM 1558 NH1 ARG A 105 -5.159 -16.256 -5.839 1.00 44.44 N ATOM 1559 NH2 ARG A 105 -3.739 -16.625 -7.604 1.00 61.40 N ATOM 0 H ARG A 105 -10.446 -14.251 -10.583 1.00 20.15 H new ATOM 0 HA ARG A 105 -10.805 -16.715 -8.991 1.00 61.25 H new ATOM 0 HB2 ARG A 105 -9.552 -14.055 -8.232 1.00 30.24 H new ATOM 0 HB3 ARG A 105 -9.768 -15.418 -7.151 1.00 30.24 H new ATOM 0 HG2 ARG A 105 -8.293 -16.778 -8.677 1.00 44.31 H new ATOM 0 HG3 ARG A 105 -7.993 -15.323 -9.607 1.00 44.31 H new ATOM 0 HD2 ARG A 105 -7.112 -14.199 -7.576 1.00 22.43 H new ATOM 0 HD3 ARG A 105 -7.428 -15.642 -6.634 1.00 22.43 H new ATOM 0 HE ARG A 105 -5.639 -15.882 -9.001 1.00 32.43 H new ATOM 0 HH11 ARG A 105 -6.070 -15.965 -5.484 1.00 44.44 H new ATOM 0 HH12 ARG A 105 -4.436 -16.570 -5.191 1.00 44.44 H new ATOM 0 HH21 ARG A 105 -3.554 -16.619 -8.607 1.00 61.40 H new ATOM 0 HH22 ARG A 105 -3.018 -16.938 -6.954 1.00 61.40 H new ATOM 1573 N THR A 106 -12.762 -15.798 -7.696 1.00 63.14 N ATOM 1574 CA THR A 106 -13.963 -15.290 -7.096 1.00 32.04 C ATOM 1575 C THR A 106 -13.561 -14.441 -5.900 1.00 73.42 C ATOM 1576 O THR A 106 -12.926 -14.930 -4.975 1.00 30.41 O ATOM 1577 CB THR A 106 -14.886 -16.440 -6.637 1.00 54.02 C ATOM 1578 OG1 THR A 106 -15.133 -17.328 -7.752 1.00 12.34 O ATOM 1579 CG2 THR A 106 -16.223 -15.898 -6.125 1.00 74.14 C ATOM 0 H THR A 106 -12.539 -16.765 -7.462 1.00 63.14 H new ATOM 0 HA THR A 106 -14.515 -14.698 -7.826 1.00 32.04 H new ATOM 0 HB THR A 106 -14.393 -16.976 -5.826 1.00 54.02 H new ATOM 0 HG1 THR A 106 -15.717 -18.060 -7.464 1.00 12.34 H new ATOM 0 HG21 THR A 106 -16.855 -16.728 -5.808 1.00 74.14 H new ATOM 0 HG22 THR A 106 -16.046 -15.233 -5.280 1.00 74.14 H new ATOM 0 HG23 THR A 106 -16.721 -15.347 -6.922 1.00 74.14 H new ATOM 1587 N ILE A 107 -13.915 -13.200 -5.914 1.00 74.53 N ATOM 1588 CA ILE A 107 -13.520 -12.319 -4.853 1.00 2.44 C ATOM 1589 C ILE A 107 -14.646 -12.101 -3.902 1.00 23.00 C ATOM 1590 O ILE A 107 -15.779 -12.544 -4.145 1.00 21.04 O ATOM 1591 CB ILE A 107 -12.999 -10.943 -5.362 1.00 33.15 C ATOM 1592 CG1 ILE A 107 -14.078 -10.197 -6.178 1.00 31.41 C ATOM 1593 CG2 ILE A 107 -11.718 -11.128 -6.170 1.00 54.43 C ATOM 1594 CD1 ILE A 107 -13.677 -8.789 -6.603 1.00 61.33 C ATOM 0 H ILE A 107 -14.478 -12.767 -6.646 1.00 74.53 H new ATOM 0 HA ILE A 107 -12.692 -12.813 -4.344 1.00 2.44 H new ATOM 0 HB ILE A 107 -12.769 -10.324 -4.495 1.00 33.15 H new ATOM 0 HG12 ILE A 107 -14.312 -10.780 -7.068 1.00 31.41 H new ATOM 0 HG13 ILE A 107 -14.991 -10.139 -5.585 1.00 31.41 H new ATOM 0 HG21 ILE A 107 -11.365 -10.158 -6.520 1.00 54.43 H new ATOM 0 HG22 ILE A 107 -10.955 -11.587 -5.542 1.00 54.43 H new ATOM 0 HG23 ILE A 107 -11.918 -11.772 -7.027 1.00 54.43 H new ATOM 0 HD11 ILE A 107 -14.489 -8.335 -7.171 1.00 61.33 H new ATOM 0 HD12 ILE A 107 -13.472 -8.186 -5.718 1.00 61.33 H new ATOM 0 HD13 ILE A 107 -12.783 -8.837 -7.224 1.00 61.33 H new ATOM 1606 N LYS A 108 -14.336 -11.461 -2.821 1.00 73.51 N ATOM 1607 CA LYS A 108 -15.282 -11.213 -1.789 1.00 34.53 C ATOM 1608 C LYS A 108 -15.169 -9.778 -1.365 1.00 51.34 C ATOM 1609 O LYS A 108 -14.076 -9.317 -1.028 1.00 3.41 O ATOM 1610 CB LYS A 108 -15.026 -12.143 -0.592 1.00 51.53 C ATOM 1611 CG LYS A 108 -16.019 -11.974 0.552 1.00 42.11 C ATOM 1612 CD LYS A 108 -17.429 -12.260 0.081 1.00 13.02 C ATOM 1613 CE LYS A 108 -18.450 -12.079 1.184 1.00 0.34 C ATOM 1614 NZ LYS A 108 -19.812 -12.488 0.755 1.00 42.21 N ATOM 0 H LYS A 108 -13.404 -11.092 -2.630 1.00 73.51 H new ATOM 0 HA LYS A 108 -16.288 -11.409 -2.161 1.00 34.53 H new ATOM 0 HB2 LYS A 108 -15.057 -13.177 -0.936 1.00 51.53 H new ATOM 0 HB3 LYS A 108 -14.019 -11.963 -0.215 1.00 51.53 H new ATOM 0 HG2 LYS A 108 -15.759 -12.648 1.369 1.00 42.11 H new ATOM 0 HG3 LYS A 108 -15.960 -10.959 0.945 1.00 42.11 H new ATOM 0 HD2 LYS A 108 -17.674 -11.598 -0.750 1.00 13.02 H new ATOM 0 HD3 LYS A 108 -17.483 -13.281 -0.298 1.00 13.02 H new ATOM 0 HE2 LYS A 108 -18.152 -12.666 2.053 1.00 0.34 H new ATOM 0 HE3 LYS A 108 -18.466 -11.034 1.495 1.00 0.34 H new ATOM 0 HZ1 LYS A 108 -20.486 -12.316 1.528 1.00 42.21 H new ATOM 0 HZ2 LYS A 108 -20.094 -11.935 -0.079 1.00 42.21 H new ATOM 0 HZ3 LYS A 108 -19.811 -13.500 0.515 1.00 42.21 H new ATOM 1628 N VAL A 109 -16.271 -9.068 -1.392 1.00 53.41 N ATOM 1629 CA VAL A 109 -16.277 -7.685 -0.991 1.00 24.54 C ATOM 1630 C VAL A 109 -17.367 -7.421 0.025 1.00 2.51 C ATOM 1631 O VAL A 109 -18.498 -7.866 -0.138 1.00 50.55 O ATOM 1632 CB VAL A 109 -16.342 -6.646 -2.167 1.00 21.42 C ATOM 1633 CG1 VAL A 109 -15.123 -6.739 -3.037 1.00 54.50 C ATOM 1634 CG2 VAL A 109 -17.564 -6.801 -3.025 1.00 31.11 C ATOM 0 H VAL A 109 -17.178 -9.428 -1.689 1.00 53.41 H new ATOM 0 HA VAL A 109 -15.301 -7.525 -0.533 1.00 24.54 H new ATOM 0 HB VAL A 109 -16.389 -5.667 -1.690 1.00 21.42 H new ATOM 0 HG11 VAL A 109 -15.195 -6.009 -3.843 1.00 54.50 H new ATOM 0 HG12 VAL A 109 -14.234 -6.535 -2.440 1.00 54.50 H new ATOM 0 HG13 VAL A 109 -15.054 -7.741 -3.461 1.00 54.50 H new ATOM 0 HG21 VAL A 109 -17.549 -6.054 -3.818 1.00 31.11 H new ATOM 0 HG22 VAL A 109 -17.575 -7.798 -3.465 1.00 31.11 H new ATOM 0 HG23 VAL A 109 -18.457 -6.664 -2.415 1.00 31.11 H new ATOM 1644 N LEU A 110 -17.024 -6.750 1.074 1.00 1.25 N ATOM 1645 CA LEU A 110 -17.986 -6.364 2.078 1.00 32.32 C ATOM 1646 C LEU A 110 -17.549 -5.044 2.683 1.00 2.21 C ATOM 1647 O LEU A 110 -16.379 -4.690 2.544 1.00 11.31 O ATOM 1648 CB LEU A 110 -18.346 -7.528 3.100 1.00 30.22 C ATOM 1649 CG LEU A 110 -17.336 -8.127 4.084 1.00 11.20 C ATOM 1650 CD1 LEU A 110 -15.932 -8.337 3.591 1.00 42.03 C ATOM 1651 CD2 LEU A 110 -17.466 -7.597 5.482 1.00 32.44 C ATOM 0 H LEU A 110 -16.069 -6.448 1.269 1.00 1.25 H new ATOM 0 HA LEU A 110 -18.958 -6.192 1.616 1.00 32.32 H new ATOM 0 HB2 LEU A 110 -19.181 -7.164 3.699 1.00 30.22 H new ATOM 0 HB3 LEU A 110 -18.722 -8.358 2.501 1.00 30.22 H new ATOM 0 HG LEU A 110 -17.660 -9.166 4.151 1.00 11.20 H new ATOM 0 HD11 LEU A 110 -15.326 -8.766 4.389 1.00 42.03 H new ATOM 0 HD12 LEU A 110 -15.943 -9.017 2.739 1.00 42.03 H new ATOM 0 HD13 LEU A 110 -15.506 -7.381 3.287 1.00 42.03 H new ATOM 0 HD21 LEU A 110 -16.718 -8.067 6.120 1.00 32.44 H new ATOM 0 HD22 LEU A 110 -17.313 -6.518 5.478 1.00 32.44 H new ATOM 0 HD23 LEU A 110 -18.462 -7.820 5.865 1.00 32.44 H new ATOM 1663 N PRO A 111 -18.436 -4.257 3.311 1.00 41.14 N ATOM 1664 CA PRO A 111 -18.052 -2.961 3.818 1.00 12.31 C ATOM 1665 C PRO A 111 -17.246 -3.104 5.099 1.00 53.35 C ATOM 1666 O PRO A 111 -17.638 -3.838 6.017 1.00 0.55 O ATOM 1667 CB PRO A 111 -19.399 -2.276 4.078 1.00 51.32 C ATOM 1668 CG PRO A 111 -20.308 -3.391 4.432 1.00 3.32 C ATOM 1669 CD PRO A 111 -19.848 -4.574 3.625 1.00 2.51 C ATOM 0 HA PRO A 111 -17.417 -2.397 3.135 1.00 12.31 H new ATOM 0 HB2 PRO A 111 -19.327 -1.548 4.886 1.00 51.32 H new ATOM 0 HB3 PRO A 111 -19.750 -1.740 3.197 1.00 51.32 H new ATOM 0 HG2 PRO A 111 -20.264 -3.606 5.500 1.00 3.32 H new ATOM 0 HG3 PRO A 111 -21.343 -3.139 4.200 1.00 3.32 H new ATOM 0 HD2 PRO A 111 -19.934 -5.502 4.190 1.00 2.51 H new ATOM 0 HD3 PRO A 111 -20.442 -4.696 2.719 1.00 2.51 H new ATOM 1677 N LYS A 112 -16.125 -2.445 5.155 1.00 62.12 N ATOM 1678 CA LYS A 112 -15.311 -2.506 6.321 1.00 21.43 C ATOM 1679 C LYS A 112 -15.884 -1.461 7.249 1.00 0.21 C ATOM 1680 O LYS A 112 -15.801 -0.281 6.991 1.00 20.04 O ATOM 1681 CB LYS A 112 -13.817 -2.310 5.948 1.00 23.34 C ATOM 1682 CG LYS A 112 -12.824 -2.739 7.038 1.00 23.23 C ATOM 1683 CD LYS A 112 -12.525 -1.658 8.058 1.00 52.53 C ATOM 1684 CE LYS A 112 -11.626 -0.590 7.447 1.00 0.21 C ATOM 1685 NZ LYS A 112 -11.250 0.443 8.418 1.00 74.24 N ATOM 0 H LYS A 112 -15.759 -1.861 4.404 1.00 62.12 H new ATOM 0 HA LYS A 112 -15.324 -3.474 6.822 1.00 21.43 H new ATOM 0 HB2 LYS A 112 -13.606 -2.875 5.040 1.00 23.34 H new ATOM 0 HB3 LYS A 112 -13.649 -1.258 5.716 1.00 23.34 H new ATOM 0 HG2 LYS A 112 -13.222 -3.612 7.555 1.00 23.23 H new ATOM 0 HG3 LYS A 112 -11.891 -3.046 6.565 1.00 23.23 H new ATOM 0 HD2 LYS A 112 -13.455 -1.206 8.403 1.00 52.53 H new ATOM 0 HD3 LYS A 112 -12.040 -2.096 8.931 1.00 52.53 H new ATOM 0 HE2 LYS A 112 -10.725 -1.059 7.052 1.00 0.21 H new ATOM 0 HE3 LYS A 112 -12.139 -0.125 6.605 1.00 0.21 H new ATOM 0 HZ1 LYS A 112 -10.244 0.679 8.302 1.00 74.24 H new ATOM 0 HZ2 LYS A 112 -11.826 1.294 8.260 1.00 74.24 H new ATOM 0 HZ3 LYS A 112 -11.413 0.089 9.382 1.00 74.24 H new ATOM 1699 N ARG A 113 -16.489 -1.924 8.305 1.00 3.52 N ATOM 1700 CA ARG A 113 -17.389 -1.106 9.080 1.00 23.20 C ATOM 1701 C ARG A 113 -16.700 -0.432 10.246 1.00 2.30 C ATOM 1702 O ARG A 113 -15.918 -1.056 10.972 1.00 2.34 O ATOM 1703 CB ARG A 113 -18.550 -1.978 9.547 1.00 40.55 C ATOM 1704 CG ARG A 113 -19.740 -1.249 10.137 1.00 31.03 C ATOM 1705 CD ARG A 113 -20.831 -2.244 10.532 1.00 53.42 C ATOM 1706 NE ARG A 113 -21.188 -3.148 9.412 1.00 24.15 N ATOM 1707 CZ ARG A 113 -22.421 -3.607 9.127 1.00 43.43 C ATOM 1708 NH1 ARG A 113 -23.474 -3.225 9.850 1.00 72.21 N ATOM 1709 NH2 ARG A 113 -22.592 -4.455 8.116 1.00 23.14 N ATOM 0 H ARG A 113 -16.376 -2.875 8.656 1.00 3.52 H new ATOM 0 HA ARG A 113 -17.760 -0.297 8.451 1.00 23.20 H new ATOM 0 HB2 ARG A 113 -18.897 -2.569 8.700 1.00 40.55 H new ATOM 0 HB3 ARG A 113 -18.174 -2.679 10.292 1.00 40.55 H new ATOM 0 HG2 ARG A 113 -19.428 -0.676 11.010 1.00 31.03 H new ATOM 0 HG3 ARG A 113 -20.134 -0.536 9.413 1.00 31.03 H new ATOM 0 HD2 ARG A 113 -20.492 -2.836 11.382 1.00 53.42 H new ATOM 0 HD3 ARG A 113 -21.718 -1.700 10.856 1.00 53.42 H new ATOM 0 HE ARG A 113 -20.429 -3.450 8.801 1.00 24.15 H new ATOM 0 HH11 ARG A 113 -23.350 -2.578 10.629 1.00 72.21 H new ATOM 0 HH12 ARG A 113 -24.403 -3.580 9.624 1.00 72.21 H new ATOM 0 HH21 ARG A 113 -21.791 -4.755 7.561 1.00 23.14 H new ATOM 0 HH22 ARG A 113 -23.524 -4.805 7.896 1.00 23.14 H new ATOM 1723 N THR A 114 -17.011 0.829 10.413 1.00 73.54 N ATOM 1724 CA THR A 114 -16.484 1.661 11.451 1.00 72.04 C ATOM 1725 C THR A 114 -17.039 1.230 12.807 1.00 14.22 C ATOM 1726 O THR A 114 -18.174 0.728 12.899 1.00 73.33 O ATOM 1727 CB THR A 114 -16.914 3.113 11.170 1.00 63.23 C ATOM 1728 OG1 THR A 114 -16.604 3.411 9.823 1.00 42.44 O ATOM 1729 CG2 THR A 114 -16.181 4.102 12.071 1.00 65.24 C ATOM 0 H THR A 114 -17.665 1.318 9.802 1.00 73.54 H new ATOM 0 HA THR A 114 -15.398 1.576 11.473 1.00 72.04 H new ATOM 0 HB THR A 114 -17.982 3.204 11.366 1.00 63.23 H new ATOM 0 HG1 THR A 114 -15.831 2.880 9.540 1.00 42.44 H new ATOM 0 HG21 THR A 114 -16.511 5.116 11.843 1.00 65.24 H new ATOM 0 HG22 THR A 114 -16.400 3.875 13.114 1.00 65.24 H new ATOM 0 HG23 THR A 114 -15.107 4.023 11.900 1.00 65.24 H new ATOM 1737 N ASN A 115 -16.249 1.394 13.839 1.00 75.23 N ATOM 1738 CA ASN A 115 -16.663 1.073 15.179 1.00 31.45 C ATOM 1739 C ASN A 115 -15.986 2.024 16.131 1.00 22.41 C ATOM 1740 O ASN A 115 -14.771 2.209 16.064 1.00 40.33 O ATOM 1741 CB ASN A 115 -16.278 -0.370 15.525 1.00 74.22 C ATOM 1742 CG ASN A 115 -16.775 -0.805 16.904 1.00 33.30 C ATOM 1743 OD1 ASN A 115 -17.871 -1.319 17.038 1.00 61.24 O ATOM 1744 ND2 ASN A 115 -15.968 -0.610 17.924 1.00 63.43 N ATOM 0 H ASN A 115 -15.298 1.755 13.771 1.00 75.23 H new ATOM 0 HA ASN A 115 -17.746 1.168 15.260 1.00 31.45 H new ATOM 0 HB2 ASN A 115 -16.687 -1.041 14.769 1.00 74.22 H new ATOM 0 HB3 ASN A 115 -15.193 -0.470 15.487 1.00 74.22 H new ATOM 0 HD21 ASN A 115 -16.254 -0.892 18.862 1.00 63.43 H new ATOM 0 HD22 ASN A 115 -15.056 -0.177 17.777 1.00 63.43 H new ATOM 1751 N MET A 116 -16.755 2.638 16.991 1.00 55.31 N ATOM 1752 CA MET A 116 -16.220 3.546 17.984 1.00 71.22 C ATOM 1753 C MET A 116 -16.103 2.814 19.315 1.00 34.42 C ATOM 1754 O MET A 116 -17.109 2.589 19.985 1.00 51.50 O ATOM 1755 CB MET A 116 -17.125 4.782 18.136 1.00 61.01 C ATOM 1756 CG MET A 116 -16.637 5.792 19.176 1.00 62.10 C ATOM 1757 SD MET A 116 -17.741 7.218 19.360 1.00 5.24 S ATOM 1758 CE MET A 116 -17.681 7.929 17.711 1.00 12.42 C ATOM 0 H MET A 116 -17.768 2.527 17.027 1.00 55.31 H new ATOM 0 HA MET A 116 -15.235 3.887 17.664 1.00 71.22 H new ATOM 0 HB2 MET A 116 -17.204 5.281 17.170 1.00 61.01 H new ATOM 0 HB3 MET A 116 -18.128 4.453 18.408 1.00 61.01 H new ATOM 0 HG2 MET A 116 -16.536 5.292 20.139 1.00 62.10 H new ATOM 0 HG3 MET A 116 -15.644 6.143 18.894 1.00 62.10 H new ATOM 0 HE1 MET A 116 -18.052 8.953 17.743 1.00 12.42 H new ATOM 0 HE2 MET A 116 -16.652 7.927 17.351 1.00 12.42 H new ATOM 0 HE3 MET A 116 -18.302 7.339 17.037 1.00 12.42 H new ATOM 1768 N PRO A 117 -14.884 2.395 19.703 1.00 30.40 N ATOM 1769 CA PRO A 117 -14.663 1.665 20.955 1.00 33.51 C ATOM 1770 C PRO A 117 -14.672 2.603 22.164 1.00 75.10 C ATOM 1771 O PRO A 117 -14.813 2.167 23.311 1.00 71.21 O ATOM 1772 CB PRO A 117 -13.258 1.042 20.773 1.00 73.21 C ATOM 1773 CG PRO A 117 -12.852 1.357 19.365 1.00 51.20 C ATOM 1774 CD PRO A 117 -13.625 2.574 18.969 1.00 62.54 C ATOM 0 HA PRO A 117 -15.444 0.928 21.144 1.00 33.51 H new ATOM 0 HB2 PRO A 117 -12.549 1.460 21.487 1.00 73.21 H new ATOM 0 HB3 PRO A 117 -13.283 -0.035 20.942 1.00 73.21 H new ATOM 0 HG2 PRO A 117 -11.779 1.540 19.301 1.00 51.20 H new ATOM 0 HG3 PRO A 117 -13.073 0.522 18.700 1.00 51.20 H new ATOM 0 HD2 PRO A 117 -13.113 3.493 19.256 1.00 62.54 H new ATOM 0 HD3 PRO A 117 -13.785 2.622 17.892 1.00 62.54 H new ATOM 1782 N GLY A 118 -14.533 3.877 21.891 1.00 40.22 N ATOM 1783 CA GLY A 118 -14.501 4.866 22.918 1.00 51.44 C ATOM 1784 C GLY A 118 -13.206 5.613 22.870 1.00 44.52 C ATOM 1785 O GLY A 118 -12.898 6.269 21.867 1.00 45.13 O ATOM 0 H GLY A 118 -14.439 4.249 20.946 1.00 40.22 H new ATOM 0 HA2 GLY A 118 -15.334 5.558 22.794 1.00 51.44 H new ATOM 0 HA3 GLY A 118 -14.622 4.394 23.893 1.00 51.44 H new ATOM 1789 N ILE A 119 -12.437 5.509 23.916 1.00 25.02 N ATOM 1790 CA ILE A 119 -11.147 6.149 23.982 1.00 44.45 C ATOM 1791 C ILE A 119 -10.033 5.133 23.712 1.00 12.42 C ATOM 1792 O ILE A 119 -9.740 4.256 24.534 1.00 23.42 O ATOM 1793 CB ILE A 119 -10.927 6.922 25.322 1.00 73.41 C ATOM 1794 CG1 ILE A 119 -11.161 6.011 26.550 1.00 63.53 C ATOM 1795 CG2 ILE A 119 -11.826 8.155 25.376 1.00 53.02 C ATOM 1796 CD1 ILE A 119 -10.924 6.691 27.887 1.00 30.33 C ATOM 0 H ILE A 119 -12.684 4.978 24.751 1.00 25.02 H new ATOM 0 HA ILE A 119 -11.114 6.905 23.198 1.00 44.45 H new ATOM 0 HB ILE A 119 -9.887 7.248 25.355 1.00 73.41 H new ATOM 0 HG12 ILE A 119 -12.185 5.639 26.522 1.00 63.53 H new ATOM 0 HG13 ILE A 119 -10.504 5.144 26.475 1.00 63.53 H new ATOM 0 HG21 ILE A 119 -11.662 8.684 26.315 1.00 53.02 H new ATOM 0 HG22 ILE A 119 -11.589 8.815 24.542 1.00 53.02 H new ATOM 0 HG23 ILE A 119 -12.870 7.848 25.310 1.00 53.02 H new ATOM 0 HD11 ILE A 119 -11.110 5.982 28.694 1.00 30.33 H new ATOM 0 HD12 ILE A 119 -9.892 7.039 27.940 1.00 30.33 H new ATOM 0 HD13 ILE A 119 -11.599 7.541 27.988 1.00 30.33 H new ATOM 1808 N SER A 120 -9.460 5.225 22.543 1.00 2.45 N ATOM 1809 CA SER A 120 -8.430 4.309 22.124 1.00 13.21 C ATOM 1810 C SER A 120 -7.151 5.064 21.770 1.00 22.51 C ATOM 1811 O SER A 120 -6.174 4.459 21.305 1.00 34.05 O ATOM 1812 CB SER A 120 -8.933 3.542 20.897 1.00 75.34 C ATOM 1813 OG SER A 120 -10.164 2.882 21.176 1.00 73.12 O ATOM 0 H SER A 120 -9.693 5.938 21.852 1.00 2.45 H new ATOM 0 HA SER A 120 -8.205 3.619 22.937 1.00 13.21 H new ATOM 0 HB2 SER A 120 -9.067 4.231 20.063 1.00 75.34 H new ATOM 0 HB3 SER A 120 -8.186 2.810 20.590 1.00 75.34 H new ATOM 0 HG SER A 120 -9.994 2.095 21.735 1.00 73.12 H new ATOM 1819 N SER A 121 -7.167 6.382 22.017 1.00 62.23 N ATOM 1820 CA SER A 121 -6.086 7.295 21.640 1.00 64.21 C ATOM 1821 C SER A 121 -5.916 7.361 20.113 1.00 40.13 C ATOM 1822 O SER A 121 -5.461 6.402 19.478 1.00 34.40 O ATOM 1823 CB SER A 121 -4.758 6.938 