USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=65 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: A 101 LYS NZ :NH3+ -175:sc= 1.13 (180deg=0.143) USER MOD Set 1.2: B 96 ASN : amide:sc= -1.58! K(o=-0.45!,f=-2.7) USER MOD Set 2.1: B 81 CYS SG : rot -115:sc= 0.942 USER MOD Set 2.2: B 110 THR OG1 : rot 64:sc= 1.92 USER MOD Set 3.1: B 62 HIS : no HD1:sc= -1.69 X(o=-1.9,f=-1.6) USER MOD Set 3.2: B 63 GLN : amide:sc= -0.179 X(o=-1.9,f=-1.6) USER MOD Set 4.1: B 12 LYS NZ :NH3+ -168:sc= 0.919 (180deg=0.832) USER MOD Set 4.2: B 48 SER OG : rot 110:sc= 0 USER MOD Set 5.1: B 28 LYS NZ :NH3+ -123:sc= 1.71 (180deg=0.363) USER MOD Set 5.2: B 29 ASN : amide:sc= 0.112 K(o=1.8,f=-3.4) USER MOD Set 6.1: A 96 ASN : amide:sc= -1.6! K(o=-0.67!,f=-4.1) USER MOD Set 6.2: B 101 LYS NZ :NH3+ 180:sc= 0.931 (180deg=-0.065) USER MOD Set 7.1: A 81 CYS SG : rot -116:sc= 0.952 USER MOD Set 7.2: A 110 THR OG1 : rot 64:sc= 1.91 USER MOD Set 8.1: A 62 HIS : no HD1:sc= -1.68 X(o=-1.8,f=-1.8) USER MOD Set 8.2: A 63 GLN : amide:sc= -0.154 X(o=-1.8,f=-1.9) USER MOD Set 9.1: A 28 LYS NZ :NH3+ -122:sc= 1.68 (180deg=0.29) USER MOD Set 9.2: A 29 ASN : amide:sc= 0.229 K(o=1.9,f=-3.9) USER MOD Set10.1: A 12 LYS NZ :NH3+ -171:sc= 0.82 (180deg=0.766) USER MOD Set10.2: A 48 SER OG : rot 100:sc= 0 USER MOD Single : A 2 SER OG : rot 36:sc= 0.117 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot -100:sc= 0.00011 USER MOD Single : A 9 SER OG : rot -146:sc= -0.103 USER MOD Single : A 18 LYS NZ :NH3+ 173:sc= -0.0395 (180deg=-0.0512) USER MOD Single : A 22 CYS SG : rot 51:sc= 0.845 USER MOD Single : A 23 MET CE :methyl -136:sc= -0.155 (180deg=-0.919) USER MOD Single : A 24 SER OG : rot 15:sc= 0.0243 USER MOD Single : A 26 THR OG1 : rot 175:sc= 0.422 USER MOD Single : A 30 MET CE :methyl 164:sc= 0 (180deg=-0.438) USER MOD Single : A 37 SER OG : rot 180:sc= -1.32 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 47 THR OG1 : rot 180:sc= -0.117 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0223) USER MOD Single : A 57 TYR OH : rot 180:sc= -1.33 USER MOD Single : A 58 CYS SG : rot 76:sc= -3.8! USER MOD Single : A 60 HIS : no HE2:sc= -0.126 X(o=-0.13,f=-0.34) USER MOD Single : A 61 HIS : +bothHN:sc= 1.02 K(o=1,f=-5.2!) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot -114:sc= 0.327 USER MOD Single : A 82 LYS NZ :NH3+ 160:sc= 0.524 (180deg=0.00706) USER MOD Single : A 85 GLN : amide:sc= -0.615 K(o=-0.62,f=-1.3!) USER MOD Single : A 87 THR OG1 : rot -160:sc= -1.06 USER MOD Single : A 97 TYR OH : rot 180:sc= -0.322 USER MOD Single : A 107 THR OG1 : rot 85:sc= 1.02 USER MOD Single : A 108 CYS SG : rot 82:sc= 0.725 USER MOD Single : A 109 LYS NZ :NH3+ 175:sc= 0.375 (180deg=0.256) USER MOD Single : A 113 ASN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 114 MET CE :methyl 158:sc= -1.8 (180deg=-2.43!) USER MOD Single : B 2 SER OG : rot 25:sc= 0.147 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot -100:sc= -0.0108 USER MOD Single : B 9 SER OG : rot -145:sc= -0.0824 USER MOD Single : B 18 LYS NZ :NH3+ 166:sc= -0.0648 (180deg=-0.15) USER MOD Single : B 22 CYS SG : rot 60:sc= 0.785 USER MOD Single : B 23 MET CE :methyl -139:sc= -0.165 (180deg=-1.03) USER MOD Single : B 24 SER OG : rot 16:sc= 0.0972 USER MOD Single : B 26 THR OG1 : rot 176:sc= 0.496 USER MOD Single : B 30 MET CE :methyl 161:sc= 0 (180deg=-0.562) USER MOD Single : B 37 SER OG : rot 180:sc= -1.22 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=-0.0019) USER MOD Single : B 47 THR OG1 : rot 180:sc= -0.0907 USER MOD Single : B 49 THR OG1 : rot 180:sc= 0 USER MOD Single : B 53 LYS NZ :NH3+ 174:sc= -0.0011 (180deg=-0.0699) USER MOD Single : B 57 TYR OH : rot 180:sc= -1.34 USER MOD Single : B 58 CYS SG : rot 73:sc= -3.65! USER MOD Single : B 60 HIS : no HE2:sc= -0.0594 X(o=-0.059,f=-0.46) USER MOD Single : B 61 HIS : +bothHN:sc= 1.15 K(o=1.2,f=-5.6!) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 SER OG : rot 180:sc= 0 USER MOD Single : B 76 TYR OH : rot -112:sc= 0.365 USER MOD Single : B 82 LYS NZ :NH3+ 156:sc= 0.711 (180deg=0.0227) USER MOD Single : B 85 GLN : amide:sc= -0.574 K(o=-0.57,f=-1.6!) USER MOD Single : B 87 THR OG1 : rot -171:sc= -0.753 USER MOD Single : B 97 TYR OH : rot 180:sc= -0.405 USER MOD Single : B 107 THR OG1 : rot 84:sc= 1.03 USER MOD Single : B 108 CYS SG : rot 82:sc= 0.75 USER MOD Single : B 109 LYS NZ :NH3+ 171:sc= 0.396 (180deg=0.321) USER MOD Single : B 113 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : B 114 MET CE :methyl 154:sc= -1.73 (180deg=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -14.682 -15.263 -15.993 1.00 50.32 N ATOM 2 CA SER A 2 -15.996 -14.741 -15.569 1.00 41.42 C ATOM 3 C SER A 2 -15.857 -13.340 -14.945 1.00 34.22 C ATOM 4 O SER A 2 -14.822 -13.018 -14.338 1.00 54.22 O ATOM 5 CB SER A 2 -16.658 -15.722 -14.578 1.00 50.25 C ATOM 6 OG SER A 2 -16.758 -17.023 -15.143 1.00 73.42 O ATOM 0 HA SER A 2 -16.634 -14.649 -16.448 1.00 41.42 H new ATOM 0 HB2 SER A 2 -16.075 -15.764 -13.658 1.00 50.25 H new ATOM 0 HB3 SER A 2 -17.651 -15.360 -14.310 1.00 50.25 H new ATOM 0 HG SER A 2 -15.974 -17.197 -15.705 1.00 73.42 H new ATOM 14 N LEU A 3 -16.911 -12.511 -15.106 1.00 13.32 N ATOM 15 CA LEU A 3 -16.961 -11.152 -14.531 1.00 52.35 C ATOM 16 C LEU A 3 -17.396 -11.211 -13.057 1.00 2.44 C ATOM 17 O LEU A 3 -18.508 -11.665 -12.754 1.00 2.41 O ATOM 18 CB LEU A 3 -17.950 -10.257 -15.332 1.00 11.22 C ATOM 19 CG LEU A 3 -17.646 -10.082 -16.853 1.00 40.42 C ATOM 20 CD1 LEU A 3 -18.736 -9.239 -17.549 1.00 3.12 C ATOM 21 CD2 LEU A 3 -16.238 -9.480 -17.071 1.00 44.43 C ATOM 0 H LEU A 3 -17.746 -12.764 -15.635 1.00 13.32 H new ATOM 0 HA LEU A 3 -15.963 -10.719 -14.592 1.00 52.35 H new ATOM 0 HB2 LEU A 3 -18.951 -10.676 -15.229 1.00 11.22 H new ATOM 0 HB3 LEU A 3 -17.969 -9.270 -14.871 1.00 11.22 H new ATOM 0 HG LEU A 3 -17.657 -11.070 -17.312 1.00 40.42 H new ATOM 0 HD11 LEU A 3 -18.495 -9.135 -18.607 1.00 3.12 H new ATOM 0 HD12 LEU A 3 -19.701 -9.734 -17.443 1.00 3.12 H new ATOM 0 HD13 LEU A 3 -18.782 -8.252 -17.089 1.00 3.12 H new ATOM 0 HD21 LEU A 3 -16.051 -9.368 -18.139 1.00 44.43 H new ATOM 0 HD22 LEU A 3 -16.181 -8.504 -16.589 1.00 44.43 H new ATOM 0 HD23 LEU A 3 -15.488 -10.143 -16.639 1.00 44.43 H new ATOM 33 N VAL A 4 -16.513 -10.766 -12.148 1.00 3.04 N ATOM 34 CA VAL A 4 -16.852 -10.562 -10.732 1.00 72.52 C ATOM 35 C VAL A 4 -17.470 -9.159 -10.564 1.00 23.22 C ATOM 36 O VAL A 4 -16.869 -8.138 -10.926 1.00 13.34 O ATOM 37 CB VAL A 4 -15.619 -10.778 -9.765 1.00 64.22 C ATOM 38 CG1 VAL A 4 -15.208 -12.271 -9.735 1.00 1.22 C ATOM 39 CG2 VAL A 4 -14.414 -9.878 -10.146 1.00 5.43 C ATOM 0 H VAL A 4 -15.545 -10.538 -12.375 1.00 3.04 H new ATOM 0 HA VAL A 4 -17.580 -11.320 -10.442 1.00 72.52 H new ATOM 0 HB VAL A 4 -15.933 -10.482 -8.764 1.00 64.22 H new ATOM 0 HG11 VAL A 4 -14.358 -12.401 -9.065 1.00 1.22 H new ATOM 0 HG12 VAL A 4 -16.045 -12.872 -9.380 1.00 1.22 H new ATOM 0 HG13 VAL A 4 -14.931 -12.592 -10.739 1.00 1.22 H new ATOM 0 HG21 VAL A 4 -13.591 -10.060 -9.455 1.00 5.43 H new ATOM 0 HG22 VAL A 4 -14.093 -10.110 -11.162 1.00 5.43 H new ATOM 0 HG23 VAL A 4 -14.710 -8.830 -10.089 1.00 5.43 H new ATOM 49 N LYS A 5 -18.705 -9.144 -10.063 1.00 51.33 N ATOM 50 CA LYS A 5 -19.503 -7.930 -9.896 1.00 52.30 C ATOM 51 C LYS A 5 -19.124 -7.267 -8.568 1.00 40.24 C ATOM 52 O LYS A 5 -19.196 -7.904 -7.516 1.00 41.22 O ATOM 53 CB LYS A 5 -21.002 -8.305 -9.934 1.00 65.44 C ATOM 54 CG LYS A 5 -21.412 -9.117 -11.184 1.00 15.33 C ATOM 55 CD LYS A 5 -22.901 -9.527 -11.179 1.00 15.23 C ATOM 56 CE LYS A 5 -23.274 -10.380 -12.404 1.00 21.22 C ATOM 57 NZ LYS A 5 -24.694 -10.802 -12.377 1.00 21.44 N ATOM 0 H LYS A 5 -19.187 -9.989 -9.757 1.00 51.33 H new ATOM 0 HA LYS A 5 -19.308 -7.222 -10.701 1.00 52.30 H new ATOM 0 HB2 LYS A 5 -21.245 -8.882 -9.042 1.00 65.44 H new ATOM 0 HB3 LYS A 5 -21.596 -7.392 -9.895 1.00 65.44 H new ATOM 0 HG2 LYS A 5 -21.207 -8.526 -12.077 1.00 15.33 H new ATOM 0 HG3 LYS A 5 -20.795 -10.013 -11.246 1.00 15.33 H new ATOM 0 HD2 LYS A 5 -23.119 -10.086 -10.269 1.00 15.23 H new ATOM 0 HD3 LYS A 5 -23.522 -8.632 -11.159 1.00 15.23 H new ATOM 0 HE2 LYS A 5 -23.083 -9.811 -13.314 1.00 21.22 H new ATOM 0 HE3 LYS A 5 -22.635 -11.262 -12.439 1.00 21.22 H new ATOM 0 HZ1 LYS A 5 -24.902 -11.374 -13.220 1.00 21.44 H new ATOM 0 HZ2 LYS A 5 -24.872 -11.367 -11.522 1.00 21.44 H new ATOM 0 HZ3 LYS A 5 -25.306 -9.961 -12.369 1.00 21.44 H new ATOM 71 N LEU A 6 -18.670 -6.012 -8.629 1.00 23.00 N ATOM 72 CA LEU A 6 -18.183 -5.278 -7.450 1.00 52.55 C ATOM 73 C LEU A 6 -19.044 -4.037 -7.223 1.00 72.02 C ATOM 74 O LEU A 6 -18.935 -3.059 -7.976 1.00 72.55 O ATOM 75 CB LEU A 6 -16.691 -4.876 -7.650 1.00 71.03 C ATOM 76 CG LEU A 6 -15.697 -6.049 -7.937 1.00 23.42 C ATOM 77 CD1 LEU A 6 -14.275 -5.522 -8.198 1.00 22.25 C ATOM 78 CD2 LEU A 6 -15.707 -7.096 -6.798 1.00 60.53 C ATOM 0 H LEU A 6 -18.628 -5.474 -9.494 1.00 23.00 H new ATOM 0 HA LEU A 6 -18.254 -5.921 -6.572 1.00 52.55 H new ATOM 0 HB2 LEU A 6 -16.634 -4.168 -8.476 1.00 71.03 H new ATOM 0 HB3 LEU A 6 -16.354 -4.351 -6.756 1.00 71.03 H new ATOM 0 HG LEU A 6 -16.038 -6.551 -8.843 1.00 23.42 H new ATOM 0 HD11 LEU A 6 -13.607 -6.360 -8.394 1.00 22.25 H new ATOM 0 HD12 LEU A 6 -14.286 -4.857 -9.062 1.00 22.25 H new ATOM 0 HD13 LEU A 6 -13.923 -4.975 -7.323 1.00 22.25 H new ATOM 0 HD21 LEU A 6 -15.004 -7.896 -7.033 1.00 60.53 H new ATOM 0 HD22 LEU A 6 -15.415 -6.619 -5.863 1.00 60.53 H new ATOM 0 HD23 LEU A 6 -16.709 -7.512 -6.695 1.00 60.53 H new ATOM 90 N GLU A 7 -19.939 -4.091 -6.222 1.00 33.01 N ATOM 91 CA GLU A 7 -20.664 -2.899 -5.768 1.00 44.23 C ATOM 92 C GLU A 7 -19.705 -1.993 -4.996 1.00 75.24 C ATOM 93 O GLU A 7 -18.808 -2.466 -4.291 1.00 12.34 O ATOM 94 CB GLU A 7 -21.893 -3.234 -4.874 1.00 22.40 C ATOM 95 CG GLU A 7 -23.067 -3.904 -5.604 1.00 33.12 C ATOM 96 CD GLU A 7 -22.816 -5.384 -5.888 1.00 15.22 C ATOM 97 OE1 GLU A 7 -22.431 -5.733 -7.028 1.00 21.14 O ATOM 98 OE2 GLU A 7 -22.995 -6.201 -4.954 1.00 72.23 O ATOM 0 H GLU A 7 -20.175 -4.945 -5.716 1.00 33.01 H new ATOM 0 HA GLU A 7 -21.047 -2.397 -6.657 1.00 44.23 H new ATOM 0 HB2 GLU A 7 -21.567 -3.889 -4.066 1.00 22.40 H new ATOM 0 HB3 GLU A 7 -22.250 -2.313 -4.414 1.00 22.40 H new ATOM 0 HG2 GLU A 7 -23.970 -3.802 -5.002 1.00 33.12 H new ATOM 0 HG3 GLU A 7 -23.250 -3.384 -6.544 1.00 33.12 H new ATOM 105 N SER A 8 -19.898 -0.696 -5.161 1.00 62.35 N ATOM 106 CA SER A 8 -19.158 0.328 -4.432 1.00 5.21 C ATOM 107 C SER A 8 -19.918 0.721 -3.155 1.00 72.01 C ATOM 108 O SER A 8 -20.966 0.140 -2.829 1.00 70.31 O ATOM 109 CB SER A 8 -18.971 1.530 -5.376 1.00 32.24 C ATOM 110 OG SER A 8 -20.213 1.936 -5.943 1.00 71.40 O ATOM 0 H SER A 8 -20.583 -0.315 -5.814 1.00 62.35 H new ATOM 0 HA SER A 8 -18.182 -0.043 -4.119 1.00 5.21 H new ATOM 0 HB2 SER A 8 -18.529 2.362 -4.827 1.00 32.24 H new ATOM 0 HB3 SER A 8 -18.274 1.267 -6.171 1.00 32.24 H new ATOM 0 HG SER A 8 -20.290 1.579 -6.852 1.00 71.40 H new ATOM 116 N SER A 9 -19.371 1.701 -2.421 1.00 42.41 N ATOM 117 CA SER A 9 -20.076 2.364 -1.315 1.00 13.43 C ATOM 118 C SER A 9 -21.271 3.179 -1.861 1.00 1.44 C ATOM 119 O SER A 9 -22.260 3.402 -1.161 1.00 50.42 O ATOM 120 CB SER A 9 -19.093 3.266 -0.544 1.00 74.30 C ATOM 121 OG SER A 9 -18.457 4.196 -1.407 1.00 73.53 O ATOM 0 H SER A 9 -18.428 2.056 -2.578 1.00 42.41 H new ATOM 0 HA SER A 9 -20.467 1.614 -0.628 1.00 13.43 H new ATOM 0 HB2 SER A 9 -19.627 3.802 0.240 1.00 74.30 H new ATOM 0 HB3 SER A 9 -18.340 2.650 -0.053 1.00 74.30 H new ATOM 0 HG SER A 9 -17.539 4.352 -1.100 1.00 73.53 H new ATOM 127 N ASP A 10 -21.148 3.597 -3.141 1.00 71.12 N ATOM 128 CA ASP A 10 -22.203 4.299 -3.899 1.00 70.33 C ATOM 129 C ASP A 10 -23.215 3.282 -4.512 1.00 21.33 C ATOM 130 O ASP A 10 -24.222 3.679 -5.104 1.00 54.51 O ATOM 131 CB ASP A 10 -21.510 5.151 -5.003 1.00 14.01 C ATOM 132 CG ASP A 10 -22.462 6.024 -5.843 1.00 0.10 C ATOM 133 OD1 ASP A 10 -22.757 7.161 -5.428 1.00 31.03 O ATOM 134 OD2 ASP A 10 -22.897 5.585 -6.933 1.00 21.44 O ATOM 0 H ASP A 10 -20.297 3.452 -3.684 1.00 71.12 H new ATOM 0 HA ASP A 10 -22.776 4.950 -3.239 1.00 70.33 H new ATOM 0 HB2 ASP A 10 -20.769 5.797 -4.531 1.00 14.01 H new ATOM 0 HB3 ASP A 10 -20.969 4.482 -5.672 1.00 14.01 H new ATOM 139 N GLU A 11 -22.916 1.969 -4.337 1.00 12.43 N ATOM 140 CA GLU A 11 -23.796 0.821 -4.688 1.00 25.42 C ATOM 141 C GLU A 11 -23.868 0.522 -6.205 1.00 41.34 C ATOM 142 O GLU A 11 -24.548 -0.433 -6.602 1.00 41.22 O ATOM 143 CB GLU A 11 -25.225 0.977 -4.085 1.00 3.35 C ATOM 144 CG GLU A 11 -25.284 0.996 -2.540 1.00 31.52 C ATOM 145 CD GLU A 11 -26.697 1.284 -1.996 1.00 24.14 C ATOM 146 OE1 GLU A 11 -26.964 2.422 -1.550 1.00 72.51 O ATOM 147 OE2 GLU A 11 -27.554 0.378 -2.025 1.00 23.13 O ATOM 0 H GLU A 11 -22.028 1.669 -3.935 1.00 12.43 H new ATOM 0 HA GLU A 11 -23.320 -0.047 -4.231 1.00 