USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=64 USER MOD reduce.3.24.130724 removed 1828 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 81 CYS SG : rot 78:sc= 1.22 USER MOD Set 1.2: B 110 THR OG1 : rot 58:sc= 0.957 USER MOD Set 2.1: A 101 LYS NZ :NH3+ 176:sc= 0.672 (180deg=0.646) USER MOD Set 2.2: B 101 LYS NZ :NH3+ 174:sc= 0.904 (180deg=0.83) USER MOD Set 3.1: B 47 THR OG1 : rot 180:sc=-0.00108 USER MOD Set 3.2: B 49 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: B 28 LYS NZ :NH3+ -123:sc= 1.77 (180deg=0.159) USER MOD Set 4.2: B 29 ASN : amide:sc= 1.02 K(o=2.8,f=-7.4) USER MOD Set 5.1: A 81 CYS SG : rot 79:sc= 1.23 USER MOD Set 5.2: A 110 THR OG1 : rot 59:sc= 0.935 USER MOD Set 6.1: A 47 THR OG1 : rot 180:sc=-0.00355 USER MOD Set 6.2: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 28 LYS NZ :NH3+ -119:sc= 1.65 (180deg=0.113) USER MOD Set 7.2: A 29 ASN : amide:sc= 1.08 K(o=2.7,f=-7.6) USER MOD Single : A 2 SER OG : rot 180:sc= -0.16 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 60:sc= 0.00804 USER MOD Single : A 9 SER OG : rot 68:sc= -0.0605 USER MOD Single : A 12 LYS NZ :NH3+ -174:sc= 0.653 (180deg=0.603) USER MOD Single : A 18 LYS NZ :NH3+ 155:sc= 0.168 (180deg=-0.629) USER MOD Single : A 22 CYS SG : rot 57:sc= 1.3 USER MOD Single : A 23 MET CE :methyl -144:sc= -0.0934 (180deg=-1.86!) USER MOD Single : A 24 SER OG : rot 25:sc= -0.3 USER MOD Single : A 26 THR OG1 : rot -129:sc= 0.041 USER MOD Single : A 30 MET CE :methyl 161:sc= 0 (180deg=-0.5) USER MOD Single : A 37 SER OG : rot 73:sc= 0.204 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot -147:sc= 0.319 USER MOD Single : A 53 LYS NZ :NH3+ -146:sc= 1.13 (180deg=-0.719) USER MOD Single : A 57 TYR OH : rot -7:sc= 0.761 USER MOD Single : A 58 CYS SG : rot 75:sc= 0.734 USER MOD Single : A 60 HIS : no HD1:sc= -0.0863 X(o=-0.086,f=-0.47) USER MOD Single : A 61 HIS : no HE2:sc= 0.551 K(o=0.55,f=-3.9!) USER MOD Single : A 62 HIS : no HD1:sc= -0.638 K(o=-0.64,f=-2.9!) USER MOD Single : A 63 GLN : amide:sc= -0.0223 X(o=-0.022,f=-0.33) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=-0.0092) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 88:sc= 0.265 USER MOD Single : A 82 LYS NZ :NH3+ -171:sc= 0.567 (180deg=0.53) USER MOD Single : A 85 GLN : amide:sc= 0.306 X(o=0.31,f=-0.058) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -0.248 X(o=-0.25,f=-0.54) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 81:sc= 1.04 USER MOD Single : A 108 CYS SG : rot 79:sc= 0.961 USER MOD Single : A 109 LYS NZ :NH3+ -145:sc= 0.512 (180deg=-0.243) USER MOD Single : A 113 ASN : amide:sc= 0.645 K(o=0.65,f=-0.023) USER MOD Single : A 114 MET CE :methyl 174:sc= -0.731 (180deg=-0.809) USER MOD Single : B 2 SER OG : rot 180:sc= -0.0816 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot 63:sc= 0.0193 USER MOD Single : B 9 SER OG : rot 73:sc= 0.00336 USER MOD Single : B 12 LYS NZ :NH3+ -171:sc= 0.615 (180deg=0.545) USER MOD Single : B 18 LYS NZ :NH3+ 154:sc= 0.3 (180deg=-0.256) USER MOD Single : B 22 CYS SG : rot 66:sc= 1.26 USER MOD Single : B 23 MET CE :methyl -145:sc= -0.11 (180deg=-1.87!) USER MOD Single : B 24 SER OG : rot 22:sc= -0.352 USER MOD Single : B 26 THR OG1 : rot -129:sc= 0.0443 USER MOD Single : B 30 MET CE :methyl 160:sc= 0 (180deg=-0.543) USER MOD Single : B 37 SER OG : rot 70:sc= 0.189 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 48 SER OG : rot -146:sc= 0.336 USER MOD Single : B 53 LYS NZ :NH3+ -134:sc= 1.18 (180deg=-0.687) USER MOD Single : B 57 TYR OH : rot -7:sc= 0.846 USER MOD Single : B 58 CYS SG : rot 77:sc= 0.776 USER MOD Single : B 60 HIS : no HD1:sc= -0.0453 X(o=-0.045,f=-0.46) USER MOD Single : B 61 HIS : no HE2:sc= 0.699 K(o=0.7,f=-3.9!) USER MOD Single : B 62 HIS : no HD1:sc= -0.492 K(o=-0.49,f=-3.1!) USER MOD Single : B 63 GLN : amide:sc= -0.0461 X(o=-0.046,f=-0.31) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=-0.0066) USER MOD Single : B 68 SER OG : rot 180:sc= 0 USER MOD Single : B 76 TYR OH : rot -141:sc= 0.276 USER MOD Single : B 82 LYS NZ :NH3+ -169:sc= 0.486 (180deg=0.439) USER MOD Single : B 85 GLN : amide:sc= 0.365 X(o=0.36,f=-0.053) USER MOD Single : B 87 THR OG1 : rot 180:sc= 0 USER MOD Single : B 96 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : B 97 TYR OH : rot 180:sc= 0 USER MOD Single : B 107 THR OG1 : rot 82:sc= 1.02 USER MOD Single : B 108 CYS SG : rot 79:sc= 0.464 USER MOD Single : B 109 LYS NZ :NH3+ -138:sc= 0.388 (180deg=-0.419) USER MOD Single : B 113 ASN : amide:sc= 0.561 K(o=0.56,f=-0.039) USER MOD Single : B 114 MET CE :methyl 174:sc= -0.635 (180deg=-0.773) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -17.577 -13.745 -17.736 1.00 35.33 N ATOM 2 CA SER A 2 -18.647 -12.735 -17.597 1.00 11.25 C ATOM 3 C SER A 2 -18.200 -11.592 -16.677 1.00 0.42 C ATOM 4 O SER A 2 -17.154 -11.674 -16.010 1.00 42.31 O ATOM 5 CB SER A 2 -19.938 -13.400 -17.065 1.00 15.04 C ATOM 6 OG SER A 2 -21.011 -12.469 -16.965 1.00 54.33 O ATOM 0 HA SER A 2 -18.856 -12.310 -18.579 1.00 11.25 H new ATOM 0 HB2 SER A 2 -20.226 -14.216 -17.728 1.00 15.04 H new ATOM 0 HB3 SER A 2 -19.744 -13.838 -16.086 1.00 15.04 H new ATOM 0 HG SER A 2 -21.810 -12.925 -16.627 1.00 54.33 H new ATOM 14 N LEU A 3 -19.012 -10.524 -16.647 1.00 10.11 N ATOM 15 CA LEU A 3 -18.763 -9.336 -15.824 1.00 63.11 C ATOM 16 C LEU A 3 -19.241 -9.577 -14.373 1.00 53.23 C ATOM 17 O LEU A 3 -20.428 -9.858 -14.145 1.00 71.33 O ATOM 18 CB LEU A 3 -19.497 -8.111 -16.435 1.00 14.43 C ATOM 19 CG LEU A 3 -19.164 -7.773 -17.926 1.00 13.23 C ATOM 20 CD1 LEU A 3 -20.100 -6.666 -18.467 1.00 75.51 C ATOM 21 CD2 LEU A 3 -17.673 -7.387 -18.108 1.00 60.32 C ATOM 0 H LEU A 3 -19.867 -10.463 -17.199 1.00 10.11 H new ATOM 0 HA LEU A 3 -17.692 -9.136 -15.806 1.00 63.11 H new ATOM 0 HB2 LEU A 3 -20.571 -8.281 -16.355 1.00 14.43 H new ATOM 0 HB3 LEU A 3 -19.267 -7.236 -15.827 1.00 14.43 H new ATOM 0 HG LEU A 3 -19.337 -8.676 -18.512 1.00 13.23 H new ATOM 0 HD11 LEU A 3 -19.847 -6.451 -19.505 1.00 75.51 H new ATOM 0 HD12 LEU A 3 -21.135 -7.004 -18.408 1.00 75.51 H new ATOM 0 HD13 LEU A 3 -19.979 -5.763 -17.869 1.00 75.51 H new ATOM 0 HD21 LEU A 3 -17.481 -7.159 -19.157 1.00 60.32 H new ATOM 0 HD22 LEU A 3 -17.447 -6.511 -17.500 1.00 60.32 H new ATOM 0 HD23 LEU A 3 -17.041 -8.219 -17.796 1.00 60.32 H new ATOM 33 N VAL A 4 -18.303 -9.511 -13.408 1.00 54.01 N ATOM 34 CA VAL A 4 -18.629 -9.495 -11.971 1.00 2.22 C ATOM 35 C VAL A 4 -19.078 -8.073 -11.565 1.00 14.34 C ATOM 36 O VAL A 4 -18.407 -7.072 -11.864 1.00 53.31 O ATOM 37 CB VAL A 4 -17.436 -10.004 -11.069 1.00 4.40 C ATOM 38 CG1 VAL A 4 -17.165 -11.508 -11.326 1.00 43.10 C ATOM 39 CG2 VAL A 4 -16.146 -9.164 -11.271 1.00 50.12 C ATOM 0 H VAL A 4 -17.303 -9.468 -13.603 1.00 54.01 H new ATOM 0 HA VAL A 4 -19.447 -10.195 -11.802 1.00 2.22 H new ATOM 0 HB VAL A 4 -17.737 -9.875 -10.029 1.00 4.40 H new ATOM 0 HG11 VAL A 4 -16.340 -11.842 -10.696 1.00 43.10 H new ATOM 0 HG12 VAL A 4 -18.059 -12.085 -11.089 1.00 43.10 H new ATOM 0 HG13 VAL A 4 -16.905 -11.657 -12.374 1.00 43.10 H new ATOM 0 HG21 VAL A 4 -15.355 -9.552 -10.630 1.00 50.12 H new ATOM 0 HG22 VAL A 4 -15.831 -9.225 -12.313 1.00 50.12 H new ATOM 0 HG23 VAL A 4 -16.345 -8.124 -11.012 1.00 50.12 H new ATOM 49 N LYS A 5 -20.241 -8.011 -10.918 1.00 52.13 N ATOM 50 CA LYS A 5 -20.915 -6.760 -10.560 1.00 44.54 C ATOM 51 C LYS A 5 -20.382 -6.266 -9.209 1.00 11.45 C ATOM 52 O LYS A 5 -20.667 -6.865 -8.175 1.00 10.51 O ATOM 53 CB LYS A 5 -22.439 -7.028 -10.499 1.00 62.23 C ATOM 54 CG LYS A 5 -23.018 -7.690 -11.770 1.00 2.43 C ATOM 55 CD LYS A 5 -24.516 -8.014 -11.641 1.00 34.32 C ATOM 56 CE LYS A 5 -25.097 -8.649 -12.911 1.00 70.13 C ATOM 57 NZ LYS A 5 -26.536 -8.976 -12.746 1.00 73.01 N ATOM 0 H LYS A 5 -20.752 -8.843 -10.622 1.00 52.13 H new ATOM 0 HA LYS A 5 -20.721 -5.986 -11.302 1.00 44.54 H new ATOM 0 HB2 LYS A 5 -22.650 -7.667 -9.642 1.00 62.23 H new ATOM 0 HB3 LYS A 5 -22.956 -6.084 -10.327 1.00 62.23 H new ATOM 0 HG2 LYS A 5 -22.866 -7.027 -12.621 1.00 2.43 H new ATOM 0 HG3 LYS A 5 -22.469 -8.608 -11.979 1.00 2.43 H new ATOM 0 HD2 LYS A 5 -24.666 -8.691 -10.800 1.00 34.32 H new ATOM 0 HD3 LYS A 5 -25.063 -7.099 -11.415 1.00 34.32 H new ATOM 0 HE2 LYS A 5 -24.972 -7.965 -13.751 1.00 70.13 H new ATOM 0 HE3 LYS A 5 -24.542 -9.556 -13.153 1.00 70.13 H new ATOM 0 HZ1 LYS A 5 -26.898 -9.404 -13.622 1.00 73.01 H new ATOM 0 HZ2 LYS A 5 -26.652 -9.647 -11.960 1.00 73.01 H new ATOM 0 HZ3 LYS A 5 -27.068 -8.107 -12.540 1.00 73.01 H new ATOM 71 N LEU A 6 -19.558 -5.216 -9.233 1.00 45.34 N ATOM 72 CA LEU A 6 -18.910 -4.685 -8.027 1.00 4.05 C ATOM 73 C LEU A 6 -19.529 -3.335 -7.664 1.00 60.44 C ATOM 74 O LEU A 6 -19.164 -2.305 -8.244 1.00 71.45 O ATOM 75 CB LEU A 6 -17.376 -4.563 -8.257 1.00 3.12 C ATOM 76 CG LEU A 6 -16.645 -5.883 -8.670 1.00 0.33 C ATOM 77 CD1 LEU A 6 -15.143 -5.638 -8.932 1.00 2.35 C ATOM 78 CD2 LEU A 6 -16.865 -7.003 -7.621 1.00 70.45 C ATOM 0 H LEU A 6 -19.320 -4.709 -10.086 1.00 45.34 H new ATOM 0 HA LEU A 6 -19.069 -5.369 -7.193 1.00 4.05 H new ATOM 0 HB2 LEU A 6 -17.202 -3.815 -9.031 1.00 3.12 H new ATOM 0 HB3 LEU A 6 -16.919 -4.187 -7.342 1.00 3.12 H new ATOM 0 HG LEU A 6 -17.087 -6.223 -9.607 1.00 0.33 H new ATOM 0 HD11 LEU A 6 -14.666 -6.576 -9.217 1.00 2.35 H new ATOM 0 HD12 LEU A 6 -15.028 -4.913 -9.738 1.00 2.35 H new ATOM 0 HD13 LEU A 6 -14.674 -5.252 -8.027 1.00 2.35 H new ATOM 0 HD21 LEU A 6 -16.344 -7.906 -7.938 1.00 70.45 H new ATOM 0 HD22 LEU A 6 -16.475 -6.679 -6.656 1.00 70.45 H new ATOM 0 HD23 LEU A 6 -17.931 -7.212 -7.530 1.00 70.45 H new ATOM 90 N GLU A 7 -20.513 -3.350 -6.744 1.00 31.14 N ATOM 91 CA GLU A 7 -21.107 -2.109 -6.222 1.00 55.14 C ATOM 92 C GLU A 7 -20.097 -1.403 -5.325 1.00 55.01 C ATOM 93 O GLU A 7 -19.390 -2.045 -4.550 1.00 51.11 O ATOM 94 CB GLU A 7 -22.425 -2.340 -5.432 1.00 30.34 C ATOM 95 CG GLU A 7 -23.585 -2.893 -6.276 1.00 73.14 C ATOM 96 CD GLU A 7 -23.432 -4.384 -6.620 1.00 2.41 C ATOM 97 OE1 GLU A 7 -23.548 -5.212 -5.686 1.00 63.24 O ATOM 98 OE2 GLU A 7 -23.209 -4.729 -7.804 1.00 52.40 O ATOM 0 H GLU A 7 -20.910 -4.203 -6.350 1.00 31.14 H new ATOM 0 HA GLU A 7 -21.361 -1.494 -7.085 1.00 55.14 H new ATOM 0 HB2 GLU A 7 -22.226 -3.031 -4.613 1.00 30.34 H new ATOM 0 HB3 GLU A 7 -22.736 -1.396 -4.984 1.00 30.34 H new ATOM 0 HG2 GLU A 7 -24.520 -2.746 -5.736 1.00 73.14 H new ATOM 0 HG3 GLU A 7 -23.658 -2.320 -7.200 1.00 73.14 H new ATOM 105 N SER A 8 -20.020 -0.087 -5.462 1.00 34.55 N ATOM 106 CA SER A 8 -19.202 0.762 -4.594 1.00 3.41 C ATOM 107 C SER A 8 -19.948 1.077 -3.278 1.00 52.04 C ATOM 108 O SER A 8 -21.070 0.599 -3.051 1.00 2.51 O ATOM 109 CB SER A 8 -18.876 2.047 -5.373 1.00 70.32 C ATOM 110 OG SER A 8 -20.062 2.664 -5.860 1.00 2.21 O ATOM 0 H SER A 8 -20.525 0.429 -6.182 1.00 34.55 H new ATOM 0 HA SER A 8 -18.280 0.251 -4.318 1.00 3.41 H new ATOM 0 HB2 SER A 8 -18.340 2.742 -4.727 1.00 70.32 H new ATOM 0 HB3 SER A 8 -18.215 1.813 -6.207 1.00 70.32 H new ATOM 0 HG SER A 8 -20.645 2.892 -5.106 1.00 2.21 H new ATOM 116 N SER A 9 -19.308 1.879 -2.418 1.00 51.40 N ATOM 117 CA SER A 9 -19.940 2.457 -1.214 1.00 52.13 C ATOM 118 C SER A 9 -21.098 3.415 -1.598 1.00 14.11 C ATOM 119 O SER A 9 -22.046 3.611 -0.831 1.00 30.32 O ATOM 120 CB SER A 9 -18.878 3.207 -0.388 1.00 45.22 C ATOM 121 OG SER A 9 -17.767 2.375 -0.110 1.00 2.02 O ATOM 0 H SER A 9 -18.331 2.150 -2.534 1.00 51.40 H new ATOM 0 HA SER A 9 -20.361 1.648 -0.617 1.00 52.13 H new ATOM 0 HB2 SER A 9 -18.547 4.091 -0.933 1.00 45.22 H new ATOM 0 HB3 SER A 9 -19.319 3.555 0.546 1.00 45.22 H new ATOM 0 HG SER A 9 -17.281 2.190 -0.941 1.00 2.02 H new ATOM 127 N ASP A 10 -21.000 3.984 -2.817 1.00 4.04 N ATOM 128 CA ASP A 10 -22.031 4.863 -3.414 1.00 24.11 C ATOM 129 C ASP A 10 -23.063 4.029 -4.226 1.00 52.43 C ATOM 130 O ASP A 10 -23.845 4.574 -4.996 1.00 14.44 O ATOM 131 CB ASP A 10 -21.306 5.922 -4.290 1.00 40.44 C ATOM 132 CG ASP A 10 -22.215 7.033 -4.869 1.00 70.43 C ATOM 133 OD1 ASP A 10 -22.453 7.052 -6.097 1.00 53.30 O ATOM 134 OD2 ASP A 10 -22.686 7.895 -4.100 1.00 34.21 O ATOM 0 H ASP A 10 -20.192 3.845 -3.424 1.00 4.04 H new ATOM 0 HA ASP A 10 -22.600 5.373 -2.637 1.00 24.11 H new ATOM 0 HB2 ASP A 10 -20.523 6.390 -3.693 1.00 40.44 H new ATOM 0 HB3 ASP A 10 -20.813 5.410 -5.117 1.00 40.44 H new ATOM 139 N GLU A 11 -23.025 2.686 -4.043 1.00 24.22 N ATOM 140 CA GLU A 11 -24.034 1.713 -4.558 1.00 74.51 C ATOM 141 C GLU A 11 -24.002 1.537 -6.100 1.00 62.31 C ATOM 142 O GLU A 11 -24.797 0.766 -6.647 1.00 42.35 O ATOM 143 CB GLU A 11 -25.478 2.072 -4.075 1.00 0.44 C ATOM 144 CG GLU A 11 -25.646 2.157 -2.542 1.00 61.21 C ATOM 145 CD GLU A 11 -27.074 2.547 -2.108 1.00 11.23 C ATOM 146 OE1 GLU A 11 -27.818 1.689 -1.588 1.00 63.10 O ATOM 147 OE2 GLU A 11 -27.461 3.714 -2.305 1.00 54.32 O ATOM 0 H GLU A 11 -22.275 2.233 -3.521 1.00 24.22 H new ATOM 0 HA GLU A 11 -23.750 0.751 -4.132 1.00 74.51 H new ATOM 0 HB2 GLU A 11 -25.764 3.029 -4.511 1.00 0.44 H new ATOM 0 HB3 GLU A 11 -26.171 1.325 -4.462 1.00 0.44 H new ATOM 0 HG2 GLU A 11 -25.389 1.194 -2.101 1.00 61.21 H new ATOM 0 HG3 GLU A 11 -24.941 2.887 -2.146 1.00 61.21 H new ATOM 154 N LYS A 12 -23.069 2.221 -6.794 1.00 1.13 N ATOM 155 CA LYS A 12 -22.958 2.151 -8.266 1.00 13.14 C ATOM 156 C LYS A 12 -22.378 0.789 -8.687 1.00 71.32 C ATOM 157 O LYS A 12 -21.275 0.434 -8.256 1.00 30.34 O ATOM 158 CB LYS A 12 -22.068 3.305 -8.805 1.00 43.03 C ATOM 159 CG LYS A 12 -22.652 4.722 -8.630 1.00 54.30 C ATOM 160 CD LYS A 12 -23.925 4.959 -9.469 1.00 42.11 C ATOM 161 CE LYS A 12 -24.422 6.410 -9.389 1.00 41.14 C ATOM 162 NZ LYS A 12 -24.734 6.831 -7.998 1.00 24.02 N ATOM 0 H LYS A 12 -22.379 2.831 -6.356 1.00 1.13 H new ATOM 0 HA LYS A 12 -23.955 2.259 -8.694 1.00 13.14 H new ATOM 0 HB2 LYS A 12 -21.102 3.263 -8.302 1.00 43.03 H new ATOM 0 HB3 LYS A 12 -21.883 3.134 -9.865 1.00 43.03 H new ATOM 0 HG2 LYS A 12 -22.882 4.886 -7.577 1.00 54.30 H new ATOM 0 HG3 LYS A 12 -21.897 5.457 -8.910 1.00 54.30 H new ATOM 0 HD2 LYS A 12 -23.723 4.705 -10.509 1.00 42.11 H new ATOM 0 HD3 LYS A 12 -24.713 4.289 -9.125 1.00 42.11 H new ATOM 0 HE2 LYS A 12 -23.663 7.074 -9.804 1.00 41.14 H new ATOM 0 HE3 LYS A 12 -25.314 6.519 -10.007 1.00 41.14 H new ATOM 0 HZ1 LYS A 12 -25.160 7.780 -8.010 1.00 24.02 H new ATOM 0 HZ2 LYS A 12 -25.402 6.157 -7.573 1.00 24.02 H new ATOM 0 HZ3 LYS A 12 -23.859 6.852 -7.437 1.00 24.02 H new ATOM 176 N VAL A 13 -23.133 0.054 -9.521 1.00 34.32 N ATOM 177 CA VAL A 13 -22.743 -1.272 -10.022 1.00 63.34 C ATOM 178 C VAL A 13 -21.673 -1.114 -11.120 1.00 62.15 C ATOM 179 O VAL A 13 -21.972 -0.604 -12.202 1.00 63.52 O ATOM 180 CB VAL A 13 -23.989 -2.046 -10.609 1.00 61.30 C ATOM 181 CG1 VAL A 13 -23.602 -3.468 -11.085 1.00 21.50 C ATOM 182 CG2 VAL A 13 -25.155 -2.086 -9.588 1.00 72.24 C ATOM 0 H VAL A 13 -24.039 0.368 -9.869 1.00 34.32 H new ATOM 0 HA VAL A 13 -22.340 -1.849 -9.189 1.00 63.34 H new ATOM 0 HB VAL A 13 -24.336 -1.496 -11.484 1.00 61.30 H new ATOM 0 HG11 VAL A 13 -24.483 -3.971 -11.483 1.00 21.50 H new ATOM 0 HG12 VAL A 13 -22.843 -3.397 -11.864 1.00 21.50 H new ATOM 0 HG13 VAL A 13 -23.207 -4.038 -10.244 1.00 21.50 H new ATOM 0 HG21 VAL A 13 -25.998 -2.625 -10.020 1.00 72.24 H new ATOM 0 HG22 VAL A 13 -24.827 -2.593 -8.681 1.00 72.24 H new ATOM 0 HG23 VAL A 13 -25.461 -1.068 -9.345 1.00 72.24 H new ATOM 192 N PHE A 14 -20.429 -1.506 -10.811 1.00 24.22 N ATOM 193 CA PHE A 14 -19.315 -1.524 -11.773 1.00 12.02 C ATOM 194 C PHE A 14 -19.055 -2.968 -12.223 1.00 33.05 C ATOM 195 O PHE A 14 -18.325 -3.724 -11.565 1.00 11.51 O ATOM 196 CB PHE A 14 -18.045 -0.887 -11.155 1.00 1.22 C ATOM 197 CG PHE A 14 -18.181 0.612 -10.898 1.00 34.11 C ATOM 198 CD1 PHE A 14 -18.081 1.522 -11.952 1.00 4.02 C ATOM 199 CD2 PHE A 14 -18.428 1.112 -9.619 1.00 42.22 C ATOM 200 CE1 PHE A 14 -18.224 2.876 -11.736 1.00 64.43 C ATOM 201 CE2 PHE A 14 -18.565 2.467 -9.406 1.00 55.11 C ATOM 202 CZ PHE A 14 -18.465 3.350 -10.465 1.00 41.44 C ATOM 0 H PHE A 14 -20.164 -1.823 -9.878 1.00 24.22 H new ATOM 0 HA PHE A 14 -19.582 -0.929 -12.646 1.00 12.02 H new ATOM 0 HB2 PHE A 14 -17.816 -1.390 -10.215 1.00 1.22 H new ATOM 0 HB3 PHE A 14 -17.200 -1.058 -11.822 1.00 1.22 H new ATOM 0 HD1 PHE A 14 -17.889 1.160 -12.951 1.00 4.02 H new ATOM 0 HD2 PHE A 14 -18.513 0.430 -8.786 1.00 42.22 H new ATOM 0 HE1 PHE A 14 -18.147 3.566 -12.564 1.00 64.43 H new ATOM 0 HE2 PHE A 14 -18.751 2.840 -8.410 1.00 55.11 H new ATOM 0 HZ PHE A 14 -18.576 4.411 -10.296 1.00 41.44 H new ATOM 212 N GLU A 15 -19.719 -3.349 -13.320 1.00 15.00 N ATOM 213 CA GLU A 15 -19.537 -4.653 -13.960 1.00 23.13 C ATOM 214 C GLU A 15 -18.206 -4.666 -14.741 1.00 42.03 C ATOM 215 O GLU A 15 -18.017 -3.882 -15.681 1.00 53.50 O ATOM 216 CB GLU A 15 -20.724 -4.959 -14.906 1.00 3.14 C ATOM 217 CG GLU A 15 -22.106 -4.955 -14.230 1.00 42.35 C ATOM 218 CD GLU A 15 -23.234 -5.399 -15.177 1.00 54.21 C ATOM 219 OE1 GLU A 15 -23.768 -4.547 -15.918 1.00 65.43 O ATOM 220 OE2 GLU A 15 -23.587 -6.596 -15.193 1.00 4.21 O ATOM 0 H GLU A 15 -20.402 -2.756 -13.791 1.00 15.00 H new ATOM 0 HA GLU A 15 -19.505 -5.426 -13.192 1.00 23.13 H new ATOM 0 HB2 GLU A 15 -20.727 -4.225 -15.711 1.00 3.14 H new ATOM 0 HB3 GLU A 15 -20.562 -5.934 -15.365 1.00 3.14 H new ATOM 0 HG2 GLU A 15 -22.084 -5.616 -13.364 1.00 42.35 H new ATOM 0 HG3 GLU A 15 -22.322 -3.953 -13.860 1.00 42.35 H new ATOM 227 N ILE A 16 -17.282 -5.534 -14.319 1.00 30.20 N ATOM 228 CA ILE A 16 -15.962 -5.687 -14.950 1.00 75.42 C ATOM 229 C ILE A 16 -15.647 -7.184 -15.078 1.00 62.34 C ATOM 230 O ILE A 16 -16.192 -7.975 -14.312 1.00 20.01 O ATOM 231 CB ILE A 16 -14.865 -4.932 -14.108 1.00 11.31 C ATOM 232 CG1 ILE A 16 -13.504 -4.900 -14.868 1.00 32.11 C ATOM 233 CG2 ILE A 16 -14.710 -5.545 -12.687 1.00 21.54 C ATOM 234 CD1 ILE A 16 -12.431 -4.069 -14.206 1.00 45.00 C ATOM 0 H ILE A 16 -17.427 -6.156 -13.524 1.00 30.20 H new ATOM 0 HA ILE A 16 -15.967 -5.244 -15.946 1.00 75.42 H new ATOM 0 HB ILE A 16 -15.199 -3.903 -13.977 1.00 11.31 H new ATOM 0 HG12 ILE A 16 -13.139 -5.922 -14.975 1.00 32.11 H new ATOM 0 HG13 ILE A 16 -13.674 -4.515 -15.874 1.00 32.11 H new ATOM 0 HG21 ILE A 16 -13.945 -4.998 -12.136 1.00 21.54 H new ATOM 0 HG22 ILE A 16 -15.659 -5.476 -12.155 1.00 21.54 H new ATOM 0 HG23 ILE A 16 -14.417 -6.592 -12.772 1.00 21.54 H new ATOM 0 HD11 ILE A 16 -11.521 -4.106 -14.805 1.00 45.00 H new ATOM 0 HD12 ILE A 16 -12.770 -3.036 -14.123 1.00 45.00 H new ATOM 0 HD13 ILE A 16 -12.227 -4.464 -13.211 1.00 45.00 H new ATOM 246 N GLU A 17 -14.804 -7.572 -16.063 1.00 43.14 N ATOM 247 CA GLU A 17 -14.464 -8.989 -16.318 1.00 51.44 C ATOM 248 C GLU A 17 -13.915 -9.665 -15.043 1.00 65.23 C ATOM 249 O GLU A 17 -13.112 -9.067 -14.309 1.00 70.33 O ATOM 250 CB GLU A 17 -13.419 -9.132 -17.457 1.00 21.05 C ATOM 251 CG GLU A 17 -13.764 -8.421 -18.787 1.00 24.04 C ATOM 252 CD GLU A 17 -12.706 -8.658 -19.898 1.00 52.34 C ATOM 253 OE1 GLU A 17 -13.085 -8.968 -21.048 1.00 23.42 O ATOM 254 OE2 GLU A 17 -11.492 -8.535 -19.621 1.00 41.41 O ATOM 0 H GLU A 17 -14.345 -6.918 -16.697 1.00 43.14 H new ATOM 0 HA GLU A 17 -15.386 -9.483 -16.623 1.00 51.44 H new ATOM 0 HB2 GLU A 17 -12.465 -8.746 -17.098 1.00 21.05 H new ATOM 0 HB3 GLU A 17 -13.277 -10.193 -17.662 1.00 21.05 H new ATOM 0 HG2 GLU A 17 -14.735 -8.771 -19.138 1.00 24.04 H new ATOM 0 HG3 GLU A 17 -13.858 -7.350 -18.606 1.00 24.04 H new ATOM 261 N LYS A 18 -14.362 -10.907 -14.809 1.00 12.01 N ATOM 262 CA LYS A 18 -13.943 -11.731 -13.659 1.00 60.13 C ATOM 263 C LYS A 18 -12.411 -11.923 -13.646 1.00 44.31 C ATOM 264 O LYS A 18 -11.774 -11.851 -12.589 1.00 10.11 O ATOM 265 CB LYS A 18 -14.668 -13.105 -13.725 1.00 64.11 C ATOM 266 CG LYS A 18 -14.320 -14.084 -12.581 1.00 54.43 C ATOM 267 CD LYS A 18 -14.949 -15.480 -12.787 1.00 34.13 C ATOM 268 CE LYS A 18 -14.492 -16.501 -11.735 1.00 71.51 C ATOM 269 NZ LYS A 18 -14.996 -17.869 -12.034 1.00 32.21 N ATOM 0 H LYS A 18 -15.032 -11.376 -15.418 1.00 12.01 H new ATOM 0 HA LYS A 18 -14.218 -11.221 -12.736 1.00 60.13 H new ATOM 0 HB2 LYS A 18 -15.744 -12.931 -13.719 1.00 64.11 H new ATOM 0 HB3 LYS A 18 -14.427 -13.581 -14.676 1.00 64.11 H new ATOM 0 HG2 LYS A 18 -13.237 -14.184 -12.509 1.00 54.43 H new ATOM 0 HG3 LYS A 18 -14.666 -13.669 -11.634 1.00 54.43 H new ATOM 0 HD2 LYS A 18 -16.035 -15.392 -12.754 1.00 34.13 H new ATOM 0 HD3 LYS A 18 -14.689 -15.847 -13.780 1.00 34.13 H new ATOM 0 HE2 LYS A 18 -13.403 -16.516 -11.693 1.00 71.51 H new ATOM 0 HE3 LYS A 18 -14.844 -16.191 -10.751 1.00 71.51 H new ATOM 0 HZ1 LYS A 18 -14.367 -18.574 -11.599 1.00 32.21 H new ATOM 0 HZ2 LYS A 18 -15.956 -17.977 -11.649 1.00 32.21 H new ATOM 0 HZ3 LYS A 18 -15.018 -18.014 -13.064 1.00 32.21 H new ATOM 283 N GLU A 19 -11.848 -12.122 -14.851 1.00 12.13 N ATOM 284 CA GLU A 19 -10.397 -12.332 -15.065 1.00 2.01 C ATOM 285 C GLU A 19 -9.559 -11.090 -14.676 1.00 13.33 C ATOM 286 O GLU A 19 -8.387 -11.220 -14.291 1.00 32.53 O ATOM 287 CB GLU A 19 -10.150 -12.742 -16.545 1.00 54.41 C ATOM 288 CG GLU A 19 -10.739 -11.772 -17.593 1.00 73.03 C ATOM 289 CD GLU A 19 -10.750 -12.356 -19.014 1.00 11.24 C ATOM 290 OE1 GLU A 19 -9.684 -12.410 -19.656 1.00 74.15 O ATOM 291 OE2 GLU A 19 -11.824 -12.777 -19.495 1.00 73.33 O ATOM 0 H GLU A 19 -12.389 -12.143 -15.715 1.00 12.13 H new ATOM 0 HA GLU A 19 -10.067 -13.137 -14.408 1.00 2.01 H new ATOM 0 HB2 GLU A 19 -9.076 -12.824 -16.710 1.00 54.41 H new ATOM 0 HB3 GLU A 19 -10.574 -13.733 -16.709 1.00 54.41 H new ATOM 0 HG2 GLU A 19 -11.758 -11.511 -17.306 1.00 73.03 H new ATOM 0 HG3 GLU A 19 -10.160 -10.848 -17.590 1.00 73.03 H new ATOM 298 N ILE A 20 -10.172 -9.893 -14.776 1.00 52.44 N ATOM 299 CA ILE A 20 -9.542 -8.629 -14.355 1.00 23.41 C ATOM 300 C ILE A 20 -9.570 -8.508 -12.815 1.00 52.14 C ATOM 301 O ILE A 20 -8.571 -8.119 -12.189 1.00 34.45 O ATOM 302 CB ILE A 20 -10.253 -7.377 -14.988 1.00 5.33 C ATOM 303 CG1 ILE A 20 -10.248 -7.435 -16.545 1.00 23.44 C ATOM 304 CG2 ILE A 20 -9.590 -6.080 -14.503 1.00 43.24 C ATOM 305 CD1 ILE A 20 -10.876 -6.230 -17.246 1.00 42.53 C ATOM 0 H ILE A 20 -11.114 -9.777 -15.150 1.00 52.44 H new ATOM 0 HA ILE A 20 -8.511 -8.648 -14.709 1.00 23.41 H new ATOM 0 HB ILE A 20 -11.292 -7.391 -14.659 1.00 5.33 H new ATOM 0 HG12 ILE A 20 -9.217 -7.536 -16.885 1.00 23.44 H new ATOM 0 HG13 ILE A 20 -10.777 -8.334 -16.860 1.00 23.44 H new ATOM 0 HG21 ILE A 20 -10.095 -5.224 -14.951 1.00 43.24 H new ATOM 0 HG22 ILE A 20 -9.664 -6.018 -13.417 1.00 43.24 H new ATOM 0 HG23 ILE A 20 -8.540 -6.076 -14.796 1.00 43.24 H new ATOM 0 HD11 ILE A 20 -10.822 -6.368 -18.326 1.00 42.53 H new ATOM 0 HD12 ILE A 20 -11.919 -6.136 -16.944 1.00 42.53 H new ATOM 0 HD13 ILE A 20 -10.335 -5.325 -16.969 1.00 42.53 H new ATOM 317 N ALA A 21 -10.728 -8.850 -12.225 1.00 20.12 N ATOM 318 CA ALA A 21 -10.955 -8.779 -10.760 1.00 11.23 C ATOM 319 C ALA A 21 -10.004 -9.704 -9.960 1.00 45.51 C ATOM 320 O ALA A 21 -9.834 -9.530 -8.745 1.00 53.34 O ATOM 321 CB ALA A 21 -12.423 -9.107 -10.455 1.00 64.20 C ATOM 0 H ALA A 21 -11.538 -9.185 -12.746 1.00 20.12 H new ATOM 0 HA ALA A 21 -10.730 -7.762 -10.438 1.00 11.23 H new ATOM 0 HB1 ALA A 21 -12.591 -9.055 -9.379 1.00 64.20 H new ATOM 0 HB2 ALA A 21 -13.069 -8.388 -10.958 1.00 64.20 H new ATOM 0 HB3 ALA A 21 -12.653 -10.111 -10.810 1.00 64.20 H new ATOM 327 N CYS A 22 -9.393 -10.678 -10.658 1.00 30.00 N ATOM 328 CA CYS A 22 -8.416 -11.615 -10.076 1.00 22.14 C ATOM 329 C CYS A 22 -7.065 -10.931 -9.740 1.00 64.24 C ATOM 330 O CYS A 22 -6.321 -11.428 -8.888 1.00 74.30 O ATOM 331 CB CYS A 22 -8.196 -12.789 -11.048 1.00 32.14 C ATOM 332 SG CYS A 22 -9.715 -13.663 -11.502 1.00 75.23 S ATOM 0 H CYS A 22 -9.565 -10.838 -11.651 1.00 30.00 H new ATOM 0 HA CYS A 22 -8.824 -11.981 -9.134 1.00 22.14 H new ATOM 0 HB2 CYS A 22 -7.721 -12.413 -11.954 1.00 32.14 H new ATOM 0 HB3 CYS A 22 -7.503 -13.498 -10.595 1.00 32.14 H new ATOM 0 HG CYS A 22 -10.565 -12.821 -12.010 1.00 75.23 H new ATOM 338 N MET A 23 -6.748 -9.803 -10.421 1.00 15.33 N ATOM 339 CA MET A 23 -5.502 -9.021 -10.170 1.00 62.30 C ATOM 340 C MET A 23 -5.556 -8.342 -8.791 1.00 14.12 C ATOM 341 O MET A 23 -4.521 -8.118 -8.147 1.00 64.45 O ATOM 342 CB MET A 23 -5.273 -7.950 -11.265 1.00 3.51 C ATOM 343 CG MET A 23 -5.147 -8.499 -12.692 1.00 62.44 C ATOM 344 SD MET A 23 -4.650 -7.242 -13.895 1.00 0.33 S ATOM 345 CE MET A 23 -5.921 -5.991 -13.691 1.00 43.45 C ATOM 0 H MET A 23 -7.339 -9.409 -11.153 1.00 15.33 H new ATOM 0 HA MET A 23 -4.669 -9.723 -10.195 1.00 62.30 H new ATOM 0 HB2 MET A 23 -6.100 -7.240 -11.236 1.00 3.51 H new ATOM 0 HB3 MET A 23 -4.367 -7.394 -11.024 1.00 3.51 H new ATOM 0 HG2 MET A 23 -4.418 -9.309 -12.700 1.00 62.44 H new ATOM 0 HG3 MET A 23 -6.102 -8.927 -12.996 1.00 62.44 H new ATOM 0 HE1 MET A 23 -6.151 -5.545 -14.659 1.00 43.45 H new ATOM 0 HE2 MET A 23 -6.820 -6.450 -13.280 1.00 43.45 H new ATOM 0 HE3 MET A 23 -5.564 -5.218 -13.011 1.00 43.45 H new ATOM 355 N SER A 24 -6.774 -7.990 -8.370 1.00 62.22 N ATOM 356 CA SER A 24 -7.041 -7.536 -7.009 1.00 53.04 C ATOM 357 C SER A 24 -6.996 -8.756 -6.084 1.00 2.42 C ATOM 358 O SER A 24 -7.825 -9.654 -6.231 1.00 53.54 O ATOM 359 CB SER A 24 -8.424 -6.849 -6.935 1.00 14.31 C ATOM 360 OG SER A 24 -8.755 -6.495 -5.604 1.00 14.34 O ATOM 0 H SER A 24 -7.601 -8.013 -8.966 1.00 62.22 H new ATOM 0 HA SER A 24 -6.291 -6.807 -6.700 1.00 53.04 H new ATOM 0 HB2 SER A 24 -8.422 -5.957 -7.561 1.00 14.31 H new ATOM 0 HB3 SER A 24 -9.186 -7.518 -7.335 1.00 14.31 H new ATOM 0 HG SER A 24 -7.934 -6.391 -5.079 1.00 14.34 H new ATOM 366 N VAL A 25 -6.011 -8.797 -5.166 1.00 2.24 N ATOM 367 CA VAL A 25 -5.842 -9.916 -4.216 1.00 22.02 C ATOM 368 C VAL A 25 -7.081 -10.047 -3.309 1.00 5.10 C ATOM 369 O VAL A 25 -7.565 -11.150 -3.063 1.00 12.54 O ATOM 370 CB VAL A 25 -4.537 -9.743 -3.348 1.00 25.43 C ATOM 371 CG1 VAL A 25 -4.380 -10.875 -2.295 1.00 44.43 C ATOM 372 CG2 VAL A 25 -3.281 -9.647 -4.255 1.00 4.54 C ATOM 0 H VAL A 25 -5.313 -8.060 -5.061 1.00 2.24 H new ATOM 0 HA VAL A 25 -5.736 -10.832 -4.797 1.00 22.02 H new ATOM 0 HB VAL A 25 -4.636 -8.808 -2.797 1.00 25.43 H new ATOM 0 HG11 VAL A 25 -3.467 -10.714 -1.721 1.00 44.43 H new ATOM 0 HG12 VAL A 25 -5.238 -10.868 -1.622 1.00 44.43 H new ATOM 0 HG13 VAL A 25 -4.325 -11.838 -2.802 1.00 44.43 H new ATOM 0 HG21 VAL A 25 -2.393 -9.528 -3.635 1.00 4.54 H new ATOM 0 HG22 VAL A 25 -3.190 -10.557 -4.848 1.00 4.54 H new ATOM 0 HG23 VAL A 25 -3.377 -8.789 -4.920 1.00 4.54 H new ATOM 382 N THR A 26 -7.600 -8.895 -2.858 1.00 72.52 N ATOM 383 CA THR A 26 -8.759 -8.830 -1.950 1.00 1.42 C ATOM 384 C THR A 26 -10.038 -9.402 -2.607 1.00 40.33 C ATOM 385 O THR A 26 -10.674 -10.305 -2.038 1.00 54.54 O ATOM 386 CB THR A 26 -8.992 -7.361 -1.488 1.00 24.13 C ATOM 387 OG1 THR A 26 -7.782 -6.866 -0.893 1.00 24.13 O ATOM 388 CG2 THR A 26 -10.154 -7.212 -0.482 1.00 34.13 C ATOM 0 H THR A 26 -7.228 -7.980 -3.112 1.00 72.52 H new ATOM 0 HA THR A 26 -8.537 -9.449 -1.080 1.00 1.42 H new ATOM 0 HB THR A 26 -9.267 -6.784 -2.371 1.00 24.13 H new ATOM 0 HG1 THR A 26 -7.984 -6.477 -0.016 1.00 24.13 H new ATOM 0 HG21 THR A 26 -10.261 -6.164 -0.202 1.00 34.13 H new ATOM 0 HG22 THR A 26 -11.079 -7.561 -0.940 1.00 34.13 H new ATOM 0 HG23 THR A 26 -9.943 -7.805 0.408 1.00 34.13 H new ATOM 396 N ILE A 27 -10.382 -8.902 -3.819 1.00 40.35 N ATOM 397 CA ILE A 27 -11.583 -9.357 -4.559 1.00 10.32 C ATOM 398 C ILE A 27 -11.444 -10.847 -4.937 1.00 72.01 C ATOM 399 O ILE A 27 -12.397 -11.612 -4.793 1.00 24.11 O ATOM 400 CB ILE A 27 -11.848 -8.496 -5.855 1.00 50.13 C ATOM 401 CG1 ILE A 27 -12.039 -6.988 -5.492 1.00 23.31 C ATOM 402 CG2 ILE A 27 -13.077 -9.026 -6.649 1.00 0.20 C ATOM 403 CD1 ILE A 27 -12.190 -6.058 -6.686 1.00 31.41 C ATOM 0 H ILE A 27 -9.844 -8.184 -4.304 1.00 40.35 H new ATOM 0 HA ILE A 27 -12.439 -9.225 -3.897 1.00 10.32 H new ATOM 0 HB ILE A 27 -10.971 -8.589 -6.495 1.00 50.13 H new ATOM 0 HG12 ILE A 27 -12.921 -6.890 -4.859 1.00 23.31 H new ATOM 0 HG13 ILE A 27 -11.184 -6.660 -4.900 1.00 23.31 H new ATOM 0 HG21 ILE A 27 -13.231 -8.410 -7.535 1.00 0.20 H new ATOM 0 HG22 ILE A 27 -12.898 -10.058 -6.951 1.00 0.20 H new ATOM 0 HG23 ILE A 27 -13.965 -8.982 -6.018 1.00 0.20 H new ATOM 0 HD11 ILE A 27 -12.317 -5.034 -6.336 1.00 31.41 H new ATOM 0 HD12 ILE A 27 -11.299 -6.120 -7.310 1.00 31.41 H new ATOM 0 HD13 ILE A 27 -13.062 -6.353 -7.269 1.00 31.41 H new ATOM 415 N LYS A 28 -10.232 -11.233 -5.390 1.00 21.31 N ATOM 416 CA LYS A 28 -9.900 -12.622 -5.782 1.00 13.41 C ATOM 417 C LYS A 28 -10.188 -13.603 -4.629 1.00 42.21 C ATOM 418 O LYS A 28 -10.924 -14.574 -4.802 1.00 51.41 O ATOM 419 CB LYS A 28 -8.407 -12.718 -6.195 1.00 51.31 C ATOM 420 CG LYS A 28 -7.934 -14.123 -6.634 1.00 14.31 C ATOM 421 CD LYS A 28 -6.417 -14.188 -6.925 1.00 63.55 C ATOM 422 CE LYS A 28 -5.550 -13.848 -5.702 1.00 24.45 C ATOM 423 NZ LYS A 28 -5.794 -14.766 -4.560 1.00 55.55 N ATOM 0 H LYS A 28 -9.450 -10.586 -5.495 1.00 21.31 H new ATOM 0 HA LYS A 28 -10.527 -12.894 -6.631 1.00 13.41 H new ATOM 0 HB2 LYS A 28 -8.227 -12.020 -7.013 1.00 51.31 H new ATOM 0 HB3 LYS A 28 -7.793 -12.391 -5.356 1.00 51.31 H new ATOM 0 HG2 LYS A 28 -8.179 -14.843 -5.853 1.00 14.31 H new ATOM 0 HG3 LYS A 28 -8.483 -14.422 -7.527 1.00 14.31 H new ATOM 0 HD2 LYS A 28 -6.163 -15.189 -7.275 1.00 63.55 H new ATOM 0 HD3 LYS A 28 -6.179 -13.497 -7.734 1.00 63.55 H new ATOM 0 HE2 LYS A 28 -4.498 -13.894 -5.982 1.00 24.45 H new ATOM 0 HE3 LYS A 28 -5.753 -12.823 -5.390 1.00 24.45 H new ATOM 0 HZ1 LYS A 28 -6.143 -14.222 -3.745 1.00 55.55 H new ATOM 0 HZ2 LYS A 28 -6.504 -15.476 -4.831 1.00 55.55 H new ATOM 0 HZ3 LYS A 28 -4.907 -15.244 -4.303 1.00 55.55 H new ATOM 437 N ASN A 29 -9.627 -13.287 -3.442 1.00 72.13 N ATOM 438 CA ASN A 29 -9.774 -14.106 -2.213 1.00 75.34 C ATOM 439 C ASN A 29 -11.250 -14.236 -1.802 1.00 61.01 C ATOM 440 O ASN A 29 -11.667 -15.290 -1.310 1.00 32.13 O ATOM 441 CB ASN A 29 -8.940 -13.505 -1.040 1.00 12.23 C ATOM 442 CG ASN A 29 -7.415 -13.683 -1.189 1.00 32.22 C ATOM 443 OD1 ASN A 29 -6.886 -13.791 -2.293 1.00 32.32 O ATOM 444 ND2 ASN A 29 -6.696 -13.676 -0.073 1.00 52.15 N ATOM 0 H ASN A 29 -9.056 -12.453 -3.306 1.00 72.13 H new ATOM 0 HA ASN A 29 -9.393 -15.102 -2.437 1.00 75.34 H new ATOM 0 HB2 ASN A 29 -9.164 -12.441 -0.958 1.00 12.23 H new ATOM 0 HB3 ASN A 29 -9.259 -13.970 -0.107 1.00 12.23 H new ATOM 0 HD21 ASN A 29 -5.681 -13.761 -0.120 1.00 52.15 H new ATOM 0 HD22 ASN A 29 -7.159 -13.585 0.831 1.00 52.15 H new ATOM 451 N MET A 30 -12.027 -13.150 -2.000 1.00 72.30 N ATOM 452 CA MET A 30 -13.483 -13.149 -1.738 1.00 72.31 C ATOM 453 C MET A 30 -14.198 -14.151 -2.663 1.00 1.21 C ATOM 454 O MET A 30 -15.001 -14.964 -2.196 1.00 14.42 O ATOM 455 CB MET A 30 -14.084 -11.725 -1.914 1.00 1.30 C ATOM 456 CG MET A 30 -13.637 -10.703 -0.859 1.00 33.14 C ATOM 457 SD MET A 30 -14.378 -9.073 -1.120 1.00 3.33 S ATOM 458 CE MET A 30 -13.766 -8.163 0.304 1.00 55.54 C ATOM 0 H MET A 30 -11.668 -12.258 -2.342 1.00 72.30 H new ATOM 0 HA MET A 30 -13.638 -13.455 -0.704 1.00 72.31 H new ATOM 0 HB2 MET A 30 -13.812 -11.350 -2.901 1.00 1.30 H new ATOM 0 HB3 MET A 30 -15.171 -11.799 -1.890 1.00 1.30 H new ATOM 0 HG2 MET A 30 -13.906 -11.067 0.132 1.00 33.14 H new ATOM 0 HG3 MET A 30 -12.551 -10.613 -0.881 1.00 33.14 H new ATOM 0 HE1 MET A 30 -13.848 -7.093 0.115 1.00 55.54 H new ATOM 0 HE2 MET A 30 -14.357 -8.422 1.183 1.00 55.54 H new ATOM 0 HE3 MET A 30 -12.722 -8.421 0.480 1.00 55.54 H new ATOM 468 N ILE A 31 -13.862 -14.096 -3.966 1.00 40.43 N ATOM 469 CA ILE A 31 -14.426 -14.995 -5.000 1.00 11.40 C ATOM 470 C ILE A 31 -14.071 -16.469 -4.677 1.00 13.11 C ATOM 471 O ILE A 31 -14.866 -17.369 -4.924 1.00 55.51 O ATOM 472 CB ILE A 31 -13.909 -14.600 -6.451 1.00 12.14 C ATOM 473 CG1 ILE A 31 -14.339 -13.134 -6.816 1.00 61.23 C ATOM 474 CG2 ILE A 31 -14.395 -15.600 -7.539 1.00 14.02 C ATOM 475 CD1 ILE A 31 -13.802 -12.616 -8.146 1.00 10.22 C ATOM 0 H ILE A 31 -13.189 -13.425 -4.336 1.00 40.43 H new ATOM 0 HA ILE A 31 -15.510 -14.884 -4.993 1.00 11.40 H new ATOM 0 HB ILE A 31 -12.820 -14.650 -6.428 1.00 12.14 H new ATOM 0 HG12 ILE A 31 -15.428 -13.086 -6.838 1.00 61.23 H new ATOM 0 HG13 ILE A 31 -14.006 -12.466 -6.022 1.00 61.23 H new ATOM 0 HG21 ILE A 31 -14.017 -15.290 -8.513 1.00 14.02 H new ATOM 0 HG22 ILE A 31 -14.024 -16.598 -7.307 1.00 14.02 H new ATOM 0 HG23 ILE A 31 -15.485 -15.614 -7.560 1.00 14.02 H new ATOM 0 HD11 ILE A 31 -14.153 -11.597 -8.308 1.00 10.22 H new ATOM 0 HD12 ILE A 31 -12.712 -12.625 -8.127 1.00 10.22 H new ATOM 0 HD13 ILE A 31 -14.156 -13.255 -8.955 1.00 10.22 H new ATOM 487 N GLU A 32 -12.879 -16.685 -4.090 1.00 2.22 N ATOM 488 CA GLU A 32 -12.387 -18.030 -3.720 1.00 32.32 C ATOM 489 C GLU A 32 -13.163 -18.613 -2.520 1.00 75.40 C ATOM 490 O GLU A 32 -13.554 -19.784 -2.556 1.00 54.43 O ATOM 491 CB GLU A 32 -10.865 -17.989 -3.423 1.00 22.50 C ATOM 492 CG GLU A 32 -10.005 -17.582 -4.636 1.00 11.43 C ATOM 493 CD GLU A 32 -8.502 -17.528 -4.330 1.00 2.41 C ATOM 494 OE1 GLU A 32 -7.821 -18.574 -4.447 1.00 50.44 O ATOM 495 OE2 GLU A 32 -7.993 -16.446 -3.971 1.00 14.34 O ATOM 0 H GLU A 32 -12.229 -15.934 -3.858 1.00 2.22 H new ATOM 0 HA GLU A 32 -12.559 -18.690 -4.570 1.00 32.32 H new ATOM 0 HB2 GLU A 32 -10.682 -17.288 -2.608 1.00 22.50 H new ATOM 0 HB3 GLU A 32 -10.545 -18.972 -3.076 1.00 22.50 H new ATOM 0 HG2 GLU A 32 -10.177 -18.289 -5.447 1.00 11.43 H new ATOM 0 HG3 GLU A 32 -10.331 -16.604 -4.991 1.00 11.43 H new ATOM 502 N ASP A 33 -13.387 -17.791 -1.472 1.00 0.52 N ATOM 503 CA ASP A 33 -14.103 -18.229 -0.243 1.00 32.31 C ATOM 504 C ASP A 33 -15.592 -18.512 -0.525 1.00 34.15 C ATOM 505 O ASP A 33 -16.153 -19.500 -0.034 1.00 72.41 O ATOM 506 CB ASP A 33 -13.967 -17.171 0.896 1.00 33.42 C ATOM 507 CG ASP A 33 -12.597 -17.197 1.602 1.00 12.42 C ATOM 508 OD1 ASP A 33 -12.313 -18.183 2.326 1.00 23.34 O ATOM 509 OD2 ASP A 33 -11.809 -16.231 1.467 1.00 40.44 O ATOM 0 H ASP A 33 -13.083 -16.818 -1.448 1.00 0.52 H new ATOM 0 HA ASP A 33 -13.635 -19.157 0.085 1.00 32.31 H new ATOM 0 HB2 ASP A 33 -14.133 -16.178 0.479 1.00 33.42 H new ATOM 0 HB3 ASP A 33 -14.750 -17.342 1.635 1.00 33.42 H new ATOM 514 N ILE A 34 -16.210 -17.630 -1.314 1.00 11.42 N ATOM 515 CA ILE A 34 -17.627 -17.743 -1.727 1.00 42.34 C ATOM 516 C ILE A 34 -17.794 -18.868 -2.774 1.00 14.13 C ATOM 517 O ILE A 34 -18.832 -19.548 -2.825 1.00 61.30 O ATOM 518 CB ILE A 34 -18.122 -16.353 -2.303 1.00 2.42 C ATOM 519 CG1 ILE A 34 -18.013 -15.251 -1.194 1.00 44.21 C ATOM 520 CG2 ILE A 34 -19.564 -16.426 -2.875 1.00 40.34 C ATOM 521 CD1 ILE A 34 -18.270 -13.834 -1.665 1.00 12.32 C ATOM 0 H ILE A 34 -15.743 -16.806 -1.693 1.00 11.42 H new ATOM 0 HA ILE A 34 -18.237 -18.000 -0.861 1.00 42.34 H new ATOM 0 HB ILE A 34 -17.473 -16.090 -3.138 1.00 2.42 H new ATOM 0 HG12 ILE A 34 -18.721 -15.487 -0.399 1.00 44.21 H new ATOM 0 HG13 ILE A 34 -17.016 -15.296 -0.756 1.00 44.21 H new ATOM 0 HG21 ILE A 34 -19.854 -15.447 -3.257 1.00 40.34 H new ATOM 0 HG22 ILE A 34 -19.598 -17.156 -3.684 1.00 40.34 H new ATOM 0 HG23 ILE A 34 -20.254 -16.727 -2.086 1.00 40.34 H new ATOM 0 HD11 ILE A 34 -18.171 -13.147 -0.824 1.00 12.32 H new ATOM 0 HD12 ILE A 34 -17.546 -13.570 -2.436 1.00 12.32 H new ATOM 0 HD13 ILE A 34 -19.278 -13.764 -2.074 1.00 12.32 H new ATOM 533 N GLY A 35 -16.733 -19.092 -3.561 1.00 50.14 N ATOM 534 CA GLY A 35 -16.791 -19.952 -4.744 1.00 51.24 C ATOM 535 C GLY A 35 -17.155 -19.137 -5.979 1.00 44.30 C ATOM 536 O GLY A 35 -17.586 -17.975 -5.853 1.00 42.41 O ATOM 0 H GLY A 35 -15.814 -18.682 -3.394 1.00 50.14 H new ATOM 0 HA2 GLY A 35 -15.828 -20.440 -4.894 1.00 51.24 H new ATOM 0 HA3 GLY A 35 -17.528 -20.741 -4.592 1.00 51.24 H new ATOM 540 N GLU A 36 -16.960 -19.730 -7.168 1.00 32.33 N ATOM 541 CA GLU A 36 -17.258 -19.080 -8.456 1.00 42.41 C ATOM 542 C GLU A 36 -18.756 -18.735 -8.535 1.00 2.32 C ATOM 543 O GLU A 36 -19.595 -19.600 -8.813 1.00 23.44 O ATOM 544 CB GLU A 36 -16.828 -19.989 -9.641 1.00 12.43 C ATOM 545 CG GLU A 36 -15.333 -20.361 -9.631 1.00 3.31 C ATOM 546 CD GLU A 36 -14.942 -21.260 -10.811 1.00 72.53 C ATOM 547 OE1 GLU A 36 -14.530 -20.722 -11.868 1.00 42.43 O ATOM 548 OE2 GLU A 36 -15.083 -22.497 -10.702 1.00 64.35 O ATOM 0 H GLU A 36 -16.590 -20.676 -7.264 1.00 32.33 H new ATOM 0 HA GLU A 36 -16.687 -18.154 -8.526 1.00 42.41 H new ATOM 0 HB2 GLU A 36 -17.420 -20.904 -9.618 1.00 12.43 H new ATOM 0 HB3 GLU A 36 -17.060 -19.482 -10.578 1.00 12.43 H new ATOM 0 HG2 GLU A 36 -14.735 -19.450 -9.659 1.00 3.31 H new ATOM 0 HG3 GLU A 36 -15.095 -20.870 -8.697 1.00 3.31 H new ATOM 555 N SER A 37 -19.068 -17.473 -8.222 1.00 23.52 N ATOM 556 CA SER A 37 -20.444 -16.955 -8.166 1.00 1.52 C ATOM 557 C SER A 37 -20.549 -15.686 -9.020 1.00 43.33 C ATOM 558 O SER A 37 -19.665 -14.816 -8.966 1.00 71.22 O ATOM 559 CB SER A 37 -20.825 -16.641 -6.701 1.00 72.43 C ATOM 560 OG SER A 37 -20.678 -17.785 -5.883 1.00 64.22 O ATOM 0 H SER A 37 -18.364 -16.771 -7.997 1.00 23.52 H new ATOM 0 HA SER A 37 -21.131 -17.706 -8.556 1.00 1.52 H new ATOM 0 HB2 SER A 37 -20.196 -15.836 -6.322 1.00 72.43 H new ATOM 0 HB3 SER A 37 -21.855 -16.288 -6.657 1.00 72.43 H new ATOM 0 HG SER A 37 -19.725 -17.969 -5.746 1.00 64.22 H new ATOM 566 N ASP A 38 -21.631 -15.579 -9.805 1.00 22.02 N ATOM 567 CA ASP A 38 -21.968 -14.338 -10.535 1.00 62.32 C ATOM 568 C ASP A 38 -22.612 -13.305 -9.584 1.00 21.32 C ATOM 569 O ASP A 38 -22.888 -12.172 -9.995 1.00 11.31 O ATOM 570 CB ASP A 38 -22.904 -14.645 -11.732 1.00 43.21 C ATOM 571 CG ASP A 38 -24.282 -15.204 -11.339 1.00 25.11 C ATOM 572 OD1 ASP A 38 -25.258 -14.419 -11.234 1.00 43.23 O ATOM 573 OD2 ASP A 38 -24.397 -16.433 -11.146 1.00 11.40 O ATOM 0 H ASP A 38 -22.294 -16.339 -9.954 1.00 22.02 H new ATOM 0 HA ASP A 38 -21.046 -13.909 -10.927 1.00 62.32 H new ATOM 0 HB2 ASP A 38 -23.048 -13.731 -12.308 1.00 43.21 H new ATOM 0 HB3 ASP A 38 -22.410 -15.361 -12.389 1.00 43.21 H new ATOM 578 N SER A 39 -22.842 -13.737 -8.319 1.00 54.04 N ATOM 579 CA SER A 39 -23.350 -12.902 -7.225 1.00 0.14 C ATOM 580 C SER A 39 -22.562 -11.578 -7.108 1.00 72.41 C ATOM 581 O SER A 39 -21.325 -11.611 -7.035 1.00 62.20 O ATOM 582 CB SER A 39 -23.265 -13.690 -5.893 1.00 43.14 C ATOM 583 OG SER A 39 -23.987 -14.909 -5.977 1.00 4.13 O ATOM 0 H SER A 39 -22.672 -14.702 -8.034 1.00 54.04 H new ATOM 0 HA SER A 39 -24.388 -12.650 -7.441 1.00 0.14 H new ATOM 0 HB2 SER A 39 -22.222 -13.897 -5.654 1.00 43.14 H new ATOM 0 HB3 SER A 39 -23.663 -13.082 -5.081 1.00 43.14 H new ATOM 0 HG SER A 39 -23.918 -15.390 -5.126 1.00 4.13 H new ATOM 589 N PRO A 40 -23.270 -10.402 -7.128 1.00 51.10 N ATOM 590 CA PRO A 40 -22.621 -9.078 -7.032 1.00 33.21 C ATOM 591 C PRO A 40 -21.893 -8.889 -5.685 1.00 0.23 C ATOM 592 O PRO A 40 -22.464 -9.170 -4.627 1.00 14.30 O ATOM 593 CB PRO A 40 -23.808 -8.092 -7.205 1.00 64.13 C ATOM 594 CG PRO A 40 -25.025 -8.863 -6.812 1.00 15.13 C ATOM 595 CD PRO A 40 -24.753 -10.275 -7.256 1.00 54.12 C ATOM 0 HA PRO A 40 -21.839 -8.930 -7.777 1.00 33.21 H new ATOM 0 HB2 PRO A 40 -23.681 -7.211 -6.576 1.00 64.13 H new ATOM 0 HB3 PRO A 40 -23.881 -7.741 -8.235 1.00 64.13 H new ATOM 0 HG2 PRO A 40 -25.193 -8.813 -5.736 1.00 15.13 H new ATOM 0 HG3 PRO A 40 -25.918 -8.463 -7.293 1.00 15.13 H new ATOM 0 HD2 PRO A 40 -25.273 -11.000 -6.630 1.00 54.12 H new ATOM 0 HD3 PRO A 40 -25.083 -10.444 -8.281 1.00 54.12 H new ATOM 603 N ILE A 41 -20.611 -8.470 -5.736 1.00 1.14 N ATOM 604 CA ILE A 41 -19.778 -8.277 -4.535 1.00 70.20 C ATOM 605 C ILE A 41 -19.624 -6.764 -4.261 1.00 75.33 C ATOM 606 O ILE A 41 -18.866 -6.081 -4.962 1.00 53.31 O ATOM 607 CB ILE A 41 -18.353 -8.957 -4.684 1.00 34.05 C ATOM 608 CG1 ILE A 41 -18.484 -10.463 -5.106 1.00 42.04 C ATOM 609 CG2 ILE A 41 -17.521 -8.816 -3.378 1.00 65.34 C ATOM 610 CD1 ILE A 41 -19.304 -11.336 -4.158 1.00 4.24 C ATOM 0 H ILE A 41 -20.128 -8.257 -6.609 1.00 1.14 H new ATOM 0 HA ILE A 41 -20.276 -8.759 -3.694 1.00 70.20 H new ATOM 0 HB ILE A 41 -17.820 -8.432 -5.477 1.00 34.05 H new ATOM 0 HG12 ILE A 41 -18.935 -10.508 -6.097 1.00 42.04 H new ATOM 0 HG13 ILE A 41 -17.484 -10.888 -5.192 1.00 42.04 H new ATOM 0 HG21 ILE A 41 -16.550 -9.292 -3.512 1.00 65.34 H new ATOM 0 HG22 ILE A 41 -17.379 -7.760 -3.149 1.00 65.34 H new ATOM 0 HG23 ILE A 41 -18.050 -9.297 -2.556 1.00 65.34 H new ATOM 0 HD11 ILE A 41 -19.334 -12.357 -4.538 1.00 4.24 H new ATOM 0 HD12 ILE A 41 -18.845 -11.330 -3.169 1.00 4.24 H new ATOM 0 HD13 ILE A 41 -20.319 -10.944 -4.089 1.00 4.24 H new ATOM 622 N PRO A 42 -20.374 -6.197 -3.257 1.00 1.05 N ATOM 623 CA PRO A 42 -20.208 -4.790 -2.846 1.00 45.24 C ATOM 624 C PRO A 42 -18.882 -4.592 -2.083 1.00 24.05 C ATOM 625 O PRO A 42 -18.421 -5.494 -1.367 1.00 32.51 O ATOM 626 CB PRO A 42 -21.451 -4.510 -1.941 1.00 3.24 C ATOM 627 CG PRO A 42 -22.357 -5.695 -2.133 1.00 4.25 C ATOM 628 CD PRO A 42 -21.446 -6.850 -2.468 1.00 34.13 C ATOM 0 HA PRO A 42 -20.157 -4.103 -3.691 1.00 45.24 H new ATOM 0 HB2 PRO A 42 -21.160 -4.402 -0.896 1.00 3.24 H new ATOM 0 HB3 PRO A 42 -21.948 -3.584 -2.231 1.00 3.24 H new ATOM 0 HG2 PRO A 42 -22.933 -5.899 -1.230 1.00 4.25 H new ATOM 0 HG3 PRO A 42 -23.073 -5.515 -2.935 1.00 4.25 H new ATOM 0 HD2 PRO A 42 -21.054 -7.331 -1.572 1.00 34.13 H new ATOM 0 HD3 PRO A 42 -21.961 -7.619 -3.043 1.00 34.13 H new ATOM 636 N LEU A 43 -18.273 -3.416 -2.253 1.00 74.02 N ATOM 637 CA LEU A 43 -17.030 -3.029 -1.577 1.00 51.33 C ATOM 638 C LEU A 43 -17.330 -1.784 -0.702 1.00 54.04 C ATOM 639 O LEU A 43 -17.304 -0.654 -1.206 1.00 73.30 O ATOM 640 CB LEU A 43 -15.915 -2.748 -2.633 1.00 73.34 C ATOM 641 CG LEU A 43 -15.531 -3.943 -3.576 1.00 71.41 C ATOM 642 CD1 LEU A 43 -14.506 -3.508 -4.651 1.00 1.41 C ATOM 643 CD2 LEU A 43 -15.027 -5.172 -2.771 1.00 60.14 C ATOM 0 H LEU A 43 -18.635 -2.693 -2.875 1.00 74.02 H new ATOM 0 HA LEU A 43 -16.665 -3.832 -0.937 1.00 51.33 H new ATOM 0 HB2 LEU A 43 -16.236 -1.912 -3.254 1.00 73.34 H new ATOM 0 HB3 LEU A 43 -15.017 -2.427 -2.105 1.00 73.34 H new ATOM 0 HG LEU A 43 -16.439 -4.250 -4.095 1.00 71.41 H new ATOM 0 HD11 LEU A 43 -14.262 -4.359 -5.287 1.00 1.41 H new ATOM 0 HD12 LEU A 43 -14.933 -2.711 -5.260 1.00 1.41 H new ATOM 0 HD13 LEU A 43 -13.600 -3.147 -4.165 1.00 1.41 H new ATOM 0 HD21 LEU A 43 -14.771 -5.978 -3.459 1.00 60.14 H new ATOM 0 HD22 LEU A 43 -14.145 -4.893 -2.195 1.00 60.14 H new ATOM 0 HD23 LEU A 43 -15.811 -5.509 -2.093 1.00 60.14 H new ATOM 655 N PRO A 44 -17.679 -1.985 0.620 1.00 65.22 N ATOM 656 CA PRO A 44 -18.084 -0.887 1.531 1.00 64.42 C ATOM 657 C PRO A 44 -16.869 -0.126 2.123 1.00 23.02 C ATOM 658 O PRO A 44 -16.652 -0.099 3.339 1.00 44.43 O ATOM 659 CB PRO A 44 -18.915 -1.645 2.603 1.00 50.35 C ATOM 660 CG PRO A 44 -18.260 -2.990 2.708 1.00 31.14 C ATOM 661 CD PRO A 44 -17.707 -3.304 1.324 1.00 65.30 C ATOM 0 HA PRO A 44 -18.646 -0.093 1.039 1.00 64.42 H new ATOM 0 HB2 PRO A 44 -18.901 -1.121 3.559 1.00 50.35 H new ATOM 0 HB3 PRO A 44 -19.959 -1.735 2.304 1.00 50.35 H new ATOM 0 HG2 PRO A 44 -17.463 -2.978 3.452 1.00 31.14 H new ATOM 0 HG3 PRO A 44 -18.977 -3.749 3.022 1.00 31.14 H new ATOM 0 HD2 PRO A 44 -16.711 -3.742 1.385 1.00 65.30 H new ATOM 0 HD3 PRO A 44 -18.338 -4.021 0.798 1.00 65.30 H new ATOM 669 N ASN A 45 -16.103 0.516 1.230 1.00 33.11 N ATOM 670 CA ASN A 45 -14.894 1.285 1.588 1.00 21.13 C ATOM 671 C ASN A 45 -14.557 2.258 0.444 1.00 31.32 C ATOM 672 O ASN A 45 -14.363 3.459 0.663 1.00 15.04 O ATOM 673 CB ASN A 45 -13.701 0.332 1.868 1.00 53.43 C ATOM 674 CG ASN A 45 -12.402 1.054 2.256 1.00 73.33 C ATOM 675 OD1 ASN A 45 -11.567 1.371 1.407 1.00 14.44 O ATOM 676 ND2 ASN A 45 -12.231 1.317 3.540 1.00 61.33 N ATOM 0 H ASN A 45 -16.303 0.519 0.230 1.00 33.11 H new ATOM 0 HA ASN A 45 -15.085 1.853 2.498 1.00 21.13 H new ATOM 0 HB2 ASN A 45 -13.977 -0.353 2.670 1.00 53.43 H new ATOM 0 HB3 ASN A 45 -13.517 -0.273 0.980 1.00 53.43 H new ATOM 0 HD21 ASN A 45 -11.387 1.797 3.854 1.00 61.33 H new ATOM 0 HD22 ASN A 45 -12.943 1.040 4.216 1.00 61.33 H new ATOM 683 N VAL A 46 -14.511 1.712 -0.786 1.00 55.31 N ATOM 684 CA VAL A 46 -14.184 2.481 -2.001 1.00 32.34 C ATOM 685 C VAL A 46 -15.478 3.043 -2.651 1.00 1.24 C ATOM 686 O VAL A 46 -16.417 2.296 -2.934 1.00 35.41 O ATOM 687 CB VAL A 46 -13.353 1.599 -3.014 1.00 62.04 C ATOM 688 CG1 VAL A 46 -14.094 0.302 -3.419 1.00 42.53 C ATOM 689 CG2 VAL A 46 -12.921 2.423 -4.253 1.00 53.32 C ATOM 0 H VAL A 46 -14.699 0.726 -0.965 1.00 55.31 H new ATOM 0 HA VAL A 46 -13.559 3.330 -1.722 1.00 32.34 H new ATOM 0 HB VAL A 46 -12.449 1.285 -2.491 1.00 62.04 H new ATOM 0 HG11 VAL A 46 -13.478 -0.266 -4.116 1.00 42.53 H new ATOM 0 HG12 VAL A 46 -14.286 -0.300 -2.531 1.00 42.53 H new ATOM 0 HG13 VAL A 46 -15.040 0.557 -3.896 1.00 42.53 H new ATOM 0 HG21 VAL A 46 -12.351 1.788 -4.931 1.00 53.32 H new ATOM 0 HG22 VAL A 46 -13.806 2.800 -4.766 1.00 53.32 H new ATOM 0 HG23 VAL A 46 -12.302 3.262 -3.934 1.00 53.32 H new ATOM 699 N THR A 47 -15.510 4.371 -2.868 1.00 13.14 N ATOM 700 CA THR A 47 -16.674 5.087 -3.438 1.00 34.35 C ATOM 701 C THR A 47 -16.731 4.925 -4.972 1.00 71.45 C ATOM 702 O THR A 47 -15.816 4.351 -5.565 1.00 32.15 O ATOM 703 CB THR A 47 -16.599 6.593 -3.060 1.00 65.23 C ATOM 704 OG1 THR A 47 -15.343 7.127 -3.512 1.00 60.10 O ATOM 705 CG2 THR A 47 -16.747 6.809 -1.540 1.00 53.01 C ATOM 0 H THR A 47 -14.724 4.985 -2.652 1.00 13.14 H new ATOM 0 HA THR A 47 -17.583 4.653 -3.021 1.00 34.35 H new ATOM 0 HB THR A 47 -17.426 7.111 -3.545 1.00 65.23 H new ATOM 0 HG1 THR A 47 -15.289 8.077 -3.279 1.00 60.10 H new ATOM 0 HG21 THR A 47 -16.689 7.874 -1.317 1.00 53.01 H new ATOM 0 HG22 THR A 47 -17.710 6.421 -1.209 1.00 53.01 H new ATOM 0 HG23 THR A 47 -15.946 6.285 -1.018 1.00 53.01 H new ATOM 713 N SER A 48 -17.808 5.442 -5.604 1.00 12.14 N ATOM 714 CA SER A 48 -18.079 5.216 -7.039 1.00 51.00 C ATOM 715 C SER A 48 -17.030 5.866 -7.941 1.00 70.02 C ATOM 716 O SER A 48 -16.523 5.227 -8.858 1.00 40.24 O ATOM 717 CB SER A 48 -19.475 5.738 -7.414 1.00 5.53 C ATOM 718 OG SER A 48 -19.610 7.120 -7.122 1.00 1.30 O ATOM 0 H SER A 48 -18.506 6.022 -5.139 1.00 12.14 H new ATOM 0 HA SER A 48 -18.034 4.139 -7.200 1.00 51.00 H new ATOM 0 HB2 SER A 48 -19.654 5.570 -8.476 1.00 5.53 H new ATOM 0 HB3 SER A 48 -20.233 5.175 -6.870 1.00 5.53 H new ATOM 0 HG SER A 48 -20.534 7.310 -6.857 1.00 1.30 H new ATOM 724 N THR A 49 -16.715 7.130 -7.656 1.00 33.15 N ATOM 725 CA THR A 49 -15.770 7.933 -8.442 1.00 2.52 C ATOM 726 C THR A 49 -14.362 7.301 -8.452 1.00 45.35 C ATOM 727 O THR A 49 -13.662 7.320 -9.473 1.00 11.32 O ATOM 728 CB THR A 49 -15.702 9.376 -7.855 1.00 44.30 C ATOM 729 OG1 THR A 49 -15.345 9.310 -6.463 1.00 14.43 O ATOM 730 CG2 THR A 49 -17.039 10.122 -8.000 1.00 4.14 C ATOM 0 H THR A 49 -17.113 7.634 -6.863 1.00 33.15 H new ATOM 0 HA THR A 49 -16.125 7.968 -9.472 1.00 2.52 H new ATOM 0 HB THR A 49 -14.949 9.927 -8.418 1.00 44.30 H new ATOM 0 HG1 THR A 49 -15.300 10.217 -6.093 1.00 14.43 H new ATOM 0 HG21 THR A 49 -16.945 11.122 -7.578 1.00 4.14 H new ATOM 0 HG22 THR A 49 -17.301 10.197 -9.055 1.00 4.14 H new ATOM 0 HG23 THR A 49 -17.820 9.576 -7.470 1.00 4.14 H new ATOM 738 N ILE A 50 -13.978 6.720 -7.311 1.00 41.11 N ATOM 739 CA ILE A 50 -12.650 6.130 -7.125 1.00 61.25 C ATOM 740 C ILE A 50 -12.602 4.726 -7.750 1.00 5.43 C ATOM 741 O ILE A 50 -11.682 4.425 -8.508 1.00 4.42 O ATOM 742 CB ILE A 50 -12.264 6.098 -5.601 1.00 40.34 C ATOM 743 CG1 ILE A 50 -12.360 7.538 -4.997 1.00 30.24 C ATOM 744 CG2 ILE A 50 -10.857 5.492 -5.371 1.00 54.21 C ATOM 745 CD1 ILE A 50 -11.527 8.604 -5.717 1.00 52.22 C ATOM 0 H ILE A 50 -14.580 6.646 -6.491 1.00 41.11 H new ATOM 0 HA ILE A 50 -11.913 6.751 -7.635 1.00 61.25 H new ATOM 0 HB ILE A 50 -12.974 5.449 -5.088 1.00 40.34 H new ATOM 0 HG12 ILE A 50 -13.405 7.849 -5.005 1.00 30.24 H new ATOM 0 HG13 ILE A 50 -12.047 7.499 -3.954 1.00 30.24 H new ATOM 0 HG21 ILE A 50 -10.632 5.490 -4.305 1.00 54.21 H new ATOM 0 HG22 ILE A 50 -10.835 4.470 -5.749 1.00 54.21 H new ATOM 0 HG23 ILE A 50 -10.113 6.090 -5.898 1.00 54.21 H new ATOM 0 HD11 ILE A 50 -11.662 9.566 -5.223 1.00 52.22 H new ATOM 0 HD12 ILE A 50 -10.474 8.325 -5.687 1.00 52.22 H new ATOM 0 HD13 ILE A 50 -11.852 8.681 -6.754 1.00 52.22 H new ATOM 757 N LEU A 51 -13.637 3.903 -7.466 1.00 55.33 N ATOM 758 CA LEU A 51 -13.755 2.513 -7.987 1.00 11.31 C ATOM 759 C LEU A 51 -13.894 2.507 -9.524 1.00 32.14 C ATOM 760 O LEU A 51 -13.499 1.545 -10.190 1.00 74.34 O ATOM 761 CB LEU A 51 -14.950 1.759 -7.327 1.00 20.21 C ATOM 762 CG LEU A 51 -15.016 0.216 -7.595 1.00 60.30 C ATOM 763 CD1 LEU A 51 -13.715 -0.497 -7.135 1.00 54.31 C ATOM 764 CD2 LEU A 51 -16.270 -0.425 -6.944 1.00 54.11 C ATOM 0 H LEU A 51 -14.417 4.180 -6.869 1.00 55.33 H new ATOM 0 HA LEU A 51 -12.838 1.986 -7.724 1.00 11.31 H new ATOM 0 HB2 LEU A 51 -14.906 1.920 -6.250 1.00 20.21 H new ATOM 0 HB3 LEU A 51 -15.878 2.210 -7.679 1.00 20.21 H new ATOM 0 HG LEU A 51 -15.103 0.080 -8.673 1.00 60.30 H new ATOM 0 HD11 LEU A 51 -13.795 -1.565 -7.336 1.00 54.31 H new ATOM 0 HD12 LEU A 51 -12.864 -0.088 -7.680 1.00 54.31 H new ATOM 0 HD13 LEU A 51 -13.572 -0.338 -6.066 1.00 54.31 H new ATOM 0 HD21 LEU A 51 -16.281 -1.495 -7.152 1.00 54.11 H new ATOM 0 HD22 LEU A 51 -16.243 -0.265 -5.866 1.00 54.11 H new ATOM 0 HD23 LEU A 51 -17.169 0.034 -7.356 1.00 54.11 H new ATOM 776 N GLU A 52 -14.473 3.598 -10.057 1.00 73.23 N ATOM 777 CA GLU A 52 -14.538 3.887 -11.505 1.00 24.25 C ATOM 778 C GLU A 52 -13.131 3.818 -12.119 1.00 43.23 C ATOM 779 O GLU A 52 -12.890 3.056 -13.050 1.00 53.10 O ATOM 780 CB GLU A 52 -15.122 5.317 -11.704 1.00 24.30 C ATOM 781 CG GLU A 52 -14.993 5.917 -13.125 1.00 52.41 C ATOM 782 CD GLU A 52 -15.018 7.457 -13.126 1.00 35.24 C ATOM 783 OE1 GLU A 52 -14.031 8.074 -12.641 1.00 45.24 O ATOM 784 OE2 GLU A 52 -15.999 8.058 -13.624 1.00 42.53 O ATOM 0 H GLU A 52 -14.917 4.317 -9.486 1.00 73.23 H new ATOM 0 HA GLU A 52 -15.173 3.150 -11.997 1.00 24.25 H new ATOM 0 HB2 GLU A 52 -16.178 5.296 -11.436 1.00 24.30 H new ATOM 0 HB3 GLU A 52 -14.628 5.989 -11.002 1.00 24.30 H new ATOM 0 HG2 GLU A 52 -14.063 5.573 -13.577 1.00 52.41 H new ATOM 0 HG3 GLU A 52 -15.807 5.544 -13.747 1.00 52.41 H new ATOM 791 N LYS A 53 -12.204 4.590 -11.524 1.00 3.44 N ATOM 792 CA LYS A 53 -10.818 4.715 -12.008 1.00 14.32 C ATOM 793 C LYS A 53 -9.967 3.491 -11.635 1.00 4.21 C ATOM 794 O LYS A 53 -9.072 3.127 -12.390 1.00 34.13 O ATOM 795 CB LYS A 53 -10.179 6.030 -11.471 1.00 52.31 C ATOM 796 CG LYS A 53 -10.496 7.290 -12.318 1.00 41.34 C ATOM 797 CD LYS A 53 -9.922 8.591 -11.699 1.00 20.31 C ATOM 798 CE LYS A 53 -10.616 8.962 -10.378 1.00 13.32 C ATOM 799 NZ LYS A 53 -12.077 9.162 -10.568 1.00 50.23 N ATOM 0 H LYS A 53 -12.396 5.147 -10.691 1.00 3.44 H new ATOM 0 HA LYS A 53 -10.846 4.759 -13.097 1.00 14.32 H new ATOM 0 HB2 LYS A 53 -10.524 6.197 -10.451 1.00 52.31 H new ATOM 0 HB3 LYS A 53 -9.098 5.901 -11.424 1.00 52.31 H new ATOM 0 HG2 LYS A 53 -10.089 7.160 -13.321 1.00 41.34 H new ATOM 0 HG3 LYS A 53 -11.576 7.389 -12.423 1.00 41.34 H new ATOM 0 HD2 LYS A 53 -8.853 8.467 -11.524 1.00 20.31 H new ATOM 0 HD3 LYS A 53 -10.035 9.410 -12.409 1.00 20.31 H new ATOM 0 HE2 LYS A 53 -10.448 8.174 -9.644 1.00 13.32 H new ATOM 0 HE3 LYS A 53 -10.172 9.873 -9.976 1.00 13.32 H new ATOM 0 HZ1 LYS A 53 -12.412 9.908 -9.925 1.00 50.23 H new ATOM 0 HZ2 LYS A 53 -12.264 9.443 -11.552 1.00 50.23 H new ATOM 0 HZ3 LYS A 53 -12.579 8.275 -10.360 1.00 50.23 H new ATOM 813 N VAL A 54 -10.248 2.870 -10.479 1.00 72.10 N ATOM 814 CA VAL A 54 -9.543 1.652 -10.030 1.00 14.54 C ATOM 815 C VAL A 54 -9.755 0.529 -11.059 1.00 60.14 C ATOM 816 O VAL A 54 -8.792 -0.038 -11.591 1.00 20.35 O ATOM 817 CB VAL A 54 -10.036 1.201 -8.595 1.00 5.10 C ATOM 818 CG1 VAL A 54 -9.530 -0.211 -8.210 1.00 54.13 C ATOM 819 CG2 VAL A 54 -9.619 2.236 -7.523 1.00 11.13 C ATOM 0 H VAL A 54 -10.966 3.193 -9.830 1.00 72.10 H new ATOM 0 HA VAL A 54 -8.478 1.871 -9.954 1.00 14.54 H new ATOM 0 HB VAL A 54 -11.124 1.151 -8.637 1.00 5.10 H new ATOM 0 HG11 VAL A 54 -9.897 -0.471 -7.217 1.00 54.13 H new ATOM 0 HG12 VAL A 54 -9.896 -0.939 -8.934 1.00 54.13 H new ATOM 0 HG13 VAL A 54 -8.440 -0.219 -8.207 1.00 54.13 H new ATOM 0 HG21 VAL A 54 -9.968 1.907 -6.544 1.00 11.13 H new ATOM 0 HG22 VAL A 54 -8.533 2.328 -7.509 1.00 11.13 H new ATOM 0 HG23 VAL A 54 -10.062 3.203 -7.759 1.00 11.13 H new ATOM 829 N LEU A 55 -11.031 0.276 -11.372 1.00 61.13 N ATOM 830 CA LEU A 55 -11.432 -0.785 -12.302 1.00 14.23 C ATOM 831 C LEU A 55 -11.146 -0.412 -13.766 1.00 51.11 C ATOM 832 O LEU A 55 -10.878 -1.299 -14.568 1.00 43.12 O ATOM 833 CB LEU A 55 -12.921 -1.161 -12.085 1.00 74.31 C ATOM 834 CG LEU A 55 -13.260 -1.803 -10.697 1.00 41.11 C ATOM 835 CD1 LEU A 55 -14.743 -2.213 -10.619 1.00 54.33 C ATOM 836 CD2 LEU A 55 -12.328 -3.001 -10.367 1.00 10.41 C ATOM 0 H LEU A 