22.323 1.00 44.42 C ATOM 1824 OG SER A 121 -4.865 7.010 23.735 1.00 21.30 O ATOM 0 H SER A 121 -7.942 6.846 22.490 1.00 62.23 H new ATOM 0 HA SER A 121 -6.375 8.285 21.994 1.00 64.21 H new ATOM 0 HB2 SER A 121 -4.456 5.932 22.031 1.00 44.42 H new ATOM 0 HB3 SER A 121 -3.977 7.617 21.981 1.00 44.42 H new ATOM 0 HG SER A 121 -4.004 6.776 24.141 1.00 21.30 H new ATOM 1830 N THR A 122 -6.279 8.484 19.535 1.00 74.23 N ATOM 1831 CA THR A 122 -6.195 8.669 18.101 1.00 53.45 C ATOM 1832 C THR A 122 -4.739 8.615 17.647 1.00 3.41 C ATOM 1833 O THR A 122 -4.378 7.900 16.703 1.00 15.42 O ATOM 1834 CB THR A 122 -6.835 10.023 17.694 1.00 20.10 C ATOM 1835 OG1 THR A 122 -6.195 11.109 18.409 1.00 24.23 O ATOM 1836 CG2 THR A 122 -8.317 10.016 18.029 1.00 34.44 C ATOM 0 H THR A 122 -6.639 9.292 20.042 1.00 74.23 H new ATOM 0 HA THR A 122 -6.744 7.864 17.613 1.00 53.45 H new ATOM 0 HB THR A 122 -6.702 10.163 16.621 1.00 20.10 H new ATOM 0 HG1 THR A 122 -5.430 11.435 17.891 1.00 24.23 H new ATOM 0 HG21 THR A 122 -8.760 10.969 17.741 1.00 34.44 H new ATOM 0 HG22 THR A 122 -8.809 9.209 17.486 1.00 34.44 H new ATOM 0 HG23 THR A 122 -8.447 9.865 19.101 1.00 34.44 H new ATOM 1844 N ASP A 123 -3.926 9.344 18.353 1.00 41.13 N ATOM 1845 CA ASP A 123 -2.516 9.457 18.116 1.00 33.23 C ATOM 1846 C ASP A 123 -1.927 10.016 19.374 1.00 74.31 C ATOM 1847 O ASP A 123 -2.602 10.761 20.080 1.00 0.14 O ATOM 1848 CB ASP A 123 -2.230 10.396 16.918 1.00 65.44 C ATOM 1849 CG ASP A 123 -2.723 11.825 17.125 1.00 74.41 C ATOM 1850 OD1 ASP A 123 -3.963 12.080 17.014 1.00 3.31 O ATOM 1851 OD2 ASP A 123 -1.881 12.728 17.357 1.00 3.21 O ATOM 0 H ASP A 123 -4.242 9.902 19.146 1.00 41.13 H new ATOM 0 HA ASP A 123 -2.081 8.489 17.867 1.00 33.23 H new ATOM 0 HB2 ASP A 123 -1.156 10.415 16.732 1.00 65.44 H new ATOM 0 HB3 ASP A 123 -2.701 9.985 16.025 1.00 65.44 H new ATOM 1856 N ARG A 124 -0.730 9.637 19.707 1.00 55.22 N ATOM 1857 CA ARG A 124 -0.140 10.144 20.925 1.00 20.11 C ATOM 1858 C ARG A 124 1.301 10.555 20.665 1.00 54.52 C ATOM 1859 O ARG A 124 1.927 10.035 19.731 1.00 22.13 O ATOM 1860 CB ARG A 124 -0.218 9.083 22.038 1.00 11.42 C ATOM 1861 CG ARG A 124 0.037 9.624 23.442 1.00 74.22 C ATOM 1862 CD ARG A 124 -1.041 10.638 23.818 1.00 22.14 C ATOM 1863 NE ARG A 124 -0.906 11.170 25.178 1.00 61.32 N ATOM 1864 CZ ARG A 124 -1.775 12.036 25.738 1.00 63.10 C ATOM 1865 NH1 ARG A 124 -2.824 12.479 25.041 1.00 52.30 N ATOM 1866 NH2 ARG A 124 -1.585 12.462 26.977 1.00 42.33 N ATOM 0 H ARG A 124 -0.148 8.993 19.171 1.00 55.22 H new ATOM 0 HA ARG A 124 -0.697 11.021 21.256 1.00 20.11 H new ATOM 0 HB2 ARG A 124 -1.204 8.620 22.014 1.00 11.42 H new ATOM 0 HB3 ARG A 124 0.508 8.298 21.827 1.00 11.42 H new ATOM 0 HG2 ARG A 124 0.042 8.804 24.160 1.00 74.22 H new ATOM 0 HG3 ARG A 124 1.020 10.093 23.486 1.00 74.22 H new ATOM 0 HD2 ARG A 124 -1.011 11.466 23.110 1.00 22.14 H new ATOM 0 HD3 ARG A 124 -2.019 10.168 23.717 1.00 22.14 H new ATOM 0 HE ARG A 124 -0.106 10.867 25.734 1.00 61.32 H new ATOM 0 HH11 ARG A 124 -2.970 12.162 24.082 1.00 52.30 H new ATOM 0 HH12 ARG A 124 -3.480 13.134 25.467 1.00 52.30 H new ATOM 0 HH21 ARG A 124 -0.780 12.135 27.511 1.00 42.33 H new ATOM 0 HH22 ARG A 124 -2.244 13.117 27.398 1.00 42.33 H new TER 1880 ARG A 124 ATOM 1881 N ALA B 1 8.710 14.768 25.380 1.00 11.31 N ATOM 1882 CA ALA B 1 9.150 13.667 24.553 1.00 30.43 C ATOM 1883 C ALA B 1 9.067 12.379 25.355 1.00 12.15 C ATOM 1884 O ALA B 1 8.694 12.409 26.537 1.00 33.41 O ATOM 1885 CB ALA B 1 10.574 13.910 24.070 1.00 22.10 C ATOM 0 H1 ALA B 1 7.847 15.184 24.974 1.00 11.31 H new ATOM 0 H2 ALA B 1 8.509 14.422 26.340 1.00 11.31 H new ATOM 0 H3 ALA B 1 9.456 15.491 25.421 1.00 11.31 H new ATOM 0 HA ALA B 1 8.506 13.585 23.678 1.00 30.43 H new ATOM 0 HB1 ALA B 1 10.895 13.074 23.448 1.00 22.10 H new ATOM 0 HB2 ALA B 1 10.608 14.830 23.487 1.00 22.10 H new ATOM 0 HB3 ALA B 1 11.239 13.999 24.929 1.00 22.10 H new ATOM 1891 N ILE B 2 9.399 11.271 24.730 1.00 42.45 N ATOM 1892 CA ILE B 2 9.366 9.981 25.393 1.00 41.30 C ATOM 1893 C ILE B 2 10.544 9.833 26.349 1.00 15.43 C ATOM 1894 O ILE B 2 11.677 10.206 26.023 1.00 24.33 O ATOM 1895 CB ILE B 2 9.313 8.748 24.406 1.00 11.22 C ATOM 1896 CG1 ILE B 2 10.596 8.585 23.512 1.00 24.43 C ATOM 1897 CG2 ILE B 2 8.056 8.798 23.546 1.00 61.24 C ATOM 1898 CD1 ILE B 2 10.874 9.702 22.513 1.00 51.33 C ATOM 0 H ILE B 2 9.698 11.235 23.755 1.00 42.45 H new ATOM 0 HA ILE B 2 8.430 9.966 25.951 1.00 41.30 H new ATOM 0 HB ILE B 2 9.282 7.862 25.041 1.00 11.22 H new ATOM 0 HG12 ILE B 2 11.461 8.492 24.169 1.00 24.43 H new ATOM 0 HG13 ILE B 2 10.512 7.648 22.962 1.00 24.43 H new ATOM 0 HG21 ILE B 2 8.040 7.940 22.874 1.00 61.24 H new ATOM 0 HG22 ILE B 2 7.175 8.773 24.187 1.00 61.24 H new ATOM 0 HG23 ILE B 2 8.052 9.717 22.960 1.00 61.24 H new ATOM 0 HD11 ILE B 2 11.784 9.475 21.957 1.00 51.33 H new ATOM 0 HD12 ILE B 2 10.037 9.787 21.820 1.00 51.33 H new ATOM 0 HD13 ILE B 2 11.000 10.644 23.046 1.00 51.33 H new ATOM 1910 N ALA B 3 10.270 9.322 27.519 1.00 34.22 N ATOM 1911 CA ALA B 3 11.290 9.120 28.519 1.00 23.34 C ATOM 1912 C ALA B 3 11.491 7.627 28.748 1.00 44.14 C ATOM 1913 O ALA B 3 10.525 6.854 28.661 1.00 31.45 O ATOM 1914 CB ALA B 3 10.890 9.812 29.819 1.00 1.23 C ATOM 0 H ALA B 3 9.335 9.033 27.808 1.00 34.22 H new ATOM 0 HA ALA B 3 12.228 9.553 28.173 1.00 23.34 H new ATOM 0 HB1 ALA B 3 11.666 9.654 30.569 1.00 1.23 H new ATOM 0 HB2 ALA B 3 10.770 10.881 29.640 1.00 1.23 H new ATOM 0 HB3 ALA B 3 9.949 9.396 30.178 1.00 1.23 H new ATOM 1920 N PRO B 4 12.738 7.179 29.007 1.00 1.32 N ATOM 1921 CA PRO B 4 13.025 5.771 29.284 1.00 5.15 C ATOM 1922 C PRO B 4 12.347 5.309 30.573 1.00 50.35 C ATOM 1923 O PRO B 4 12.754 5.684 31.677 1.00 43.12 O ATOM 1924 CB PRO B 4 14.555 5.718 29.434 1.00 3.35 C ATOM 1925 CG PRO B 4 15.044 6.985 28.817 1.00 71.03 C ATOM 1926 CD PRO B 4 13.964 7.998 29.035 1.00 52.22 C ATOM 0 HA PRO B 4 12.653 5.116 28.496 1.00 5.15 H new ATOM 0 HB2 PRO B 4 14.847 5.650 30.482 1.00 3.35 H new ATOM 0 HB3 PRO B 4 14.972 4.846 28.930 1.00 3.35 H new ATOM 0 HG2 PRO B 4 15.978 7.307 29.277 1.00 71.03 H new ATOM 0 HG3 PRO B 4 15.242 6.849 27.754 1.00 71.03 H new ATOM 0 HD2 PRO B 4 14.082 8.517 29.986 1.00 52.22 H new ATOM 0 HD3 PRO B 4 13.960 8.759 28.255 1.00 52.22 H new ATOM 1934 N CYS B 5 11.286 4.553 30.421 1.00 24.31 N ATOM 1935 CA CYS B 5 10.521 4.035 31.532 1.00 75.44 C ATOM 1936 C CYS B 5 9.938 2.688 31.139 1.00 34.42 C ATOM 1937 O CYS B 5 10.118 2.245 29.993 1.00 11.33 O ATOM 1938 CB CYS B 5 9.392 5.019 31.913 1.00 34.14 C ATOM 1939 SG CYS B 5 9.972 6.660 32.425 1.00 65.45 S ATOM 0 H CYS B 5 10.924 4.276 29.509 1.00 24.31 H new ATOM 0 HA CYS B 5 11.170 3.914 32.399 1.00 75.44 H new ATOM 0 HB2 CYS B 5 8.722 5.133 31.060 1.00 34.14 H new ATOM 0 HB3 CYS B 5 8.806 4.585 32.723 1.00 34.14 H new ATOM 0 HG CYS B 5 11.271 6.691 32.392 1.00 65.45 H new ATOM 1945 N MET B 6 9.251 2.046 32.056 1.00 54.13 N ATOM 1946 CA MET B 6 8.658 0.751 31.792 1.00 41.22 C ATOM 1947 C MET B 6 7.233 0.923 31.311 1.00 31.32 C ATOM 1948 O MET B 6 6.563 1.917 31.642 1.00 2.24 O ATOM 1949 CB MET B 6 8.682 -0.140 33.048 1.00 62.31 C ATOM 1950 CG MET B 6 10.071 -0.467 33.566 1.00 4.42 C ATOM 1951 SD MET B 6 10.032 -1.507 35.045 1.00 12.22 S ATOM 1952 CE MET B 6 11.785 -1.711 35.360 1.00 23.33 C ATOM 0 H MET B 6 9.087 2.401 32.998 1.00 54.13 H new ATOM 0 HA MET B 6 9.247 0.262 31.016 1.00 41.22 H new ATOM 0 HB2 MET B 6 8.121 0.356 33.840 1.00 62.31 H new ATOM 0 HB3 MET B 6 8.163 -1.072 32.826 1.00 62.31 H new ATOM 0 HG2 MET B 6 10.637 -0.974 32.784 1.00 4.42 H new ATOM 0 HG3 MET B 6 10.599 0.460 33.791 1.00 4.42 H new ATOM 0 HE1 MET B 6 11.926 -2.332 36.245 1.00 23.33 H new ATOM 0 HE2 MET B 6 12.255 -2.191 34.502 1.00 23.33 H new ATOM 0 HE3 MET B 6 12.241 -0.735 35.525 1.00 23.33 H new ATOM 1962 N GLN B 7 6.777 -0.015 30.538 1.00 42.53 N ATOM 1963 CA GLN B 7 5.437 0.002 30.026 1.00 43.45 C ATOM 1964 C GLN B 7 4.486 -0.582 31.060 1.00 25.10 C ATOM 1965 O GLN B 7 4.787 -1.597 31.701 1.00 44.12 O ATOM 1966 CB GLN B 7 5.357 -0.784 28.701 1.00 72.43 C ATOM 1967 CG GLN B 7 3.957 -0.860 28.097 1.00 42.24 C ATOM 1968 CD GLN B 7 3.369 0.506 27.806 1.00 34.41 C ATOM 1969 OE1 GLN B 7 2.716 1.104 28.659 1.00 0.24 O ATOM 1970 NE2 GLN B 7 3.567 0.989 26.615 1.00 60.50 N ATOM 0 H GLN B 7 7.327 -0.821 30.241 1.00 42.53 H new ATOM 0 HA GLN B 7 5.144 1.032 29.824 1.00 43.45 H new ATOM 0 HB2 GLN B 7 6.027 -0.321 27.977 1.00 72.43 H new ATOM 0 HB3 GLN B 7 5.722 -1.797 28.871 1.00 72.43 H new ATOM 0 HG2 GLN B 7 3.995 -1.438 27.174 1.00 42.24 H new ATOM 0 HG3 GLN B 7 3.299 -1.395 28.782 1.00 42.24 H new ATOM 0 HE21 GLN B 7 4.115 0.462 25.935 1.00 60.50 H new ATOM 0 HE22 GLN B 7 3.174 1.895 26.360 1.00 60.50 H new ATOM 1979 N THR B 8 3.368 0.062 31.236 1.00 34.53 N ATOM 1980 CA THR B 8 2.377 -0.401 32.148 1.00 71.25 C ATOM 1981 C THR B 8 1.345 -1.225 31.377 1.00 31.33 C ATOM 1982 O THR B 8 1.012 -0.905 30.219 1.00 62.42 O ATOM 1983 CB THR B 8 1.702 0.775 32.926 1.00 43.21 C ATOM 1984 OG1 THR B 8 0.714 0.271 33.836 1.00 13.25 O ATOM 1985 CG2 THR B 8 1.056 1.776 31.982 1.00 14.13 C ATOM 0 H THR B 8 3.123 0.923 30.748 1.00 34.53 H new ATOM 0 HA THR B 8 2.855 -1.028 32.901 1.00 71.25 H new ATOM 0 HB THR B 8 2.486 1.287 33.483 1.00 43.21 H new ATOM 0 HG1 THR B 8 0.301 1.018 34.317 1.00 13.25 H new ATOM 0 HG21 THR B 8 0.598 2.578 32.560 1.00 14.13 H new ATOM 0 HG22 THR B 8 1.815 2.194 31.320 1.00 14.13 H new ATOM 0 HG23 THR B 8 0.292 1.275 31.388 1.00 14.13 H new ATOM 1993 N THR B 9 0.876 -2.273 31.990 1.00 71.43 N ATOM 1994 CA THR B 9 -0.061 -3.176 31.389 1.00 2.23 C ATOM 1995 C THR B 9 -1.425 -2.493 31.228 1.00 50.44 C ATOM 1996 O THR B 9 -2.170 -2.338 32.197 1.00 54.04 O ATOM 1997 CB THR B 9 -0.199 -4.437 32.270 1.00 65.20 C ATOM 1998 OG1 THR B 9 1.115 -4.969 32.531 1.00 44.34 O ATOM 1999 CG2 THR B 9 -1.034 -5.502 31.576 1.00 62.22 C ATOM 0 H THR B 9 1.140 -2.529 32.941 1.00 71.43 H new ATOM 0 HA THR B 9 0.301 -3.465 30.402 1.00 2.23 H new ATOM 0 HB THR B 9 -0.696 -4.159 33.200 1.00 65.20 H new ATOM 0 HG1 THR B 9 1.039 -5.769 33.091 1.00 44.34 H new ATOM 0 HG21 THR B 9 -1.114 -6.378 32.220 1.00 62.22 H new ATOM 0 HG22 THR B 9 -2.030 -5.108 31.373 1.00 62.22 H new ATOM 0 HG23 THR B 9 -0.557 -5.784 30.637 1.00 62.22 H new ATOM 2007 N HIS B 10 -1.711 -2.036 30.021 1.00 23.12 N ATOM 2008 CA HIS B 10 -2.976 -1.377 29.740 1.00 51.30 C ATOM 2009 C HIS B 10 -3.565 -1.873 28.429 1.00 4.50 C ATOM 2010 O HIS B 10 -4.765 -2.102 28.337 1.00 42.12 O ATOM 2011 CB HIS B 10 -2.838 0.182 29.744 1.00 14.54 C ATOM 2012 CG HIS B 10 -1.961 0.782 28.657 1.00 73.43 C ATOM 2013 ND1 HIS B 10 -0.612 0.995 28.801 1.00 54.31 N ATOM 2014 CD2 HIS B 10 -2.271 1.237 27.413 1.00 31.24 C ATOM 2015 CE1 HIS B 10 -0.135 1.555 27.708 1.00 52.32 C ATOM 2016 NE2 HIS B 10 -1.118 1.710 26.852 1.00 11.32 N ATOM 0 H HIS B 10 -1.085 -2.109 29.219 1.00 23.12 H new ATOM 0 HA HIS B 10 -3.664 -1.638 30.544 1.00 51.30 H new ATOM 0 HB2 HIS B 10 -3.835 0.614 29.657 1.00 14.54 H new ATOM 0 HB3 HIS B 10 -2.441 0.488 30.712 1.00 14.54 H new ATOM 0 HD2 HIS B 10 -3.248 1.226 26.953 1.00 31.24 H new ATOM 0 HE1 HIS B 10 0.894 1.839 27.544 1.00 52.32 H new ATOM 0 HE2 HIS B 10 -1.035 2.117 25.920 1.00 11.32 H new ATOM 2025 N SER B 11 -2.687 -2.049 27.425 1.00 33.20 N ATOM 2026 CA SER B 11 -3.053 -2.489 26.075 1.00 51.42 C ATOM 2027 C SER B 11 -3.924 -1.454 25.329 1.00 62.45 C ATOM 2028 O SER B 11 -4.755 -0.769 25.922 1.00 70.50 O ATOM 2029 CB SER B 11 -3.721 -3.868 26.113 1.00 41.30 C ATOM 2030 OG SER B 11 -2.841 -4.821 26.698 1.00 65.13 O ATOM 0 H SER B 11 -1.686 -1.885 27.536 1.00 33.20 H new ATOM 0 HA SER B 11 -2.128 -2.576 25.505 1.00 51.42 H new ATOM 0 HB2 SER B 11 -4.647 -3.817 26.686 1.00 41.30 H new ATOM 0 HB3 SER B 11 -3.988 -4.180 25.103 1.00 41.30 H new ATOM 0 HG SER B 11 -3.277 -5.699 26.720 1.00 65.13 H new ATOM 2036 N LYS B 12 -3.695 -1.312 24.043 1.00 24.04 N ATOM 2037 CA LYS B 12 -4.493 -0.412 23.238 1.00 45.35 C ATOM 2038 C LYS B 12 -5.836 -1.061 22.975 1.00 21.24 C ATOM 2039 O LYS B 12 -5.924 -2.045 22.234 1.00 51.30 O ATOM 2040 CB LYS B 12 -3.794 -0.095 21.909 1.00 50.12 C ATOM 2041 CG LYS B 12 -2.448 0.602 22.046 1.00 22.21 C ATOM 2042 CD LYS B 12 -1.818 0.837 20.678 1.00 33.31 C ATOM 2043 CE LYS B 12 -0.478 1.560 20.779 1.00 73.42 C ATOM 2044 NZ LYS B 12 -0.615 2.917 21.346 1.00 40.14 N ATOM 0 H LYS B 12 -2.964 -1.807 23.532 1.00 24.04 H new ATOM 0 HA LYS B 12 -4.627 0.527 23.776 1.00 45.35 H new ATOM 0 HB2 LYS B 12 -3.651 -1.025 21.359 1.00 50.12 H new ATOM 0 HB3 LYS B 12 -4.453 0.533 21.309 1.00 50.12 H new ATOM 0 HG2 LYS B 12 -2.577 1.554 22.560 1.00 22.21 H new ATOM 0 HG3 LYS B 12 -1.781 -0.003 22.659 1.00 22.21 H new ATOM 0 HD2 LYS B 12 -1.676 -0.120 20.176 1.00 33.31 H new ATOM 0 HD3 LYS B 12 -2.500 1.423 20.061 1.00 33.31 H new ATOM 0 HE2 LYS B 12 0.202 0.976 21.400 1.00 73.42 H new ATOM 0 HE3 LYS B 12 -0.028 1.626 19.789 1.00 73.42 H new ATOM 0 HZ1 LYS B 12 0.283 3.430 21.240 1.00 40.14 H new ATOM 0 HZ2 LYS B 12 -1.368 3.429 20.843 1.00 40.14 H new ATOM 0 HZ3 LYS B 12 -0.857 2.849 22.355 1.00 40.14 H new ATOM 2058 N MET B 13 -6.857 -0.559 23.601 1.00 40.41 N ATOM 2059 CA MET B 13 -8.175 -1.113 23.448 1.00 25.53 C ATOM 2060 C MET B 13 -8.793 -0.538 22.187 1.00 63.40 C ATOM 2061 O MET B 13 -9.131 0.636 22.132 1.00 71.44 O ATOM 2062 CB MET B 13 -9.022 -0.829 24.718 1.00 5.12 C ATOM 2063 CG MET B 13 -10.415 -1.484 24.772 1.00 45.42 C ATOM 2064 SD MET B 13 -11.628 -0.808 23.607 1.00 63.22 S ATOM 2065 CE MET B 13 -11.746 0.889 24.198 1.00 53.52 C ATOM 0 H MET B 13 -6.805 0.242 24.230 1.00 40.41 H new ATOM 0 HA MET B 13 -8.134 -2.197 23.341 1.00 25.53 H new ATOM 0 HB2 MET B 13 -8.455 -1.160 25.588 1.00 5.12 H new ATOM 0 HB3 MET B 13 -9.148 0.250 24.811 1.00 5.12 H new ATOM 0 HG2 MET B 13 -10.305 -2.551 24.580 1.00 45.42 H new ATOM 0 HG3 MET B 13 -10.809 -1.381 25.783 1.00 45.42 H new ATOM 0 HE1 MET B 13 -12.794 1.150 24.347 1.00 53.52 H new ATOM 0 HE2 MET B 13 -11.210 0.983 25.143 1.00 53.52 H new ATOM 0 HE3 MET B 13 -11.306 1.562 23.462 1.00 53.52 H new ATOM 2075 N THR B 14 -8.887 -1.351 21.168 1.00 33.50 N ATOM 2076 CA THR B 14 -9.419 -0.925 19.909 1.00 41.41 C ATOM 2077 C THR B 14 -10.282 -2.059 19.329 1.00 14.55 C ATOM 2078 O THR B 14 -10.508 -3.073 20.004 1.00 32.44 O ATOM 2079 CB THR B 14 -8.263 -0.517 18.928 1.00 75.43 C ATOM 2080 OG1 THR B 14 -8.792 0.037 17.708 1.00 34.22 O ATOM 2081 CG2 THR B 14 -7.361 -1.710 18.600 1.00 21.33 C ATOM 0 H THR B 14 -8.595 -2.328 21.192 1.00 33.50 H new ATOM 0 HA THR B 14 -10.042 -0.042 20.048 1.00 41.41 H new ATOM 0 HB THR B 14 -7.666 0.242 19.434 1.00 75.43 H new ATOM 0 HG1 THR B 14 -8.054 0.339 17.139 1.00 34.22 H new ATOM 0 HG21 THR B 14 -6.571 -1.393 17.919 1.00 21.33 H new ATOM 0 HG22 THR B 14 -6.916 -2.093 19.518 1.00 21.33 H new ATOM 0 HG23 THR B 14 -7.953 -2.495 18.129 1.00 21.33 H new ATOM 2089 N ALA B 15 -10.744 -1.899 18.110 1.00 24.11 N ATOM 2090 CA ALA B 15 -11.623 -2.869 17.498 1.00 44.14 C ATOM 2091 C ALA B 15 -11.117 -3.279 16.129 1.00 52.14 C ATOM 2092 O ALA B 15 -10.211 -2.631 15.568 1.00 2.54 O ATOM 2093 CB ALA B 15 -13.035 -2.315 17.400 1.00 62.12 C ATOM 0 H ALA B 15 -10.523 -1.098 17.518 1.00 24.11 H new ATOM 0 HA ALA B 15 -11.638 -3.757 18.129 1.00 44.14 H new ATOM 0 HB1 ALA B 15 -13.686 -3.057 16.937 1.00 62.12 H new ATOM 0 HB2 ALA B 15 -13.404 -2.081 18.399 1.00 62.12 H new ATOM 0 HB3 ALA B 15 -13.029 -1.409 16.794 1.00 62.12 H new ATOM 2099 N GLY B 16 -11.737 -4.327 15.580 1.00 23.04 N ATOM 2100 CA GLY B 16 -11.357 -4.891 14.289 1.00 24.33 C ATOM 2101 C