25.42 H new ATOM 0 HB2 GLU A 11 -25.663 1.901 -4.462 1.00 3.35 H new ATOM 0 HB3 GLU A 11 -25.847 0.159 -4.447 1.00 3.35 H new ATOM 0 HG2 GLU A 11 -24.942 0.035 -2.157 1.00 31.52 H new ATOM 0 HG3 GLU A 11 -24.595 1.752 -2.165 1.00 31.52 H new ATOM 154 N LYS A 12 -23.170 1.316 -7.054 1.00 43.42 N ATOM 155 CA LYS A 12 -23.081 1.015 -8.502 1.00 40.40 C ATOM 156 C LYS A 12 -22.159 -0.202 -8.724 1.00 31.23 C ATOM 157 O LYS A 12 -21.067 -0.276 -8.141 1.00 72.34 O ATOM 158 CB LYS A 12 -22.620 2.243 -9.357 1.00 52.22 C ATOM 159 CG LYS A 12 -23.729 3.314 -9.596 1.00 12.20 C ATOM 160 CD LYS A 12 -23.487 4.190 -10.862 1.00 31.31 C ATOM 161 CE LYS A 12 -22.340 5.208 -10.715 1.00 45.10 C ATOM 162 NZ LYS A 12 -22.675 6.308 -9.764 1.00 64.32 N ATOM 0 H LYS A 12 -22.668 2.156 -6.766 1.00 43.42 H new ATOM 0 HA LYS A 12 -24.086 0.775 -8.849 1.00 40.40 H new ATOM 0 HB2 LYS A 12 -21.774 2.718 -8.861 1.00 52.22 H new ATOM 0 HB3 LYS A 12 -22.264 1.885 -10.323 1.00 52.22 H new ATOM 0 HG2 LYS A 12 -24.692 2.813 -9.690 1.00 12.20 H new ATOM 0 HG3 LYS A 12 -23.791 3.962 -8.722 1.00 12.20 H new ATOM 0 HD2 LYS A 12 -23.271 3.536 -11.707 1.00 31.31 H new ATOM 0 HD3 LYS A 12 -24.406 4.726 -11.100 1.00 31.31 H new ATOM 0 HE2 LYS A 12 -21.443 4.694 -10.370 1.00 45.10 H new ATOM 0 HE3 LYS A 12 -22.108 5.633 -11.691 1.00 45.10 H new ATOM 0 HZ1 LYS A 12 -21.942 7.044 -9.813 1.00 64.32 H new ATOM 0 HZ2 LYS A 12 -23.596 6.719 -10.019 1.00 64.32 H new ATOM 0 HZ3 LYS A 12 -22.721 5.929 -8.797 1.00 64.32 H new ATOM 176 N VAL A 13 -22.640 -1.143 -9.552 1.00 4.13 N ATOM 177 CA VAL A 13 -21.983 -2.435 -9.825 1.00 32.42 C ATOM 178 C VAL A 13 -20.918 -2.274 -10.932 1.00 15.44 C ATOM 179 O VAL A 13 -21.146 -1.559 -11.916 1.00 21.42 O ATOM 180 CB VAL A 13 -23.045 -3.515 -10.271 1.00 13.41 C ATOM 181 CG1 VAL A 13 -22.395 -4.910 -10.466 1.00 33.50 C ATOM 182 CG2 VAL A 13 -24.231 -3.582 -9.272 1.00 51.15 C ATOM 0 H VAL A 13 -23.515 -1.026 -10.062 1.00 4.13 H new ATOM 0 HA VAL A 13 -21.500 -2.769 -8.907 1.00 32.42 H new ATOM 0 HB VAL A 13 -23.440 -3.203 -11.238 1.00 13.41 H new ATOM 0 HG11 VAL A 13 -23.157 -5.627 -10.773 1.00 33.50 H new ATOM 0 HG12 VAL A 13 -21.625 -4.848 -11.235 1.00 33.50 H new ATOM 0 HG13 VAL A 13 -21.946 -5.237 -9.528 1.00 33.50 H new ATOM 0 HG21 VAL A 13 -24.946 -4.334 -9.606 1.00 51.15 H new ATOM 0 HG22 VAL A 13 -23.859 -3.849 -8.283 1.00 51.15 H new ATOM 0 HG23 VAL A 13 -24.722 -2.610 -9.225 1.00 51.15 H new ATOM 192 N PHE A 14 -19.757 -2.932 -10.749 1.00 32.35 N ATOM 193 CA PHE A 14 -18.649 -2.927 -11.722 1.00 70.33 C ATOM 194 C PHE A 14 -18.196 -4.369 -11.980 1.00 54.43 C ATOM 195 O PHE A 14 -17.500 -4.979 -11.160 1.00 30.40 O ATOM 196 CB PHE A 14 -17.485 -2.033 -11.218 1.00 35.40 C ATOM 197 CG PHE A 14 -17.869 -0.554 -11.166 1.00 14.21 C ATOM 198 CD1 PHE A 14 -17.843 0.227 -12.323 1.00 73.33 C ATOM 199 CD2 PHE A 14 -18.306 0.041 -9.981 1.00 24.42 C ATOM 200 CE1 PHE A 14 -18.239 1.548 -12.294 1.00 43.52 C ATOM 201 CE2 PHE A 14 -18.691 1.362 -9.957 1.00 3.24 C ATOM 202 CZ PHE A 14 -18.661 2.115 -11.112 1.00 74.25 C ATOM 0 H PHE A 14 -19.561 -3.486 -9.915 1.00 32.35 H new ATOM 0 HA PHE A 14 -18.989 -2.502 -12.666 1.00 70.33 H new ATOM 0 HB2 PHE A 14 -17.181 -2.362 -10.224 1.00 35.40 H new ATOM 0 HB3 PHE A 14 -16.623 -2.159 -11.873 1.00 35.40 H new ATOM 0 HD1 PHE A 14 -17.508 -0.209 -13.253 1.00 73.33 H new ATOM 0 HD2 PHE A 14 -18.342 -0.542 -9.073 1.00 24.42 H new ATOM 0 HE1 PHE A 14 -18.218 2.138 -13.198 1.00 43.52 H new ATOM 0 HE2 PHE A 14 -19.018 1.811 -9.030 1.00 3.24 H new ATOM 0 HZ PHE A 14 -18.969 3.150 -11.090 1.00 74.25 H new ATOM 212 N GLU A 15 -18.644 -4.908 -13.121 1.00 70.10 N ATOM 213 CA GLU A 15 -18.406 -6.296 -13.523 1.00 13.24 C ATOM 214 C GLU A 15 -17.058 -6.391 -14.257 1.00 30.21 C ATOM 215 O GLU A 15 -16.989 -6.241 -15.484 1.00 41.14 O ATOM 216 CB GLU A 15 -19.569 -6.774 -14.430 1.00 74.24 C ATOM 217 CG GLU A 15 -20.972 -6.462 -13.876 1.00 1.24 C ATOM 218 CD GLU A 15 -22.101 -6.905 -14.812 1.00 43.32 C ATOM 219 OE1 GLU A 15 -22.840 -7.850 -14.480 1.00 34.31 O ATOM 220 OE2 GLU A 15 -22.254 -6.300 -15.890 1.00 15.14 O ATOM 0 H GLU A 15 -19.191 -4.381 -13.801 1.00 70.10 H new ATOM 0 HA GLU A 15 -18.366 -6.940 -12.645 1.00 13.24 H new ATOM 0 HB2 GLU A 15 -19.466 -6.308 -15.410 1.00 74.24 H new ATOM 0 HB3 GLU A 15 -19.480 -7.850 -14.578 1.00 74.24 H new ATOM 0 HG2 GLU A 15 -21.093 -6.956 -12.912 1.00 1.24 H new ATOM 0 HG3 GLU A 15 -21.055 -5.390 -13.698 1.00 1.24 H new ATOM 227 N ILE A 16 -15.986 -6.574 -13.487 1.00 4.53 N ATOM 228 CA ILE A 16 -14.613 -6.675 -14.014 1.00 54.11 C ATOM 229 C ILE A 16 -14.205 -8.159 -14.105 1.00 54.04 C ATOM 230 O ILE A 16 -14.722 -8.991 -13.357 1.00 12.25 O ATOM 231 CB ILE A 16 -13.606 -5.866 -13.105 1.00 30.34 C ATOM 232 CG1 ILE A 16 -12.170 -5.836 -13.726 1.00 71.32 C ATOM 233 CG2 ILE A 16 -13.583 -6.418 -11.655 1.00 12.44 C ATOM 234 CD1 ILE A 16 -11.147 -5.054 -12.924 1.00 71.14 C ATOM 0 H ILE A 16 -16.039 -6.658 -12.472 1.00 4.53 H new ATOM 0 HA ILE A 16 -14.580 -6.239 -15.012 1.00 54.11 H new ATOM 0 HB ILE A 16 -13.963 -4.837 -13.059 1.00 30.34 H new ATOM 0 HG12 ILE A 16 -11.816 -6.861 -13.839 1.00 71.32 H new ATOM 0 HG13 ILE A 16 -12.231 -5.408 -14.727 1.00 71.32 H new ATOM 0 HG21 ILE A 16 -12.880 -5.839 -11.056 1.00 12.44 H new ATOM 0 HG22 ILE A 16 -14.580 -6.341 -11.220 1.00 12.44 H new ATOM 0 HG23 ILE A 16 -13.273 -7.463 -11.668 1.00 12.44 H new ATOM 0 HD11 ILE A 16 -10.183 -5.089 -13.431 1.00 71.14 H new ATOM 0 HD12 ILE A 16 -11.471 -4.017 -12.833 1.00 71.14 H new ATOM 0 HD13 ILE A 16 -11.051 -5.493 -11.931 1.00 71.14 H new ATOM 246 N GLU A 17 -13.299 -8.473 -15.041 1.00 20.42 N ATOM 247 CA GLU A 17 -12.729 -9.818 -15.211 1.00 44.51 C ATOM 248 C GLU A 17 -11.993 -10.249 -13.914 1.00 22.24 C ATOM 249 O GLU A 17 -11.245 -9.449 -13.329 1.00 61.42 O ATOM 250 CB GLU A 17 -11.748 -9.830 -16.418 1.00 13.22 C ATOM 251 CG GLU A 17 -12.364 -9.647 -17.835 1.00 74.05 C ATOM 252 CD GLU A 17 -12.917 -8.244 -18.166 1.00 73.42 C ATOM 253 OE1 GLU A 17 -12.438 -7.242 -17.602 1.00 24.42 O ATOM 254 OE2 GLU A 17 -13.812 -8.133 -19.035 1.00 15.34 O ATOM 0 H GLU A 17 -12.937 -7.793 -15.709 1.00 20.42 H new ATOM 0 HA GLU A 17 -13.535 -10.525 -15.408 1.00 44.51 H new ATOM 0 HB2 GLU A 17 -11.013 -9.040 -16.264 1.00 13.22 H new ATOM 0 HB3 GLU A 17 -11.207 -10.776 -16.404 1.00 13.22 H new ATOM 0 HG2 GLU A 17 -11.603 -9.897 -18.574 1.00 74.05 H new ATOM 0 HG3 GLU A 17 -13.172 -10.369 -17.952 1.00 74.05 H new ATOM 261 N LYS A 18 -12.218 -11.504 -13.482 1.00 51.35 N ATOM 262 CA LYS A 18 -11.706 -12.023 -12.195 1.00 74.41 C ATOM 263 C LYS A 18 -10.164 -12.069 -12.175 1.00 41.52 C ATOM 264 O LYS A 18 -9.542 -11.689 -11.179 1.00 73.52 O ATOM 265 CB LYS A 18 -12.282 -13.432 -11.906 1.00 54.21 C ATOM 266 CG LYS A 18 -11.919 -13.996 -10.505 1.00 5.45 C ATOM 267 CD LYS A 18 -12.436 -15.435 -10.272 1.00 21.33 C ATOM 268 CE LYS A 18 -11.778 -16.463 -11.215 1.00 73.34 C ATOM 269 NZ LYS A 18 -12.254 -17.847 -10.954 1.00 54.03 N ATOM 0 H LYS A 18 -12.758 -12.187 -14.012 1.00 51.35 H new ATOM 0 HA LYS A 18 -12.034 -11.337 -11.414 1.00 74.41 H new ATOM 0 HB2 LYS A 18 -13.367 -13.394 -11.999 1.00 54.21 H new ATOM 0 HB3 LYS A 18 -11.920 -14.123 -12.668 1.00 54.21 H new ATOM 0 HG2 LYS A 18 -10.836 -13.983 -10.385 1.00 5.45 H new ATOM 0 HG3 LYS A 18 -12.332 -13.340 -9.739 1.00 5.45 H new ATOM 0 HD2 LYS A 18 -12.245 -15.722 -9.238 1.00 21.33 H new ATOM 0 HD3 LYS A 18 -13.516 -15.456 -10.415 1.00 21.33 H new ATOM 0 HE2 LYS A 18 -11.993 -16.195 -12.249 1.00 73.34 H new ATOM 0 HE3 LYS A 18 -10.695 -16.424 -11.094 1.00 73.34 H new ATOM 0 HZ1 LYS A 18 -11.879 -18.486 -11.683 1.00 54.03 H new ATOM 0 HZ2 LYS A 18 -11.923 -18.157 -10.018 1.00 54.03 H new ATOM 0 HZ3 LYS A 18 -13.294 -17.867 -10.978 1.00 54.03 H new ATOM 283 N GLU A 19 -9.574 -12.537 -13.296 1.00 4.31 N ATOM 284 CA GLU A 19 -8.107 -12.603 -13.491 1.00 43.25 C ATOM 285 C GLU A 19 -7.432 -11.219 -13.328 1.00 61.12 C ATOM 286 O GLU A 19 -6.265 -11.131 -12.932 1.00 74.02 O ATOM 287 CB GLU A 19 -7.751 -13.204 -14.889 1.00 0.13 C ATOM 288 CG GLU A 19 -8.328 -12.449 -16.134 1.00 63.02 C ATOM 289 CD GLU A 19 -9.666 -13.010 -16.665 1.00 74.45 C ATOM 290 OE1 GLU A 19 -9.678 -13.642 -17.738 1.00 33.13 O ATOM 291 OE2 GLU A 19 -10.704 -12.829 -16.008 1.00 65.23 O ATOM 0 H GLU A 19 -10.104 -12.882 -14.096 1.00 4.31 H new ATOM 0 HA GLU A 19 -7.720 -13.259 -12.712 1.00 43.25 H new ATOM 0 HB2 GLU A 19 -6.665 -13.237 -14.981 1.00 0.13 H new ATOM 0 HB3 GLU A 19 -8.105 -14.235 -14.919 1.00 0.13 H new ATOM 0 HG2 GLU A 19 -8.467 -11.400 -15.873 1.00 63.02 H new ATOM 0 HG3 GLU A 19 -7.591 -12.483 -16.936 1.00 63.02 H new ATOM 298 N ILE A 20 -8.176 -10.149 -13.661 1.00 34.30 N ATOM 299 CA ILE A 20 -7.719 -8.756 -13.493 1.00 2.14 C ATOM 300 C ILE A 20 -7.834 -8.343 -12.008 1.00 45.00 C ATOM 301 O ILE A 20 -6.919 -7.725 -11.444 1.00 32.05 O ATOM 302 CB ILE A 20 -8.546 -7.770 -14.403 1.00 14.13 C ATOM 303 CG1 ILE A 20 -8.466 -8.212 -15.903 1.00 31.03 C ATOM 304 CG2 ILE A 20 -8.064 -6.316 -14.215 1.00 14.44 C ATOM 305 CD1 ILE A 20 -9.138 -7.285 -16.906 1.00 23.30 C ATOM 0 H ILE A 20 -9.114 -10.225 -14.055 1.00 34.30 H new ATOM 0 HA ILE A 20 -6.676 -8.697 -13.803 1.00 2.14 H new ATOM 0 HB ILE A 20 -9.592 -7.810 -14.098 1.00 14.13 H new ATOM 0 HG12 ILE A 20 -7.416 -8.312 -16.177 1.00 31.03 H new ATOM 0 HG13 ILE A 20 -8.915 -9.201 -15.995 1.00 31.03 H new ATOM 0 HG21 ILE A 20 -8.649 -5.653 -14.853 1.00 14.44 H new ATOM 0 HG22 ILE A 20 -8.191 -6.022 -13.173 1.00 14.44 H new ATOM 0 HG23 ILE A 20 -7.011 -6.244 -14.486 1.00 14.44 H new ATOM 0 HD11 ILE A 20 -9.020 -7.690 -17.911 1.00 23.30 H new ATOM 0 HD12 ILE A 20 -10.199 -7.202 -16.671 1.00 23.30 H new ATOM 0 HD13 ILE A 20 -8.677 -6.299 -16.856 1.00 23.30 H new ATOM 317 N ALA A 21 -8.958 -8.744 -11.382 1.00 24.15 N ATOM 318 CA ALA A 21 -9.267 -8.447 -9.966 1.00 43.25 C ATOM 319 C ALA A 21 -8.385 -9.256 -8.982 1.00 42.12 C ATOM 320 O ALA A 21 -8.498 -9.089 -7.765 1.00 54.05 O ATOM 321 CB ALA A 21 -10.762 -8.711 -9.702 1.00 72.14 C ATOM 0 H ALA A 21 -9.684 -9.288 -11.848 1.00 24.15 H new ATOM 0 HA ALA A 21 -9.041 -7.395 -9.789 1.00 43.25 H new ATOM 0 HB1 ALA A 21 -10.991 -8.493 -8.659 1.00 72.14 H new ATOM 0 HB2 ALA A 21 -11.364 -8.071 -10.348 1.00 72.14 H new ATOM 0 HB3 ALA A 21 -10.990 -9.756 -9.912 1.00 72.14 H new ATOM 327 N CYS A 22 -7.514 -10.135 -9.520 1.00 71.40 N ATOM 328 CA CYS A 22 -6.537 -10.902 -8.726 1.00 14.30 C ATOM 329 C CYS A 22 -5.360 -10.018 -8.244 1.00 22.01 C ATOM 330 O CYS A 22 -4.698 -10.361 -7.257 1.00 2.13 O ATOM 331 CB CYS A 22 -6.038 -12.105 -9.545 1.00 62.44 C ATOM 332 SG CYS A 22 -7.351 -13.273 -9.974 1.00 14.14 S ATOM 0 H CYS A 22 -7.470 -10.332 -10.520 1.00 71.40 H new ATOM 0 HA CYS A 22 -7.035 -11.267 -7.828 1.00 14.30 H new ATOM 0 HB2 CYS A 22 -5.570 -11.743 -10.460 1.00 62.44 H new ATOM 0 HB3 CYS A 22 -5.268 -12.627 -8.978 1.00 62.44 H new ATOM 0 HG CYS A 22 -8.346 -12.630 -10.508 1.00 14.14 H new ATOM 338 N MET A 23 -5.087 -8.890 -8.947 1.00 54.54 N ATOM 339 CA MET A 23 -4.075 -7.895 -8.490 1.00 31.22 C ATOM 340 C MET A 23 -4.565 -7.157 -7.233 1.00 22.22 C ATOM 341 O MET A 23 -3.757 -6.646 -6.443 1.00 53.21 O ATOM 342 CB MET A 23 -3.704 -6.886 -9.610 1.00 2.14 C ATOM 343 CG MET A 23 -2.862 -7.486 -10.746 1.00 30.31 C ATOM 344 SD MET A 23 -2.291 -6.244 -11.929 1.00 21.43 S ATOM 345 CE MET A 23 -3.837 -5.613 -12.572 1.00 62.33 C ATOM 0 H MET A 23 -5.547 -8.645 -9.824 1.00 54.54 H new ATOM 0 HA MET A 23 -3.169 -8.447 -8.239 1.00 31.22 H new ATOM 0 HB2 MET A 23 -4.621 -6.475 -10.031 1.00 2.14 H new ATOM 0 HB3 MET A 23 -3.156 -6.054 -9.167 1.00 2.14 H new ATOM 0 HG2 MET A 23 -1.999 -7.999 -10.320 1.00 30.31 H new ATOM 0 HG3 MET A 23 -3.452 -8.237 -11.271 1.00 30.31 H new ATOM 0 HE1 MET A 23 -3.768 -5.516 -13.655 1.00 62.33 H new ATOM 0 HE2 MET A 23 -4.644 -6.301 -12.320 1.00 62.33 H new ATOM 0 HE3 MET A 23 -4.043 -4.637 -12.132 1.00 62.33 H new ATOM 355 N SER A 24 -5.895 -7.103 -7.070 1.00 50.11 N ATOM 356 CA SER A 24 -6.530 -6.706 -5.818 1.00 45.42 C ATOM 357 C SER A 24 -6.384 -7.872 -4.833 1.00 63.14 C ATOM 358 O SER A 24 -7.121 -8.849 -4.933 1.00 34.21 O ATOM 359 CB SER A 24 -8.018 -6.351 -6.055 1.00 72.32 C ATOM 360 OG SER A 24 -8.648 -5.952 -4.854 1.00 12.23 O ATOM 0 H SER A 24 -6.558 -7.336 -7.810 1.00 50.11 H new ATOM 0 HA SER A 24 -6.052 -5.816 -5.409 1.00 45.42 H new ATOM 0 HB2 SER A 24 -8.090 -5.549 -6.790 1.00 72.32 H new ATOM 0 HB3 SER A 24 -8.538 -7.213 -6.472 1.00 72.32 H new ATOM 0 HG SER A 24 -7.967 -5.759 -4.176 1.00 12.23 H new ATOM 366 N VAL A 25 -5.385 -7.780 -3.930 1.00 12.15 N ATOM 367 CA VAL A 25 -5.053 -8.864 -2.982 1.00 22.31 C ATOM 368 C VAL A 25 -6.223 -9.116 -2.005 1.00 74.13 C ATOM 369 O VAL A 25 -6.488 -10.261 -1.653 1.00 52.42 O ATOM 370 CB VAL A 25 -3.714 -8.567 -2.197 1.00 44.23 C ATOM 