55 -11.815 0.802 -10.987 1.00 61.13 H new ATOM 0 HA LEU A 55 -10.824 -1.664 -12.086 1.00 14.23 H new ATOM 0 HB2 LEU A 55 -13.526 -0.263 -12.207 1.00 74.31 H new ATOM 0 HB3 LEU A 55 -13.220 -1.856 -12.870 1.00 74.31 H new ATOM 0 HG LEU A 55 -13.082 -1.040 -9.939 1.00 41.11 H new ATOM 0 HD11 LEU A 55 -14.947 -2.655 -9.644 1.00 54.33 H new ATOM 0 HD12 LEU A 55 -15.371 -1.333 -10.757 1.00 54.33 H new ATOM 0 HD13 LEU A 55 -14.961 -2.941 -11.401 1.00 54.33 H new ATOM 0 HD21 LEU A 55 -12.598 -3.416 -9.396 1.00 10.41 H new ATOM 0 HD22 LEU A 55 -12.438 -3.769 -11.133 1.00 10.41 H new ATOM 0 HD23 LEU A 55 -11.293 -2.660 -10.340 1.00 10.41 H new ATOM 848 N ASP A 56 -11.183 0.892 -14.111 1.00 44.32 N ATOM 849 CA ASP A 56 -10.884 1.354 -15.493 1.00 53.14 C ATOM 850 C ASP A 56 -9.372 1.260 -15.787 1.00 31.42 C ATOM 851 O ASP A 56 -8.966 0.973 -16.925 1.00 64.44 O ATOM 852 CB ASP A 56 -11.401 2.793 -15.741 1.00 62.53 C ATOM 853 CG ASP A 56 -11.349 3.204 -17.225 1.00 74.14 C ATOM 854 OD1 ASP A 56 -10.529 4.068 -17.598 1.00 43.40 O ATOM 855 OD2 ASP A 56 -12.119 2.633 -18.034 1.00 52.11 O ATOM 0 H ASP A 56 -11.415 1.643 -13.461 1.00 44.32 H new ATOM 0 HA ASP A 56 -11.412 0.692 -16.180 1.00 53.14 H new ATOM 0 HB2 ASP A 56 -12.428 2.871 -15.384 1.00 62.53 H new ATOM 0 HB3 ASP A 56 -10.806 3.493 -15.155 1.00 62.53 H new ATOM 860 N TYR A 57 -8.548 1.499 -14.750 1.00 43.22 N ATOM 861 CA TYR A 57 -7.091 1.256 -14.806 1.00 12.32 C ATOM 862 C TYR A 57 -6.830 -0.236 -15.001 1.00 44.44 C ATOM 863 O TYR A 57 -5.943 -0.624 -15.756 1.00 44.30 O ATOM 864 CB TYR A 57 -6.378 1.746 -13.514 1.00 5.51 C ATOM 865 CG TYR A 57 -4.886 1.349 -13.416 1.00 34.41 C ATOM 866 CD1 TYR A 57 -3.894 2.063 -14.100 1.00 22.24 C ATOM 867 CD2 TYR A 57 -4.477 0.235 -12.664 1.00 11.44 C ATOM 868 CE1 TYR A 57 -2.566 1.680 -14.034 1.00 43.32 C ATOM 869 CE2 TYR A 57 -3.153 -0.141 -12.596 1.00 1.02 C ATOM 870 CZ TYR A 57 -2.201 0.578 -13.280 1.00 5.42 C ATOM 871 OH TYR A 57 -0.884 0.183 -13.216 1.00 44.10 O ATOM 0 H TYR A 57 -8.869 1.864 -13.853 1.00 43.22 H new ATOM 0 HA TYR A 57 -6.687 1.820 -15.647 1.00 12.32 H new ATOM 0 HB2 TYR A 57 -6.456 2.832 -13.460 1.00 5.51 H new ATOM 0 HB3 TYR A 57 -6.905 1.345 -12.648 1.00 5.51 H new ATOM 0 HD1 TYR A 57 -4.170 2.926 -14.688 1.00 22.24 H new ATOM 0 HD2 TYR A 57 -5.217 -0.340 -12.127 1.00 11.44 H new ATOM 0 HE1 TYR A 57 -1.815 2.241 -14.570 1.00 43.32 H new ATOM 0 HE2 TYR A 57 -2.864 -0.999 -12.007 1.00 1.02 H new ATOM 0 HH TYR A 57 -0.353 0.710 -13.849 1.00 44.10 H new ATOM 881 N CYS A 58 -7.605 -1.051 -14.275 1.00 2.32 N ATOM 882 CA CYS A 58 -7.527 -2.509 -14.342 1.00 74.41 C ATOM 883 C CYS A 58 -7.984 -3.033 -15.734 1.00 22.10 C ATOM 884 O CYS A 58 -7.471 -4.057 -16.208 1.00 62.05 O ATOM 885 CB CYS A 58 -8.335 -3.117 -13.177 1.00 33.13 C ATOM 886 SG CYS A 58 -7.639 -2.778 -11.540 1.00 21.40 S ATOM 0 H CYS A 58 -8.309 -0.711 -13.620 1.00 2.32 H new ATOM 0 HA CYS A 58 -6.490 -2.826 -14.231 1.00 74.41 H new ATOM 0 HB2 CYS A 58 -9.353 -2.730 -13.214 1.00 33.13 H new ATOM 0 HB3 CYS A 58 -8.398 -4.196 -13.317 1.00 33.13 H new ATOM 0 HG CYS A 58 -7.877 -1.542 -11.215 1.00 21.40 H new ATOM 892 N ARG A 59 -8.937 -2.315 -16.386 1.00 45.34 N ATOM 893 CA ARG A 59 -9.338 -2.584 -17.794 1.00 3.50 C ATOM 894 C ARG A 59 -8.134 -2.347 -18.721 1.00 32.25 C ATOM 895 O ARG A 59 -7.788 -3.203 -19.533 1.00 30.42 O ATOM 896 CB ARG A 59 -10.516 -1.667 -18.245 1.00 75.11 C ATOM 897 CG ARG A 59 -11.867 -1.903 -17.538 1.00 34.33 C ATOM 898 CD ARG A 59 -12.942 -0.897 -17.996 1.00 4.44 C ATOM 899 NE ARG A 59 -14.184 -1.011 -17.207 1.00 43.20 N ATOM 900 CZ ARG A 59 -14.911 0.023 -16.739 1.00 2.33 C ATOM 901 NH1 ARG A 59 -14.537 1.283 -16.974 1.00 64.01 N ATOM 902 NH2 ARG A 59 -16.022 -0.209 -16.050 1.00 24.12 N ATOM 0 H ARG A 59 -9.444 -1.541 -15.956 1.00 45.34 H new ATOM 0 HA ARG A 59 -9.671 -3.620 -17.855 1.00 3.50 H new ATOM 0 HB2 ARG A 59 -10.223 -0.629 -18.088 1.00 75.11 H new ATOM 0 HB3 ARG A 59 -10.662 -1.798 -19.317 1.00 75.11 H new ATOM 0 HG2 ARG A 59 -12.210 -2.918 -17.741 1.00 34.33 H new ATOM 0 HG3 ARG A 59 -11.731 -1.822 -16.460 1.00 34.33 H new ATOM 0 HD2 ARG A 59 -12.550 0.116 -17.909 1.00 4.44 H new ATOM 0 HD3 ARG A 59 -13.166 -1.062 -19.050 1.00 4.44 H new ATOM 0 HE ARG A 59 -14.520 -1.951 -16.998 1.00 43.20 H new ATOM 0 HH11 ARG A 59 -13.692 1.472 -17.513 1.00 64.01 H new ATOM 0 HH12 ARG A 59 -15.096 2.056 -16.614 1.00 64.01 H new ATOM 0 HH21 ARG A 59 -16.323 -1.168 -15.876 1.00 24.12 H new ATOM 0 HH22 ARG A 59 -16.574 0.572 -15.695 1.00 24.12 H new ATOM 916 N HIS A 60 -7.503 -1.168 -18.555 1.00 52.31 N ATOM 917 CA HIS A 60 -6.303 -0.759 -19.317 1.00 35.15 C ATOM 918 C HIS A 60 -5.157 -1.762 -19.133 1.00 2.44 C ATOM 919 O HIS A 60 -4.513 -2.149 -20.095 1.00 22.53 O ATOM 920 CB HIS A 60 -5.847 0.659 -18.882 1.00 73.30 C ATOM 921 CG HIS A 60 -4.543 1.124 -19.500 1.00 61.54 C ATOM 922 ND1 HIS A 60 -4.442 1.561 -20.797 1.00 63.01 N ATOM 923 CD2 HIS A 60 -3.286 1.185 -18.993 1.00 14.22 C ATOM 924 CE1 HIS A 60 -3.192 1.865 -21.065 1.00 24.34 C ATOM 925 NE2 HIS A 60 -2.464 1.654 -19.986 1.00 62.24 N ATOM 0 H HIS A 60 -7.813 -0.466 -17.883 1.00 52.31 H new ATOM 0 HA HIS A 60 -6.568 -0.740 -20.374 1.00 35.15 H new ATOM 0 HB2 HIS A 60 -6.630 1.372 -19.140 1.00 73.30 H new ATOM 0 HB3 HIS A 60 -5.745 0.676 -17.797 1.00 73.30 H new ATOM 0 HD2 HIS A 60 -2.987 0.914 -17.991 1.00 14.22 H new ATOM 0 HE1 HIS A 60 -2.822 2.228 -22.013 1.00 24.34 H new ATOM 0 HE2 HIS A 60 -1.460 1.813 -19.904 1.00 62.24 H new ATOM 934 N HIS A 61 -4.944 -2.173 -17.883 1.00 60.13 N ATOM 935 CA HIS A 61 -3.827 -3.039 -17.477 1.00 23.32 C ATOM 936 C HIS A 61 -3.980 -4.455 -18.071 1.00 43.11 C ATOM 937 O HIS A 61 -2.987 -5.103 -18.414 1.00 41.54 O ATOM 938 CB HIS A 61 -3.784 -3.092 -15.931 1.00 12.10 C ATOM 939 CG HIS A 61 -2.635 -3.867 -15.349 1.00 1.45 C ATOM 940 ND1 HIS A 61 -2.696 -5.213 -15.063 1.00 75.23 N ATOM 941 CD2 HIS A 61 -1.396 -3.467 -14.992 1.00 52.45 C ATOM 942 CE1 HIS A 61 -1.549 -5.604 -14.549 1.00 14.04 C ATOM 943 NE2 HIS A 61 -0.741 -4.563 -14.492 1.00 12.11 N ATOM 0 H HIS A 61 -5.552 -1.911 -17.107 1.00 60.13 H new ATOM 0 HA HIS A 61 -2.891 -2.630 -17.858 1.00 23.32 H new ATOM 0 HB2 HIS A 61 -3.744 -2.072 -15.549 1.00 12.10 H new ATOM 0 HB3 HIS A 61 -4.716 -3.530 -15.572 1.00 12.10 H new ATOM 0 HD1 HIS A 61 -3.504 -5.814 -15.224 1.00 75.23 H new ATOM 0 HD2 HIS A 61 -0.995 -2.468 -15.083 1.00 52.45 H new ATOM 0 HE1 HIS A 61 -1.310 -6.607 -14.228 1.00 14.04 H new ATOM 952 N HIS A 62 -5.240 -4.924 -18.164 1.00 73.23 N ATOM 953 CA HIS A 62 -5.561 -6.282 -18.645 1.00 31.02 C ATOM 954 C HIS A 62 -5.590 -6.352 -20.182 1.00 4.21 C ATOM 955 O HIS A 62 -5.022 -7.271 -20.778 1.00 11.15 O ATOM 956 CB HIS A 62 -6.913 -6.742 -18.050 1.00 32.02 C ATOM 957 CG HIS A 62 -7.302 -8.161 -18.394 1.00 3.31 C ATOM 958 ND1 HIS A 62 -6.852 -9.245 -17.678 1.00 41.30 N ATOM 959 CD2 HIS A 62 -8.110 -8.667 -19.364 1.00 63.32 C ATOM 960 CE1 HIS A 62 -7.356 -10.346 -18.184 1.00 30.11 C ATOM 961 NE2 HIS A 62 -8.119 -10.022 -19.203 1.00 63.32 N ATOM 0 H HIS A 62 -6.061 -4.375 -17.909 1.00 73.23 H new ATOM 0 HA HIS A 62 -4.773 -6.956 -18.309 1.00 31.02 H new ATOM 0 HB2 HIS A 62 -6.870 -6.644 -16.965 1.00 32.02 H new ATOM 0 HB3 HIS A 62 -7.696 -6.070 -18.400 1.00 32.02 H new ATOM 0 HD2 HIS A 62 -8.642 -8.105 -20.117 1.00 63.32 H new ATOM 0 HE1 HIS A 62 -7.174 -11.348 -17.824 1.00 30.11 H new ATOM 0 HE2 HIS A 62 -8.638 -10.681 -19.784 1.00 63.32 H new ATOM 970 N GLN A 63 -6.275 -5.384 -20.804 1.00 3.34 N ATOM 971 CA GLN A 63 -6.485 -5.346 -22.270 1.00 21.20 C ATOM 972 C GLN A 63 -5.224 -4.852 -23.000 1.00 72.13 C ATOM 973 O GLN A 63 -4.985 -5.205 -24.160 1.00 4.24 O ATOM 974 CB GLN A 63 -7.704 -4.439 -22.612 1.00 25.13 C ATOM 975 CG GLN A 63 -9.063 -4.910 -22.028 1.00 61.23 C ATOM 976 CD GLN A 63 -9.543 -6.264 -22.569 1.00 13.42 C ATOM 977 OE1 GLN A 63 -9.243 -6.643 -23.698 1.00 64.32 O ATOM 978 NE2 GLN A 63 -10.311 -6.989 -21.778 1.00 1.04 N ATOM 0 H GLN A 63 -6.703 -4.601 -20.310 1.00 3.34 H new ATOM 0 HA GLN A 63 -6.691 -6.360 -22.611 1.00 21.20 H new ATOM 0 HB2 GLN A 63 -7.500 -3.432 -22.249 1.00 25.13 H new ATOM 0 HB3 GLN A 63 -7.796 -4.374 -23.696 1.00 25.13 H new ATOM 0 HG2 GLN A 63 -8.977 -4.974 -20.943 1.00 61.23 H new ATOM 0 HG3 GLN A 63 -9.820 -4.156 -22.244 1.00 61.23 H new ATOM 0 HE21 GLN A 63 -10.545 -6.651 -20.845 1.00 1.04 H new ATOM 0 HE22 GLN A 63 -10.671 -7.888 -22.100 1.00 1.04 H new ATOM 987 N HIS A 64 -4.441 -4.004 -22.318 1.00 71.40 N ATOM 988 CA HIS A 64 -3.144 -3.501 -22.804 1.00 62.54 C ATOM 989 C HIS A 64 -2.082 -3.817 -21.726 1.00 74.35 C ATOM 990 O HIS A 64 -2.014 -3.108 -20.712 1.00 31.41 O ATOM 991 CB HIS A 64 -3.205 -1.967 -23.088 1.00 23.51 C ATOM 992 CG HIS A 64 -4.162 -1.565 -24.194 1.00 13.23 C ATOM 993 ND1 HIS A 64 -3.744 -1.115 -25.426 1.00 62.12 N ATOM 994 CD2 HIS A 64 -5.522 -1.537 -24.242 1.00 73.11 C ATOM 995 CE1 HIS A 64 -4.788 -0.827 -26.176 1.00 31.02 C ATOM 996 NE2 HIS A 64 -5.879 -1.075 -25.486 1.00 65.33 N ATOM 0 H HIS A 64 -4.693 -3.641 -21.399 1.00 71.40 H new ATOM 0 HA HIS A 64 -2.885 -3.987 -23.745 1.00 62.54 H new ATOM 0 HB2 HIS A 64 -3.494 -1.453 -22.171 1.00 23.51 H new ATOM 0 HB3 HIS A 64 -2.205 -1.619 -23.347 1.00 23.51 H new ATOM 0 HD2 HIS A 64 -6.196 -1.825 -23.449 1.00 73.11 H new ATOM 0 HE1 HIS A 64 -4.753 -0.450 -27.188 1.00 31.02 H new ATOM 0 HE2 HIS A 64 -6.834 -0.946 -25.819 1.00 65.33 H new ATOM 1005 N PRO A 65 -1.271 -4.918 -21.897 1.00 71.30 N ATOM 1006 CA PRO A 65 -0.252 -5.334 -20.896 1.00 0.51 C ATOM 1007 C PRO A 65 0.749 -4.202 -20.576 1.00 2.32 C ATOM 1008 O PRO A 65 1.641 -3.908 -21.377 1.00 1.31 O ATOM 1009 CB PRO A 65 0.445 -6.555 -21.568 1.00 43.22 C ATOM 1010 CG PRO A 65 -0.568 -7.072 -22.545 1.00 43.43 C ATOM 1011 CD PRO A 65 -1.292 -5.848 -23.060 1.00 41.42 C ATOM 0 HA PRO A 65 -0.694 -5.580 -19.931 1.00 0.51 H new ATOM 0 HB2 PRO A 65 1.366 -6.260 -22.070 1.00 43.22 H new ATOM 0 HB3 PRO A 65 0.712 -7.314 -20.833 1.00 43.22 H new ATOM 0 HG2 PRO A 65 -0.087 -7.615 -23.359 1.00 43.43 H new ATOM 0 HG3 PRO A 65 -1.260 -7.764 -22.064 1.00 43.43 H new ATOM 0 HD2 PRO A 65 -0.789 -5.419 -23.926 1.00 41.42 H new ATOM 0 HD3 PRO A 65 -2.311 -6.084 -23.367 1.00 41.42 H new ATOM 1019 N GLY A 66 0.517 -3.523 -19.441 1.00 44.43 N ATOM 1020 CA GLY A 66 1.351 -2.411 -19.003 1.00 52.31 C ATOM 1021 C GLY A 66 0.814 -1.777 -17.727 1.00 42.10 C ATOM 1022 O GLY A 66 0.996 -2.331 -16.641 1.00 72.10 O ATOM 0 H GLY A 66 -0.254 -3.735 -18.808 1.00 44.43 H new ATOM 0 HA2 GLY A 66 2.369 -2.763 -18.835 1.00 52.31 H new ATOM 0 HA3 GLY A 66 1.400 -1.659 -19.791 1.00 52.31 H new ATOM 1026 N GLY A 67 0.120 -0.629 -17.871 1.00 41.42 N ATOM 1027 CA GLY A 67 -0.324 0.182 -16.723 1.00 34.53 C ATOM 1028 C GLY A 67 0.802 1.039 -16.133 1.00 73.22 C ATOM 1029 O GLY A 67 0.604 1.746 -15.136 1.00 25.13 O ATOM 0 H GLY A 67 -0.145 -0.243 -18.777 1.00 41.42 H new ATOM 0 HA2 GLY A 67 -1.142 0.830 -17.036 1.00 34.53 H new ATOM 0 HA3 GLY A 67 -0.718 -0.477 -15.949 1.00 34.53 H new ATOM 1033 N SER A 68 1.983 0.974 -16.771 1.00 73.53 N ATOM 1034 CA SER A 68 3.219 1.634 -16.333 1.00 42.43 C ATOM 1035 C SER A 68 4.107 1.901 -17.571 1.00 14.32 C ATOM 1036 O SER A 68 3.933 1.257 -18.622 1.00 3.44 O ATOM 1037 CB SER A 68 3.983 0.743 -15.307 1.00 64.23 C ATOM 1038 OG SER A 68 3.173 0.395 -14.192 1.00 3.23 O ATOM 0 H SER A 68 2.105 0.443 -17.633 1.00 73.53 H new ATOM 0 HA SER A 68 2.972 2.576 -15.844 1.00 42.43 H new ATOM 0 HB2 SER A 68 4.327 -0.165 -15.802 1.00 64.23 H new ATOM 0 HB3 SER A 68 4.870 1.272 -14.959 1.00 64.23 H new ATOM 0 HG SER A 68 3.689 -0.164 -13.575 1.00 3.23 H new ATOM 1044 N GLY A 69 5.045 2.846 -17.430 1.00 12.33 N ATOM 1045 CA GLY A 69 5.996 3.189 -18.490 1.00 45.53 C ATOM 1046 C GLY A 69 7.291 3.742 -17.912 1.00 22.20 C ATOM 1047 O GLY A 69 7.259 4.488 -16.921 1.00 32.03 O ATOM 0 H GLY A 69 5.164 3.393 -16.577 1.00 12.33 H new ATOM 0 HA2 GLY A 69 6.211 2.304 -19.089 1.00 45.53 H new ATOM 0 HA3 GLY A 69 5.549 3.925 -19.158 1.00 45.53 H new ATOM 1051 N LEU A 70 8.430 3.370 -18.523 1.00 21.23 N ATOM 1052 CA LEU A 70 9.772 3.795 -18.083 1.00 44.13 C ATOM 1053 C LEU A 70 10.037 5.228 -18.596 1.00 5.53 C ATOM 1054 O LEU A 70 9.955 6.199 -17.837 1.00 64.30 O ATOM 1055 CB LEU A 70 10.843 2.784 -18.598 1.00 74.40 C ATOM 1056 CG LEU A 70 10.629 1.289 -18.186 1.00 21.35 C ATOM 1057 CD1 LEU A 70 11.673 0.359 -18.851 1.00 63.02 C ATOM 1058 CD2 LEU A 70 10.621 1.123 -16.643 1.00 43.43 C ATOM 0 H LEU A 70 8.446 2.762 -19.342 1.00 21.23 H new ATOM 0 HA LEU A 70 9.831 3.805 -16.995 1.00 44.13 H new ATOM 0 HB2 LEU A 70 10.873 2.840 -19.686 1.00 74.40 H new ATOM 0 HB3 LEU A 70 11.820 3.104 -18.236 1.00 74.40 H new ATOM 0 HG LEU A 70 9.648 0.988 -18.553 1.00 21.35 H new ATOM 0 HD11 LEU A 70 11.493 -0.670 -18.541 1.00 63.02 H new ATOM 0 HD12 LEU A 70 11.587 0.432 -19.935 1.00 63.02 H new ATOM 0 HD13 LEU A 70 12.675 0.660 -18.545 1.00 63.02 H new ATOM 0 HD21 LEU A 70 10.470 0.073 -16.391 1.00 43.43 H new ATOM 0 HD22 LEU A 70 11.574 1.461 -16.236 1.00 43.43 H new ATOM 0 HD23 LEU A 70 9.813 1.718 -16.217 1.00 43.43 H new ATOM 1070 N ASP A 71 10.308 5.341 -19.910 1.00 24.31 N ATOM 1071 CA ASP A 71 10.450 6.644 -20.606 1.00 41.35 C ATOM 1072 C ASP A 71 9.267 6.837 -21.589 1.00 1.24 C ATOM 1073 O ASP A 71 9.142 7.869 -22.254 1.00 64.11 O ATOM 1074 CB ASP A 71 11.836 6.703 -21.317 1.00 0.51 C ATOM 1075 CG ASP A 71 12.177 8.073 -21.950 1.00 43.01 C ATOM 1076 OD1 ASP A 71 12.218 9.086 -21.219 1.00 31.20 O ATOM 1077 OD2 ASP A 71 12.427 8.141 -23.175 1.00 23.43 O ATOM 0 H ASP A 71 10.435 4.536 -20.523 1.00 24.31 H new ATOM 0 HA ASP A 71 10.415 7.467 -19.892 1.00 41.35 H new ATOM 0 HB2 ASP A 71 12.611 6.448 -20.595 1.00 0.51 H new ATOM 0 HB3 ASP A 71 11.863 5.941 -22.096 1.00 0.51 H new ATOM 1082 N ASP A 72 8.370 5.832 -21.620 1.00 13.52 N ATOM 1083 CA ASP A 72 7.188 5.798 -22.488 1.00 75.53 C ATOM 1084 C ASP A 72 5.929 6.101 -21.648 1.00 14.44 C ATOM 1085 O ASP A 72 5.342 5.215 -21.023 1.00 44.31 O ATOM 1086 CB ASP A 72 7.109 4.422 -23.226 1.00 42.01 C ATOM 1087 CG ASP A 72 7.052 3.198 -22.282 1.00 30.23 C ATOM 1088 OD1 ASP A 72 8.059 2.928 -21.577 1.00 35.24 O ATOM 1089 OD2 ASP A 72 6.013 2.491 -22.252 1.00 61.32 O ATOM 0 H ASP A 72 8.453 5.006 -21.028 1.00 13.52 H new ATOM 0 HA ASP A 72 7.258 6.565 -23.259 1.00 75.53 H new ATOM 0 HB2 ASP A 72 6.226 4.415 -23.865 1.00 42.01 H new ATOM 0 HB3 ASP A 72 7.976 4.323 -23.879 1.00 42.01 H new ATOM 1094 N ILE A 73 5.567 7.389 -21.581 1.00 54.44 N ATOM 1095 CA ILE A 73 4.387 7.861 -20.841 1.00 75.40 C ATOM 1096 C ILE A 73 3.173 7.870 -21.796 1.00 22.31 C ATOM 1097 O ILE A 73 3.128 8.699 -22.717 1.00 42.54 O ATOM 1098 CB ILE A 73 4.602 9.304 -20.215 1.00 15.43 C ATOM 1099 CG1 ILE A 73 5.742 9.317 -19.127 1.00 43.13 C ATOM 1100 CG2 ILE A 73 3.280 9.862 -19.621 1.00 32.42 C ATOM 1101 CD1 ILE A 73 7.168 9.180 -19.651 1.00 35.34 C ATOM 0 H ILE A 73 6.086 8.137 -22.040 1.00 54.44 H new ATOM 0 HA ILE A 73 4.213 7.180 -20.008 1.00 75.40 H new ATOM 0 HB ILE A 73 4.918 9.955 -21.030 1.00 15.43 H new ATOM 0 HG12 ILE A 73 5.670 10.248 -18.565 1.00 43.13 H new ATOM 0 HG13 ILE A 73 5.555 8.506 -18.424 1.00 43.13 H new ATOM 0 HG21 ILE A 73 3.459 10.851 -19.200 1.00 32.42 H new ATOM 0 HG22 ILE A 73 2.529 9.933 -20.408 1.00 32.42 H new ATOM 0 HG23 ILE A 73 2.922 9.194 -18.838 1.00 32.42 H new ATOM 0 HD11 ILE A 73 7.867 9.202 -18.815 1.00 35.34 H new ATOM 0 HD12 ILE A 73 7.270 8.235 -20.185 1.00 35.34 H new ATOM 0 HD13 ILE A 73 7.387 10.005 -20.329 1.00 35.34 H new ATOM 1113 N PRO A 74 2.184 6.926 -21.626 1.00 52.04 N ATOM 1114 CA PRO A 74 0.953 6.913 -22.436 1.00 34.02 C ATOM 1115 C PRO A 74 -0.037 8.023 -21.977 1.00 70.15 C ATOM 1116 O PRO A 74 -0.061 8.363 -20.781 1.00 43.42 O ATOM 1117 CB PRO A 74 0.383 5.474 -22.210 1.00 64.25 C ATOM 1118 CG PRO A 74 1.423 4.741 -21.400 1.00 33.52 C ATOM 1119 CD PRO A 74 2.180 5.807 -20.653 1.00 52.34 C ATOM 0 HA PRO A 74 1.129 7.124 -23.491 1.00 34.02 H new ATOM 0 HB2 PRO A 74 -0.570 5.510 -21.682 1.00 64.25 H new ATOM 0 HB3 PRO A 74 0.202 4.972 -23.160 1.00 64.25 H new ATOM 0 HG2 PRO A 74 0.958 4.035 -20.712 1.00 33.52 H new ATOM 0 HG3 PRO A 74 2.088 4.166 -22.044 1.00 33.52 H new ATOM 0 HD2 PRO A 74 1.686 6.080 -19.720 1.00 52.34 H new ATOM 0 HD3 PRO A 74 3.190 5.486 -20.397 1.00 52.34 H new ATOM 1127 N PRO A 75 -0.847 8.613 -22.933 1.00 44.10 N ATOM 1128 CA PRO A 75 -1.805 9.707 -22.635 1.00 63.41 C ATOM 1129 C PRO A 75 -2.780 9.363 -21.489 1.00 73.22 C ATOM 1130 O PRO A 75 -2.897 10.137 -20.536 1.00 3.41 O ATOM 1131 CB PRO A 75 -2.555 9.908 -23.977 1.00 11.20 C ATOM 1132 CG PRO A 75 -1.588 9.440 -25.018 1.00 41.34 C ATOM 1133 CD PRO A 75 -0.865 8.275 -24.385 1.00 71.14 C ATOM 0 HA PRO A 75 -1.296 10.605 -22.285 1.00 63.41 H new ATOM 0 HB2 PRO A 75 -3.479 9.331 -24.006 1.00 11.20 H new ATOM 0 HB3 PRO A 75 -2.826 10.953 -24.128 1.00 11.20 H new ATOM 0 HG2 PRO A 75 -2.105 9.136 -25.928 1.00 41.34 H new ATOM 0 HG3 PRO A 75 -0.893 10.232 -25.295 1.00 41.34 H new ATOM 0 HD2 PRO A 75 -1.383 7.334 -24.570 1.00 71.14 H new ATOM 0 HD3 PRO A 75 0.144 8.167 -24.783 1.00 71.14 H new ATOM 1141 N TYR A 76 -3.436 8.176 -21.576 1.00 4.05 N ATOM 1142 CA TYR A 76 -4.401 7.710 -20.547 1.00 4.11 C ATOM 1143 C TYR A 76 -3.768 7.708 -19.148 1.00 64.43 C ATOM 1144 O TYR A 76 -4.316 8.289 -18.221 1.00 15.32 O ATOM 1145 CB TYR A 76 -4.964 6.284 -20.859 1.00 72.34 C ATOM 1146 CG TYR A 76 -5.733 5.648 -19.674 1.00 20.43 C ATOM 1147 CD1 TYR A 76 -5.152 4.649 -18.876 1.00 12.13 C ATOM 1148 CD2 TYR A 76 -7.004 6.104 -19.310 1.00 11.12 C ATOM 1149 CE1 TYR A 76 -5.809 4.137 -17.773 1.00 55.32 C ATOM 1150 CE2 TYR A 76 -7.663 5.580 -18.217 1.00 23.03 C ATOM 1151 CZ TYR A 76 -7.061 4.603 -17.449 1.00 30.54 C ATOM 1152 OH TYR A 76 -7.707 4.100 -16.347 1.00 64.11 O ATOM 0 H TYR A 76 -3.313 7.524 -22.350 1.00 4.05 H new ATOM 0 HA TYR A 76 -5.230 8.417 -20.569 1.00 4.11 H new ATOM 0 HB2 TYR A 76 -5.628 6.345 -21.721 1.00 72.34 H new ATOM 0 HB3 TYR A 76 -4.138 5.630 -21.139 1.00 72.34 H new ATOM 0 HD1 TYR A 76 -4.172 4.273 -19.129 1.00 12.13 H new ATOM 0 HD2 TYR A 76 -7.478 6.879 -19.894 1.00 11.12 H new ATOM 0 HE1 TYR A 76 -5.341 3.374 -17.168 1.00 55.32 H new ATOM 0 HE2 TYR A 76 -8.651 5.934 -17.962 1.00 23.03 H new ATOM 0 HH TYR A 76 -7.452 4.616 -15.554 1.00 64.11 H new ATOM 1162 N ASP A 77 -2.624 7.025 -19.032 1.00 13.23 N ATOM 1163 CA ASP A 77 -1.960 6.740 -17.743 1.00 25.31 C ATOM 1164 C ASP A 77 -1.522 8.034 -17.037 1.00 61.35 C ATOM 1165 O ASP A 77 -1.524 8.105 -15.797 1.00 42.22 O ATOM 1166 CB ASP A 77 -0.750 5.798 -17.979 1.00 25.23 C ATOM 1167 CG ASP A 77 -1.157 4.441 -18.598 1.00 22.44 C ATOM 1168 OD1 ASP A 77 -1.003 3.384 -17.944 1.00 0.03 O ATOM 1169 OD2 ASP A 77 -1.640 4.428 -19.755 1.00 33.50 O ATOM 0 H ASP A 77 -2.123 6.648 -19.836 1.00 13.23 H new ATOM 0 HA ASP A 77 -2.675 6.244 -17.086 1.00 25.31 H new ATOM 0 HB2 ASP A 77 -0.034 6.292 -18.636 1.00 25.23 H new ATOM 0 HB3 ASP A 77 -0.243 5.622 -17.031 1.00 25.23 H new ATOM 1174 N ARG A 78 -1.170 9.054 -17.831 1.00 52.24 N ATOM 1175 CA ARG A 78 -0.803 10.379 -17.303 1.00 11.41 C ATOM 1176 C ARG A 78 -2.059 11.153 -16.850 1.00 32.05 C ATOM 1177 O ARG A 78 -2.081 11.723 -15.750 1.00 64.43 O ATOM 1178 CB ARG A 78 0.001 11.172 -18.358 1.00 21.43 C ATOM 1179 CG ARG A 78 0.599 12.494 -17.834 1.00 51.13 C ATOM 1180 CD ARG A 78 1.473 13.215 -18.873 1.00 60.44 C ATOM 1181 NE ARG A 78 2.055 14.460 -18.339 1.00 52.04 N ATOM 1182 CZ ARG A 78 2.828 15.314 -19.029 1.00 11.41 C ATOM 1183 NH1 ARG A 78 3.142 15.081 -20.301 1.00 62.10 N ATOM 1184 NH2 ARG A 78 3.290 16.406 -18.431 1.00 31.14 N ATOM 0 H ARG A 78 -1.131 8.988 -18.848 1.00 52.24 H new ATOM 0 HA ARG A 78 -0.168 10.244 -16.428 1.00 11.41 H new ATOM 0 HB2 ARG A 78 0.809 10.543 -18.731 1.00 21.43 H new ATOM 0 HB3 ARG A 78 -0.649 11.391 -19.205 1.00 21.43 H new ATOM 0 HG2 ARG A 78 -0.211 13.156 -17.528 1.00 51.13 H new ATOM 0 HG3 ARG A 78 1.196 12.289 -16.946 1.00 51.13 H new ATOM 0 HD2 ARG A 78 2.274 12.550 -19.196 1.00 60.44 H new ATOM 0 HD3 ARG A 78 0.874 13.444 -19.754 1.00 60.44 H new ATOM 0 HE ARG A 78 1.854 14.691 -17.366 1.00 52.04 H new ATOM 0 HH11 ARG A 78 2.794 14.243 -20.767 1.00 62.10 H new ATOM 0 HH12 ARG A 78 3.730 15.741 -20.810 1.00 62.10 H new ATOM 0 HH21 ARG A 78 3.057 16.590 -17.455 1.00 31.14 H new ATOM 0 HH22 ARG A 78 3.878 17.060 -18.947 1.00 31.14 H new ATOM 1198 N ASP A 79 -3.111 11.132 -17.696 1.00 72.43 N ATOM 1199 CA ASP A 79 -4.421 11.780 -17.396 1.00 4.23 C ATOM 1200 C ASP A 79 -5.145 11.089 -16.228 1.00 14.34 C ATOM 1201 O ASP A 79 -5.997 11.698 -15.566 1.00 12.55 O ATOM 1202 CB ASP A 79 -5.335 11.828 -18.654 1.00 11.12 C ATOM 1203 CG ASP A 79 -4.906 12.900 -19.678 1.00 64.44 C ATOM 1204 OD1 ASP A 79 -4.261 12.566 -20.692 1.00 74.34 O ATOM 1205 OD2 ASP A 79 -5.219 14.094 -19.473 1.00 20.51 O ATOM 0 H ASP A 79 -3.084 10.669 -18.605 1.00 72.43 H new ATOM 0 HA ASP A 79 -4.204 12.805 -17.095 1.00 4.23 H new ATOM 0 HB2 ASP A 79 -5.329 10.851 -19.137 1.00 11.12 H new ATOM 0 HB3 ASP A 79 -6.361 12.023 -18.342 1.00 11.12 H new ATOM 1210 N PHE A 80 -4.795 9.818 -15.998 1.00 12.04 N ATOM 1211 CA PHE A 80 -5.300 9.009 -14.881 1.00 4.22 C ATOM 1212 C PHE A 80 -4.771 9.569 -13.549 1.00 30.22 C ATOM 1213 O PHE A 80 -5.508 9.678 -12.560 1.00 25.02 O ATOM 1214 CB PHE A 80 -4.853 7.529 -15.077 1.00 75.21 C ATOM 1215 CG PHE A 80 -5.252 6.598 -13.939 1.00 45.25 C ATOM 1216 CD1 PHE A 80 -4.327 6.201 -12.967 1.00 4.22 C ATOM 1217 CD2 PHE A 80 -6.562 6.156 -13.822 1.00 13.02 C ATOM 1218 CE1 PHE A 80 -4.709 5.397 -11.918 1.00 3.20 C ATOM 1219 CE2 PHE A 80 -6.935 5.349 -12.781 1.00 25.44 C ATOM 1220 CZ PHE A 80 -6.017 4.967 -11.824 1.00 74.41 C ATOM 0 H PHE A 80 -4.140 9.313 -16.595 1.00 12.04 H new ATOM 0 HA PHE A 80 -6.389 9.048 -14.858 1.00 4.22 H new ATOM 0 HB2 PHE A 80 -5.281 7.152 -16.006 1.00 75.21 H new ATOM 0 HB3 PHE A 80 -3.769 7.501 -15.191 1.00 75.21 H new ATOM 0 HD1 PHE A 80 -3.301 6.530 -13.041 1.00 4.22 H new ATOM 0 HD2 PHE A 80 -7.294 6.451 -14.559 1.00 13.02 H new ATOM 0 HE1 PHE A 80 -3.987 5.103 -11.170 1.00 3.20 H new ATOM 0 HE2 PHE A 80 -7.957 5.008 -12.708 1.00 25.44 H new ATOM 0 HZ PHE A 80 -6.321 4.333 -11.004 1.00 74.41 H new ATOM 1230 N CYS A 81 -3.480 9.928 -13.564 1.00 54.20 N ATOM 1231 CA CYS A 81 -2.773 10.463 -12.396 1.00 41.42 C ATOM 1232 C CYS A 81 -3.136 11.941 -12.127 1.00 74.52 C ATOM 1233 O CYS A 81 -2.861 12.450 -11.034 1.00 15.32 O ATOM 1234 CB CYS A 81 -1.265 10.286 -12.618 1.00 75.20 C ATOM 1235 SG CYS A 81 -0.801 8.565 -12.894 1.00 24.52 S ATOM 0 H CYS A 81 -2.893 9.854 -14.395 1.00 54.20 H new ATOM 0 HA CYS A 81 -3.081 9.912 -11.508 1.00 41.42 H new ATOM 0 HB2 CYS A 81 -0.955 10.884 -13.475 1.00 75.20 H new ATOM 0 HB3 CYS A 81 -0.727 10.669 -11.751 1.00 75.20 H new ATOM 0 HG CYS A 81 -1.067 8.236 -14.123 1.00 24.52 H new ATOM 1241 N LYS A 82 -3.761 12.613 -13.123 1.00 12.32 N ATOM 1242 CA LYS A 82 -4.249 13.999 -12.979 1.00 44.32 C ATOM 1243 C LYS A 82 -5.546 14.000 -12.151 1.00 13.23 C ATOM 1244 O LYS A 82 -6.652 14.009 -12.704 1.00 3.24 O ATOM 1245 CB LYS A 82 -4.506 14.651 -14.366 1.00 12.24 C ATOM 1246 CG LYS A 82 -3.267 14.768 -15.269 1.00 73.32 C ATOM 1247 CD LYS A 82 -3.610 15.359 -16.658 1.00 14.43 C ATOM 1248 CE LYS A 82 -2.422 15.345 -17.636 1.00 44.43 C ATOM 1249 NZ LYS A 82 -2.820 15.835 -18.984 1.00 52.41 N ATOM 0 H LYS A 82 -3.939 12.209 -14.043 1.00 12.32 H new ATOM 0 HA LYS A 82 -3.484 14.584 -12.469 1.00 44.32 H new ATOM 0 HB2 LYS A 82 -5.265 14.069 -14.889 1.00 12.24 H new ATOM 0 HB3 LYS A 82 -4.919 15.648 -14.211 1.00 12.24 H new ATOM 0 HG2 LYS A 82 -2.523 15.398 -14.782 1.00 73.32 H new ATOM 0 HG3 LYS A 82 -2.818 13.783 -15.396 1.00 73.32 H new ATOM 0 HD2 LYS A 82 -4.435 14.794 -17.092 1.00 14.43 H new ATOM 0 HD3 LYS A 82 -3.957 16.385 -16.533 1.00 14.43 H new ATOM 0 HE2 LYS A 82 -1.619 15.969 -17.243 1.00 44.43 H new ATOM 0 HE3 LYS A 82 -2.028 14.332 -17.717 1.00 44.43 H new ATOM 0 HZ1 LYS A 82 -2.044 15.671 -19.656 1.00 52.41 H new ATOM 0 HZ2 LYS A 82 -3.668 15.324 -19.303 1.00 52.41 H new ATOM 0 HZ3 LYS A 82 -3.027 16.853 -18.936 1.00 52.41 H new ATOM 1263 N VAL A 83 -5.388 13.910 -10.825 1.00 33.13 N ATOM 1264 CA VAL A 83 -6.484 13.981 -9.839 1.00 60.10 C ATOM 1265 C VAL A 83 -6.081 14.966 -8.730 1.00 33.21 C ATOM 1266 O VAL A 83 -4.883 15.258 -8.565 1.00 61.35 O ATOM 1267 CB VAL A 83 -6.804 12.562 -9.217 1.00 15.12 C ATOM 1268 CG1 VAL A 83 -7.417 11.596 -10.268 1.00 34.31 C ATOM 1269 CG2 VAL A 83 -5.545 11.939 -8.560 1.00 11.00 C ATOM 0 H VAL A 83 -4.473 13.783 -10.393 1.00 33.13 H new ATOM 0 HA VAL A 83 -7.388 14.324 -10.342 1.00 60.10 H new ATOM 0 HB VAL A 83 -7.551 12.715 -8.438 1.00 15.12 H new ATOM 0 HG11 VAL A 83 -7.622 10.633 -9.801 1.00 34.31 H new ATOM 0 HG12 VAL A 83 -8.346 12.018 -10.652 1.00 34.31 H new ATOM 0 HG13 VAL A 83 -6.714 11.458 -11.089 1.00 34.31 H new ATOM 0 HG21 VAL A 83 -5.797 10.965 -8.142 1.00 11.00 H new ATOM 0 HG22 VAL A 83 -4.764 11.820 -9.311 1.00 11.00 H new ATOM 0 HG23 VAL A 83 -5.188 12.594 -7.765 1.00 11.00 H new ATOM 1279 N ASP A 84 -7.070 15.482 -7.975 1.00 34.14 N ATOM 1280 CA ASP A 84 -6.804 16.411 -6.856 1.00 34.45 C ATOM 1281 C ASP A 84 -6.147 15.632 -5.695 1.00 14.44 C ATOM 1282 O ASP A 84 -6.329 14.423 -5.605 1.00 70.44 O ATOM 1283 CB ASP A 84 -8.116 17.111 -6.407 1.00 70.22 C ATOM 1284 CG ASP A 84 -7.871 18.325 -5.489 1.00 13.15 C ATOM 1285 OD1 ASP A 84 -6.985 19.150 -5.803 1.00 10.31 O ATOM 1286 OD2 ASP A 84 -8.572 18.478 -4.468 1.00 11.33 O ATOM 0 H ASP A 84 -8.058 15.273 -8.118 1.00 34.14 H new ATOM 0 HA ASP A 84 -6.117 17.193 -7.181 1.00 34.45 H new ATOM 0 HB2 ASP A 84 -8.668 17.436 -7.289 1.00 70.22 H new ATOM 0 HB3 ASP A 84 -8.745 16.390 -5.885 1.00 70.22 H new ATOM 1291 N GLN A 85 -5.396 16.329 -4.818 1.00 4.10 N ATOM 1292 CA GLN A 85 -4.564 15.680 -3.772 1.00 42.34 C ATOM 1293 C GLN A 85 -5.400 14.795 -2.785 1.00 73.14 C ATOM 1294 O GLN A 85 -4.989 13.654 -2.525 1.00 40.14 O ATOM 1295 CB GLN A 85 -3.683 16.728 -3.022 1.00 60.12 C ATOM 1296 CG GLN A 85 -2.675 16.134 -2.006 1.00 12.25 C ATOM 1297 CD GLN A 85 -1.715 15.089 -2.613 1.00 74.43 C ATOM 1298 OE1 GLN A 85 -0.652 15.427 -3.128 1.00 61.21 O ATOM 1299 NE2 GLN A 85 -2.079 13.811 -2.534 1.00 52.33 N ATOM 0 H GLN A 85 -5.346 17.348 -4.810 1.00 4.10 H new ATOM 0 HA GLN A 85 -3.894 14.991 -4.287 1.00 42.34 H new ATOM 0 HB2 GLN A 85 -3.131 17.310 -3.760 1.00 60.12 H new ATOM 0 HB3 GLN A 85 -4.339 17.421 -2.496 1.00 60.12 H new ATOM 0 HG2 GLN A 85 -2.088 16.945 -1.576 1.00 12.25 H new ATOM 0 HG3 GLN A 85 -3.228 15.672 -1.188 1.00 12.25 H new ATOM 0 HE21 GLN A 85 -2.968 13.560 -2.101 1.00 52.33 H new ATOM 0 HE22 GLN A 85 -1.469 13.083 -2.907 1.00 52.33 H new ATOM 1308 N PRO A 86 -6.572 15.264 -2.222 1.00 64.33 N ATOM 1309 CA PRO A 86 -7.502 14.371 -1.477 1.00 73.32 C ATOM 1310 C PRO A 86 -7.931 13.121 -2.283 1.00 70.23 C ATOM 1311 O PRO A 86 -7.862 11.994 -1.778 1.00 32.03 O ATOM 1312 CB PRO A 86 -8.714 15.281 -1.167 1.00 65.24 C ATOM 1313 CG PRO A 86 -8.130 16.655 -1.115 1.00 41.45 C ATOM 1314 CD PRO A 86 -7.052 16.673 -2.176 1.00 4.43 C ATOM 0 HA PRO A 86 -7.029 13.958 -0.586 1.00 73.32 H new ATOM 0 HB2 PRO A 86 -9.480 15.202 -1.938 1.00 65.24 H new ATOM 0 HB3 PRO A 86 -9.184 15.011 -0.221 1.00 65.24 H new ATOM 0 HG2 PRO A 86 -8.889 17.412 -1.313 1.00 41.45 H new ATOM 0 HG3 PRO A 86 -7.715 16.869 -0.130 1.00 41.45 H new ATOM 0 HD2 PRO A 86 -7.446 16.993 -3.141 1.00 4.43 H new ATOM 0 HD3 PRO A 86 -6.247 17.361 -1.917 1.00 4.43 H new ATOM 1322 N THR A 87 -8.329 13.349 -3.546 1.00 64.01 N ATOM 1323 CA THR A 87 -8.755 12.285 -4.483 1.00 54.24 C ATOM 1324 C THR A 87 -7.609 11.274 -4.761 1.00 32.51 C ATOM 1325 O THR A 87 -7.852 10.083 -4.991 1.00 51.42 O ATOM 1326 CB THR A 87 -9.232 12.932 -5.825 1.00 54.21 C ATOM 1327 OG1 THR A 87 -10.162 13.993 -5.547 1.00 24.43 O ATOM 1328 CG2 THR A 87 -9.892 11.918 -6.773 1.00 43.41 C ATOM 0 H THR A 87 -8.366 14.284 -3.953 1.00 64.01 H new ATOM 0 HA THR A 87 -9.576 11.736 -4.023 1.00 54.24 H new ATOM 0 HB THR A 87 -8.344 13.318 -6.325 1.00 54.21 H new ATOM 0 HG1 THR A 87 -10.458 14.398 -6.389 1.00 24.43 H new ATOM 0 HG21 THR A 87 -10.203 12.424 -7.687 1.00 43.41 H new ATOM 0 HG22 THR A 87 -9.179 11.131 -7.018 1.00 43.41 H new ATOM 0 HG23 THR A 87 -10.763 11.479 -6.287 1.00 43.41 H new ATOM 1336 N LEU A 88 -6.367 11.781 -4.708 1.00 63.22 N ATOM 1337 CA LEU A 88 -5.143 11.003 -4.956 1.00 31.15 C ATOM 1338 C LEU A 88 -4.930 10.021 -3.789 1.00 23.12 C ATOM 1339 O LEU A 88 -4.618 8.844 -4.002 1.00 44.42 O ATOM 1340 CB LEU A 88 -3.936 11.987 -5.146 1.00 24.41 C ATOM 1341 CG LEU A 88 -2.708 11.470 -5.971 1.00 65.55 C ATOM 1342 CD1 LEU A 88 -1.764 12.635 -6.353 1.00 42.23 C ATOM 1343 CD2 LEU A 88 -1.938 10.351 -5.239 1.00 65.13 C ATOM 0 H LEU A 88 -6.182 12.760 -4.488 1.00 63.22 H new ATOM 0 HA LEU A 88 -5.229 10.415 -5.870 1.00 31.15 H new ATOM 0 HB2 LEU A 88 -4.310 12.890 -5.629 1.00 24.41 H new ATOM 0 HB3 LEU A 88 -3.580 12.278 -4.158 1.00 24.41 H new ATOM 0 HG LEU A 88 -3.104 11.035 -6.889 1.00 65.55 H new ATOM 0 HD11 LEU A 88 -0.921 12.248 -6.925 1.00 42.23 H new ATOM 0 HD12 LEU A 88 -2.308 13.361 -6.956 1.00 42.23 H new ATOM 0 HD13 LEU A 88 -1.397 13.118 -5.447 1.00 42.23 H new ATOM 0 HD21 LEU A 88 -1.097 10.027 -5.852 1.00 65.13 H new ATOM 0 HD22 LEU A 88 -1.568 10.728 -4.285 1.00 65.13 H new ATOM 0 HD23 LEU A 88 -2.604 9.507 -5.062 1.00 65.13 H new ATOM 1355 N PHE A 89 -5.123 10.525 -2.558 1.00 62.34 N ATOM 1356 CA PHE A 89 -5.046 9.708 -1.333 1.00 41.21 C ATOM 1357 C PHE A 89 -6.136 8.627 -1.318 1.00 24.54 C ATOM 1358 O PHE A 89 -5.918 7.537 -0.792 1.00 52.13 O ATOM 1359 CB PHE A 89 -5.147 10.598 -0.072 1.00 62.12 C ATOM 1360 CG PHE A 89 -3.943 11.514 0.165 1.00 4.12 C ATOM 1361 CD1 PHE A 89 -4.102 12.841 0.563 1.00 31.13 C ATOM 1362 CD2 PHE A 89 -2.643 11.028 0.021 1.00 41.53 C ATOM 1363 CE1 PHE A 89 -3.006 13.649 0.810 1.00 54.52 C ATOM 1364 CE2 PHE A 89 -1.554 11.836 0.264 1.00 63.00 C ATOM 1365 CZ PHE A 89 -1.731 13.147 0.663 1.00 23.14 C ATOM 0 H PHE A 89 -5.336 11.507 -2.384 1.00 62.34 H new ATOM 0 HA PHE A 89 -4.077 9.210 -1.326 1.00 41.21 H new ATOM 0 HB2 PHE A 89 -6.044 11.213 -0.149 1.00 62.12 H new ATOM 0 HB3 PHE A 89 -5.275 9.956 0.800 1.00 62.12 H new ATOM 0 HD1 PHE A 89 -5.097 13.245 0.680 1.00 31.13 H new ATOM 0 HD2 PHE A 89 -2.488 10.004 -0.285 1.00 41.53 H new ATOM 0 HE1 PHE A 89 -3.150 14.674 1.118 1.00 54.52 H new ATOM 0 HE2 PHE A 89 -0.556 11.442 0.142 1.00 63.00 H new ATOM 0 HZ PHE A 89 -0.875 13.775 0.859 1.00 23.14 H new ATOM 1375 N GLU A 90 -7.298 8.946 -1.900 1.00 45.53 N ATOM 1376 CA GLU A 90 -8.415 8.000 -2.067 1.00 5.41 C ATOM 1377 C GLU A 90 -8.043 6.832 -3.002 1.00 54.30 C ATOM 1378 O GLU A 90 -8.481 5.693 -2.789 1.00 23.43 O ATOM 1379 CB GLU A 90 -9.652 8.746 -2.608 1.00 42.54 C ATOM 1380 CG GLU A 90 -10.252 9.772 -1.636 1.00 22.02 C ATOM 1381 CD GLU A 90 -10.772 9.126 -0.342 1.00 72.21 C ATOM 1382 OE1 GLU A 90 -11.558 8.150 -0.440 1.00 72.03 O ATOM 1383 OE2 GLU A 90 -10.438 9.603 0.771 1.00 1.22 O ATOM 0 H GLU A 90 -7.494 9.875 -2.272 1.00 45.53 H new ATOM 0 HA GLU A 90 -8.644 7.574 -1.090 1.00 5.41 H new ATOM 0 HB2 GLU A 90 -9.378 9.256 -3.531 1.00 42.54 H new ATOM 0 HB3 GLU A 90 -10.419 8.015 -2.863 1.00 42.54 H new ATOM 0 HG2 GLU A 90 -9.496 10.517 -1.388 1.00 22.02 H new ATOM 0 HG3 GLU A 90 -11.069 10.299 -2.129 1.00 22.02 H new ATOM 1390 N LEU A 91 -7.255 7.138 -4.047 1.00 65.33 N ATOM 1391 CA LEU A 91 -6.721 6.122 -4.978 1.00 73.24 C ATOM 1392 C LEU A 91 -5.707 5.204 -4.256 1.00 62.13 C ATOM 1393 O LEU A 91 -5.646 4.001 -4.543 1.00 24.10 O ATOM 1394 CB LEU A 91 -6.057 6.795 -6.215 1.00 22.43 C ATOM 1395 CG LEU A 91 -6.993 7.642 -7.143 1.00 45.13 C ATOM 1396 CD1 LEU A 91 -6.195 8.283 -8.305 1.00 33.55 C ATOM 1397 CD2 LEU A 91 -8.173 6.795 -7.678 1.00 51.43 C ATOM 0 H LEU A 91 -6.970 8.091 -4.272 1.00 65.33 H new ATOM 0 HA LEU A 91 -7.555 5.513 -5.328 1.00 73.24 H new ATOM 0 HB2 LEU A 91 -5.254 7.441 -5.860 1.00 22.43 H new ATOM 0 HB3 LEU A 91 -5.595 6.015 -6.819 1.00 22.43 H new ATOM 0 HG LEU A 91 -7.412 8.448 -6.541 1.00 45.13 H new ATOM 0 HD11 LEU A 91 -6.870 8.865 -8.933 1.00 33.55 H new ATOM 0 HD12 LEU A 91 -5.423 8.937 -7.899 1.00 33.55 H new ATOM 0 HD13 LEU A 91 -5.729 7.499 -8.902 1.00 33.55 H new ATOM 0 HD21 LEU A 91 -8.803 7.412 -8.318 1.00 51.43 H new ATOM 0 HD22 LEU A 91 -7.786 5.954 -8.253 1.00 51.43 H new ATOM 0 HD23 LEU A 91 -8.762 6.422 -6.840 1.00 51.43 H new ATOM 1409 N ILE A 92 -4.920 5.789 -3.326 1.00 71.50 N ATOM 1410 CA ILE A 92 -3.957 5.037 -2.484 1.00 21.02 C ATOM 1411 C ILE A 92 -4.722 4.087 -1.528 1.00 22.24 C ATOM 1412 O ILE A 92 -4.356 2.912 -1.382 1.00 54.12 O ATOM 1413 CB ILE A 92 -3.011 6.006 -1.653 1.00 42.02 C ATOM 1414 CG1 ILE A 92 -2.226 6.971 -2.605 1.00 13.12 C ATOM 1415 CG2 ILE A 92 -2.031 5.206 -0.749 1.00 10.51 C ATOM 1416 CD1 ILE A 92 -1.315 7.973 -1.909 1.00 55.54 C ATOM 0 H ILE A 92 -4.932 6.791 -3.137 1.00 71.50 H new ATOM 0 HA ILE A 92 -3.321 4.452 -3.149 1.00 21.02 H new ATOM 0 HB ILE A 92 -3.646 6.608 -1.003 1.00 42.02 H new ATOM 0 HG12 ILE A 92 -1.624 6.371 -3.288 1.00 13.12 H new ATOM 0 HG13 ILE A 92 -2.945 7.520 -3.213 1.00 13.12 H new ATOM 0 HG21 ILE A 92 -1.399 5.900 -0.195 1.00 10.51 H new ATOM 0 HG22 ILE A 92 -2.599 4.594 -0.049 1.00 10.51 H new ATOM 0 HG23 ILE A 92 -1.407 4.563 -1.369 1.00 10.51 H new ATOM 0 HD11 ILE A 92 -0.818 8.593 -2.655 1.00 55.54 H new ATOM 0 HD12 ILE A 92 -1.908 8.606 -1.248 1.00 55.54 H new ATOM 0 HD13 ILE A 92 -0.566 7.439 -1.324 1.00 55.54 H new ATOM 1428 N LEU A 93 -5.807 4.614 -0.920 1.00 21.03 N ATOM 1429 CA LEU A 93 -6.678 3.866 0.017 1.00 22.15 C ATOM 1430 C LEU A 93 -7.308 2.645 -0.668 1.00 43.22 C ATOM 1431 O LEU A 93 -7.274 1.544 -0.129 1.00 52.23 O ATOM 1432 CB LEU A 93 -7.808 4.785 0.578 1.00 23.14 C ATOM 1433 CG LEU A 93 -7.364 5.921 1.549 1.00 11.21 C ATOM 1434 CD1 LEU A 93 -8.552 6.846 1.904 1.00 2.03 C ATOM 1435 CD2 LEU A 93 -6.704 5.337 2.816 1.00 62.32 C ATOM 0 H LEU A 93 -6.107 5.578 -1.066 1.00 21.03 H new ATOM 0 HA LEU A 93 -6.052 3.524 0.841 1.00 22.15 H new ATOM 0 HB2 LEU A 93 -8.327 5.241 -0.265 1.00 23.14 H new ATOM 0 HB3 LEU A 93 -8.532 4.157 1.097 1.00 23.14 H new ATOM 0 HG LEU A 93 -6.617 6.529 1.038 1.00 11.21 H new ATOM 0 HD11 LEU A 93 -8.213 7.629 2.582 1.00 2.03 H new ATOM 0 HD12 LEU A 93 -8.945 7.299 0.994 1.00 2.03 H new ATOM 0 HD13 LEU A 93 -9.336 6.262 2.386 1.00 2.03 H new ATOM 0 HD21 LEU A 93 -6.403 6.150 3.477 1.00 62.32 H new ATOM 0 HD22 LEU A 93 -7.415 4.693 3.333 1.00 62.32 H new ATOM 0 HD23 LEU A 93 -5.827 4.755 2.534 1.00 62.32 H new ATOM 1447 N ALA A 94 -7.866 2.873 -1.867 1.00 11.44 N ATOM 1448 CA ALA A 94 -8.558 1.840 -2.662 1.00 31.54 C ATOM 1449 C ALA A 94 -7.584 0.766 -3.179 1.00 13.50 C ATOM 1450 O ALA A 94 -7.932 -0.413 -3.249 1.00 24.31 O ATOM 1451 CB ALA A 94 -9.291 2.502 -3.832 1.00 34.40 C ATOM 0 H ALA A 94 -7.851 3.788 -2.318 1.00 11.44 H new ATOM 0 HA ALA A 94 -9.277 1.338 -2.014 1.00 31.54 H new ATOM 0 HB1 ALA A 94 -9.802 1.739 -4.419 1.00 34.40 H new ATOM 0 HB2 ALA A 94 -10.021 3.214 -3.448 1.00 34.40 H new ATOM 0 HB3 ALA A 94 -8.572 3.025 -4.463 1.00 34.40 H new ATOM 1457 N ALA A 95 -6.368 1.200 -3.538 1.00 14.21 N ATOM 1458 CA ALA A 95 -5.313 0.314 -4.063 1.00 43.04 C ATOM 1459 C ALA A 95 -4.723 -0.582 -2.956 1.00 73.13 C ATOM 1460 O ALA A 95 -4.303 -1.703 -3.231 1.00 74.01 O ATOM 1461 CB ALA A 95 -4.217 1.145 -4.729 1.00 25.44 C ATOM 0 H ALA A 95 -6.085 2.178 -3.473 1.00 14.21 H new ATOM 0 HA ALA A 95 -5.761 -0.343 -4.808 1.00 43.04 H new ATOM 0 HB1 ALA A 95 -3.442 0.483 -5.114 1.00 25.44 H new ATOM 0 HB2 ALA A 95 -4.645 1.719 -5.551 1.00 25.44 H new ATOM 0 HB3 ALA A 95 -3.782 1.826 -3.998 1.00 25.44 H new ATOM 1467 N ASN A 96 -4.677 -0.052 -1.718 1.00 20.13 N ATOM 1468 CA ASN A 96 -4.236 -0.805 -0.514 1.00 14.22 C ATOM 1469 C ASN A 96 -5.376 -1.727 -0.010 1.00 3.42 C ATOM 1470 O ASN A 96 -5.130 -2.856 0.436 1.00 71.24 O ATOM 1471 CB ASN A 96 -3.791 0.205 0.591 1.00 31.51 C ATOM 1472 CG ASN A 96 -3.271 -0.439 1.889 1.00 41.43 C ATOM 1473 OD1 ASN A 96 -2.753 -1.558 1.892 1.00 65.52 O ATOM 1474 ND2 ASN A 96 -3.369 0.288 2.998 1.00 64.51 N ATOM 0 H ASN A 96 -4.944 0.912 -1.518 1.00 20.13 H new ATOM 0 HA ASN A 96 -3.387 -1.440 -0.767 1.00 14.22 H new ATOM 0 HB2 ASN A 96 -3.010 0.846 0.183 1.00 31.51 H new ATOM 0 HB3 ASN A 96 -4.636 0.849 0.836 1.00 31.51 H new ATOM 0 HD21 ASN A 96 -3.011 -0.077 3.880 1.00 64.51 H new ATOM 0 HD22 ASN A 96 -3.802 1.211 2.966 1.00 64.51 H new ATOM 1481 N TYR A 97 -6.624 -1.228 -0.120 1.00 75.21 N ATOM 1482 CA TYR A 97 -7.853 -1.963 0.270 1.00 74.23 C ATOM 1483 C TYR A 97 -8.056 -3.199 -0.620 1.00 71.41 C ATOM 1484 O TYR A 97 -8.492 -4.246 -0.142 1.00 71.01 O ATOM 1485 CB TYR A 97 -9.098 -1.018 0.194 1.00 43.45 C ATOM 1486 CG TYR A 97 -10.482 -1.713 0.279 1.00 34.23 C ATOM 1487 CD1 TYR A 97 -11.367 -1.699 -0.809 1.00 40.13 C ATOM 1488 CD2 TYR A 97 -10.890 -2.393 1.433 1.00 0.41 C ATOM 1489 CE1 TYR A 97 -12.594 -2.333 -0.747 1.00 2.05 C ATOM 1490 CE2 TYR A 97 -12.121 -3.025 1.495 1.00 24.21 C ATOM 1491 CZ TYR A 97 -12.967 -2.993 0.403 1.00 60.21 C ATOM 1492 OH TYR A 97 -14.191 -3.623 0.463 1.00 61.41 O ATOM 0 H TYR A 97 -6.813 -0.295 -0.485 1.00 75.21 H new ATOM 0 HA TYR A 97 -7.738 -2.304 1.299 1.00 74.23 H new ATOM 0 HB2 TYR A 97 -9.028 -0.291 1.003 1.00 43.45 H new ATOM 0 HB3 TYR A 97 -9.050 -0.460 -0.741 1.00 43.45 H new ATOM 0 HD1 TYR A 97 -11.084 -1.182 -1.714 1.00 40.13 H new ATOM 0 HD2 TYR A 97 -10.233 -2.425 2.290 1.00 0.41 H new ATOM 0 HE1 TYR A 97 -13.258 -2.311 -1.598 1.00 2.05 H new ATOM 0 HE2 TYR A 97 -12.419 -3.542 2.395 1.00 24.21 H new ATOM 0 HH TYR A 97 -14.301 -4.042 1.342 1.00 61.41 H new ATOM 1502 N LEU A 98 -7.758 -3.048 -1.918 1.00 12.31 N ATOM 1503 CA LEU A 98 -7.883 -4.132 -2.908 1.00 24.33 C ATOM 1504 C LEU A 98 -6.538 -4.850 -3.140 1.00 74.43 C ATOM 1505 O LEU A 98 -6.494 -5.881 -3.826 1.00 63.54 O ATOM 1506 CB LEU A 98 -8.477 -3.570 -4.227 1.00 53.21 C ATOM 1507 CG LEU A 98 -9.944 -3.036 -4.128 1.00 20.24 C ATOM 1508 CD1 LEU A 98 -10.471 -2.536 -5.492 1.00 60.24 C ATOM 1509 CD2 LEU A 98 -10.880 -4.107 -3.519 1.00 20.41 C ATOM 0 H LEU A 98 -7.423 -2.170 -2.314 1.00 12.31 H new ATOM 0 HA LEU A 98 -8.567 -4.885 -2.517 1.00 24.33 H new ATOM 0 HB2 LEU A 98 -7.837 -2.761 -4.578 1.00 53.21 H new ATOM 0 HB3 LEU A 98 -8.444 -4.354 -4.984 1.00 53.21 H new ATOM 0 HG LEU A 98 -9.934 -2.176 -3.459 1.00 20.24 H new ATOM 0 HD11 LEU A 98 -11.493 -2.174 -5.377 1.00 60.24 H new ATOM 0 HD12 LEU A 98 -9.837 -1.725 -5.852 1.00 60.24 H new ATOM 0 HD13 LEU A 98 -10.455 -3.355 -6.211 1.00 60.24 H new ATOM 0 HD21 LEU A 98 -11.894 -3.713 -3.460 1.00 20.41 H new ATOM 0 HD22 LEU A 98 -10.873 -4.997 -4.148 1.00 20.41 H new ATOM 0 HD23 LEU A 98 -10.533 -4.367 -2.519 1.00 20.41 H new ATOM 1521 N ASP A 99 -5.463 -4.285 -2.559 1.00 12.20 N ATOM 1522 CA ASP A 99 -4.087 -4.847 -2.577 1.00 61.44 C ATOM 1523 C ASP A 99 -3.580 -5.068 -4.030 1.00 74.30 C ATOM 1524 O ASP A 99 -2.826 -6.010 -4.330 1.00 74.11 O ATOM 1525 CB ASP A 99 -4.021 -6.147 -1.704 1.00 32.42 C ATOM 1526 CG ASP A 99 -2.587 -6.579 -1.327 1.00 42.41 C ATOM 1527 OD1 ASP A 99 -2.188 -7.730 -1.608 1.00 62.10 O ATOM 1528 OD2 ASP A 99 -1.845 -5.763 -0.738 1.00 73.03 O ATOM 0 H ASP A 99 -5.522 -3.403 -2.050 1.00 12.20 H new ATOM 0 HA ASP A 99 -3.406 -4.122 -2.131 1.00 61.44 H new ATOM 0 HB2 ASP A 99 -4.593 -5.988 -0.790 1.00 32.42 H new ATOM 0 HB3 ASP A 99 -4.504 -6.961 -2.245 1.00 32.42 H new ATOM 1533 N ILE A 100 -4.005 -4.153 -4.930 1.00 14.21 N ATOM 1534 CA ILE A 100 -3.595 -4.153 -6.335 1.00 3.54 C ATOM 1535 C ILE A 100 -2.187 -3.545 -6.414 1.00 4.44 C ATOM 1536 O ILE A 100 -2.035 -2.324 -6.293 1.00 14.50 O ATOM 1537 CB ILE A 100 -4.587 -3.329 -7.248 1.00 43.21 C ATOM 1538 CG1 ILE A 100 -6.054 -3.811 -7.048 1.00 54.43 C ATOM 1539 CG2 ILE A 100 -4.175 -3.426 -8.741 1.00 4.42 C ATOM 1540 CD1 ILE A 100 -7.101 -3.044 -7.842 1.00 53.32 C ATOM 0 H ILE A 100 -4.644 -3.395 -4.692 1.00 14.21 H new ATOM 0 HA ILE A 100 -3.605 -5.178 -6.705 1.00 3.54 H new ATOM 0 HB ILE A 100 -4.530 -2.283 -6.948 1.00 43.21 H new ATOM 0 HG12 ILE A 100 -6.114 -4.865 -7.321 1.00 54.43 H new ATOM 0 HG13 ILE A 100 -6.301 -3.741 -5.989 1.00 54.43 H new ATOM 0 HG21 ILE A 100 -4.873 -2.851 -9.349 1.00 4.42 H new ATOM 0 HG22 ILE A 100 -3.169 -3.026 -8.867 1.00 4.42 H new ATOM 0 HG23 ILE A 100 -4.193 -4.469 -9.056 1.00 4.42 H new ATOM 0 HD11 ILE A 100 -8.089 -3.455 -7.634 1.00 53.32 H new ATOM 0 HD12 ILE A 100 -7.078 -1.993 -7.554 1.00 53.32 H new ATOM 0 HD13 ILE A 100 -6.888 -3.133 -8.907 1.00 53.32 H new ATOM 1552 N LYS A 101 -1.177 -4.418 -6.585 1.00 34.14 N ATOM 1553 CA LYS A 101 0.250 -4.026 -6.586 1.00 11.20 C ATOM 1554 C LYS A 101 0.587 -2.978 -7.694 1.00 32.35 C ATOM 1555 O LYS A 101 1.206 -1.962 -7.360 1.00 35.41 O ATOM 1556 CB LYS A 101 1.182 -5.269 -6.709 1.00 70.44 C ATOM 1557 CG LYS A 101 0.886 -6.429 -5.729 1.00 52.43 C ATOM 1558 CD LYS A 101 0.939 -6.030 -4.235 1.00 50.20 C ATOM 1559 CE LYS A 101 0.752 -7.246 -3.306 1.00 31.31 C ATOM 1560 NZ LYS A 101 0.700 -6.849 -1.874 1.00 73.21 N ATOM 0 H LYS A 101 -1.325 -5.417 -6.727 1.00 34.14 H new ATOM 0 HA LYS A 101 0.434 -3.548 -5.624 1.00 11.20 H new ATOM 0 HB2 LYS A 101 1.114 -5.652 -7.727 1.00 70.44 H new ATOM 0 HB3 LYS A 101 2.212 -4.944 -6.559 1.00 70.44 H new ATOM 0 HG2 LYS A 101 -0.102 -6.833 -5.950 1.00 52.43 H new ATOM 0 HG3 LYS A 101 1.604 -7.230 -5.905 1.00 52.43 H new ATOM 0 HD2 LYS A 101 1.896 -5.554 -4.021 1.00 50.20 H new ATOM 0 HD3 LYS A 101 0.163 -5.293 -4.029 1.00 50.20 H new ATOM 0 HE2 LYS A 101 -0.168 -7.767 -3.572 1.00 31.31 H new ATOM 0 HE3 LYS A 101 1.572 -7.948 -3.458 1.00 31.31 H new ATOM 0 HZ1 LYS A 101 0.506 -7.686 -1.288 1.00 73.21 H new ATOM 0 HZ2 LYS A 101 1.613 -6.435 -1.595 1.00 73.21 H new ATOM 0 HZ3 LYS A 101 -0.055 -6.147 -1.736 1.00 73.21 H new ATOM 1574 N PRO A 102 0.186 -3.176 -9.022 1.00 11.03 N ATOM 1575 CA PRO A 102 0.468 -2.171 -10.087 1.00 23.12 C ATOM 1576 C PRO A 102 -0.127 -0.781 -9.767 1.00 53.35 C ATOM 1577 O PRO A 102 0.581 0.220 -9.832 1.00 31.35 O ATOM 1578 CB PRO A 102 -0.175 -2.781 -11.370 1.00 5.14 C ATOM 1579 CG PRO A 102 -1.125 -3.833 -10.876 1.00 33.42 C ATOM 1580 CD PRO A 102 -0.521 -4.363 -9.598 1.00 61.43 C ATOM 0 HA PRO A 102 1.538 -1.991 -10.194 1.00 23.12 H new ATOM 0 HB2 PRO A 102 -0.698 -2.019 -11.948 1.00 5.14 H new ATOM 0 HB3 PRO A 102 0.584 -3.212 -12.023 1.00 5.14 H new ATOM 0 HG2 PRO A 102 -2.115 -3.413 -10.696 1.00 33.42 H new ATOM 0 HG3 PRO A 102 -1.245 -4.628 -11.611 1.00 33.42 H new ATOM 0 HD2 PRO A 102 -1.286 -4.741 -8.920 1.00 61.43 H new ATOM 0 HD3 PRO A 102 0.168 -5.185 -9.791 1.00 61.43 H new ATOM 1588 N LEU A 103 -1.419 -0.748 -9.375 1.00 41.14 N ATOM 1589 CA LEU A 103 -2.138 0.512 -9.088 1.00 10.24 C ATOM 1590 C LEU A 103 -1.506 1.260 -7.903 1.00 21.42 C ATOM 1591 O LEU A 103 -1.256 2.464 -7.986 1.00 44.20 O ATOM 1592 CB LEU A 103 -3.641 0.237 -8.808 1.00 24.40 C ATOM 1593 CG LEU A 103 -4.526 1.490 -8.499 1.00 1.44 C ATOM 1594 CD1 LEU A 103 -4.478 2.521 -9.647 1.00 64.44 C ATOM 1595 CD2 LEU A 103 -5.979 1.079 -8.164 1.00 31.34 C ATOM 0 H LEU A 103 -1.988 -1.585 -9.250 1.00 41.14 H new ATOM 0 HA LEU A 103 -2.056 1.145 -9.971 1.00 10.24 H new ATOM 0 HB2 LEU A 103 -4.063 -0.276 -9.673 1.00 24.40 H new ATOM 0 HB3 LEU A 103 -3.712 -0.450 -7.964 1.00 24.40 H new ATOM 0 HG LEU A 103 -4.109 1.975 -7.617 1.00 1.44 H new ATOM 0 HD11 LEU A 103 -5.105 3.376 -9.395 1.00 64.44 H new ATOM 0 HD12 LEU A 103 -3.451 2.855 -9.793 1.00 64.44 H new ATOM 0 HD13 LEU A 103 -4.844 2.061 -10.565 1.00 64.44 H new ATOM 0 HD21 LEU A 103 -6.570 1.970 -7.954 1.00 31.34 H new ATOM 0 HD22 LEU A 103 -6.412 0.548 -9.012 1.00 31.34 H new ATOM 0 HD23 LEU A 103 -5.981 0.428 -7.290 1.00 31.34 H new ATOM 1607 N LEU A 104 -1.239 0.516 -6.820 1.00 43.30 N ATOM 1608 CA LEU A 104 -0.690 1.076 -5.572 1.00 14.25 C ATOM 1609 C LEU A 104 0.703 1.668 -5.816 1.00 43.41 C ATOM 1610 O LEU A 104 1.005 2.774 -5.356 1.00 12.34 O ATOM 1611 CB LEU A 104 -0.643 -0.009 -4.461 1.00 44.00 C ATOM 1612 CG LEU A 104 -0.164 0.454 -3.045 1.00 62.35 C ATOM 1613 CD1 LEU A 104 -1.065 1.579 -2.468 1.00 11.20 C ATOM 1614 CD2 LEU A 104 -0.074 -0.754 -2.078 1.00 15.24 C ATOM 0 H LEU A 104 -1.397 -0.491 -6.782 1.00 43.30 H new ATOM 0 HA LEU A 104 -1.346 1.878 -5.235 1.00 14.25 H new ATOM 0 HB2 LEU A 104 -1.641 -0.436 -4.360 1.00 44.00 H new ATOM 0 HB3 LEU A 104 0.014 -0.811 -4.797 1.00 44.00 H new ATOM 0 HG LEU A 104 0.835 0.877 -3.154 1.00 62.35 H new ATOM 0 HD11 LEU A 104 -0.697 1.871 -1.484 1.00 11.20 H new ATOM 0 HD12 LEU A 104 -1.042 2.441 -3.134 1.00 11.20 H new ATOM 0 HD13 LEU A 104 -2.089 1.216 -2.380 1.00 11.20 H new ATOM 0 HD21 LEU A 104 0.261 -0.412 -1.099 1.00 15.24 H new ATOM 0 HD22 LEU A 104 -1.055 -1.219 -1.984 1.00 15.24 H new ATOM 0 HD23 LEU A 104 0.636 -1.482 -2.470 1.00 15.24 H new ATOM 1626 N ASP A 105 1.523 0.935 -6.589 1.00 3.31 N ATOM 1627 CA ASP A 105 2.912 1.324 -6.875 1.00 15.15 C ATOM 1628 C ASP A 105 2.949 2.592 -7.747 1.00 35.42 C ATOM 1629 O ASP A 105 3.650 3.546 -7.418 1.00 50.31 O ATOM 1630 CB ASP A 105 3.684 0.169 -7.559 1.00 23.54 C ATOM 1631 CG ASP A 105 5.186 0.472 -7.722 1.00 12.34 C ATOM 1632 OD1 ASP A 105 5.936 0.352 -6.720 1.00 53.52 O ATOM 1633 OD2 ASP A 105 5.621 0.887 -8.818 1.00 23.21 O ATOM 0 H ASP A 105 1.242 0.060 -7.031 1.00 3.31 H new ATOM 0 HA ASP A 105 3.404 1.542 -5.927 1.00 15.15 H new ATOM 0 HB2 ASP A 105 3.563 -0.741 -6.972 1.00 23.54 H new ATOM 0 HB3 ASP A 105 3.248 -0.024 -8.539 1.00 23.54 H new ATOM 1638 N VAL A 106 2.157 2.596 -8.842 1.00 13.34 N ATOM 1639 CA VAL A 106 2.074 3.739 -9.784 1.00 73.34 C ATOM 1640 C VAL A 106 1.611 5.024 -9.063 1.00 2.22 C ATOM 1641 O VAL A 106 2.208 6.085 -9.239 1.00 61.15 O ATOM 1642 CB VAL A 106 1.122 3.426 -11.012 1.00 34.04 C ATOM 1643 CG1 VAL A 106 0.835 4.684 -11.884 1.00 22.11 C ATOM 1644 CG2 VAL A 106 1.712 2.290 -11.883 1.00 31.41 C ATOM 0 H VAL A 106 1.559 1.811 -9.099 1.00 13.34 H new ATOM 0 HA VAL A 106 3.079 3.901 -10.173 1.00 73.34 H new ATOM 0 HB VAL A 106 0.168 3.101 -10.596 1.00 34.04 H new ATOM 0 HG11 VAL A 106 0.178 4.412 -12.710 1.00 22.11 H new ATOM 0 HG12 VAL A 106 0.353 5.448 -11.274 1.00 22.11 H new ATOM 0 HG13 VAL A 106 1.773 5.074 -12.279 1.00 22.11 H new ATOM 0 HG21 VAL A 106 1.044 2.090 -12.721 1.00 31.41 H new ATOM 0 HG22 VAL A 106 2.689 2.592 -12.262 1.00 31.41 H new ATOM 0 HG23 VAL A 106 1.819 1.388 -11.281 1.00 31.41 H new ATOM 1654 N THR A 107 0.565 4.903 -8.228 1.00 75.11 N ATOM 1655 CA THR A 107 -0.017 6.045 -7.490 1.00 70.54 C ATOM 1656 C THR A 107 0.969 6.589 -6.414 1.00 12.04 C ATOM 1657 O THR A 107 1.052 7.808 -6.192 1.00 73.13 O ATOM 1658 CB THR A 107 -1.394 5.640 -6.858 1.00 4.21 C ATOM 1659 OG1 THR A 107 -2.238 5.083 -7.881 1.00 71.45 O ATOM 1660 CG2 THR A 107 -2.132 6.830 -6.222 1.00 24.00 C ATOM 0 H THR A 107 0.098 4.015 -8.044 1.00 75.11 H new ATOM 0 HA THR A 107 -0.194 6.855 -8.198 1.00 70.54 H new ATOM 0 HB THR A 107 -1.182 4.916 -6.071 1.00 4.21 H new ATOM 0 HG1 THR A 107 -1.998 4.144 -8.028 1.00 71.45 H new ATOM 0 HG21 THR A 107 -3.078 6.489 -5.801 1.00 24.00 H new ATOM 0 HG22 THR A 107 -1.517 7.259 -5.431 1.00 24.00 H new ATOM 0 HG23 THR A 107 -2.325 7.587 -6.982 1.00 24.00 H new ATOM 1668 N CYS A 108 1.736 5.678 -5.778 1.00 21.15 N ATOM 1669 CA CYS A 108 2.790 6.047 -4.801 1.00 31.31 C ATOM 1670 C CYS A 108 4.014 6.665 -5.515 1.00 43.01 C ATOM 1671 O CYS A 108 4.725 7.497 -4.943 1.00 50.25 O ATOM 1672 CB CYS A 108 3.219 4.816 -3.963 1.00 20.13 C ATOM 1673 SG CYS A 108 1.896 4.137 -2.935 1.00 11.52 S ATOM 0 H CYS A 108 1.646 4.673 -5.924 1.00 21.15 H new ATOM 0 HA CYS A 108 2.373 6.795 -4.127 1.00 31.31 H new ATOM 0 HB2 CYS A 108 3.580 4.038 -4.636 1.00 20.13 H new ATOM 0 HB3 CYS A 108 4.056 5.097 -3.323 1.00 20.13 H new ATOM 0 HG CYS A 108 1.100 3.419 -3.671 1.00 11.52 H new ATOM 1679 N LYS A 109 4.258 6.238 -6.763 1.00 13.23 N ATOM 1680 CA LYS A 109 5.338 6.789 -7.605 1.00 41.14 C ATOM 1681 C LYS A 109 4.944 8.173 -8.154 1.00 62.41 C ATOM 1682 O LYS A 109 5.817 9.009 -8.339 1.00 33.23 O ATOM 1683 CB LYS A 109 5.747 5.793 -8.745 1.00 12.31 C ATOM 1684 CG LYS A 109 6.958 4.872 -8.410 1.00 24.03 C ATOM 1685 CD LYS A 109 6.800 4.111 -7.074 1.00 12.21 C ATOM 1686 CE LYS A 109 7.990 3.187 -6.770 1.00 11.21 C ATOM 1687 NZ LYS A 109 8.134 2.110 -7.785 1.00 3.20 N ATOM 0 H LYS A 109 3.716 5.504 -7.219 1.00 13.23 H new ATOM 0 HA LYS A 109 6.222 6.923 -6.981 1.00 41.14 H new ATOM 0 HB2 LYS A 109 4.888 5.166 -8.985 1.00 12.31 H new ATOM 0 HB3 LYS A 109 5.983 6.367 -9.641 1.00 12.31 H new ATOM 0 HG2 LYS A 109 7.091 4.151 -9.217 1.00 24.03 H new ATOM 0 HG3 LYS A 109 7.864 5.476 -8.370 1.00 24.03 H new ATOM 0 HD2 LYS A 109 6.688 4.830 -6.263 1.00 12.21 H new ATOM 0 HD3 LYS A 109 5.885 3.519 -7.104 1.00 12.21 H new ATOM 0 HE2 LYS A 109 8.906 3.776 -6.734 1.00 11.21 H new ATOM 0 HE3 LYS A 109 7.860 2.741 -5.784 1.00 11.21 H new ATOM 0 HZ1 LYS A 109 8.471 1.241 -7.324 1.00 3.20 H new ATOM 0 HZ2 LYS A 109 7.213 1.929 -8.233 1.00 3.20 H new ATOM 0 HZ3 LYS A 109 8.819 2.405 -8.510 1.00 3.20 H new ATOM 1701 N THR A 110 3.635 8.403 -8.389 1.00 0.42 N ATOM 1702 CA THR A 110 3.115 9.693 -8.889 1.00 42.03 C ATOM 1703 C THR A 110 3.501 10.843 -7.933 1.00 52.35 C ATOM 1704 O THR A 110 4.120 11.833 -8.350 1.00 21.11 O ATOM 1705 CB THR A 110 1.558 9.652 -9.078 1.00 3.20 C ATOM 1706 OG1 THR A 110 1.217 8.630 -10.027 1.00 75.32 O ATOM 1707 CG2 THR A 110 0.984 11.003 -9.560 1.00 42.12 C ATOM 0 H THR A 110 2.910 7.701 -8.238 1.00 0.42 H new ATOM 0 HA THR A 110 3.570 9.873 -9.863 1.00 42.03 H new ATOM 0 HB THR A 110 1.120 9.436 -8.104 1.00 3.20 H new ATOM 0 HG1 THR A 110 1.548 7.764 -9.708 1.00 75.32 H new ATOM 0 HG21 THR A 110 -0.097 10.919 -9.674 1.00 42.12 H new ATOM 0 HG22 THR A 110 1.212 11.777 -8.828 1.00 42.12 H new ATOM 0 HG23 THR A 110 1.431 11.267 -10.518 1.00 42.12 H new ATOM 1715 N VAL A 111 3.163 10.667 -6.635 1.00 73.30 N ATOM 1716 CA VAL A 111 3.504 11.644 -5.581 1.00 33.13 C ATOM 1717 C VAL A 111 5.027 11.741 -5.393 1.00 51.03 C ATOM 1718 O VAL A 111 5.552 12.833 -5.157 1.00 53.51 O ATOM 1719 CB VAL A 111 2.796 11.327 -4.205 1.00 21.03 C ATOM 1720 CG1 VAL A 111 1.274 11.560 -4.297 1.00 43.01 C ATOM 1721 CG2 VAL A 111 3.104 9.893 -3.708 1.00 75.21 C ATOM 0 H VAL A 111 2.652 9.853 -6.294 1.00 73.30 H new ATOM 0 HA VAL A 111 3.128 12.610 -5.919 1.00 33.13 H new ATOM 0 HB VAL A 111 3.206 12.019 -3.470 1.00 21.03 H new ATOM 0 HG11 VAL A 111 0.813 11.334 -3.336 1.00 43.01 H new ATOM 0 HG12 VAL A 111 1.080 12.601 -4.557 1.00 43.01 H new ATOM 0 HG13 VAL A 111 0.852 10.910 -5.064 1.00 43.01 H new ATOM 0 HG21 VAL A 111 2.596 9.720 -2.759 1.00 75.21 H new ATOM 0 HG22 VAL A 111 2.754 9.170 -4.444 1.00 75.21 H new ATOM 0 HG23 VAL A 111 4.179 9.779 -3.570 1.00 75.21 H new ATOM 1731 N ALA A 112 5.725 10.598 -5.554 1.00 11.41 N ATOM 1732 CA ALA A 112 7.191 10.520 -5.422 1.00 32.14 C ATOM 1733 C ALA A 112 7.903 11.375 -6.493 1.00 71.44 C ATOM 1734 O ALA A 112 8.884 12.064 -6.195 1.00 2.23 O ATOM 1735 CB ALA A 112 7.654 9.056 -5.488 1.00 55.22 C ATOM 0 H ALA A 112 5.287 9.705 -5.779 1.00 11.41 H new ATOM 0 HA ALA A 112 7.465 10.928 -4.449 1.00 32.14 H new ATOM 0 HB1 ALA A 112 8.739 9.013 -5.389 1.00 55.22 H new ATOM 0 HB2 ALA A 112 7.193 8.492 -4.677 1.00 55.22 H new ATOM 0 HB3 ALA A 112 7.359 8.624 -6.444 1.00 55.22 H new ATOM 1741 N ASN A 113 7.371 11.348 -7.728 1.00 75.13 N ATOM 1742 CA ASN A 113 7.925 12.131 -8.855 1.00 44.34 C ATOM 1743 C ASN A 113 7.669 13.633 -8.656 1.00 23.42 C ATOM 1744 O ASN A 113 8.520 14.448 -8.993 1.00 60.44 O ATOM 1745 CB ASN A 113 7.348 11.663 -10.229 1.00 24.13 C ATOM 1746 CG ASN A 113 7.992 10.370 -10.759 1.00 44.22 C ATOM 1747 OD1 ASN A 113 9.082 10.402 -11.328 1.00 74.11 O ATOM 1748 ND2 ASN A 113 7.304 9.248 -10.642 1.00 64.51 N ATOM 0 H ASN A 113 6.554 10.790 -7.975 1.00 75.13 H new ATOM 0 HA ASN A 113 9.001 11.955 -8.868 1.00 44.34 H new ATOM 0 HB2 ASN A 113 6.274 11.509 -10.129 1.00 24.13 H new ATOM 0 HB3 ASN A 113 7.490 12.457 -10.962 1.00 24.13 H new ATOM 0 HD21 ASN A 113 7.675 8.380 -11.029 1.00 64.51 H new ATOM 0 HD22 ASN A 113 6.402 9.250 -10.165 1.00 64.51 H new ATOM 1755 N MET A 114 6.494 13.987 -8.101 1.00 73.41 N ATOM 1756 CA MET A 114 6.100 15.401 -7.904 1.00 34.33 C ATOM 1757 C MET A 114 6.940 16.086 -6.804 1.00 12.34 C ATOM 1758 O MET A 114 7.344 17.246 -6.964 1.00 14.34 O ATOM 1759 CB MET A 114 4.579 15.521 -7.596 1.00 21.23 C ATOM 1760 CG MET A 114 3.664 15.085 -8.752 1.00 53.40 C ATOM 1761 SD MET A 114 1.914 15.460 -8.470 1.00 12.52 S ATOM 1762 CE MET A 114 1.537 14.541 -6.972 1.00 24.51 C ATOM 0 H MET A 114 5.798 13.314 -7.780 1.00 73.41 H