GLY B 16 -11.389 -3.894 13.143 1.00 22.42 C ATOM 2102 O GLY B 16 -10.670 -4.062 12.165 1.00 60.12 O ATOM 0 H GLY B 16 -12.520 -4.808 16.023 1.00 23.04 H new ATOM 0 HA2 GLY B 16 -10.352 -5.306 14.367 1.00 24.33 H new ATOM 0 HA3 GLY B 16 -12.026 -5.719 14.055 1.00 24.33 H new ATOM 2106 N ALA B 17 -12.211 -2.856 13.288 1.00 2.40 N ATOM 2107 CA ALA B 17 -12.360 -1.790 12.286 1.00 35.11 C ATOM 2108 C ALA B 17 -11.021 -1.137 11.917 1.00 40.54 C ATOM 2109 O ALA B 17 -10.764 -0.852 10.751 1.00 13.11 O ATOM 2110 CB ALA B 17 -13.319 -0.729 12.802 1.00 52.44 C ATOM 0 H ALA B 17 -12.800 -2.726 14.111 1.00 2.40 H new ATOM 0 HA ALA B 17 -12.757 -2.252 11.382 1.00 35.11 H new ATOM 0 HB1 ALA B 17 -13.426 0.059 12.056 1.00 52.44 H new ATOM 0 HB2 ALA B 17 -14.292 -1.181 12.995 1.00 52.44 H new ATOM 0 HB3 ALA B 17 -12.927 -0.303 13.726 1.00 52.44 H new ATOM 2116 N TYR B 18 -10.181 -0.908 12.904 1.00 22.15 N ATOM 2117 CA TYR B 18 -8.898 -0.266 12.658 1.00 73.01 C ATOM 2118 C TYR B 18 -7.883 -1.256 12.121 1.00 11.05 C ATOM 2119 O TYR B 18 -7.016 -0.906 11.302 1.00 14.13 O ATOM 2120 CB TYR B 18 -8.377 0.419 13.927 1.00 61.44 C ATOM 2121 CG TYR B 18 -9.215 1.600 14.361 1.00 64.02 C ATOM 2122 CD1 TYR B 18 -10.299 1.452 15.223 1.00 52.44 C ATOM 2123 CD2 TYR B 18 -8.924 2.865 13.894 1.00 52.33 C ATOM 2124 CE1 TYR B 18 -11.060 2.543 15.599 1.00 33.10 C ATOM 2125 CE2 TYR B 18 -9.676 3.955 14.259 1.00 62.30 C ATOM 2126 CZ TYR B 18 -10.740 3.794 15.109 1.00 24.23 C ATOM 2127 OH TYR B 18 -11.497 4.898 15.463 1.00 40.44 O ATOM 0 H TYR B 18 -10.357 -1.153 13.878 1.00 22.15 H new ATOM 0 HA TYR B 18 -9.049 0.500 11.898 1.00 73.01 H new ATOM 0 HB2 TYR B 18 -8.344 -0.310 14.737 1.00 61.44 H new ATOM 0 HB3 TYR B 18 -7.353 0.753 13.756 1.00 61.44 H new ATOM 0 HD1 TYR B 18 -10.548 0.472 15.603 1.00 52.44 H new ATOM 0 HD2 TYR B 18 -8.086 3.001 13.226 1.00 52.33 H new ATOM 0 HE1 TYR B 18 -11.897 2.418 16.270 1.00 33.10 H new ATOM 0 HE2 TYR B 18 -9.430 4.935 13.878 1.00 62.30 H new ATOM 0 HH TYR B 18 -10.932 5.698 15.455 1.00 40.44 H new ATOM 2137 N THR B 19 -7.970 -2.463 12.603 1.00 53.03 N ATOM 2138 CA THR B 19 -7.107 -3.525 12.182 1.00 71.22 C ATOM 2139 C THR B 19 -7.466 -4.140 10.794 1.00 73.53 C ATOM 2140 O THR B 19 -8.328 -3.635 10.077 1.00 2.42 O ATOM 2141 CB THR B 19 -7.000 -4.583 13.288 1.00 41.40 C ATOM 2142 OG1 THR B 19 -8.310 -4.931 13.745 1.00 62.33 O ATOM 2143 CG2 THR B 19 -6.185 -4.036 14.456 1.00 41.02 C ATOM 0 H THR B 19 -8.652 -2.739 13.309 1.00 53.03 H new ATOM 0 HA THR B 19 -6.123 -3.084 12.021 1.00 71.22 H new ATOM 0 HB THR B 19 -6.504 -5.467 12.888 1.00 41.40 H new ATOM 0 HG1 THR B 19 -8.546 -4.375 14.517 1.00 62.33 H new ATOM 0 HG21 THR B 19 -6.114 -4.794 15.237 1.00 41.02 H new ATOM 0 HG22 THR B 19 -5.184 -3.776 14.111 1.00 41.02 H new ATOM 0 HG23 THR B 19 -6.674 -3.148 14.856 1.00 41.02 H new ATOM 2151 N GLU B 20 -6.767 -5.224 10.474 1.00 31.22 N ATOM 2152 CA GLU B 20 -6.744 -5.942 9.171 1.00 34.10 C ATOM 2153 C GLU B 20 -8.129 -6.532 8.647 1.00 53.30 C ATOM 2154 O GLU B 20 -8.146 -7.334 7.704 1.00 31.01 O ATOM 2155 CB GLU B 20 -5.644 -7.024 9.306 1.00 55.22 C ATOM 2156 CG GLU B 20 -4.266 -6.391 9.642 1.00 72.31 C ATOM 2157 CD GLU B 20 -3.174 -7.369 10.068 1.00 55.25 C ATOM 2158 OE1 GLU B 20 -2.516 -7.967 9.207 1.00 15.13 O ATOM 2159 OE2 GLU B 20 -2.931 -7.503 11.305 1.00 42.34 O ATOM 0 H GLU B 20 -6.152 -5.669 11.156 1.00 31.22 H new ATOM 0 HA GLU B 20 -6.529 -5.217 8.386 1.00 34.10 H new ATOM 0 HB2 GLU B 20 -5.921 -7.732 10.087 1.00 55.22 H new ATOM 0 HB3 GLU B 20 -5.570 -7.588 8.376 1.00 55.22 H new ATOM 0 HG2 GLU B 20 -3.916 -5.843 8.767 1.00 72.31 H new ATOM 0 HG3 GLU B 20 -4.407 -5.662 10.440 1.00 72.31 H new ATOM 2166 N GLY B 21 -9.246 -6.076 9.208 1.00 54.33 N ATOM 2167 CA GLY B 21 -10.583 -6.508 8.763 1.00 43.32 C ATOM 2168 C GLY B 21 -10.914 -7.961 9.085 1.00 74.44 C ATOM 2169 O GLY B 21 -10.834 -8.374 10.245 1.00 14.14 O ATOM 0 H GLY B 21 -9.259 -5.404 9.975 1.00 54.33 H new ATOM 0 HA2 GLY B 21 -11.332 -5.866 9.226 1.00 43.32 H new ATOM 0 HA3 GLY B 21 -10.659 -6.361 7.686 1.00 43.32 H new ATOM 2173 N PRO B 22 -11.328 -8.751 8.059 1.00 0.50 N ATOM 2174 CA PRO B 22 -11.699 -10.167 8.219 1.00 53.41 C ATOM 2175 C PRO B 22 -10.611 -11.037 8.918 1.00 45.53 C ATOM 2176 O PRO B 22 -10.940 -11.743 9.886 1.00 1.23 O ATOM 2177 CB PRO B 22 -12.017 -10.642 6.795 1.00 12.30 C ATOM 2178 CG PRO B 22 -12.306 -9.389 6.040 1.00 34.14 C ATOM 2179 CD PRO B 22 -11.485 -8.304 6.672 1.00 74.12 C ATOM 0 HA PRO B 22 -12.549 -10.274 8.892 1.00 53.41 H new ATOM 0 HB2 PRO B 22 -11.177 -11.183 6.360 1.00 12.30 H new ATOM 0 HB3 PRO B 22 -12.872 -11.318 6.784 1.00 12.30 H new ATOM 0 HG2 PRO B 22 -12.050 -9.504 4.987 1.00 34.14 H new ATOM 0 HG3 PRO B 22 -13.368 -9.147 6.085 1.00 34.14 H new ATOM 0 HD2 PRO B 22 -10.521 -8.191 6.176 1.00 74.12 H new ATOM 0 HD3 PRO B 22 -11.987 -7.338 6.617 1.00 74.12 H new ATOM 2187 N PRO B 23 -9.315 -11.049 8.457 1.00 44.54 N ATOM 2188 CA PRO B 23 -8.278 -11.719 9.206 1.00 52.25 C ATOM 2189 C PRO B 23 -8.021 -10.947 10.483 1.00 44.11 C ATOM 2190 O PRO B 23 -8.039 -9.709 10.492 1.00 62.12 O ATOM 2191 CB PRO B 23 -7.042 -11.666 8.295 1.00 60.12 C ATOM 2192 CG PRO B 23 -7.291 -10.521 7.387 1.00 75.34 C ATOM 2193 CD PRO B 23 -8.780 -10.445 7.211 1.00 21.31 C ATOM 0 HA PRO B 23 -8.538 -12.742 9.478 1.00 52.25 H new ATOM 0 HB2 PRO B 23 -6.130 -11.521 8.874 1.00 60.12 H new ATOM 0 HB3 PRO B 23 -6.921 -12.595 7.737 1.00 60.12 H new ATOM 0 HG2 PRO B 23 -6.901 -9.596 7.811 1.00 75.34 H new ATOM 0 HG3 PRO B 23 -6.792 -10.668 6.429 1.00 75.34 H new ATOM 0 HD2 PRO B 23 -9.116 -9.415 7.089 1.00 21.31 H new ATOM 0 HD3 PRO B 23 -9.107 -10.994 6.328 1.00 21.31 H new ATOM 2201 N GLN B 24 -7.786 -11.641 11.537 1.00 5.12 N ATOM 2202 CA GLN B 24 -7.551 -10.989 12.771 1.00 74.15 C ATOM 2203 C GLN B 24 -6.108 -10.599 12.852 1.00 53.43 C ATOM 2204 O GLN B 24 -5.241 -11.292 12.294 1.00 73.43 O ATOM 2205 CB GLN B 24 -8.000 -11.841 13.954 1.00 64.51 C ATOM 2206 CG GLN B 24 -9.504 -12.019 14.014 1.00 61.15 C ATOM 2207 CD GLN B 24 -10.248 -10.705 14.201 1.00 52.32 C ATOM 2208 OE1 GLN B 24 -9.743 -9.773 14.810 1.00 31.22 O ATOM 2209 NE2 GLN B 24 -11.438 -10.623 13.680 1.00 23.12 N ATOM 0 H GLN B 24 -7.752 -12.660 11.569 1.00 5.12 H new ATOM 0 HA GLN B 24 -8.153 -10.082 12.822 1.00 74.15 H new ATOM 0 HB2 GLN B 24 -7.525 -12.820 13.891 1.00 64.51 H new ATOM 0 HB3 GLN B 24 -7.656 -11.379 14.880 1.00 64.51 H new ATOM 0 HG2 GLN B 24 -9.845 -12.497 13.096 1.00 61.15 H new ATOM 0 HG3 GLN B 24 -9.753 -12.692 14.835 1.00 61.15 H new ATOM 0 HE21 GLN B 24 -11.831 -11.419 13.178 1.00 23.12 H new ATOM 0 HE22 GLN B 24 -11.978 -9.763 13.774 1.00 23.12 H new ATOM 2218 N PRO B 25 -5.821 -9.480 13.493 1.00 34.43 N ATOM 2219 CA PRO B 25 -4.478 -8.977 13.596 1.00 72.21 C ATOM 2220 C PRO B 25 -3.567 -9.954 14.310 1.00 30.24 C ATOM 2221 O PRO B 25 -3.907 -10.495 15.381 1.00 65.44 O ATOM 2222 CB PRO B 25 -4.617 -7.671 14.397 1.00 71.24 C ATOM 2223 CG PRO B 25 -5.943 -7.767 15.062 1.00 31.43 C ATOM 2224 CD PRO B 25 -6.795 -8.618 14.178 1.00 11.21 C ATOM 0 HA PRO B 25 -4.028 -8.822 12.616 1.00 72.21 H new ATOM 0 HB2 PRO B 25 -3.815 -7.569 15.128 1.00 71.24 H new ATOM 0 HB3 PRO B 25 -4.565 -6.800 13.744 1.00 71.24 H new ATOM 0 HG2 PRO B 25 -5.849 -8.209 16.054 1.00 31.43 H new ATOM 0 HG3 PRO B 25 -6.384 -6.779 15.193 1.00 31.43 H new ATOM 0 HD2 PRO B 25 -7.513 -9.202 14.753 1.00 11.21 H new ATOM 0 HD3 PRO B 25 -7.366 -8.017 13.471 1.00 11.21 H new ATOM 2232 N LEU B 26 -2.430 -10.208 13.712 1.00 4.31 N ATOM 2233 CA LEU B 26 -1.447 -11.062 14.312 1.00 22.40 C ATOM 2234 C LEU B 26 -0.810 -10.385 15.530 1.00 31.12 C ATOM 2235 O LEU B 26 -1.158 -9.240 15.849 1.00 33.34 O ATOM 2236 CB LEU B 26 -0.423 -11.685 13.280 1.00 4.10 C ATOM 2237 CG LEU B 26 0.372 -10.779 12.279 1.00 4.22 C ATOM 2238 CD1 LEU B 26 -0.526 -10.041 11.288 1.00 73.21 C ATOM 2239 CD2 LEU B 26 1.277 -9.818 12.999 1.00 44.54 C ATOM 0 H LEU B 26 -2.165 -9.830 12.803 1.00 4.31 H new ATOM 0 HA LEU B 26 -1.964 -11.944 14.690 1.00 22.40 H new ATOM 0 HB2 LEU B 26 0.313 -12.242 13.859 1.00 4.10 H new ATOM 0 HB3 LEU B 26 -0.975 -12.411 12.683 1.00 4.10 H new ATOM 0 HG LEU B 26 0.989 -11.459 11.692 1.00 4.22 H new ATOM 0 HD11 LEU B 26 0.088 -9.432 10.624 1.00 73.21 H new ATOM 0 HD12 LEU B 26 -1.089 -10.765 10.699 1.00 73.21 H new ATOM 0 HD13 LEU B 26 -1.218 -9.399 11.833 1.00 73.21 H new ATOM 0 HD21 LEU B 26 1.811 -9.207 12.272 1.00 44.54 H new ATOM 0 HD22 LEU B 26 0.682 -9.174 13.647 1.00 44.54 H new ATOM 0 HD23 LEU B 26 1.994 -10.375 13.601 1.00 44.54 H new ATOM 2251 N SER B 27 0.088 -11.064 16.191 1.00 25.21 N ATOM 2252 CA SER B 27 0.622 -10.594 17.453 1.00 4.32 C ATOM 2253 C SER B 27 1.268 -9.207 17.363 1.00 74.21 C ATOM 2254 O SER B 27 1.893 -8.853 16.356 1.00 12.15 O ATOM 2255 CB SER B 27 1.663 -11.554 17.919 1.00 72.34 C ATOM 2256 OG SER B 27 1.194 -12.888 17.890 1.00 2.04 O ATOM 0 H SER B 27 0.473 -11.955 15.877 1.00 25.21 H new ATOM 0 HA SER B 27 -0.218 -10.523 18.144 1.00 4.32 H new ATOM 0 HB2 SER B 27 2.548 -11.465 17.289 1.00 72.34 H new ATOM 0 HB3 SER B 27 1.967 -11.297 18.934 1.00 72.34 H new ATOM 0 HG SER B 27 1.912 -13.481 17.585 1.00 2.04 H new ATOM 2262 N ALA B 28 1.106 -8.448 18.430 1.00 54.43 N ATOM 2263 CA ALA B 28 1.739 -7.155 18.590 1.00 50.44 C ATOM 2264 C ALA B 28 3.261 -7.276 18.458 1.00 65.40 C ATOM 2265 O ALA B 28 3.889 -6.496 17.765 1.00 72.20 O ATOM 2266 CB ALA B 28 1.351 -6.532 19.922 1.00 3.23 C ATOM 0 H ALA B 28 0.522 -8.718 19.221 1.00 54.43 H new ATOM 0 HA ALA B 28 1.387 -6.497 17.795 1.00 50.44 H new ATOM 0 HB1 ALA B 28 1.836 -5.561 20.025 1.00 3.23 H new ATOM 0 HB2 ALA B 28 0.269 -6.403 19.962 1.00 3.23 H new ATOM 0 HB3 ALA B 28 1.669 -7.184 20.735 1.00 3.23 H new ATOM 2272 N GLU B 29 3.833 -8.280 19.098 1.00 35.31 N ATOM 2273 CA GLU B 29 5.280 -8.541 19.018 1.00 14.11 C ATOM 2274 C GLU B 29 5.709 -8.819 17.580 1.00 13.40 C ATOM 2275 O GLU B 29 6.696 -8.247 17.103 1.00 64.11 O ATOM 2276 CB GLU B 29 5.634 -9.685 19.932 1.00 1.41 C ATOM 2277 CG GLU B 29 5.461 -9.343 21.393 1.00 24.13 C ATOM 2278 CD GLU B 29 6.654 -8.647 21.984 1.00 72.01 C ATOM 2279 OE1 GLU B 29 7.715 -9.282 22.121 1.00 55.11 O ATOM 2280 OE2 GLU B 29 6.562 -7.442 22.297 1.00 42.33 O ATOM 0 H GLU B 29 3.323 -8.939 19.686 1.00 35.31 H new ATOM 0 HA GLU B 29 5.822 -7.653 19.345 1.00 14.11 H new ATOM 0 HB2 GLU B 29 5.010 -10.545 19.689 1.00 1.41 H new ATOM 0 HB3 GLU B 29 6.668 -9.981 19.753 1.00 1.41 H new ATOM 0 HG2 GLU B 29 4.583 -8.707 21.509 1.00 24.13 H new ATOM 0 HG3 GLU B 29 5.268 -10.258 21.953 1.00 24.13 H new ATOM 2287 N GLU B 30 4.943 -9.669 16.882 1.00 23.13 N ATOM 2288 CA GLU B 30 5.172 -9.922 15.454 1.00 52.53 C ATOM 2289 C GLU B 30 5.140 -8.626 14.672 1.00 30.42 C ATOM 2290 O GLU B 30 5.918 -8.431 13.753 1.00 61.35 O ATOM 2291 CB GLU B 30 4.136 -10.901 14.853 1.00 32.12 C ATOM 2292 CG GLU B 30 4.433 -12.392 15.016 1.00 1.32 C ATOM 2293 CD GLU B 30 4.514 -12.876 16.435 1.00 12.23 C ATOM 2294 OE1 GLU B 30 5.523 -12.679 17.065 1.00 35.40 O ATOM 2295 OE2 GLU B 30 3.568 -13.488 16.921 1.00 15.33 O ATOM 0 H GLU B 30 4.163 -10.191 17.282 1.00 23.13 H new ATOM 0 HA GLU B 30 6.157 -10.382 15.375 1.00 52.53 H new ATOM 0 HB2 GLU B 30 3.167 -10.694 15.308 1.00 32.12 H new ATOM 0 HB3 GLU B 30 4.041 -10.686 13.789 1.00 32.12 H new ATOM 0 HG2 GLU B 30 3.659 -12.959 14.499 1.00 1.32 H new ATOM 0 HG3 GLU B 30 5.377 -12.615 14.519 1.00 1.32 H new ATOM 2302 N LYS B 31 4.284 -7.721 15.099 1.00 53.52 N ATOM 2303 CA LYS B 31 4.117 -6.460 14.445 1.00 14.43 C ATOM 2304 C LYS B 31 5.296 -5.554 14.641 1.00 33.10 C ATOM 2305 O LYS B 31 5.636 -4.823 13.740 1.00 60.25 O ATOM 2306 CB LYS B 31 2.802 -5.809 14.812 1.00 44.35 C ATOM 2307 CG LYS B 31 1.637 -6.482 14.123 1.00 61.10 C ATOM 2308 CD LYS B 31 0.326 -6.174 14.760 1.00 54.30 C ATOM 2309 CE LYS B 31 -0.834 -6.847 14.036 1.00 14.33 C ATOM 2310 NZ LYS B 31 -0.786 -6.657 12.560 1.00 74.21 N ATOM 0 H LYS B 31 3.686 -7.850 15.915 1.00 53.52 H new ATOM 0 HA LYS B 31 4.074 -6.657 13.374 1.00 14.43 H new ATOM 0 HB2 LYS B 31 2.662 -5.854 15.892 1.00 44.35 H new ATOM 0 HB3 LYS B 31 2.828 -4.754 14.537 1.00 44.35 H new ATOM 0 HG2 LYS B 31 1.610 -6.169 13.079 1.00 61.10 H new ATOM 0 HG3 LYS B 31 1.793 -7.561 14.129 1.00 61.10 H new ATOM 0 HD2 LYS B 31 0.343 -6.501 15.800 1.00 54.30 H new ATOM 0 HD3 LYS B 31 0.171 -5.095 14.767 1.00 54.30 H new ATOM 0 HE2 LYS B 31 -0.825 -7.914 14.260 1.00 14.33 H new ATOM 0 HE3 LYS B 31 -1.774 -6.449 14.418 1.00 14.33 H new ATOM 0 HZ1 LYS B 31 -1.746 -6.740 12.168 1.00 74.21 H new ATOM 0 HZ2 LYS B 31 -0.404 -5.714 12.344 1.00 74.21 H new ATOM 0 HZ3 LYS B 31 -0.175 -7.384 12.136 1.00 74.21 H new ATOM 2324 N LYS B 32 5.939 -5.589 15.811 1.00 73.01 N ATOM 2325 CA LYS B 32 7.151 -4.807 15.989 1.00 65.12 C ATOM 2326 C LYS B 32 8.299 -5.371 15.168 1.00 20.55 C ATOM 2327 O LYS B 32 9.051 -4.619 14.589 1.00 63.53 O ATOM 2328 CB LYS B 32 7.602 -4.640 17.466 1.00 14.11 C ATOM 2329 CG LYS B 32 7.008 -3.458 18.298 1.00 42.22 C ATOM 2330 CD LYS B 32 5.568 -3.618 18.838 1.00 25.35 C ATOM 2331 CE LYS B 32 4.489 -3.658 17.787 1.00 53.11 C ATOM 2332 NZ LYS B 32 4.552 -2.500 16.855 1.00 74.13 N ATOM 0 H LYS B 32 5.648 -6.134 16.622 1.00 73.01 H new ATOM 0 HA LYS B 32 6.888 -3.812 15.631 1.00 65.12 H new ATOM 0 HB2 LYS B 32 7.367 -5.566 17.991 1.00 14.11 H new ATOM 0 HB3 LYS B 32 8.687 -4.537 17.472 1.00 14.11 H new ATOM 0 HG2 LYS B 32 7.668 -3.279 19.147 1.00 42.22 H new ATOM 0 HG3 LYS B 32 7.037 -2.562 17.678 1.00 42.22 H new ATOM 0 HD2 LYS B 32 5.517 -4.536 19.424 1.00 25.35 H new ATOM 0 HD3 LYS B 32 5.359 -2.793 19.519 1.00 25.35 H new ATOM 0 HE2 LYS B 32 4.577 -4.583 17.217 1.00 53.11 H new ATOM 0 HE3 LYS B 32 3.514 -3.675 18.274 1.00 53.11 H new ATOM 0 HZ1 LYS B 32 3.588 -2.169 16.647 1.00 74.13 H new ATOM 0 HZ2 LYS B 32 5.095 -1.730 17.295 1.00 74.13 H new ATOM 0 HZ3 LYS B 32 5.017 -2.791 15.971 1.00 74.13 H new ATOM 2346 N GLU B 33 8.399 -6.692 15.099 1.00 31.44 N ATOM 2347 CA GLU B 33 9.487 -7.352 14.361 1.00 50.24 C ATOM 2348 C GLU B 33 9.395 -7.055 12.866 1.00 1.32 C ATOM 2349 O GLU B 33 10.378 -6.695 12.237 1.00 72.12 O ATOM 2350 CB GLU B 33 9.454 -8.865 14.612 1.00 71.24 C ATOM 2351 CG GLU B 33 9.725 -9.260 16.058 1.00 63.10 C ATOM 2352 CD GLU B 33 11.166 -9.057 16.494 1.00 44.54 C ATOM 2353 OE1 GLU B 33 11.722 -7.985 16.298 1.00 13.43 O ATOM 2354 OE2 GLU B 33 11.766 -10.009 17.019 1.00 5.23 O ATOM 0 H GLU B 33 7.743 -7.335 15.543 1.00 31.44 H new ATOM 0 HA GLU B 33 10.436 -6.956 14.723 1.00 50.24 H new ATOM 0 HB2 GLU B 33 8.478 -9.250 14.318 1.00 71.24 H new ATOM 0 HB3 GLU B 33 10.193 -9.345 13.970 1.00 71.24 H new ATOM 0 HG2 GLU B 33 9.073 -8.679 16.711 1.00 63.10 H new ATOM 0 HG3 GLU B 33 9.459 -10.308 16.193 1.00 63.10 H new ATOM 2361 N ILE B 34 8.200 -7.180 12.328 1.00 32.31 N ATOM 2362 CA ILE B 34 7.962 -6.943 10.904 1.00 3.44 C ATOM 2363 C ILE B 34 8.075 -5.462 10.560 1.00 30.23 C ATOM 2364 O ILE B 34 8.568 -5.096 9.498 1.00 74.12 O ATOM 2365 CB ILE B 34 6.620 -7.533 10.412 1.00 31.22 C ATOM 2366 CG1 ILE B 34 5.436 -6.916 11.162 1.00 1.21 C ATOM 2367 CG2 ILE B 34 6.638 -9.042 10.570 1.00 23.21 C ATOM 2368 CD1 ILE B 34 4.093 -7.529 10.833 1.00 32.42 C ATOM 0 H ILE B 34 7.367 -7.446 12.853 1.00 32.31 H new ATOM 0 HA ILE B 34 8.748 -7.476 10.369 1.00 3.44 H new ATOM 0 HB ILE B 34 6.497 -7.290 9.357 1.00 31.22 H new ATOM 0 HG12 ILE B 34 5.612 -7.012 12.233 1.00 1.21 H new ATOM 0 HG13 ILE B 34 5.398 -5.850 10.940 1.00 1.21 H new ATOM 0 HG21 ILE B 34 5.691 -9.456 10.223 1.00 23.21 H new ATOM 0 HG22 ILE B 34 7.454 -9.460 9.981 1.00 23.21 H new