371 CG1 VAL A 25 -3.324 -9.724 -1.235 1.00 11.12 C ATOM 372 CG2 VAL A 25 -2.559 -8.258 -3.186 1.00 14.44 C ATOM 0 H VAL A 25 -4.789 -6.957 -3.838 1.00 12.15 H new ATOM 0 HA VAL A 25 -4.892 -9.771 -3.565 1.00 22.31 H new ATOM 0 HB VAL A 25 -3.892 -7.687 -1.579 1.00 44.23 H new ATOM 0 HG11 VAL A 25 -2.397 -9.472 -0.719 1.00 11.12 H new ATOM 0 HG12 VAL A 25 -4.118 -9.872 -0.503 1.00 11.12 H new ATOM 0 HG13 VAL A 25 -3.183 -10.641 -1.807 1.00 11.12 H new ATOM 0 HG21 VAL A 25 -1.645 -8.056 -2.627 1.00 14.44 H new ATOM 0 HG22 VAL A 25 -2.402 -9.115 -3.841 1.00 14.44 H new ATOM 0 HG23 VAL A 25 -2.817 -7.385 -3.786 1.00 14.44 H new ATOM 382 N THR A 26 -6.934 -8.039 -1.618 1.00 52.13 N ATOM 383 CA THR A 26 -8.113 -8.119 -0.724 1.00 20.32 C ATOM 384 C THR A 26 -9.240 -8.978 -1.343 1.00 74.11 C ATOM 385 O THR A 26 -9.694 -9.949 -0.726 1.00 50.15 O ATOM 386 CB THR A 26 -8.646 -6.686 -0.401 1.00 75.44 C ATOM 387 OG1 THR A 26 -7.587 -5.930 0.188 1.00 21.53 O ATOM 388 CG2 THR A 26 -9.858 -6.682 0.555 1.00 3.54 C ATOM 0 H THR A 26 -6.710 -7.089 -1.914 1.00 52.13 H new ATOM 0 HA THR A 26 -7.795 -8.601 0.200 1.00 20.32 H new ATOM 0 HB THR A 26 -8.984 -6.248 -1.340 1.00 75.44 H new ATOM 0 HG1 THR A 26 -7.881 -5.005 0.323 1.00 21.53 H new ATOM 0 HG21 THR A 26 -10.176 -5.655 0.736 1.00 3.54 H new ATOM 0 HG22 THR A 26 -10.678 -7.242 0.105 1.00 3.54 H new ATOM 0 HG23 THR A 26 -9.577 -7.147 1.500 1.00 3.54 H new ATOM 396 N ILE A 27 -9.636 -8.636 -2.590 1.00 10.32 N ATOM 397 CA ILE A 27 -10.701 -9.351 -3.329 1.00 32.01 C ATOM 398 C ILE A 27 -10.240 -10.788 -3.661 1.00 24.21 C ATOM 399 O ILE A 27 -11.016 -11.734 -3.532 1.00 42.23 O ATOM 400 CB ILE A 27 -11.105 -8.575 -4.643 1.00 51.12 C ATOM 401 CG1 ILE A 27 -11.623 -7.140 -4.290 1.00 52.32 C ATOM 402 CG2 ILE A 27 -12.160 -9.358 -5.480 1.00 41.54 C ATOM 403 CD1 ILE A 27 -11.950 -6.273 -5.494 1.00 75.45 C ATOM 0 H ILE A 27 -9.228 -7.860 -3.111 1.00 10.32 H new ATOM 0 HA ILE A 27 -11.585 -9.403 -2.693 1.00 32.01 H new ATOM 0 HB ILE A 27 -10.212 -8.483 -5.261 1.00 51.12 H new ATOM 0 HG12 ILE A 27 -12.516 -7.232 -3.672 1.00 52.32 H new ATOM 0 HG13 ILE A 27 -10.869 -6.633 -3.688 1.00 52.32 H new ATOM 0 HG21 ILE A 27 -12.410 -8.788 -6.375 1.00 41.54 H new ATOM 0 HG22 ILE A 27 -11.750 -10.326 -5.768 1.00 41.54 H new ATOM 0 HG23 ILE A 27 -13.059 -9.508 -4.883 1.00 41.54 H new ATOM 0 HD11 ILE A 27 -12.301 -5.298 -5.156 1.00 75.45 H new ATOM 0 HD12 ILE A 27 -11.056 -6.145 -6.104 1.00 75.45 H new ATOM 0 HD13 ILE A 27 -12.728 -6.753 -6.087 1.00 75.45 H new ATOM 415 N LYS A 28 -8.948 -10.920 -4.030 1.00 32.01 N ATOM 416 CA LYS A 28 -8.309 -12.213 -4.364 1.00 74.44 C ATOM 417 C LYS A 28 -8.429 -13.198 -3.184 1.00 64.14 C ATOM 418 O LYS A 28 -8.884 -14.321 -3.366 1.00 23.01 O ATOM 419 CB LYS A 28 -6.813 -11.994 -4.722 1.00 11.00 C ATOM 420 CG LYS A 28 -6.036 -13.272 -5.132 1.00 23.14 C ATOM 421 CD LYS A 28 -4.516 -13.031 -5.300 1.00 3.03 C ATOM 422 CE LYS A 28 -3.825 -12.566 -3.997 1.00 31.24 C ATOM 423 NZ LYS A 28 -3.923 -13.578 -2.906 1.00 71.14 N ATOM 0 H LYS A 28 -8.313 -10.126 -4.105 1.00 32.01 H new ATOM 0 HA LYS A 28 -8.823 -12.639 -5.226 1.00 74.44 H new ATOM 0 HB2 LYS A 28 -6.753 -11.275 -5.539 1.00 11.00 H new ATOM 0 HB3 LYS A 28 -6.313 -11.544 -3.864 1.00 11.00 H new ATOM 0 HG2 LYS A 28 -6.194 -14.044 -4.379 1.00 23.14 H new ATOM 0 HG3 LYS A 28 -6.443 -13.653 -6.069 1.00 23.14 H new ATOM 0 HD2 LYS A 28 -4.045 -13.951 -5.645 1.00 3.03 H new ATOM 0 HD3 LYS A 28 -4.357 -12.281 -6.075 1.00 3.03 H new ATOM 0 HE2 LYS A 28 -2.775 -12.357 -4.201 1.00 31.24 H new ATOM 0 HE3 LYS A 28 -4.277 -11.632 -3.663 1.00 31.24 H new ATOM 0 HZ1 LYS A 28 -4.393 -13.154 -2.081 1.00 71.14 H new ATOM 0 HZ2 LYS A 28 -4.476 -14.394 -3.238 1.00 71.14 H new ATOM 0 HZ3 LYS A 28 -2.969 -13.892 -2.637 1.00 71.14 H new ATOM 437 N ASN A 29 -8.060 -12.722 -1.971 1.00 14.25 N ATOM 438 CA ASN A 29 -8.073 -13.538 -0.734 1.00 52.32 C ATOM 439 C ASN A 29 -9.507 -13.962 -0.364 1.00 73.22 C ATOM 440 O ASN A 29 -9.712 -15.075 0.123 1.00 63.21 O ATOM 441 CB ASN A 29 -7.420 -12.777 0.460 1.00 52.43 C ATOM 442 CG ASN A 29 -5.920 -12.508 0.273 1.00 74.31 C ATOM 443 OD1 ASN A 29 -5.221 -13.227 -0.443 1.00 44.52 O ATOM 444 ND2 ASN A 29 -5.406 -11.478 0.935 1.00 1.13 N ATOM 0 H ASN A 29 -7.745 -11.763 -1.823 1.00 14.25 H new ATOM 0 HA ASN A 29 -7.483 -14.432 -0.935 1.00 52.32 H new ATOM 0 HB2 ASN A 29 -7.936 -11.827 0.600 1.00 52.43 H new ATOM 0 HB3 ASN A 29 -7.566 -13.356 1.372 1.00 52.43 H new ATOM 0 HD21 ASN A 29 -4.411 -11.267 0.857 1.00 1.13 H new ATOM 0 HD22 ASN A 29 -6.006 -10.898 1.521 1.00 1.13 H new ATOM 451 N MET A 30 -10.484 -13.062 -0.613 1.00 54.34 N ATOM 452 CA MET A 30 -11.923 -13.336 -0.379 1.00 23.02 C ATOM 453 C MET A 30 -12.423 -14.471 -1.294 1.00 31.03 C ATOM 454 O MET A 30 -13.150 -15.365 -0.848 1.00 52.22 O ATOM 455 CB MET A 30 -12.776 -12.053 -0.611 1.00 3.13 C ATOM 456 CG MET A 30 -12.547 -10.929 0.403 1.00 45.54 C ATOM 457 SD MET A 30 -13.515 -9.457 0.004 1.00 72.41 S ATOM 458 CE MET A 30 -13.126 -8.378 1.377 1.00 53.44 C ATOM 0 H MET A 30 -10.300 -12.128 -0.980 1.00 54.34 H new ATOM 0 HA MET A 30 -12.036 -13.649 0.659 1.00 23.02 H new ATOM 0 HB2 MET A 30 -12.564 -11.670 -1.609 1.00 3.13 H new ATOM 0 HB3 MET A 30 -13.831 -12.328 -0.593 1.00 3.13 H new ATOM 0 HG2 MET A 30 -12.813 -11.280 1.400 1.00 45.54 H new ATOM 0 HG3 MET A 30 -11.488 -10.672 0.427 1.00 45.54 H new ATOM 0 HE1 MET A 30 -13.413 -7.356 1.129 1.00 53.44 H new ATOM 0 HE2 MET A 30 -13.672 -8.704 2.262 1.00 53.44 H new ATOM 0 HE3 MET A 30 -12.055 -8.415 1.577 1.00 53.44 H new ATOM 468 N ILE A 31 -12.000 -14.420 -2.571 1.00 54.05 N ATOM 469 CA ILE A 31 -12.385 -15.414 -3.588 1.00 43.22 C ATOM 470 C ILE A 31 -11.764 -16.788 -3.258 1.00 23.23 C ATOM 471 O ILE A 31 -12.468 -17.790 -3.243 1.00 44.23 O ATOM 472 CB ILE A 31 -11.983 -14.938 -5.039 1.00 11.01 C ATOM 473 CG1 ILE A 31 -12.728 -13.609 -5.401 1.00 63.12 C ATOM 474 CG2 ILE A 31 -12.278 -16.031 -6.097 1.00 32.13 C ATOM 475 CD1 ILE A 31 -12.356 -13.009 -6.747 1.00 12.52 C ATOM 0 H ILE A 31 -11.383 -13.689 -2.925 1.00 54.05 H new ATOM 0 HA ILE A 31 -13.470 -15.516 -3.571 1.00 43.22 H new ATOM 0 HB ILE A 31 -10.909 -14.753 -5.045 1.00 11.01 H new ATOM 0 HG12 ILE A 31 -13.802 -13.797 -5.388 1.00 63.12 H new ATOM 0 HG13 ILE A 31 -12.524 -12.873 -4.623 1.00 63.12 H new ATOM 0 HG21 ILE A 31 -11.989 -15.669 -7.084 1.00 32.13 H new ATOM 0 HG22 ILE A 31 -11.710 -16.930 -5.859 1.00 32.13 H new ATOM 0 HG23 ILE A 31 -13.343 -16.263 -6.093 1.00 32.13 H new ATOM 0 HD11 ILE A 31 -12.924 -12.092 -6.906 1.00 12.52 H new ATOM 0 HD12 ILE A 31 -11.290 -12.783 -6.762 1.00 12.52 H new ATOM 0 HD13 ILE A 31 -12.587 -13.721 -7.539 1.00 12.52 H new ATOM 487 N GLU A 32 -10.447 -16.795 -2.939 1.00 65.34 N ATOM 488 CA GLU A 32 -9.678 -18.018 -2.584 1.00 40.30 C ATOM 489 C GLU A 32 -10.251 -18.700 -1.333 1.00 42.14 C ATOM 490 O GLU A 32 -10.277 -19.935 -1.243 1.00 44.40 O ATOM 491 CB GLU A 32 -8.182 -17.673 -2.349 1.00 50.11 C ATOM 492 CG GLU A 32 -7.435 -17.133 -3.585 1.00 25.15 C ATOM 493 CD GLU A 32 -6.005 -16.677 -3.255 1.00 62.03 C ATOM 494 OE1 GLU A 32 -5.849 -15.617 -2.612 1.00 4.24 O ATOM 495 OE2 GLU A 32 -5.037 -17.386 -3.597 1.00 22.01 O ATOM 0 H GLU A 32 -9.882 -15.946 -2.920 1.00 65.34 H new ATOM 0 HA GLU A 32 -9.762 -18.710 -3.422 1.00 40.30 H new ATOM 0 HB2 GLU A 32 -8.117 -16.933 -1.552 1.00 50.11 H new ATOM 0 HB3 GLU A 32 -7.670 -18.568 -1.996 1.00 50.11 H new ATOM 0 HG2 GLU A 32 -7.398 -17.908 -4.351 1.00 25.15 H new ATOM 0 HG3 GLU A 32 -7.992 -16.296 -4.005 1.00 25.15 H new ATOM 502 N ASP A 33 -10.696 -17.865 -0.383 1.00 13.33 N ATOM 503 CA ASP A 33 -11.304 -18.303 0.888 1.00 12.01 C ATOM 504 C ASP A 33 -12.561 -19.155 0.631 1.00 20.02 C ATOM 505 O ASP A 33 -12.737 -20.229 1.213 1.00 44.52 O ATOM 506 CB ASP A 33 -11.661 -17.048 1.730 1.00 11.21 C ATOM 507 CG ASP A 33 -12.362 -17.365 3.062 1.00 20.20 C ATOM 508 OD1 ASP A 33 -13.610 -17.341 3.124 1.00 32.45 O ATOM 509 OD2 ASP A 33 -11.662 -17.629 4.059 1.00 62.13 O ATOM 0 H ASP A 33 -10.644 -16.850 -0.475 1.00 13.33 H new ATOM 0 HA ASP A 33 -10.592 -18.922 1.434 1.00 12.01 H new ATOM 0 HB2 ASP A 33 -10.748 -16.490 1.936 1.00 11.21 H new ATOM 0 HB3 ASP A 33 -12.305 -16.398 1.138 1.00 11.21 H new ATOM 514 N ILE A 34 -13.392 -18.665 -0.294 1.00 1.54 N ATOM 515 CA ILE A 34 -14.680 -19.280 -0.659 1.00 31.35 C ATOM 516 C ILE A 34 -14.490 -20.321 -1.797 1.00 54.44 C ATOM 517 O ILE A 34 -15.372 -21.149 -2.057 1.00 41.23 O ATOM 518 CB ILE A 34 -15.692 -18.132 -1.068 1.00 55.35 C ATOM 519 CG1 ILE A 34 -15.815 -17.102 0.113 1.00 23.15 C ATOM 520 CG2 ILE A 34 -17.086 -18.680 -1.472 1.00 63.12 C ATOM 521 CD1 ILE A 34 -16.705 -15.901 -0.155 1.00 52.13 C ATOM 0 H ILE A 34 -13.189 -17.816 -0.821 1.00 1.54 H new ATOM 0 HA ILE A 34 -15.090 -19.822 0.193 1.00 31.35 H new ATOM 0 HB ILE A 34 -15.293 -17.633 -1.952 1.00 55.35 H new ATOM 0 HG12 ILE A 34 -16.196 -17.626 0.990 1.00 23.15 H new ATOM 0 HG13 ILE A 34 -14.817 -16.743 0.364 1.00 23.15 H new ATOM 0 HG21 ILE A 34 -17.739 -17.850 -1.742 1.00 63.12 H new ATOM 0 HG22 ILE A 34 -16.980 -19.351 -2.324 1.00 63.12 H new ATOM 0 HG23 ILE A 34 -17.520 -19.224 -0.633 1.00 63.12 H new ATOM 0 HD11 ILE A 34 -16.719 -15.256 0.723 1.00 52.13 H new ATOM 0 HD12 ILE A 34 -16.318 -15.344 -1.008 1.00 52.13 H new ATOM 0 HD13 ILE A 34 -17.718 -16.240 -0.373 1.00 52.13 H new ATOM 533 N GLY A 35 -13.297 -20.316 -2.417 1.00 14.21 N ATOM 534 CA GLY A 35 -13.010 -21.136 -3.597 1.00 11.33 C ATOM 535 C GLY A 35 -13.112 -20.286 -4.857 1.00 4.51 C ATOM 536 O GLY A 35 -12.094 -19.858 -5.409 1.00 13.13 O ATOM 0 H GLY A 35 -12.510 -19.744 -2.112 1.00 14.21 H new ATOM 0 HA2 GLY A 35 -12.011 -21.566 -3.518 1.00 11.33 H new ATOM 0 HA3 GLY A 35 -13.712 -21.968 -3.652 1.00 11.33 H new ATOM 540 N GLU A 36 -14.360 -20.003 -5.277 1.00 60.44 N ATOM 541 CA GLU A 36 -14.683 -19.049 -6.364 1.00 24.01 C ATOM 542 C GLU A 36 -15.978 -18.299 -5.999 1.00 30.04 C ATOM 543 O GLU A 36 -17.073 -18.870 -6.072 1.00 3.44 O ATOM 544 CB GLU A 36 -14.819 -19.765 -7.751 1.00 61.34 C ATOM 545 CG GLU A 36 -13.483 -20.258 -8.350 1.00 64.35 C ATOM 546 CD GLU A 36 -13.619 -20.985 -9.700 1.00 34.54 C ATOM 547 OE1 GLU A 36 -13.751 -20.308 -10.745 1.00 64.23 O ATOM 548 OE2 GLU A 36 -13.574 -22.238 -9.724 1.00 12.11 O ATOM 0 H GLU A 36 -15.187 -20.436 -4.866 1.00 60.44 H new ATOM 0 HA GLU A 36 -13.862 -18.339 -6.463 1.00 24.01 H new ATOM 0 HB2 GLU A 36 -15.490 -20.617 -7.642 1.00 61.34 H new ATOM 0 HB3 GLU A 36 -15.288 -19.078 -8.456 1.00 61.34 H new ATOM 0 HG2 GLU A 36 -12.819 -19.403 -8.477 1.00 64.35 H new ATOM 0 HG3 GLU A 36 -13.005 -20.929 -7.637 1.00 64.35 H new ATOM 555 N SER A 37 -15.829 -17.036 -5.552 1.00 43.32 N ATOM 556 CA SER A 37 -16.951 -16.161 -5.175 1.00 4.23 C ATOM 557 C SER A 37 -17.788 -15.769 -6.413 1.00 44.41 C ATOM 558 O SER A 37 -17.373 -14.916 -7.209 1.00 12.32 O ATOM 559 CB SER A 37 -16.411 -14.900 -4.465 1.00 10.40 C ATOM 560 OG SER A 37 -15.659 -15.243 -3.316 1.00 64.42 O ATOM 0 H SER A 37 -14.917 -16.593 -5.442 1.00 43.32 H new ATOM 0 HA SER A 37 -17.603 -16.705 -4.491 1.00 4.23 H new ATOM 0 HB2 SER A 37 -15.788 -14.330 -5.154 1.00 10.40 H new ATOM 0 HB3 SER A 37 -17.243 -14.256 -4.180 1.00 10.40 H new ATOM 0 HG SER A 37 -15.327 -14.427 -2.886 1.00 64.42 H new ATOM 566 N ASP A 38 -18.950 -16.434 -6.584 1.00 61.11 N ATOM 567 CA ASP A 38 -19.877 -16.190 -7.714 1.00 24.03 C ATOM 568 C ASP A 38 -20.802 -15.000 -7.404 1.00 52.12 C ATOM 569 O ASP A 38 -21.242 -14.284 -8.314 1.00 63.05 O ATOM 570 CB ASP A 38 -20.721 -17.464 -8.018 1.00 13.44 C ATOM 571 CG ASP A 38 -21.816 -17.771 -6.970 1.00 2.20 C ATOM 572 OD1 ASP A 38 -21.473 -18.005 -5.792 1.00 33.42 O ATOM 573 OD2 ASP A 38 -23.022 -17.787 -7.321 1.00 52.55 O ATOM 0 H ASP A 38 -19.274 -17.157 -5.942 1.00 61.11 H new ATOM 0 HA ASP A 38 -19.284 -15.950 -8.596 1.00 24.03 H new ATOM 0 HB2 ASP A 38 -21.192 -17.348 -8.994 1.00 13.44 H new ATOM 0 HB3 ASP A 38 -20.051 -18.321 -8.087 1.00 13.44 H new ATOM 578 N SER A 39 -21.123 -14.839 -6.102 1.00 25.33 N ATOM 579 CA SER A 39 -21.957 -13.744 -5.600 1.00 34.24 C ATOM 580 C SER A 39 -21.162 -12.419 -5.643 1.00 43.14 C ATOM 581 O SER A 39 -19.958 -12.425 -5.349 1.00 12.43 O ATOM 582 CB SER A 39 -22.438 -14.051 -4.156 1.00 70.42 C ATOM 583 OG SER A 39 -21.344 -14.231 -3.266 1.00 32.41 O ATOM 0 H SER A 39 -20.804 -15.474 -5.370 1.00 25.33 H new ATOM 0 HA SER A 39 -22.837 -13.644 -6.236 1.00 34.24 H new ATOM 0 HB2 SER A 39 -23.066 -13.235 -3.800 1.00 70.42 H new ATOM 0 HB3 SER A 39 -23.055 -14.949 -4.161 1.00 70.42 H new ATOM 0 HG SER A 39 -21.682 -14.421 -2.366 1.00 32.41 H new ATOM 589 N PRO A 40 -21.819 -11.279 -6.036 1.00 24.13 N ATOM 590 CA PRO A 40 -21.170 -9.948 -6.063 1.00 22.44 C ATOM 591 C PRO A 40 -20.576 -9.533 -4.694 1.00 32.32 C ATOM 592 O PRO A 40 -21.158 -9.834 -3.646 