new ATOM 0 HA MET A 114 6.301 15.923 -8.839 1.00 34.33 H new ATOM 0 HB2 MET A 114 4.349 14.917 -6.718 1.00 21.23 H new ATOM 0 HB3 MET A 114 4.353 16.556 -7.339 1.00 21.23 H new ATOM 0 HG2 MET A 114 3.990 15.577 -9.668 1.00 53.40 H new ATOM 0 HG3 MET A 114 3.777 14.012 -8.909 1.00 53.40 H new ATOM 0 HE1 MET A 114 0.525 14.779 -6.644 1.00 24.51 H new ATOM 0 HE2 MET A 114 1.612 13.472 -7.172 1.00 24.51 H new ATOM 0 HE3 MET A 114 2.245 14.814 -6.190 1.00 24.51 H new ATOM 1772 N ILE A 115 7.212 15.362 -5.696 1.00 74.22 N ATOM 1773 CA ILE A 115 7.971 15.917 -4.544 1.00 1.34 C ATOM 1774 C ILE A 115 9.494 15.925 -4.809 1.00 34.40 C ATOM 1775 O ILE A 115 10.221 16.753 -4.252 1.00 12.23 O ATOM 1776 CB ILE A 115 7.652 15.162 -3.195 1.00 53.33 C ATOM 1777 CG1 ILE A 115 8.068 13.656 -3.269 1.00 71.20 C ATOM 1778 CG2 ILE A 115 6.150 15.311 -2.831 1.00 34.51 C ATOM 1779 CD1 ILE A 115 7.802 12.847 -2.006 1.00 55.01 C ATOM 0 H ILE A 115 6.919 14.393 -5.571 1.00 74.22 H new ATOM 0 HA ILE A 115 7.639 16.949 -4.432 1.00 1.34 H new ATOM 0 HB ILE A 115 8.244 15.622 -2.404 1.00 53.33 H new ATOM 0 HG12 ILE A 115 7.537 13.189 -4.099 1.00 71.20 H new ATOM 0 HG13 ILE A 115 9.132 13.600 -3.500 1.00 71.20 H new ATOM 0 HG21 ILE A 115 5.948 14.784 -1.898 1.00 34.51 H new ATOM 0 HG22 ILE A 115 5.908 16.367 -2.711 1.00 34.51 H new ATOM 0 HG23 ILE A 115 5.539 14.886 -3.627 1.00 34.51 H new ATOM 0 HD11 ILE A 115 8.125 11.817 -2.159 1.00 55.01 H new ATOM 0 HD12 ILE A 115 8.355 13.281 -1.173 1.00 55.01 H new ATOM 0 HD13 ILE A 115 6.736 12.863 -1.781 1.00 55.01 H new ATOM 1791 N ARG A 116 9.970 15.001 -5.663 1.00 73.20 N ATOM 1792 CA ARG A 116 11.395 14.921 -6.059 1.00 74.42 C ATOM 1793 C ARG A 116 11.676 15.731 -7.341 1.00 34.43 C ATOM 1794 O ARG A 116 12.837 16.046 -7.633 1.00 14.30 O ATOM 1795 CB ARG A 116 11.809 13.440 -6.258 1.00 30.11 C ATOM 1796 CG ARG A 116 11.873 12.610 -4.955 1.00 4.31 C ATOM 1797 CD ARG A 116 12.274 11.143 -5.200 1.00 31.24 C ATOM 1798 NE ARG A 116 12.465 10.398 -3.943 1.00 22.22 N ATOM 1799 CZ ARG A 116 13.643 10.118 -3.371 1.00 12.34 C ATOM 1800 NH1 ARG A 116 14.789 10.516 -3.920 1.00 61.33 N ATOM 1801 NH2 ARG A 116 13.661 9.447 -2.237 1.00 72.11 N ATOM 0 H ARG A 116 9.383 14.289 -6.099 1.00 73.20 H new ATOM 0 HA ARG A 116 11.990 15.357 -5.256 1.00 74.42 H new ATOM 0 HB2 ARG A 116 11.103 12.967 -6.940 1.00 30.11 H new ATOM 0 HB3 ARG A 116 12.786 13.411 -6.740 1.00 30.11 H new ATOM 0 HG2 ARG A 116 12.589 13.068 -4.273 1.00 4.31 H new ATOM 0 HG3 ARG A 116 10.901 12.639 -4.463 1.00 4.31 H new ATOM 0 HD2 ARG A 116 11.505 10.653 -5.797 1.00 31.24 H new ATOM 0 HD3 ARG A 116 13.196 11.113 -5.781 1.00 31.24 H new ATOM 0 HE ARG A 116 11.626 10.066 -3.467 1.00 22.22 H new ATOM 0 HH11 ARG A 116 14.780 11.045 -4.792 1.00 61.33 H new ATOM 0 HH12 ARG A 116 15.676 10.292 -3.468 1.00 61.33 H new ATOM 0 HH21 ARG A 116 12.786 9.148 -1.807 1.00 72.11 H new ATOM 0 HH22 ARG A 116 14.550 9.226 -1.789 1.00 72.11 H new ATOM 1815 N GLY A 117 10.623 16.049 -8.104 1.00 41.31 N ATOM 1816 CA GLY A 117 10.752 16.786 -9.367 1.00 23.43 C ATOM 1817 C GLY A 117 10.483 18.275 -9.170 1.00 32.04 C ATOM 1818 O GLY A 117 11.444 19.041 -8.928 1.00 72.22 O ATOM 1819 OXT GLY A 117 9.301 18.680 -9.194 1.00 37.81 O ATOM 0 H GLY A 117 9.662 15.804 -7.865 1.00 41.31 H new ATOM 0 HA2 GLY A 117 11.754 16.646 -9.772 1.00 23.43 H new ATOM 0 HA3 GLY A 117 10.053 16.382 -10.099 1.00 23.43 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 17.374 -13.786 17.819 1.00 50.34 N ATOM 1825 CA SER B 2 18.432 -12.754 17.767 1.00 44.14 C ATOM 1826 C SER B 2 17.996 -11.585 16.873 1.00 24.35 C ATOM 1827 O SER B 2 16.970 -11.662 16.173 1.00 53.40 O ATOM 1828 CB SER B 2 19.761 -13.381 17.270 1.00 63.44 C ATOM 1829 OG SER B 2 20.835 -12.447 17.280 1.00 23.44 O ATOM 0 HA SER B 2 18.597 -12.361 18.770 1.00 44.14 H new ATOM 0 HB2 SER B 2 20.017 -14.232 17.901 1.00 63.44 H new ATOM 0 HB3 SER B 2 19.624 -13.763 16.258 1.00 63.44 H new ATOM 0 HG SER B 2 21.652 -12.885 16.961 1.00 23.44 H new ATOM 1837 N LEU B 3 18.779 -10.495 16.922 1.00 14.41 N ATOM 1838 CA LEU B 3 18.538 -9.286 16.125 1.00 13.44 C ATOM 1839 C LEU B 3 19.090 -9.474 14.693 1.00 55.50 C ATOM 1840 O LEU B 3 20.290 -9.720 14.520 1.00 64.11 O ATOM 1841 CB LEU B 3 19.218 -8.066 16.806 1.00 62.43 C ATOM 1842 CG LEU B 3 18.808 -7.770 18.286 1.00 34.40 C ATOM 1843 CD1 LEU B 3 19.692 -6.656 18.894 1.00 33.15 C ATOM 1844 CD2 LEU B 3 17.304 -7.424 18.411 1.00 71.23 C ATOM 0 H LEU B 3 19.602 -10.430 17.521 1.00 14.41 H new ATOM 0 HA LEU B 3 17.465 -9.107 16.063 1.00 13.44 H new ATOM 0 HB2 LEU B 3 20.297 -8.217 16.775 1.00 62.43 H new ATOM 0 HB3 LEU B 3 19.003 -7.179 16.209 1.00 62.43 H new ATOM 0 HG LEU B 3 18.975 -8.683 18.858 1.00 34.40 H new ATOM 0 HD11 LEU B 3 19.386 -6.470 19.923 1.00 33.15 H new ATOM 0 HD12 LEU B 3 20.736 -6.970 18.877 1.00 33.15 H new ATOM 0 HD13 LEU B 3 19.578 -5.742 18.311 1.00 33.15 H new ATOM 0 HD21 LEU B 3 17.062 -7.226 19.455 1.00 71.23 H new ATOM 0 HD22 LEU B 3 17.083 -6.540 17.813 1.00 71.23 H new ATOM 0 HD23 LEU B 3 16.707 -8.263 18.053 1.00 71.23 H new ATOM 1856 N VAL B 4 18.209 -9.402 13.681 1.00 14.31 N ATOM 1857 CA VAL B 4 18.618 -9.346 12.267 1.00 0.01 C ATOM 1858 C VAL B 4 19.065 -7.908 11.917 1.00 64.15 C ATOM 1859 O VAL B 4 18.364 -6.927 12.208 1.00 45.25 O ATOM 1860 CB VAL B 4 17.487 -9.856 11.289 1.00 74.33 C ATOM 1861 CG1 VAL B 4 17.236 -11.371 11.497 1.00 52.33 C ATOM 1862 CG2 VAL B 4 16.171 -9.047 11.444 1.00 63.41 C ATOM 0 H VAL B 4 17.199 -9.381 13.819 1.00 14.31 H new ATOM 0 HA VAL B 4 19.459 -10.026 12.130 1.00 0.01 H new ATOM 0 HB VAL B 4 17.838 -9.696 10.269 1.00 74.33 H new ATOM 0 HG11 VAL B 4 16.454 -11.707 10.816 1.00 52.33 H new ATOM 0 HG12 VAL B 4 18.154 -11.923 11.296 1.00 52.33 H new ATOM 0 HG13 VAL B 4 16.923 -11.550 12.526 1.00 52.33 H new ATOM 0 HG21 VAL B 4 15.423 -9.433 10.752 1.00 63.41 H new ATOM 0 HG22 VAL B 4 15.804 -9.142 12.466 1.00 63.41 H new ATOM 0 HG23 VAL B 4 16.361 -7.997 11.223 1.00 63.41 H new ATOM 1872 N LYS B 5 20.261 -7.808 11.332 1.00 60.15 N ATOM 1873 CA LYS B 5 20.929 -6.534 11.043 1.00 1.41 C ATOM 1874 C LYS B 5 20.457 -6.018 9.675 1.00 31.30 C ATOM 1875 O LYS B 5 20.802 -6.595 8.645 1.00 71.12 O ATOM 1876 CB LYS B 5 22.463 -6.766 11.063 1.00 11.12 C ATOM 1877 CG LYS B 5 22.987 -7.443 12.351 1.00 14.34 C ATOM 1878 CD LYS B 5 24.501 -7.738 12.309 1.00 62.24 C ATOM 1879 CE LYS B 5 25.007 -8.398 13.605 1.00 4.02 C ATOM 1880 NZ LYS B 5 26.451 -8.730 13.532 1.00 20.41 N ATOM 0 H LYS B 5 20.802 -8.622 11.041 1.00 60.15 H new ATOM 0 HA LYS B 5 20.680 -5.783 11.793 1.00 1.41 H new ATOM 0 HB2 LYS B 5 22.737 -7.381 10.206 1.00 11.12 H new ATOM 0 HB3 LYS B 5 22.966 -5.807 10.940 1.00 11.12 H new ATOM 0 HG2 LYS B 5 22.772 -6.801 13.205 1.00 14.34 H new ATOM 0 HG3 LYS B 5 22.446 -8.376 12.510 1.00 14.34 H new ATOM 0 HD2 LYS B 5 24.718 -8.391 11.463 1.00 62.24 H new ATOM 0 HD3 LYS B 5 25.045 -6.808 12.142 1.00 62.24 H new ATOM 0 HE2 LYS B 5 24.831 -7.727 14.446 1.00 4.02 H new ATOM 0 HE3 LYS B 5 24.435 -9.306 13.797 1.00 4.02 H new ATOM 0 HZ1 LYS B 5 26.751 -9.172 14.424 1.00 20.41 H new ATOM 0 HZ2 LYS B 5 26.616 -9.390 12.746 1.00 20.41 H new ATOM 0 HZ3 LYS B 5 27.000 -7.861 13.375 1.00 20.41 H new ATOM 1894 N LEU B 6 19.618 -4.980 9.676 1.00 23.30 N ATOM 1895 CA LEU B 6 19.023 -4.431 8.448 1.00 21.34 C ATOM 1896 C LEU B 6 19.630 -3.061 8.149 1.00 11.12 C ATOM 1897 O LEU B 6 19.207 -2.050 8.727 1.00 14.15 O ATOM 1898 CB LEU B 6 17.475 -4.348 8.597 1.00 23.43 C ATOM 1899 CG LEU B 6 16.756 -5.693 8.944 1.00 62.54 C ATOM 1900 CD1 LEU B 6 15.236 -5.487 9.133 1.00 64.21 C ATOM 1901 CD2 LEU B 6 17.053 -6.784 7.884 1.00 43.42 C ATOM 0 H LEU B 6 19.330 -4.494 10.525 1.00 23.30 H new ATOM 0 HA LEU B 6 19.243 -5.090 7.608 1.00 21.34 H new ATOM 0 HB2 LEU B 6 17.241 -3.621 9.375 1.00 23.43 H new ATOM 0 HB3 LEU B 6 17.058 -3.964 7.666 1.00 23.43 H new ATOM 0 HG LEU B 6 17.159 -6.044 9.894 1.00 62.54 H new ATOM 0 HD11 LEU B 6 14.767 -6.441 9.373 1.00 64.21 H new ATOM 0 HD12 LEU B 6 15.063 -4.782 9.946 1.00 64.21 H new ATOM 0 HD13 LEU B 6 14.805 -5.092 8.213 1.00 64.21 H new ATOM 0 HD21 LEU B 6 16.538 -7.705 8.156 1.00 43.42 H new ATOM 0 HD22 LEU B 6 16.704 -6.448 6.908 1.00 43.42 H new ATOM 0 HD23 LEU B 6 18.127 -6.967 7.842 1.00 43.42 H new ATOM 1913 N GLU B 7 20.665 -3.036 7.288 1.00 51.43 N ATOM 1914 CA GLU B 7 21.258 -1.771 6.828 1.00 43.32 C ATOM 1915 C GLU B 7 20.280 -1.066 5.892 1.00 21.03 C ATOM 1916 O GLU B 7 19.631 -1.706 5.066 1.00 75.43 O ATOM 1917 CB GLU B 7 22.624 -1.949 6.105 1.00 64.14 C ATOM 1918 CG GLU B 7 23.757 -2.504 6.987 1.00 63.35 C ATOM 1919 CD GLU B 7 23.629 -4.009 7.267 1.00 54.32 C ATOM 1920 OE1 GLU B 7 23.957 -4.801 6.354 1.00 20.14 O ATOM 1921 OE2 GLU B 7 23.201 -4.394 8.381 1.00 51.25 O ATOM 0 H GLU B 7 21.103 -3.872 6.901 1.00 51.43 H new ATOM 0 HA GLU B 7 21.451 -1.174 7.719 1.00 43.32 H new ATOM 0 HB2 GLU B 7 22.484 -2.617 5.255 1.00 64.14 H new ATOM 0 HB3 GLU B 7 22.935 -0.984 5.704 1.00 64.14 H new ATOM 0 HG2 GLU B 7 24.713 -2.312 6.501 1.00 63.35 H new ATOM 0 HG3 GLU B 7 23.767 -1.965 7.934 1.00 63.35 H new ATOM 1928 N SER B 8 20.171 0.244 6.048 1.00 74.30 N ATOM 1929 CA SER B 8 19.380 1.096 5.161 1.00 40.14 C ATOM 1930 C SER B 8 20.185 1.449 3.896 1.00 4.13 C ATOM 1931 O SER B 8 21.321 0.985 3.711 1.00 15.34 O ATOM 1932 CB SER B 8 18.993 2.354 5.956 1.00 74.04 C ATOM 1933 OG SER B 8 20.139 2.976 6.524 1.00 11.31 O ATOM 0 H SER B 8 20.632 0.755 6.801 1.00 74.30 H new ATOM 0 HA SER B 8 18.480 0.581 4.826 1.00 40.14 H new ATOM 0 HB2 SER B 8 18.481 3.058 5.301 1.00 74.04 H new ATOM 0 HB3 SER B 8 18.292 2.087 6.746 1.00 74.04 H new ATOM 0 HG SER B 8 20.736 3.277 5.808 1.00 11.31 H new ATOM 1939 N SER B 9 19.582 2.264 3.023 1.00 25.32 N ATOM 1940 CA SER B 9 20.267 2.872 1.869 1.00 12.23 C ATOM 1941 C SER B 9 21.386 3.833 2.348 1.00 43.40 C ATOM 1942 O SER B 9 22.392 4.037 1.664 1.00 54.11 O ATOM 1943 CB SER B 9 19.235 3.615 0.996 1.00 12.14 C ATOM 1944 OG SER B 9 18.150 2.767 0.662 1.00 44.31 O ATOM 0 H SER B 9 18.598 2.524 3.095 1.00 25.32 H new ATOM 0 HA SER B 9 20.735 2.090 1.271 1.00 12.23 H new ATOM 0 HB2 SER B 9 18.866 4.491 1.529 1.00 12.14 H new ATOM 0 HB3 SER B 9 19.715 3.974 0.085 1.00 12.14 H new ATOM 0 HG SER B 9 17.586 2.630 1.452 1.00 44.31 H new ATOM 1950 N ASP B 10 21.194 4.393 3.564 1.00 1.30 N ATOM 1951 CA ASP B 10 22.179 5.269 4.241 1.00 51.44 C ATOM 1952 C ASP B 10 23.168 4.431 5.107 1.00 32.03 C ATOM 1953 O ASP B 10 23.876 4.961 5.966 1.00 74.52 O ATOM 1954 CB ASP B 10 21.411 6.325 5.081 1.00 1.11 C ATOM 1955 CG ASP B 10 22.307 7.412 5.720 1.00 42.23 C ATOM 1956 OD1 ASP B 10 22.450 7.440 6.964 1.00 74.03 O ATOM 1957 OD2 ASP B 10 22.877 8.237 4.975 1.00 5.32 O ATOM 0 H ASP B 10 20.344 4.249 4.108 1.00 1.30 H new ATOM 0 HA ASP B 10 22.787 5.788 3.500 1.00 51.44 H new ATOM 0 HB2 ASP B 10 20.672 6.810 4.443 1.00 1.11 H new ATOM 0 HB3 ASP B 10 20.863 5.813 5.872 1.00 1.11 H new ATOM 1962 N GLU B 11 23.189 3.098 4.864 1.00 1.23 N ATOM 1963 CA GLU B 11 24.194 2.143 5.407 1.00 65.42 C ATOM 1964 C GLU B 11 24.095 1.935 6.941 1.00 51.10 C ATOM 1965 O GLU B 11 24.899 1.183 7.510 1.00 74.53 O ATOM 1966 CB GLU B 11 25.641 2.562 4.997 1.00 1.12 C ATOM 1967 CG GLU B 11 25.867 2.691 3.472 1.00 63.01 C ATOM 1968 CD GLU B 11 27.281 3.187 3.119 1.00 40.43 C ATOM 1969 OE1 GLU B 11 28.120 2.382 2.656 1.00 33.10 O ATOM 1970 OE2 GLU B 11 27.566 4.388 3.333 1.00 10.40 O ATOM 0 H GLU B 11 22.493 2.644 4.272 1.00 1.23 H new ATOM 0 HA GLU B 11 23.960 1.178 4.957 1.00 65.42 H new ATOM 0 HB2 GLU B 11 25.876 3.517 5.468 1.00 1.12 H new ATOM 0 HB3 GLU B 11 26.344 1.829 5.394 1.00 1.12 H new ATOM 0 HG2 GLU B 11 25.698 1.723 3.001 1.00 63.01 H new ATOM 0 HG3 GLU B 11 25.131 3.380 3.057 1.00 63.01 H new ATOM 1977 N LYS B 12 23.098 2.568 7.597 1.00 52.13 N ATOM 1978 CA LYS B 12 22.903 2.467 9.056 1.00 13.14 C ATOM 1979 C LYS B 12 22.323 1.090 9.411 1.00 34.41 C ATOM 1980 O LYS B 12 21.262 0.723 8.898 1.00 74.12 O ATOM 1981 CB LYS B 12 21.965 3.597 9.575 1.00 34.22 C ATOM 1982 CG LYS B 12 22.538 5.026 9.474 1.00 3.11 C ATOM 1983 CD LYS B 12 23.761 5.261 10.391 1.00 31.54 C ATOM 1984 CE LYS B 12 24.225 6.726 10.380 1.00 70.32 C ATOM 1985 NZ LYS B 12 24.603 7.183 9.020 1.00 32.13 N ATOM 0 H LYS B 12 22.410 3.160 7.131 1.00 52.13 H new ATOM 0 HA LYS B 12 23.872 2.584 9.541 1.00 13.14 H new ATOM 0 HB2 LYS B 12 21.031 3.557 9.015 1.00 34.22 H new ATOM 0 HB3 LYS B 12 21.721 3.394 10.618 1.00 34.22 H new ATOM 0 HG2 LYS B 12 22.824 5.223 8.441 1.00 3.11 H new ATOM 0 HG3 LYS B 12 21.757 5.742 9.731 1.00 3.11 H new ATOM 0 HD2 LYS B 12 23.509 4.970 11.411 1.00 31.54 H new ATOM 0 HD3 LYS B 12 24.582 4.620 10.070 1.00 31.54 H new ATOM 0 HE2 LYS B 12 23.428 7.361 10.766 1.00 70.32 H new ATOM 0 HE3 LYS B 12 25.077 6.841 11.050 1.00 70.32 H new ATOM 0 HZ1 LYS B 12 25.051 8.120 9.081 1.00 32.13 H new ATOM 0 HZ2 LYS B 12 25.271 6.506 8.600 1.00 32.13 H new ATOM 0 HZ3 LYS B 12 23.752 7.244 8.425 1.00 32.13 H new ATOM 1999 N VAL B 13 23.034 0.360 10.280 1.00 44.13 N ATOM 2000 CA VAL B 13 22.651 -0.987 10.729 1.00 24.44 C ATOM 2001 C VAL B 13 21.525 -0.884 11.770 1.00 22.24 C ATOM 2002 O VAL B 13 21.756 -0.403 12.881 1.00 34.15 O ATOM 2003 CB VAL B 13 23.881 -1.740 11.368 1.00 25.44 C ATOM 2004 CG1 VAL B 13 23.516 -3.196 11.754 1.00 65.23 C ATOM 2005 CG2 VAL B 13 25.103 -1.682 10.428 1.00 62.23 C ATOM 0 H VAL B 13 23.904 0.692 10.697 1.00 44.13 H new ATOM 0 HA VAL B 13 22.308 -1.551 9.862 1.00 24.44 H new ATOM 0 HB VAL B 13 24.150 -1.228 12.292 1.00 25.44 H new ATOM 0 HG11 VAL B 13 24.386 -3.686 12.191 1.00 65.23 H new ATOM 0 HG12 VAL B 13 22.702 -3.187 12.479 1.00 65.23 H new ATOM 0 HG13 VAL B 13 23.203 -3.741 10.863 1.00 65.23 H new ATOM 0 HG21 VAL B 13 25.941 -2.207 10.887 1.00 62.23 H new ATOM 0 HG22 VAL B 13 24.854 -2.156 9.478 1.00 62.23 H new ATOM 0 HG23 VAL B 13 25.379 -0.642 10.253 1.00 62.23 H new ATOM 2015 N PHE B 14 20.311 -1.293 11.383 1.00 14.42 N ATOM 2016 CA PHE B 14 19.152 -1.363 12.283 1.00 42.31 C ATOM 2017 C PHE B 14 18.909 -2.822 12.687 1.00 64.25 C ATOM 2018 O PHE B 14 18.230 -3.579 11.979 1.00 41.10 O ATOM 2019 CB PHE B 14 17.902 -0.738 11.617 1.00 51.22 C ATOM 2020 CG PHE B 14 18.022 0.772 11.400 1.00 13.24 C ATOM 2021 CD1 PHE B 14 17.853 1.654 12.470 1.00 63.41 C ATOM 2022 CD2 PHE B 14 18.328 1.308 10.150 1.00 51.33 C ATOM 2023 CE1 PHE B 14 17.987 3.016 12.295 1.00 55.02 C ATOM 2024 CE2 PHE B 14 18.456 2.671 9.977 1.00 23.31 C ATOM 2025 CZ PHE B 14 18.288 3.526 11.051 1.00 73.34 C ATOM 0 H PHE B 14 20.103 -1.587 10.429 1.00 14.42 H new ATOM 0 HA PHE B 14 19.357 -0.785 13.184 1.00 42.31 H new ATOM 0 HB2 PHE B 14 17.730 -1.223 10.656 1.00 51.22 H new ATOM 0 HB3 PHE B 14 17.029 -0.941 12.237 1.00 51.22 H new ATOM 0 HD1 PHE B 14 17.614 1.264 13.448 1.00 63.41 H new ATOM 0 HD2 PHE B 14 18.467 0.648 9.306 1.00 51.33 H new ATOM 0 HE1 PHE B 14 17.856 3.683 13.134 1.00 55.02 H new ATOM 0 HE2 PHE B 14 18.688 3.071 9.001 1.00 23.31 H new ATOM 0 HZ PHE B 14 18.393 4.592 10.915 1.00 73.34 H new ATOM 2035 N GLU B 15 19.535 -3.216 13.806 1.00 31.34 N ATOM 2036 CA GLU B 15 19.351 -4.541 14.405 1.00 73.31 C ATOM 2037 C GLU B 15 17.980 -4.603 15.108 1.00 73.15 C ATOM 2038 O GLU B 15 17.736 -3.861 16.063 1.00 62.44 O ATOM 2039 CB GLU B 15 20.489 -4.841 15.413 1.00 20.44 C ATOM 2040 CG GLU B 15 21.909 -4.784 14.823 1.00 73.10 C ATOM 2041 CD GLU B 15 22.984 -5.270 15.813 1.00 63.23 C ATOM 2042 OE1 GLU B 15 23.496 -4.452 16.606 1.00 64.33 O ATOM 2043 OE2 GLU B 15 23.306 -6.472 15.818 1.00 70.51 O ATOM 0 H GLU B 15 20.184 -2.621 14.320 1.00 31.34 H new ATOM 0 HA GLU B 15 19.384 -5.296 13.619 1.00 73.31 H new ATOM 0 HB2 GLU B 15 20.424 -4.128 16.235 1.00 20.44 H new ATOM 0 HB3 GLU B 15 20.327 -5.832 15.837 1.00 20.44 H new ATOM 0 HG2 GLU B 15 21.948 -5.395 13.921 1.00 73.10 H new ATOM 0 HG3 GLU B 15 22.133 -3.760 14.524 1.00 73.10 H new ATOM 2050 N ILE B 16 17.090 -5.470 14.608 1.00 21.13 N ATOM 2051 CA ILE B 16 15.740 -5.661 15.159 1.00 13.42 C ATOM 2052 C ILE B 16 15.444 -7.166 15.240 1.00 42.13 C ATOM 2053 O ILE B 16 16.036 -7.933 14.486 1.00 41.14 O ATOM 2054 CB ILE B 16 14.670 -4.906 14.282 1.00 64.31 C ATOM 2055 CG1 ILE B 16 13.275 -4.915 14.979 1.00 70.34 C ATOM 2056 CG2 ILE B 16 14.592 -5.485 12.839 1.00 73.20 C ATOM 2057 CD1 ILE B 16 12.215 -4.090 14.290 1.00 53.23 C ATOM 0 H ILE B 16 17.287 -6.064 13.803 1.00 21.13 H new ATOM 0 HA ILE B 16 15.687 -5.237 16.162 1.00 13.42 H new ATOM 0 HB ILE B 16 14.992 -3.869 14.189 1.00 64.31 H new ATOM 0 HG12 ILE B 16 12.926 -5.945 15.047 1.00 70.34 H new ATOM 0 HG13 ILE B 16 13.392 -4.550 15.999 1.00 70.34 H new ATOM 0 HG21 ILE B 16 13.843 -4.937 12.267 1.00 73.20 H new ATOM 0 HG22 ILE B 16 15.563 -5.386 12.354 1.00 73.20 H new ATOM 0 HG23 ILE B 16 14.315 -6.538 12.884 1.00 73.20 H new ATOM 0 HD11 ILE B 16 11.281 -4.158 14.848 1.00 53.23 H new ATOM 0 HD12 ILE B 16 12.536 -3.049 14.245 1.00 53.23 H new ATOM 0 HD13 ILE B 16 12.062 -4.466 13.278 1.00 53.23 H new ATOM 2069 N GLU B 17 14.561 -7.586 16.174 1.00 11.21 N ATOM 2070 CA GLU B 17 14.232 -9.011 16.390 1.00 63.32 C ATOM 2071 C GLU B 17 13.754 -9.674 15.078 1.00 74.42 C ATOM 2072 O GLU B 17 12.972 -9.077 14.319 1.00 11.34 O ATOM 2073 CB GLU B 17 13.138 -9.182 17.481 1.00 2.33 C ATOM 2074 CG GLU B 17 13.413 -8.476 18.833 1.00 70.51 C ATOM 2075 CD GLU B 17 12.297 -8.703 19.888 1.00 54.31 C ATOM 2076 OE1 GLU B 17 12.618 -8.968 21.071 1.00 0.31 O ATOM 2077 OE2 GLU B 17 11.099 -8.612 19.537 1.00 44.25 O ATOM 0 H GLU B 17 14.060 -6.950 16.795 1.00 11.21 H new ATOM 0 HA GLU B 17 15.145 -9.502 16.728 1.00 63.32 H new ATOM 0 HB2 GLU B 17 12.194 -8.808 17.083 1.00 2.33 H new ATOM 0 HB3 GLU B 17 13.004 -10.247 17.670 1.00 2.33 H new ATOM 0 HG2 GLU B 17 14.361 -8.835 19.235 1.00 70.51 H new ATOM 0 HG3 GLU B 17 13.525 -7.406 18.659 1.00 70.51 H new ATOM 2084 N LYS B 18 14.242 -10.901 14.837 1.00 44.02 N ATOM 2085 CA LYS B 18 13.909 -11.703 13.644 1.00 43.44 C ATOM 2086 C LYS B 18 12.389 -11.929 13.539 1.00 32.33 C ATOM 2087 O LYS B 18 11.809 -11.855 12.449 1.00 44.11 O ATOM 2088 CB LYS B 18 14.655 -13.065 13.718 1.00 34.23 C ATOM 2089 CG LYS B 18 14.398 -14.022 12.533 1.00 51.33 C ATOM 2090 CD LYS B 18 15.060 -15.401 12.741 1.00 3.32 C ATOM 2091 CE LYS B 18 14.701 -16.413 11.645 1.00 2.41 C ATOM 2092 NZ LYS B 18 15.213 -17.770 11.968 1.00 43.21 N ATOM 0 H LYS B 18 14.887 -11.372 15.472 1.00 44.02 H new ATOM 0 HA LYS B 18 14.227 -11.161 12.753 1.00 43.44 H new ATOM 0 HB2 LYS B 18 15.726 -12.871 13.782 1.00 34.23 H new ATOM 0 HB3 LYS B 18 14.367 -13.569 14.640 1.00 34.23 H new ATOM 0 HG2 LYS B 18 13.324 -14.153 12.401 1.00 51.33 H new ATOM 0 HG3 LYS B 18 14.780 -13.573 11.616 1.00 51.33 H new ATOM 0 HD2 LYS B 18 16.142 -15.277 12.772 1.00 3.32 H new ATOM 0 HD3 LYS B 18 14.757 -15.800 13.709 1.00 3.32 H new ATOM 0 HE2 LYS B 18 13.618 -16.451 11.524 1.00 2.41 H new ATOM 0 HE3 LYS B 18 15.117 -16.083 10.693 1.00 2.41 H new ATOM 0 HZ1 LYS B 18 14.624 -18.485 11.495 1.00 43.21 H new ATOM 0 HZ2 LYS B 18 16.195 -17.858 11.638 1.00 43.21 H new ATOM 0 HZ3 LYS B 18 15.178 -17.918 12.997 1.00 43.21 H new ATOM 2106 N GLU B 19 11.767 -12.163 14.708 1.00 12.24 N ATOM 2107 CA GLU B 19 10.315 -12.403 14.837 1.00 44.34 C ATOM 2108 C GLU B 19 9.481 -11.171 14.423 1.00 24.43 C ATOM 2109 O GLU B 19 8.353 -11.321 13.938 1.00 13.11 O ATOM 2110 CB GLU B 19 9.991 -12.854 16.287 1.00 33.22 C ATOM 2111 CG GLU B 19 10.479 -11.908 17.402 1.00 34.42 C ATOM 2112 CD GLU B 19 10.427 -12.567 18.787 1.00 71.30 C ATOM 2113 OE1 GLU B 19 9.354 -12.565 19.425 1.00 10.30 O ATOM 2114 OE2 GLU B 19 11.451 -13.128 19.224 1.00 51.12 O ATOM 0 H GLU B 19 12.261 -12.192 15.600 1.00 12.24 H new ATOM 0 HA GLU B 19 10.036 -13.201 14.148 1.00 44.34 H new ATOM 0 HB2 GLU B 19 8.911 -12.970 16.380 1.00 33.22 H new ATOM 0 HB3 GLU B 19 10.432 -13.837 16.450 1.00 33.22 H new ATOM 0 HG2 GLU B 19 11.501 -11.595 17.189 1.00 34.42 H new ATOM 0 HG3 GLU B 19 9.864 -11.008 17.407 1.00 34.42 H new ATOM 2121 N ILE B 20 10.051 -9.967 14.602 1.00 11.25 N ATOM 2122 CA ILE B 20 9.416 -8.706 14.176 1.00 25.44 C ATOM 2123 C ILE B 20 9.521 -8.548 12.642 1.00 64.25 C ATOM 2124 O ILE B 20 8.548 -8.166 11.974 1.00 75.34 O ATOM 2125 CB ILE B 20 10.065 -7.456 14.874 1.00 62.14 C ATOM 2126 CG1 ILE B 20 9.977 -7.552 16.426 1.00 21.33 C ATOM 2127 CG2 ILE B 20 9.403 -6.162 14.385 1.00 43.13 C ATOM 2128 CD1 ILE B 20 10.540 -6.349 17.182 1.00 62.30 C ATOM 0 H ILE B 20 10.961 -9.840 15.044 1.00 11.25 H new ATOM 0 HA ILE B 20 8.369 -8.755 14.474 1.00 25.44 H new ATOM 0 HB ILE B 20 11.120 -7.441 14.600 1.00 62.14 H new ATOM 0 HG12 ILE B 20 8.932 -7.682 16.708 1.00 21.33 H new ATOM 0 HG13 ILE B 20 10.509 -8.447 16.750 1.00 21.33 H new ATOM 0 HG21 ILE B 20 9.865 -5.308 14.879 1.00 43.13 H new ATOM 0 HG22 ILE B 20 9.533 -6.072 13.307 1.00 43.13 H new ATOM 0 HG23 ILE B 20 8.339 -6.186 14.621 1.00 43.13 H new ATOM 0 HD11 ILE B 20 10.433 -6.511 18.255 1.00 62.30 H new ATOM 0 HD12 ILE B 20 11.595 -6.227 16.937 1.00 62.30 H new ATOM 0 HD13 ILE B 20 9.994 -5.450 16.894 1.00 62.30 H new ATOM 2140 N ALA B 21 10.713 -8.854 12.106 1.00 32.02 N ATOM 2141 CA ALA B 21 11.017 -8.746 10.658 1.00 14.13 C ATOM 2142 C ALA B 21 10.130 -9.674 9.790 1.00 51.52 C ATOM 2143 O ALA B 21 10.025 -9.479 8.571 1.00 44.00 O ATOM 2144 CB ALA B 21 12.506 -9.037 10.427 1.00 12.23 C ATOM 0 H ALA B 21 11.501 -9.186 12.662 1.00 32.02 H new ATOM 0 HA ALA B 21 10.789 -7.727 10.344 1.00 14.13 H new ATOM 0 HB1 ALA B 21 12.731 -8.958 9.363 1.00 12.23 H new ATOM 0 HB2 ALA B 21 13.108 -8.316 10.980 1.00 12.23 H new ATOM 0 HB3 ALA B 21 12.738 -10.044 10.773 1.00 12.23 H new ATOM 2150 N CYS B 22 9.503 -10.677 10.435 1.00 72.45 N ATOM 2151 CA CYS B 22 8.574 -11.616 9.782 1.00 52.53 C ATOM 2152 C CYS B 22 7.228 -10.947 9.397 1.00 1.12 C ATOM 2153 O CYS B 22 6.531 -11.441 8.508 1.00 72.30 O ATOM 2154 CB CYS B 22 8.328 -12.827 10.708 1.00 73.21 C ATOM 2155 SG CYS B 22 9.836 -13.718 11.168 1.00 3.54 S ATOM 0 H CYS B 22 9.629 -10.858 11.431 1.00 72.45 H new ATOM 0 HA CYS B 22 9.037 -11.948 8.853 1.00 52.53 H new ATOM 0 HB2 CYS B 22 7.830 -12.483 11.615 1.00 73.21 H new ATOM 0 HB3 CYS B 22 7.646 -13.518 10.212 1.00 73.21 H new ATOM 0 HG CYS B 22 10.586 -12.951 11.903 1.00 3.54 H new ATOM 2161 N MET B 23 6.862 -9.837 10.084 1.00 31.23 N ATOM 2162 CA MET B 23 5.621 -9.067 9.781 1.00 70.10 C ATOM 2163 C MET B 23 5.742 -8.351 8.426 1.00 31.54 C ATOM 2164 O MET B 23 4.742 -8.125 7.738 1.00 71.34 O ATOM 2165 CB MET B 23 5.308 -8.027 10.891 1.00 54.34 C ATOM 2166 CG MET B 23 5.112 -8.619 12.295 1.00 51.22 C ATOM 2167 SD MET B 23 4.538 -7.406 13.511 1.00 14.32 S ATOM 2168 CE MET B 23 5.785 -6.120 13.384 1.00 54.12 C ATOM 0 H MET B 23 7.408 -9.451 10.854 1.00 31.23 H new ATOM 0 HA MET B 23 4.801 -9.783 9.739 1.00 70.10 H new ATOM 0 HB2 MET B 23 6.121 -7.302 10.929 1.00 54.34 H new ATOM 0 HB3 MET B 23 4.406 -7.481 10.613 1.00 54.34 H new ATOM 0 HG2 MET B 23 4.393 -9.436 12.240 1.00 51.22 H new ATOM 0 HG3 MET B 23 6.055 -9.047 12.636 1.00 51.22 H new ATOM 0 HE1 MET B 23 5.956 -5.681 14.367 1.00 54.12 H new ATOM 0 HE2 MET B 23 6.715 -6.550 13.012 1.00 54.12 H new ATOM 0 HE3 MET B 23 5.442 -5.347 12.696 1.00 54.12 H new ATOM 2178 N SER B 24 6.975 -7.981 8.071 1.00 70.23 N ATOM 2179 CA SER B 24 7.299 -7.490 6.736 1.00 34.12 C ATOM 2180 C SER B 24 7.324 -8.689 5.781 1.00 12.55 C ATOM 2181 O SER B 24 8.165 -9.572 5.947 1.00 2.53 O ATOM 2182 CB SER B 24 8.668 -6.774 6.747 1.00 14.31 C ATOM 2183 OG SER B 24 9.053 -6.380 5.442 1.00 45.20 O ATOM 0 H SER B 24 7.775 -8.015 8.703 1.00 70.23 H new ATOM 0 HA SER B 24 6.551 -6.769 6.407 1.00 34.12 H new ATOM 0 HB2 SER B 24 8.617 -5.898 7.394 1.00 14.31 H new ATOM 0 HB3 SER B 24 9.424 -7.437 7.167 1.00 14.31 H new ATOM 0 HG SER B 24 8.258 -6.314 4.872 1.00 45.20 H new ATOM 2189 N VAL B 25 6.384 -8.727 4.816 1.00 73.44 N ATOM 2190 CA VAL B 25 6.288 -9.824 3.829 1.00 31.11 C ATOM 2191 C VAL B 25 7.577 -9.907 2.988 1.00 53.11 C ATOM 2192 O VAL B 25 8.101 -10.994 2.747 1.00 41.00 O ATOM 2193 CB VAL B 25 5.030 -9.646 2.892 1.00 42.12 C ATOM 2194 CG1 VAL B 25 4.951 -10.749 1.802 1.00 1.12 C ATOM 2195 CG2 VAL B 25 3.720 -9.594 3.726 1.00 30.43 C ATOM 0 H VAL B 25 5.674 -8.004 4.698 1.00 73.44 H new ATOM 0 HA VAL B 25 6.166 -10.757 4.379 1.00 31.11 H new ATOM 0 HB VAL B 25 5.147 -8.693 2.375 1.00 42.12 H new ATOM 0 HG11 VAL B 25 4.070 -10.585 1.182 1.00 1.12 H new ATOM 0 HG12 VAL B 25 5.845 -10.710 1.180 1.00 1.12 H new ATOM 0 HG13 VAL B 25 4.883 -11.727 2.278 1.00 1.12 H new ATOM 0 HG21 VAL B 25 2.868 -9.471 3.058 1.00 30.43 H new ATOM 0 HG22 VAL B 25 3.609 -10.521 4.288 1.00 30.43 H new ATOM 0 HG23 VAL B 25 3.763 -8.753 4.418 1.00 30.43 H new ATOM 2205 N THR B 26 8.092 -8.736 2.590 1.00 32.40 N ATOM 2206 CA THR B 26 9.297 -8.625 1.751 1.00 15.34 C ATOM 2207 C THR B 26 10.551 -9.189 2.459 1.00 43.44 C ATOM 2208 O THR B 26 11.234 -10.064 1.901 1.00 64.23 O ATOM 2209 CB THR B 26 9.525 -7.143 1.333 1.00 53.32 C ATOM 2210 OG1 THR B 26 8.340 -6.657 0.685 1.00 70.35 O ATOM 2211 CG2 THR B 26 10.734 -6.952 0.390 1.00 54.21 C ATOM 0 H THR B 26 7.685 -7.835 2.841 1.00 32.40 H new ATOM 0 HA THR B 26 9.133 -9.228 0.858 1.00 15.34 H new ATOM 0 HB THR B 26 9.742 -6.582 2.242 1.00 53.32 H new ATOM 0 HG1 THR B 26 8.581 -6.245 -0.171 1.00 70.35 H new ATOM 0 HG21 THR B 26 10.836 -5.896 0.138 1.00 54.21 H new ATOM 0 HG22 THR B 26 11.641 -7.295 0.887 1.00 54.21 H new ATOM 0 HG23 THR B 26 10.579 -7.529 -0.522 1.00 54.21 H new ATOM 2219 N ILE B 27 10.822 -8.714 3.699 1.00 4.25 N ATOM 2220 CA ILE B 27 11.993 -9.163 4.489 1.00 51.23 C ATOM 2221 C ILE B 27 11.864 -10.665 4.823 1.00 51.30 C ATOM 2222 O ILE B 27 12.839 -11.408 4.710 1.00 34.12 O ATOM 2223 CB ILE B 27 12.169 -8.328 5.819 1.00 41.13 C ATOM 2224 CG1 ILE B 27 12.347 -6.808 5.502 1.00 11.13 C ATOM 2225 CG2 ILE B 27 13.364 -8.852 6.667 1.00 41.14 C ATOM 2226 CD1 ILE B 27 12.415 -5.902 6.723 1.00 54.23 C ATOM 0 H ILE B 27 10.245 -8.020 4.173 1.00 4.25 H new ATOM 0 HA ILE B 27 12.880 -8.998 3.878 1.00 51.23 H new ATOM 0 HB ILE B 27 11.261 -8.455 6.408 1.00 41.13 H new ATOM 0 HG12 ILE B 27 13.259 -6.678 4.920 1.00 11.13 H new ATOM 0 HG13 ILE B 27 11.518 -6.484 4.873 1.00 11.13 H new ATOM 0 HG21 ILE B 27 13.456 -8.255 7.574 1.00 41.14 H new ATOM 0 HG22 ILE B 27 13.191 -9.894 6.935 1.00 41.14 H new ATOM 0 