ATOM 0 HG23 ILE B 34 6.781 -9.296 11.620 1.00 23.21 H new ATOM 0 HD11 ILE B 34 3.314 -7.030 11.410 1.00 32.42 H new ATOM 0 HD12 ILE B 34 3.889 -7.409 9.769 1.00 32.42 H new ATOM 0 HD13 ILE B 34 4.106 -8.590 11.083 1.00 32.42 H new ATOM 2380 N ASP B 35 7.655 -4.617 11.493 1.00 21.44 N ATOM 2381 CA ASP B 35 7.673 -3.169 11.305 1.00 32.21 C ATOM 2382 C ASP B 35 9.108 -2.695 11.331 1.00 54.41 C ATOM 2383 O ASP B 35 9.492 -1.813 10.612 1.00 62.11 O ATOM 2384 CB ASP B 35 6.903 -2.495 12.447 1.00 32.11 C ATOM 2385 CG ASP B 35 6.705 -1.014 12.263 1.00 75.10 C ATOM 2386 OD1 ASP B 35 7.577 -0.225 12.659 1.00 73.50 O ATOM 2387 OD2 ASP B 35 5.643 -0.616 11.733 1.00 73.12 O ATOM 0 H ASP B 35 7.293 -4.913 12.399 1.00 21.44 H new ATOM 0 HA ASP B 35 7.208 -2.914 10.353 1.00 32.21 H new ATOM 0 HB2 ASP B 35 5.928 -2.972 12.545 1.00 32.11 H new ATOM 0 HB3 ASP B 35 7.437 -2.666 13.382 1.00 32.11 H new ATOM 2392 N LYS B 36 9.882 -3.351 12.155 1.00 64.42 N ATOM 2393 CA LYS B 36 11.275 -3.054 12.397 1.00 41.21 C ATOM 2394 C LYS B 36 12.089 -3.240 11.109 1.00 2.12 C ATOM 2395 O LYS B 36 13.085 -2.561 10.881 1.00 63.31 O ATOM 2396 CB LYS B 36 11.752 -4.048 13.441 1.00 11.25 C ATOM 2397 CG LYS B 36 12.956 -3.667 14.213 1.00 52.52 C ATOM 2398 CD LYS B 36 13.306 -4.755 15.219 1.00 71.25 C ATOM 2399 CE LYS B 36 12.407 -4.725 16.436 1.00 74.21 C ATOM 2400 NZ LYS B 36 12.731 -5.817 17.364 1.00 42.01 N ATOM 0 H LYS B 36 9.546 -4.144 12.702 1.00 64.42 H new ATOM 0 HA LYS B 36 11.401 -2.024 12.732 1.00 41.21 H new ATOM 0 HB2 LYS B 36 10.937 -4.222 14.144 1.00 11.25 H new ATOM 0 HB3 LYS B 36 11.952 -4.997 12.943 1.00 11.25 H new ATOM 0 HG2 LYS B 36 13.794 -3.506 13.536 1.00 52.52 H new ATOM 0 HG3 LYS B 36 12.780 -2.725 14.733 1.00 52.52 H new ATOM 0 HD2 LYS B 36 13.229 -5.730 14.738 1.00 71.25 H new ATOM 0 HD3 LYS B 36 14.343 -4.636 15.533 1.00 71.25 H new ATOM 0 HE2 LYS B 36 12.513 -3.768 16.946 1.00 74.21 H new ATOM 0 HE3 LYS B 36 11.366 -4.806 16.124 1.00 74.21 H new ATOM 0 HZ1 LYS B 36 12.515 -5.521 18.337 1.00 42.01 H new ATOM 0 HZ2 LYS B 36 12.166 -6.656 17.123 1.00 42.01 H new ATOM 0 HZ3 LYS B 36 13.742 -6.048 17.289 1.00 42.01 H new ATOM 2414 N ARG B 37 11.653 -4.160 10.289 1.00 65.42 N ATOM 2415 CA ARG B 37 12.322 -4.475 9.057 1.00 14.14 C ATOM 2416 C ARG B 37 11.460 -4.144 7.835 1.00 22.50 C ATOM 2417 O ARG B 37 11.562 -4.781 6.778 1.00 73.33 O ATOM 2418 CB ARG B 37 12.813 -5.929 9.100 1.00 63.44 C ATOM 2419 CG ARG B 37 11.768 -6.940 9.521 1.00 43.12 C ATOM 2420 CD ARG B 37 12.407 -8.267 9.826 1.00 74.35 C ATOM 2421 NE ARG B 37 11.445 -9.259 10.335 1.00 54.05 N ATOM 2422 CZ ARG B 37 11.526 -9.861 11.543 1.00 22.31 C ATOM 2423 NH1 ARG B 37 12.462 -9.494 12.424 1.00 42.22 N ATOM 2424 NH2 ARG B 37 10.657 -10.808 11.869 1.00 11.12 N ATOM 0 H ARG B 37 10.815 -4.716 10.460 1.00 65.42 H new ATOM 0 HA ARG B 37 13.201 -3.840 8.948 1.00 14.14 H new ATOM 0 HB2 ARG B 37 13.185 -6.202 8.112 1.00 63.44 H new ATOM 0 HB3 ARG B 37 13.657 -5.992 9.787 1.00 63.44 H new ATOM 0 HG2 ARG B 37 11.236 -6.576 10.400 1.00 43.12 H new ATOM 0 HG3 ARG B 37 11.030 -7.060 8.728 1.00 43.12 H new ATOM 0 HD2 ARG B 37 12.878 -8.655 8.923 1.00 74.35 H new ATOM 0 HD3 ARG B 37 13.198 -8.124 10.562 1.00 74.35 H new ATOM 0 HE ARG B 37 10.661 -9.510 9.733 1.00 54.05 H new ATOM 0 HH11 ARG B 37 13.123 -8.754 12.187 1.00 42.22 H new ATOM 0 HH12 ARG B 37 12.515 -9.954 13.333 1.00 42.22 H new ATOM 0 HH21 ARG B 37 9.929 -11.081 11.209 1.00 11.12 H new ATOM 0 HH22 ARG B 37 10.717 -11.263 12.780 1.00 11.12 H new ATOM 2438 N SER B 38 10.649 -3.118 7.980 1.00 3.12 N ATOM 2439 CA SER B 38 9.857 -2.606 6.888 1.00 74.22 C ATOM 2440 C SER B 38 10.523 -1.338 6.302 1.00 61.12 C ATOM 2441 O SER B 38 11.396 -0.726 6.935 1.00 32.44 O ATOM 2442 CB SER B 38 8.444 -2.292 7.393 1.00 60.13 C ATOM 2443 OG SER B 38 7.573 -1.910 6.341 1.00 40.21 O ATOM 0 H SER B 38 10.522 -2.617 8.859 1.00 3.12 H new ATOM 0 HA SER B 38 9.793 -3.354 6.098 1.00 74.22 H new ATOM 0 HB2 SER B 38 8.038 -3.168 7.899 1.00 60.13 H new ATOM 0 HB3 SER B 38 8.493 -1.491 8.131 1.00 60.13 H new ATOM 0 HG SER B 38 6.643 -2.029 6.627 1.00 40.21 H new ATOM 2449 N VAL B 39 10.118 -0.957 5.100 1.00 13.43 N ATOM 2450 CA VAL B 39 10.629 0.231 4.431 1.00 33.13 C ATOM 2451 C VAL B 39 9.492 1.037 3.822 1.00 23.22 C ATOM 2452 O VAL B 39 8.375 0.536 3.667 1.00 13.22 O ATOM 2453 CB VAL B 39 11.673 -0.072 3.306 1.00 1.21 C ATOM 2454 CG1 VAL B 39 12.901 -0.761 3.866 1.00 42.52 C ATOM 2455 CG2 VAL B 39 11.058 -0.904 2.200 1.00 23.15 C ATOM 0 H VAL B 39 9.421 -1.467 4.557 1.00 13.43 H new ATOM 0 HA VAL B 39 11.138 0.798 5.211 1.00 33.13 H new ATOM 0 HB VAL B 39 11.983 0.884 2.883 1.00 1.21 H new ATOM 0 HG11 VAL B 39 13.607 -0.958 3.059 1.00 42.52 H new ATOM 0 HG12 VAL B 39 13.371 -0.119 4.611 1.00 42.52 H new ATOM 0 HG13 VAL B 39 12.610 -1.703 4.331 1.00 42.52 H new ATOM 0 HG21 VAL B 39 11.807 -1.099 1.432 1.00 23.15 H new ATOM 0 HG22 VAL B 39 10.704 -1.850 2.610 1.00 23.15 H new ATOM 0 HG23 VAL B 39 10.220 -0.363 1.761 1.00 23.15 H new ATOM 2465 N TYR B 40 9.790 2.258 3.490 1.00 53.21 N ATOM 2466 CA TYR B 40 8.876 3.168 2.851 1.00 4.34 C ATOM 2467 C TYR B 40 9.328 3.375 1.442 1.00 61.42 C ATOM 2468 O TYR B 40 10.480 3.724 1.218 1.00 60.02 O ATOM 2469 CB TYR B 40 8.891 4.526 3.575 1.00 40.25 C ATOM 2470 CG TYR B 40 8.220 5.660 2.810 1.00 10.35 C ATOM 2471 CD1 TYR B 40 6.887 5.900 2.940 1.00 24.21 C ATOM 2472 CD2 TYR B 40 8.965 6.492 1.972 1.00 64.05 C ATOM 2473 CE1 TYR B 40 6.279 6.927 2.273 1.00 74.41 C ATOM 2474 CE2 TYR B 40 8.395 7.530 1.291 1.00 42.05 C ATOM 2475 CZ TYR B 40 7.033 7.759 1.438 1.00 21.43 C ATOM 2476 OH TYR B 40 6.423 8.818 0.775 1.00 4.13 O ATOM 0 H TYR B 40 10.709 2.666 3.661 1.00 53.21 H new ATOM 0 HA TYR B 40 7.868 2.754 2.881 1.00 4.34 H new ATOM 0 HB2 TYR B 40 8.397 4.414 4.540 1.00 40.25 H new ATOM 0 HB3 TYR B 40 9.925 4.804 3.777 1.00 40.25 H new ATOM 0 HD1 TYR B 40 6.296 5.265 3.584 1.00 24.21 H new ATOM 0 HD2 TYR B 40 10.023 6.309 1.859 1.00 64.05 H new ATOM 0 HE1 TYR B 40 5.219 7.096 2.390 1.00 74.41 H new ATOM 0 HE2 TYR B 40 8.993 8.161 0.650 1.00 42.05 H new ATOM 0 HH TYR B 40 6.718 8.832 -0.160 1.00 4.13 H new ATOM 2486 N VAL B 41 8.461 3.140 0.507 1.00 34.43 N ATOM 2487 CA VAL B 41 8.740 3.397 -0.872 1.00 45.22 C ATOM 2488 C VAL B 41 7.802 4.470 -1.367 1.00 72.22 C ATOM 2489 O VAL B 41 6.592 4.260 -1.425 1.00 64.32 O ATOM 2490 CB VAL B 41 8.524 2.132 -1.728 1.00 35.14 C ATOM 2491 CG1 VAL B 41 8.851 2.369 -3.200 1.00 41.24 C ATOM 2492 CG2 VAL B 41 9.301 0.960 -1.169 1.00 43.12 C ATOM 0 H VAL B 41 7.530 2.761 0.681 1.00 34.43 H new ATOM 0 HA VAL B 41 9.780 3.711 -0.960 1.00 45.22 H new ATOM 0 HB VAL B 41 7.463 1.887 -1.679 1.00 35.14 H new ATOM 0 HG11 VAL B 41 8.684 1.450 -3.762 1.00 41.24 H new ATOM 0 HG12 VAL B 41 8.209 3.157 -3.593 1.00 41.24 H new ATOM 0 HG13 VAL B 41 9.894 2.669 -3.297 1.00 41.24 H new ATOM 0 HG21 VAL B 41 9.131 0.081 -1.791 1.00 43.12 H new ATOM 0 HG22 VAL B 41 10.364 1.199 -1.161 1.00 43.12 H new ATOM 0 HG23 VAL B 41 8.968 0.754 -0.152 1.00 43.12 H new ATOM 2502 N GLY B 42 8.334 5.605 -1.683 1.00 4.22 N ATOM 2503 CA GLY B 42 7.529 6.658 -2.208 1.00 45.54 C ATOM 2504 C GLY B 42 7.803 6.861 -3.671 1.00 63.54 C ATOM 2505 O GLY B 42 8.727 6.243 -4.211 1.00 21.55 O ATOM 0 H GLY B 42 9.325 5.827 -1.586 1.00 4.22 H new ATOM 0 HA2 GLY B 42 6.475 6.424 -2.060 1.00 45.54 H new ATOM 0 HA3 GLY B 42 7.730 7.581 -1.664 1.00 45.54 H new ATOM 2509 N ASN B 43 7.006 7.735 -4.298 1.00 54.52 N ATOM 2510 CA ASN B 43 7.089 8.086 -5.744 1.00 24.33 C ATOM 2511 C ASN B 43 6.399 7.055 -6.654 1.00 2.01 C ATOM 2512 O ASN B 43 6.015 7.383 -7.791 1.00 41.14 O ATOM 2513 CB ASN B 43 8.541 8.345 -6.199 1.00 40.51 C ATOM 2514 CG ASN B 43 8.671 8.724 -7.671 1.00 3.55 C ATOM 2515 OD1 ASN B 43 8.755 7.866 -8.542 1.00 50.43 O ATOM 2516 ND2 ASN B 43 8.759 9.996 -7.945 1.00 0.34 N ATOM 0 H ASN B 43 6.263 8.237 -3.812 1.00 54.52 H new ATOM 0 HA ASN B 43 6.537 9.020 -5.850 1.00 24.33 H new ATOM 0 HB2 ASN B 43 8.965 9.143 -5.590 1.00 40.51 H new ATOM 0 HB3 ASN B 43 9.135 7.451 -6.011 1.00 40.51 H new ATOM 0 HD21 ASN B 43 8.902 10.302 -8.908 1.00 0.34 H new ATOM 0 HD22 ASN B 43 8.685 10.685 -7.197 1.00 0.34 H new ATOM 2523 N VAL B 44 6.187 5.847 -6.132 1.00 12.22 N ATOM 2524 CA VAL B 44 5.599 4.739 -6.891 1.00 31.11 C ATOM 2525 C VAL B 44 4.250 5.136 -7.486 1.00 33.30 C ATOM 2526 O VAL B 44 3.312 5.494 -6.781 1.00 24.43 O ATOM 2527 CB VAL B 44 5.514 3.431 -6.031 1.00 14.43 C ATOM 2528 CG1 VAL B 44 4.724 3.635 -4.755 1.00 63.20 C ATOM 2529 CG2 VAL B 44 4.941 2.285 -6.829 1.00 15.22 C ATOM 0 H VAL B 44 6.418 5.607 -5.168 1.00 12.22 H new ATOM 0 HA VAL B 44 6.262 4.515 -7.727 1.00 31.11 H new ATOM 0 HB VAL B 44 6.536 3.178 -5.748 1.00 14.43 H new ATOM 0 HG11 VAL B 44 4.693 2.701 -4.193 1.00 63.20 H new ATOM 0 HG12 VAL B 44 5.201 4.406 -4.151 1.00 63.20 H new ATOM 0 HG13 VAL B 44 3.708 3.944 -5.001 1.00 63.20 H new ATOM 0 HG21 VAL B 44 4.896 1.393 -6.204 1.00 15.22 H new ATOM 0 HG22 VAL B 44 3.937 2.543 -7.167 1.00 15.22 H new ATOM 0 HG23 VAL B 44 5.576 2.090 -7.693 1.00 15.22 H new ATOM 2539 N ASP B 45 4.197 5.114 -8.797 1.00 61.01 N ATOM 2540 CA ASP B 45 3.037 5.575 -9.514 1.00 3.14 C ATOM 2541 C ASP B 45 1.839 4.662 -9.356 1.00 44.01 C ATOM 2542 O ASP B 45 1.964 3.461 -9.127 1.00 75.22 O ATOM 2543 CB ASP B 45 3.345 5.802 -11.009 1.00 24.13 C ATOM 2544 CG ASP B 45 2.168 6.415 -11.779 1.00 74.31 C ATOM 2545 OD1 ASP B 45 1.952 7.648 -11.686 1.00 54.03 O ATOM 2546 OD2 ASP B 45 1.431 5.677 -12.460 1.00 62.03 O ATOM 0 H ASP B 45 4.954 4.777 -9.392 1.00 61.01 H new ATOM 0 HA ASP B 45 2.773 6.531 -9.063 1.00 3.14 H new ATOM 0 HB2 ASP B 45 4.212 6.457 -11.100 1.00 24.13 H new ATOM 0 HB3 ASP B 45 3.615 4.850 -11.467 1.00 24.13 H new ATOM 2551 N TYR B 46 0.706 5.281 -9.503 1.00 63.14 N ATOM 2552 CA TYR B 46 -0.629 4.712 -9.483 1.00 73.11 C ATOM 2553 C TYR B 46 -0.716 3.483 -10.415 1.00 1.42 C ATOM 2554 O TYR B 46 -1.462 2.527 -10.152 1.00 21.01 O ATOM 2555 CB TYR B 46 -1.495 5.831 -10.026 1.00 43.13 C ATOM 2556 CG TYR B 46 -2.976 5.667 -10.028 1.00 61.04 C ATOM 2557 CD1 TYR B 46 -3.655 5.142 -11.125 1.00 51.24 C ATOM 2558 CD2 TYR B 46 -3.705 6.122 -8.960 1.00 13.11 C ATOM 2559 CE1 TYR B 46 -5.026 5.089 -11.139 1.00 14.45 C ATOM 2560 CE2 TYR B 46 -5.065 6.062 -8.949 1.00 22.35 C ATOM 2561 CZ TYR B 46 -5.731 5.547 -10.052 1.00 74.12 C ATOM 2562 OH TYR B 46 -7.095 5.524 -10.080 1.00 42.14 O ATOM 0 H TYR B 46 0.679 6.289 -9.654 1.00 63.14 H new ATOM 0 HA TYR B 46 -0.926 4.371 -8.491 1.00 73.11 H new ATOM 0 HB2 TYR B 46 -1.265 6.731 -9.455 1.00 43.13 H new ATOM 0 HB3 TYR B 46 -1.184 6.018 -11.054 1.00 43.13 H new ATOM 0 HD1 TYR B 46 -3.097 4.773 -11.973 1.00 51.24 H new ATOM 0 HD2 TYR B 46 -3.188 6.538 -8.108 1.00 13.11 H new ATOM 0 HE1 TYR B 46 -5.547 4.691 -11.997 1.00 14.45 H new ATOM 0 HE2 TYR B 46 -5.620 6.412 -8.091 1.00 22.35 H new ATOM 0 HH TYR B 46 -7.400 4.671 -10.455 1.00 42.14 H new ATOM 2572 N GLY B 47 0.050 3.519 -11.491 1.00 14.32 N ATOM 2573 CA GLY B 47 0.047 2.455 -12.445 1.00 15.22 C ATOM 2574 C GLY B 47 1.102 1.386 -12.187 1.00 51.11 C ATOM 2575 O GLY B 47 1.178 0.423 -12.943 1.00 14.40 O ATOM 0 H GLY B 47 0.683 4.287 -11.716 1.00 14.32 H new ATOM 0 HA2 GLY B 47 -0.937 1.986 -12.447 1.00 15.22 H new ATOM 0 HA3 GLY B 47 0.204 2.873 -13.440 1.00 15.22 H new ATOM 2579 N SER B 48 1.904 1.521 -11.135 1.00 72.34 N ATOM 2580 CA SER B 48 2.916 0.524 -10.863 1.00 70.14 C ATOM 2581 C SER B 48 2.263 -0.735 -10.266 1.00 34.24 C ATOM 2582 O SER B 48 1.231 -0.653 -9.576 1.00 22.21 O ATOM 2583 CB SER B 48 3.997 1.087 -9.934 1.00 4.54 C ATOM 2584 OG SER B 48 5.066 0.165 -9.743 1.00 21.05 O ATOM 0 H SER B 48 1.870 2.296 -10.473 1.00 72.34 H new ATOM 0 HA SER B 48 3.402 0.247 -11.799 1.00 70.14 H new ATOM 0 HB2 SER B 48 4.388 2.015 -10.352 1.00 4.54 H new ATOM 0 HB3 SER B 48 3.554 1.334 -8.969 1.00 4.54 H new ATOM 0 HG SER B 48 5.355 0.188 -8.807 1.00 21.05 H new ATOM 2590 N THR B 49 2.828 -1.876 -10.574 1.00 55.12 N ATOM 2591 CA THR B 49 2.325 -3.141 -10.119 1.00 0.40 C ATOM 2592 C THR B 49 3.089 -3.663 -8.885 1.00 45.42 C ATOM 2593 O THR B 49 4.240 -3.278 -8.646 1.00 74.32 O ATOM 2594 CB THR B 49 2.437 -4.145 -11.260 1.00 34.31 C ATOM 2595 OG1 THR B 49 3.787 -4.147 -11.758 1.00 20.24 O ATOM 2596 CG2 THR B 49 1.494 -3.792 -12.392 1.00 31.43 C ATOM 0 H THR B 49 3.662 -1.949 -11.156 1.00 55.12 H new ATOM 0 HA THR B 49 1.285 -3.010 -9.819 1.00 0.40 H new ATOM 0 HB THR B 49 2.169 -5.130 -10.879 1.00 34.31 H new ATOM 0 HG1 THR B 49 4.121 -5.068 -11.794 1.00 20.24 H new ATOM 0 HG21 THR B 49 1.595 -4.525 -13.192 1.00 31.43 H new ATOM 0 HG22 THR B 49 0.468 -3.795 -12.025 1.00 31.43 H new ATOM 0 HG23 THR B 49 1.740 -2.801 -12.775 1.00 31.43 H new ATOM 2604 N ALA B 50 2.445 -4.547 -8.121 1.00 34.21 N ATOM 2605 CA ALA B 50 2.997 -5.119 -6.899 1.00 71.13 C ATOM 2606 C ALA B 50 4.108 -6.131 -7.183 1.00 44.00 C ATOM 2607 O ALA B 50 5.159 -6.067 -6.554 1.00 44.23 O ATOM 2608 CB ALA B 50 1.860 -5.766 -6.097 1.00 1.32 C ATOM 0 H ALA B 50 1.510 -4.889 -8.341 1.00 34.21 H new ATOM 0 HA ALA B 50 3.453 -4.318 -6.318 1.00 71.13 H new ATOM 0 HB1 ALA B 50 2.261 -6.198 -5.180 1.00 1.32 H new ATOM 0 HB2 ALA B 50 1.115 -5.010 -5.847 1.00 1.32 H new ATOM 0 HB3 ALA B 50 1.394 -6.550 -6.694 1.00 1.32 H new ATOM 2614 N GLN B 51 3.884 -7.080 -8.126 1.00 3.30 N ATOM 2615 CA GLN B 51 4.928 -8.097 -8.402 1.00 72.51 C ATOM 2616 C GLN B 51 6.251 -7.472 -8.856 1.00 31.22 C ATOM 2617 O GLN B 51 7.328 -7.986 -8.539 1.00 3.10 O ATOM 2618 CB GLN B 51 4.502 -9.218 -9.398 1.00 41.04 C ATOM 2619 CG GLN B 51 4.555 -8.899 -10.902 1.00 5.35 C ATOM 2620 CD GLN B 51 3.508 -8.004 -11.431 1.00 42.42 C ATOM 2621 OE1 GLN B 51 3.689 -6.826 -11.473 1.00 1.33 O ATOM 2622 NE2 GLN B 51 2.410 -8.563 -11.842 1.00 73.01 N ATOM 0 H GLN B 51 3.034 -7.163 -8.683 1.00 3.30 H new ATOM 0 HA GLN B 51 5.074 -8.580 -7.436 1.00 72.51 H new ATOM 0 HB2 GLN B 51 5.136 -10.086 -9.217 1.00 41.04 H new ATOM 0 HB3 GLN B 51 3.481 -9.513 -9.154 1.00 41.04 H new ATOM 0 HG2 GLN B 51 5.525 -8.453 -11.120 1.00 5.35 H new ATOM 0 HG3 GLN B 51 4.506 -9.840 -11.450 1.00 5.35 H new ATOM 0 HE21 GLN B 51 2.301 -9.576 -11.786 1.00 73.01 H new ATOM 0 HE22 GLN B 51 1.656 -7.989 -12.221 1.00 73.01 H new ATOM 2631 N ASP B 52 6.155 -6.374 -9.594 1.00 53.20 N ATOM 2632 CA ASP B 52 7.342 -5.660 -10.074 1.00 61.33 C ATOM 2633 C ASP B 52 8.072 -5.008 -8.912 1.00 11.42 C ATOM 2634 O ASP B 52 9.299 -5.021 -8.845 1.00 24.53 O ATOM 2635 CB ASP B 52 6.971 -4.635 -11.148 1.00 21.05 C ATOM 2636 CG ASP B 52 8.165 -3.872 -11.703 1.00 23.25 C ATOM 2637 OD1 ASP B 52 9.053 -4.494 -12.345 1.00 34.45 O ATOM 2638 OD2 ASP B 52 8.228 -2.640 -11.525 1.00 75.21 O ATOM 0 H ASP B 52 5.269 -5.954 -9.876 1.00 53.20 H new ATOM 0 HA ASP B 52 8.016 -6.382 -10.535 1.00 61.33 H new ATOM 0 HB2 ASP B 52 6.465 -5.147 -11.967 1.00 21.05 H new ATOM 0 HB3 ASP B 52 6.259 -3.924 -10.729 1.00 21.05 H new ATOM 2643 N LEU B 53 7.301 -4.472 -7.979 1.00 3.22 N ATOM 2644 CA LEU B 53 7.849 -3.874 -6.766 1.00 2.02 C ATOM 2645 C LEU B 53 8.524 -4.912 -5.899 1.00 61.42 C ATOM 2646 O LEU B 53 9.663 -4.710 -5.448 1.00 20.30 O ATOM 2647 CB LEU B 53 6.733 -3.194 -5.972 1.00 33.24 C ATOM 2648 CG LEU B 53 6.239 -1.874 -6.517 1.00 10.00 C ATOM 2649 CD1 LEU B 53 4.956 -1.471 -5.806 1.00 25.31 C ATOM 2650 CD2 LEU B 53 7.308 -0.825 -6.271 1.00 73.32 C ATOM 0 H LEU B 53 6.283 -4.438 -8.038 1.00 3.22 H new ATOM 0 HA LEU B 53 8.595 -3.136 -7.062 1.00 2.02 H new ATOM 0 HB2 LEU B 53 5.887 -3.879 -5.913 1.00 33.24 H new ATOM 0 HB3 LEU B 53 7.085 -3.034 -4.953 1.00 33.24 H new ATOM 0 HG LEU B 