1.00 51.45 O ATOM 593 CB PRO A 40 -22.317 -8.999 -6.472 1.00 70.42 C ATOM 594 CG PRO A 40 -23.308 -9.853 -7.185 1.00 54.21 C ATOM 595 CD PRO A 40 -23.234 -11.201 -6.508 1.00 10.33 C ATOM 0 HA PRO A 40 -20.318 -9.931 -6.743 1.00 22.44 H new ATOM 0 HB2 PRO A 40 -22.764 -8.525 -5.598 1.00 70.42 H new ATOM 0 HB3 PRO A 40 -21.953 -8.199 -7.117 1.00 70.42 H new ATOM 0 HG2 PRO A 40 -24.311 -9.433 -7.115 1.00 54.21 H new ATOM 0 HG3 PRO A 40 -23.068 -9.932 -8.245 1.00 54.21 H new ATOM 0 HD2 PRO A 40 -23.938 -11.273 -5.679 1.00 10.33 H new ATOM 0 HD3 PRO A 40 -23.472 -12.010 -7.199 1.00 10.33 H new ATOM 603 N ILE A 41 -19.411 -8.859 -4.734 1.00 3.14 N ATOM 604 CA ILE A 41 -18.697 -8.398 -3.532 1.00 14.13 C ATOM 605 C ILE A 41 -19.012 -6.893 -3.315 1.00 62.43 C ATOM 606 O ILE A 41 -18.531 -6.047 -4.086 1.00 23.15 O ATOM 607 CB ILE A 41 -17.126 -8.621 -3.638 1.00 33.41 C ATOM 608 CG1 ILE A 41 -16.731 -10.136 -3.894 1.00 23.54 C ATOM 609 CG2 ILE A 41 -16.405 -8.075 -2.374 1.00 34.32 C ATOM 610 CD1 ILE A 41 -16.945 -10.653 -5.320 1.00 34.12 C ATOM 0 H ILE A 41 -18.938 -8.619 -5.605 1.00 3.14 H new ATOM 0 HA ILE A 41 -19.040 -8.988 -2.682 1.00 14.13 H new ATOM 0 HB ILE A 41 -16.792 -8.059 -4.510 1.00 33.41 H new ATOM 0 HG12 ILE A 41 -15.680 -10.266 -3.635 1.00 23.54 H new ATOM 0 HG13 ILE A 41 -17.307 -10.761 -3.212 1.00 23.54 H new ATOM 0 HG21 ILE A 41 -15.331 -8.238 -2.468 1.00 34.32 H new ATOM 0 HG22 ILE A 41 -16.602 -7.008 -2.275 1.00 34.32 H new ATOM 0 HG23 ILE A 41 -16.775 -8.596 -1.491 1.00 34.32 H new ATOM 0 HD11 ILE A 41 -16.641 -11.698 -5.377 1.00 34.12 H new ATOM 0 HD12 ILE A 41 -17.999 -10.566 -5.584 1.00 34.12 H new ATOM 0 HD13 ILE A 41 -16.347 -10.063 -6.015 1.00 34.12 H new ATOM 622 N PRO A 42 -19.869 -6.534 -2.300 1.00 60.31 N ATOM 623 CA PRO A 42 -20.142 -5.126 -1.932 1.00 1.24 C ATOM 624 C PRO A 42 -18.967 -4.528 -1.115 1.00 22.24 C ATOM 625 O PRO A 42 -18.548 -5.106 -0.107 1.00 15.44 O ATOM 626 CB PRO A 42 -21.461 -5.213 -1.093 1.00 63.22 C ATOM 627 CG PRO A 42 -21.924 -6.645 -1.207 1.00 32.33 C ATOM 628 CD PRO A 42 -20.670 -7.450 -1.449 1.00 74.31 C ATOM 0 HA PRO A 42 -20.247 -4.468 -2.795 1.00 1.24 H new ATOM 0 HB2 PRO A 42 -21.282 -4.941 -0.053 1.00 63.22 H new ATOM 0 HB3 PRO A 42 -22.215 -4.526 -1.477 1.00 63.22 H new ATOM 0 HG2 PRO A 42 -22.430 -6.969 -0.297 1.00 32.33 H new ATOM 0 HG3 PRO A 42 -22.633 -6.765 -2.026 1.00 32.33 H new ATOM 0 HD2 PRO A 42 -20.157 -7.694 -0.519 1.00 74.31 H new ATOM 0 HD3 PRO A 42 -20.882 -8.393 -1.953 1.00 74.31 H new ATOM 636 N LEU A 43 -18.444 -3.376 -1.570 1.00 61.23 N ATOM 637 CA LEU A 43 -17.262 -2.709 -0.977 1.00 61.55 C ATOM 638 C LEU A 43 -17.679 -1.371 -0.306 1.00 13.41 C ATOM 639 O LEU A 43 -17.769 -0.341 -0.987 1.00 11.42 O ATOM 640 CB LEU A 43 -16.188 -2.481 -2.082 1.00 63.33 C ATOM 641 CG LEU A 43 -15.629 -3.772 -2.778 1.00 53.01 C ATOM 642 CD1 LEU A 43 -14.758 -3.421 -4.003 1.00 62.20 C ATOM 643 CD2 LEU A 43 -14.858 -4.662 -1.769 1.00 61.43 C ATOM 0 H LEU A 43 -18.831 -2.873 -2.368 1.00 61.23 H new ATOM 0 HA LEU A 43 -16.832 -3.345 -0.203 1.00 61.55 H new ATOM 0 HB2 LEU A 43 -16.616 -1.836 -2.849 1.00 63.33 H new ATOM 0 HB3 LEU A 43 -15.351 -1.939 -1.641 1.00 63.33 H new ATOM 0 HG LEU A 43 -16.481 -4.347 -3.141 1.00 53.01 H new ATOM 0 HD11 LEU A 43 -14.387 -4.338 -4.461 1.00 62.20 H new ATOM 0 HD12 LEU A 43 -15.356 -2.869 -4.728 1.00 62.20 H new ATOM 0 HD13 LEU A 43 -13.915 -2.807 -3.686 1.00 62.20 H new ATOM 0 HD21 LEU A 43 -14.482 -5.549 -2.279 1.00 61.43 H new ATOM 0 HD22 LEU A 43 -14.021 -4.100 -1.354 1.00 61.43 H new ATOM 0 HD23 LEU A 43 -15.528 -4.963 -0.964 1.00 61.43 H new ATOM 655 N PRO A 44 -17.966 -1.369 1.042 1.00 40.22 N ATOM 656 CA PRO A 44 -18.435 -0.165 1.773 1.00 25.43 C ATOM 657 C PRO A 44 -17.268 0.759 2.206 1.00 13.35 C ATOM 658 O PRO A 44 -16.950 0.879 3.400 1.00 22.11 O ATOM 659 CB PRO A 44 -19.190 -0.792 2.976 1.00 71.30 C ATOM 660 CG PRO A 44 -18.426 -2.053 3.286 1.00 3.35 C ATOM 661 CD PRO A 44 -17.862 -2.548 1.957 1.00 74.23 C ATOM 0 HA PRO A 44 -19.058 0.497 1.172 1.00 25.43 H new ATOM 0 HB2 PRO A 44 -19.204 -0.116 3.831 1.00 71.30 H new ATOM 0 HB3 PRO A 44 -20.228 -1.009 2.724 1.00 71.30 H new ATOM 0 HG2 PRO A 44 -17.626 -1.857 4.000 1.00 3.35 H new ATOM 0 HG3 PRO A 44 -19.078 -2.802 3.735 1.00 3.35 H new ATOM 0 HD2 PRO A 44 -16.829 -2.878 2.063 1.00 74.23 H new ATOM 0 HD3 PRO A 44 -18.430 -3.397 1.576 1.00 74.23 H new ATOM 669 N ASN A 45 -16.642 1.398 1.208 1.00 64.13 N ATOM 670 CA ASN A 45 -15.528 2.346 1.416 1.00 14.32 C ATOM 671 C ASN A 45 -15.288 3.120 0.115 1.00 64.10 C ATOM 672 O ASN A 45 -15.546 4.326 0.038 1.00 33.41 O ATOM 673 CB ASN A 45 -14.231 1.601 1.866 1.00 52.01 C ATOM 674 CG ASN A 45 -13.005 2.517 2.018 1.00 5.32 C ATOM 675 OD1 ASN A 45 -12.231 2.707 1.075 1.00 5.22 O ATOM 676 ND2 ASN A 45 -12.811 3.080 3.201 1.00 43.45 N ATOM 0 H ASN A 45 -16.892 1.274 0.227 1.00 64.13 H new ATOM 0 HA ASN A 45 -15.792 3.042 2.212 1.00 14.32 H new ATOM 0 HB2 ASN A 45 -14.421 1.104 2.818 1.00 52.01 H new ATOM 0 HB3 ASN A 45 -14.001 0.821 1.140 1.00 52.01 H new ATOM 0 HD21 ASN A 45 -12.006 3.688 3.351 1.00 43.45 H new ATOM 0 HD22 ASN A 45 -13.467 2.905 3.963 1.00 43.45 H new ATOM 683 N VAL A 46 -14.832 2.390 -0.916 1.00 31.34 N ATOM 684 CA VAL A 46 -14.470 2.971 -2.217 1.00 63.12 C ATOM 685 C VAL A 46 -15.742 3.352 -3.017 1.00 53.14 C ATOM 686 O VAL A 46 -16.625 2.514 -3.227 1.00 33.21 O ATOM 687 CB VAL A 46 -13.540 1.986 -3.031 1.00 70.12 C ATOM 688 CG1 VAL A 46 -14.189 0.591 -3.244 1.00 32.43 C ATOM 689 CG2 VAL A 46 -13.097 2.619 -4.373 1.00 1.33 C ATOM 0 H VAL A 46 -14.704 1.379 -0.870 1.00 31.34 H new ATOM 0 HA VAL A 46 -13.904 3.886 -2.044 1.00 63.12 H new ATOM 0 HB VAL A 46 -12.649 1.820 -2.426 1.00 70.12 H new ATOM 0 HG11 VAL A 46 -13.507 -0.045 -3.809 1.00 32.43 H new ATOM 0 HG12 VAL A 46 -14.394 0.134 -2.276 1.00 32.43 H new ATOM 0 HG13 VAL A 46 -15.121 0.704 -3.797 1.00 32.43 H new ATOM 0 HG21 VAL A 46 -12.458 1.919 -4.912 1.00 1.33 H new ATOM 0 HG22 VAL A 46 -13.976 2.846 -4.976 1.00 1.33 H new ATOM 0 HG23 VAL A 46 -12.544 3.538 -4.177 1.00 1.33 H new ATOM 699 N THR A 47 -15.835 4.633 -3.432 1.00 65.04 N ATOM 700 CA THR A 47 -16.985 5.162 -4.202 1.00 73.32 C ATOM 701 C THR A 47 -16.980 4.611 -5.631 1.00 13.24 C ATOM 702 O THR A 47 -15.983 4.053 -6.070 1.00 11.10 O ATOM 703 CB THR A 47 -16.953 6.721 -4.247 1.00 42.23 C ATOM 704 OG1 THR A 47 -15.760 7.155 -4.913 1.00 52.22 O ATOM 705 CG2 THR A 47 -17.005 7.330 -2.838 1.00 42.22 C ATOM 0 H THR A 47 -15.116 5.331 -3.244 1.00 65.04 H new ATOM 0 HA THR A 47 -17.896 4.840 -3.698 1.00 73.32 H new ATOM 0 HB THR A 47 -17.834 7.061 -4.792 1.00 42.23 H new ATOM 0 HG1 THR A 47 -15.740 8.134 -4.943 1.00 52.22 H new ATOM 0 HG21 THR A 47 -16.981 8.417 -2.910 1.00 42.22 H new ATOM 0 HG22 THR A 47 -17.924 7.020 -2.341 1.00 42.22 H new ATOM 0 HG23 THR A 47 -16.147 6.986 -2.261 1.00 42.22 H new ATOM 713 N SER A 48 -18.095 4.797 -6.356 1.00 15.41 N ATOM 714 CA SER A 48 -18.262 4.269 -7.720 1.00 75.24 C ATOM 715 C SER A 48 -17.303 4.946 -8.708 1.00 73.24 C ATOM 716 O SER A 48 -16.765 4.290 -9.594 1.00 41.13 O ATOM 717 CB SER A 48 -19.717 4.456 -8.181 1.00 52.30 C ATOM 718 OG SER A 48 -20.089 5.820 -8.149 1.00 1.43 O ATOM 0 H SER A 48 -18.904 5.316 -6.014 1.00 15.41 H new ATOM 0 HA SER A 48 -18.022 3.206 -7.700 1.00 75.24 H new ATOM 0 HB2 SER A 48 -19.834 4.067 -9.193 1.00 52.30 H new ATOM 0 HB3 SER A 48 -20.382 3.879 -7.539 1.00 52.30 H new ATOM 0 HG SER A 48 -20.035 6.195 -9.053 1.00 1.43 H new ATOM 724 N THR A 49 -17.108 6.263 -8.527 1.00 75.13 N ATOM 725 CA THR A 49 -16.244 7.084 -9.388 1.00 2.33 C ATOM 726 C THR A 49 -14.774 6.621 -9.291 1.00 12.44 C ATOM 727 O THR A 49 -14.104 6.412 -10.310 1.00 75.30 O ATOM 728 CB THR A 49 -16.351 8.589 -8.976 1.00 74.42 C ATOM 729 OG1 THR A 49 -17.735 8.958 -8.853 1.00 75.30 O ATOM 730 CG2 THR A 49 -15.669 9.526 -9.988 1.00 10.31 C ATOM 0 H THR A 49 -17.549 6.790 -7.773 1.00 75.13 H new ATOM 0 HA THR A 49 -16.578 6.966 -10.419 1.00 2.33 H new ATOM 0 HB THR A 49 -15.836 8.699 -8.022 1.00 74.42 H new ATOM 0 HG1 THR A 49 -17.800 9.901 -8.593 1.00 75.30 H new ATOM 0 HG21 THR A 49 -15.772 10.559 -9.655 1.00 10.31 H new ATOM 0 HG22 THR A 49 -14.611 9.273 -10.063 1.00 10.31 H new ATOM 0 HG23 THR A 49 -16.139 9.411 -10.965 1.00 10.31 H new ATOM 738 N ILE A 50 -14.311 6.436 -8.043 1.00 2.30 N ATOM 739 CA ILE A 50 -12.934 6.022 -7.746 1.00 35.21 C ATOM 740 C ILE A 50 -12.718 4.548 -8.142 1.00 23.33 C ATOM 741 O ILE A 50 -11.738 4.232 -8.805 1.00 73.35 O ATOM 742 CB ILE A 50 -12.589 6.255 -6.225 1.00 73.54 C ATOM 743 CG1 ILE A 50 -12.732 7.768 -5.855 1.00 35.32 C ATOM 744 CG2 ILE A 50 -11.176 5.729 -5.860 1.00 2.23 C ATOM 745 CD1 ILE A 50 -11.819 8.718 -6.619 1.00 23.51 C ATOM 0 H ILE A 50 -14.885 6.571 -7.211 1.00 2.30 H new ATOM 0 HA ILE A 50 -12.257 6.638 -8.337 1.00 35.21 H new ATOM 0 HB ILE A 50 -13.306 5.682 -5.637 1.00 73.54 H new ATOM 0 HG12 ILE A 50 -13.766 8.070 -6.025 1.00 35.32 H new ATOM 0 HG13 ILE A 50 -12.537 7.884 -4.789 1.00 35.32 H new ATOM 0 HG21 ILE A 50 -10.982 5.911 -4.803 1.00 2.23 H new ATOM 0 HG22 ILE A 50 -11.123 4.659 -6.060 1.00 2.23 H new ATOM 0 HG23 ILE A 50 -10.428 6.247 -6.461 1.00 2.23 H new ATOM 0 HD11 ILE A 50 -11.998 9.741 -6.287 1.00 23.51 H new ATOM 0 HD12 ILE A 50 -10.779 8.453 -6.431 1.00 23.51 H new ATOM 0 HD13 ILE A 50 -12.026 8.642 -7.686 1.00 23.51 H new ATOM 757 N LEU A 51 -13.679 3.673 -7.761 1.00 55.41 N ATOM 758 CA LEU A 51 -13.633 2.221 -8.057 1.00 41.14 C ATOM 759 C LEU A 51 -13.587 1.980 -9.571 1.00 24.52 C ATOM 760 O LEU A 51 -12.866 1.098 -10.034 1.00 1.22 O ATOM 761 CB LEU A 51 -14.858 1.478 -7.438 1.00 74.23 C ATOM 762 CG LEU A 51 -14.852 -0.085 -7.547 1.00 40.13 C ATOM 763 CD1 LEU A 51 -13.614 -0.700 -6.854 1.00 73.51 C ATOM 764 CD2 LEU A 51 -16.162 -0.695 -6.993 1.00 24.10 C ATOM 0 H LEU A 51 -14.509 3.954 -7.239 1.00 55.41 H new ATOM 0 HA LEU A 51 -12.725 1.821 -7.605 1.00 41.14 H new ATOM 0 HB2 LEU A 51 -14.924 1.747 -6.384 1.00 74.23 H new ATOM 0 HB3 LEU A 51 -15.762 1.851 -7.919 1.00 74.23 H new ATOM 0 HG LEU A 51 -14.792 -0.334 -8.607 1.00 40.13 H new ATOM 0 HD11 LEU A 51 -13.645 -1.785 -6.950 1.00 73.51 H new ATOM 0 HD12 LEU A 51 -12.707 -0.319 -7.324 1.00 73.51 H new ATOM 0 HD13 LEU A 51 -13.616 -0.429 -5.798 1.00 73.51 H new ATOM 0 HD21 LEU A 51 -16.125 -1.781 -7.084 1.00 24.10 H new ATOM 0 HD22 LEU A 51 -16.275 -0.422 -5.944 1.00 24.10 H new ATOM 0 HD23 LEU A 51 -17.010 -0.312 -7.561 1.00 24.10 H new ATOM 776 N GLU A 52 -14.339 2.812 -10.323 1.00 61.13 N ATOM 777 CA GLU A 52 -14.385 2.756 -11.791 1.00 54.43 C ATOM 778 C GLU A 52 -12.981 2.956 -12.369 1.00 2.31 C ATOM 779 O GLU A 52 -12.516 2.141 -13.157 1.00 52.53 O ATOM 780 CB GLU A 52 -15.345 3.835 -12.355 1.00 4.42 C ATOM 781 CG GLU A 52 -15.543 3.769 -13.883 1.00 34.24 C ATOM 782 CD GLU A 52 -16.546 4.806 -14.401 1.00 5.30 C ATOM 783 OE1 GLU A 52 -16.129 5.930 -14.747 1.00 34.24 O ATOM 784 OE2 GLU A 52 -17.761 4.503 -14.460 1.00 71.45 O ATOM 0 H GLU A 52 -14.930 3.541 -9.924 1.00 61.13 H new ATOM 0 HA GLU A 52 -14.758 1.775 -12.083 1.00 54.43 H new ATOM 0 HB2 GLU A 52 -16.315 3.731 -11.869 1.00 4.42 H new ATOM 0 HB3 GLU A 52 -14.961 4.820 -12.092 1.00 4.42 H new ATOM 0 HG2 GLU A 52 -14.583 3.922 -14.375 1.00 34.24 H new ATOM 0 HG3 GLU A 52 -15.886 2.771 -14.157 1.00 34.24 H new ATOM 791 N LYS A 53 -12.313 4.029 -11.914 1.00 11.54 N ATOM 792 CA LYS A 53 -10.973 4.410 -12.389 1.00 31.51 C ATOM 793 C LYS A 53 -9.906 3.365 -12.010 1.00 44.53 C ATOM 794 O LYS A 53 -9.107 2.959 -12.855 1.00 5.50 O ATOM 795 CB LYS A 53 -10.579 5.797 -11.829 1.00 14.52 C ATOM 796 CG LYS A 53 -11.416 6.973 -12.377 1.00 41.14 C ATOM 797 CD LYS A 53 -10.863 8.340 -11.928 1.00 31.51 C ATOM 798 CE LYS A 53 -9.432 8.616 -12.440 1.00 30.22 C ATOM 799 NZ LYS A 53 -9.368 8.669 -13.924 1.00 33.01 N ATOM 0 H LYS A 53 -12.688 4.658 -11.204 1.00 11.54 H new ATOM 0 HA LYS A 53 -11.016 4.457 -13.477 1.00 31.51 H new ATOM 0 HB2 LYS A 53 -10.673 5.776 -10.743 1.00 14.52 H new ATOM 0 HB3 LYS A 53 -9.528 5.980 -12.054 1.00 14.52 H new ATOM 0 HG2 LYS A 53 -11.432 6.929 -13.466 1.00 41.14 H new ATOM 0 HG3 LYS A 53 -12.447 6.871 -12.039 1.00 41.14 H new ATOM 0 HD2 LYS A 53 -11.527 9.128 -12.283 1.00 31.51 H new ATOM 0 HD3 LYS A 53 -10.867 8.386 -10.839 1.00 31.51 H new ATOM 0 HE2 LYS A 53 -9.076 9.561 -12.029 1.00 30.22 H new ATOM 0 HE3 LYS A 53 -8.761 7.837 -12.077 1.00 30.22 H new ATOM 0 HZ1 LYS A 53 -8.404 8.923 -14.221 1.00 33.01 H new ATOM 0 HZ2 LYS A 53 -9.617 7.738 -14.316 1.00 33.01 H new ATOM 0 HZ3 LYS A 53 -10.038 9.383 -14.275 1.00 33.01 H new ATOM 813 N VAL A 54 -9.919 2.946 -10.730 1.00 23.02 N ATOM 814 CA VAL A 54 -8.926 2.015 -10.165 1.00 3.30 C ATOM 815 C VAL A 54 -8.976 0.658 -10.900 1.00 65.13 C ATOM 816 O VAL A 54 -7.931 0.134 -11.311 1.00 24.03 O ATOM 817 CB