HG23 ILE B 27 14.284 -8.774 6.087 1.00 41.14 H new ATOM 0 HD11 ILE B 27 12.539 -4.868 6.402 1.00 54.23 H new ATOM 0 HD12 ILE B 27 11.493 -5.996 7.297 1.00 54.23 H new ATOM 0 HD13 ILE B 27 13.261 -6.193 7.345 1.00 54.23 H new ATOM 2238 N LYS B 28 10.638 -11.087 5.201 1.00 1.54 N ATOM 2239 CA LYS B 28 10.314 -12.492 5.544 1.00 62.55 C ATOM 2240 C LYS B 28 10.684 -13.436 4.384 1.00 51.22 C ATOM 2241 O LYS B 28 11.419 -14.403 4.579 1.00 15.42 O ATOM 2242 CB LYS B 28 8.802 -12.629 5.874 1.00 62.02 C ATOM 2243 CG LYS B 28 8.337 -14.054 6.262 1.00 31.11 C ATOM 2244 CD LYS B 28 6.806 -14.156 6.477 1.00 35.31 C ATOM 2245 CE LYS B 28 5.993 -13.782 5.223 1.00 73.04 C ATOM 2246 NZ LYS B 28 6.296 -14.662 4.066 1.00 40.22 N ATOM 0 H LYS B 28 9.838 -10.459 5.278 1.00 1.54 H new ATOM 0 HA LYS B 28 10.898 -12.773 6.420 1.00 62.55 H new ATOM 0 HB2 LYS B 28 8.563 -11.951 6.693 1.00 62.02 H new ATOM 0 HB3 LYS B 28 8.227 -12.300 5.009 1.00 62.02 H new ATOM 0 HG2 LYS B 28 8.635 -14.753 5.480 1.00 31.11 H new ATOM 0 HG3 LYS B 28 8.847 -14.360 7.175 1.00 31.11 H new ATOM 0 HD2 LYS B 28 6.554 -15.174 6.776 1.00 35.31 H new ATOM 0 HD3 LYS B 28 6.516 -13.501 7.299 1.00 35.31 H new ATOM 0 HE2 LYS B 28 4.929 -13.842 5.452 1.00 73.04 H new ATOM 0 HE3 LYS B 28 6.203 -12.747 4.953 1.00 73.04 H new ATOM 0 HZ1 LYS B 28 6.614 -14.083 3.263 1.00 40.22 H new ATOM 0 HZ2 LYS B 28 7.046 -15.333 4.328 1.00 40.22 H new ATOM 0 HZ3 LYS B 28 5.440 -15.187 3.796 1.00 40.22 H new ATOM 2260 N ASN B 29 10.193 -13.094 3.176 1.00 71.22 N ATOM 2261 CA ASN B 29 10.419 -13.878 1.938 1.00 10.43 C ATOM 2262 C ASN B 29 11.915 -13.977 1.606 1.00 34.24 C ATOM 2263 O ASN B 29 12.377 -15.022 1.130 1.00 53.01 O ATOM 2264 CB ASN B 29 9.637 -13.261 0.740 1.00 13.22 C ATOM 2265 CG ASN B 29 8.114 -13.466 0.812 1.00 4.51 C ATOM 2266 OD1 ASN B 29 7.539 -13.624 1.887 1.00 41.11 O ATOM 2267 ND2 ASN B 29 7.445 -13.432 -0.333 1.00 4.21 N ATOM 0 H ASN B 29 9.624 -12.261 3.028 1.00 71.22 H new ATOM 0 HA ASN B 29 10.044 -14.886 2.114 1.00 10.43 H new ATOM 0 HB2 ASN B 29 9.847 -12.192 0.694 1.00 13.22 H new ATOM 0 HB3 ASN B 29 10.008 -13.699 -0.187 1.00 13.22 H new ATOM 0 HD21 ASN B 29 6.431 -13.538 -0.334 1.00 4.21 H new ATOM 0 HD22 ASN B 29 7.945 -13.300 -1.212 1.00 4.21 H new ATOM 2274 N MET B 30 12.660 -12.885 1.873 1.00 55.51 N ATOM 2275 CA MET B 30 14.127 -12.852 1.690 1.00 53.13 C ATOM 2276 C MET B 30 14.808 -13.861 2.634 1.00 1.01 C ATOM 2277 O MET B 30 15.652 -14.650 2.199 1.00 60.24 O ATOM 2278 CB MET B 30 14.694 -11.421 1.922 1.00 61.21 C ATOM 2279 CG MET B 30 14.291 -10.389 0.857 1.00 40.10 C ATOM 2280 SD MET B 30 14.993 -8.750 1.171 1.00 2.33 S ATOM 2281 CE MET B 30 14.393 -7.827 -0.248 1.00 70.13 C ATOM 0 H MET B 30 12.267 -12.009 2.218 1.00 55.51 H new ATOM 0 HA MET B 30 14.343 -13.134 0.659 1.00 53.13 H new ATOM 0 HB2 MET B 30 14.359 -11.066 2.897 1.00 61.21 H new ATOM 0 HB3 MET B 30 15.782 -11.478 1.960 1.00 61.21 H new ATOM 0 HG2 MET B 30 14.617 -10.738 -0.123 1.00 40.10 H new ATOM 0 HG3 MET B 30 13.204 -10.314 0.823 1.00 40.10 H new ATOM 0 HE1 MET B 30 14.430 -6.760 -0.030 1.00 70.13 H new ATOM 0 HE2 MET B 30 15.019 -8.043 -1.114 1.00 70.13 H new ATOM 0 HE3 MET B 30 13.365 -8.118 -0.463 1.00 70.13 H new ATOM 2291 N ILE B 31 14.399 -13.841 3.919 1.00 15.34 N ATOM 2292 CA ILE B 31 14.924 -14.753 4.962 1.00 10.33 C ATOM 2293 C ILE B 31 14.611 -16.224 4.595 1.00 63.33 C ATOM 2294 O ILE B 31 15.406 -17.120 4.867 1.00 61.11 O ATOM 2295 CB ILE B 31 14.327 -14.400 6.391 1.00 53.21 C ATOM 2296 CG1 ILE B 31 14.704 -12.935 6.805 1.00 41.23 C ATOM 2297 CG2 ILE B 31 14.783 -15.413 7.483 1.00 51.31 C ATOM 2298 CD1 ILE B 31 14.087 -12.456 8.115 1.00 30.43 C ATOM 0 H ILE B 31 13.694 -13.191 4.266 1.00 15.34 H new ATOM 0 HA ILE B 31 16.005 -14.623 5.010 1.00 10.33 H new ATOM 0 HB ILE B 31 13.242 -14.473 6.313 1.00 53.21 H new ATOM 0 HG12 ILE B 31 15.789 -12.864 6.884 1.00 41.23 H new ATOM 0 HG13 ILE B 31 14.398 -12.258 6.008 1.00 41.23 H new ATOM 0 HG21 ILE B 31 14.351 -15.132 8.443 1.00 51.31 H new ATOM 0 HG22 ILE B 31 14.448 -16.414 7.213 1.00 51.31 H new ATOM 0 HG23 ILE B 31 15.870 -15.403 7.558 1.00 51.31 H new ATOM 0 HD11 ILE B 31 14.406 -11.433 8.315 1.00 30.43 H new ATOM 0 HD12 ILE B 31 13.000 -12.488 8.039 1.00 30.43 H new ATOM 0 HD13 ILE B 31 14.413 -13.104 8.929 1.00 30.43 H new ATOM 2310 N GLU B 32 13.456 -16.447 3.945 1.00 52.22 N ATOM 2311 CA GLU B 32 13.012 -17.788 3.526 1.00 13.11 C ATOM 2312 C GLU B 32 13.872 -18.331 2.360 1.00 32.42 C ATOM 2313 O GLU B 32 14.311 -19.489 2.403 1.00 52.21 O ATOM 2314 CB GLU B 32 11.508 -17.764 3.144 1.00 34.44 C ATOM 2315 CG GLU B 32 10.561 -17.405 4.309 1.00 61.55 C ATOM 2316 CD GLU B 32 9.085 -17.364 3.892 1.00 74.12 C ATOM 2317 OE1 GLU B 32 8.435 -18.430 3.867 1.00 54.40 O ATOM 2318 OE2 GLU B 32 8.569 -16.272 3.573 1.00 73.14 O ATOM 0 H GLU B 32 12.804 -15.703 3.695 1.00 52.22 H new ATOM 0 HA GLU B 32 13.144 -18.466 4.370 1.00 13.11 H new ATOM 0 HB2 GLU B 32 11.362 -17.045 2.338 1.00 34.44 H new ATOM 0 HB3 GLU B 32 11.229 -18.743 2.753 1.00 34.44 H new ATOM 0 HG2 GLU B 32 10.686 -18.134 5.110 1.00 61.55 H new ATOM 0 HG3 GLU B 32 10.845 -16.434 4.715 1.00 61.55 H new ATOM 2325 N ASP B 33 14.127 -17.487 1.333 1.00 43.32 N ATOM 2326 CA ASP B 33 14.929 -17.880 0.140 1.00 24.42 C ATOM 2327 C ASP B 33 16.393 -18.157 0.510 1.00 10.41 C ATOM 2328 O ASP B 33 16.982 -19.148 0.064 1.00 44.31 O ATOM 2329 CB ASP B 33 14.873 -16.785 -0.972 1.00 31.53 C ATOM 2330 CG ASP B 33 13.572 -16.805 -1.786 1.00 51.20 C ATOM 2331 OD1 ASP B 33 13.399 -17.725 -2.615 1.00 45.23 O ATOM 2332 OD2 ASP B 33 12.722 -15.910 -1.614 1.00 71.21 O ATOM 0 H ASP B 33 13.789 -16.525 1.303 1.00 43.32 H new ATOM 0 HA ASP B 33 14.485 -18.798 -0.245 1.00 24.42 H new ATOM 0 HB2 ASP B 33 14.989 -15.804 -0.511 1.00 31.53 H new ATOM 0 HB3 ASP B 33 15.717 -16.921 -1.648 1.00 31.53 H new ATOM 2337 N ILE B 34 16.958 -17.268 1.329 1.00 2.20 N ATOM 2338 CA ILE B 34 18.350 -17.359 1.812 1.00 31.51 C ATOM 2339 C ILE B 34 18.490 -18.488 2.858 1.00 63.41 C ATOM 2340 O ILE B 34 19.548 -19.116 2.980 1.00 51.15 O ATOM 2341 CB ILE B 34 18.795 -15.969 2.422 1.00 1.05 C ATOM 2342 CG1 ILE B 34 18.713 -14.845 1.330 1.00 51.33 C ATOM 2343 CG2 ILE B 34 20.213 -16.031 3.054 1.00 73.22 C ATOM 2344 CD1 ILE B 34 18.928 -13.433 1.845 1.00 35.23 C ATOM 0 H ILE B 34 16.461 -16.451 1.684 1.00 2.20 H new ATOM 0 HA ILE B 34 19.002 -17.599 0.972 1.00 31.51 H new ATOM 0 HB ILE B 34 18.103 -15.727 3.229 1.00 1.05 H new ATOM 0 HG12 ILE B 34 19.457 -15.052 0.560 1.00 51.33 H new ATOM 0 HG13 ILE B 34 17.735 -14.896 0.851 1.00 51.33 H new ATOM 0 HG21 ILE B 34 20.474 -15.053 3.459 1.00 73.22 H new ATOM 0 HG22 ILE B 34 20.222 -16.770 3.855 1.00 73.22 H new ATOM 0 HG23 ILE B 34 20.939 -16.313 2.292 1.00 73.22 H new ATOM 0 HD11 ILE B 34 18.852 -12.728 1.017 1.00 35.23 H new ATOM 0 HD12 ILE B 34 18.169 -13.198 2.591 1.00 35.23 H new ATOM 0 HD13 ILE B 34 19.917 -13.357 2.297 1.00 35.23 H new ATOM 2356 N GLY B 35 17.395 -18.760 3.575 1.00 34.42 N ATOM 2357 CA GLY B 35 17.417 -19.652 4.733 1.00 60.33 C ATOM 2358 C GLY B 35 17.678 -18.870 6.010 1.00 73.03 C ATOM 2359 O GLY B 35 18.059 -17.687 5.949 1.00 22.01 O ATOM 0 H GLY B 35 16.475 -18.370 3.369 1.00 34.42 H new ATOM 0 HA2 GLY B 35 16.465 -20.178 4.811 1.00 60.33 H new ATOM 0 HA3 GLY B 35 18.190 -20.409 4.600 1.00 60.33 H new ATOM 2363 N GLU B 36 17.455 -19.517 7.165 1.00 54.10 N ATOM 2364 CA GLU B 36 17.654 -18.897 8.486 1.00 13.31 C ATOM 2365 C GLU B 36 19.137 -18.521 8.661 1.00 55.52 C ATOM 2366 O GLU B 36 19.979 -19.373 8.963 1.00 32.54 O ATOM 2367 CB GLU B 36 17.169 -19.842 9.622 1.00 62.21 C ATOM 2368 CG GLU B 36 15.690 -20.246 9.501 1.00 14.00 C ATOM 2369 CD GLU B 36 15.213 -21.126 10.665 1.00 45.12 C ATOM 2370 OE1 GLU B 36 14.663 -20.575 11.652 1.00 74.12 O ATOM 2371 OE2 GLU B 36 15.401 -22.364 10.610 1.00 1.30 O ATOM 0 H GLU B 36 17.132 -20.483 7.210 1.00 54.10 H new ATOM 0 HA GLU B 36 17.056 -17.988 8.547 1.00 13.31 H new ATOM 0 HB2 GLU B 36 17.784 -20.742 9.621 1.00 62.21 H new ATOM 0 HB3 GLU B 36 17.325 -19.351 10.582 1.00 62.21 H new ATOM 0 HG2 GLU B 36 15.076 -19.347 9.457 1.00 14.00 H new ATOM 0 HG3 GLU B 36 15.540 -20.781 8.563 1.00 14.00 H new ATOM 2378 N SER B 37 19.436 -17.245 8.385 1.00 52.44 N ATOM 2379 CA SER B 37 20.797 -16.696 8.416 1.00 33.42 C ATOM 2380 C SER B 37 20.818 -15.448 9.308 1.00 22.44 C ATOM 2381 O SER B 37 19.894 -14.624 9.254 1.00 10.31 O ATOM 2382 CB SER B 37 21.246 -16.347 6.975 1.00 15.41 C ATOM 2383 OG SER B 37 21.162 -17.483 6.126 1.00 30.32 O ATOM 0 H SER B 37 18.729 -16.556 8.130 1.00 52.44 H new ATOM 0 HA SER B 37 21.488 -17.433 8.826 1.00 33.42 H new ATOM 0 HB2 SER B 37 20.621 -15.546 6.580 1.00 15.41 H new ATOM 0 HB3 SER B 37 22.270 -15.975 6.990 1.00 15.41 H new ATOM 0 HG SER B 37 20.221 -17.708 5.973 1.00 30.32 H new ATOM 2389 N ASP B 38 21.869 -15.323 10.138 1.00 12.43 N ATOM 2390 CA ASP B 38 22.135 -14.096 10.921 1.00 41.03 C ATOM 2391 C ASP B 38 22.823 -13.031 10.033 1.00 44.24 C ATOM 2392 O ASP B 38 23.097 -11.917 10.496 1.00 2.25 O ATOM 2393 CB ASP B 38 23.002 -14.419 12.173 1.00 13.22 C ATOM 2394 CG ASP B 38 24.417 -14.933 11.838 1.00 5.14 C ATOM 2395 OD1 ASP B 38 25.371 -14.124 11.782 1.00 75.12 O ATOM 2396 OD2 ASP B 38 24.584 -16.154 11.623 1.00 24.10 O ATOM 0 H ASP B 38 22.556 -16.063 10.287 1.00 12.43 H new ATOM 0 HA ASP B 38 21.183 -13.692 11.267 1.00 41.03 H new ATOM 0 HB2 ASP B 38 23.088 -13.521 12.785 1.00 13.22 H new ATOM 0 HB3 ASP B 38 22.488 -15.167 12.776 1.00 13.22 H new ATOM 2401 N SER B 39 23.108 -13.421 8.764 1.00 25.41 N ATOM 2402 CA SER B 39 23.662 -12.548 7.718 1.00 25.35 C ATOM 2403 C SER B 39 22.860 -11.234 7.590 1.00 41.12 C ATOM 2404 O SER B 39 21.630 -11.284 7.446 1.00 52.01 O ATOM 2405 CB SER B 39 23.671 -13.302 6.362 1.00 15.24 C ATOM 2406 OG SER B 39 24.456 -14.480 6.433 1.00 13.14 O ATOM 0 H SER B 39 22.952 -14.376 8.441 1.00 25.41 H new ATOM 0 HA SER B 39 24.682 -12.286 7.999 1.00 25.35 H new ATOM 0 HB2 SER B 39 22.650 -13.559 6.080 1.00 15.24 H new ATOM 0 HB3 SER B 39 24.062 -12.648 5.582 1.00 15.24 H new ATOM 0 HG SER B 39 24.442 -14.935 5.565 1.00 13.14 H new ATOM 2412 N PRO B 40 23.543 -10.047 7.674 1.00 43.32 N ATOM 2413 CA PRO B 40 22.876 -8.730 7.566 1.00 14.00 C ATOM 2414 C PRO B 40 22.222 -8.511 6.181 1.00 5.23 C ATOM 2415 O PRO B 40 22.870 -8.710 5.148 1.00 41.10 O ATOM 2416 CB PRO B 40 24.031 -7.730 7.830 1.00 3.41 C ATOM 2417 CG PRO B 40 25.286 -8.472 7.502 1.00 42.41 C ATOM 2418 CD PRO B 40 25.015 -9.897 7.900 1.00 14.30 C ATOM 0 HA PRO B 40 22.047 -8.619 8.265 1.00 14.00 H new ATOM 0 HB2 PRO B 40 23.928 -6.840 7.210 1.00 3.41 H new ATOM 0 HB3 PRO B 40 24.032 -7.397 8.868 1.00 3.41 H new ATOM 0 HG2 PRO B 40 25.522 -8.397 6.440 1.00 42.41 H new ATOM 0 HG3 PRO B 40 26.138 -8.066 8.047 1.00 42.41 H new ATOM 0 HD2 PRO B 40 25.588 -10.599 7.294 1.00 14.30 H new ATOM 0 HD3 PRO B 40 25.283 -10.081 8.940 1.00 14.30 H new ATOM 2426 N ILE B 41 20.926 -8.139 6.171 1.00 34.44 N ATOM 2427 CA ILE B 41 20.155 -7.933 4.931 1.00 50.14 C ATOM 2428 C ILE B 41 19.986 -6.416 4.679 1.00 70.52 C ATOM 2429 O ILE B 41 19.186 -5.761 5.361 1.00 61.22 O ATOM 2430 CB ILE B 41 18.738 -8.643 4.988 1.00 45.43 C ATOM 2431 CG1 ILE B 41 18.879 -10.156 5.385 1.00 50.45 C ATOM 2432 CG2 ILE B 41 17.976 -8.491 3.640 1.00 53.13 C ATOM 2433 CD1 ILE B 41 19.760 -10.993 4.460 1.00 22.12 C ATOM 0 H ILE B 41 20.387 -7.974 7.021 1.00 34.44 H new ATOM 0 HA ILE B 41 20.708 -8.386 4.108 1.00 50.14 H new ATOM 0 HB ILE B 41 18.151 -8.146 5.760 1.00 45.43 H new ATOM 0 HG12 ILE B 41 19.284 -10.213 6.395 1.00 50.45 H new ATOM 0 HG13 ILE B 41 17.885 -10.601 5.414 1.00 50.45 H new ATOM 0 HG21 ILE B 41 17.009 -8.988 3.711 1.00 53.13 H new ATOM 0 HG22 ILE B 41 17.825 -7.433 3.424 1.00 53.13 H new ATOM 0 HG23 ILE B 41 18.559 -8.945 2.839 1.00 53.13 H new ATOM 0 HD11 ILE B 41 19.792 -12.021 4.820 1.00 22.12 H new ATOM 0 HD12 ILE B 41 19.348 -10.975 3.451 1.00 22.12 H new ATOM 0 HD13 ILE B 41 20.769 -10.581 4.448 1.00 22.12 H new ATOM 2445 N PRO B 42 20.772 -5.817 3.724 1.00 23.15 N ATOM 2446 CA PRO B 42 20.605 -4.402 3.336 1.00 64.14 C ATOM 2447 C PRO B 42 19.322 -4.201 2.502 1.00 52.31 C ATOM 2448 O PRO B 42 18.936 -5.075 1.714 1.00 33.52 O ATOM 2449 CB PRO B 42 21.890 -4.083 2.507 1.00 31.33 C ATOM 2450 CG PRO B 42 22.799 -5.266 2.713 1.00 43.14 C ATOM 2451 CD PRO B 42 21.888 -6.438 2.969 1.00 41.32 C ATOM 0 HA PRO B 42 20.494 -3.740 4.194 1.00 64.14 H new ATOM 0 HB2 PRO B 42 21.654 -3.947 1.452 1.00 31.33 H new ATOM 0 HB3 PRO B 42 22.360 -3.161 2.849 1.00 31.33 H new ATOM 0 HG2 PRO B 42 23.422 -5.439 1.836 1.00 43.14 H new ATOM 0 HG3 PRO B 42 23.472 -5.101 3.555 1.00 43.14 H new ATOM 0 HD2 PRO B 42 21.545 -6.896 2.041 1.00 41.32 H new ATOM 0 HD3 PRO B 42 22.383 -7.219 3.546 1.00 41.32 H new ATOM 2459 N LEU B 43 18.667 -3.052 2.692 1.00 63.42 N ATOM 2460 CA LEU B 43 17.454 -2.669 1.959 1.00 51.42 C ATOM 2461 C LEU B 43 17.775 -1.397 1.132 1.00 24.03 C ATOM 2462 O LEU B 43 17.691 -0.281 1.659 1.00 33.12 O ATOM 2463 CB LEU B 43 16.277 -2.439 2.959 1.00 32.01 C ATOM 2464 CG LEU B 43 15.871 -3.664 3.852 1.00 23.52 C ATOM 2465 CD1 LEU B 43 14.779 -3.275 4.878 1.00 71.21 C ATOM 2466 CD2 LEU B 43 15.437 -4.881 2.990 1.00 20.50 C ATOM 0 H LEU B 43 18.968 -2.351 3.369 1.00 63.42 H new ATOM 0 HA LEU B 43 17.141 -3.461 1.279 1.00 51.42 H new ATOM 0 HB2 LEU B 43 16.543 -1.611 3.616 1.00 32.01 H new ATOM 0 HB3 LEU B 43 15.402 -2.126 2.390 1.00 32.01 H new ATOM 0 HG LEU B 43 16.755 -3.966 4.414 1.00 23.52 H new ATOM 0 HD11 LEU B 43 14.520 -4.145 5.481 1.00 71.21 H new ATOM 0 HD12 LEU B 43 15.154 -2.483 5.526 1.00 71.21 H new ATOM 0 HD13 LEU B 43 13.893 -2.922 4.350 1.00 71.21 H new ATOM 0 HD21 LEU B 43 15.163 -5.710 3.643 1.00 20.50 H new ATOM 0 HD22 LEU B 43 14.580 -4.605 2.376 1.00 20.50 H new ATOM 0 HD23 LEU B 43 16.263 -5.184 2.346 1.00 20.50 H new ATOM 2478 N PRO B 44 18.208 -1.555 -0.170 1.00 72.34 N ATOM 2479 CA PRO B 44 18.646 -0.424 -1.029 1.00 13.21 C ATOM 2480 C PRO B 44 17.456 0.333 -1.677 1.00 5.02 C ATOM 2481 O PRO B 44 17.348 0.445 -2.904 1.00 51.34 O ATOM 2482 CB PRO B 44 19.549 -1.137 -2.068 1.00 35.44 C ATOM 2483 CG PRO B 44 18.930 -2.491 -2.248 1.00 4.31 C ATOM 2484 CD PRO B 44 18.311 -2.856 -0.905 1.00 5.42 C ATOM 0 HA PRO B 44 19.161 0.365 -0.481 1.00 13.21 H new ATOM 0 HB2 PRO B 44 19.579 -0.588 -3.009 1.00 35.44 H new ATOM 0 HB3 PRO B 44 20.576 -1.216 -1.712 1.00 35.44 H new ATOM 0 HG2 PRO B 44 18.174 -2.472 -3.033 1.00 4.31 H new ATOM 0 HG3 PRO B 44 19.679 -3.225 -2.544 1.00 4.31 H new ATOM 0 HD2 PRO B 44 17.332 -3.318 -1.032 1.00 5.42 H new ATOM 0 HD3 PRO B 44 18.932 -3.569 -0.363 1.00 5.42 H new ATOM 2492 N ASN B 45 16.599 0.904 -0.815 1.00 32.41 N ATOM 2493 CA ASN B 45 15.391 1.653 -1.228 1.00 72.54 C ATOM 2494 C ASN B 45 14.962 2.584 -0.082 1.00 61.15 C ATOM 2495 O ASN B 45 14.719 3.776 -0.289 1.00 72.44 O ATOM 2496 CB ASN B 45 14.239 0.690 -1.610 1.00 62.03 C ATOM 2497 CG ASN B 45 12.961 1.399 -2.091 1.00 53.31 C ATOM 2498 OD1 ASN B 45 12.069 1.709 -1.301 1.00 62.54 O ATOM 2499 ND2 ASN B 45 12.868 1.660 -3.388 1.00 23.45 N ATOM 0 H ASN B 45 16.722 0.861 0.197 1.00 32.41 H new ATOM 0 HA ASN B 45 15.626 2.246 -2.112 1.00 72.54 H new ATOM 0 HB2 ASN B 45 14.586 0.018 -2.395 1.00 62.03 H new ATOM 0 HB3 ASN B 45 13.995 0.071 -0.746 1.00 62.03 H new ATOM 0 HD21 ASN B 45 12.041 2.130 -3.756 1.00 23.45 H new ATOM 0 HD22 ASN B 45 13.624 1.391 -4.018 1.00 23.45 H new ATOM 2506 N VAL B 46 14.881 2.020 1.135 1.00 3.34 N ATOM 2507 CA VAL B 46 14.468 2.763 2.342 1.00 23.33 C ATOM 2508 C VAL B 46 15.712 3.339 3.069 1.00 43.13 C ATOM 2509 O VAL B 46 16.657 2.607 3.374 1.00 73.33 O ATOM 2510 CB VAL B 46 13.602 1.848 3.295 1.00 63.30 C ATOM 2511 CG1 VAL B 46 14.350 0.560 3.712 1.00 70.03 C ATOM 2512 CG2 VAL B 46 13.094 2.636 4.528 1.00 53.25 C ATOM 0 H VAL B 46 15.099 1.039 1.312 1.00 3.34 H new ATOM 0 HA VAL B 46 13.839 3.602 2.042 1.00 23.33 H new ATOM 0 HB VAL B 46 12.730 1.532 2.722 1.00 63.30 H new ATOM 0 HG11 VAL B 46 13.713 -0.035 4.366 1.00 70.03 H new ATOM 0 HG12 VAL B 46 14.599 -0.020 2.823 1.00 70.03 H new ATOM 0 HG13 VAL B 46 15.265 0.826 4.241 1.00 70.03 H new ATOM 0 HG21 VAL B 46 12.502 1.977 5.163 1.00 53.25 H new ATOM 0 HG22 VAL B 46 13.945 3.015 5.093 1.00 53.25 H new ATOM 0 HG23 VAL B 46 12.477 3.471 4.197 1.00 53.25 H new ATOM 2522 N THR B 47 15.703 4.663 3.318 1.00 45.32 N ATOM 2523 CA THR B 47 16.819 5.384 3.966 1.00 53.32 C ATOM 2524 C THR B 47 16.796 5.192 5.497 1.00 52.35 C ATOM 2525 O THR B 47 15.860 4.595 6.031 1.00 0.41 O ATOM 2526 CB THR B 47 16.752 6.895 3.614 1.00 63.02 C ATOM 2527 OG1 THR B 47 15.466 7.425 3.993 1.00 4.22 O ATOM 2528 CG2 THR B 47 16.996 7.144 2.116 1.00 44.02 C ATOM 0 H THR B 47 14.918 5.267 3.074 1.00 45.32 H new ATOM 0 HA THR B 47 17.754 4.969 3.590 1.00 53.32 H new ATOM 0 HB THR B 47 17.542 7.402 4.168 1.00 63.02 H new ATOM 0 HG1 THR B 47 15.427 8.379 3.771 1.00 4.22 H new ATOM 0 HG21 THR B 47 16.941 8.213 1.911 1.00 44.02 H new ATOM 0 HG22 THR B 47 17.983 6.772 1.841 1.00 44.02 H new ATOM 0 HG23 THR B 47 16.237 6.623 1.532 1.00 44.02 H new ATOM 2536 N SER B 48 17.831 5.711 6.193 1.00 13.30 N ATOM 2537 CA SER B 48 18.038 5.462 7.636 1.00 55.12 C ATOM 2538 C SER B 48 16.933 6.072 8.497 1.00 32.40 C ATOM 2539 O SER B 48 16.391 5.401 9.369 1.00 2.25 O ATOM 2540 CB SER B 48 19.405 6.005 8.084 1.00 64.53 C ATOM 2541 OG SER B 48 19.532 7.384 7.794 1.00 64.21 O ATOM 0 H SER B 48 18.542 6.310 5.774 1.00 13.30 H new ATOM 0 HA SER B 48 18.008 4.382 7.778 1.00 55.12 H new ATOM 0 HB2 SER B 48 19.529 5.844 9.155 1.00 64.53 H new ATOM 0 HB3 SER B 48 20.200 5.452 7.584 1.00 64.53 H new ATOM 0 HG SER B 48 20.463 7.586 7.565 1.00 64.21 H new ATOM 2547 N THR B 49 16.613 7.339 8.230 1.00 13.55 N ATOM 2548 CA THR B 49 15.610 8.107 8.984 1.00 40.43 C ATOM 2549 C THR B 49 14.216 7.452 8.904 1.00 65.44 C ATOM 2550 O THR B 49 13.461 7.433 9.886 1.00 11.24 O ATOM 2551 CB THR B 49 15.553 9.563 8.430 1.00 41.13 C ATOM 2552 OG1 THR B 49 15.296 9.524 7.017 1.00 34.14 O ATOM 2553 CG2 THR B 49 16.863 10.331 8.687 1.00 22.55 C ATOM 0 H THR B 49 17.046 7.871 7.475 1.00 13.55 H new ATOM 0 HA THR B 49 15.905 8.122 10.033 1.00 40.43 H new ATOM 0 HB THR B 49 14.752 10.086 8.952 1.00 41.13 H new ATOM 0 HG1 THR B 49 15.258 10.438 6.666 1.00 34.14 H new ATOM 0 HG21 THR B 49 16.778 11.340 8.284 1.00 22.55 H new ATOM 0 HG22 THR B 49 17.050 10.383 9.760 1.00 22.55 H new ATOM 0 HG23 THR B 49 17.689 9.814 8.199 1.00 22.55 H new ATOM 2561 N ILE B 50 13.907 6.889 7.731 1.00 61.25 N ATOM 2562 CA ILE B 50 12.603 6.278 7.457 1.00 22.34 C ATOM 2563 C ILE B 50 12.548 4.858 8.047 1.00 14.11 C ATOM 2564 O ILE B 50 11.595 4.523 8.751 1.00 4.23 O ATOM 2565 CB ILE B 50 12.304 6.277 5.912 1.00 24.12 C ATOM 2566 CG1 ILE B 50 12.402 7.734 5.344 1.00 73.41 C ATOM 2567 CG2 ILE B 50 10.924 5.650 5.593 1.00 44.44 C ATOM 2568 CD1 ILE B 50 11.509 8.766 6.042 1.00 53.34 C ATOM 0 H ILE B 50 14.555 6.844 6.944 1.00 61.25 H new ATOM 0 HA ILE B 50 11.826 6.871 7.939 1.00 22.34 H new ATOM 0 HB ILE B 50 13.057 5.657 5.425 1.00 24.12 H new ATOM 0 HG12 ILE B 50 13.438 8.066 5.415 1.00 73.41 H new ATOM 0 HG13 ILE B 50 12.146 7.712 4.285 1.00 73.41 H new ATOM 0 HG21 ILE B 50 10.756 5.669 4.516 1.00 44.44 H new ATOM 0 HG22 ILE B 50 10.903 4.619 5.946 1.00 44.44 H new ATOM 0 HG23 ILE B 50 10.141 6.221 6.092 1.00 44.44 H new ATOM 0 HD11 ILE B 50 11.649 9.742 5.577 1.00 53.34 H new ATOM 0 HD12 ILE B 50 10.465 8.466 5.949 1.00 53.34 H new ATOM 0 HD13 ILE B 50 11.777 8.825 7.097 1.00 53.34 H new ATOM 2580 N LEU B 51 13.611 4.058 7.800 1.00 1.35 N ATOM 2581 CA LEU B 51 13.728 2.658 8.294 1.00 73.21 C ATOM 2582 C LEU B 51 13.787 2.618 9.835 1.00 72.42 C ATOM 2583 O LEU B 51 13.378 1.633 10.457 1.00 14.11 O ATOM 2584 CB LEU B 51 14.972 1.944 7.682 1.00 73.02 C ATOM 2585 CG LEU B 51 15.058 0.398 7.922 1.00 13.45 C ATOM 2586 CD1 LEU B 51 13.798 -0.328 7.376 1.00 5.23 C ATOM 2587 CD2 LEU B 51 16.359 -0.204 7.327 1.00 20.01 C ATOM 0 H LEU B 51 14.416 4.362 7.252 1.00 1.35 H new ATOM 0 HA LEU B 51 12.836 2.121 7.971 1.00 73.21 H new ATOM 0 HB2 LEU B 51 14.980 2.127 6.607 1.00 73.02 H new ATOM 0 HB3 LEU B 51 15.870 2.407 8.091 1.00 73.02 H new ATOM 0 HG LEU B 51 15.092 0.238 9.000 1.00 13.45 H new ATOM 0 HD11 LEU B 51 13.888 -1.399 7.558 1.00 5.23 H new ATOM 0 HD12 LEU B 51 12.911 0.053 7.882 1.00 5.23 H new ATOM 0 HD13 LEU B 51 13.710 -0.148 6.305 1.00 5.23 H new ATOM 0 HD21 LEU B 51 16.382 -1.278 7.514 1.00 20.01 H new ATOM 0 HD22 LEU B 51 16.386 -0.022 6.253 1.00 20.01 H new ATOM 0 HD23 LEU B 51 17.224 0.264 7.796 1.00 20.01 H new ATOM 2599 N GLU B 52 14.317 3.709 10.421 1.00 11.31 N ATOM 2600 CA GLU B 52 14.300 3.966 11.876 1.00 11.41 C ATOM 2601 C GLU B 52 12.865 3.854 12.414 1.00 53.00 C ATOM 2602 O GLU B 52 12.594 3.065 13.312 1.00 32.24 O ATOM 2603 CB GLU B 52 14.845 5.400 12.146 1.00 24.35 C ATOM 2604 CG GLU B 52 14.630 5.955 13.578 1.00 73.33 C ATOM 2605 CD GLU B 52 14.626 7.492 13.624 1.00 60.23 C ATOM 2606 OE1 GLU B 52 13.629 8.102 13.168 1.00 11.11 O ATOM 2607 OE2 GLU B 52 15.610 8.098 14.100 1.00 5.33 O ATOM 0 H GLU B 52 14.776 4.449 9.889 1.00 11.31 H new ATOM 0 HA GLU B 52 14.926 3.230 12.380 1.00 11.41 H new ATOM 0 HB2 GLU B 52 15.914 5.406 11.933 1.00 24.35 H new ATOM 0 HB3 GLU B 52 14.375 6.084 11.439 1.00 24.35 H new ATOM 0 HG2 GLU B 52 13.684 5.581 13.970 1.00 73.33 H new ATOM 0 HG3 GLU B 52 15.417 5.578 14.231 1.00 73.33 H new ATOM 2614 N LYS B 53 11.954 4.621 11.789 1.00 24.14 N ATOM 2615 CA LYS B 53 10.543 4.707 12.201 1.00 32.14 C ATOM 2616 C LYS B 53 9.738 3.476 11.755 1.00 2.42 C ATOM 2617 O LYS B 53 8.809 3.079 12.449 1.00 34.21 O ATOM 2618 CB LYS B 53 9.909 6.023 11.660 1.00 1.23 C ATOM 2619 CG LYS B 53 10.151 7.268 12.552 1.00 24.55 C ATOM 2620 CD LYS B 53 9.580 8.570 11.931 1.00 2.44 C ATOM 2621 CE LYS B 53 10.345 8.994 10.665 1.00 64.12 C ATOM 2622 NZ LYS B 53 11.785 9.216 10.953 1.00 1.35 N ATOM 0 H LYS B 53 12.178 5.201 10.980 1.00 24.14 H new ATOM 0 HA LYS B 53 10.510 4.724 13.290 1.00 32.14 H new ATOM 0 HB2 LYS B 53 10.308 6.221 10.665 1.00 1.23 H new ATOM 0 HB3 LYS B 53 8.835 5.875 11.549 1.00 1.23 H new ATOM 0 HG2 LYS B 53 9.694 7.105 13.528 1.00 24.55 H new ATOM 0 HG3 LYS B 53 11.222 7.389 12.718 1.00 24.55 H new ATOM 0 HD2 LYS B 53 8.528 8.423 11.686 1.00 2.44 H new ATOM 0 HD3 LYS B 53 9.626 9.372 12.667 1.00 2.44 H new ATOM 0 HE2 LYS B 53 10.239 8.225 9.899 1.00 64.12 H new ATOM 0 HE3 LYS B 53 9.908 9.907 10.262 1.00 64.12 H new ATOM 0 HZ1 LYS B 53 12.094 10.107 10.513 1.00 1.35 H new ATOM 0 HZ2 LYS B 53 11.929 9.270 11.982 1.00 1.35 H new ATOM 0 HZ3 LYS B 53 12.342 8.428 10.566 1.00 1.35 H new ATOM 2636 N VAL B 54 10.096 2.886 10.604 1.00 20.33 N ATOM 2637 CA VAL B 54 9.441 1.667 10.088 1.00 44.44 C ATOM 2638 C VAL B 54 9.620 0.523 11.100 1.00 33.32 C ATOM 2639 O VAL B 54 8.641 -0.075 11.566 1.00 24.30 O ATOM 2640 CB VAL B 54 10.016 1.260 8.672 1.00 42.34 C ATOM 2641 CG1 VAL B 54 9.558 -0.152 8.230 1.00 11.51 C ATOM 2642 CG2 VAL B 54 9.635 2.313 7.604 1.00 43.21 C ATOM 0 H VAL B 54 10.844 3.236 10.005 1.00 20.33 H new ATOM 0 HA VAL B 54 8.378 1.869 9.959 1.00 44.44 H new ATOM 0 HB VAL B 54 11.101 1.229 8.768 1.00 42.34 H new ATOM 0 HG11 VAL B 54 9.981 -0.382 7.252 1.00 11.51 H new ATOM 0 HG12 VAL B 54 9.901 -0.889 8.956 1.00 11.51 H new ATOM 0 HG13 VAL B 54 8.470 -0.180 8.171 1.00 11.51 H new ATOM 0 HG21 VAL B 54 10.040 2.014 6.637 1.00 43.21 H new ATOM 0 HG22 VAL B 54 8.550 2.386 7.536 1.00 43.21 H new ATOM 0 HG23 VAL B 54 10.046 3.282 7.886 1.00 43.21 H new ATOM 2652 N LEU B 55 10.881 0.285 11.475 1.00 43.33 N ATOM 2653 CA LEU B 55 11.252 -0.790 12.399 1.00 52.34 C ATOM 2654 C LEU B 55 10.879 -0.454 13.852 1.00 71.10 C ATOM 2655 O LEU B 55 10.588 -1.361 14.621 1.00 24.02 O ATOM 2656 CB LEU B 55 12.759 -1.133 12.257 1.00 73.14 C ATOM 2657 CG LEU B 55 13.184 -1.735 10.875 1.00 21.11 C ATOM 2658 CD1 LEU B 55 14.679 -2.112 10.870 1.00 33.21 C ATOM 2659 CD2 LEU B 55 12.294 -2.943 10.472 1.00 61.15 C ATOM 0 H LEU B 55 11.675 0.834 11.145 1.00 43.33 H new ATOM 0 HA LEU B 55 10.677 -1.675 12.129 1.00 52.34 H new ATOM 0 HB2 LEU B 55 13.339 -0.227 12.433 1.00 73.14 H new ATOM 0 HB3 LEU B 55 13.028 -1.841 13.041 1.00 73.14 H new ATOM 0 HG LEU B 55 13.032 -0.961 10.123 1.00 21.11 H new ATOM 0 HD11 LEU B 55 14.946 -2.527 9.898 1.00 33.21 H new ATOM 0 HD12 LEU B 55 15.279 -1.223 11.062 1.00 33.21 H new ATOM 0 HD13 LEU B 55 14.870 -2.853 11.646 1.00 33.21 H new ATOM 0 HD21 LEU B 55 12.622 -3.331 9.508 1.00 61.15 H new ATOM 0 HD22 LEU B 55 12.379 -3.725 11.226 1.00 61.15 H new ATOM 0 HD23 LEU B 55 11.255 -2.621 10.399 1.00 61.15 H new ATOM 2671 N ASP B 56 10.866 0.840 14.221 1.00 55.24 N ATOM 2672 CA ASP B 56 10.491 1.265 15.596 1.00 33.55 C ATOM 2673 C ASP B 56 8.968 1.136 15.815 1.00 10.45 C ATOM 2674 O ASP B 56 8.513 0.816 16.923 1.00 45.23 O ATOM 2675 CB ASP B 56 10.964 2.704 15.897 1.00 12.45 C ATOM 2676 CG ASP B 56 10.818 3.082 17.380 1.00 50.22 C ATOM 2677 OD1 ASP B 56 9.931 3.888 17.719 1.00 24.32 O ATOM 2678 OD2 ASP B 56 11.583 2.544 18.214 1.00 5.42 O ATOM 0 H ASP B 56 11.108 1.610 13.597 1.00 55.24 H new ATOM 0 HA ASP B 56 10.998 0.598 16.293 1.00 33.55 H new ATOM 0 HB2 ASP B 56 12.008 2.807 15.602 1.00 12.45 H new ATOM 0 HB3 ASP B 56 10.390 3.404 15.290 1.00 12.45 H new ATOM 2683 N TYR B 57 8.192 1.389 14.744 1.00 3.01 N ATOM 2684 CA TYR B 57 6.740 1.116 14.720 1.00 22.44 C ATOM 2685 C TYR B 57 6.502 -0.386 14.871 1.00 2.11 C ATOM 2686 O TYR B 57 5.583 -0.808 15.570 1.00 41.43 O ATOM 2687 CB TYR B 57 6.088 1.619 13.404 1.00 23.00 C ATOM 2688 CG TYR B 57 4.610 1.196 13.219 1.00 1.11 C ATOM 2689 CD1 TYR B 57 3.571 1.876 13.864 1.00 21.25 C ATOM 2690 CD2 TYR B 57 4.264 0.092 12.421 1.00 54.23 C ATOM 2691 CE1 TYR B 57 2.254 1.470 13.720 1.00 64.41 C ATOM 2692 CE2 TYR B 57 2.952 -0.306 12.274 1.00 71.42 C ATOM 2693 CZ TYR B 57 1.951 0.380 12.923 1.00 15.24 C ATOM 2694 OH TYR B 57 0.647 -0.038 12.781 1.00 52.02 O ATOM 0 H TYR B 57 8.550 1.786 13.875 1.00 3.01 H new ATOM 0 HA TYR B 57 6.279 1.653 15.549 1.00 22.44 H new ATOM 0 HB2 TYR B 57 6.148 2.707 13.376 1.00 23.00 H new ATOM 0 HB3 TYR B 57 6.668 1.246 12.560 1.00 23.00 H new ATOM 0 HD1 TYR B 57 3.799 2.731 14.484 1.00 21.25 H new ATOM 0 HD2 TYR B 57 5.043 -0.457 11.912 1.00 54.23 H new ATOM 0 HE1 TYR B 57 