53 6.037 -1.963 -7.584 1.00 10.00 H new ATOM 0 HD11 LEU B 53 4.604 -0.519 -6.203 1.00 25.31 H new ATOM 0 HD12 LEU B 53 4.195 -2.235 -5.967 1.00 25.31 H new ATOM 0 HD13 LEU B 53 5.148 -1.370 -4.738 1.00 25.31 H new ATOM 0 HD21 LEU B 53 6.970 0.136 -6.658 1.00 73.32 H new ATOM 0 HD22 LEU B 53 7.495 -0.740 -5.201 1.00 73.32 H new ATOM 0 HD23 LEU B 53 8.228 -1.117 -6.778 1.00 73.32 H new ATOM 2662 N GLU B 54 7.841 -6.028 -5.682 1.00 55.34 N ATOM 2663 CA GLU B 54 8.350 -7.103 -4.861 1.00 51.54 C ATOM 2664 C GLU B 54 9.636 -7.652 -5.461 1.00 4.21 C ATOM 2665 O GLU B 54 10.641 -7.705 -4.795 1.00 70.12 O ATOM 2666 CB GLU B 54 7.214 -8.158 -4.740 1.00 3.10 C ATOM 2667 CG GLU B 54 7.371 -9.293 -3.705 1.00 33.51 C ATOM 2668 CD GLU B 54 8.219 -10.475 -4.148 1.00 35.21 C ATOM 2669 OE1 GLU B 54 9.419 -10.365 -4.258 1.00 63.40 O ATOM 2670 OE2 GLU B 54 7.645 -11.555 -4.367 1.00 3.35 O ATOM 0 H GLU B 54 6.917 -6.208 -6.074 1.00 55.34 H new ATOM 0 HA GLU B 54 8.619 -6.768 -3.859 1.00 51.54 H new ATOM 0 HB2 GLU B 54 6.290 -7.626 -4.511 1.00 3.10 H new ATOM 0 HB3 GLU B 54 7.083 -8.618 -5.719 1.00 3.10 H new ATOM 0 HG2 GLU B 54 7.808 -8.875 -2.798 1.00 33.51 H new ATOM 0 HG3 GLU B 54 6.379 -9.659 -3.441 1.00 33.51 H new ATOM 2677 N ALA B 55 9.622 -7.946 -6.746 1.00 63.42 N ATOM 2678 CA ALA B 55 10.813 -8.462 -7.430 1.00 2.41 C ATOM 2679 C ALA B 55 12.004 -7.508 -7.309 1.00 63.43 C ATOM 2680 O ALA B 55 13.169 -7.921 -7.050 1.00 45.55 O ATOM 2681 CB ALA B 55 10.514 -8.724 -8.894 1.00 54.12 C ATOM 0 H ALA B 55 8.804 -7.840 -7.346 1.00 63.42 H new ATOM 0 HA ALA B 55 11.082 -9.398 -6.940 1.00 2.41 H new ATOM 0 HB1 ALA B 55 11.409 -9.106 -9.385 1.00 54.12 H new ATOM 0 HB2 ALA B 55 9.713 -9.459 -8.976 1.00 54.12 H new ATOM 0 HB3 ALA B 55 10.205 -7.795 -9.374 1.00 54.12 H new ATOM 2687 N HIS B 56 11.700 -6.231 -7.437 1.00 11.25 N ATOM 2688 CA HIS B 56 12.708 -5.192 -7.450 1.00 73.55 C ATOM 2689 C HIS B 56 13.390 -5.114 -6.086 1.00 52.52 C ATOM 2690 O HIS B 56 14.603 -4.948 -5.993 1.00 33.45 O ATOM 2691 CB HIS B 56 12.068 -3.845 -7.830 1.00 23.44 C ATOM 2692 CG HIS B 56 13.046 -2.774 -8.197 1.00 53.21 C ATOM 2693 ND1 HIS B 56 13.276 -2.402 -9.500 1.00 44.13 N ATOM 2694 CD2 HIS B 56 13.839 -1.987 -7.443 1.00 43.04 C ATOM 2695 CE1 HIS B 56 14.163 -1.440 -9.534 1.00 73.13 C ATOM 2696 NE2 HIS B 56 14.519 -1.167 -8.299 1.00 71.54 N ATOM 0 H HIS B 56 10.745 -5.886 -7.535 1.00 11.25 H new ATOM 0 HA HIS B 56 13.466 -5.430 -8.196 1.00 73.55 H new ATOM 0 HB2 HIS B 56 11.390 -4.003 -8.669 1.00 23.44 H new ATOM 0 HB3 HIS B 56 11.463 -3.496 -6.993 1.00 23.44 H new ATOM 0 HD2 HIS B 56 13.921 -2.002 -6.366 1.00 43.04 H new ATOM 0 HE1 HIS B 56 14.537 -0.955 -10.423 1.00 73.13 H new ATOM 0 HE2 HIS B 56 15.196 -0.456 -8.023 1.00 71.54 H new ATOM 2705 N PHE B 57 12.608 -5.240 -5.043 1.00 40.33 N ATOM 2706 CA PHE B 57 13.118 -5.225 -3.687 1.00 20.41 C ATOM 2707 C PHE B 57 13.657 -6.570 -3.247 1.00 23.15 C ATOM 2708 O PHE B 57 14.487 -6.657 -2.351 1.00 71.02 O ATOM 2709 CB PHE B 57 12.137 -4.632 -2.703 1.00 32.35 C ATOM 2710 CG PHE B 57 12.064 -3.152 -2.803 1.00 63.53 C ATOM 2711 CD1 PHE B 57 13.017 -2.386 -2.181 1.00 31.15 C ATOM 2712 CD2 PHE B 57 11.072 -2.525 -3.519 1.00 35.12 C ATOM 2713 CE1 PHE B 57 12.982 -1.016 -2.263 1.00 53.53 C ATOM 2714 CE2 PHE B 57 11.031 -1.157 -3.605 1.00 32.01 C ATOM 2715 CZ PHE B 57 11.981 -0.407 -2.979 1.00 20.01 C ATOM 0 H PHE B 57 11.597 -5.356 -5.106 1.00 40.33 H new ATOM 0 HA PHE B 57 13.976 -4.553 -3.695 1.00 20.41 H new ATOM 0 HB2 PHE B 57 11.148 -5.055 -2.879 1.00 32.35 H new ATOM 0 HB3 PHE B 57 12.427 -4.912 -1.690 1.00 32.35 H new ATOM 0 HD1 PHE B 57 13.805 -2.867 -1.620 1.00 31.15 H new ATOM 0 HD2 PHE B 57 10.318 -3.115 -4.018 1.00 35.12 H new ATOM 0 HE1 PHE B 57 13.736 -0.422 -1.768 1.00 53.53 H new ATOM 0 HE2 PHE B 57 10.246 -0.674 -4.169 1.00 32.01 H new ATOM 0 HZ PHE B 57 11.947 0.670 -3.046 1.00 20.01 H new ATOM 2725 N SER B 58 13.202 -7.606 -3.916 1.00 54.53 N ATOM 2726 CA SER B 58 13.544 -8.975 -3.583 1.00 11.34 C ATOM 2727 C SER B 58 15.004 -9.236 -3.879 1.00 11.33 C ATOM 2728 O SER B 58 15.624 -10.135 -3.292 1.00 52.10 O ATOM 2729 CB SER B 58 12.652 -9.974 -4.336 1.00 70.40 C ATOM 2730 OG SER B 58 12.986 -11.323 -4.004 1.00 21.54 O ATOM 0 H SER B 58 12.576 -7.523 -4.717 1.00 54.53 H new ATOM 0 HA SER B 58 13.370 -9.117 -2.516 1.00 11.34 H new ATOM 0 HB2 SER B 58 11.606 -9.786 -4.093 1.00 70.40 H new ATOM 0 HB3 SER B 58 12.761 -9.824 -5.410 1.00 70.40 H new ATOM 0 HG SER B 58 12.401 -11.936 -4.497 1.00 21.54 H new ATOM 2736 N SER B 59 15.570 -8.472 -4.786 1.00 64.33 N ATOM 2737 CA SER B 59 16.983 -8.580 -5.040 1.00 43.14 C ATOM 2738 C SER B 59 17.804 -8.180 -3.787 1.00 33.44 C ATOM 2739 O SER B 59 18.968 -8.554 -3.649 1.00 60.22 O ATOM 2740 CB SER B 59 17.347 -7.702 -6.225 1.00 31.22 C ATOM 2741 OG SER B 59 16.568 -8.053 -7.365 1.00 71.25 O ATOM 0 H SER B 59 15.079 -7.779 -5.351 1.00 64.33 H new ATOM 0 HA SER B 59 17.225 -9.617 -5.273 1.00 43.14 H new ATOM 0 HB2 SER B 59 17.182 -6.654 -5.973 1.00 31.22 H new ATOM 0 HB3 SER B 59 18.407 -7.811 -6.454 1.00 31.22 H new ATOM 0 HG SER B 59 16.813 -7.477 -8.119 1.00 71.25 H new ATOM 2747 N CYS B 60 17.183 -7.433 -2.880 1.00 0.41 N ATOM 2748 CA CYS B 60 17.837 -6.981 -1.667 1.00 1.11 C ATOM 2749 C CYS B 60 17.344 -7.757 -0.424 1.00 41.14 C ATOM 2750 O CYS B 60 17.570 -7.335 0.705 1.00 34.15 O ATOM 2751 CB CYS B 60 17.568 -5.488 -1.506 1.00 65.05 C ATOM 2752 SG CYS B 60 18.057 -4.513 -2.952 1.00 33.14 S ATOM 0 H CYS B 60 16.214 -7.127 -2.969 1.00 0.41 H new ATOM 0 HA CYS B 60 18.908 -7.168 -1.750 1.00 1.11 H new ATOM 0 HB2 CYS B 60 16.506 -5.336 -1.316 1.00 65.05 H new ATOM 0 HB3 CYS B 60 18.104 -5.121 -0.631 1.00 65.05 H new ATOM 0 HG CYS B 60 17.694 -3.276 -2.784 1.00 33.14 H new ATOM 2758 N GLY B 61 16.714 -8.899 -0.639 1.00 54.11 N ATOM 2759 CA GLY B 61 16.234 -9.685 0.486 1.00 63.35 C ATOM 2760 C GLY B 61 14.940 -10.413 0.207 1.00 3.43 C ATOM 2761 O GLY B 61 14.350 -10.266 -0.858 1.00 71.51 O ATOM 0 H GLY B 61 16.526 -9.296 -1.559 1.00 54.11 H new ATOM 0 HA2 GLY B 61 16.998 -10.412 0.763 1.00 63.35 H new ATOM 0 HA3 GLY B 61 16.094 -9.028 1.344 1.00 63.35 H new ATOM 2765 N SER B 62 14.493 -11.184 1.166 1.00 10.22 N ATOM 2766 CA SER B 62 13.291 -11.946 1.019 1.00 73.50 C ATOM 2767 C SER B 62 12.135 -11.127 1.579 1.00 73.15 C ATOM 2768 O SER B 62 12.153 -10.715 2.743 1.00 54.10 O ATOM 2769 CB SER B 62 13.429 -13.286 1.763 1.00 35.51 C ATOM 2770 OG SER B 62 12.317 -14.136 1.529 1.00 63.51 O ATOM 0 H SER B 62 14.956 -11.297 2.068 1.00 10.22 H new ATOM 0 HA SER B 62 13.103 -12.166 -0.032 1.00 73.50 H new ATOM 0 HB2 SER B 62 14.343 -13.787 1.443 1.00 35.51 H new ATOM 0 HB3 SER B 62 13.525 -13.100 2.833 1.00 35.51 H new ATOM 0 HG SER B 62 12.440 -14.978 2.016 1.00 63.51 H new ATOM 2776 N ILE B 63 11.173 -10.858 0.752 1.00 3.31 N ATOM 2777 CA ILE B 63 10.037 -10.058 1.131 1.00 53.54 C ATOM 2778 C ILE B 63 8.926 -10.896 1.752 1.00 10.32 C ATOM 2779 O ILE B 63 8.574 -11.964 1.254 1.00 41.55 O ATOM 2780 CB ILE B 63 9.512 -9.257 -0.075 1.00 4.03 C ATOM 2781 CG1 ILE B 63 10.591 -8.291 -0.543 1.00 31.22 C ATOM 2782 CG2 ILE B 63 8.237 -8.494 0.285 1.00 74.22 C ATOM 2783 CD1 ILE B 63 10.208 -7.498 -1.748 1.00 12.21 C ATOM 0 H ILE B 63 11.148 -11.187 -0.213 1.00 3.31 H new ATOM 0 HA ILE B 63 10.373 -9.358 1.895 1.00 53.54 H new ATOM 0 HB ILE B 63 9.268 -9.951 -0.879 1.00 4.03 H new ATOM 0 HG12 ILE B 63 10.830 -7.606 0.270 1.00 31.22 H new ATOM 0 HG13 ILE B 63 11.498 -8.853 -0.763 1.00 31.22 H new ATOM 0 HG21 ILE B 63 7.888 -7.937 -0.585 1.00 74.22 H new ATOM 0 HG22 ILE B 63 7.467 -9.199 0.597 1.00 74.22 H new ATOM 0 HG23 ILE B 63 8.446 -7.801 1.100 1.00 74.22 H new ATOM 0 HD11 ILE B 63 11.027 -6.833 -2.021 1.00 12.21 H new ATOM 0 HD12 ILE B 63 9.998 -8.174 -2.577 1.00 12.21 H new ATOM 0 HD13 ILE B 63 9.319 -6.907 -1.527 1.00 12.21 H new ATOM 2795 N ASN B 64 8.406 -10.406 2.852 1.00 12.11 N ATOM 2796 CA ASN B 64 7.331 -11.055 3.580 1.00 35.33 C ATOM 2797 C ASN B 64 5.979 -10.488 3.245 1.00 11.22 C ATOM 2798 O ASN B 64 5.027 -11.221 3.139 1.00 44.15 O ATOM 2799 CB ASN B 64 7.593 -11.021 5.076 1.00 54.44 C ATOM 2800 CG ASN B 64 8.576 -12.086 5.502 1.00 22.35 C ATOM 2801 OD1 ASN B 64 8.529 -13.206 5.028 1.00 41.54 O ATOM 2802 ND2 ASN B 64 9.507 -11.734 6.300 1.00 55.04 N ATOM 0 H ASN B 64 8.719 -9.533 3.276 1.00 12.11 H new ATOM 0 HA ASN B 64 7.314 -12.097 3.260 1.00 35.33 H new ATOM 0 HB2 ASN B 64 7.978 -10.040 5.355 1.00 54.44 H new ATOM 0 HB3 ASN B 64 6.654 -11.159 5.612 1.00 54.44 H new ATOM 0 HD21 ASN B 64 10.237 -12.398 6.556 1.00 55.04 H new ATOM 0 HD22 ASN B 64 9.521 -10.788 6.682 1.00 55.04 H new ATOM 2809 N ARG B 65 5.891 -9.191 3.069 1.00 70.04 N ATOM 2810 CA ARG B 65 4.612 -8.547 2.711 1.00 40.13 C ATOM 2811 C ARG B 65 4.895 -7.220 2.047 1.00 62.44 C ATOM 2812 O ARG B 65 6.005 -6.683 2.184 1.00 72.42 O ATOM 2813 CB ARG B 65 3.681 -8.283 3.937 1.00 34.31 C ATOM 2814 CG ARG B 65 3.313 -9.490 4.814 1.00 22.11 C ATOM 2815 CD ARG B 65 2.242 -9.139 5.839 1.00 43.41 C ATOM 2816 NE ARG B 65 2.663 -8.083 6.683 1.00 13.34 N ATOM 2817 CZ ARG B 65 1.952 -7.525 7.665 1.00 72.50 C ATOM 2818 NH1 ARG B 65 0.756 -8.026 8.012 1.00 5.00 N ATOM 2819 NH2 ARG B 65 2.447 -6.473 8.301 1.00 12.44 N ATOM 0 H ARG B 65 6.677 -8.547 3.163 1.00 70.04 H new ATOM 0 HA ARG B 65 4.094 -9.238 2.046 1.00 40.13 H new ATOM 0 HB2 ARG B 65 4.162 -7.539 4.572 1.00 34.31 H new ATOM 0 HB3 ARG B 65 2.756 -7.839 3.569 1.00 34.31 H new ATOM 0 HG2 ARG B 65 2.958 -10.304 4.182 1.00 22.11 H new ATOM 0 HG3 ARG B 65 4.204 -9.851 5.328 1.00 22.11 H new ATOM 0 HD2 ARG B 65 1.324 -8.853 5.325 1.00 43.41 H new ATOM 0 HD3 ARG B 65 2.010 -10.018 6.441 1.00 43.41 H new ATOM 0 HE ARG B 65 3.600 -7.713 6.525 1.00 13.34 H new ATOM 0 HH11 ARG B 65 0.383 -8.840 7.524 1.00 5.00 H new ATOM 0 HH12 ARG B 65 0.220 -7.592 8.764 1.00 5.00 H new ATOM 0 HH21 ARG B 65 3.359 -6.101 8.038 1.00 12.44 H new ATOM 0 HH22 ARG B 65 1.916 -6.036 9.054 1.00 12.44 H new ATOM 2833 N ILE B 66 3.911 -6.689 1.338 1.00 20.42 N ATOM 2834 CA ILE B 66 4.019 -5.368 0.737 1.00 12.00 C ATOM 2835 C ILE B 66 2.647 -4.738 0.753 1.00 0.13 C ATOM 2836 O ILE B 66 1.635 -5.425 0.558 1.00 45.23 O ATOM 2837 CB ILE B 66 4.614 -5.290 -0.745 1.00 65.34 C ATOM 2838 CG1 ILE B 66 3.697 -5.861 -1.806 1.00 54.41 C ATOM 2839 CG2 ILE B 66 5.968 -5.944 -0.864 1.00 22.31 C ATOM 2840 CD1 ILE B 66 4.262 -5.705 -3.217 1.00 50.44 C ATOM 0 H ILE B 66 3.022 -7.157 1.164 1.00 20.42 H new ATOM 0 HA ILE B 66 4.754 -4.837 1.342 1.00 12.00 H new ATOM 0 HB ILE B 66 4.714 -4.220 -0.928 1.00 65.34 H new ATOM 0 HG12 ILE B 66 3.525 -6.918 -1.602 1.00 54.41 H new ATOM 0 HG13 ILE B 66 2.728 -5.364 -1.749 1.00 54.41 H new ATOM 0 HG21 ILE B 66 6.323 -5.861 -1.891 1.00 22.31 H new ATOM 0 HG22 ILE B 66 6.672 -5.448 -0.196 1.00 22.31 H new ATOM 0 HG23 ILE B 66 5.889 -6.996 -0.591 1.00 22.31 H new ATOM 0 HD11 ILE B 66 3.564 -6.131 -3.938 1.00 50.44 H new ATOM 0 HD12 ILE B 66 4.408 -4.647 -3.436 1.00 50.44 H new ATOM 0 HD13 ILE B 66 5.217 -6.225 -3.286 1.00 50.44 H new ATOM 2852 N THR B 67 2.606 -3.481 1.022 1.00 34.05 N ATOM 2853 CA THR B 67 1.376 -2.743 1.059 1.00 73.23 C ATOM 2854 C THR B 67 1.521 -1.551 0.141 1.00 43.30 C ATOM 2855 O THR B 67 2.483 -0.814 0.263 1.00 25.12 O ATOM 2856 CB THR B 67 1.045 -2.299 2.503 1.00 75.43 C ATOM 2857 OG1 THR B 67 0.991 -3.443 3.358 1.00 55.55 O ATOM 2858 CG2 THR B 67 -0.284 -1.559 2.562 1.00 31.00 C ATOM 0 H THR B 67 3.433 -2.921 1.227 1.00 34.05 H new ATOM 0 HA THR B 67 0.550 -3.370 0.723 1.00 73.23 H new ATOM 0 HB THR B 67 1.830 -1.621 2.837 1.00 75.43 H new ATOM 0 HG1 THR B 67 0.783 -3.158 4.272 1.00 55.55 H new ATOM 0 HG21 THR B 67 -0.489 -1.260 3.590 1.00 31.00 H new ATOM 0 HG22 THR B 67 -0.235 -0.673 1.929 1.00 31.00 H new ATOM 0 HG23 THR B 67 -1.081 -2.214 2.209 1.00 31.00 H new ATOM 2866 N ILE B 68 0.598 -1.361 -0.767 1.00 70.11 N ATOM 2867 CA ILE B 68 0.699 -0.283 -1.722 1.00 62.24 C ATOM 2868 C ILE B 68 -0.564 0.522 -1.596 1.00 72.05 C ATOM 2869 O ILE B 68 -1.647 -0.028 -1.718 1.00 30.31 O ATOM 2870 CB ILE B 68 0.798 -0.765 -3.226 1.00 14.34 C ATOM 2871 CG1 ILE B 68 1.752 -1.958 -3.430 1.00 63.02 C ATOM 2872 CG2 ILE B 68 1.226 0.383 -4.135 1.00 11.25 C ATOM 2873 CD1 ILE B 68 1.145 -3.293 -3.049 1.00 62.41 C ATOM 0 H ILE B 68 -0.236 -1.940 -0.867 1.00 70.11 H new ATOM 0 HA ILE B 68 1.611 0.272 -1.501 1.00 62.24 H new ATOM 0 HB ILE B 68 -0.203 -1.104 -3.492 1.00 14.34 H new ATOM 0 HG12 ILE B 68 2.058 -1.993 -4.476 1.00 63.02 H new ATOM 0 HG13 ILE B 68 2.654 -1.797 -2.839 1.00 63.02 H new ATOM 0 HG21 ILE B 68 1.288 0.029 -5.164 1.00 11.25 H new ATOM 0 HG22 ILE B 68 0.495 1.189 -4.072 1.00 11.25 H new ATOM 0 HG23 ILE B 68 2.202 0.752 -3.820 1.00 11.25 H new ATOM 0 HD11 ILE B 68 1.874 -4.086 -3.219 1.00 62.41 H new ATOM 0 HD12 ILE B 68 0.864 -3.278 -1.996 1.00 62.41 H new ATOM 0 HD13 ILE B 68 0.260 -3.477 -3.658 1.00 62.41 H new ATOM 2885 N LEU B 69 -0.450 1.769 -1.296 1.00 42.13 N ATOM 2886 CA LEU B 69 -1.620 2.607 -1.196 1.00 2.12 C ATOM 2887 C LEU B 69 -1.545 3.773 -2.159 1.00 64.41 C ATOM 2888 O LEU B 69 -0.492 4.407 -2.302 1.00 2.31 O ATOM 2889 CB LEU B 69 -1.958 3.069 0.252 1.00 71.34 C ATOM 2890 CG LEU B 69 -0.885 3.846 1.031 1.00 64.53 C ATOM 2891 CD1 LEU B 69 -1.530 4.478 2.260 1.00 70.41 C ATOM 2892 CD2 LEU B 69 0.194 2.880 1.512 1.00 42.54 C ATOM 0 H LEU B 69 0.435 2.242 -1.114 1.00 42.13 H new ATOM 0 HA LEU B 69 -2.458 1.974 -1.489 1.00 2.12 H new ATOM 0 HB2 LEU B 69 -2.852 3.691 0.204 1.00 71.34 H new ATOM 0 HB3 LEU B 69 -2.217 2.184 0.833 1.00 71.34 H new ATOM 0 HG LEU B 69 -0.449 4.608 0.385 1.00 64.53 H new ATOM 0 HD11 LEU B 69 -0.778 5.032 2.821 1.00 70.41 H new ATOM 0 HD12 LEU B 69 -2.323 5.157 1.946 1.00 70.41 H new ATOM 0 HD13 LEU B 69 -1.951 3.696 2.892 1.00 70.41 H new ATOM 0 HD21 LEU B 69 0.955 3.431 2.065 1.00 42.54 H new ATOM 0 HD22 LEU B 69 -0.254 2.129 2.162 1.00 42.54 H new ATOM 0 HD23 LEU B 69 0.653 2.390 0.653 1.00 42.54 H new ATOM 2904 N CYS B 70 -2.628 4.033 -2.833 1.00 22.31 N ATOM 2905 CA CYS B 70 -2.729 5.154 -3.733 1.00 74.40 C ATOM 2906 C CYS B 70 -3.804 6.094 -3.203 1.00 15.44 C ATOM 2907 O CYS B 70 -4.961 5.671 -3.014 1.00 21.33 O ATOM 2908 CB CYS B 70 -3.089 4.658 -5.138 1.00 41.35 C ATOM 2909 SG CYS B 70 -1.898 3.487 -5.832 1.00 12.11 S ATOM 0 H CYS B 70 -3.476 3.469 -2.775 1.00 22.31 H new ATOM 0 HA CYS B 70 -1.778 5.683 -3.794 1.00 74.40 H new ATOM 0 HB2 CYS B 70 -4.071 4.185 -5.105 1.00 41.35 H new ATOM 0 HB3 CYS B 70 -3.171 5.516 -5.805 1.00 41.35 H new ATOM 0 HG CYS B 70 -2.288 3.123 -7.018 1.00 12.11 H new ATOM 2915 N ASP B 71 -3.458 7.349 -2.931 1.00 43.11 N ATOM 2916 CA ASP B 71 -4.449 8.254 -2.366 1.00 41.22 C ATOM 2917 C ASP B 71 -4.835 9.338 -3.335 1.00 20.24 C ATOM 2918 O ASP B 71 -3.990 10.002 -3.896 1.00 43.44 O ATOM 2919 CB ASP B 71 -4.023 8.852 -1.008 1.00 61.55 C ATOM 2920 CG ASP B 71 -2.901 9.872 -1.066 1.00 71.33 C ATOM 2921 OD1 ASP B 71 -3.193 11.069 -1.235 1.00 52.03 O ATOM 2922 OD2 ASP B 71 -1.736 9.504 -0.904 1.00 52.33 O ATOM 0 H ASP B 71 -2.533 7.751 -3.086 1.00 43.11 H new ATOM 0 HA ASP B 71 -5.330 7.642 -2.174 1.00 41.22 H new ATOM 0 HB2 ASP B 71 -4.893 9.321 -0.548 1.00 61.55 H new ATOM 0 HB3 ASP B 71 -3.716 8.037 -0.352 1.00 61.55 H new ATOM 2927 N LYS B 72 -6.123 9.492 -3.537 1.00 43.41 N ATOM 2928 CA LYS B 72 -6.657 10.467 -4.463 1.00 73.50 C ATOM 2929 C LYS B 72 -7.609 11.432 -3.712 1.00 41.33 C ATOM 2930 O LYS B 72 -8.259 12.271 -4.332 1.00 71.23 O ATOM 2931 CB LYS B 72 -7.482 9.726 -5.545 1.00 45.10 C ATOM 2932 CG LYS B 72 -7.886 10.584 -6.736 1.00 2.43 C ATOM 2933 CD