VAL A 54 -9.147 1.835 -8.607 1.00 73.53 C ATOM 818 CG1 VAL A 54 -8.234 0.737 -8.017 1.00 62.03 C ATOM 819 CG2 VAL A 54 -8.920 3.176 -7.859 1.00 32.33 C ATOM 0 H VAL A 54 -10.623 3.246 -10.056 1.00 23.02 H new ATOM 0 HA VAL A 54 -7.932 2.439 -10.311 1.00 3.30 H new ATOM 0 HB VAL A 54 -10.181 1.520 -8.466 1.00 73.53 H new ATOM 0 HG11 VAL A 54 -8.418 0.647 -6.946 1.00 62.03 H new ATOM 0 HG12 VAL A 54 -8.448 -0.215 -8.503 1.00 62.03 H new ATOM 0 HG13 VAL A 54 -7.190 1.003 -8.184 1.00 62.03 H new ATOM 0 HG21 VAL A 54 -9.077 3.028 -6.791 1.00 32.33 H new ATOM 0 HG22 VAL A 54 -7.900 3.521 -8.031 1.00 32.33 H new ATOM 0 HG23 VAL A 54 -9.623 3.923 -8.229 1.00 32.33 H new ATOM 829 N LEU A 55 -10.201 0.128 -11.097 1.00 1.31 N ATOM 830 CA LEU A 55 -10.420 -1.136 -11.826 1.00 74.11 C ATOM 831 C LEU A 55 -10.027 -0.991 -13.314 1.00 63.44 C ATOM 832 O LEU A 55 -9.349 -1.863 -13.856 1.00 73.24 O ATOM 833 CB LEU A 55 -11.895 -1.610 -11.722 1.00 21.31 C ATOM 834 CG LEU A 55 -12.415 -2.018 -10.306 1.00 31.43 C ATOM 835 CD1 LEU A 55 -13.882 -2.489 -10.386 1.00 20.30 C ATOM 836 CD2 LEU A 55 -11.507 -3.084 -9.639 1.00 72.30 C ATOM 0 H LEU A 55 -11.060 0.561 -10.757 1.00 1.31 H new ATOM 0 HA LEU A 55 -9.783 -1.887 -11.359 1.00 74.11 H new ATOM 0 HB2 LEU A 55 -12.534 -0.812 -12.100 1.00 21.31 H new ATOM 0 HB3 LEU A 55 -12.024 -2.463 -12.388 1.00 21.31 H new ATOM 0 HG LEU A 55 -12.376 -1.135 -9.668 1.00 31.43 H new ATOM 0 HD11 LEU A 55 -14.229 -2.770 -9.391 1.00 20.30 H new ATOM 0 HD12 LEU A 55 -14.503 -1.681 -10.772 1.00 20.30 H new ATOM 0 HD13 LEU A 55 -13.952 -3.350 -11.051 1.00 20.30 H new ATOM 0 HD21 LEU A 55 -11.906 -3.338 -8.657 1.00 72.30 H new ATOM 0 HD22 LEU A 55 -11.478 -3.978 -10.262 1.00 72.30 H new ATOM 0 HD23 LEU A 55 -10.498 -2.686 -9.529 1.00 72.30 H new ATOM 848 N ASP A 56 -10.444 0.135 -13.936 1.00 72.21 N ATOM 849 CA ASP A 56 -10.229 0.420 -15.382 1.00 62.42 C ATOM 850 C ASP A 56 -8.727 0.482 -15.717 1.00 55.42 C ATOM 851 O ASP A 56 -8.292 0.006 -16.777 1.00 0.52 O ATOM 852 CB ASP A 56 -10.940 1.748 -15.776 1.00 53.53 C ATOM 853 CG ASP A 56 -10.895 2.052 -17.286 1.00 61.41 C ATOM 854 OD1 ASP A 56 -11.586 1.356 -18.053 1.00 62.30 O ATOM 855 OD2 ASP A 56 -10.195 2.996 -17.707 1.00 22.42 O ATOM 0 H ASP A 56 -10.943 0.880 -13.449 1.00 72.21 H new ATOM 0 HA ASP A 56 -10.663 -0.394 -15.962 1.00 62.42 H new ATOM 0 HB2 ASP A 56 -11.981 1.701 -15.455 1.00 53.53 H new ATOM 0 HB3 ASP A 56 -10.476 2.572 -15.235 1.00 53.53 H new ATOM 860 N TYR A 57 -7.947 1.049 -14.782 1.00 1.51 N ATOM 861 CA TYR A 57 -6.482 1.099 -14.875 1.00 3.01 C ATOM 862 C TYR A 57 -5.903 -0.318 -14.775 1.00 22.53 C ATOM 863 O TYR A 57 -5.018 -0.692 -15.554 1.00 52.21 O ATOM 864 CB TYR A 57 -5.891 2.002 -13.759 1.00 73.45 C ATOM 865 CG TYR A 57 -4.350 2.088 -13.770 1.00 73.20 C ATOM 866 CD1 TYR A 57 -3.565 1.153 -13.074 1.00 4.05 C ATOM 867 CD2 TYR A 57 -3.686 3.078 -14.493 1.00 43.34 C ATOM 868 CE1 TYR A 57 -2.189 1.205 -13.103 1.00 41.02 C ATOM 869 CE2 TYR A 57 -2.309 3.138 -14.520 1.00 64.22 C ATOM 870 CZ TYR A 57 -1.565 2.199 -13.827 1.00 31.01 C ATOM 871 OH TYR A 57 -0.191 2.248 -13.875 1.00 44.25 O ATOM 0 H TYR A 57 -8.318 1.486 -13.938 1.00 1.51 H new ATOM 0 HA TYR A 57 -6.210 1.527 -15.840 1.00 3.01 H new ATOM 0 HB2 TYR A 57 -6.301 3.006 -13.864 1.00 73.45 H new ATOM 0 HB3 TYR A 57 -6.216 1.624 -12.790 1.00 73.45 H new ATOM 0 HD1 TYR A 57 -4.052 0.376 -12.503 1.00 4.05 H new ATOM 0 HD2 TYR A 57 -4.260 3.810 -15.041 1.00 43.34 H new ATOM 0 HE1 TYR A 57 -1.604 0.474 -12.564 1.00 41.02 H new ATOM 0 HE2 TYR A 57 -1.812 3.916 -15.081 1.00 64.22 H new ATOM 0 HH TYR A 57 0.090 3.007 -14.427 1.00 44.25 H new ATOM 881 N CYS A 58 -6.405 -1.087 -13.786 1.00 2.25 N ATOM 882 CA CYS A 58 -5.961 -2.466 -13.533 1.00 14.53 C ATOM 883 C CYS A 58 -6.213 -3.371 -14.755 1.00 42.12 C ATOM 884 O CYS A 58 -5.442 -4.305 -14.997 1.00 33.32 O ATOM 885 CB CYS A 58 -6.651 -3.031 -12.273 1.00 21.52 C ATOM 886 SG CYS A 58 -6.184 -2.167 -10.759 1.00 64.41 S ATOM 0 H CYS A 58 -7.129 -0.766 -13.143 1.00 2.25 H new ATOM 0 HA CYS A 58 -4.885 -2.448 -13.358 1.00 14.53 H new ATOM 0 HB2 CYS A 58 -7.732 -2.970 -12.400 1.00 21.52 H new ATOM 0 HB3 CYS A 58 -6.401 -4.087 -12.173 1.00 21.52 H new ATOM 0 HG CYS A 58 -6.803 -1.025 -10.702 1.00 64.41 H new ATOM 892 N ARG A 59 -7.292 -3.079 -15.523 1.00 74.20 N ATOM 893 CA ARG A 59 -7.605 -3.808 -16.769 1.00 40.35 C ATOM 894 C ARG A 59 -6.462 -3.633 -17.773 1.00 1.35 C ATOM 895 O ARG A 59 -5.999 -4.606 -18.370 1.00 71.21 O ATOM 896 CB ARG A 59 -8.959 -3.357 -17.386 1.00 35.24 C ATOM 897 CG ARG A 59 -10.170 -3.515 -16.438 1.00 25.01 C ATOM 898 CD ARG A 59 -11.522 -3.216 -17.116 1.00 60.04 C ATOM 899 NE ARG A 59 -11.982 -4.335 -17.963 1.00 43.14 N ATOM 900 CZ ARG A 59 -12.236 -4.282 -19.278 1.00 14.35 C ATOM 901 NH1 ARG A 59 -12.074 -3.161 -19.966 1.00 23.54 N ATOM 902 NH2 ARG A 59 -12.670 -5.362 -19.896 1.00 5.43 N ATOM 0 H ARG A 59 -7.959 -2.341 -15.297 1.00 74.20 H new ATOM 0 HA ARG A 59 -7.708 -4.865 -16.523 1.00 40.35 H new ATOM 0 HB2 ARG A 59 -8.879 -2.312 -17.685 1.00 35.24 H new ATOM 0 HB3 ARG A 59 -9.143 -3.934 -18.292 1.00 35.24 H new ATOM 0 HG2 ARG A 59 -10.185 -4.532 -16.047 1.00 25.01 H new ATOM 0 HG3 ARG A 59 -10.044 -2.848 -15.586 1.00 25.01 H new ATOM 0 HD2 ARG A 59 -12.271 -3.009 -16.352 1.00 60.04 H new ATOM 0 HD3 ARG A 59 -11.430 -2.316 -17.724 1.00 60.04 H new ATOM 0 HE ARG A 59 -12.120 -5.235 -17.503 1.00 43.14 H new ATOM 0 HH11 ARG A 59 -11.750 -2.316 -19.495 1.00 23.54 H new ATOM 0 HH12 ARG A 59 -12.273 -3.143 -20.966 1.00 23.54 H new ATOM 0 HH21 ARG A 59 -12.809 -6.227 -19.374 1.00 5.43 H new ATOM 0 HH22 ARG A 59 -12.866 -5.333 -20.896 1.00 5.43 H new ATOM 916 N HIS A 60 -5.974 -2.381 -17.889 1.00 64.35 N ATOM 917 CA HIS A 60 -4.853 -2.033 -18.771 1.00 41.52 C ATOM 918 C HIS A 60 -3.549 -2.703 -18.297 1.00 4.15 C ATOM 919 O HIS A 60 -2.774 -3.212 -19.112 1.00 51.02 O ATOM 920 CB HIS A 60 -4.662 -0.497 -18.854 1.00 1.12 C ATOM 921 CG HIS A 60 -3.568 -0.112 -19.811 1.00 14.41 C ATOM 922 ND1 HIS A 60 -2.302 0.238 -19.411 1.00 72.30 N ATOM 923 CD2 HIS A 60 -3.540 -0.115 -21.163 1.00 13.21 C ATOM 924 CE1 HIS A 60 -1.552 0.420 -20.470 1.00 43.43 C ATOM 925 NE2 HIS A 60 -2.276 0.220 -21.547 1.00 2.30 N ATOM 0 H HIS A 60 -6.350 -1.586 -17.372 1.00 64.35 H new ATOM 0 HA HIS A 60 -5.093 -2.405 -19.767 1.00 41.52 H new ATOM 0 HB2 HIS A 60 -5.597 -0.033 -19.168 1.00 1.12 H new ATOM 0 HB3 HIS A 60 -4.429 -0.107 -17.863 1.00 1.12 H new ATOM 0 HD1 HIS A 60 -1.994 0.340 -18.444 1.00 72.30 H new ATOM 0 HD2 HIS A 60 -4.368 -0.341 -21.819 1.00 13.21 H new ATOM 0 HE1 HIS A 60 -0.507 0.691 -20.459 1.00 43.43 H new ATOM 934 N HIS A 61 -3.333 -2.702 -16.967 1.00 10.12 N ATOM 935 CA HIS A 61 -2.129 -3.274 -16.348 1.00 15.14 C ATOM 936 C HIS A 61 -2.137 -4.821 -16.420 1.00 63.14 C ATOM 937 O HIS A 61 -1.096 -5.458 -16.276 1.00 55.34 O ATOM 938 CB HIS A 61 -1.988 -2.799 -14.878 1.00 20.42 C ATOM 939 CG HIS A 61 -0.671 -3.194 -14.252 1.00 34.12 C ATOM 940 ND1 HIS A 61 -0.459 -4.423 -13.659 1.00 74.00 N ATOM 941 CD2 HIS A 61 0.520 -2.553 -14.215 1.00 73.33 C ATOM 942 CE1 HIS A 61 0.798 -4.516 -13.285 1.00 64.21 C ATOM 943 NE2 HIS A 61 1.412 -3.397 -13.608 1.00 72.21 N ATOM 0 H HIS A 61 -3.990 -2.304 -16.295 1.00 10.12 H new ATOM 0 HA HIS A 61 -1.267 -2.917 -16.912 1.00 15.14 H new ATOM 0 HB2 HIS A 61 -2.090 -1.714 -14.841 1.00 20.42 H new ATOM 0 HB3 HIS A 61 -2.804 -3.216 -14.288 1.00 20.42 H new ATOM 0 HD1 HIS A 61 -1.167 -5.146 -13.531 1.00 74.00 H new ATOM 0 HD2 HIS A 61 0.728 -1.563 -14.593 1.00 73.33 H new ATOM 0 HE1 HIS A 61 1.250 -5.366 -12.796 1.00 64.21 H new ATOM 0 HE2 HIS A 61 2.396 -3.191 -13.434 1.00 72.21 H new ATOM 952 N HIS A 62 -3.321 -5.421 -16.605 1.00 50.34 N ATOM 953 CA HIS A 62 -3.437 -6.874 -16.808 1.00 62.54 C ATOM 954 C HIS A 62 -3.065 -7.234 -18.257 1.00 61.33 C ATOM 955 O HIS A 62 -2.379 -8.234 -18.501 1.00 1.42 O ATOM 956 CB HIS A 62 -4.861 -7.367 -16.477 1.00 72.42 C ATOM 957 CG HIS A 62 -5.048 -8.857 -16.635 1.00 22.14 C ATOM 958 ND1 HIS A 62 -4.677 -9.766 -15.671 1.00 62.03 N ATOM 959 CD2 HIS A 62 -5.541 -9.594 -17.663 1.00 44.31 C ATOM 960 CE1 HIS A 62 -4.932 -10.985 -16.095 1.00 1.31 C ATOM 961 NE2 HIS A 62 -5.457 -10.908 -17.297 1.00 33.20 N ATOM 0 H HIS A 62 -4.212 -4.924 -16.618 1.00 50.34 H new ATOM 0 HA HIS A 62 -2.744 -7.373 -16.130 1.00 62.54 H new ATOM 0 HB2 HIS A 62 -5.102 -7.088 -15.451 1.00 72.42 H new ATOM 0 HB3 HIS A 62 -5.572 -6.852 -17.123 1.00 72.42 H new ATOM 0 HD2 HIS A 62 -5.928 -9.213 -18.597 1.00 44.31 H new ATOM 0 HE1 HIS A 62 -4.742 -11.896 -15.547 1.00 1.31 H new ATOM 0 HE2 HIS A 62 -5.754 -11.701 -17.865 1.00 33.20 H new ATOM 970 N GLN A 63 -3.528 -6.397 -19.204 1.00 41.31 N ATOM 971 CA GLN A 63 -3.237 -6.567 -20.641 1.00 2.50 C ATOM 972 C GLN A 63 -1.753 -6.254 -20.928 1.00 20.51 C ATOM 973 O GLN A 63 -1.160 -6.792 -21.864 1.00 22.42 O ATOM 974 CB GLN A 63 -4.163 -5.656 -21.500 1.00 73.44 C ATOM 975 CG GLN A 63 -5.681 -5.865 -21.282 1.00 44.40 C ATOM 976 CD GLN A 63 -6.146 -7.305 -21.509 1.00 22.24 C ATOM 977 OE1 GLN A 63 -6.188 -8.121 -20.581 1.00 64.10 O ATOM 978 NE2 GLN A 63 -6.506 -7.631 -22.738 1.00 65.43 N ATOM 0 H GLN A 63 -4.112 -5.587 -18.997 1.00 41.31 H new ATOM 0 HA GLN A 63 -3.432 -7.605 -20.912 1.00 2.50 H new ATOM 0 HB2 GLN A 63 -3.922 -4.615 -21.286 1.00 73.44 H new ATOM 0 HB3 GLN A 63 -3.937 -5.825 -22.553 1.00 73.44 H new ATOM 0 HG2 GLN A 63 -5.937 -5.567 -20.265 1.00 44.40 H new ATOM 0 HG3 GLN A 63 -6.229 -5.206 -21.955 1.00 44.40 H new ATOM 0 HE21 GLN A 63 -6.461 -6.937 -23.484 1.00 65.43 H new ATOM 0 HE22 GLN A 63 -6.829 -8.577 -22.941 1.00 65.43 H new ATOM 987 N HIS A 64 -1.164 -5.381 -20.088 1.00 23.43 N ATOM 988 CA HIS A 64 0.267 -5.035 -20.129 1.00 14.24 C ATOM 989 C HIS A 64 0.870 -5.246 -18.721 1.00 1.04 C ATOM 990 O HIS A 64 0.976 -4.285 -17.938 1.00 62.32 O ATOM 991 CB HIS A 64 0.470 -3.570 -20.608 1.00 51.23 C ATOM 992 CG HIS A 64 -0.010 -3.291 -22.009 1.00 64.24 C ATOM 993 ND1 HIS A 64 0.802 -3.387 -23.117 1.00 22.53 N ATOM 994 CD2 HIS A 64 -1.223 -2.910 -22.475 1.00 55.42 C ATOM 995 CE1 HIS A 64 0.114 -3.075 -24.194 1.00 12.41 C ATOM 996 NE2 HIS A 64 -1.119 -2.781 -23.834 1.00 15.44 N ATOM 0 H HIS A 64 -1.676 -4.891 -19.354 1.00 23.43 H new ATOM 0 HA HIS A 64 0.778 -5.681 -20.843 1.00 14.24 H new ATOM 0 HB2 HIS A 64 -0.050 -2.903 -19.921 1.00 51.23 H new ATOM 0 HB3 HIS A 64 1.531 -3.326 -20.547 1.00 51.23 H new ATOM 0 HD2 HIS A 64 -2.110 -2.739 -21.883 1.00 55.42 H new ATOM 0 HE1 HIS A 64 0.496 -3.062 -25.204 1.00 12.41 H new ATOM 0 HE2 HIS A 64 -1.872 -2.503 -24.464 1.00 15.44 H new ATOM 1005 N PRO A 65 1.221 -6.526 -18.352 1.00 40.23 N ATOM 1006 CA PRO A 65 1.719 -6.859 -16.997 1.00 54.25 C ATOM 1007 C PRO A 65 3.167 -6.375 -16.777 1.00 24.00 C ATOM 1008 O PRO A 65 4.131 -7.129 -16.984 1.00 33.13 O ATOM 1009 CB PRO A 65 1.578 -8.404 -16.940 1.00 23.15 C ATOM 1010 CG PRO A 65 1.730 -8.858 -18.368 1.00 2.21 C ATOM 1011 CD PRO A 65 1.156 -7.740 -19.225 1.00 71.45 C ATOM 0 HA PRO A 65 1.164 -6.364 -16.200 1.00 54.25 H new ATOM 0 HB2 PRO A 65 2.341 -8.847 -16.301 1.00 23.15 H new ATOM 0 HB3 PRO A 65 0.611 -8.698 -16.532 1.00 23.15 H new ATOM 0 HG2 PRO A 65 2.777 -9.038 -18.611 1.00 2.21 H new ATOM 0 HG3 PRO A 65 1.198 -9.794 -18.539 1.00 2.21 H new ATOM 0 HD2 PRO A 65 1.735 -7.603 -20.138 1.00 71.45 H new ATOM 0 HD3 PRO A 65 0.131 -7.957 -19.527 1.00 71.45 H new ATOM 1019 N GLY A 66 3.307 -5.096 -16.403 1.00 11.24 N ATOM 1020 CA GLY A 66 4.619 -4.510 -16.159 1.00 21.31 C ATOM 1021 C GLY A 66 4.545 -3.048 -15.754 1.00 23.45 C ATOM 1022 O GLY A 66 4.123 -2.735 -14.635 1.00 35.40 O ATOM 0 H GLY A 66 2.526 -4.454 -16.265 1.00 11.24 H new ATOM 0 HA2 GLY A 66 5.124 -5.074 -15.375 1.00 21.31 H new ATOM 0 HA3 GLY A 66 5.226 -4.602 -17.059 1.00 21.31 H new ATOM 1026 N GLY A 67 4.909 -2.148 -16.687 1.00 2.24 N ATOM 1027 CA GLY A 67 5.085 -0.724 -16.386 1.00 62.53 C ATOM 1028 C GLY A 67 6.548 -0.423 -16.075 1.00 71.22 C ATOM 1029 O GLY A 67 6.952 -0.393 -14.906 1.00 24.13 O ATOM 0 H GLY A 67 5.087 -2.390 -17.662 1.00 2.24 H new ATOM 0 HA2 GLY A 67 4.756 -0.123 -17.234 1.00 62.53 H new ATOM 0 HA3 GLY A 67 4.461 -0.446 -15.537 1.00 62.53 H new ATOM 1033 N SER A 68 7.336 -0.215 -17.137 1.00 35.41 N ATOM 1034 CA SER A 68 8.807 -0.085 -17.065 1.00 61.41 C ATOM 1035 C SER A 68 9.261 1.348 -16.723 1.00 72.42 C ATOM 1036 O SER A 68 10.364 1.552 -16.197 1.00 65.30 O ATOM 1037 CB SER A 68 9.408 -0.510 -18.424 1.00 4.43 C ATOM 1038 OG SER A 68 8.954 -1.795 -18.806 1.00 41.52 O ATOM 0 H SER A 68 6.971 -0.130 -18.086 1.00 35.41 H new ATOM 0 HA SER A 68 9.162 -0.730 -16.261 1.00 61.41 H new ATOM 0 HB2 SER A 68 9.135 0.217 -19.189 1.00 4.43 H new ATOM 0 HB3 SER A 68 10.496 -0.510 -18.359 1.00 4.43 H new ATOM 0 HG SER A 68 9.348 -2.038 -19.670 1.00 41.52 H new ATOM 1044 N GLY A 69 