1.465 2.004 14.229 1.00 64.41 H new ATOM 0 HE2 TYR B 57 2.710 -1.154 11.651 1.00 71.42 H new ATOM 0 HH TYR B 57 0.073 0.465 13.396 1.00 52.02 H new ATOM 2704 N CYS B 58 7.332 -1.169 14.172 1.00 34.33 N ATOM 2705 CA CYS B 58 7.279 -2.628 14.203 1.00 72.41 C ATOM 2706 C CYS B 58 7.676 -3.177 15.604 1.00 44.34 C ATOM 2707 O CYS B 58 7.163 -4.224 16.024 1.00 5.24 O ATOM 2708 CB CYS B 58 8.160 -3.192 13.070 1.00 71.53 C ATOM 2709 SG CYS B 58 7.539 -2.833 11.408 1.00 52.43 S ATOM 0 H CYS B 58 8.064 -0.801 13.565 1.00 34.33 H new ATOM 0 HA CYS B 58 6.255 -2.961 14.032 1.00 72.41 H new ATOM 0 HB2 CYS B 58 9.166 -2.783 13.167 1.00 71.53 H new ATOM 0 HB3 CYS B 58 8.242 -4.272 13.191 1.00 71.53 H new ATOM 0 HG CYS B 58 7.808 -1.599 11.101 1.00 52.43 H new ATOM 2715 N ARG B 59 8.576 -2.456 16.321 1.00 34.03 N ATOM 2716 CA ARG B 59 8.910 -2.751 17.743 1.00 3.53 C ATOM 2717 C ARG B 59 7.659 -2.561 18.613 1.00 72.12 C ATOM 2718 O ARG B 59 7.293 -3.439 19.392 1.00 2.23 O ATOM 2719 CB ARG B 59 10.041 -1.823 18.276 1.00 14.14 C ATOM 2720 CG ARG B 59 11.428 -2.009 17.630 1.00 63.14 C ATOM 2721 CD ARG B 59 12.449 -0.979 18.156 1.00 71.53 C ATOM 2722 NE ARG B 59 13.728 -1.049 17.424 1.00 73.34 N ATOM 2723 CZ ARG B 59 14.463 0.004 17.021 1.00 3.32 C ATOM 2724 NH1 ARG B 59 14.059 1.253 17.258 1.00 35.44 N ATOM 2725 NH2 ARG B 59 15.620 -0.201 16.397 1.00 22.12 N ATOM 0 H ARG B 59 9.087 -1.661 15.937 1.00 34.03 H new ATOM 0 HA ARG B 59 9.261 -3.782 17.794 1.00 3.53 H new ATOM 0 HB2 ARG B 59 9.732 -0.788 18.133 1.00 14.14 H new ATOM 0 HB3 ARG B 59 10.138 -1.982 19.350 1.00 14.14 H new ATOM 0 HG2 ARG B 59 11.791 -3.017 17.833 1.00 63.14 H new ATOM 0 HG3 ARG B 59 11.340 -1.914 16.548 1.00 63.14 H new ATOM 0 HD2 ARG B 59 12.033 0.024 18.064 1.00 71.53 H new ATOM 0 HD3 ARG B 59 12.628 -1.154 19.217 1.00 71.53 H new ATOM 0 HE ARG B 59 14.087 -1.978 17.204 1.00 73.34 H new ATOM 0 HH11 ARG B 59 13.182 1.420 17.751 1.00 35.44 H new ATOM 0 HH12 ARG B 59 14.627 2.041 16.946 1.00 35.44 H new ATOM 0 HH21 ARG B 59 15.946 -1.152 16.226 1.00 22.12 H new ATOM 0 HH22 ARG B 59 16.181 0.593 16.089 1.00 22.12 H new ATOM 2739 N HIS B 60 7.017 -1.391 18.445 1.00 10.43 N ATOM 2740 CA HIS B 60 5.776 -1.022 19.157 1.00 4.35 C ATOM 2741 C HIS B 60 4.655 -2.041 18.888 1.00 23.12 C ATOM 2742 O HIS B 60 3.963 -2.455 19.803 1.00 12.24 O ATOM 2743 CB HIS B 60 5.315 0.396 18.727 1.00 13.32 C ATOM 2744 CG HIS B 60 3.974 0.823 19.288 1.00 21.45 C ATOM 2745 ND1 HIS B 60 3.795 1.242 20.585 1.00 42.34 N ATOM 2746 CD2 HIS B 60 2.745 0.869 18.712 1.00 53.24 C ATOM 2747 CE1 HIS B 60 2.523 1.519 20.783 1.00 14.12 C ATOM 2748 NE2 HIS B 60 1.860 1.309 19.661 1.00 23.51 N ATOM 0 H HIS B 60 7.346 -0.667 17.806 1.00 10.43 H new ATOM 0 HA HIS B 60 5.989 -1.024 20.226 1.00 4.35 H new ATOM 0 HB2 HIS B 60 6.070 1.118 19.037 1.00 13.32 H new ATOM 0 HB3 HIS B 60 5.267 0.433 17.639 1.00 13.32 H new ATOM 0 HD2 HIS B 60 2.508 0.607 17.691 1.00 53.24 H new ATOM 0 HE1 HIS B 60 2.092 1.862 21.712 1.00 14.12 H new ATOM 0 HE2 HIS B 60 0.859 1.450 19.524 1.00 23.51 H new ATOM 2757 N HIS B 61 4.513 -2.423 17.617 1.00 5.21 N ATOM 2758 CA HIS B 61 3.432 -3.296 17.127 1.00 2.31 C ATOM 2759 C HIS B 61 3.577 -4.725 17.686 1.00 65.54 C ATOM 2760 O HIS B 61 2.580 -5.395 17.970 1.00 1.54 O ATOM 2761 CB HIS B 61 3.473 -3.306 15.579 1.00 52.42 C ATOM 2762 CG HIS B 61 2.370 -4.084 14.912 1.00 31.40 C ATOM 2763 ND1 HIS B 61 2.473 -5.422 14.589 1.00 72.04 N ATOM 2764 CD2 HIS B 61 1.145 -3.693 14.491 1.00 15.04 C ATOM 2765 CE1 HIS B 61 1.365 -5.816 13.997 1.00 55.22 C ATOM 2766 NE2 HIS B 61 0.541 -4.788 13.926 1.00 65.32 N ATOM 0 H HIS B 61 5.156 -2.131 16.881 1.00 5.21 H new ATOM 0 HA HIS B 61 2.471 -2.912 17.469 1.00 2.31 H new ATOM 0 HB2 HIS B 61 3.435 -2.276 15.224 1.00 52.42 H new ATOM 0 HB3 HIS B 61 4.430 -3.718 15.260 1.00 52.42 H new ATOM 0 HD1 HIS B 61 3.282 -6.014 14.779 1.00 72.04 H new ATOM 0 HD2 HIS B 61 0.722 -2.704 14.583 1.00 15.04 H new ATOM 0 HE1 HIS B 61 1.164 -6.812 13.631 1.00 55.22 H new ATOM 2775 N HIS B 62 4.837 -5.181 17.823 1.00 31.53 N ATOM 2776 CA HIS B 62 5.152 -6.543 18.287 1.00 4.01 C ATOM 2777 C HIS B 62 5.099 -6.644 19.823 1.00 54.14 C ATOM 2778 O HIS B 62 4.510 -7.581 20.361 1.00 3.31 O ATOM 2779 CB HIS B 62 6.547 -6.961 17.770 1.00 32.44 C ATOM 2780 CG HIS B 62 6.943 -8.377 18.109 1.00 2.20 C ATOM 2781 ND1 HIS B 62 6.528 -9.464 17.373 1.00 61.05 N ATOM 2782 CD2 HIS B 62 7.728 -8.880 19.100 1.00 23.53 C ATOM 2783 CE1 HIS B 62 7.036 -10.562 17.889 1.00 33.24 C ATOM 2784 NE2 HIS B 62 7.763 -10.231 18.933 1.00 24.21 N ATOM 0 H HIS B 62 5.661 -4.617 17.616 1.00 31.53 H new ATOM 0 HA HIS B 62 4.398 -7.221 17.887 1.00 4.01 H new ATOM 0 HB2 HIS B 62 6.570 -6.840 16.687 1.00 32.44 H new ATOM 0 HB3 HIS B 62 7.292 -6.280 18.182 1.00 32.44 H new ATOM 0 HD2 HIS B 62 8.228 -8.315 19.872 1.00 23.53 H new ATOM 0 HE1 HIS B 62 6.882 -11.565 17.518 1.00 33.24 H new ATOM 0 HE2 HIS B 62 8.274 -10.885 19.526 1.00 24.21 H new ATOM 2793 N GLN B 63 5.741 -5.674 20.506 1.00 33.34 N ATOM 2794 CA GLN B 63 5.870 -5.662 21.983 1.00 22.00 C ATOM 2795 C GLN B 63 4.564 -5.200 22.654 1.00 72.04 C ATOM 2796 O GLN B 63 4.284 -5.566 23.797 1.00 33.12 O ATOM 2797 CB GLN B 63 7.057 -4.750 22.421 1.00 24.34 C ATOM 2798 CG GLN B 63 8.448 -5.204 21.911 1.00 71.32 C ATOM 2799 CD GLN B 63 8.914 -6.562 22.455 1.00 74.55 C ATOM 2800 OE1 GLN B 63 8.553 -6.969 23.558 1.00 63.13 O ATOM 2801 NE2 GLN B 63 9.724 -7.268 21.690 1.00 14.13 N ATOM 0 H GLN B 63 6.185 -4.876 20.052 1.00 33.34 H new ATOM 0 HA GLN B 63 6.073 -6.682 22.308 1.00 22.00 H new ATOM 0 HB2 GLN B 63 6.868 -3.737 22.066 1.00 24.34 H new ATOM 0 HB3 GLN B 63 7.081 -4.707 23.510 1.00 24.34 H new ATOM 0 HG2 GLN B 63 8.424 -5.252 20.822 1.00 71.32 H new ATOM 0 HG3 GLN B 63 9.184 -4.447 22.180 1.00 71.32 H new ATOM 0 HE21 GLN B 63 10.008 -6.908 20.779 1.00 14.13 H new ATOM 0 HE22 GLN B 63 10.066 -8.174 22.009 1.00 14.13 H new ATOM 2810 N HIS B 64 3.791 -4.372 21.939 1.00 15.22 N ATOM 2811 CA HIS B 64 2.459 -3.907 22.362 1.00 72.00 C ATOM 2812 C HIS B 64 1.464 -4.226 21.220 1.00 15.12 C ATOM 2813 O HIS B 64 1.446 -3.506 20.213 1.00 45.21 O ATOM 2814 CB HIS B 64 2.470 -2.379 22.674 1.00 11.31 C ATOM 2815 CG HIS B 64 3.341 -1.971 23.841 1.00 23.53 C ATOM 2816 ND1 HIS B 64 2.831 -1.570 25.056 1.00 52.11 N ATOM 2817 CD2 HIS B 64 4.692 -1.893 23.969 1.00 50.14 C ATOM 2818 CE1 HIS B 64 3.819 -1.262 25.871 1.00 24.11 C ATOM 2819 NE2 HIS B 64 4.960 -1.450 25.243 1.00 45.05 N ATOM 0 H HIS B 64 4.077 -3.999 21.034 1.00 15.22 H new ATOM 0 HA HIS B 64 2.161 -4.416 23.279 1.00 72.00 H new ATOM 0 HB2 HIS B 64 2.806 -1.844 21.785 1.00 11.31 H new ATOM 0 HB3 HIS B 64 1.448 -2.057 22.873 1.00 11.31 H new ATOM 0 HD2 HIS B 64 5.421 -2.135 23.210 1.00 50.14 H new ATOM 0 HE1 HIS B 64 3.710 -0.913 26.887 1.00 24.11 H new ATOM 0 HE2 HIS B 64 5.888 -1.293 25.636 1.00 45.05 H new ATOM 2828 N PRO B 65 0.659 -5.340 21.332 1.00 33.21 N ATOM 2829 CA PRO B 65 -0.297 -5.759 20.269 1.00 32.35 C ATOM 2830 C PRO B 65 -1.323 -4.651 19.923 1.00 30.41 C ATOM 2831 O PRO B 65 -2.313 -4.459 20.633 1.00 71.12 O ATOM 2832 CB PRO B 65 -0.984 -7.019 20.868 1.00 13.04 C ATOM 2833 CG PRO B 65 -0.019 -7.525 21.901 1.00 25.43 C ATOM 2834 CD PRO B 65 0.629 -6.288 22.482 1.00 73.13 C ATOM 0 HA PRO B 65 0.203 -5.961 19.322 1.00 32.35 H new ATOM 0 HB2 PRO B 65 -1.947 -6.771 21.314 1.00 13.04 H new ATOM 0 HB3 PRO B 65 -1.172 -7.770 20.101 1.00 13.04 H new ATOM 0 HG2 PRO B 65 -0.533 -8.099 22.672 1.00 25.43 H new ATOM 0 HG3 PRO B 65 0.724 -8.186 21.455 1.00 25.43 H new ATOM 0 HD2 PRO B 65 0.054 -5.888 23.317 1.00 73.13 H new ATOM 0 HD3 PRO B 65 1.631 -6.498 22.856 1.00 73.13 H new ATOM 2842 N GLY B 66 -1.022 -3.896 18.858 1.00 34.23 N ATOM 2843 CA GLY B 66 -1.843 -2.774 18.428 1.00 61.41 C ATOM 2844 C GLY B 66 -1.257 -2.110 17.192 1.00 35.42 C ATOM 2845 O GLY B 66 -1.377 -2.652 16.092 1.00 25.04 O ATOM 0 H GLY B 66 -0.200 -4.052 18.275 1.00 34.23 H new ATOM 0 HA2 GLY B 66 -2.854 -3.120 18.214 1.00 61.41 H new ATOM 0 HA3 GLY B 66 -1.920 -2.045 19.235 1.00 61.41 H new ATOM 2849 N GLY B 67 -0.590 -0.950 17.382 1.00 0.52 N ATOM 2850 CA GLY B 67 -0.105 -0.123 16.261 1.00 73.31 C ATOM 2851 C GLY B 67 -1.212 0.711 15.610 1.00 1.12 C ATOM 2852 O GLY B 67 -0.973 1.436 14.635 1.00 25.35 O ATOM 0 H GLY B 67 -0.376 -0.567 18.303 1.00 0.52 H new ATOM 0 HA2 GLY B 67 0.680 0.542 16.621 1.00 73.31 H new ATOM 0 HA3 GLY B 67 0.346 -0.770 15.508 1.00 73.31 H new ATOM 2856 N SER B 68 -2.429 0.602 16.166 1.00 11.53 N ATOM 2857 CA SER B 68 -3.650 1.255 15.666 1.00 44.51 C ATOM 2858 C SER B 68 -4.619 1.466 16.846 1.00 45.11 C ATOM 2859 O SER B 68 -4.523 0.764 17.856 1.00 25.35 O ATOM 2860 CB SER B 68 -4.331 0.378 14.578 1.00 50.32 C ATOM 2861 OG SER B 68 -3.450 0.097 13.500 1.00 41.13 O ATOM 0 H SER B 68 -2.596 0.040 17.001 1.00 11.53 H new ATOM 0 HA SER B 68 -3.389 2.214 15.219 1.00 44.51 H new ATOM 0 HB2 SER B 68 -4.669 -0.557 15.024 1.00 50.32 H new ATOM 0 HB3 SER B 68 -5.216 0.890 14.200 1.00 50.32 H new ATOM 0 HG SER B 68 -3.911 -0.457 12.836 1.00 41.13 H new ATOM 2867 N GLY B 69 -5.549 2.419 16.697 1.00 35.55 N ATOM 2868 CA GLY B 69 -6.560 2.713 17.719 1.00 3.42 C ATOM 2869 C GLY B 69 -7.836 3.258 17.094 1.00 2.31 C ATOM 2870 O GLY B 69 -7.767 4.031 16.127 1.00 40.44 O ATOM 0 H GLY B 69 -5.621 3.006 15.866 1.00 35.55 H new ATOM 0 HA2 GLY B 69 -6.786 1.807 18.281 1.00 3.42 H new ATOM 0 HA3 GLY B 69 -6.162 3.438 18.429 1.00 3.42 H new ATOM 2874 N LEU B 70 -8.997 2.846 17.638 1.00 62.42 N ATOM 2875 CA LEU B 70 -10.326 3.246 17.135 1.00 4.33 C ATOM 2876 C LEU B 70 -10.661 4.664 17.649 1.00 33.41 C ATOM 2877 O LEU B 70 -10.626 5.642 16.890 1.00 54.10 O ATOM 2878 CB LEU B 70 -11.401 2.206 17.585 1.00 21.52 C ATOM 2879 CG LEU B 70 -11.152 0.723 17.151 1.00 35.40 C ATOM 2880 CD1 LEU B 70 -12.237 -0.218 17.728 1.00 21.44 C ATOM 2881 CD2 LEU B 70 -11.049 0.592 15.607 1.00 1.23 C ATOM 0 H LEU B 70 -9.040 2.222 18.444 1.00 62.42 H new ATOM 0 HA LEU B 70 -10.321 3.268 16.045 1.00 4.33 H new ATOM 0 HB2 LEU B 70 -11.474 2.237 18.672 1.00 21.52 H new ATOM 0 HB3 LEU B 70 -12.368 2.520 17.192 1.00 21.52 H new ATOM 0 HG LEU B 70 -10.193 0.415 17.567 1.00 35.40 H new ATOM 0 HD11 LEU B 70 -12.038 -1.241 17.410 1.00 21.44 H new ATOM 0 HD12 LEU B 70 -12.221 -0.167 18.817 1.00 21.44 H new ATOM 0 HD13 LEU B 70 -13.217 0.091 17.364 1.00 21.44 H new ATOM 0 HD21 LEU B 70 -10.876 -0.451 15.341 1.00 1.23 H new ATOM 0 HD22 LEU B 70 -11.978 0.934 15.150 1.00 1.23 H new ATOM 0 HD23 LEU B 70 -10.221 1.201 15.245 1.00 1.23 H new ATOM 2893 N ASP B 71 -10.966 4.752 18.959 1.00 63.11 N ATOM 2894 CA ASP B 71 -11.157 6.039 19.673 1.00 63.33 C ATOM 2895 C ASP B 71 -10.033 6.222 20.720 1.00 24.14 C ATOM 2896 O ASP B 71 -9.949 7.247 21.408 1.00 55.41 O ATOM 2897 CB ASP B 71 -12.571 6.079 20.320 1.00 34.32 C ATOM 2898 CG ASP B 71 -12.929 7.439 20.959 1.00 2.24 C ATOM 2899 OD1 ASP B 71 -12.999 8.448 20.221 1.00 24.22 O ATOM 2900 OD2 ASP B 71 -13.122 7.506 22.199 1.00 75.20 O ATOM 0 H ASP B 71 -11.088 3.934 19.556 1.00 63.11 H new ATOM 0 HA ASP B 71 -11.095 6.870 18.970 1.00 63.33 H new ATOM 0 HB2 ASP B 71 -13.314 5.839 19.560 1.00 34.32 H new ATOM 0 HB3 ASP B 71 -12.633 5.303 21.083 1.00 34.32 H new ATOM 2905 N ASP B 72 -9.137 5.222 20.788 1.00 25.14 N ATOM 2906 CA ASP B 72 -8.011 5.180 21.723 1.00 24.41 C ATOM 2907 C ASP B 72 -6.718 5.532 20.962 1.00 33.14 C ATOM 2908 O ASP B 72 -6.079 4.673 20.347 1.00 71.31 O ATOM 2909 CB ASP B 72 -7.956 3.783 22.433 1.00 73.01 C ATOM 2910 CG ASP B 72 -7.788 2.571 21.482 1.00 52.12 C ATOM 2911 OD1 ASP B 72 -8.661 2.362 20.605 1.00 22.03 O ATOM 2912 OD2 ASP B 72 -6.797 1.813 21.621 1.00 53.42 O ATOM 0 H ASP B 72 -9.181 4.405 20.179 1.00 25.14 H new ATOM 0 HA ASP B 72 -8.133 5.919 22.515 1.00 24.41 H new ATOM 0 HB2 ASP B 72 -7.129 3.786 23.143 1.00 73.01 H new ATOM 0 HB3 ASP B 72 -8.871 3.649 23.010 1.00 73.01 H new ATOM 2917 N ILE B 73 -6.379 6.831 20.952 1.00 3.12 N ATOM 2918 CA ILE B 73 -5.174 7.347 20.288 1.00 63.55 C ATOM 2919 C ILE B 73 -4.016 7.350 21.313 1.00 22.11 C ATOM 2920 O ILE B 73 -4.060 8.122 22.276 1.00 72.45 O ATOM 2921 CB ILE B 73 -5.384 8.804 19.687 1.00 35.20 C ATOM 2922 CG1 ILE B 73 -6.465 8.823 18.536 1.00 65.23 C ATOM 2923 CG2 ILE B 73 -4.042 9.402 19.181 1.00 1.45 C ATOM 2924 CD1 ILE B 73 -7.918 8.653 18.977 1.00 13.02 C ATOM 0 H ILE B 73 -6.936 7.555 21.406 1.00 3.12 H new ATOM 0 HA ILE B 73 -4.941 6.697 19.444 1.00 63.55 H new ATOM 0 HB ILE B 73 -5.758 9.428 20.499 1.00 35.20 H new ATOM 0 HG12 ILE B 73 -6.378 9.767 17.999 1.00 65.23 H new ATOM 0 HG13 ILE B 73 -6.226 8.030 17.828 1.00 65.23 H new ATOM 0 HG21 ILE B 73 -4.218 10.399 18.776 1.00 1.45 H new ATOM 0 HG22 ILE B 73 -3.337 9.466 20.010 1.00 1.45 H new ATOM 0 HG23 ILE B 73 -3.629 8.761 18.402 1.00 1.45 H new ATOM 0 HD11 ILE B 73 -8.569 8.682 18.103 1.00 13.02 H new ATOM 0 HD12 ILE B 73 -8.035 7.695 19.485 1.00 13.02 H new ATOM 0 HD13 ILE B 73 -8.188 9.460 19.658 1.00 13.02 H new ATOM 2936 N PRO B 74 -2.983 6.450 21.158 1.00 44.12 N ATOM 2937 CA PRO B 74 -1.796 6.445 22.036 1.00 24.54 C ATOM 2938 C PRO B 74 -0.810 7.589 21.668 1.00 55.45 C ATOM 2939 O PRO B 74 -0.735 7.973 20.487 1.00 10.34 O ATOM 2940 CB PRO B 74 -1.164 5.037 21.797 1.00 12.20 C ATOM 2941 CG PRO B 74 -2.122 4.306 20.894 1.00 61.15 C ATOM 2942 CD PRO B 74 -2.888 5.370 20.149 1.00 3.02 C ATOM 0 HA PRO B 74 -2.046 6.618 23.083 1.00 24.54 H new ATOM 0 HB2 PRO B 74 -0.180 5.123 21.336 1.00 12.20 H new ATOM 0 HB3 PRO B 74 -1.029 4.504 22.738 1.00 12.20 H new ATOM 0 HG2 PRO B 74 -1.587 3.655 20.203 1.00 61.15 H new ATOM 0 HG3 PRO B 74 -2.796 3.673 21.471 1.00 61.15 H new ATOM 0 HD2 PRO B 74 -2.363 5.696 19.251 1.00 3.02 H new ATOM 0 HD3 PRO B 74 -3.871 5.019 19.834 1.00 3.02 H new ATOM 2950 N PRO B 75 -0.050 8.148 22.682 1.00 72.32 N ATOM 2951 CA PRO B 75 0.897 9.272 22.466 1.00 24.33 C ATOM 2952 C PRO B 75 1.935 8.987 21.361 1.00 64.41 C ATOM 2953 O PRO B 75 2.095 9.804 20.447 1.00 50.35 O ATOM 2954 CB PRO B 75 1.573 9.449 23.850 1.00 24.33 C ATOM 2955 CG PRO B 75 0.565 8.923 24.824 1.00 33.33 C ATOM 2956 CD PRO B 75 -0.087 7.750 24.122 1.00 45.44 C ATOM 0 HA PRO B 75 0.386 10.169 22.117 1.00 24.33 H new ATOM 0 HB2 PRO B 75 2.510 8.895 23.909 1.00 24.33 H new ATOM 0 HB3 PRO B 75 1.808 10.495 24.047 1.00 24.33 H new ATOM 0 HG2 PRO B 75 1.041 8.611 25.754 1.00 33.33 H new ATOM 0 HG3 PRO B 75 -0.169 9.686 25.082 1.00 33.33 H new ATOM 0 HD2 PRO B 75 0.458 6.823 24.297 1.00 45.44 H new ATOM 0 HD3 PRO B 75 -1.108 7.590 24.469 1.00 45.44 H new ATOM 2964 N TYR B 76 2.601 7.807 21.442 1.00 72.33 N ATOM 2965 CA TYR B 76 3.620 7.383 20.455 1.00 2.34 C ATOM 2966 C TYR B 76 3.057 7.407 19.025 1.00 72.20 C ATOM 2967 O TYR B 76 3.632 8.039 18.147 1.00 43.11 O ATOM 2968 CB TYR B 76 4.182 5.958 20.762 1.00 15.40 C ATOM 2969 CG TYR B 76 5.026 5.364 19.608 1.00 0.21 C ATOM 2970 CD1 TYR B 76 4.508 4.377 18.755 1.00 42.21 C ATOM 2971 CD2 TYR B 76 6.307 5.848 19.326 1.00 63.20 C ATOM 2972 CE1 TYR B 76 5.230 3.906 17.677 1.00 55.22 C ATOM 2973 CE2 TYR B 76 7.034 5.364 18.257 1.00 74.52 C ATOM 2974 CZ TYR B 76 6.491 4.397 17.434 1.00 62.23 C ATOM 2975 OH TYR B 76 7.202 3.939 16.351 1.00 60.23 O ATOM 0 H TYR B 76 2.447 7.129 22.188 1.00 72.33 H new ATOM 0 HA TYR B 76 4.437 8.100 20.534 1.00 2.34 H new ATOM 0 HB2 TYR B 76 4.794 6.004 21.663 1.00 15.40 H new ATOM 0 HB3 TYR B 76 3.350 5.287 20.976 1.00 15.40 H new ATOM 0 HD1 TYR B 76 3.523 3.977 18.946 1.00 42.21 H new ATOM 0 HD2 TYR B 76 6.735 6.614 19.956 1.00 63.20 H new ATOM 0 HE1 TYR B 76 4.806 3.155 17.027 1.00 55.22 H new ATOM 0 HE2 TYR B 76 8.027 5.742 18.064 1.00 74.52 H new ATOM 0 HH TYR B 76 8.145 3.836 16.598 1.00 60.23 H new ATOM 2985 N ASP B 77 1.944 6.691 18.828 1.00 32.33 N ATOM 2986 CA ASP B 77 1.361 6.425 17.496 1.00 70.45 C ATOM 2987 C ASP B 77 0.937 7.727 16.792 1.00 63.41 C ATOM 2988 O ASP B 77 1.014 7.827 15.558 1.00 62.05 O ATOM 2989 CB ASP B 77 0.161 5.449 17.631 1.00 63.12 C ATOM 2990 CG ASP B 77 0.558 4.086 18.241 1.00 61.25 C ATOM 2991 OD1 ASP B 77 0.456 3.039 17.560 1.00 0.03 O ATOM 2992 OD2 ASP B 77 0.976 4.059 19.420 1.00 1.44 O ATOM 0 H ASP B 77 1.413 6.273 19.592 1.00 32.33 H new ATOM 0 HA ASP B 77 2.126 5.960 16.875 1.00 70.45 H new ATOM 0 HB2 ASP B 77 -0.607 5.909 18.253 1.00 63.12 H new ATOM 0 HB3 ASP B 77 -0.280 5.286 16.648 1.00 63.12 H new ATOM 2997 N ARG B 78 0.512 8.723 17.586 1.00 20.20 N ATOM 2998 CA ARG B 78 0.147 10.053 17.065 1.00 1.11 C ATOM 2999 C ARG B 78 1.414 10.862 16.710 1.00 31.43 C ATOM 3000 O ARG B 78 1.487 11.466 15.634 1.00 5.20 O ATOM 3001 CB ARG B 78 -0.733 10.810 18.087 1.00 52.04 C ATOM 3002 CG ARG B 78 -1.322 12.141 17.562 1.00 4.22 C ATOM 3003 CD ARG B 78 -2.259 12.823 18.572 1.00 61.20 C ATOM 3004 NE ARG B 78 -2.840 14.067 18.040 1.00 5.22 N ATOM 3005 CZ ARG B 78 -3.676 14.886 18.706 1.00 1.13 C ATOM 3006 NH1 ARG B 78 -4.047 14.619 19.954 1.00 60.54 N ATOM 3007 NH2 ARG B 78 -4.135 15.975 18.110 1.00 65.54 N ATOM 0 H ARG B 78 0.412 8.632 18.597 1.00 20.20 H new ATOM 0 HA ARG B 78 -0.434 9.924 16.152 1.00 1.11 H new ATOM 0 HB2 ARG B 78 -1.553 10.160 18.394 1.00 52.04 H new ATOM 0 HB3 ARG B 78 -0.139 11.016 18.977 1.00 52.04 H new ATOM 0 HG2 ARG B 78 -0.506 12.821 17.315 1.00 4.22 H new ATOM 0 HG3 ARG B 78 -1.869 11.951 16.638 1.00 4.22 H new ATOM 0 HD2 ARG B 78 -3.061 12.136 18.842 1.00 61.20 H new ATOM 0 HD3 ARG B 78 -1.707 13.044 19.486 1.00 61.20 H new ATOM 0 HE ARG B 78 -2.588 14.330 17.087 1.00 5.22 H new ATOM 0 HH11 ARG B 78 -3.698 13.783 20.422 1.00 60.54 H new ATOM 0 HH12 ARG B 78 -4.681 15.250 20.444 1.00 60.54 H new ATOM 0 HH21 ARG B 78 -3.855 16.189 17.153 1.00 65.54 H new ATOM 0 HH22 ARG B 78 -4.769 16.600 18.608 1.00 65.54 H new ATOM 3021 N ASP B 79 2.417 10.842 17.617 1.00 2.52 N ATOM 3022 CA ASP B 79 3.729 11.520 17.406 1.00 73.24 C ATOM 3023 C ASP B 79 4.527 10.869 16.265 1.00 55.11 C ATOM 3024 O ASP B 79 5.406 11.505 15.672 1.00 52.13 O ATOM 3025 CB ASP B 79 4.581 11.562 18.707 1.00 41.30 C ATOM 3026 CG ASP B 79 4.098 12.620 19.720 1.00 0.21 C ATOM 3027 OD1 ASP B 79 3.426 12.273 20.710 1.00 15.03 O ATOM 3028 OD2 ASP B 79 4.395 13.819 19.529 1.00 61.33 O ATOM 0 H ASP B 79 2.347 10.360 18.513 1.00 2.52 H new ATOM 0 HA ASP B 79 3.503 12.548 17.122 1.00 73.24 H new ATOM 0 HB2 ASP B 79 4.558 10.580 19.179 1.00 41.30 H new ATOM 0 HB3 ASP B 79 5.619 11.766 18.446 1.00 41.30 H new ATOM 3033 N PHE B 80 4.213 9.600 15.983 1.00 51.21 N ATOM 3034 CA PHE B 80 4.797 8.828 14.876 1.00 11.14 C ATOM 3035 C PHE B 80 4.336 9.414 13.530 1.00 54.01 C ATOM 3036 O PHE B 80 5.129 9.571 12.593 1.00 33.24 O ATOM 3037 CB PHE B 80 4.364 7.337 15.009 1.00 52.51 C ATOM 3038 CG PHE B 80 4.842 6.441 13.873 1.00 15.14 C ATOM 3039 CD1 PHE B 80 3.978 6.045 12.843 1.00 34.05 C ATOM 3040 CD2 PHE B 80 6.165 6.026 13.816 1.00 71.53 C ATOM 3041 CE1 PHE B 80 4.433 5.269 11.800 1.00 25.32 C ATOM 3042 CE2 PHE B 80 6.609 5.246 12.780 1.00 3.20 C ATOM 3043 CZ PHE B 80 5.752 4.867 11.769 1.00 21.41 C ATOM 0 H PHE B 80 3.533 9.069 16.527 1.00 51.21 H new ATOM 0 HA PHE B 80 5.885 8.885 14.917 1.00 11.14 H new ATOM 0 HB2 PHE B 80 4.745 6.943 15.951 1.00 52.51 H new ATOM 0 HB3 PHE B 80 3.276 7.290 15.060 1.00 52.51 H new ATOM 0 HD1 PHE B 80 2.943 6.352 12.867 1.00 34.05 H new ATOM 0 HD2 PHE B 80 6.852 6.321 14.596 1.00 71.53 H new ATOM 0 HE1 PHE B 80 3.759 4.976 11.009 1.00 25.32 H new ATOM 0 HE2 PHE B 80 7.640 4.925 12.756 1.00 3.20 H new ATOM 0 HZ PHE B 80 6.113 4.257 10.954 1.00 21.41 H new ATOM 3053 N CYS B 81 3.035 9.742 13.476 1.00 11.34 N ATOM 3054 CA CYS B 81 2.378 10.293 12.282 1.00 23.35 C ATOM 3055 C CYS B 81 2.729 11.787 12.069 1.00 22.41 C ATOM 3056 O CYS B 81 2.484 12.330 10.984 1.00 32.10 O ATOM 3057 CB CYS B 81 0.854 10.093 12.413 1.00 4.22 C ATOM 3058 SG CYS B 81 0.364 8.367 12.629 1.00 15.41 S ATOM 0 H CYS B 81 2.404 9.630 14.269 1.00 11.34 H new ATOM 0 HA CYS B 81 2.742 9.761 11.403 1.00 23.35 H new ATOM 0 HB2 CYS B 81 0.492 10.673 13.262 1.00 4.22 H new ATOM 0 HB3 CYS B 81 0.366 10.491 11.523 1.00 4.22 H new ATOM 0 HG CYS B 81 0.574 8.007 13.860 1.00 15.41 H new ATOM 3064 N LYS B 82 3.297 12.442 13.112 1.00 1.10 N ATOM 3065 CA LYS B 82 3.764 13.842 13.031 1.00 44.04 C ATOM 3066 C LYS B 82 5.100 13.908 12.266 1.00 64.24 C ATOM 3067 O LYS B 82 6.181 13.950 12.868 1.00 71.53 O ATOM 3068 CB LYS B 82 3.923 14.458 14.449 1.00 51.53 C ATOM 3069 CG LYS B 82 2.624 14.528 15.275 1.00 14.33 C ATOM 3070 CD LYS B 82 2.870 15.082 16.697 1.00 65.14 C ATOM 3071 CE LYS B 82 1.627 15.029 17.599 1.00 12.22 C ATOM 3072 NZ LYS B 82 1.933 15.500 18.980 1.00 22.42 N ATOM 0 H LYS B 82 3.442 12.014 14.027 1.00 1.10 H new ATOM 0 HA LYS B 82 3.016 14.424 12.492 1.00 44.04 H new ATOM 0 HB2 LYS B 82 4.658 13.873 15.003 1.00 51.53 H new ATOM 0 HB3 LYS B 82 4.327 15.465 14.349 1.00 51.53 H new ATOM 0 HG2 LYS B 82 1.901 15.160 14.760 1.00 14.33 H new ATOM 0 HG3 LYS B 82 2.185 13.533 15.345 1.00 14.33 H new ATOM 0 HD2 LYS B 82 3.674 14.514 17.166 1.00 65.14 H new ATOM 0 HD3 LYS B 82 3.211 16.115 16.622 1.00 65.14 H new ATOM 0 HE2 LYS B 82 0.838 15.646 17.169 1.00 12.22 H new ATOM 0 HE3 LYS B 82 1.247 14.008 17.638 1.00 12.22 H new ATOM 0 HZ1 LYS B 82 1.133 15.279 19.607 1.00 22.42 H new ATOM 0 HZ2 LYS B 82 2.789 15.022 19.328 1.00 22.42 H new ATOM 0 HZ3 LYS B 82 2.091 16.528 18.969 1.00 22.42 H new ATOM 3086 N VAL B 83 5.006 13.840 10.936 1.00 72.44 N ATOM 3087 CA VAL B 83 6.149 13.945 10.009 1.00 53.02 C ATOM 3088 C VAL B 83 5.783 14.938 8.892 1.00 2.33 C ATOM 3089 O VAL B 83 4.589 15.200 8.657 1.00 65.30 O ATOM 3090 CB VAL B 83 6.536 12.544 9.384 1.00 72.14 C ATOM 3091 CG1 VAL B 83 7.113 11.573 10.450 1.00 0.13 C ATOM 3092 CG2 VAL B 83 5.330 11.910 8.645 1.00 24.35 C ATOM 0 H VAL B 83 4.115 13.707 10.457 1.00 72.44 H new ATOM 0 HA VAL B 83 7.017 14.297 10.566 1.00 53.02 H new ATOM 0 HB VAL B 83 7.324 12.724 8.652 1.00 72.14 H new ATOM 0 HG11 VAL B 83 7.365 10.623 9.978 1.00 0.13 H new ATOM 0 HG12 VAL B 83 8.009 12.008 10.892 1.00 0.13 H new ATOM 0 HG13 VAL B 83 6.370 11.405 11.229 1.00 0.13 H new ATOM 0 HG21 VAL B 83 5.625 10.948 8.226 1.00 24.35 H new ATOM 0 HG22 VAL B 83 4.509 11.763 9.347 1.00 24.35 H new ATOM 0 HG23 VAL B 83 5.006 12.572 7.842 1.00 24.35 H new ATOM 3102 N ASP B 84 6.801 15.492 8.207 1.00 32.01 N ATOM 3103 CA ASP B 84 6.585 16.442 7.098 1.00 72.04 C ATOM 3104 C ASP B 84 6.006 15.677 5.887 1.00 32.04 C ATOM 3105 O ASP B 84 6.200 14.469 5.793 1.00 1.24 O ATOM 3106 CB ASP B 84 7.915 17.169 6.749 1.00 45.03 C ATOM 3107 CG ASP B 84 7.716 18.429 5.888 1.00 40.41 C ATOM 3108 OD1 ASP B 84 6.868 19.274 6.261 1.00 61.52 O ATOM 3109 OD2 ASP B 84 8.412 18.599 4.856 1.00 43.31 O ATOM 0 H ASP B 84 7.783 15.298 8.402 1.00 32.01 H new ATOM 0 HA ASP B 84 5.869 17.209 7.392 1.00 72.04 H new ATOM 0 HB2 ASP B 84 8.422 17.446 7.673 1.00 45.03 H new ATOM 0 HB3 ASP B 84 8.571 16.477 6.221 1.00 45.03 H new ATOM 3114 N GLN B 85 5.294 16.375 4.978 1.00 10.23 N ATOM 3115 CA GLN B 85 4.527 15.728 3.881 1.00 13.33 C ATOM 3116 C GLN B 85 5.422 14.876 2.916 1.00 34.22 C ATOM 3117 O GLN B 85 5.047 13.731 2.619 1.00 0.51 O ATOM 3118 CB GLN B 85 3.660 16.777 3.115 1.00 45.11 C ATOM 3119 CG GLN B 85 2.729 16.199 2.023 1.00 2.54 C ATOM 3120 CD GLN B 85 1.769 15.105 2.532 1.00 51.13 C ATOM 3121 OE1 GLN B 85 0.673 15.392 3.006 1.00 61.04 O ATOM 3122 NE2 GLN B 85 2.177 13.845 2.411 1.00 54.31 N ATOM 0 H GLN B 85 5.231 17.393 4.979 1.00 10.23 H new ATOM 0 HA GLN B 85 3.851 15.012 4.349 1.00 13.33 H new ATOM 0 HB2 GLN B 85 3.050 17.318 3.839 1.00 45.11 H new ATOM 0 HB3 GLN B 85 4.326 17.505 2.652 1.00 45.11 H new ATOM 0 HG2 GLN B 85 2.143 17.011 1.593 1.00 2.54 H new ATOM 0 HG3 GLN B 85 3.340 15.787 1.220 1.00 2.54 H new ATOM 0 HE21 GLN B 85 3.094 13.642 2.013 1.00 54.31 H new ATOM 0 HE22 GLN B 85 1.573 13.082 2.716 1.00 54.31 H new ATOM 3131 N PRO B 86 6.606 15.376 2.406 1.00 21.14 N ATOM 3132 CA PRO B 86 7.586 14.511 1.681 1.00 53.03 C ATOM 3133 C PRO B 86 8.008 13.261 2.497 1.00 54.40 C ATOM 3134 O PRO B 86 8.008 12.143 1.970 1.00 4.21 O ATOM 3135 CB PRO B 86 8.789 15.453 1.444 1.00 54.43 C ATOM 3136 CG PRO B 86 8.183 16.819 1.402 1.00 11.21 C ATOM 3137 CD PRO B 86 7.059 16.796 2.414 1.00 73.04 C ATOM 0 HA PRO B 86 7.164 14.102 0.763 1.00 53.03 H new ATOM 0 HB2 PRO B 86 9.525 15.368 2.244 1.00 54.43 H new ATOM 0 HB3 PRO B 86 9.303 15.216 0.512 1.00 54.43 H new ATOM 0 HG2 PRO B 86 8.920 17.583 1.652 1.00 11.21 H new ATOM 0 HG3 PRO B 86 7.808 17.051 0.405 1.00 11.21 H new ATOM 0 HD2 PRO B 86 7.403 17.101 3.402 1.00 73.04 H new ATOM 0 HD3 PRO B 86 6.254 17.475 2.134 1.00 73.04 H new ATOM 3145 N THR B 87 8.323 13.477 3.793 1.00 5.24 N ATOM 3146 CA THR B 87 8.725 12.409 4.740 1.00 20.03 C ATOM 3147 C THR B 87 7.590 11.368 4.938 1.00 14.35 C ATOM 3148 O THR B 87 7.847 10.178 5.155 1.00 51.52 O ATOM 3149 CB THR B 87 9.108 13.045 6.123 1.00 24.12 C ATOM 3150 OG1 THR B 87 10.012 14.140 5.913 1.00 33.54 O ATOM 3151 CG2 THR B 87 9.760 12.035 7.091 1.00 12.40 C ATOM 0 H THR B 87 8.306 14.405 4.217 1.00 5.24 H new ATOM 0 HA THR B 87 9.587 11.892 4.319 1.00 20.03 H new ATOM 0 HB THR B 87 8.180 13.386 6.582 1.00 24.12 H new ATOM 0 HG1 THR B 87 10.250 14.538 6.776 1.00 33.54 H new ATOM 0 HG21 THR B 87 10.002 12.534 8.029 1.00 12.40 H new ATOM 0 HG22 THR B 87 9.067 11.216 7.284 1.00 12.40 H new ATOM 0 HG23 THR B 87 10.673 11.640 6.644 1.00 12.40 H new ATOM 3159 N LEU B 88 6.341 11.851 4.830 1.00 12.35 N ATOM 3160 CA LEU B 88 5.122 11.043 4.992 1.00 75.33 C ATOM 3161 C LEU B 88 4.990 10.088 3.788 1.00 35.50 C ATOM 3162 O LEU B 88 4.690 8.902 3.956 1.00 61.45 O ATOM 3163 CB LEU B 88 3.887 12.002 5.147 1.00 0.02 C ATOM 3164 CG LEU B 88 2.627 11.443 5.894 1.00 32.03 C ATOM 3165 CD1 LEU B 88 1.642 12.584 6.248 1.00 52.44 C ATOM 3166 CD2 LEU B 88 1.921 10.329 5.096 1.00 23.25 C ATOM 0 H LEU B 88 6.147 12.831 4.624 1.00 12.35 H new ATOM 0 HA LEU B 88 5.171 10.429 5.892 1.00 75.33 H new ATOM 0 HB2 LEU B 88 4.220 12.897 5.672 1.00 0.02 H new ATOM 0 HB3 LEU B 88 3.576 12.314 4.150 1.00 0.02 H new ATOM 0 HG LEU B 88 2.979 10.993 6.822 1.00 32.03 H new ATOM 0 HD11 LEU B 88 0.777 12.170 6.765 1.00 52.44 H new ATOM 0 HD12 LEU B 88 2.140 13.307 6.894 1.00 52.44 H new ATOM 0 HD13 LEU B 88 1.315 13.079 5.334 1.00 52.44 H new ATOM 0 HD21 LEU B 88 1.055 9.974 5.655 1.00 23.25 H new ATOM 0 HD22 LEU B 88 1.596 10.722 4.133 1.00 23.25 H new