LYS B 72 -9.060 9.997 -7.516 1.00 70.11 C ATOM 2934 CE LYS B 72 -8.794 8.607 -8.073 1.00 52.30 C ATOM 2935 NZ LYS B 72 -9.965 8.113 -8.843 1.00 62.41 N ATOM 0 H LYS B 72 -6.836 8.940 -3.060 1.00 43.41 H new ATOM 0 HA LYS B 72 -5.836 11.026 -4.913 1.00 73.50 H new ATOM 0 HB2 LYS B 72 -6.902 8.877 -5.906 1.00 45.10 H new ATOM 0 HB3 LYS B 72 -8.383 9.323 -5.083 1.00 45.10 H new ATOM 0 HG2 LYS B 72 -8.151 11.582 -6.386 1.00 2.43 H new ATOM 0 HG3 LYS B 72 -7.032 10.696 -7.404 1.00 2.43 H new ATOM 0 HD2 LYS B 72 -9.933 9.956 -6.864 1.00 70.11 H new ATOM 0 HD3 LYS B 72 -9.308 10.667 -8.339 1.00 70.11 H new ATOM 0 HE2 LYS B 72 -7.914 8.630 -8.716 1.00 52.30 H new ATOM 0 HE3 LYS B 72 -8.574 7.919 -7.256 1.00 52.30 H new ATOM 0 HZ1 LYS B 72 -10.029 7.079 -8.752 1.00 62.41 H new ATOM 0 HZ2 LYS B 72 -10.833 8.548 -8.471 1.00 62.41 H new ATOM 0 HZ3 LYS B 72 -9.853 8.366 -9.846 1.00 62.41 H new ATOM 2949 N PHE B 73 -7.710 11.303 -2.368 1.00 44.52 N ATOM 2950 CA PHE B 73 -8.675 12.134 -1.595 1.00 64.44 C ATOM 2951 C PHE B 73 -8.450 13.654 -1.730 1.00 45.54 C ATOM 2952 O PHE B 73 -9.342 14.443 -1.406 1.00 35.11 O ATOM 2953 CB PHE B 73 -8.766 11.721 -0.104 1.00 45.44 C ATOM 2954 CG PHE B 73 -7.547 12.001 0.740 1.00 13.03 C ATOM 2955 CD1 PHE B 73 -6.441 11.192 0.669 1.00 41.11 C ATOM 2956 CD2 PHE B 73 -7.535 13.068 1.629 1.00 20.30 C ATOM 2957 CE1 PHE B 73 -5.337 11.431 1.461 1.00 63.14 C ATOM 2958 CE2 PHE B 73 -6.432 13.312 2.421 1.00 35.04 C ATOM 2959 CZ PHE B 73 -5.333 12.492 2.337 1.00 71.03 C ATOM 0 H PHE B 73 -7.157 10.655 -1.807 1.00 44.52 H new ATOM 0 HA PHE B 73 -9.638 11.923 -2.061 1.00 64.44 H new ATOM 0 HB2 PHE B 73 -9.617 12.235 0.343 1.00 45.44 H new ATOM 0 HB3 PHE B 73 -8.978 10.653 -0.057 1.00 45.44 H new ATOM 0 HD1 PHE B 73 -6.435 10.357 -0.016 1.00 41.11 H new ATOM 0 HD2 PHE B 73 -8.398 13.713 1.701 1.00 20.30 H new ATOM 0 HE1 PHE B 73 -4.475 10.784 1.393 1.00 63.14 H new ATOM 0 HE2 PHE B 73 -6.433 14.147 3.106 1.00 35.04 H new ATOM 0 HZ PHE B 73 -4.469 12.680 2.957 1.00 71.03 H new ATOM 2969 N SER B 74 -7.282 14.056 -2.196 1.00 5.13 N ATOM 2970 CA SER B 74 -6.981 15.455 -2.394 1.00 13.11 C ATOM 2971 C SER B 74 -7.208 15.877 -3.857 1.00 63.24 C ATOM 2972 O SER B 74 -6.946 17.030 -4.235 1.00 4.03 O ATOM 2973 CB SER B 74 -5.538 15.712 -1.988 1.00 62.05 C ATOM 2974 OG SER B 74 -4.668 14.818 -2.673 1.00 71.24 O ATOM 0 H SER B 74 -6.522 13.423 -2.446 1.00 5.13 H new ATOM 0 HA SER B 74 -7.653 16.050 -1.775 1.00 13.11 H new ATOM 0 HB2 SER B 74 -5.266 16.742 -2.217 1.00 62.05 H new ATOM 0 HB3 SER B 74 -5.427 15.585 -0.911 1.00 62.05 H new ATOM 0 HG SER B 74 -3.742 14.994 -2.405 1.00 71.24 H new ATOM 2980 N GLY B 75 -7.711 14.956 -4.669 1.00 75.33 N ATOM 2981 CA GLY B 75 -7.921 15.226 -6.072 1.00 54.34 C ATOM 2982 C GLY B 75 -6.988 14.410 -6.942 1.00 32.22 C ATOM 2983 O GLY B 75 -7.425 13.617 -7.761 1.00 15.23 O ATOM 0 H GLY B 75 -7.979 14.017 -4.373 1.00 75.33 H new ATOM 0 HA2 GLY B 75 -8.955 15.002 -6.336 1.00 54.34 H new ATOM 0 HA3 GLY B 75 -7.766 16.287 -6.266 1.00 54.34 H new ATOM 2987 N HIS B 76 -5.713 14.603 -6.755 1.00 52.22 N ATOM 2988 CA HIS B 76 -4.721 13.866 -7.521 1.00 2.12 C ATOM 2989 C HIS B 76 -4.208 12.665 -6.772 1.00 30.23 C ATOM 2990 O HIS B 76 -3.821 12.771 -5.612 1.00 1.34 O ATOM 2991 CB HIS B 76 -3.604 14.745 -8.086 1.00 32.34 C ATOM 2992 CG HIS B 76 -4.065 15.581 -9.241 1.00 72.10 C ATOM 2993 ND1 HIS B 76 -4.379 16.910 -9.138 1.00 3.54 N ATOM 2994 CD2 HIS B 76 -4.274 15.248 -10.541 1.00 65.34 C ATOM 2995 CE1 HIS B 76 -4.763 17.363 -10.315 1.00 40.24 C ATOM 2996 NE2 HIS B 76 -4.704 16.373 -11.182 1.00 5.41 N ATOM 0 H HIS B 76 -5.326 15.263 -6.080 1.00 52.22 H new ATOM 0 HA HIS B 76 -5.242 13.485 -8.399 1.00 2.12 H new ATOM 0 HB2 HIS B 76 -3.224 15.396 -7.299 1.00 32.34 H new ATOM 0 HB3 HIS B 76 -2.775 14.114 -8.406 1.00 32.34 H new ATOM 0 HD2 HIS B 76 -4.127 14.274 -10.985 1.00 65.34 H new ATOM 0 HE1 HIS B 76 -5.073 18.374 -10.532 1.00 40.24 H new ATOM 0 HE2 HIS B 76 -4.941 16.437 -12.172 1.00 5.41 H new ATOM 3005 N PRO B 77 -4.221 11.499 -7.417 1.00 55.05 N ATOM 3006 CA PRO B 77 -3.806 10.256 -6.792 1.00 41.14 C ATOM 3007 C PRO B 77 -2.282 10.080 -6.706 1.00 23.02 C ATOM 3008 O PRO B 77 -1.569 10.200 -7.710 1.00 34.45 O ATOM 3009 CB PRO B 77 -4.436 9.205 -7.685 1.00 21.51 C ATOM 3010 CG PRO B 77 -4.463 9.823 -9.039 1.00 55.05 C ATOM 3011 CD PRO B 77 -4.661 11.295 -8.818 1.00 71.43 C ATOM 0 HA PRO B 77 -4.120 10.204 -5.750 1.00 41.14 H new ATOM 0 HB2 PRO B 77 -3.854 8.283 -7.682 1.00 21.51 H new ATOM 0 HB3 PRO B 77 -5.440 8.949 -7.347 1.00 21.51 H new ATOM 0 HG2 PRO B 77 -3.533 9.630 -9.574 1.00 55.05 H new ATOM 0 HG3 PRO B 77 -5.270 9.407 -9.642 1.00 55.05 H new ATOM 0 HD2 PRO B 77 -4.069 11.888 -9.515 1.00 71.43 H new ATOM 0 HD3 PRO B 77 -5.702 11.585 -8.958 1.00 71.43 H new ATOM 3019 N LYS B 78 -1.803 9.819 -5.503 1.00 4.02 N ATOM 3020 CA LYS B 78 -0.381 9.595 -5.225 1.00 31.55 C ATOM 3021 C LYS B 78 -0.152 8.149 -4.881 1.00 52.42 C ATOM 3022 O LYS B 78 -1.098 7.436 -4.589 1.00 73.12 O ATOM 3023 CB LYS B 78 0.088 10.421 -4.026 1.00 12.20 C ATOM 3024 CG LYS B 78 -0.185 11.896 -4.126 1.00 30.31 C ATOM 3025 CD LYS B 78 0.649 12.697 -3.121 1.00 73.43 C ATOM 3026 CE LYS B 78 0.452 12.254 -1.675 1.00 4.32 C ATOM 3027 NZ LYS B 78 -0.927 12.435 -1.197 1.00 1.13 N ATOM 0 H LYS B 78 -2.394 9.754 -4.674 1.00 4.02 H new ATOM 0 HA LYS B 78 0.173 9.886 -6.117 1.00 31.55 H new ATOM 0 HB2 LYS B 78 -0.396 10.037 -3.128 1.00 12.20 H new ATOM 0 HB3 LYS B 78 1.160 10.273 -3.899 1.00 12.20 H new ATOM 0 HG2 LYS B 78 0.036 12.239 -5.137 1.00 30.31 H new ATOM 0 HG3 LYS B 78 -1.244 12.083 -3.950 1.00 30.31 H new ATOM 0 HD2 LYS B 78 1.704 12.604 -3.380 1.00 73.43 H new ATOM 0 HD3 LYS B 78 0.392 13.753 -3.207 1.00 73.43 H new ATOM 0 HE2 LYS B 78 0.727 11.203 -1.583 1.00 4.32 H new ATOM 0 HE3 LYS B 78 1.129 12.818 -1.033 1.00 4.32 H new ATOM 0 HZ1 LYS B 78 -0.989 12.148 -0.199 1.00 1.13 H new ATOM 0 HZ2 LYS B 78 -1.197 13.435 -1.287 1.00 1.13 H new ATOM 0 HZ3 LYS B 78 -1.571 11.850 -1.766 1.00 1.13 H new ATOM 3041 N GLY B 79 1.093 7.729 -4.900 1.00 42.24 N ATOM 3042 CA GLY B 79 1.395 6.371 -4.554 1.00 31.32 C ATOM 3043 C GLY B 79 2.566 6.228 -3.603 1.00 21.10 C ATOM 3044 O GLY B 79 3.607 6.886 -3.759 1.00 71.02 O ATOM 0 H GLY B 79 1.898 8.304 -5.149 1.00 42.24 H new ATOM 0 HA2 GLY B 79 0.514 5.917 -4.101 1.00 31.32 H new ATOM 0 HA3 GLY B 79 1.609 5.813 -5.465 1.00 31.32 H new ATOM 3048 N TYR B 80 2.377 5.377 -2.619 1.00 62.15 N ATOM 3049 CA TYR B 80 3.391 4.980 -1.665 1.00 22.43 C ATOM 3050 C TYR B 80 3.177 3.581 -1.163 1.00 43.33 C ATOM 3051 O TYR B 80 2.042 3.127 -1.026 1.00 54.33 O ATOM 3052 CB TYR B 80 3.837 6.047 -0.581 1.00 23.11 C ATOM 3053 CG TYR B 80 2.776 6.942 0.086 1.00 4.10 C ATOM 3054 CD1 TYR B 80 2.079 7.840 -0.683 1.00 72.44 C ATOM 3055 CD2 TYR B 80 2.539 6.949 1.492 1.00 2.31 C ATOM 3056 CE1 TYR B 80 1.181 8.702 -0.149 1.00 11.02 C ATOM 3057 CE2 TYR B 80 1.608 7.859 2.062 1.00 43.24 C ATOM 3058 CZ TYR B 80 0.941 8.727 1.190 1.00 54.42 C ATOM 3059 OH TYR B 80 0.042 9.628 1.654 1.00 63.31 O ATOM 0 H TYR B 80 1.478 4.924 -2.454 1.00 62.15 H new ATOM 0 HA TYR B 80 4.309 4.954 -2.252 1.00 22.43 H new ATOM 0 HB2 TYR B 80 4.355 5.509 0.213 1.00 23.11 H new ATOM 0 HB3 TYR B 80 4.569 6.704 -1.051 1.00 23.11 H new ATOM 0 HD1 TYR B 80 2.252 7.860 -1.749 1.00 72.44 H new ATOM 0 HD2 TYR B 80 3.071 6.258 2.129 1.00 2.31 H new ATOM 0 HE1 TYR B 80 0.647 9.381 -0.797 1.00 11.02 H new ATOM 0 HE2 TYR B 80 1.423 7.880 3.126 1.00 43.24 H new ATOM 0 HH TYR B 80 -0.659 9.766 0.983 1.00 63.31 H new ATOM 3069 N ALA B 81 4.252 2.882 -0.941 1.00 50.03 N ATOM 3070 CA ALA B 81 4.196 1.486 -0.610 1.00 2.12 C ATOM 3071 C ALA B 81 5.152 1.171 0.501 1.00 42.53 C ATOM 3072 O ALA B 81 6.118 1.886 0.713 1.00 3.31 O ATOM 3073 CB ALA B 81 4.537 0.648 -1.836 1.00 4.03 C ATOM 0 H ALA B 81 5.196 3.265 -0.984 1.00 50.03 H new ATOM 0 HA ALA B 81 3.185 1.248 -0.280 1.00 2.12 H new ATOM 0 HB1 ALA B 81 4.493 -0.410 -1.577 1.00 4.03 H new ATOM 0 HB2 ALA B 81 3.821 0.858 -2.631 1.00 4.03 H new ATOM 0 HB3 ALA B 81 5.542 0.896 -2.178 1.00 4.03 H new ATOM 3079 N TYR B 82 4.870 0.130 1.228 1.00 54.50 N ATOM 3080 CA TYR B 82 5.730 -0.314 2.291 1.00 3.34 C ATOM 3081 C TYR B 82 6.119 -1.730 2.009 1.00 70.23 C ATOM 3082 O TYR B 82 5.253 -2.574 1.757 1.00 45.51 O ATOM 3083 CB TYR B 82 4.999 -0.257 3.623 1.00 43.52 C ATOM 3084 CG TYR B 82 4.291 1.026 3.848 1.00 45.23 C ATOM 3085 CD1 TYR B 82 4.977 2.231 3.958 1.00 24.13 C ATOM 3086 CD2 TYR B 82 2.925 1.038 3.914 1.00 1.51 C ATOM 3087 CE1 TYR B 82 4.291 3.407 4.137 1.00 11.34 C ATOM 3088 CE2 TYR B 82 2.244 2.187 4.084 1.00 3.52 C ATOM 3089 CZ TYR B 82 2.909 3.361 4.196 1.00 24.12 C ATOM 3090 OH TYR B 82 2.194 4.484 4.353 1.00 71.13 O ATOM 0 H TYR B 82 4.033 -0.439 1.101 1.00 54.50 H new ATOM 0 HA TYR B 82 6.608 0.330 2.347 1.00 3.34 H new ATOM 0 HB2 TYR B 82 4.279 -1.074 3.670 1.00 43.52 H new ATOM 0 HB3 TYR B 82 5.715 -0.416 4.430 1.00 43.52 H new ATOM 0 HD1 TYR B 82 6.056 2.242 3.902 1.00 24.13 H new ATOM 0 HD2 TYR B 82 2.382 0.108 3.828 1.00 1.51 H new ATOM 0 HE1 TYR B 82 4.817 4.345 4.230 1.00 11.34 H new ATOM 0 HE2 TYR B 82 1.165 2.172 4.131 1.00 3.52 H new ATOM 0 HH TYR B 82 1.239 4.264 4.372 1.00 71.13 H new ATOM 3100 N ILE B 83 7.387 -1.999 2.007 1.00 43.24 N ATOM 3101 CA ILE B 83 7.874 -3.327 1.730 1.00 73.12 C ATOM 3102 C ILE B 83 8.433 -3.901 3.044 1.00 5.35 C ATOM 3103 O ILE B 83 9.228 -3.245 3.710 1.00 23.10 O ATOM 3104 CB ILE B 83 9.024 -3.266 0.670 1.00 72.43 C ATOM 3105 CG1 ILE B 83 8.636 -2.402 -0.552 1.00 63.13 C ATOM 3106 CG2 ILE B 83 9.420 -4.650 0.212 1.00 25.52 C ATOM 3107 CD1 ILE B 83 7.428 -2.867 -1.333 1.00 10.34 C ATOM 0 H ILE B 83 8.117 -1.312 2.196 1.00 43.24 H new ATOM 0 HA ILE B 83 7.069 -3.949 1.339 1.00 73.12 H new ATOM 0 HB ILE B 83 9.877 -2.799 1.161 1.00 72.43 H new ATOM 0 HG12 ILE B 83 8.453 -1.384 -0.209 1.00 63.13 H new ATOM 0 HG13 ILE B 83 9.489 -2.362 -1.229 1.00 63.13 H new ATOM 0 HG21 ILE B 83 10.221 -4.575 -0.524 1.00 25.52 H new ATOM 0 HG22 ILE B 83 9.766 -5.231 1.067 1.00 25.52 H new ATOM 0 HG23 ILE B 83 8.559 -5.145 -0.238 1.00 25.52 H new ATOM 0 HD11 ILE B 83 7.249 -2.187 -2.166 1.00 10.34 H new ATOM 0 HD12 ILE B 83 7.607 -3.871 -1.717 1.00 10.34 H new ATOM 0 HD13 ILE B 83 6.555 -2.878 -0.680 1.00 10.34 H new ATOM 3119 N GLU B 84 7.991 -5.076 3.433 1.00 33.02 N ATOM 3120 CA GLU B 84 8.465 -5.706 4.666 1.00 32.25 C ATOM 3121 C GLU B 84 9.375 -6.881 4.343 1.00 13.43 C ATOM 3122 O GLU B 84 8.960 -7.831 3.659 1.00 31.53 O ATOM 3123 CB GLU B 84 7.277 -6.175 5.495 1.00 55.25 C ATOM 3124 CG GLU B 84 6.335 -5.054 5.890 1.00 73.11 C ATOM 3125 CD GLU B 84 5.112 -5.554 6.595 1.00 61.21 C ATOM 3126 OE1 GLU B 84 4.217 -6.033 5.927 1.00 70.41 O ATOM 3127 OE2 GLU B 84 5.033 -5.474 7.835 1.00 1.35 O ATOM 0 H GLU B 84 7.302 -5.624 2.918 1.00 33.02 H new ATOM 0 HA GLU B 84 9.034 -4.975 5.240 1.00 32.25 H new ATOM 0 HB2 GLU B 84 6.722 -6.923 4.929 1.00 55.25 H new ATOM 0 HB3 GLU B 84 7.644 -6.665 6.397 1.00 55.25 H new ATOM 0 HG2 GLU B 84 6.862 -4.352 6.537 1.00 73.11 H new ATOM 0 HG3 GLU B 84 6.037 -4.503 4.998 1.00 73.11 H new ATOM 3134 N PHE B 85 10.598 -6.825 4.825 1.00 73.05 N ATOM 3135 CA PHE B 85 11.576 -7.862 4.544 1.00 11.15 C ATOM 3136 C PHE B 85 11.685 -8.860 5.675 1.00 24.14 C ATOM 3137 O PHE B 85 11.233 -8.610 6.791 1.00 32.04 O ATOM 3138 CB PHE B 85 12.948 -7.260 4.285 1.00 62.41 C ATOM 3139 CG PHE B 85 13.028 -6.372 3.083 1.00 73.25 C ATOM 3140 CD1 PHE B 85 13.323 -6.901 1.838 1.00 63.11 C ATOM 3141 CD2 PHE B 85 12.830 -5.012 3.200 1.00 74.42 C ATOM 3142 CE1 PHE B 85 13.411 -6.085 0.734 1.00 43.11 C ATOM 3143 CE2 PHE B 85 12.921 -4.192 2.100 1.00 54.32 C ATOM 3144 CZ PHE B 85 13.211 -4.727 0.865 1.00 44.11 C ATOM 0 H PHE B 85 10.943 -6.069 5.417 1.00 73.05 H new ATOM 0 HA PHE B 85 11.227 -8.382 3.652 1.00 11.15 H new ATOM 0 HB2 PHE B 85 13.250 -6.688 5.162 1.00 62.41 H new ATOM 0 HB3 PHE B 85 13.668 -8.070 4.169 1.00 62.41 H new ATOM 0 HD1 PHE B 85 13.485 -7.964 1.733 1.00 63.11 H new ATOM 0 HD2 PHE B 85 12.601 -4.587 4.166 1.00 74.42 H new ATOM 0 HE1 PHE B 85 13.636 -6.507 -0.234 1.00 43.11 H new ATOM 0 HE2 PHE B 85 12.765 -3.128 2.205 1.00 54.32 H new ATOM 0 HZ PHE B 85 13.282 -4.084 0.000 1.00 44.11 H new ATOM 3154 N ALA B 86 12.255 -10.005 5.361 1.00 54.41 N ATOM 3155 CA ALA B 86 12.511 -11.041 6.335 1.00 2.23 C ATOM 3156 C ALA B 86 13.594 -10.642 7.321 1.00 31.31 C ATOM 3157 O ALA B 86 13.521 -10.982 8.507 1.00 11.00 O ATOM 3158 CB ALA B 86 12.872 -12.347 5.640 1.00 70.20 C ATOM 0 H ALA B 86 12.555 -10.243 4.416 1.00 54.41 H new ATOM 0 HA ALA B 86 11.594 -11.186 6.906 1.00 2.23 H new ATOM 0 HB1 ALA B 86 13.062 -13.117 6.388 1.00 70.20 H new ATOM 0 HB2 ALA B 86 12.047 -12.659 5.000 1.00 70.20 H new ATOM 0 HB3 ALA B 86 13.766 -12.202 5.034 1.00 70.20 H new ATOM 3164 N GLU B 87 14.594 -9.936 6.848 1.00 42.14 N ATOM 3165 CA GLU B 87 15.674 -9.541 7.714 1.00 34.02 C ATOM 3166 C GLU B 87 15.835 -8.033 7.743 1.00 1.20 C ATOM 3167 O GLU B 87 15.418 -7.323 6.825 1.00 74.25 O ATOM 3168 CB GLU B 87 16.984 -10.173 7.249 1.00 50.51 C ATOM 3169 CG GLU B 87 17.806 -10.837 8.361 1.00 53.42 C ATOM 3170 CD GLU B 87 18.163 -9.893 9.468 1.00 70.44 C ATOM 3171 OE1 GLU B 87 19.121 -9.135 9.323 1.00 75.41 O ATOM 3172 OE2 GLU B 87 17.463 -9.874 10.498 1.00 33.33 O ATOM 0 H GLU B 87 14.680 -9.627 5.880 1.00 42.14 H new ATOM 0 HA GLU B 87 15.432 -9.887 8.719 1.00 34.02 H new ATOM 0 HB2 GLU B 87 16.761 -10.919 6.486 1.00 50.51 H new ATOM 0 HB3 GLU B 87 17.594 -9.404 6.775 1.00 50.51 H new ATOM 0 HG2 GLU B 87 17.241 -11.674 8.772 1.00 53.42 H new ATOM 0 HG3 GLU B 87 18.720 -11.249 7.933 1.00 53.42 H new ATOM 3179 N ARG B 88 16.449 -7.566 8.805 1.00 3.30 N ATOM 3180 CA ARG B 88 16.789 -6.186 8.983 1.00 35.34 C ATOM 3181 C ARG B 88 17.855 -5.747 8.004 1.00 31.24 C ATOM 3182 O ARG B 88 17.829 -4.607 7.532 1.00 72.43 O ATOM 3183 CB ARG B 88 17.274 -5.930 10.398 1.00 75.20 C ATOM 3184 CG ARG B 88 16.285 -5.222 11.298 1.00 20.43 C ATOM 3185 CD ARG B 88 15.905 -3.866 10.714 1.00 41.23 C ATOM 3186 NE ARG B 88 17.089 -3.115 10.251 1.00 33.24 N ATOM 3187 CZ ARG B 88 17.486 -1.932 10.697 1.00 62.54 C ATOM 3188 NH1 ARG B 88 16.862 -1.343 11.710 1.00 14.34 N ATOM 3189 NH2 ARG B 88 18.525 -1.347 10.127 1.00 22.43 N ATOM 0 H ARG B 88 16.731 -8.157 9.587 1.00 3.30 H new ATOM 0 HA ARG B 88 15.885 -5.606 8.798 1.00 35.34 H new ATOM 0 HB2 ARG B 88 17.537 -6.885 10.853 1.00 75.20 H new ATOM 0 HB3 ARG B 88 18.187 -5.337 10.351 1.00 75.20 H new ATOM 0 HG2 ARG B 88 15.392 -5.835 11.420 1.00 20.43 H new ATOM 0 HG3 ARG B 88 16.718 -5.089 12.290 1.00 20.43 H new ATOM 0 HD2 ARG B 88 15.217 -4.009 9.881 1.00 41.23 H new ATOM 0 HD3 ARG B 88 15.376 -3.282 11.467 1.00 41.23 H new ATOM 0 HE ARG B 88 17.654 -3.547 9.520 1.00 33.24 H new ATOM 0 HH11 ARG B 88 16.067 -1.801 12.155 1.00 14.34 H new ATOM 0 HH12 ARG B 88 17.178 -0.432 12.043 1.00 14.34 H new ATOM 0 HH21 ARG B 88 19.009 -1.806 9.355 1.00 22.43 H new ATOM 0 HH22 ARG B 88 18.843 -0.436 10.459 1.00 22.43 H new ATOM 3203 N ASN B 89 18.787 -6.654 7.693 1.00 3.52 N ATOM 3204 CA ASN B 89 19.880 -6.334 6.755 1.00 11.14 C ATOM 3205 C ASN B 89 19.318 -5.966 5.412 1.00 75.11 C ATOM 3206 O ASN B 89 19.886 -5.139 4.701 1.00 31.12 O ATOM 3207 CB ASN B 89 20.847 -7.507 6.531 1.00 43.53 C ATOM 3208 CG ASN B 89 21.671 -7.962 7.726 1.00 5.22 C ATOM 3209 OD1 ASN B 89 21.986 -9.119 7.842 1.00 43.50 O ATOM 3210 ND2 ASN B 89 22.056 -7.091 8.565 1.00 62.14 N ATOM 0 H ASN B 89 18.812 -7.602 8.068 1.00 3.52 H new ATOM 0 HA ASN B 89 20.426 -5.507 7.210 1.00 11.14 H new