8.418 2.339 -17.052 1.00 41.32 N ATOM 1045 CA GLY A 69 8.785 3.755 -16.975 1.00 24.35 C ATOM 1046 C GLY A 69 9.406 4.233 -18.285 1.00 12.14 C ATOM 1047 O GLY A 69 8.950 5.210 -18.886 1.00 3.50 O ATOM 0 H GLY A 69 7.465 2.178 -17.378 1.00 41.32 H new ATOM 0 HA2 GLY A 69 7.901 4.351 -16.749 1.00 24.35 H new ATOM 0 HA3 GLY A 69 9.490 3.907 -16.158 1.00 24.35 H new ATOM 1051 N LEU A 70 10.436 3.491 -18.749 1.00 33.34 N ATOM 1052 CA LEU A 70 11.152 3.765 -20.016 1.00 55.05 C ATOM 1053 C LEU A 70 10.372 3.260 -21.255 1.00 31.12 C ATOM 1054 O LEU A 70 10.842 3.407 -22.388 1.00 51.42 O ATOM 1055 CB LEU A 70 12.604 3.160 -19.948 1.00 11.31 C ATOM 1056 CG LEU A 70 12.759 1.641 -19.522 1.00 52.05 C ATOM 1057 CD1 LEU A 70 12.311 0.647 -20.622 1.00 54.44 C ATOM 1058 CD2 LEU A 70 14.209 1.338 -19.072 1.00 2.10 C ATOM 0 H LEU A 70 10.797 2.678 -18.250 1.00 33.34 H new ATOM 0 HA LEU A 70 11.230 4.846 -20.135 1.00 55.05 H new ATOM 0 HB2 LEU A 70 13.062 3.280 -20.930 1.00 11.31 H new ATOM 0 HB3 LEU A 70 13.185 3.763 -19.250 1.00 11.31 H new ATOM 0 HG LEU A 70 12.085 1.493 -18.678 1.00 52.05 H new ATOM 0 HD11 LEU A 70 12.443 -0.374 -20.265 1.00 54.44 H new ATOM 0 HD12 LEU A 70 11.260 0.815 -20.859 1.00 54.44 H new ATOM 0 HD13 LEU A 70 12.914 0.799 -21.517 1.00 54.44 H new ATOM 0 HD21 LEU A 70 14.289 0.290 -18.785 1.00 2.10 H new ATOM 0 HD22 LEU A 70 14.895 1.543 -19.894 1.00 2.10 H new ATOM 0 HD23 LEU A 70 14.465 1.968 -18.220 1.00 2.10 H new ATOM 1070 N ASP A 71 9.167 2.686 -21.032 1.00 12.33 N ATOM 1071 CA ASP A 71 8.325 2.095 -22.103 1.00 20.35 C ATOM 1072 C ASP A 71 7.462 3.163 -22.818 1.00 21.30 C ATOM 1073 O ASP A 71 6.502 2.800 -23.509 1.00 13.04 O ATOM 1074 CB ASP A 71 7.407 0.976 -21.506 1.00 13.54 C ATOM 1075 CG ASP A 71 6.373 1.508 -20.487 1.00 75.14 C ATOM 1076 OD1 ASP A 71 6.718 1.632 -19.300 1.00 5.22 O ATOM 1077 OD2 ASP A 71 5.219 1.805 -20.872 1.00 1.01 O ATOM 0 H ASP A 71 8.749 2.619 -20.104 1.00 12.33 H new ATOM 0 HA ASP A 71 8.994 1.662 -22.846 1.00 20.35 H new ATOM 0 HB2 ASP A 71 6.881 0.476 -22.319 1.00 13.54 H new ATOM 0 HB3 ASP A 71 8.031 0.225 -21.021 1.00 13.54 H new ATOM 1082 N ASP A 72 7.806 4.464 -22.602 1.00 41.23 N ATOM 1083 CA ASP A 72 7.106 5.655 -23.154 1.00 74.52 C ATOM 1084 C ASP A 72 5.898 6.059 -22.284 1.00 31.41 C ATOM 1085 O ASP A 72 5.572 7.252 -22.206 1.00 34.14 O ATOM 1086 CB ASP A 72 6.700 5.486 -24.656 1.00 0.23 C ATOM 1087 CG ASP A 72 6.009 6.725 -25.267 1.00 72.10 C ATOM 1088 OD1 ASP A 72 4.771 6.709 -25.459 1.00 2.20 O ATOM 1089 OD2 ASP A 72 6.707 7.720 -25.557 1.00 21.25 O ATOM 0 H ASP A 72 8.604 4.718 -22.020 1.00 41.23 H new ATOM 0 HA ASP A 72 7.828 6.471 -23.123 1.00 74.52 H new ATOM 0 HB2 ASP A 72 7.592 5.257 -25.239 1.00 0.23 H new ATOM 0 HB3 ASP A 72 6.032 4.630 -24.746 1.00 0.23 H new ATOM 1094 N ILE A 73 5.267 5.060 -21.619 1.00 41.10 N ATOM 1095 CA ILE A 73 4.071 5.234 -20.765 1.00 2.33 C ATOM 1096 C ILE A 73 2.864 5.734 -21.608 1.00 34.23 C ATOM 1097 O ILE A 73 2.836 6.899 -22.006 1.00 54.35 O ATOM 1098 CB ILE A 73 4.315 6.179 -19.509 1.00 72.13 C ATOM 1099 CG1 ILE A 73 5.431 5.588 -18.572 1.00 74.32 C ATOM 1100 CG2 ILE A 73 3.002 6.436 -18.712 1.00 55.52 C ATOM 1101 CD1 ILE A 73 5.078 4.265 -17.903 1.00 31.22 C ATOM 0 H ILE A 73 5.584 4.091 -21.664 1.00 41.10 H new ATOM 0 HA ILE A 73 3.842 4.249 -20.358 1.00 2.33 H new ATOM 0 HB ILE A 73 4.658 7.141 -19.889 1.00 72.13 H new ATOM 0 HG12 ILE A 73 6.340 5.450 -19.157 1.00 74.32 H new ATOM 0 HG13 ILE A 73 5.659 6.320 -17.797 1.00 74.32 H new ATOM 0 HG21 ILE A 73 3.213 7.086 -17.863 1.00 55.52 H new ATOM 0 HG22 ILE A 73 2.270 6.915 -19.362 1.00 55.52 H new ATOM 0 HG23 ILE A 73 2.603 5.487 -18.353 1.00 55.52 H new ATOM 0 HD11 ILE A 73 5.910 3.940 -17.278 1.00 31.22 H new ATOM 0 HD12 ILE A 73 4.190 4.395 -17.285 1.00 31.22 H new ATOM 0 HD13 ILE A 73 4.882 3.512 -18.666 1.00 31.22 H new ATOM 1113 N PRO A 74 1.865 4.842 -21.921 1.00 22.42 N ATOM 1114 CA PRO A 74 0.629 5.230 -22.658 1.00 70.22 C ATOM 1115 C PRO A 74 -0.101 6.447 -22.009 1.00 70.05 C ATOM 1116 O PRO A 74 -0.148 6.544 -20.774 1.00 33.43 O ATOM 1117 CB PRO A 74 -0.245 3.941 -22.615 1.00 52.13 C ATOM 1118 CG PRO A 74 0.408 3.046 -21.602 1.00 61.44 C ATOM 1119 CD PRO A 74 1.869 3.392 -21.607 1.00 31.31 C ATOM 0 HA PRO A 74 0.845 5.563 -23.673 1.00 70.22 H new ATOM 0 HB2 PRO A 74 -1.271 4.172 -22.330 1.00 52.13 H new ATOM 0 HB3 PRO A 74 -0.286 3.462 -23.593 1.00 52.13 H new ATOM 0 HG2 PRO A 74 -0.024 3.200 -20.613 1.00 61.44 H new ATOM 0 HG3 PRO A 74 0.257 1.997 -21.856 1.00 61.44 H new ATOM 0 HD2 PRO A 74 2.336 3.189 -20.643 1.00 31.31 H new ATOM 0 HD3 PRO A 74 2.418 2.818 -22.354 1.00 31.31 H new ATOM 1127 N PRO A 75 -0.656 7.395 -22.854 1.00 71.32 N ATOM 1128 CA PRO A 75 -1.292 8.658 -22.377 1.00 50.41 C ATOM 1129 C PRO A 75 -2.335 8.474 -21.255 1.00 24.41 C ATOM 1130 O PRO A 75 -2.424 9.317 -20.372 1.00 71.22 O ATOM 1131 CB PRO A 75 -1.956 9.230 -23.653 1.00 3.50 C ATOM 1132 CG PRO A 75 -1.104 8.717 -24.772 1.00 5.45 C ATOM 1133 CD PRO A 75 -0.687 7.322 -24.347 1.00 75.21 C ATOM 0 HA PRO A 75 -0.548 9.311 -21.920 1.00 50.41 H new ATOM 0 HB2 PRO A 75 -2.988 8.892 -23.751 1.00 3.50 H new ATOM 0 HB3 PRO A 75 -1.978 10.320 -23.636 1.00 3.50 H new ATOM 0 HG2 PRO A 75 -1.658 8.694 -25.710 1.00 5.45 H new ATOM 0 HG3 PRO A 75 -0.236 9.356 -24.931 1.00 5.45 H new ATOM 0 HD2 PRO A 75 -1.395 6.570 -24.696 1.00 75.21 H new ATOM 0 HD3 PRO A 75 0.288 7.055 -24.754 1.00 75.21 H new ATOM 1141 N TYR A 76 -3.110 7.365 -21.300 1.00 71.10 N ATOM 1142 CA TYR A 76 -4.123 7.052 -20.264 1.00 43.24 C ATOM 1143 C TYR A 76 -3.482 6.952 -18.862 1.00 32.42 C ATOM 1144 O TYR A 76 -3.977 7.548 -17.912 1.00 62.45 O ATOM 1145 CB TYR A 76 -4.894 5.729 -20.590 1.00 22.24 C ATOM 1146 CG TYR A 76 -5.722 5.185 -19.401 1.00 21.24 C ATOM 1147 CD1 TYR A 76 -5.292 4.076 -18.655 1.00 30.53 C ATOM 1148 CD2 TYR A 76 -6.890 5.829 -18.986 1.00 24.34 C ATOM 1149 CE1 TYR A 76 -5.992 3.642 -17.551 1.00 30.31 C ATOM 1150 CE2 TYR A 76 -7.595 5.386 -17.889 1.00 33.34 C ATOM 1151 CZ TYR A 76 -7.140 4.298 -17.173 1.00 55.03 C ATOM 1152 OH TYR A 76 -7.838 3.874 -16.064 1.00 55.54 O ATOM 0 H TYR A 76 -3.053 6.670 -22.045 1.00 71.10 H new ATOM 0 HA TYR A 76 -4.837 7.876 -20.265 1.00 43.24 H new ATOM 0 HB2 TYR A 76 -5.560 5.905 -21.435 1.00 22.24 H new ATOM 0 HB3 TYR A 76 -4.178 4.968 -20.901 1.00 22.24 H new ATOM 0 HD1 TYR A 76 -4.395 3.553 -18.953 1.00 30.53 H new ATOM 0 HD2 TYR A 76 -7.246 6.689 -19.534 1.00 24.34 H new ATOM 0 HE1 TYR A 76 -5.641 2.791 -16.985 1.00 30.31 H new ATOM 0 HE2 TYR A 76 -8.502 5.889 -17.590 1.00 33.34 H new ATOM 0 HH TYR A 76 -8.714 3.532 -16.340 1.00 55.54 H new ATOM 1162 N ASP A 77 -2.395 6.176 -18.768 1.00 2.41 N ATOM 1163 CA ASP A 77 -1.735 5.826 -17.486 1.00 70.33 C ATOM 1164 C ASP A 77 -1.038 7.054 -16.864 1.00 25.15 C ATOM 1165 O ASP A 77 -0.935 7.176 -15.639 1.00 74.20 O ATOM 1166 CB ASP A 77 -0.717 4.673 -17.731 1.00 14.41 C ATOM 1167 CG ASP A 77 -1.386 3.369 -18.232 1.00 23.20 C ATOM 1168 OD1 ASP A 77 -1.285 2.318 -17.553 1.00 30.43 O ATOM 1169 OD2 ASP A 77 -2.028 3.398 -19.312 1.00 12.11 O ATOM 0 H ASP A 77 -1.938 5.765 -19.582 1.00 2.41 H new ATOM 0 HA ASP A 77 -2.492 5.492 -16.777 1.00 70.33 H new ATOM 0 HB2 ASP A 77 0.023 4.999 -18.462 1.00 14.41 H new ATOM 0 HB3 ASP A 77 -0.181 4.467 -16.805 1.00 14.41 H new ATOM 1174 N ARG A 78 -0.572 7.948 -17.746 1.00 54.12 N ATOM 1175 CA ARG A 78 0.047 9.235 -17.374 1.00 73.12 C ATOM 1176 C ARG A 78 -1.027 10.220 -16.856 1.00 33.14 C ATOM 1177 O ARG A 78 -0.899 10.811 -15.780 1.00 73.01 O ATOM 1178 CB ARG A 78 0.752 9.816 -18.631 1.00 43.12 C ATOM 1179 CG ARG A 78 1.420 11.200 -18.448 1.00 34.04 C ATOM 1180 CD ARG A 78 1.836 11.821 -19.792 1.00 71.33 C ATOM 1181 NE ARG A 78 0.666 12.005 -20.684 1.00 71.53 N ATOM 1182 CZ ARG A 78 0.717 12.183 -22.014 1.00 53.25 C ATOM 1183 NH1 ARG A 78 1.877 12.215 -22.661 1.00 65.24 N ATOM 1184 NH2 ARG A 78 -0.410 12.334 -22.685 1.00 51.30 N ATOM 0 H ARG A 78 -0.613 7.799 -18.754 1.00 54.12 H new ATOM 0 HA ARG A 78 0.773 9.082 -16.575 1.00 73.12 H new ATOM 0 HB2 ARG A 78 1.512 9.107 -18.959 1.00 43.12 H new ATOM 0 HB3 ARG A 78 0.019 9.891 -19.434 1.00 43.12 H new ATOM 0 HG2 ARG A 78 0.730 11.871 -17.937 1.00 34.04 H new ATOM 0 HG3 ARG A 78 2.297 11.098 -17.809 1.00 34.04 H new ATOM 0 HD2 ARG A 78 2.318 12.783 -19.617 1.00 71.33 H new ATOM 0 HD3 ARG A 78 2.571 11.180 -20.279 1.00 71.33 H new ATOM 0 HE ARG A 78 -0.257 11.996 -20.250 1.00 71.53 H new ATOM 0 HH11 ARG A 78 2.751 12.103 -22.147 1.00 65.24 H new ATOM 0 HH12 ARG A 78 1.894 12.351 -23.672 1.00 65.24 H new ATOM 0 HH21 ARG A 78 -1.303 12.315 -22.193 1.00 51.30 H new ATOM 0 HH22 ARG A 78 -0.388 12.470 -23.696 1.00 51.30 H new ATOM 1198 N ASP A 79 -2.096 10.351 -17.650 1.00 54.44 N ATOM 1199 CA ASP A 79 -3.221 11.280 -17.420 1.00 70.24 C ATOM 1200 C ASP A 79 -4.195 10.769 -16.347 1.00 21.40 C ATOM 1201 O ASP A 79 -5.083 11.511 -15.922 1.00 44.23 O ATOM 1202 CB ASP A 79 -3.945 11.636 -18.744 1.00 71.05 C ATOM 1203 CG ASP A 79 -3.113 12.602 -19.612 1.00 53.04 C ATOM 1204 OD1 ASP A 79 -2.456 12.164 -20.579 1.00 42.15 O ATOM 1205 OD2 ASP A 79 -3.097 13.819 -19.303 1.00 52.11 O ATOM 0 H ASP A 79 -2.211 9.798 -18.499 1.00 54.44 H new ATOM 0 HA ASP A 79 -2.793 12.203 -17.027 1.00 70.24 H new ATOM 0 HB2 ASP A 79 -4.144 10.723 -19.306 1.00 71.05 H new ATOM 0 HB3 ASP A 79 -4.910 12.089 -18.519 1.00 71.05 H new ATOM 1210 N PHE A 80 -4.085 9.477 -15.990 1.00 72.22 N ATOM 1211 CA PHE A 80 -4.822 8.883 -14.855 1.00 5.32 C ATOM 1212 C PHE A 80 -4.590 9.711 -13.564 1.00 13.42 C ATOM 1213 O PHE A 80 -5.506 9.893 -12.744 1.00 61.32 O ATOM 1214 CB PHE A 80 -4.381 7.404 -14.647 1.00 14.22 C ATOM 1215 CG PHE A 80 -5.172 6.684 -13.567 1.00 11.52 C ATOM 1216 CD1 PHE A 80 -6.398 6.102 -13.865 1.00 1.32 C ATOM 1217 CD2 PHE A 80 -4.709 6.617 -12.251 1.00 21.22 C ATOM 1218 CE1 PHE A 80 -7.134 5.479 -12.886 1.00 63.32 C ATOM 1219 CE2 PHE A 80 -5.450 5.991 -11.277 1.00 72.21 C ATOM 1220 CZ PHE A 80 -6.663 5.420 -11.592 1.00 62.01 C ATOM 0 H PHE A 80 -3.484 8.814 -16.479 1.00 72.22 H new ATOM 0 HA PHE A 80 -5.888 8.899 -15.081 1.00 5.32 H new ATOM 0 HB2 PHE A 80 -4.490 6.864 -15.588 1.00 14.22 H new ATOM 0 HB3 PHE A 80 -3.323 7.381 -14.388 1.00 14.22 H new ATOM 0 HD1 PHE A 80 -6.776 6.140 -14.876 1.00 1.32 H new ATOM 0 HD2 PHE A 80 -3.759 7.062 -11.996 1.00 21.22 H new ATOM 0 HE1 PHE A 80 -8.087 5.033 -13.132 1.00 63.32 H new ATOM 0 HE2 PHE A 80 -5.080 5.947 -10.263 1.00 72.21 H new ATOM 0 HZ PHE A 80 -7.244 4.927 -10.827 1.00 62.01 H new ATOM 1230 N CYS A 81 -3.357 10.227 -13.440 1.00 21.41 N ATOM 1231 CA CYS A 81 -2.906 11.056 -12.317 1.00 31.13 C ATOM 1232 C CYS A 81 -3.590 12.445 -12.298 1.00 32.24 C ATOM 1233 O CYS A 81 -3.567 13.126 -11.264 1.00 42.24 O ATOM 1234 CB CYS A 81 -1.378 11.213 -12.415 1.00 34.33 C ATOM 1235 SG CYS A 81 -0.501 9.638 -12.524 1.00 22.53 S ATOM 0 H CYS A 81 -2.629 10.074 -14.138 1.00 21.41 H new ATOM 0 HA CYS A 81 -3.184 10.562 -11.386 1.00 31.13 H new ATOM 0 HB2 CYS A 81 -1.138 11.816 -13.291 1.00 34.33 H new ATOM 0 HB3 CYS A 81 -1.020 11.760 -11.543 1.00 34.33 H new ATOM 0 HG CYS A 81 0.249 9.485 -11.473 1.00 22.53 H new ATOM 1241 N LYS A 82 -4.179 12.865 -13.450 1.00 73.32 N ATOM 1242 CA LYS A 82 -4.878 14.166 -13.580 1.00 55.20 C ATOM 1243 C LYS A 82 -6.244 14.111 -12.869 1.00 21.11 C ATOM 1244 O LYS A 82 -7.285 13.868 -13.489 1.00 3.22 O ATOM 1245 CB LYS A 82 -5.074 14.571 -15.070 1.00 44.25 C ATOM 1246 CG LYS A 82 -3.793 14.598 -15.918 1.00 40.15 C ATOM 1247 CD LYS A 82 -2.743 15.613 -15.421 1.00 74.35 C ATOM 1248 CE LYS A 82 -1.545 15.708 -16.382 1.00 31.10 C ATOM 1249 NZ LYS A 82 -1.965 16.135 -17.746 1.00 50.10 N ATOM 0 H LYS A 82 -4.181 12.313 -14.308 1.00 73.32 H new ATOM 0 HA LYS A 82 -4.251 14.922 -13.107 1.00 55.20 H new ATOM 0 HB2 LYS A 82 -5.779 13.877 -15.528 1.00 44.25 H new ATOM 0 HB3 LYS A 82 -5.533 15.559 -15.103 1.00 44.25 H new ATOM 0 HG2 LYS A 82 -3.350 13.602 -15.923 1.00 40.15 H new ATOM 0 HG3 LYS A 82 -4.055 14.835 -16.949 1.00 40.15 H new ATOM 0 HD2 LYS A 82 -3.206 16.595 -15.318 1.00 74.35 H new ATOM 0 HD3 LYS A 82 -2.393 15.320 -14.431 1.00 74.35 H new ATOM 0 HE2 LYS A 82 -0.817 16.417 -15.987 1.00 31.10 H new ATOM 0 HE3 LYS A 82 -1.048 14.740 -16.441 1.00 31.10 H new ATOM 0 HZ1 LYS A 82 -1.143 16.511 -18.260 1.00 50.10 H new ATOM 0 HZ2 LYS A 82 -2.352 15.319 -18.261 1.00 50.10 H new ATOM 0 HZ3 LYS A 82 -2.693 16.873 -17.670 1.00 50.10 H new ATOM 1263 N VAL A 83 -6.204 14.265 -11.549 1.00 33.13 N ATOM 1264 CA VAL A 83 -7.385 14.294 -10.671 1.00 23.45 C ATOM 1265 C VAL A 83 -7.189 15.391 -9.617 1.00 61.04 C ATOM 1266 O VAL A 83 -6.056 15.846 -9.385 1.00 23.44 O ATOM 1267 CB VAL A 83 -7.631 12.898 -9.970 1.00 22.45 C ATOM 1268 CG1 VAL A 83 -8.091 11.819 -10.979 1.00 45.34 C ATOM 1269 CG2 VAL A 83 -6.368 12.429 -9.205 1.00 