ATOM 0 HD23 LEU B 88 2.613 9.502 4.936 1.00 23.25 H new ATOM 3178 N PHE B 89 5.245 10.626 2.578 1.00 0.02 N ATOM 3179 CA PHE B 89 5.250 9.838 1.330 1.00 2.23 C ATOM 3180 C PHE B 89 6.359 8.775 1.355 1.00 64.01 C ATOM 3181 O PHE B 89 6.188 7.693 0.799 1.00 54.35 O ATOM 3182 CB PHE B 89 5.414 10.753 0.089 1.00 52.25 C ATOM 3183 CG PHE B 89 4.207 11.645 -0.211 1.00 52.10 C ATOM 3184 CD1 PHE B 89 4.361 12.982 -0.574 1.00 23.24 C ATOM 3185 CD2 PHE B 89 2.915 11.128 -0.157 1.00 33.21 C ATOM 3186 CE1 PHE B 89 3.264 13.772 -0.868 1.00 44.41 C ATOM 3187 CE2 PHE B 89 1.824 11.919 -0.446 1.00 13.04 C ATOM 3188 CZ PHE B 89 1.993 13.240 -0.806 1.00 60.23 C ATOM 0 H PHE B 89 5.452 11.615 2.439 1.00 0.02 H new ATOM 0 HA PHE B 89 4.287 9.333 1.258 1.00 2.23 H new ATOM 0 HB2 PHE B 89 6.289 11.386 0.234 1.00 52.25 H new ATOM 0 HB3 PHE B 89 5.613 10.129 -0.782 1.00 52.25 H new ATOM 0 HD1 PHE B 89 5.352 13.408 -0.627 1.00 23.24 H new ATOM 0 HD2 PHE B 89 2.766 10.093 0.115 1.00 33.21 H new ATOM 0 HE1 PHE B 89 3.403 14.806 -1.146 1.00 44.41 H new ATOM 0 HE2 PHE B 89 0.829 11.502 -0.390 1.00 13.04 H new ATOM 0 HZ PHE B 89 1.135 13.854 -1.038 1.00 60.23 H new ATOM 3198 N GLU B 90 7.489 9.104 2.002 1.00 61.33 N ATOM 3199 CA GLU B 90 8.620 8.171 2.198 1.00 10.42 C ATOM 3200 C GLU B 90 8.221 6.977 3.094 1.00 74.41 C ATOM 3201 O GLU B 90 8.689 5.851 2.879 1.00 24.12 O ATOM 3202 CB GLU B 90 9.827 8.919 2.808 1.00 44.33 C ATOM 3203 CG GLU B 90 10.466 9.978 1.892 1.00 33.45 C ATOM 3204 CD GLU B 90 11.152 9.389 0.640 1.00 1.22 C ATOM 3205 OE1 GLU B 90 12.045 8.526 0.799 1.00 13.44 O ATOM 3206 OE2 GLU B 90 10.851 9.821 -0.495 1.00 54.24 O ATOM 0 H GLU B 90 7.648 10.027 2.407 1.00 61.33 H new ATOM 0 HA GLU B 90 8.900 7.775 1.222 1.00 10.42 H new ATOM 0 HB2 GLU B 90 9.507 9.404 3.730 1.00 44.33 H new ATOM 0 HB3 GLU B 90 10.589 8.188 3.080 1.00 44.33 H new ATOM 0 HG2 GLU B 90 9.697 10.682 1.575 1.00 33.45 H new ATOM 0 HG3 GLU B 90 11.201 10.544 2.465 1.00 33.45 H new ATOM 3213 N LEU B 91 7.373 7.246 4.108 1.00 34.33 N ATOM 3214 CA LEU B 91 6.804 6.200 4.988 1.00 42.22 C ATOM 3215 C LEU B 91 5.846 5.279 4.194 1.00 73.41 C ATOM 3216 O LEU B 91 5.791 4.070 4.454 1.00 45.31 O ATOM 3217 CB LEU B 91 6.058 6.834 6.203 1.00 60.14 C ATOM 3218 CG LEU B 91 6.924 7.675 7.205 1.00 12.42 C ATOM 3219 CD1 LEU B 91 6.051 8.277 8.338 1.00 60.32 C ATOM 3220 CD2 LEU B 91 8.091 6.836 7.783 1.00 44.20 C ATOM 0 H LEU B 91 7.063 8.190 4.341 1.00 34.33 H new ATOM 0 HA LEU B 91 7.630 5.600 5.369 1.00 42.22 H new ATOM 0 HB2 LEU B 91 5.266 7.476 5.818 1.00 60.14 H new ATOM 0 HB3 LEU B 91 5.576 6.032 6.761 1.00 60.14 H new ATOM 0 HG LEU B 91 7.358 8.504 6.647 1.00 12.42 H new ATOM 0 HD11 LEU B 91 6.681 8.854 9.015 1.00 60.32 H new ATOM 0 HD12 LEU B 91 5.292 8.928 7.905 1.00 60.32 H new ATOM 0 HD13 LEU B 91 5.566 7.472 8.890 1.00 60.32 H new ATOM 0 HD21 LEU B 91 8.672 7.448 8.474 1.00 44.20 H new ATOM 0 HD22 LEU B 91 7.690 5.972 8.313 1.00 44.20 H new ATOM 0 HD23 LEU B 91 8.733 6.498 6.970 1.00 44.20 H new ATOM 3232 N ILE B 92 5.094 5.872 3.240 1.00 2.11 N ATOM 3233 CA ILE B 92 4.194 5.121 2.330 1.00 50.40 C ATOM 3234 C ILE B 92 5.027 4.210 1.395 1.00 62.14 C ATOM 3235 O ILE B 92 4.691 3.033 1.198 1.00 34.11 O ATOM 3236 CB ILE B 92 3.273 6.091 1.472 1.00 34.45 C ATOM 3237 CG1 ILE B 92 2.418 7.016 2.404 1.00 10.11 C ATOM 3238 CG2 ILE B 92 2.361 5.295 0.496 1.00 53.32 C ATOM 3239 CD1 ILE B 92 1.525 8.020 1.685 1.00 62.01 C ATOM 0 H ILE B 92 5.092 6.879 3.078 1.00 2.11 H new ATOM 0 HA ILE B 92 3.537 4.507 2.947 1.00 50.40 H new ATOM 0 HB ILE B 92 3.928 6.722 0.871 1.00 34.45 H new ATOM 0 HG12 ILE B 92 1.792 6.387 3.037 1.00 10.11 H new ATOM 0 HG13 ILE B 92 3.092 7.562 3.064 1.00 10.11 H new ATOM 0 HG21 ILE B 92 1.745 5.990 -0.075 1.00 53.32 H new ATOM 0 HG22 ILE B 92 2.980 4.713 -0.187 1.00 53.32 H new ATOM 0 HG23 ILE B 92 1.718 4.623 1.065 1.00 53.32 H new ATOM 0 HD11 ILE B 92 0.977 8.610 2.419 1.00 62.01 H new ATOM 0 HD12 ILE B 92 2.139 8.681 1.074 1.00 62.01 H new ATOM 0 HD13 ILE B 92 0.819 7.488 1.047 1.00 62.01 H new ATOM 3251 N LEU B 93 6.130 4.772 0.857 1.00 21.40 N ATOM 3252 CA LEU B 93 7.060 4.065 -0.054 1.00 33.33 C ATOM 3253 C LEU B 93 7.684 2.842 0.638 1.00 11.34 C ATOM 3254 O LEU B 93 7.705 1.753 0.075 1.00 61.20 O ATOM 3255 CB LEU B 93 8.191 5.023 -0.545 1.00 22.42 C ATOM 3256 CG LEU B 93 7.765 6.171 -1.519 1.00 44.34 C ATOM 3257 CD1 LEU B 93 8.951 7.131 -1.796 1.00 33.14 C ATOM 3258 CD2 LEU B 93 7.176 5.603 -2.836 1.00 43.04 C ATOM 0 H LEU B 93 6.404 5.737 1.043 1.00 21.40 H new ATOM 0 HA LEU B 93 6.484 3.726 -0.915 1.00 33.33 H new ATOM 0 HB2 LEU B 93 8.658 5.475 0.330 1.00 22.42 H new ATOM 0 HB3 LEU B 93 8.955 4.423 -1.040 1.00 22.42 H new ATOM 0 HG LEU B 93 6.978 6.747 -1.033 1.00 44.34 H new ATOM 0 HD11 LEU B 93 8.629 7.920 -2.476 1.00 33.14 H new ATOM 0 HD12 LEU B 93 9.287 7.574 -0.859 1.00 33.14 H new ATOM 0 HD13 LEU B 93 9.772 6.574 -2.249 1.00 33.14 H new ATOM 0 HD21 LEU B 93 6.890 6.426 -3.491 1.00 43.04 H new ATOM 0 HD22 LEU B 93 7.925 4.987 -3.333 1.00 43.04 H new ATOM 0 HD23 LEU B 93 6.299 4.997 -2.611 1.00 43.04 H new ATOM 3270 N ALA B 94 8.168 3.051 1.872 1.00 32.31 N ATOM 3271 CA ALA B 94 8.840 2.014 2.682 1.00 73.23 C ATOM 3272 C ALA B 94 7.863 0.909 3.121 1.00 33.31 C ATOM 3273 O ALA B 94 8.231 -0.264 3.187 1.00 4.20 O ATOM 3274 CB ALA B 94 9.494 2.662 3.905 1.00 10.32 C ATOM 0 H ALA B 94 8.105 3.953 2.344 1.00 32.31 H new ATOM 0 HA ALA B 94 9.605 1.544 2.063 1.00 73.23 H new ATOM 0 HB1 ALA B 94 9.989 1.896 4.502 1.00 10.32 H new ATOM 0 HB2 ALA B 94 10.228 3.398 3.578 1.00 10.32 H new ATOM 0 HB3 ALA B 94 8.731 3.154 4.508 1.00 10.32 H new ATOM 3280 N ALA B 95 6.619 1.310 3.421 1.00 32.14 N ATOM 3281 CA ALA B 95 5.558 0.391 3.870 1.00 23.10 C ATOM 3282 C ALA B 95 5.045 -0.492 2.713 1.00 34.45 C ATOM 3283 O ALA B 95 4.642 -1.631 2.941 1.00 1.12 O ATOM 3284 CB ALA B 95 4.412 1.184 4.499 1.00 61.25 C ATOM 0 H ALA B 95 6.318 2.283 3.360 1.00 32.14 H new ATOM 0 HA ALA B 95 5.981 -0.275 4.622 1.00 23.10 H new ATOM 0 HB1 ALA B 95 3.632 0.497 4.828 1.00 61.25 H new ATOM 0 HB2 ALA B 95 4.785 1.746 5.355 1.00 61.25 H new ATOM 0 HB3 ALA B 95 4.000 1.875 3.763 1.00 61.25 H new ATOM 3290 N ASN B 96 5.040 0.067 1.485 1.00 3.20 N ATOM 3291 CA ASN B 96 4.684 -0.669 0.243 1.00 44.32 C ATOM 3292 C ASN B 96 5.872 -1.551 -0.222 1.00 34.01 C ATOM 3293 O ASN B 96 5.677 -2.672 -0.715 1.00 1.41 O ATOM 3294 CB ASN B 96 4.267 0.356 -0.859 1.00 42.14 C ATOM 3295 CG ASN B 96 3.817 -0.267 -2.194 1.00 31.34 C ATOM 3296 OD1 ASN B 96 3.332 -1.399 -2.246 1.00 61.44 O ATOM 3297 ND2 ASN B 96 3.941 0.491 -3.281 1.00 21.14 N ATOM 0 H ASN B 96 5.283 1.044 1.321 1.00 3.20 H new ATOM 0 HA ASN B 96 3.842 -1.333 0.437 1.00 44.32 H new ATOM 0 HB2 ASN B 96 3.456 0.972 -0.472 1.00 42.14 H new ATOM 0 HB3 ASN B 96 5.109 1.021 -1.052 1.00 42.14 H new ATOM 0 HD21 ASN B 96 3.631 0.139 -4.187 1.00 21.14 H new ATOM 0 HD22 ASN B 96 4.346 1.424 -3.208 1.00 21.14 H new ATOM 3304 N TYR B 97 7.099 -1.031 -0.025 1.00 25.31 N ATOM 3305 CA TYR B 97 8.364 -1.731 -0.363 1.00 0.11 C ATOM 3306 C TYR B 97 8.541 -2.983 0.507 1.00 22.01 C ATOM 3307 O TYR B 97 9.017 -4.012 0.027 1.00 61.01 O ATOM 3308 CB TYR B 97 9.582 -0.766 -0.190 1.00 44.31 C ATOM 3309 CG TYR B 97 10.986 -1.429 -0.217 1.00 32.12 C ATOM 3310 CD1 TYR B 97 11.810 -1.426 0.916 1.00 31.14 C ATOM 3311 CD2 TYR B 97 11.469 -2.072 -1.363 1.00 51.23 C ATOM 3312 CE1 TYR B 97 13.051 -2.033 0.906 1.00 45.43 C ATOM 3313 CE2 TYR B 97 12.714 -2.678 -1.372 1.00 41.53 C ATOM 3314 CZ TYR B 97 13.500 -2.658 -0.238 1.00 72.23 C ATOM 3315 OH TYR B 97 14.738 -3.263 -0.248 1.00 43.25 O ATOM 0 H TYR B 97 7.247 -0.105 0.377 1.00 25.31 H new ATOM 0 HA TYR B 97 8.315 -2.045 -1.406 1.00 0.11 H new ATOM 0 HB2 TYR B 97 9.541 -0.016 -0.980 1.00 44.31 H new ATOM 0 HB3 TYR B 97 9.470 -0.238 0.757 1.00 44.31 H new ATOM 0 HD1 TYR B 97 11.468 -0.939 1.817 1.00 31.14 H new ATOM 0 HD2 TYR B 97 10.860 -2.096 -2.255 1.00 51.23 H new ATOM 0 HE1 TYR B 97 13.668 -2.018 1.792 1.00 45.43 H new ATOM 0 HE2 TYR B 97 13.070 -3.167 -2.267 1.00 41.53 H new ATOM 0 HH TYR B 97 14.902 -3.658 -1.130 1.00 43.25 H new ATOM 3325 N LEU B 98 8.178 -2.867 1.793 1.00 21.34 N ATOM 3326 CA LEU B 98 8.271 -3.974 2.759 1.00 1.40 C ATOM 3327 C LEU B 98 6.930 -4.724 2.900 1.00 42.03 C ATOM 3328 O LEU B 98 6.874 -5.774 3.558 1.00 40.13 O ATOM 3329 CB LEU B 98 8.781 -3.432 4.121 1.00 22.11 C ATOM 3330 CG LEU B 98 10.242 -2.872 4.114 1.00 13.33 C ATOM 3331 CD1 LEU B 98 10.684 -2.394 5.516 1.00 72.45 C ATOM 3332 CD2 LEU B 98 11.233 -3.909 3.534 1.00 45.55 C ATOM 0 H LEU B 98 7.812 -2.003 2.194 1.00 21.34 H new ATOM 0 HA LEU B 98 8.989 -4.705 2.387 1.00 1.40 H new ATOM 0 HB2 LEU B 98 8.108 -2.641 4.453 1.00 22.11 H new ATOM 0 HB3 LEU B 98 8.720 -4.233 4.858 1.00 22.11 H new ATOM 0 HG LEU B 98 10.251 -1.999 3.462 1.00 13.33 H new ATOM 0 HD11 LEU B 98 11.704 -2.013 5.466 1.00 72.45 H new ATOM 0 HD12 LEU B 98 10.017 -1.602 5.857 1.00 72.45 H new ATOM 0 HD13 LEU B 98 10.643 -3.229 6.215 1.00 72.45 H new ATOM 0 HD21 LEU B 98 12.241 -3.493 3.541 1.00 45.55 H new ATOM 0 HD22 LEU B 98 11.210 -4.814 4.141 1.00 45.55 H new ATOM 0 HD23 LEU B 98 10.948 -4.152 2.510 1.00 45.55 H new ATOM 3344 N ASP B 99 5.874 -4.171 2.270 1.00 35.13 N ATOM 3345 CA ASP B 99 4.512 -4.767 2.201 1.00 73.14 C ATOM 3346 C ASP B 99 3.938 -5.038 3.621 1.00 71.14 C ATOM 3347 O ASP B 99 3.204 -6.011 3.861 1.00 3.11 O ATOM 3348 CB ASP B 99 4.527 -6.043 1.291 1.00 10.52 C ATOM 3349 CG ASP B 99 3.127 -6.507 0.827 1.00 61.24 C ATOM 3350 OD1 ASP B 99 2.725 -7.650 1.122 1.00 0.13 O ATOM 3351 OD2 ASP B 99 2.414 -5.724 0.162 1.00 43.21 O ATOM 0 H ASP B 99 5.939 -3.278 1.782 1.00 35.13 H new ATOM 0 HA ASP B 99 3.834 -4.050 1.739 1.00 73.14 H new ATOM 0 HB2 ASP B 99 5.140 -5.842 0.413 1.00 10.52 H new ATOM 0 HB3 ASP B 99 5.006 -6.858 1.834 1.00 10.52 H new ATOM 3356 N ILE B 100 4.289 -4.129 4.563 1.00 41.21 N ATOM 3357 CA ILE B 100 3.808 -4.166 5.948 1.00 65.30 C ATOM 3358 C ILE B 100 2.390 -3.582 5.967 1.00 21.13 C ATOM 3359 O ILE B 100 2.225 -2.360 5.871 1.00 34.23 O ATOM 3360 CB ILE B 100 4.736 -3.342 6.931 1.00 71.22 C ATOM 3361 CG1 ILE B 100 6.222 -3.790 6.802 1.00 31.44 C ATOM 3362 CG2 ILE B 100 4.251 -3.478 8.398 1.00 61.11 C ATOM 3363 CD1 ILE B 100 7.209 -3.020 7.670 1.00 32.52 C ATOM 0 H ILE B 100 4.918 -3.349 4.373 1.00 41.21 H new ATOM 0 HA ILE B 100 3.820 -5.199 6.295 1.00 65.30 H new ATOM 0 HB ILE B 100 4.671 -2.292 6.647 1.00 71.22 H new ATOM 0 HG12 ILE B 100 6.289 -4.848 7.055 1.00 31.44 H new ATOM 0 HG13 ILE B 100 6.525 -3.691 5.760 1.00 31.44 H new ATOM 0 HG21 ILE B 100 4.906 -2.903 9.052 1.00 61.11 H new ATOM 0 HG22 ILE B 100 3.232 -3.100 8.481 1.00 61.11 H new ATOM 0 HG23 ILE B 100 4.274 -4.527 8.693 1.00 61.11 H new ATOM 0 HD11 ILE B 100 8.215 -3.407 7.508 1.00 32.52 H new ATOM 0 HD12 ILE B 100 7.180 -1.963 7.405 1.00 32.52 H new ATOM 0 HD13 ILE B 100 6.940 -3.138 8.720 1.00 32.52 H new ATOM 3375 N LYS B 101 1.384 -4.471 6.065 1.00 61.13 N ATOM 3376 CA LYS B 101 -0.047 -4.097 5.998 1.00 62.34 C ATOM 3377 C LYS B 101 -0.455 -3.085 7.112 1.00 55.54 C ATOM 3378 O LYS B 101 -1.069 -2.068 6.774 1.00 61.25 O ATOM 3379 CB LYS B 101 -0.973 -5.349 6.041 1.00 4.22 C ATOM 3380 CG LYS B 101 -0.611 -6.484 5.058 1.00 31.52 C ATOM 3381 CD LYS B 101 -0.571 -6.059 3.575 1.00 54.41 C ATOM 3382 CE LYS B 101 -0.297 -7.254 2.645 1.00 71.31 C ATOM 3383 NZ LYS B 101 -0.164 -6.830 1.230 1.00 2.55 N ATOM 0 H LYS B 101 1.538 -5.471 6.193 1.00 61.13 H new ATOM 0 HA LYS B 101 -0.182 -3.600 5.037 1.00 62.34 H new ATOM 0 HB2 LYS B 101 -0.961 -5.753 7.053 1.00 4.22 H new ATOM 0 HB3 LYS B 101 -1.995 -5.029 5.838 1.00 4.22 H new ATOM 0 HG2 LYS B 101 0.363 -6.889 5.333 1.00 31.52 H new ATOM 0 HG3 LYS B 101 -1.335 -7.291 5.172 1.00 31.52 H new ATOM 0 HD2 LYS B 101 -1.520 -5.597 3.304 1.00 54.41 H new ATOM 0 HD3 LYS B 101 0.202 -5.304 3.434 1.00 54.41 H new ATOM 0 HE2 LYS B 101 0.616 -7.759 2.961 1.00 71.31 H new ATOM 0 HE3 LYS B 101 -1.108 -7.977 2.733 1.00 71.31 H new ATOM 0 HZ1 LYS B 101 0.120 -7.644 0.649 1.00 2.55 H new ATOM 0 HZ2 LYS B 101 -1.076 -6.463 0.890 1.00 2.55 H new ATOM 0 HZ3 LYS B 101 0.557 -6.084 1.157 1.00 2.55 H new ATOM 3397 N PRO B 102 -0.116 -3.313 8.452 1.00 12.24 N ATOM 3398 CA PRO B 102 -0.471 -2.347 9.528 1.00 45.30 C ATOM 3399 C PRO B 102 0.109 -0.939 9.278 1.00 72.22 C ATOM 3400 O PRO B 102 -0.621 0.049 9.337 1.00 63.44 O ATOM 3401 CB PRO B 102 0.121 -2.981 10.822 1.00 31.34 C ATOM 3402 CG PRO B 102 1.115 -4.000 10.350 1.00 20.24 C ATOM 3403 CD PRO B 102 0.588 -4.503 9.028 1.00 73.12 C ATOM 0 HA PRO B 102 -1.548 -2.192 9.587 1.00 45.30 H new ATOM 0 HB2 PRO B 102 0.599 -2.226 11.446 1.00 31.34 H new ATOM 0 HB3 PRO B 102 -0.660 -3.444 11.425 1.00 31.34 H new ATOM 0 HG2 PRO B 102 2.104 -3.557 10.234 1.00 20.24 H new ATOM 0 HG3 PRO B 102 1.212 -4.814 11.068 1.00 20.24 H new ATOM 0 HD2 PRO B 102 1.394 -4.844 8.379 1.00 73.12 H new ATOM 0 HD3 PRO B 102 -0.092 -5.345 9.162 1.00 73.12 H new ATOM 3411 N LEU B 103 1.418 -0.870 8.952 1.00 24.24 N ATOM 3412 CA LEU B 103 2.124 0.408 8.736 1.00 64.01 C ATOM 3413 C LEU B 103 1.539 1.173 7.537 1.00 73.54 C ATOM 3414 O LEU B 103 1.255 2.368 7.634 1.00 75.11 O ATOM 3415 CB LEU B 103 3.644 0.169 8.528 1.00 10.42 C ATOM 3416 CG LEU B 103 4.517 1.447 8.292 1.00 53.04 C ATOM 3417 CD1 LEU B 103 4.385 2.450 9.458 1.00 24.12 C ATOM 3418 CD2 LEU B 103 5.994 1.075 8.026 1.00 63.22 C ATOM 0 H LEU B 103 2.009 -1.692 8.832 1.00 24.24 H new ATOM 0 HA LEU B 103 1.984 1.016 9.630 1.00 64.01 H new ATOM 0 HB2 LEU B 103 4.032 -0.354 9.402 1.00 10.42 H new ATOM 0 HB3 LEU B 103 3.773 -0.497 7.675 1.00 10.42 H new ATOM 0 HG LEU B 103 4.137 1.943 7.399 1.00 53.04 H new ATOM 0 HD11 LEU B 103 5.005 3.324 9.258 1.00 24.12 H new ATOM 0 HD12 LEU B 103 3.344 2.759 9.556 1.00 24.12 H new ATOM 0 HD13 LEU B 103 4.712 1.977 10.384 1.00 24.12 H new ATOM 0 HD21 LEU B 103 6.575 1.983 7.866 1.00 63.22 H new ATOM 0 HD22 LEU B 103 6.394 0.535 8.885 1.00 63.22 H new ATOM 0 HD23 LEU B 103 6.056 0.444 7.140 1.00 63.22 H new ATOM 3430 N LEU B 104 1.349 0.452 6.422 1.00 32.33 N ATOM 3431 CA LEU B 104 0.853 1.029 5.159 1.00 54.33 C ATOM 3432 C LEU B 104 -0.566 1.586 5.341 1.00 12.25 C ATOM 3433 O LEU B 104 -0.869 2.691 4.883 1.00 32.12 O ATOM 3434 CB LEU B 104 0.896 -0.032 4.025 1.00 32.41 C ATOM 3435 CG LEU B 104 0.488 0.450 2.593 1.00 2.45 C ATOM 3436 CD1 LEU B 104 1.391 1.608 2.095 1.00 45.05 C ATOM 3437 CD2 LEU B 104 0.494 -0.740 1.598 1.00 71.41 C ATOM 0 H LEU B 104 1.535 -0.550 6.368 1.00 32.33 H new ATOM 0 HA LEU B 104 1.504 1.856 4.874 1.00 54.33 H new ATOM 0 HB2 LEU B 104 1.908 -0.433 3.973 1.00 32.41 H new ATOM 0 HB3 LEU B 104 0.240 -0.856 4.306 1.00 32.41 H new ATOM 0 HG LEU B 104 -0.527 0.843 2.650 1.00 2.45 H new ATOM 0 HD11 LEU B 104 1.075 1.913 1.098 1.00 45.05 H new ATOM 0 HD12 LEU B 104 1.307 2.454 2.777 1.00 45.05 H new ATOM 0 HD13 LEU B 104 2.427 1.272 2.060 1.00 45.05 H new ATOM 0 HD21 LEU B 104 0.208 -0.387 0.607 1.00 71.41 H new ATOM 0 HD22 LEU B 104 1.493 -1.173 1.555 1.00 71.41 H new ATOM 0 HD23 LEU B 104 -0.215 -1.497 1.932 1.00 71.41 H new ATOM 3449 N ASP B 105 -1.406 0.823 6.061 1.00 14.31 N ATOM 3450 CA ASP B 105 -2.817 1.175 6.284 1.00 23.25 C ATOM 3451 C ASP B 105 -2.928 2.426 7.178 1.00 51.23 C ATOM 3452 O ASP B 105 -3.638 3.368 6.836 1.00 55.33 O ATOM 3453 CB ASP B 105 -3.595 -0.011 6.904 1.00 55.21 C ATOM 3454 CG ASP B 105 -5.110 0.260 7.006 1.00 63.24 C ATOM 3455 OD1 ASP B 105 -5.809 0.161 5.971 1.00 15.05 O ATOM 3456 OD2 ASP B 105 -5.604 0.631 8.098 1.00 24.41 O ATOM 0 H ASP B 105 -1.126 -0.052 6.503 1.00 14.31 H new ATOM 0 HA ASP B 105 -3.266 1.401 5.317 1.00 23.25 H new ATOM 0 HB2 ASP B 105 -3.429 -0.904 6.301 1.00 55.21 H new ATOM 0 HB3 ASP B 105 -3.200 -0.220 7.898 1.00 55.21 H new ATOM 3461 N VAL B 106 -2.201 2.421 8.314 1.00 3.42 N ATOM 3462 CA VAL B 106 -2.191 3.545 9.278 1.00 42.43 C ATOM 3463 C VAL B 106 -1.713 4.852 8.607 1.00 22.54 C ATOM 3464 O VAL B 106 -2.343 5.896 8.771 1.00 13.13 O ATOM 3465 CB VAL B 106 -1.299 3.220 10.545 1.00 43.45 C ATOM 3466 CG1 VAL B 106 -1.082 4.460 11.464 1.00 34.52 C ATOM 3467 CG2 VAL B 106 -1.907 2.050 11.356 1.00 61.01 C ATOM 0 H VAL B 106 -1.605 1.641 8.590 1.00 3.42 H new ATOM 0 HA VAL B 106 -3.218 3.685 9.616 1.00 42.43 H new ATOM 0 HB VAL B 106 -0.319 2.926 10.169 1.00 43.45 H new ATOM 0 HG11 VAL B 106 -0.464 4.178 12.316 1.00 34.52 H new ATOM 0 HG12 VAL B 106 -0.584 5.248 10.900 1.00 34.52 H new ATOM 0 HG13 VAL B 106 -2.046 4.822 11.820 1.00 34.52 H new ATOM 0 HG21 VAL B 106 -1.279 1.843 12.222 1.00 61.01 H new ATOM 0 HG22 VAL B 106 -2.908 2.321 11.690 1.00 61.01 H new ATOM 0 HG23 VAL B 106 -1.962 1.161 10.727 1.00 61.01 H new ATOM 3477 N THR B 107 -0.621 4.768 7.828 1.00 61.44 N ATOM 3478 CA THR B 107 -0.023 5.938 7.148 1.00 45.01 C ATOM 3479 C THR B 107 -0.960 6.489 6.034 1.00 10.42 C ATOM 3480 O THR B 107 -1.049 7.711 5.830 1.00 12.53 O ATOM 3481 CB THR B 107 1.392 5.575 6.577 1.00 22.55 C ATOM 3482 OG1 THR B 107 2.195 5.011 7.628 1.00 42.55 O ATOM 3483 CG2 THR B 107 2.135 6.794 6.008 1.00 50.12 C ATOM 0 H THR B 107 -0.127 3.893 7.650 1.00 61.44 H new ATOM 0 HA THR B 107 0.101 6.732 7.885 1.00 45.01 H new ATOM 0 HB THR B 107 1.235 4.866 5.764 1.00 22.55 H new ATOM 0 HG1 THR B 107 1.976 4.062 7.733 1.00 42.55 H new ATOM 0 HG21 THR B 107 3.108 6.482 5.627 1.00 50.12 H new ATOM 0 HG22 THR B 107 1.551 7.230 5.198 1.00 50.12 H new ATOM 0 HG23 THR B 107 2.274 7.535 6.795 1.00 50.12 H new ATOM 3491 N CYS B 108 -1.672 5.578 5.340 1.00 61.14 N ATOM 3492 CA CYS B 108 -2.678 5.950 4.318 1.00 13.53 C ATOM 3493 C CYS B 108 -3.946 6.533 4.982 1.00 22.10 C ATOM 3494 O CYS B 108 -4.633 7.379 4.402 1.00 3.24 O ATOM 3495 CB CYS B 108 -3.039 4.729 3.436 1.00 64.52 C ATOM 3496 SG CYS B 108 -1.651 4.082 2.475 1.00 73.32 S ATOM 0 H CYS B 108 -1.569 4.571 5.469 1.00 61.14 H new ATOM 0 HA CYS B 108 -2.243 6.719 3.679 1.00 13.53 H new ATOM 0 HB2 CYS B 108 -3.428 3.935 4.074 1.00 64.52 H new ATOM 0 HB3 CYS B 108 -3.841 5.011 2.753 1.00 64.52 H new ATOM 0 HG CYS B 108 -0.890 3.361 3.244 1.00 73.32 H new ATOM 3502 N LYS B 109 -4.252 6.068 6.202 1.00 21.14 N ATOM 3503 CA LYS B 109 -5.389 6.577 6.996 1.00 40.43 C ATOM 3504 C LYS B 109 -5.056 7.953 7.598 1.00 23.34 C ATOM 3505 O LYS B 109 -5.956 8.766 7.769 1.00 41.30 O ATOM 3506 CB LYS B 109 -5.834 5.545 8.092 1.00 0.45 C ATOM 3507 CG LYS B 109 -7.008 4.610 7.677 1.00 12.25 C ATOM 3508 CD LYS B 109 -6.761 3.871 6.344 1.00 41.14 C ATOM 3509 CE LYS B 109 -7.916 2.935 5.955 1.00 63.04 C ATOM 3510 NZ LYS B 109 -8.102 1.831 6.936 1.00 74.23 N ATOM 0 H LYS B 109 -3.723 5.331 6.668 1.00 21.14 H new ATOM 0 HA LYS B 109 -6.240 6.707 6.327 1.00 40.43 H new ATOM 0 HB2 LYS B 109 -4.976 4.929 8.359 1.00 0.45 H new ATOM 0 HB3 LYS B 109 -6.125 6.093 8.989 1.00 0.45 H new ATOM 0 HG2 LYS B 109 -7.174 3.876 8.465 1.00 12.25 H new ATOM 0 HG3 LYS B 109 -7.921 5.200 7.593 1.00 12.25 H new ATOM 0 HD2 LYS B 109 -6.611 4.604 5.551 1.00 41.14 H new ATOM 0 HD3 LYS B 109 -5.841 3.292 6.421 1.00 41.14 H new ATOM 0 HE2 LYS B 109 -8.838 3.511 5.880 1.00 63.04 H new ATOM 0 HE3 LYS B 109 -7.723 2.513 4.969 1.00 63.04 H new ATOM 0 HZ1 LYS B 109 -8.282 0.942 6.428 1.00 74.23 H new ATOM 0 HZ2 LYS B 109 -7.243 1.732 7.514 1.00 74.23 H new ATOM 0 HZ3 LYS B 109 -8.911 2.047 7.553 1.00 74.23 H new ATOM 3524 N THR B 110 -3.765 8.203 7.904 1.00 32.33 N ATOM 3525 CA THR B 110 -3.299 9.491 8.463 1.00 3.52 C ATOM 3526 C THR B 110 -3.668 10.653 7.521 1.00 22.40 C ATOM 3527 O THR B 110 -4.339 11.617 7.930 1.00 11.43 O ATOM 3528 CB THR B 110 -1.753 9.479 8.718 1.00 12.21 C ATOM 3529 OG1 THR B 110 -1.430 8.436 9.647 1.00 0.44 O ATOM 3530 CG2 THR B 110 -1.231 10.828 9.266 1.00 12.13 C ATOM 0 H THR B 110 -3.019 7.521 7.771 1.00 32.33 H new ATOM 0 HA THR B 110 -3.800 9.635 9.421 1.00 3.52 H new ATOM 0 HB THR B 110 -1.268 9.305 7.757 1.00 12.21 H new ATOM 0 HG1 THR B 110 -1.736 7.575 9.292 1.00 0.44 H new ATOM 0 HG21 THR B 110 -0.154 10.764 9.425 1.00 12.13 H new ATOM 0 HG22 THR B 110 -1.446 11.620 8.548 1.00 12.13 H new ATOM 0 HG23 THR B 110 -1.724 11.052 10.212 1.00 12.13 H new ATOM 3538 N VAL B 111 -3.264 10.516 6.242 1.00 20.10 N ATOM 3539 CA VAL B 111 -3.568 11.508 5.195 1.00 54.33 C ATOM 3540 C VAL B 111 -5.082 11.582 4.924 1.00 51.13 C ATOM 3541 O VAL B 111 -5.612 12.672 4.690 1.00 63.10 O ATOM 3542 CB VAL B 111 -2.775 11.228 3.865 1.00 73.02 C ATOM 3543 CG1 VAL B 111 -1.267 11.494 4.049 1.00 52.12 C ATOM 3544 CG2 VAL B 111 -3.020 9.795 3.334 1.00 1.31 C ATOM 0 H VAL B 111 -2.721 9.719 5.909 1.00 20.10 H new ATOM 0 HA VAL B 111 -3.239 12.477 5.570 1.00 54.33 H new ATOM 0 HB VAL B 111 -3.156 11.922 3.116 1.00 73.02 H new ATOM 0 HG11 VAL B 111 -0.745 11.292 3.114 1.00 52.12 H new ATOM 0 HG12 VAL B 111 -1.113 12.535 4.333 1.00 52.12 H new ATOM 0 HG13 VAL B 111 -0.875 10.843 4.831 1.00 52.12 H new ATOM 0 HG21 VAL B 111 -2.453 9.646 2.415 1.00 1.31 H new ATOM 0 HG22 VAL B 111 -2.697 9.070 4.081 1.00 1.31 H new ATOM 0 HG23 VAL B 111 -4.082 9.659 3.131 1.00 1.31 H new ATOM 3554 N ALA B 112 -5.767 10.422 5.011 1.00 43.35 N ATOM 3555 CA ALA B 112 -7.226 10.320 4.812 1.00 34.23 C ATOM 3556 C ALA B 112 -8.001 11.137 5.868 1.00 55.02 C ATOM 3557 O ALA B 112 -8.986 11.807 5.545 1.00 63.25 O ATOM 3558 CB ALA B 112 -7.659 8.850 4.835 1.00 63.33 C ATOM 0 H ALA B 112 -5.322 9.529 5.222 1.00 43.35 H new ATOM 0 HA ALA B 112 -7.465 10.742 3.836 1.00 34.23 H new ATOM 0 HB1 ALA B 112 -8.737 8.786 4.687 1.00 63.33 H new ATOM 0 HB2 ALA B 112 -7.151 8.308 4.037 1.00 63.33 H new ATOM 0 HB3 ALA B 112 -7.398 8.409 5.797 1.00 63.33 H new ATOM 3564 N ASN B 113 -7.526 11.089 7.127 1.00 13.33 N ATOM 3565 CA ASN B 113 -8.150 11.830 8.249 1.00 51.01 C ATOM 3566 C ASN B 113 -7.931 13.344 8.095 1.00 1.34 C ATOM 3567 O ASN B 113 -8.826 14.128 8.406 1.00 21.25 O ATOM 3568 CB ASN B 113 -7.610 11.358 9.639 1.00 32.02 C ATOM 3569 CG ASN B 113 -8.220 10.030 10.124 1.00 72.23 C ATOM 3570 OD1 ASN B 113 -9.337 10.007 10.634 1.00 34.45 O ATOM 3571 ND2 ASN B 113 -7.478 8.940 10.043 1.00 42.34 N ATOM 0 H ASN B 113 -6.708 10.543 7.397 1.00 13.33 H new ATOM 0 HA ASN B 113 -9.218 11.615 8.212 1.00 51.01 H new ATOM 0 HB2 ASN B 113 -6.527 11.249 9.580 1.00 32.02 H new ATOM 0 HB3 ASN B 113 -7.813 12.132 10.379 1.00 32.02 H new ATOM 0 HD21 ASN B 113 -7.830 8.055 10.408 1.00 42.34 H new ATOM 0 HD22 ASN B 113 -6.553 8.983 9.615 1.00 42.34 H new ATOM 3578 N MET B 114 -6.736 13.737 7.611 1.00 3.31 N ATOM 3579 CA MET B 114 -6.360 15.159 7.468 1.00 15.41 C ATOM 3580 C MET B 114 -7.164 15.852 6.347 1.00 12.21 C ATOM 3581 O MET B 114 -7.607 16.992 6.518 1.00 42.01 O ATOM 3582 CB MET B 114 -4.825 15.313 7.235 1.00 30.44 C ATOM 3583 CG MET B 114 -3.956 14.876 8.427 1.00 30.33 C ATOM 3584 SD MET B 114 -2.203 15.298 8.242 1.00 2.23 S ATOM 3585 CE MET B 114 -1.732 14.417 6.746 1.00 13.34 C ATOM 0 H MET B 114 -6.011 13.086 7.311 1.00 3.31 H new ATOM 0 HA MET B 114 -6.611 15.658 8.404 1.00 15.41 H new ATOM 0 HB2 MET B 114 -4.542 14.728 6.360 1.00 30.44 H new ATOM 0 HB3 MET B 114 -4.607 16.356 7.005 1.00 30.44 H new ATOM 0 HG2 MET B 114 -4.339 15.342 9.335 1.00 30.33 H new ATOM 0 HG3 MET B 114 -4.050 13.798 8.558 1.00 30.33 H new ATOM 0 HE1 MET B 114 -0.711 14.684 6.473 1.00 13.34 H new ATOM 0 HE2 MET B 114 -1.792 13.343 6.922 1.00 13.34 H new ATOM 0 HE3 MET B 114 -2.407 14.690 5.935 1.00 13.34 H new ATOM 3595 N ILE B 115 -7.366 15.152 5.211 1.00 74.32 N ATOM 3596 CA ILE B 115 -8.069 15.723 4.027 1.00 63.42 C ATOM 3597 C ILE B 115 -9.605 15.728 4.209 1.00 40.11 C ATOM 3598 O ILE B 115 -10.302 16.585 3.650 1.00 32.23 O ATOM 3599 CB ILE B 115 -7.679 14.970 2.698 1.00 12.12 C ATOM 3600 CG1 ILE B 115 -8.078 13.455 2.778 1.00 61.32 C ATOM 3601 CG2 ILE B 115 -6.168 15.151 2.401 1.00 32.53 C ATOM 3602 CD1 ILE B 115 -7.748 12.613 1.561 1.00 31.35 C ATOM 0 H ILE B 115 -7.055 14.189 5.082 1.00 74.32 H new ATOM 0 HA ILE B 115 -7.738 16.758 3.944 1.00 63.42 H new ATOM 0 HB ILE B 115 -8.236 15.408 1.870 1.00 12.12 H new ATOM 0 HG12 ILE B 115 -7.583 13.015 3.644 1.00 61.32 H new ATOM 0 HG13 ILE B 115 -9.151 13.392 2.958 1.00 61.32 H new ATOM 0 HG21 ILE B 115 -5.913 14.626 1.481 1.00 32.53 H new ATOM 0 HG22 ILE B 115 -5.944 16.212 2.288 1.00 32.53 H new ATOM 0 HG23 ILE B 115 -5.584 14.743 3.226 1.00 32.53 H new ATOM 0 HD11 ILE B 115 -8.069 11.586 1.731 1.00 31.35 H new ATOM 0 HD12 ILE B 115 -8.265 13.015 0.689 1.00 31.35 H new ATOM 0 HD13 ILE B 115 -6.672 12.632 1.386 1.00 31.35 H new ATOM 3614 N ARG B 116 -10.120 14.760 4.989 1.00 32.13 N ATOM 3615 CA ARG B 116 -11.564 14.643 5.295 1.00 1.42 C ATOM 3616 C ARG B 116 -11.935 15.413 6.576 1.00 1.11 C ATOM 3617 O ARG B 116 -13.121 15.672 6.825 1.00 62.41 O ATOM 3618 CB ARG B 116 -11.954 13.147 5.443 1.00 61.14 C ATOM 3619 CG ARG B 116 -11.898 12.337 4.128 1.00 4.11 C ATOM 3620 CD ARG B 116 -12.253 10.844 4.325 1.00 71.02 C ATOM 3621 NE ARG B 116 -12.394 10.127 3.041 1.00 41.25 N ATOM 3622 CZ ARG B 116 -13.554 9.853 2.435 1.00 20.04 C ATOM 3623 NH1 ARG B 116 -14.715 10.240 2.945 1.00 63.45 N ATOM 3624 NH2 ARG B 116 -13.537 9.160 1.321 1.00 63.10 N ATOM 0 H ARG B 116 -9.550 14.036 5.426 1.00 32.13 H new ATOM 0 HA ARG B 116 -12.119 15.084 4.467 1.00 1.42 H new ATOM 0 HB2 ARG B 116 -11.289 12.681 6.170 1.00 61.14 H new ATOM 0 HB3 ARG B 116 -12.963 13.086 5.850 1.00 61.14 H new ATOM 0 HG2 ARG B 116 -12.587 12.777 3.407 1.00 4.11 H new ATOM 0 HG3 ARG B 116 -10.898 12.414 3.702 1.00 4.11 H new ATOM 0 HD2 ARG B 116 -11.478 10.364 4.923 1.00 71.02 H new ATOM 0 HD3 ARG B 116 -13.184 10.765 4.887 1.00 71.02 H new ATOM 0 HE ARG B 116 -11.539 9.816 2.580 1.00 41.25 H new ATOM 0 HH11 ARG B 116 -14.739 10.761 3.822 1.00 63.45 H new ATOM 0 HH12 ARG B 116 -15.585 10.017 2.461 1.00 63.45 H new ATOM 0 HH21 ARG B 116 -12.650 8.841 0.933 1.00 63.10 H new ATOM 0 HH22 ARG B 116 -14.411 8.941 0.843 1.00 63.10 H new ATOM 3638 N GLY B 117 -10.921 15.738 7.395 1.00 20.34 N ATOM 3639 CA GLY B 117 -11.122 16.441 8.661 1.00 22.44 C ATOM 3640 C GLY B 117 -10.774 17.921 8.536 1.00 34.53 C ATOM 3641 O GLY B 117 -11.676 18.739 8.269 1.00 4.44 O ATOM 3642 OXT GLY B 117 -9.578 18.269 8.658 1.00 37.81 O ATOM 0 H GLY B 117 -9.945 15.519 7.194 1.00 20.34 H new ATOM 0 HA2 GLY B 117 -12.160 16.335 8.977 1.00 22.44 H new ATOM 0 HA3 GLY B 117 -10.505 15.984 9.435 1.00 22.44 H new TER 3646 GLY B 117