ATOM 0 HB2 ASN B 89 20.269 -8.359 6.174 1.00 43.53 H new ATOM 0 HB3 ASN B 89 21.534 -7.231 5.731 1.00 43.53 H new ATOM 0 HD21 ASN B 89 22.642 -7.366 9.353 1.00 62.14 H new ATOM 0 HD22 ASN B 89 21.780 -6.116 8.451 1.00 62.14 H new ATOM 3217 N SER B 90 18.189 -6.571 5.058 1.00 32.45 N ATOM 3218 CA SER B 90 17.574 -6.352 3.800 1.00 24.33 C ATOM 3219 C SER B 90 17.126 -4.894 3.648 1.00 71.14 C ATOM 3220 O SER B 90 17.231 -4.317 2.561 1.00 74.21 O ATOM 3221 CB SER B 90 16.384 -7.276 3.690 1.00 41.24 C ATOM 3222 OG SER B 90 16.759 -8.608 3.999 1.00 71.30 O ATOM 0 H SER B 90 17.689 -7.228 5.657 1.00 32.45 H new ATOM 0 HA SER B 90 18.291 -6.557 3.005 1.00 24.33 H new ATOM 0 HB2 SER B 90 15.597 -6.947 4.368 1.00 41.24 H new ATOM 0 HB3 SER B 90 15.974 -7.232 2.681 1.00 41.24 H new ATOM 0 HG SER B 90 15.977 -9.194 3.925 1.00 71.30 H new ATOM 3228 N VAL B 91 16.640 -4.283 4.749 1.00 43.01 N ATOM 3229 CA VAL B 91 16.200 -2.900 4.667 1.00 64.12 C ATOM 3230 C VAL B 91 17.391 -2.023 4.422 1.00 43.23 C ATOM 3231 O VAL B 91 17.332 -1.125 3.609 1.00 43.12 O ATOM 3232 CB VAL B 91 15.374 -2.380 5.906 1.00 34.40 C ATOM 3233 CG1 VAL B 91 14.347 -3.369 6.341 1.00 4.51 C ATOM 3234 CG2 VAL B 91 16.209 -1.849 7.083 1.00 1.03 C ATOM 0 H VAL B 91 16.549 -4.717 5.667 1.00 43.01 H new ATOM 0 HA VAL B 91 15.497 -2.855 3.835 1.00 64.12 H new ATOM 0 HB VAL B 91 14.858 -1.495 5.535 1.00 34.40 H new ATOM 0 HG11 VAL B 91 13.800 -2.973 7.197 1.00 4.51 H new ATOM 0 HG12 VAL B 91 13.653 -3.557 5.522 1.00 4.51 H new ATOM 0 HG13 VAL B 91 14.836 -4.301 6.623 1.00 4.51 H new ATOM 0 HG21 VAL B 91 15.544 -1.517 7.880 1.00 1.03 H new ATOM 0 HG22 VAL B 91 16.857 -2.642 7.457 1.00 1.03 H new ATOM 0 HG23 VAL B 91 16.819 -1.011 6.747 1.00 1.03 H new ATOM 3244 N ASP B 92 18.508 -2.335 5.092 1.00 44.45 N ATOM 3245 CA ASP B 92 19.735 -1.569 4.926 1.00 54.12 C ATOM 3246 C ASP B 92 20.248 -1.666 3.494 1.00 75.14 C ATOM 3247 O ASP B 92 20.851 -0.729 2.973 1.00 24.32 O ATOM 3248 CB ASP B 92 20.814 -1.988 5.948 1.00 11.00 C ATOM 3249 CG ASP B 92 20.437 -1.658 7.390 1.00 31.34 C ATOM 3250 OD1 ASP B 92 20.724 -0.531 7.860 1.00 72.41 O ATOM 3251 OD2 ASP B 92 19.851 -2.512 8.086 1.00 60.55 O ATOM 0 H ASP B 92 18.580 -3.111 5.750 1.00 44.45 H new ATOM 0 HA ASP B 92 19.501 -0.523 5.125 1.00 54.12 H new ATOM 0 HB2 ASP B 92 20.990 -3.060 5.862 1.00 11.00 H new ATOM 0 HB3 ASP B 92 21.752 -1.490 5.701 1.00 11.00 H new ATOM 3256 N ALA B 93 19.985 -2.789 2.856 1.00 14.24 N ATOM 3257 CA ALA B 93 20.363 -2.989 1.474 1.00 74.01 C ATOM 3258 C ALA B 93 19.448 -2.177 0.541 1.00 40.21 C ATOM 3259 O ALA B 93 19.910 -1.566 -0.421 1.00 64.11 O ATOM 3260 CB ALA B 93 20.320 -4.470 1.120 1.00 44.32 C ATOM 0 H ALA B 93 19.506 -3.584 3.279 1.00 14.24 H new ATOM 0 HA ALA B 93 21.385 -2.635 1.339 1.00 74.01 H new ATOM 0 HB1 ALA B 93 20.607 -4.603 0.077 1.00 44.32 H new ATOM 0 HB2 ALA B 93 21.012 -5.017 1.760 1.00 44.32 H new ATOM 0 HB3 ALA B 93 19.310 -4.851 1.270 1.00 44.32 H new ATOM 3266 N ALA B 94 18.158 -2.148 0.857 1.00 41.14 N ATOM 3267 CA ALA B 94 17.176 -1.449 0.030 1.00 13.33 C ATOM 3268 C ALA B 94 17.290 0.072 0.191 1.00 54.13 C ATOM 3269 O ALA B 94 17.182 0.804 -0.769 1.00 30.12 O ATOM 3270 CB ALA B 94 15.757 -1.933 0.328 1.00 3.11 C ATOM 0 H ALA B 94 17.765 -2.601 1.682 1.00 41.14 H new ATOM 0 HA ALA B 94 17.395 -1.686 -1.011 1.00 13.33 H new ATOM 0 HB1 ALA B 94 15.049 -1.395 -0.302 1.00 3.11 H new ATOM 0 HB2 ALA B 94 15.686 -3.001 0.123 1.00 3.11 H new ATOM 0 HB3 ALA B 94 15.522 -1.749 1.376 1.00 3.11 H new ATOM 3276 N VAL B 95 17.507 0.529 1.415 1.00 41.52 N ATOM 3277 CA VAL B 95 17.678 1.974 1.705 1.00 24.23 C ATOM 3278 C VAL B 95 18.845 2.606 0.927 1.00 60.45 C ATOM 3279 O VAL B 95 18.891 3.815 0.742 1.00 33.14 O ATOM 3280 CB VAL B 95 17.782 2.302 3.211 1.00 35.20 C ATOM 3281 CG1 VAL B 95 16.596 1.749 3.967 1.00 13.45 C ATOM 3282 CG2 VAL B 95 19.091 1.814 3.801 1.00 63.10 C ATOM 0 H VAL B 95 17.572 -0.071 2.238 1.00 41.52 H new ATOM 0 HA VAL B 95 16.754 2.430 1.349 1.00 24.23 H new ATOM 0 HB VAL B 95 17.769 3.387 3.314 1.00 35.20 H new ATOM 0 HG11 VAL B 95 16.693 1.993 5.025 1.00 13.45 H new ATOM 0 HG12 VAL B 95 15.678 2.188 3.576 1.00 13.45 H new ATOM 0 HG13 VAL B 95 16.560 0.666 3.846 1.00 13.45 H new ATOM 0 HG21 VAL B 95 19.127 2.063 4.862 1.00 63.10 H new ATOM 0 HG22 VAL B 95 19.165 0.733 3.679 1.00 63.10 H new ATOM 0 HG23 VAL B 95 19.923 2.294 3.287 1.00 63.10 H new ATOM 3292 N ALA B 96 19.783 1.777 0.486 1.00 1.24 N ATOM 3293 CA ALA B 96 20.917 2.226 -0.336 1.00 45.13 C ATOM 3294 C ALA B 96 20.410 2.676 -1.724 1.00 5.12 C ATOM 3295 O ALA B 96 21.102 3.373 -2.465 1.00 0.55 O ATOM 3296 CB ALA B 96 21.911 1.086 -0.480 1.00 41.41 C ATOM 0 H ALA B 96 19.786 0.776 0.683 1.00 1.24 H new ATOM 0 HA ALA B 96 21.409 3.071 0.145 1.00 45.13 H new ATOM 0 HB1 ALA B 96 22.754 1.413 -1.089 1.00 41.41 H new ATOM 0 HB2 ALA B 96 22.269 0.789 0.506 1.00 41.41 H new ATOM 0 HB3 ALA B 96 21.424 0.237 -0.961 1.00 41.41 H new ATOM 3302 N MET B 97 19.196 2.288 -2.036 1.00 12.00 N ATOM 3303 CA MET B 97 18.531 2.622 -3.291 1.00 44.33 C ATOM 3304 C MET B 97 17.661 3.874 -3.108 1.00 32.14 C ATOM 3305 O MET B 97 16.899 4.227 -4.000 1.00 72.14 O ATOM 3306 CB MET B 97 17.631 1.439 -3.697 1.00 41.53 C ATOM 3307 CG MET B 97 18.381 0.146 -3.981 1.00 52.13 C ATOM 3308 SD MET B 97 17.370 -1.355 -3.721 1.00 11.45 S ATOM 3309 CE MET B 97 15.885 -1.022 -4.648 1.00 61.33 C ATOM 0 H MET B 97 18.622 1.717 -1.415 1.00 12.00 H new ATOM 0 HA MET B 97 19.278 2.817 -4.061 1.00 44.33 H new ATOM 0 HB2 MET B 97 16.909 1.258 -2.901 1.00 41.53 H new ATOM 0 HB3 MET B 97 17.064 1.718 -4.585 1.00 41.53 H new ATOM 0 HG2 MET B 97 18.737 0.161 -5.011 1.00 52.13 H new ATOM 0 HG3 MET B 97 19.261 0.097 -3.340 1.00 52.13 H new ATOM 0 HE1 MET B 97 15.257 -1.913 -4.662 1.00 61.33 H new ATOM 0 HE2 MET B 97 15.340 -0.202 -4.180 1.00 61.33 H new ATOM 0 HE3 MET B 97 16.148 -0.747 -5.669 1.00 61.33 H new ATOM 3319 N ASP B 98 17.758 4.508 -1.911 1.00 53.01 N ATOM 3320 CA ASP B 98 16.950 5.711 -1.544 1.00 11.32 C ATOM 3321 C ASP B 98 16.751 6.702 -2.674 1.00 23.55 C ATOM 3322 O ASP B 98 15.655 7.177 -2.846 1.00 42.14 O ATOM 3323 CB ASP B 98 17.448 6.424 -0.278 1.00 61.21 C ATOM 3324 CG ASP B 98 18.634 7.329 -0.493 1.00 65.04 C ATOM 3325 OD1 ASP B 98 19.755 6.832 -0.666 1.00 73.43 O ATOM 3326 OD2 ASP B 98 18.454 8.568 -0.461 1.00 1.23 O ATOM 0 H ASP B 98 18.394 4.205 -1.173 1.00 53.01 H new ATOM 0 HA ASP B 98 15.969 5.292 -1.321 1.00 11.32 H new ATOM 0 HB2 ASP B 98 16.630 7.012 0.138 1.00 61.21 H new ATOM 0 HB3 ASP B 98 17.711 5.673 0.467 1.00 61.21 H new ATOM 3331 N GLU B 99 17.793 7.057 -3.406 1.00 14.02 N ATOM 3332 CA GLU B 99 17.602 7.851 -4.586 1.00 34.45 C ATOM 3333 C GLU B 99 17.959 7.037 -5.823 1.00 2.04 C ATOM 3334 O GLU B 99 19.132 6.866 -6.163 1.00 23.40 O ATOM 3335 CB GLU B 99 18.393 9.163 -4.524 1.00 23.44 C ATOM 3336 CG GLU B 99 18.231 10.027 -5.761 1.00 61.42 C ATOM 3337 CD GLU B 99 18.946 11.342 -5.668 1.00 51.11 C ATOM 3338 OE1 GLU B 99 20.190 11.370 -5.812 1.00 71.44 O ATOM 3339 OE2 GLU B 99 18.274 12.378 -5.500 1.00 71.44 O ATOM 0 H GLU B 99 18.761 6.808 -3.201 1.00 14.02 H new ATOM 0 HA GLU B 99 16.549 8.127 -4.646 1.00 34.45 H new ATOM 0 HB2 GLU B 99 18.073 9.730 -3.650 1.00 23.44 H new ATOM 0 HB3 GLU B 99 19.450 8.935 -4.386 1.00 23.44 H new ATOM 0 HG2 GLU B 99 18.603 9.481 -6.628 1.00 61.42 H new ATOM 0 HG3 GLU B 99 17.170 10.210 -5.931 1.00 61.42 H new ATOM 3346 N THR B 100 16.942 6.513 -6.453 1.00 73.40 N ATOM 3347 CA THR B 100 17.098 5.702 -7.647 1.00 34.13 C ATOM 3348 C THR B 100 16.036 6.010 -8.663 1.00 44.43 C ATOM 3349 O THR B 100 15.047 6.671 -8.357 1.00 41.54 O ATOM 3350 CB THR B 100 17.092 4.186 -7.344 1.00 44.52 C ATOM 3351 OG1 THR B 100 15.993 3.856 -6.484 1.00 30.03 O ATOM 3352 CG2 THR B 100 18.403 3.722 -6.737 1.00 20.24 C ATOM 0 H THR B 100 15.973 6.633 -6.157 1.00 73.40 H new ATOM 0 HA THR B 100 18.075 5.961 -8.055 1.00 34.13 H new ATOM 0 HB THR B 100 16.972 3.662 -8.292 1.00 44.52 H new ATOM 0 HG1 THR B 100 16.298 3.847 -5.553 1.00 30.03 H new ATOM 0 HG21 THR B 100 18.354 2.651 -6.540 1.00 20.24 H new ATOM 0 HG22 THR B 100 19.218 3.927 -7.431 1.00 20.24 H new ATOM 0 HG23 THR B 100 18.580 4.255 -5.803 1.00 20.24 H new ATOM 3360 N VAL B 101 16.228 5.529 -9.861 1.00 41.12 N ATOM 3361 CA VAL B 101 15.279 5.735 -10.905 1.00 73.10 C ATOM 3362 C VAL B 101 14.452 4.464 -11.116 1.00 22.14 C ATOM 3363 O VAL B 101 14.989 3.358 -11.288 1.00 24.00 O ATOM 3364 CB VAL B 101 15.957 6.216 -12.225 1.00 32.23 C ATOM 3365 CG1 VAL B 101 17.002 5.233 -12.689 1.00 70.10 C ATOM 3366 CG2 VAL B 101 14.927 6.472 -13.318 1.00 4.22 C ATOM 0 H VAL B 101 17.047 4.985 -10.134 1.00 41.12 H new ATOM 0 HA VAL B 101 14.605 6.537 -10.602 1.00 73.10 H new ATOM 0 HB VAL B 101 16.455 7.162 -12.011 1.00 32.23 H new ATOM 0 HG11 VAL B 101 17.458 5.594 -13.611 1.00 70.10 H new ATOM 0 HG12 VAL B 101 17.769 5.128 -11.922 1.00 70.10 H new ATOM 0 HG13 VAL B 101 16.536 4.265 -12.870 1.00 70.10 H new ATOM 0 HG21 VAL B 101 15.433 6.806 -14.224 1.00 4.22 H new ATOM 0 HG22 VAL B 101 14.380 5.552 -13.526 1.00 4.22 H new ATOM 0 HG23 VAL B 101 14.229 7.242 -12.988 1.00 4.22 H new ATOM 3376 N PHE B 102 13.174 4.626 -11.043 1.00 72.14 N ATOM 3377 CA PHE B 102 12.230 3.569 -11.201 1.00 63.21 C ATOM 3378 C PHE B 102 11.116 4.068 -12.103 1.00 23.34 C ATOM 3379 O PHE B 102 10.478 5.080 -11.805 1.00 71.31 O ATOM 3380 CB PHE B 102 11.695 3.199 -9.812 1.00 31.45 C ATOM 3381 CG PHE B 102 10.658 2.115 -9.758 1.00 40.14 C ATOM 3382 CD1 PHE B 102 11.029 0.784 -9.676 1.00 73.34 C ATOM 3383 CD2 PHE B 102 9.306 2.434 -9.754 1.00 62.23 C ATOM 3384 CE1 PHE B 102 10.075 -0.210 -9.593 1.00 4.44 C ATOM 3385 CE2 PHE B 102 8.349 1.444 -9.676 1.00 30.04 C ATOM 3386 CZ PHE B 102 8.734 0.119 -9.594 1.00 40.00 C ATOM 0 H PHE B 102 12.741 5.532 -10.865 1.00 72.14 H new ATOM 0 HA PHE B 102 12.679 2.684 -11.652 1.00 63.21 H new ATOM 0 HB2 PHE B 102 12.538 2.895 -9.192 1.00 31.45 H new ATOM 0 HB3 PHE B 102 11.274 4.096 -9.359 1.00 31.45 H new ATOM 0 HD1 PHE B 102 12.076 0.520 -9.677 1.00 73.34 H new ATOM 0 HD2 PHE B 102 9.001 3.468 -9.813 1.00 62.23 H new ATOM 0 HE1 PHE B 102 10.377 -1.245 -9.527 1.00 4.44 H new ATOM 0 HE2 PHE B 102 7.301 1.704 -9.679 1.00 30.04 H new ATOM 0 HZ PHE B 102 7.987 -0.658 -9.531 1.00 40.00 H new ATOM 3396 N ARG B 103 10.928 3.387 -13.227 1.00 21.32 N ATOM 3397 CA ARG B 103 9.912 3.712 -14.239 1.00 42.44 C ATOM 3398 C ARG B 103 10.046 5.145 -14.757 1.00 14.34 C ATOM 3399 O ARG B 103 9.070 5.775 -15.176 1.00 51.35 O ATOM 3400 CB ARG B 103 8.518 3.430 -13.696 1.00 5.54 C ATOM 3401 CG ARG B 103 8.327 1.973 -13.353 1.00 64.21 C ATOM 3402 CD ARG B 103 6.921 1.665 -12.913 1.00 24.23 C ATOM 3403 NE ARG B 103 6.764 0.239 -12.611 1.00 74.11 N ATOM 3404 CZ ARG B 103 5.827 -0.551 -13.130 1.00 64.41 C ATOM 3405 NH1 ARG B 103 4.995 -0.081 -14.057 1.00 71.03 N ATOM 3406 NH2 ARG B 103 5.755 -1.821 -12.756 1.00 33.43 N ATOM 0 H ARG B 103 11.489 2.571 -13.473 1.00 21.32 H new ATOM 0 HA ARG B 103 10.079 3.065 -15.100 1.00 42.44 H new ATOM 0 HB2 ARG B 103 8.346 4.037 -12.807 1.00 5.54 H new ATOM 0 HB3 ARG B 103 7.774 3.729 -14.435 1.00 5.54 H new ATOM 0 HG2 ARG B 103 8.574 1.363 -14.222 1.00 64.21 H new ATOM 0 HG3 ARG B 103 9.022 1.695 -12.560 1.00 64.21 H new ATOM 0 HD2 ARG B 103 6.675 2.256 -12.031 1.00 24.23 H new ATOM 0 HD3 ARG B 103 6.220 1.954 -13.696 1.00 24.23 H new ATOM 0 HE ARG B 103 7.422 -0.179 -11.954 1.00 74.11 H new ATOM 0 HH11 ARG B 103 5.075 0.886 -14.371 1.00 71.03 H new ATOM 0 HH12 ARG B 103 4.278 -0.688 -14.453 1.00 71.03 H new ATOM 0 HH21 ARG B 103 6.416 -2.190 -12.073 1.00 33.43 H new ATOM 0 HH22 ARG B 103 5.038 -2.429 -13.152 1.00 33.43 H new ATOM 3420 N GLY B 104 11.280 5.601 -14.798 1.00 31.01 N ATOM 3421 CA GLY B 104 11.589 6.915 -15.314 1.00 25.34 C ATOM 3422 C GLY B 104 11.485 8.012 -14.274 1.00 35.13 C ATOM 3423 O GLY B 104 11.628 9.187 -14.597 1.00 63.12 O ATOM 0 H GLY B 104 12.092 5.074 -14.476 1.00 31.01 H new ATOM 0 HA2 GLY B 104 12.599 6.908 -15.723 1.00 25.34 H new ATOM 0 HA3 GLY B 104 10.913 7.141 -16.138 1.00 25.34 H new ATOM 3427 N ARG B 105 11.226 7.647 -13.040 1.00 44.30 N ATOM 3428 CA ARG B 105 11.123 8.629 -11.971 1.00 41.35 C ATOM 3429 C ARG B 105 12.133 8.334 -10.909 1.00 24.50 C ATOM 3430 O ARG B 105 12.660 7.238 -10.846 1.00 4.23 O ATOM 3431 CB ARG B 105 9.754 8.587 -11.328 1.00 32.54 C ATOM 3432 CG ARG B 105 8.615 8.859 -12.248 1.00 71.01 C ATOM 3433 CD ARG B 105 7.312 8.819 -11.499 1.00 13.24 C ATOM 3434 NE ARG B 105 6.183 9.094 -12.374 1.00 22.14 N ATOM 3435 CZ ARG B 105 4.916 9.022 -12.009 1.00 43.42 C ATOM 3436 NH1 ARG B 105 4.596 8.732 -10.746 1.00 62.23 N ATOM 3437 NH2 ARG B 105 3.964 9.243 -12.898 1.00 25.02 N ATOM 0 H ARG B 105 11.082 6.681 -12.746 1.00 44.30 H new ATOM 0 HA ARG B 105 11.296 9.612 -12.409 1.00 41.35 H new ATOM 0 HB2 ARG B 105 9.611 7.604 -10.878 1.00 32.54 H new ATOM 0 HB3 ARG B 105 9.728 9.315 -10.517 1.00 32.54 H new ATOM 0 HG2 ARG B 105 8.743 9.835 -12.716 1.00 71.01 H new ATOM 0 HG3 ARG B 105 8.603 8.121 -13.050 1.00 71.01 H new ATOM 0 HD2 ARG B 105 7.186 7.839 -11.039 1.00 13.24 H new ATOM 0 HD3 ARG B 105 7.333 9.550 -10.691 1.00 13.24 H new ATOM 0 HE ARG B 105 6.384 9.361 -13.338 1.00 22.14 H new ATOM 0 HH11 ARG B 105 5.331 8.565 -10.059 1.00 62.23 H new ATOM 0 HH12 ARG B 105 3.616 8.677 -10.468 1.00 62.23 H new ATOM 0 HH21 ARG B 105 4.209 9.468 -13.862 1.00 25.02 H new ATOM 0 HH22 ARG B 105 2.984 9.188 -12.620 1.00 25.02 H new ATOM 3451 N THR B 106 12.395 9.289 -10.082 1.00 12.41 N ATOM 3452 CA THR B 106 13.271 9.087 -8.983 1.00 14.31 C ATOM 3453 C THR B 106 12.436 8.720 -7.780 1.00 32.33 C ATOM 3454 O THR B 106 11.602 9.508 -7.349 1.00 14.02 O ATOM 3455 CB THR B 106 14.036 10.374 -8.670 1.00 1.32 C ATOM 3456 OG1 THR B 106 14.744 10.816 -9.847 1.00 45.15 O ATOM 3457 CG2 THR B 106 15.025 10.147 -7.536 1.00 35.23 C ATOM 0 H THR B 106 12.007 10.230 -10.150 1.00 12.41 H new ATOM 0 HA THR B 106 13.984 8.299 -9.225 1.00 14.31 H new ATOM 0 HB THR B 106 13.321 11.138 -8.363 1.00 1.32 H new ATOM 0 HG1 THR B 106 15.232 11.641 -9.645 1.00 45.15 H new ATOM 0 HG21 THR B 106 15.559 11.074 -7.328 1.00 35.23 H new ATOM 0 HG22 THR B 106 14.487 9.830 -6.642 1.00 35.23 H new ATOM 0 HG23 THR B 106 15.738 9.374 -7.824 1.00 35.23 H new ATOM 3465 N ILE B 107 12.670 7.567 -7.215 1.00 3.42 N ATOM 3466 CA ILE B 107 11.872 7.166 -6.076 1.00 73.14 C ATOM 3467 C ILE B 107 12.630 7.400 -4.807 1.00 43.24 C ATOM 3468 O ILE B 107 13.818 7.721 -4.842 1.00 64.34 O ATOM 3469 CB ILE B 107 11.423 5.669 -6.131 1.00 64.31 C ATOM 3470 CG1 ILE B 107 12.638 4.713 -6.134 1.00 34.12 C ATOM 3471 CG2 ILE B 107 10.534 5.420 -7.341 1.00 4.14 C ATOM 3472 CD1 ILE B 107 12.268 3.235 -6.089 1.00 42.23 C ATOM 0 H ILE B 107 13.384 6.901 -7.509 1.00 3.42 H new ATOM 0 HA ILE B 107 10.971 7.778 -6.106 1.00 73.14 H new ATOM 0 HB ILE B 107 10.845 5.462 -5.230 1.00 64.31 H new ATOM 0 HG12 ILE B 107 13.232 4.901 -7.029 1.00 34.12 H new ATOM 0 HG13 ILE B 107 13.271 4.944 -5.277 1.00 34.12 H new ATOM 0 HG21 ILE B 107 10.232 4.373 -7.361 1.00 4.14 H new ATOM 0 HG22 ILE B 107 9.648 6.052 -7.278 1.00 4.14 H new ATOM 0 HG23 ILE B 107 11.084 5.657 -8.252 1.00 4.14 H new ATOM 0 HD11 ILE B 107 13.176 2.632 -6.094 1.00 42.23 H new ATOM 0 HD12 ILE B 107 11.701 3.029 -5.181 1.00 42.23 H new ATOM 0 HD13 ILE B 107 11.662 2.985 -6.960 1.00 42.23 H new ATOM 3484 N LYS B 108 11.946 7.260 -3.697 1.00 30.31 N ATOM 3485 CA LYS B 108 12.536 7.512 -2.414 1.00 42.04 C ATOM 3486 C LYS B 108 12.203 6.386 -1.475 1.00 72.40 C ATOM 3487 O LYS B 108 11.030 6.049 -1.298 1.00 32.01 O ATOM 3488 CB LYS B 108 12.042 8.851 -1.831 1.00 33.42 C ATOM 3489 CG LYS B 108 12.670 9.224 -0.489 1.00 42.14 C ATOM 3490 CD LYS B 108 14.175 9.343 -0.616 1.00 70.43 C ATOM 3491 CE LYS B 108 14.834 9.704 0.700 1.00 12.24 C ATOM 3492 NZ LYS B 108 16.303 9.922 0.566 1.00 20.52 N ATOM 0 H LYS B 108 10.969 6.969 -3.662 1.00 30.31 H new ATOM 0 HA LYS B 108 13.617 7.576 -2.537 1.00 42.04 H new ATOM 0 HB2 LYS B 108 12.250 9.645 -2.549 1.00 33.42 H new ATOM 0 HB3 LYS B 108 10.960 8.804 -1.712 1.00 33.42 H new ATOM 0 HG2 LYS B 108 12.254 10.168 -0.137 1.00 42.14 H new ATOM 0 HG3 LYS B 108 12.422 8.469 0.257 1.00 42.14 H new ATOM 0 HD2 LYS B 108 14.583 8.399 -0.978 1.00 70.43 H new ATOM 0 HD3 LYS B 108 14.416 10.101 -1.361 1.00 70.43 H new ATOM 0 HE2 LYS B 108 14.371 10.607 1.098 1.00 12.24 H new ATOM 0 HE3 LYS B 108 14.653 8.908 1.423 1.00 12.24 H new ATOM 0 HZ1 LYS B 108 16.730 9.998 1.511 1.00 20.52 H new ATOM 0 HZ2 LYS B 108 16.728 9.121 0.057 1.00 20.52 H new ATOM 0 HZ3 LYS B 108 16.477 10.800 0.036 1.00 20.52 H new ATOM 3506 N VAL B 109 13.216 5.804 -0.879 1.00 72.43 N ATOM 3507 CA VAL B 109 13.018 4.723 0.047 1.00 53.40 C ATOM 3508 C VAL B 109 13.747 4.974 1.358 1.00 32.53 C ATOM 3509 O VAL B 109 14.887 5.468 1.365 1.00 12.55 O ATOM 3510 CB VAL B 109 13.355 3.300 -0.524 1.00 12.44 C ATOM 3511 CG1 VAL B 109 12.434 2.943 -1.657 1.00 15.20 C ATOM 3512 CG2 VAL B 109 14.771 3.176 -1.003 1.00 35.04 C ATOM 0 H VAL B 109 14.191 6.066 -1.023 1.00 72.43 H new ATOM 0 HA VAL B 109 11.945 4.709 0.236 1.00 53.40 H new ATOM 0 HB VAL B 109 13.218 2.611 0.310 1.00 12.44 H new ATOM 0 HG11 VAL B 109 12.689 1.953 -2.035 1.00 15.20 H new ATOM 0 HG12 VAL B 109 11.404 2.942 -1.302 1.00 15.20 H new ATOM 0 HG13 VAL B 109 12.541 3.675 -2.457 1.00 15.20 H new ATOM 0 HG21 VAL B 109 14.939 2.169 -1.385 1.00 35.04 H new ATOM 0 HG22 VAL B 109 14.951 3.900 -1.797 1.00 35.04 H new ATOM 0 HG23 VAL B 109 15.453 3.368 -0.175 1.00 35.04 H new ATOM 3522 N LEU B 110 13.107 4.666 2.454 1.00 61.30 N ATOM 3523 CA LEU B 110 13.749 4.756 3.751 1.00 33.13 C ATOM 3524 C LEU B 110 13.282 3.556 4.516 1.00 24.15 C ATOM 3525 O LEU B 110 12.351 2.892 4.077 1.00 4.40 O ATOM 3526 CB LEU B 110 13.327 5.907 4.669 1.00 15.43 C ATOM 3527 CG LEU B 110 13.040 7.293 4.273 1.00 43.41 C ATOM 3528 CD1 LEU B 110 11.747 7.360 3.495 1.00 74.50 C ATOM 3529 CD2 LEU B 110 12.907 7.999 5.598 1.00 52.13 C ATOM 0 H LEU B 110 12.138 4.349 2.481 1.00 61.30 H new ATOM 0 HA LEU B 110 14.810 4.871 3.529 1.00 33.13 H new ATOM 0 HB2 LEU B 110 12.427 5.558 5.176 1.00 15.43 H new ATOM 0 HB3 LEU B 110 14.110 5.978 5.424 1.00 15.43 H new ATOM 0 HG LEU B 110 13.802 7.731 3.628 1.00 43.41 H new ATOM 0 HD11 LEU B 110 11.548 8.393 3.209 1.00 74.50 H new ATOM 0 HD12 LEU B 110 11.829 6.744 2.599 1.00 74.50 H new ATOM 0 HD13 LEU B 110 10.930 6.991 4.115 1.00 74.50 H new ATOM 0 HD21 LEU B 110 12.690 9.054 5.428 1.00 52.13 H new ATOM 0 HD22 LEU B 110 12.096 7.549 6.170 1.00 52.13 H new ATOM 0 HD23 LEU B 110 13.839 7.906 6.155 1.00 52.13 H new ATOM 3541 N PRO B 111 13.868 3.257 5.675 1.00 3.32 N ATOM 3542 CA PRO B 111 13.362 2.226 6.519 1.00 45.23 C ATOM 3543 C PRO B 111 12.162 2.762 7.336 1.00 74.54 C ATOM 3544 O PRO B 111 12.222 3.849 7.941 1.00 13.32 O ATOM 3545 CB PRO B 111 14.560 1.914 7.415 1.00 60.13 C ATOM 3546 CG PRO B 111 15.243 3.222 7.555 1.00 13.41 C ATOM 3547 CD PRO B 111 15.078 3.900 6.262 1.00 14.31 C ATOM 0 HA PRO B 111 12.993 1.348 5.989 1.00 45.23 H new ATOM 0 HB2 PRO B 111 14.246 1.521 8.382 1.00 60.13 H new ATOM 0 HB3 PRO B 111 15.214 1.167 6.964 1.00 60.13 H new ATOM 0 HG2 PRO B 111 14.804 3.808 8.363 1.00 13.41 H new ATOM 0 HG3 PRO B 111 16.298 3.089 7.795 1.00 13.41 H new ATOM 0 HD2 PRO B 111 14.939 4.974 6.388 1.00 14.31 H new ATOM 0 HD3 PRO B 111 15.952 3.764 5.625 1.00 14.31 H new ATOM 3555 N LYS B 112 11.097 2.034 7.327 1.00 1.34 N ATOM 3556 CA LYS B 112 9.918 2.393 8.059 1.00 23.33 C ATOM 3557 C LYS B 112 9.994 1.601 9.306 1.00 33.21 C ATOM 3558 O LYS B 112 9.795 0.413 9.247 1.00 12.12 O ATOM 3559 CB LYS B 112 8.691 1.952 7.319 1.00 60.15 C ATOM 3560 CG LYS B 112 7.448 2.589 7.879 1.00 31.14 C ATOM 3561 CD LYS B 112 6.212 1.938 7.376 1.00 0.23 C ATOM 3562 CE LYS B 112 6.210 0.467 7.722 1.00 53.14 C ATOM 3563 NZ LYS B 112 6.467 0.206 9.164 1.00 23.15 N ATOM 0 H LYS B 112 11.014 1.161 6.806 1.00 1.34 H new ATOM 0 HA LYS B 112 9.863 3.470 8.220 1.00 23.33 H new ATOM 0 HB2 LYS B 112 8.789 2.210 6.264 1.00 60.15 H new ATOM 0 HB3 LYS B 112 8.602 0.867 7.375 1.00 60.15 H new ATOM 0 HG2 LYS B 112 7.470 2.532 8.967 1.00 31.14 H new ATOM 0 HG3 LYS B 112 7.433 3.647 7.616 1.00 31.14 H new ATOM 0 HD2 LYS B 112 5.337 2.421 7.811 1.00 0.23 H new ATOM 0 HD3 LYS B 112 6.142 2.064 6.296 1.00 0.23 H new ATOM 0 HE2 LYS B 112 5.247 0.037 7.447 1.00 53.14 H new ATOM 0 HE3 LYS B 112 6.968 -0.041 7.126 1.00 53.14 H new ATOM 0 HZ1 LYS B 112 5.928 -0.630 9.467 1.00 23.15 H new ATOM 0 HZ2 LYS B 112 7.482 0.035 9.310 1.00 23.15 H new ATOM 0 HZ3 LYS B 112 6.171 1.031 9.724 1.00 23.15 H new ATOM 3577 N ARG B 113 10.256 2.216 10.440 1.00 34.02 N ATOM 3578 CA ARG B 113 10.612 1.412 11.602 1.00 15.30 C ATOM 3579 C ARG B 113 10.178 2.032 12.893 1.00 34.13 C ATOM 3580 O ARG B 113 10.351 3.233 13.112 1.00 62.32 O ATOM 3581 CB ARG B 113 12.139 1.226 11.704 1.00 64.41 C ATOM 3582 CG ARG B 113 12.812 0.593 10.510 1.00 35.53 C ATOM 3583 CD ARG B 113 14.306 0.435 10.742 1.00 2.35 C ATOM 3584 NE ARG B 113 14.969 1.711 11.067 1.00 45.14 N ATOM 3585 CZ ARG B 113 16.197 2.082 10.654 1.00 74.21 C ATOM 3586 NH1 ARG B 113 16.904 1.293 9.837 1.00 53.32 N ATOM 3587 NH2 ARG B 113 16.697 3.247 11.046 1.00 52.31 N ATOM 0 H ARG B 113 10.233 3.225 10.587 1.00 34.02 H new ATOM 0 HA ARG B 113 10.099 0.462 11.454 1.00 15.30 H new ATOM 0 HB2 ARG B 113 12.593 2.202 11.876 1.00 64.41 H new ATOM 0 HB3 ARG B 113 12.352 0.616 12.582 1.00 64.41 H new ATOM 0 HG2 ARG B 113 12.367 -0.382 10.313 1.00 35.53 H new ATOM 0 HG3 ARG B 113 12.641 1.206 9.625 1.00 35.53 H new ATOM 0 HD2 ARG B 113 14.471 -0.273 11.555 1.00 2.35 H new ATOM 0 HD3 ARG B 113 14.765 0.009 9.850 1.00 2.35 H new ATOM 0 HE ARG B 113 14.455 2.368 11.654 1.00 45.14 H new ATOM 0 HH11 ARG B 113 16.514 0.404 9.523 1.00 53.32 H new ATOM 0 HH12 ARG B 113 17.833 1.580 9.528 1.00 53.32 H new ATOM 0 HH21 ARG B 113 16.152 3.856 11.657 1.00 52.31 H new ATOM 0 HH22 ARG B 113 17.626 3.533 10.737 1.00 52.31 H new ATOM 3601 N THR B 114 9.607 1.229 13.723 1.00 34.03 N ATOM 3602 CA THR B 114 9.420 1.563 15.089 1.00 3.42 C ATOM 3603 C THR B 114 10.335 0.655 15.897 1.00 73.34 C ATOM 3604 O THR B 114 9.958 -0.448 16.313 1.00 12.40 O ATOM 3605 CB THR B 114 7.939 1.478 15.558 1.00 41.21 C ATOM 3606 OG1 THR B 114 7.363 0.196 15.237 1.00 20.12 O ATOM 3607 CG2 THR B 114 7.105 2.579 14.932 1.00 45.34 C ATOM 0 H THR B 114 9.252 0.308 13.466 1.00 34.03 H new ATOM 0 HA THR B 114 9.678 2.611 15.243 1.00 3.42 H new ATOM 0 HB THR B 114 7.936 1.603 16.641 1.00 41.21 H new ATOM 0 HG1 THR B 114 7.566 -0.030 14.305 1.00 20.12 H new ATOM 0 HG21 THR B 114 6.074 2.496 15.277 1.00 45.34 H new ATOM 0 HG22 THR B 114 7.507 3.550 15.222 1.00 45.34 H new ATOM 0 HG23 THR B 114 7.133 2.484 13.846 1.00 45.34 H new ATOM 3615 N ASN B 115 11.576 1.090 16.028 1.00 54.40 N ATOM 3616 CA ASN B 115 12.615 0.296 16.651 1.00 61.01 C ATOM 3617 C ASN B 115 12.420 0.231 18.145 1.00 0.02 C ATOM 3618 O ASN B 115 12.788 1.143 18.890 1.00 4.23 O ATOM 3619 CB ASN B 115 14.015 0.816 16.282 1.00 50.54 C ATOM 3620 CG ASN B 115 15.147 -0.040 16.845 1.00 23.12 C ATOM 3621 OD1 ASN B 115 15.001 -1.256 17.037 1.00 1.31 O ATOM 3622 ND2 ASN B 115 16.282 0.572 17.075 1.00 4.52 N ATOM 0 H ASN B 115 11.890 2.005 15.704 1.00 54.40 H new ATOM 0 HA ASN B 115 12.539 -0.720 16.264 1.00 61.01 H new ATOM 0 HB2 ASN B 115 14.105 0.856 15.196 1.00 50.54 H new ATOM 0 HB3 ASN B 115 14.124 1.837 16.649 1.00 50.54 H new ATOM 0 HD21 ASN B 115 17.083 0.046 17.424 1.00 4.52 H new ATOM 0 HD22 ASN B 115 16.365 1.574 16.905 1.00 4.52 H new ATOM 3629 N MET B 116 11.783 -0.822 18.559 1.00 62.22 N ATOM 3630 CA MET B 116 11.474 -1.074 19.933 1.00 3.30 C ATOM 3631 C MET B 116 11.861 -2.510 20.234 1.00 31.11 C ATOM 3632 O MET B 116 11.715 -3.373 19.364 1.00 22.01 O ATOM 3633 CB MET B 116 9.962 -0.869 20.172 1.00 63.54 C ATOM 3634 CG MET B 116 9.470 0.548 19.869 1.00 35.31 C ATOM 3635 SD MET B 116 7.676 0.743 20.032 1.00 21.41 S ATOM 3636 CE MET B 116 7.434 0.333 21.764 1.00 61.03 C ATOM 0 H MET B 116 11.453 -1.553 17.929 1.00 62.22 H new ATOM 0 HA MET B 116 12.019 -0.390 20.584 1.00 3.30 H new ATOM 0 HB2 MET B 116 9.408 -1.575 19.553 1.00 63.54 H new ATOM 0 HB3 MET B 116 9.733 -1.108 21.211 1.00 63.54 H new ATOM 0 HG2 MET B 116 9.966 1.247 20.542 1.00 35.31 H new ATOM 0 HG3 MET B 116 9.766 0.817 18.855 1.00 35.31 H new ATOM 0 HE1 MET B 116 6.443 0.660 22.080 1.00 61.03 H new ATOM 0 HE2 MET B 116 7.521 -0.745 21.898 1.00 61.03 H new ATOM 0 HE3 MET B 116 8.191 0.835 22.366 1.00 61.03 H new ATOM 3646 N PRO B 117 12.383 -2.796 21.434 1.00 1.32 N ATOM 3647 CA PRO B 117 12.806 -4.148 21.804 1.00 35.31 C ATOM 3648 C PRO B 117 11.624 -5.097 21.987 1.00 60.24 C ATOM 3649 O PRO B 117 10.485 -4.663 22.240 1.00 52.31 O ATOM 3650 CB PRO B 117 13.537 -3.959 23.144 1.00 14.21 C ATOM 3651 CG PRO B 117 13.723 -2.488 23.289 1.00 5.43 C ATOM 3652 CD PRO B 117 12.609 -1.845 22.528 1.00 23.13 C ATOM 0 HA PRO B 117 13.425 -4.595 21.026 1.00 35.31 H new ATOM 0 HB2 PRO B 117 12.953 -4.365 23.970 1.00 14.21 H new ATOM 0 HB3 PRO B 117 14.495 -4.478 23.145 1.00 14.21 H new ATOM 0 HG2 PRO B 117 13.696 -2.195 24.338 1.00 5.43 H new ATOM 0 HG3 PRO B 117 14.691 -2.178 22.896 1.00 5.43 H new ATOM 0 HD2 PRO B 117 11.719 -1.715 23.143 1.00 23.13 H new ATOM 0 HD3 PRO B 117 12.887 -0.858 22.157 1.00 23.13 H new ATOM 3660 N GLY B 118 11.890 -6.367 21.865 1.00 5.43 N ATOM 3661 CA GLY B 118 10.875 -7.361 22.043 1.00 41.14 C ATOM 3662 C GLY B 118 11.030 -8.006 23.376 1.00 0.23 C ATOM 3663 O GLY B 118 12.109 -7.914 23.985 1.00 23.40 O ATOM 0 H GLY B 118 12.813 -6.739 21.640 1.00 5.43 H new ATOM 0 HA2 GLY B 118 9.888 -6.905 21.962 1.00 41.14 H new ATOM 0 HA3 GLY B 118 10.945 -8.111 21.255 1.00 41.14 H new ATOM 3667 N ILE B 119 10.007 -8.652 23.863 1.00 52.45 N ATOM 3668 CA ILE B 119 10.129 -9.269 25.144 1.00 43.24 C ATOM 3669 C ILE B 119 10.678 -10.689 25.027 1.00 2.12 C ATOM 3670 O ILE B 119 9.951 -11.676 24.910 1.00 71.13 O ATOM 3671 CB ILE B 119 8.853 -9.159 26.048 1.00 24.21 C ATOM 3672 CG1 ILE B 119 9.102 -9.818 27.419 1.00 52.15 C ATOM 3673 CG2 ILE B 119 7.614 -9.737 25.365 1.00 63.41 C ATOM 3674 CD1 ILE B 119 7.952 -9.678 28.390 1.00 42.13 C ATOM 0 H ILE B 119 9.103 -8.761 23.403 1.00 52.45 H new ATOM 0 HA ILE B 119 10.869 -8.683 25.689 1.00 43.24 H new ATOM 0 HB ILE B 119 8.654 -8.100 26.210 1.00 24.21 H new ATOM 0 HG12 ILE B 119 9.309 -10.877 27.268 1.00 52.15 H new ATOM 0 HG13 ILE B 119 9.995 -9.379 27.864 1.00 52.15 H new ATOM 0 HG21 ILE B 119 6.754 -9.639 26.028 1.00 63.41 H new ATOM 0 HG22 ILE B 119 7.422 -9.194 24.439 1.00 63.41 H new ATOM 0 HG23 ILE B 119 7.781 -10.790 25.140 1.00 63.41 H new ATOM 0 HD11 ILE B 119 8.207 -10.168 29.329 1.00 42.13 H new ATOM 0 HD12 ILE B 119 7.757 -8.621 28.573 1.00 42.13 H new ATOM 0 HD13 ILE B 119 7.061 -10.143 27.968 1.00 42.13 H new ATOM 3686 N SER B 120 11.967 -10.750 24.958 1.00 51.33 N ATOM 3687 CA SER B 120 12.689 -11.974 24.884 1.00 53.21 C ATOM 3688 C SER B 120 13.862 -11.853 25.838 1.00 21.21 C ATOM 3689 O SER B 120 14.586 -10.849 25.800 1.00 1.34 O ATOM 3690 CB SER B 120 13.171 -12.195 23.442 1.00 24.54 C ATOM 3691 OG SER B 120 12.063 -12.179 22.524 1.00 43.44 O ATOM 0 H SER B 120 12.564 -9.923 24.951 1.00 51.33 H new ATOM 0 HA SER B 120 12.068 -12.826 25.160 1.00 53.21 H new ATOM 0 HB2 SER B 120 13.886 -11.418 23.170 1.00 24.54 H new ATOM 0 HB3 SER B 120 13.694 -13.149 23.371 1.00 24.54 H new ATOM 0 HG SER B 120 12.392 -12.320 21.612 1.00 43.44 H new ATOM 3697 N SER B 121 14.028 -12.816 26.709 1.00 51.22 N ATOM 3698 CA SER B 121 15.083 -12.755 27.684 1.00 3.30 C ATOM 3699 C SER B 121 16.465 -12.896 27.043 1.00 50.51 C ATOM 3700 O SER B 121 16.838 -13.974 26.565 1.00 42.23 O ATOM 3701 CB SER B 121 14.857 -13.791 28.801 1.00 74.20 C ATOM 3702 OG SER B 121 14.734 -15.115 28.285 1.00 1.35 O ATOM 0 H SER B 121 13.445 -13.651 26.762 1.00 51.22 H new ATOM 0 HA SER B 121 15.055 -11.765 28.140 1.00 3.30 H new ATOM 0 HB2 SER B 121 15.688 -13.752 29.505 1.00 74.20 H new ATOM 0 HB3 SER B 121 13.956 -13.534 29.357 1.00 74.20 H new ATOM 0 HG SER B 121 15.384 -15.247 27.564 1.00 1.35 H new ATOM 3708 N THR B 122 17.193 -11.801 26.987 1.00 13.51 N ATOM 3709 CA THR B 122 18.534 -11.819 26.488 1.00 61.54 C ATOM 3710 C THR B 122 19.442 -12.326 27.612 1.00 63.42 C ATOM 3711 O THR B 122 19.944 -11.554 28.434 1.00 62.55 O ATOM 3712 CB THR B 122 18.966 -10.408 26.027 1.00 3.02 C ATOM 3713 OG1 THR B 122 17.966 -9.879 25.121 1.00 22.31 O ATOM 3714 CG2 THR B 122 20.306 -10.461 25.308 1.00 61.42 C ATOM 0 H THR B 122 16.866 -10.882 27.287 1.00 13.51 H new ATOM 0 HA THR B 122 18.606 -12.476 25.621 1.00 61.54 H new ATOM 0 HB THR B 122 19.063 -9.769 26.904 1.00 3.02 H new ATOM 0 HG1 THR B 122 18.233 -8.983 24.826 1.00 22.31 H new ATOM 0 HG21 THR B 122 20.590 -9.457 24.993 1.00 61.42 H new ATOM 0 HG22 THR B 122 21.065 -10.858 25.982 1.00 61.42 H new ATOM 0 HG23 THR B 122 20.224 -11.106 24.433 1.00 61.42 H new ATOM 3722 N ASP B 123 19.556 -13.625 27.688 1.00 30.14 N ATOM 3723 CA ASP B 123 20.269 -14.280 28.754 1.00 24.10 C ATOM 3724 C ASP B 123 20.812 -15.586 28.227 1.00 53.34 C ATOM 3725 O ASP B 123 20.277 -16.126 27.253 1.00 14.53 O ATOM 3726 CB ASP B 123 19.290 -14.520 29.921 1.00 24.34 C ATOM 3727 CG ASP B 123 19.912 -15.175 31.127 1.00 55.55 C ATOM 3728 OD1 ASP B 123 20.621 -14.487 31.879 1.00 13.20 O ATOM 3729 OD2 ASP B 123 19.694 -16.383 31.341 1.00 42.10 O ATOM 0 H ASP B 123 19.152 -14.266 27.005 1.00 30.14 H new ATOM 0 HA ASP B 123 21.099 -13.670 29.112 1.00 24.10 H new ATOM 0 HB2 ASP B 123 18.861 -13.564 30.222 1.00 24.34 H new ATOM 0 HB3 ASP B 123 18.468 -15.142 29.568 1.00 24.34 H new ATOM 3734 N ARG B 124 21.864 -16.076 28.814 1.00 11.13 N ATOM 3735 CA ARG B 124 22.475 -17.306 28.373 1.00 61.23 C ATOM 3736 C ARG B 124 22.553 -18.330 29.501 1.00 24.10 C ATOM 3737 O ARG B 124 23.456 -18.241 30.342 1.00 37.93 O ATOM 3738 CB ARG B 124 23.855 -17.052 27.728 1.00 21.44 C ATOM 3739 CG ARG B 124 24.817 -16.222 28.573 1.00 54.53 C ATOM 3740 CD ARG B 124 26.148 -16.921 28.735 1.00 24.21 C ATOM 3741 NE ARG B 124 26.001 -18.189 29.452 1.00 14.31 N ATOM 3742 CZ ARG B 124 26.976 -19.077 29.651 1.00 73.05 C ATOM 3743 NH1 ARG B 124 28.185 -18.880 29.115 1.00 20.54 N ATOM 3744 NH2 ARG B 124 26.734 -20.162 30.375 1.00 52.31 N ATOM 3745 OXT ARG B 124 21.721 -19.251 29.543 1.00 37.93 O ATOM 0 H ARG B 124 22.326 -15.639 29.611 1.00 11.13 H new ATOM 0 HA ARG B 124 21.834 -17.732 27.601 1.00 61.23 H new ATOM 0 HB2 ARG B 124 24.321 -18.013 27.512 1.00 21.44 H new ATOM 0 HB3 ARG B 124 23.706 -16.548 26.773 1.00 21.44 H new ATOM 0 HG2 ARG B 124 24.969 -15.249 28.105 1.00 54.53 H new ATOM 0 HG3 ARG B 124 24.378 -16.039 29.554 1.00 54.53 H new ATOM 0 HD2 ARG B 124 26.586 -17.105 27.754 1.00 24.21 H new ATOM 0 HD3 ARG B 124 26.838 -16.273 29.276 1.00 24.21 H new ATOM 0 HE ARG B 124 25.080 -18.411 29.829 1.00 14.31 H new ATOM 0 HH11 ARG B 124 28.364 -18.049 28.552 1.00 20.54 H new ATOM 0 HH12 ARG B 124 28.928 -19.561 29.269 1.00 20.54 H new ATOM 0 HH21 ARG B 124 25.808 -20.312 30.775 1.00 52.31 H new ATOM 0 HH22 ARG B 124 27.474 -20.846 30.532 1.00 52.31 H new TER 3759 ARG B 124