53.44 C ATOM 0 H VAL A 83 -5.328 14.377 -11.039 1.00 33.13 H new ATOM 0 HA VAL A 83 -8.265 14.507 -11.278 1.00 23.45 H new ATOM 0 HB VAL A 83 -8.437 13.038 -9.250 1.00 22.45 H new ATOM 0 HG11 VAL A 83 -8.249 10.876 -10.456 1.00 45.34 H new ATOM 0 HG12 VAL A 83 -9.023 12.134 -11.449 1.00 45.34 H new ATOM 0 HG13 VAL A 83 -7.326 11.686 -11.744 1.00 45.34 H new ATOM 0 HG21 VAL A 83 -6.565 11.467 -8.733 1.00 53.44 H new ATOM 0 HG22 VAL A 83 -5.537 12.327 -9.903 1.00 53.44 H new ATOM 0 HG23 VAL A 83 -6.112 13.163 -8.441 1.00 53.44 H new ATOM 1279 N ASP A 84 -8.294 15.796 -8.973 1.00 75.54 N ATOM 1280 CA ASP A 84 -8.301 16.855 -7.941 1.00 21.33 C ATOM 1281 C ASP A 84 -7.469 16.407 -6.709 1.00 71.41 C ATOM 1282 O ASP A 84 -7.272 15.199 -6.511 1.00 44.41 O ATOM 1283 CB ASP A 84 -9.775 17.176 -7.572 1.00 73.33 C ATOM 1284 CG ASP A 84 -9.967 18.415 -6.687 1.00 13.20 C ATOM 1285 OD1 ASP A 84 -10.746 18.367 -5.713 1.00 33.13 O ATOM 1286 OD2 ASP A 84 -9.337 19.455 -6.972 1.00 3.33 O ATOM 0 H ASP A 84 -9.216 15.398 -9.152 1.00 75.54 H new ATOM 0 HA ASP A 84 -7.835 17.764 -8.321 1.00 21.33 H new ATOM 0 HB2 ASP A 84 -10.342 17.314 -8.492 1.00 73.33 H new ATOM 0 HB3 ASP A 84 -10.202 16.313 -7.061 1.00 73.33 H new ATOM 1291 N GLN A 85 -6.992 17.383 -5.907 1.00 32.23 N ATOM 1292 CA GLN A 85 -5.996 17.154 -4.823 1.00 71.21 C ATOM 1293 C GLN A 85 -6.470 16.049 -3.812 1.00 12.20 C ATOM 1294 O GLN A 85 -5.725 15.080 -3.607 1.00 14.35 O ATOM 1295 CB GLN A 85 -5.631 18.514 -4.111 1.00 43.14 C ATOM 1296 CG GLN A 85 -4.160 18.672 -3.640 1.00 4.25 C ATOM 1297 CD GLN A 85 -3.689 17.696 -2.545 1.00 12.25 C ATOM 1298 OE1 GLN A 85 -2.515 17.316 -2.514 1.00 72.02 O ATOM 1299 NE2 GLN A 85 -4.562 17.317 -1.612 1.00 25.54 N ATOM 0 H GLN A 85 -7.284 18.357 -5.988 1.00 32.23 H new ATOM 0 HA GLN A 85 -5.083 16.768 -5.277 1.00 71.21 H new ATOM 0 HB2 GLN A 85 -5.860 19.331 -4.796 1.00 43.14 H new ATOM 0 HB3 GLN A 85 -6.282 18.632 -3.245 1.00 43.14 H new ATOM 0 HG2 GLN A 85 -3.508 18.556 -4.506 1.00 4.25 H new ATOM 0 HG3 GLN A 85 -4.025 19.690 -3.273 1.00 4.25 H new ATOM 0 HE21 GLN A 85 -5.528 17.642 -1.655 1.00 25.54 H new ATOM 0 HE22 GLN A 85 -4.264 16.702 -0.855 1.00 25.54 H new ATOM 1308 N PRO A 86 -7.705 16.139 -3.175 1.00 54.41 N ATOM 1309 CA PRO A 86 -8.187 15.060 -2.273 1.00 20.13 C ATOM 1310 C PRO A 86 -8.530 13.766 -3.037 1.00 33.11 C ATOM 1311 O PRO A 86 -8.341 12.678 -2.509 1.00 3.34 O ATOM 1312 CB PRO A 86 -9.444 15.678 -1.602 1.00 0.24 C ATOM 1313 CG PRO A 86 -9.941 16.690 -2.589 1.00 33.11 C ATOM 1314 CD PRO A 86 -8.697 17.264 -3.238 1.00 51.02 C ATOM 0 HA PRO A 86 -7.427 14.755 -1.553 1.00 20.13 H new ATOM 0 HB2 PRO A 86 -10.199 14.918 -1.399 1.00 0.24 H new ATOM 0 HB3 PRO A 86 -9.196 16.143 -0.648 1.00 0.24 H new ATOM 0 HG2 PRO A 86 -10.593 16.228 -3.330 1.00 33.11 H new ATOM 0 HG3 PRO A 86 -10.521 17.469 -2.095 1.00 33.11 H new ATOM 0 HD2 PRO A 86 -8.888 17.571 -4.266 1.00 51.02 H new ATOM 0 HD3 PRO A 86 -8.338 18.144 -2.704 1.00 51.02 H new ATOM 1322 N THR A 87 -8.993 13.924 -4.297 1.00 54.11 N ATOM 1323 CA THR A 87 -9.414 12.815 -5.178 1.00 1.41 C ATOM 1324 C THR A 87 -8.237 11.856 -5.486 1.00 4.53 C ATOM 1325 O THR A 87 -8.428 10.649 -5.671 1.00 33.05 O ATOM 1326 CB THR A 87 -10.006 13.400 -6.503 1.00 75.05 C ATOM 1327 OG1 THR A 87 -10.970 14.419 -6.186 1.00 45.43 O ATOM 1328 CG2 THR A 87 -10.679 12.339 -7.385 1.00 44.44 C ATOM 0 H THR A 87 -9.086 14.840 -4.736 1.00 54.11 H new ATOM 0 HA THR A 87 -10.179 12.235 -4.662 1.00 1.41 H new ATOM 0 HB THR A 87 -9.168 13.809 -7.068 1.00 75.05 H new ATOM 0 HG1 THR A 87 -11.560 14.562 -6.955 1.00 45.43 H new ATOM 0 HG21 THR A 87 -11.068 12.810 -8.288 1.00 44.44 H new ATOM 0 HG22 THR A 87 -9.949 11.577 -7.659 1.00 44.44 H new ATOM 0 HG23 THR A 87 -11.498 11.875 -6.835 1.00 44.44 H new ATOM 1336 N LEU A 88 -7.016 12.428 -5.519 1.00 14.31 N ATOM 1337 CA LEU A 88 -5.763 11.680 -5.719 1.00 15.50 C ATOM 1338 C LEU A 88 -5.508 10.758 -4.506 1.00 63.02 C ATOM 1339 O LEU A 88 -5.103 9.600 -4.662 1.00 1.11 O ATOM 1340 CB LEU A 88 -4.592 12.695 -5.954 1.00 54.44 C ATOM 1341 CG LEU A 88 -3.355 12.177 -6.775 1.00 52.31 C ATOM 1342 CD1 LEU A 88 -2.479 13.350 -7.264 1.00 53.13 C ATOM 1343 CD2 LEU A 88 -2.507 11.166 -5.977 1.00 42.45 C ATOM 0 H LEU A 88 -6.873 13.432 -5.406 1.00 14.31 H new ATOM 0 HA LEU A 88 -5.833 11.042 -6.600 1.00 15.50 H new ATOM 0 HB2 LEU A 88 -4.997 13.568 -6.466 1.00 54.44 H new ATOM 0 HB3 LEU A 88 -4.236 13.033 -4.981 1.00 54.44 H new ATOM 0 HG LEU A 88 -3.753 11.655 -7.645 1.00 52.31 H new ATOM 0 HD11 LEU A 88 -1.632 12.961 -7.828 1.00 53.13 H new ATOM 0 HD12 LEU A 88 -3.071 14.004 -7.904 1.00 53.13 H new ATOM 0 HD13 LEU A 88 -2.115 13.914 -6.406 1.00 53.13 H new ATOM 0 HD21 LEU A 88 -1.665 10.837 -6.586 1.00 42.45 H new ATOM 0 HD22 LEU A 88 -2.135 11.640 -5.069 1.00 42.45 H new ATOM 0 HD23 LEU A 88 -3.121 10.305 -5.712 1.00 42.45 H new ATOM 1355 N PHE A 89 -5.775 11.286 -3.303 1.00 62.30 N ATOM 1356 CA PHE A 89 -5.645 10.528 -2.048 1.00 44.43 C ATOM 1357 C PHE A 89 -6.767 9.486 -1.902 1.00 30.12 C ATOM 1358 O PHE A 89 -6.552 8.459 -1.271 1.00 73.40 O ATOM 1359 CB PHE A 89 -5.571 11.487 -0.835 1.00 61.20 C ATOM 1360 CG PHE A 89 -4.272 12.297 -0.827 1.00 53.42 C ATOM 1361 CD1 PHE A 89 -3.062 11.681 -0.509 1.00 62.51 C ATOM 1362 CD2 PHE A 89 -4.247 13.648 -1.163 1.00 22.53 C ATOM 1363 CE1 PHE A 89 -1.876 12.388 -0.530 1.00 72.35 C ATOM 1364 CE2 PHE A 89 -3.059 14.354 -1.171 1.00 21.30 C ATOM 1365 CZ PHE A 89 -1.875 13.725 -0.857 1.00 4.23 C ATOM 0 H PHE A 89 -6.087 12.248 -3.171 1.00 62.30 H new ATOM 0 HA PHE A 89 -4.708 9.972 -2.079 1.00 44.43 H new ATOM 0 HB2 PHE A 89 -6.423 12.167 -0.857 1.00 61.20 H new ATOM 0 HB3 PHE A 89 -5.646 10.912 0.088 1.00 61.20 H new ATOM 0 HD1 PHE A 89 -3.052 10.635 -0.242 1.00 62.51 H new ATOM 0 HD2 PHE A 89 -5.168 14.150 -1.421 1.00 22.53 H new ATOM 0 HE1 PHE A 89 -0.948 11.891 -0.289 1.00 72.35 H new ATOM 0 HE2 PHE A 89 -3.059 15.404 -1.425 1.00 21.30 H new ATOM 0 HZ PHE A 89 -0.948 14.279 -0.867 1.00 4.23 H new ATOM 1375 N GLU A 90 -7.951 9.757 -2.491 1.00 44.22 N ATOM 1376 CA GLU A 90 -9.054 8.769 -2.562 1.00 0.45 C ATOM 1377 C GLU A 90 -8.614 7.521 -3.365 1.00 44.42 C ATOM 1378 O GLU A 90 -9.004 6.397 -3.038 1.00 44.35 O ATOM 1379 CB GLU A 90 -10.324 9.386 -3.208 1.00 15.42 C ATOM 1380 CG GLU A 90 -10.862 10.658 -2.522 1.00 64.45 C ATOM 1381 CD GLU A 90 -11.253 10.462 -1.045 1.00 23.01 C ATOM 1382 OE1 GLU A 90 -12.396 10.029 -0.782 1.00 33.30 O ATOM 1383 OE2 GLU A 90 -10.435 10.757 -0.143 1.00 50.32 O ATOM 0 H GLU A 90 -8.170 10.653 -2.926 1.00 44.22 H new ATOM 0 HA GLU A 90 -9.296 8.473 -1.541 1.00 0.45 H new ATOM 0 HB2 GLU A 90 -10.104 9.620 -4.250 1.00 15.42 H new ATOM 0 HB3 GLU A 90 -11.112 8.633 -3.210 1.00 15.42 H new ATOM 0 HG2 GLU A 90 -10.104 11.439 -2.585 1.00 64.45 H new ATOM 0 HG3 GLU A 90 -11.733 11.013 -3.073 1.00 64.45 H new ATOM 1390 N LEU A 91 -7.800 7.750 -4.425 1.00 61.22 N ATOM 1391 CA LEU A 91 -7.192 6.672 -5.239 1.00 54.20 C ATOM 1392 C LEU A 91 -6.192 5.840 -4.405 1.00 31.25 C ATOM 1393 O LEU A 91 -6.107 4.625 -4.580 1.00 2.11 O ATOM 1394 CB LEU A 91 -6.478 7.259 -6.494 1.00 44.04 C ATOM 1395 CG LEU A 91 -7.387 7.937 -7.566 1.00 11.01 C ATOM 1396 CD1 LEU A 91 -6.538 8.622 -8.665 1.00 50.33 C ATOM 1397 CD2 LEU A 91 -8.379 6.919 -8.181 1.00 71.54 C ATOM 0 H LEU A 91 -7.548 8.687 -4.738 1.00 61.22 H new ATOM 0 HA LEU A 91 -7.998 6.016 -5.568 1.00 54.20 H new ATOM 0 HB2 LEU A 91 -5.745 7.992 -6.157 1.00 44.04 H new ATOM 0 HB3 LEU A 91 -5.924 6.454 -6.978 1.00 44.04 H new ATOM 0 HG LEU A 91 -7.971 8.710 -7.066 1.00 11.01 H new ATOM 0 HD11 LEU A 91 -7.198 9.086 -9.398 1.00 50.33 H new ATOM 0 HD12 LEU A 91 -5.905 9.385 -8.213 1.00 50.33 H new ATOM 0 HD13 LEU A 91 -5.913 7.878 -9.159 1.00 50.33 H new ATOM 0 HD21 LEU A 91 -8.999 7.419 -8.925 1.00 71.54 H new ATOM 0 HD22 LEU A 91 -7.823 6.111 -8.657 1.00 71.54 H new ATOM 0 HD23 LEU A 91 -9.014 6.509 -7.395 1.00 71.54 H new ATOM 1409 N ILE A 92 -5.439 6.519 -3.507 1.00 20.11 N ATOM 1410 CA ILE A 92 -4.462 5.864 -2.602 1.00 73.41 C ATOM 1411 C ILE A 92 -5.193 5.003 -1.551 1.00 34.22 C ATOM 1412 O ILE A 92 -4.799 3.861 -1.292 1.00 13.35 O ATOM 1413 CB ILE A 92 -3.533 6.922 -1.875 1.00 32.11 C ATOM 1414 CG1 ILE A 92 -2.755 7.775 -2.927 1.00 44.54 C ATOM 1415 CG2 ILE A 92 -2.556 6.243 -0.874 1.00 0.24 C ATOM 1416 CD1 ILE A 92 -1.816 8.818 -2.347 1.00 20.41 C ATOM 0 H ILE A 92 -5.490 7.531 -3.389 1.00 20.11 H new ATOM 0 HA ILE A 92 -3.829 5.225 -3.217 1.00 73.41 H new ATOM 0 HB ILE A 92 -4.175 7.585 -1.295 1.00 32.11 H new ATOM 0 HG12 ILE A 92 -2.178 7.102 -3.561 1.00 44.54 H new ATOM 0 HG13 ILE A 92 -3.478 8.277 -3.570 1.00 44.54 H new ATOM 0 HG21 ILE A 92 -1.937 7.003 -0.397 1.00 0.24 H new ATOM 0 HG22 ILE A 92 -3.127 5.710 -0.113 1.00 0.24 H new ATOM 0 HG23 ILE A 92 -1.918 5.539 -1.409 1.00 0.24 H new ATOM 0 HD11 ILE A 92 -1.324 9.356 -3.158 1.00 20.41 H new ATOM 0 HD12 ILE A 92 -2.384 9.521 -1.738 1.00 20.41 H new ATOM 0 HD13 ILE A 92 -1.064 8.327 -1.729 1.00 20.41 H new ATOM 1428 N LEU A 93 -6.279 5.569 -0.978 1.00 41.14 N ATOM 1429 CA LEU A 93 -7.105 4.898 0.047 1.00 1.21 C ATOM 1430 C LEU A 93 -7.788 3.651 -0.539 1.00 2.54 C ATOM 1431 O LEU A 93 -7.886 2.631 0.131 1.00 22.03 O ATOM 1432 CB LEU A 93 -8.167 5.878 0.632 1.00 14.51 C ATOM 1433 CG LEU A 93 -7.614 7.106 1.431 1.00 33.55 C ATOM 1434 CD1 LEU A 93 -8.763 8.043 1.874 1.00 72.31 C ATOM 1435 CD2 LEU A 93 -6.747 6.658 2.635 1.00 1.13 C ATOM 0 H LEU A 93 -6.607 6.506 -1.215 1.00 41.14 H new ATOM 0 HA LEU A 93 -6.448 4.583 0.858 1.00 1.21 H new ATOM 0 HB2 LEU A 93 -8.777 6.252 -0.190 1.00 14.51 H new ATOM 0 HB3 LEU A 93 -8.829 5.313 1.288 1.00 14.51 H new ATOM 0 HG LEU A 93 -6.965 7.672 0.762 1.00 33.55 H new ATOM 0 HD11 LEU A 93 -8.351 8.887 2.427 1.00 72.31 H new ATOM 0 HD12 LEU A 93 -9.294 8.409 0.995 1.00 72.31 H new ATOM 0 HD13 LEU A 93 -9.455 7.494 2.513 1.00 72.31 H new ATOM 0 HD21 LEU A 93 -6.380 7.536 3.166 1.00 1.13 H new ATOM 0 HD22 LEU A 93 -7.349 6.050 3.311 1.00 1.13 H new ATOM 0 HD23 LEU A 93 -5.901 6.072 2.276 1.00 1.13 H new ATOM 1447 N ALA A 94 -8.229 3.763 -1.808 1.00 61.34 N ATOM 1448 CA ALA A 94 -8.882 2.664 -2.547 1.00 72.12 C ATOM 1449 C ALA A 94 -7.873 1.570 -2.922 1.00 64.54 C ATOM 1450 O ALA A 94 -8.172 0.380 -2.819 1.00 22.01 O ATOM 1451 CB ALA A 94 -9.555 3.210 -3.811 1.00 23.13 C ATOM 0 H ALA A 94 -8.142 4.622 -2.351 1.00 61.34 H new ATOM 0 HA ALA A 94 -9.637 2.221 -1.897 1.00 72.12 H new ATOM 0 HB1 ALA A 94 -10.034 2.393 -4.350 1.00 23.13 H new ATOM 0 HB2 ALA A 94 -10.305 3.950 -3.533 1.00 23.13 H new ATOM 0 HB3 ALA A 94 -8.805 3.676 -4.450 1.00 23.13 H new ATOM 1457 N ALA A 95 -6.678 2.005 -3.361 1.00 32.43 N ATOM 1458 CA ALA A 95 -5.587 1.105 -3.771 1.00 14.35 C ATOM 1459 C ALA A 95 -5.078 0.274 -2.589 1.00 13.11 C ATOM 1460 O ALA A 95 -4.696 -0.877 -2.758 1.00 44.13 O ATOM 1461 CB ALA A 95 -4.435 1.912 -4.367 1.00 5.21 C ATOM 0 H ALA A 95 -6.442 2.994 -3.441 1.00 32.43 H new ATOM 0 HA ALA A 95 -5.982 0.423 -4.524 1.00 14.35 H new ATOM 0 HB1 ALA A 95 -3.634 1.236 -4.667 1.00 5.21 H new ATOM 0 HB2 ALA A 95 -4.789 2.463 -5.238 1.00 5.21 H new ATOM 0 HB3 ALA A 95 -4.058 2.613 -3.622 1.00 5.21 H new ATOM 1467 N ASN A 96 -5.060 0.905 -1.405 1.00 65.24 N ATOM 1468 CA ASN A 96 -4.649 0.266 -0.146 1.00 2.43 C ATOM 1469 C ASN A 96 -5.789 -0.613 0.410 1.00 1.42 C ATOM 1470 O ASN A 96 -5.540 -1.692 0.931 1.00 21.24 O ATOM 1471 CB ASN A 96 -4.222 1.354 0.876 1.00 33.32 C ATOM 1472 CG ASN A 96 -3.733 0.797 2.217 1.00 72.52 C ATOM 1473 OD1 ASN A 96 -3.214 -0.316 2.304 1.00 31.24 O ATOM 1474 ND2 ASN A 96 -3.863 1.573 3.264 1.00 14.02 N ATOM 0 H ASN A 96 -5.333 1.882 -1.294 1.00 65.24 H new ATOM 0 HA ASN A 96 -3.794 -0.384 -0.333 1.00 2.43 H new ATOM 0 HB2 ASN A 96 -3.430 1.959 0.436 1.00 33.32 H new ATOM 0 HB3 ASN A 96 -5.067 2.018 1.057 1.00 33.32 H new ATOM 0 HD21 ASN A 96 -3.531 1.259 4.176 1.00 14.02 H new ATOM 0 HD22 ASN A 96 -4.296 2.491 3.168 1.00 14.02 H new ATOM 1481 N TYR A 97 -7.042 -0.147 0.256 1.00 52.24 N ATOM 1482 CA TYR A 97 -8.256 -0.892 0.683 1.00 22.33 C ATOM 1483 C TYR A 97 -8.404 -2.208 -0.102 1.00 43.52 C ATOM 1484 O TYR A 97 -8.879 -3.220 0.433 1.00 71.52 O ATOM 1485 CB TYR A 97 -9.512 0.007 0.498 1.00 13.40 C ATOM 1486 CG TYR A 97 -10.874 -0.676 0.745 1.00 22.13 C ATOM 1487 CD1 TYR A 97 -11.777 -0.898 -0.306 1.00 13.14 C ATOM 1488 CD2 TYR A 97 -11.252 -1.097 2.025 1.00 4.05 C ATOM 1489 CE1 TYR A 97 -12.999 -1.505 -0.085 1.00 63.31 C ATOM 1490 CE2 TYR A 97 -12.475 -1.708 2.245 1.00 53.25 C ATOM 1491 CZ TYR A 97 -13.344 -1.907 1.187 1.00 72.54 C ATOM 1492 OH TYR A 97 -14.568 -2.501 1.409 1.00 64.10 O ATOM 0 H TYR A 97 -7.249 0.757 -0.168 1.00 52.24 H new ATOM 0 HA TYR A 97 -8.156 -1.150 1.737 1.00 22.33 H new ATOM 0 HB2 TYR A 97 -9.427 0.859 1.173 1.00 13.40 H new ATOM 0 HB3 TYR A 97 -9.505 0.403 -0.518 1.00 13.40 H new ATOM 0 HD1 TYR A 97 -11.512 -0.589 -1.306 1.00 13.14 H new ATOM 0 HD2 TYR A 97 -10.579 -0.943 2.855 1.00 4.05 H new ATOM 0 HE1 TYR A 97 -13.681 -1.664 -0.907 1.00 63.31 H new ATOM 0 HE2 TYR A 97 -12.750 -2.028 3.239 1.00 53.25 H new ATOM 0 HH TYR A 97 -14.655 -2.726 2.359 1.00 64.10 H new ATOM 1502 N LEU A 98 -7.999 -2.170 -1.372 1.00 44.21 N ATOM 1503 CA LEU A 98 -8.060 -3.323 -2.282 1.00 70.41 C ATOM 1504 C LEU A 98 -6.701 -4.049 -2.357 1.00 63.20 C ATOM 1505 O LEU A 98 -6.633 -5.177 -2.856 1.00 22.13 O ATOM 1506 CB LEU A 98 -8.526 -2.849 -3.683 1.00 33.21 C ATOM 1507 CG LEU A 98 -9.962 -2.232 -3.750 1.00 11.12 C ATOM 1508 CD1 LEU A 98 -10.298 -1.723 -5.173 1.00 32.24 C ATOM 1509 CD2 LEU A 98 -11.023 -3.238 -3.240 1.00 52.45 C ATOM 0 H LEU A 98 -7.615 -1.331 -1.806 1.00 44.21 H new ATOM 0 HA LEU A 98 -8.782 -4.042 -1.895 1.00 70.41 H new ATOM 0 HB2 LEU A 98 -7.815 -2.109 -4.050 1.00 33.21 H new ATOM 0 HB3 LEU A 98 -8.483 -3.698 -4.366 1.00 33.21 H new ATOM 0 HG LEU A 98 -9.981 -1.366 -3.088 1.00 11.12 H new ATOM 0 HD11 LEU A 98 -11.303 -1.301 -5.181 1.00 32.24 H new ATOM 0 HD12 LEU A 98 -9.580 -0.956 -5.464 1.00 32.24 H new ATOM 0 HD13 LEU A 98 -10.247 -2.553 -5.878 1.00 32.24 H new ATOM 0 HD21 LEU A 98 -12.012 -2.784 -3.297 1.00 52.45 H new ATOM 0 HD22 LEU A 98 -11.000 -4.136 -3.858 1.00 52.45 H new ATOM 0 HD23 LEU A 98 -10.805 -3.503 -2.206 1.00 52.45 H new ATOM 1521 N ASP A 99 -5.642 -3.391 -1.838 1.00 12.31 N ATOM 1522 CA ASP A 99 -4.245 -3.903 -1.848 1.00 35.34 C ATOM 1523 C ASP A 99 -3.739 -4.158 -3.284 1.00 52.54 C ATOM 1524 O ASP A 99 -2.933 -5.062 -3.521 1.00 14.45 O ATOM 1525 CB ASP A 99 -4.098 -5.164 -0.946 1.00 42.30 C ATOM 1526 CG ASP A 99 -4.171 -4.847 0.558 1.00 24.31 C ATOM 1527 OD1 ASP A 99 -3.113 -4.770 1.220 1.00 41.02 O ATOM 1528 OD2 ASP A 99 -5.283 -4.660 1.089 1.00 53.43 O ATOM 0 H ASP A 99 -5.729 -2.477 -1.393 1.00 12.31 H new ATOM 0 HA ASP A 99 -3.609 -3.126 -1.424 1.00 35.34 H new ATOM 0 HB2 ASP A 99 -4.883 -5.877 -1.199 1.00 42.30 H new ATOM 0 HB3 ASP A 99 -3.146 -5.648 -1.163 1.00 42.30 H new ATOM 1533 N ILE A 100 -4.202 -3.321 -4.237 1.00 73.14 N ATOM 1534 CA ILE A 100 -3.718 -3.350 -5.628 1.00 34.42 C ATOM 1535 C ILE A 100 -2.325 -2.706 -5.676 1.00 61.52 C ATOM 1536 O ILE A 100 -2.206 -1.483 -5.774 1.00 65.44 O ATOM 1537 CB ILE A 100 -4.696 -2.613 -6.627 1.00 23.52 C ATOM 1538 CG1 ILE A 100 -6.135 -3.188 -6.481 1.00 63.12 C ATOM 1539 CG2 ILE A 100 -4.187 -2.724 -8.090 1.00 64.13 C ATOM 1540 CD1 ILE A 100 -7.173 -2.635 -7.437 1.00 63.33 C ATOM 0 H ILE A 100 -4.916 -2.613 -4.063 1.00 73.14 H new ATOM 0 HA ILE A 100 -3.672 -4.390 -5.951 1.00 34.42 H new ATOM 0 HB ILE A 100 -4.722 -1.553 -6.374 1.00 23.52 H new ATOM 0 HG12 ILE A 100 -6.088 -4.269 -6.613 1.00 63.12 H new ATOM 0 HG13 ILE A 100 -6.476 -3.006 -5.462 1.00 63.12 H new ATOM 0 HG21 ILE A 100 -4.879 -2.208 -8.756 1.00 64.13 H new ATOM 0 HG22 ILE A 100 -3.200 -2.267 -8.168 1.00 64.13 H new ATOM 0 HG23 ILE A 100 -4.124 -3.774 -8.375 1.00 64.13 H new ATOM 0 HD11 ILE A 100 -8.136 -3.108 -7.242 1.00 63.33 H new ATOM 0 HD12 ILE A 100 -7.262 -1.558 -7.294 1.00 63.33 H new ATOM 0 HD13 ILE A 100 -6.869 -2.841 -8.463 1.00 63.33 H new ATOM 1552 N LYS A 101 -1.291 -3.560 -5.570 1.00 43.13 N ATOM 1553 CA LYS A 101 0.127 -3.149 -5.512 1.00 50.12 C ATOM 1554 C LYS A 101 0.521 -2.233 -6.727 1.00 55.44 C ATOM 1555 O LYS A 101 1.107 -1.173 -6.486 1.00 54.23 O ATOM 1556 CB LYS A 101 1.049 -4.418 -5.398 1.00 62.20 C ATOM 1557 CG LYS A 101 2.404 -4.228 -4.660 1.00 60.41 C ATOM 1558 CD LYS A 101 3.398 -3.271 -5.363 1.00 21.41 C ATOM 1559 CE LYS A 101 4.723 -3.136 -4.596 1.00 51.15 C ATOM 1560 NZ LYS A 101 4.516 -2.681 -3.198 1.00 25.10 N ATOM 0 H LYS A 101 -1.417 -4.571 -5.521 1.00 43.13 H new ATOM 0 HA LYS A 101 0.275 -2.542 -4.619 1.00 50.12 H new ATOM 0 HB2 LYS A 101 0.489 -5.201 -4.887 1.00 62.20 H new ATOM 0 HB3 LYS A 101 1.257 -4.780 -6.405 1.00 62.20 H new ATOM 0 HG2 LYS A 101 2.205 -3.850 -3.657 1.00 60.41 H new ATOM 0 HG3 LYS A 101 2.879 -5.202 -4.545 1.00 60.41 H new ATOM 0 HD2 LYS A 101 3.600 -3.637 -6.370 1.00 21.41 H new ATOM 0 HD3 LYS A 101 2.940 -2.288 -5.467 1.00 21.41 H new ATOM 0 HE2 LYS A 101 5.238 -4.097 -4.591 1.00 51.15 H new ATOM 0 HE3 LYS A 101 5.371 -2.429 -5.114 1.00 51.15 H new ATOM 0 HZ1 LYS A 101 5.438 -2.522 -2.744 1.00 25.10 H new ATOM 0 HZ2 LYS A 101 3.973 -1.794 -3.198 1.00 25.10 H new ATOM 0 HZ3 LYS A 101 3.991 -3.408 -2.671 1.00 25.10 H new ATOM 1574 N PRO A 102 0.217 -2.607 -8.040 1.00 34.42 N ATOM 1575 CA PRO A 102 0.589 -1.751 -9.203 1.00 2.41 C ATOM 1576 C PRO A 102 0.015 -0.319 -9.117 1.00 11.12 C ATOM 1577 O PRO A 102 0.761 0.652 -9.229 1.00 24.00 O ATOM 1578 CB PRO A 102 0.023 -2.527 -10.429 1.00 23.20 C ATOM 1579 CG PRO A 102 -0.972 -3.501 -9.866 1.00 14.12 C ATOM 1580 CD PRO A 102 -0.442 -3.873 -8.506 1.00 62.22 C ATOM 0 HA PRO A 102 1.666 -1.592 -9.256 1.00 2.41 H new ATOM 0 HB2 PRO A 102 -0.451 -1.848 -11.138 1.00 23.20 H new ATOM 0 HB3 PRO A 102 0.818 -3.045 -10.966 1.00 23.20 H new ATOM 0 HG2 PRO A 102 -1.963 -3.052 -9.792 1.00 14.12 H new ATOM 0 HG3 PRO A 102 -1.067 -4.379 -10.505 1.00 14.12 H new ATOM 0 HD2 PRO A 102 -1.241 -4.183 -7.833 1.00 62.22 H new ATOM 0 HD3 PRO A 102 0.266 -4.700 -8.562 1.00 62.22 H new ATOM 1588 N LEU A 103 -1.309 -0.212 -8.872 1.00 11.24 N ATOM 1589 CA LEU A 103 -2.015 1.086 -8.845 1.00 4.02 C ATOM 1590 C LEU A 103 -1.556 1.918 -7.632 1.00 53.12 C ATOM 1591 O LEU A 103 -1.361 3.130 -7.747 1.00 31.03 O ATOM 1592 CB LEU A 103 -3.564 0.861 -8.853 1.00 73.22 C ATOM 1593 CG LEU A 103 -4.496 2.122 -9.091 1.00 14.14 C ATOM 1594 CD1 LEU A 103 -4.854 2.877 -7.788 1.00 45.43 C ATOM 1595 CD2 LEU A 103 -3.876 3.085 -10.125 1.00 71.35 C ATOM 0 H LEU A 103 -1.912 -1.014 -8.689 1.00 11.24 H new ATOM 0 HA LEU A 103 -1.764 1.652 -9.742 1.00 4.02 H new ATOM 0 HB2 LEU A 103 -3.791 0.127 -9.626 1.00 73.22 H new ATOM 0 HB3 LEU A 103 -3.842 0.415 -7.898 1.00 73.22 H new ATOM 0 HG LEU A 103 -5.433 1.731 -9.488 1.00 14.14 H new ATOM 0 HD11 LEU A 103 -5.493 3.728 -8.024 1.00 45.43 H new ATOM 0 HD12 LEU A 103 -5.381 2.205 -7.111 1.00 45.43 H new ATOM 0 HD13 LEU A 103 -3.941 3.231 -7.310 1.00 45.43 H new ATOM 0 HD21 LEU A 103 -4.537 3.940 -10.268 1.00 71.35 H new ATOM 0 HD22 LEU A 103 -2.907 3.431 -9.765 1.00 71.35 H new ATOM 0 HD23 LEU A 103 -3.745 2.565 -11.074 1.00 71.35 H new ATOM 1607 N LEU A 104 -1.359 1.236 -6.488 1.00 11.11 N ATOM 1608 CA LEU A 104 -0.870 1.853 -5.238 1.00 41.34 C ATOM 1609 C LEU A 104 0.486 2.526 -5.465 1.00 52.10 C ATOM 1610 O LEU A 104 0.680 3.680 -5.079 1.00 21.21 O ATOM 1611 CB LEU A 104 -0.744 0.774 -4.132 1.00 74.41 C ATOM 1612 CG LEU A 104 -0.240 1.251 -2.734 1.00 61.04 C ATOM 1613 CD1 LEU A 104 -1.225 2.252 -2.080 1.00 10.34 C ATOM 1614 CD2 LEU A 104 0.030 0.037 -1.822 1.00 12.22 C ATOM 0 H LEU A 104 -1.535 0.235 -6.403 1.00 11.11 H new ATOM 0 HA LEU A 104 -1.586 2.612 -4.922 1.00 41.34 H new ATOM 0 HB2 LEU A 104 -1.721 0.308 -4.000 1.00 74.41 H new ATOM 0 HB3 LEU A 104 -0.067 -0.001 -4.490 1.00 74.41 H new ATOM 0 HG LEU A 104 0.699 1.786 -2.875 1.00 61.04 H new ATOM 0 HD11 LEU A 104 -0.839 2.560 -1.109 1.00 10.34 H new ATOM 0 HD12 LEU A 104 -1.334 3.127 -2.721 1.00 10.34 H new ATOM 0 HD13 LEU A 104 -2.196 1.774 -1.949 1.00 10.34 H new ATOM 0 HD21 LEU A 104 0.381 0.383 -0.850 1.00 12.22 H new ATOM 0 HD22 LEU A 104 -0.890 -0.533 -1.694 1.00 12.22 H new ATOM 0 HD23 LEU A 104 0.790 -0.598 -2.277 1.00 12.22 H new ATOM 1626 N ASP A 105 1.393 1.789 -6.142 1.00 15.13 N ATOM 1627 CA ASP A 105 2.775 2.226 -6.359 1.00 22.34 C ATOM 1628 C ASP A 105 2.809 3.448 -7.276 1.00 74.53 C ATOM 1629 O ASP A 105 3.350 4.472 -6.889 1.00 42.32 O ATOM 1630 CB ASP A 105 3.654 1.072 -6.921 1.00 14.32 C ATOM 1631 CG ASP A 105 5.159 1.426 -6.901 1.00 3.31 C ATOM 1632 OD1 ASP A 105 5.789 1.311 -5.825 1.00 64.40 O ATOM 1633 OD2 ASP A 105 5.720 1.824 -7.945 1.00 14.11 O ATOM 0 H ASP A 105 1.181 0.878 -6.549 1.00 15.13 H new ATOM 0 HA ASP A 105 3.197 2.511 -5.395 1.00 22.34 H new ATOM 0 HB2 ASP A 105 3.486 0.170 -6.333 1.00 14.32 H new ATOM 0 HB3 ASP A 105 3.348 0.848 -7.943 1.00 14.32 H new ATOM 1638 N VAL A 106 2.138 3.344 -8.438 1.00 21.41 N ATOM 1639 CA VAL A 106 2.069 4.428 -9.441 1.00 10.43 C ATOM 1640 C VAL A 106 1.517 5.735 -8.820 1.00 5.05 C ATOM 1641 O VAL A 106 2.113 6.804 -8.988 1.00 10.01 O ATOM 1642 CB VAL A 106 1.191 3.984 -10.675 1.00 41.45 C ATOM 1643 CG1 VAL A 106 0.979 5.138 -11.694 1.00 21.11 C ATOM 1644 CG2 VAL A 106 1.818 2.745 -11.367 1.00 44.23 C ATOM 0 H VAL A 106 1.626 2.505 -8.710 1.00 21.41 H new ATOM 0 HA VAL A 106 3.082 4.628 -9.789 1.00 10.43 H new ATOM 0 HB VAL A 106 0.206 3.715 -10.293 1.00 41.45 H new ATOM 0 HG11 VAL A 106 0.369 4.783 -12.524 1.00 21.11 H new ATOM 0 HG12 VAL A 106 0.474 5.969 -11.202 1.00 21.11 H new ATOM 0 HG13 VAL A 106 1.945 5.473 -12.071 1.00 21.11 H new ATOM 0 HG21 VAL A 106 1.201 2.451 -12.216 1.00 44.23 H new ATOM 0 HG22 VAL A 106 2.821 2.992 -11.716 1.00 44.23 H new ATOM 0 HG23 VAL A 106 1.874 1.920 -10.656 1.00 44.23 H new ATOM 1654 N THR A 107 0.410 5.612 -8.060 1.00 41.13 N ATOM 1655 CA THR A 107 -0.292 6.761 -7.454 1.00 13.45 C ATOM 1656 C THR A 107 0.526 7.395 -6.289 1.00 75.20 C ATOM 1657 O THR A 107 0.515 8.622 -6.118 1.00 15.53 O ATOM 1658 CB THR A 107 -1.723 6.335 -6.977 1.00 12.23 C ATOM 1659 OG1 THR A 107 -2.409 5.699 -8.068 1.00 4.52 O ATOM 1660 CG2 THR A 107 -2.576 7.522 -6.504 1.00 23.20 C ATOM 0 H THR A 107 -0.022 4.713 -7.849 1.00 41.13 H new ATOM 0 HA THR A 107 -0.396 7.529 -8.220 1.00 13.45 H new ATOM 0 HB THR A 107 -1.589 5.661 -6.131 1.00 12.23 H new ATOM 0 HG1 THR A 107 -2.163 4.751 -8.101 1.00 4.52 H new ATOM 0 HG21 THR A 107 -3.555 7.163 -6.187 1.00 23.20 H new ATOM 0 HG22 THR A 107 -2.081 8.015 -5.667 1.00 23.20 H new ATOM 0 HG23 THR A 107 -2.698 8.232 -7.322 1.00 23.20 H new ATOM 1668 N CYS A 108 1.261 6.554 -5.521 1.00 41.11 N ATOM 1669 CA CYS A 108 2.133 7.024 -4.414 1.00 11.50 C ATOM 1670 C CYS A 108 3.390 7.730 -4.971 1.00 44.11 C ATOM 1671 O CYS A 108 3.849 8.736 -4.406 1.00 72.10 O ATOM 1672 CB CYS A 108 2.537 5.849 -3.489 1.00 72.14 C ATOM 1673 SG CYS A 108 1.155 5.132 -2.568 1.00 23.23 S ATOM 0 H CYS A 108 1.268 5.542 -5.648 1.00 41.11 H new ATOM 0 HA CYS A 108 1.566 7.743 -3.823 1.00 11.50 H new ATOM 0 HB2 CYS A 108 3.003 5.069 -4.091 1.00 72.14 H new ATOM 0 HB3 CYS A 108 3.290 6.198 -2.782 1.00 72.14 H new ATOM 0 HG CYS A 108 0.514 4.296 -3.329 1.00 23.23 H new ATOM 1679 N LYS A 109 3.920 7.197 -6.097 1.00 11.44 N ATOM 1680 CA LYS A 109 5.080 7.776 -6.797 1.00 13.21 C ATOM 1681 C LYS A 109 4.689 9.123 -7.426 1.00 41.34 C ATOM 1682 O LYS A 109 5.506 10.031 -7.483 1.00 44.53 O ATOM 1683 CB LYS A 109 5.646 6.807 -7.882 1.00 63.11 C ATOM 1684 CG LYS A 109 6.202 5.465 -7.334 1.00 42.24 C ATOM 1685 CD LYS A 109 7.403 5.632 -6.369 1.00 34.34 C ATOM 1686 CE LYS A 109 7.825 4.302 -5.714 1.00 72.32 C ATOM 1687 NZ LYS A 109 8.126 3.246 -6.718 1.00 23.41 N ATOM 0 H LYS A 109 3.553 6.355 -6.541 1.00 11.44 H new ATOM 0 HA LYS A 109 5.871 7.936 -6.064 1.00 13.21 H new ATOM 0 HB2 LYS A 109 4.857 6.590 -8.601 1.00 63.11 H new ATOM 0 HB3 LYS A 109 6.441 7.318 -8.425 1.00 63.11 H new ATOM 0 HG2 LYS A 109 5.402 4.936 -6.815 1.00 42.24 H new ATOM 0 HG3 LYS A 109 6.506 4.839 -8.173 1.00 42.24 H new ATOM 0 HD2 LYS A 109 8.249 6.048 -6.916 1.00 34.34 H new ATOM 0 HD3 LYS A 109 7.142 6.350 -5.591 1.00 34.34 H new ATOM 0 HE2 LYS A 109 8.704 4.469 -5.092 1.00 72.32 H new ATOM 0 HE3 LYS A 109 7.029 3.956 -5.054 1.00 72.32 H new ATOM 0 HZ1 LYS A 109 8.486 2.399 -6.234 1.00 23.41 H new ATOM 0 HZ2 LYS A 109 7.259 3.005 -7.239 1.00 23.41 H new ATOM 0 HZ3 LYS A 109 8.844 3.595 -7.384 1.00 23.41 H new ATOM 1701 N THR A 110 3.411 9.234 -7.871 1.00 62.11 N ATOM 1702 CA THR A 110 2.853 10.480 -8.434 1.00 74.20 C ATOM 1703 C THR A 110 2.940 11.635 -7.419 1.00 63.02 C ATOM 1704 O THR A 110 3.406 12.722 -7.766 1.00 64.43 O ATOM 1705 CB THR A 110 1.365 10.292 -8.906 1.00 54.15 C ATOM 1706 OG1 THR A 110 1.305 9.306 -9.950 1.00 41.24 O ATOM 1707 CG2 THR A 110 0.733 11.607 -9.415 1.00 12.50 C ATOM 0 H THR A 110 2.745 8.462 -7.848 1.00 62.11 H new ATOM 0 HA THR A 110 3.456 10.731 -9.306 1.00 74.20 H new ATOM 0 HB THR A 110 0.795 9.965 -8.037 1.00 54.15 H new ATOM 0 HG1 THR A 110 1.592 8.438 -9.597 1.00 41.24 H new ATOM 0 HG21 THR A 110 -0.294 11.420 -9.728 1.00 12.50 H new ATOM 0 HG22 THR A 110 0.739 12.347 -8.615 1.00 12.50 H new ATOM 0 HG23 THR A 110 1.308 11.983 -10.262 1.00 12.50 H new ATOM 1715 N VAL A 111 2.514 11.375 -6.163 1.00 53.22 N ATOM 1716 CA VAL A 111 2.526 12.394 -5.089 1.00 41.33 C ATOM 1717 C VAL A 111 3.967 12.805 -4.761 1.00 61.51 C ATOM 1718 O VAL A 111 4.264 13.990 -4.580 1.00 22.41 O ATOM 1719 CB VAL A 111 1.818 11.906 -3.771 1.00 14.32 C ATOM 1720 CG1 VAL A 111 1.630 13.084 -2.784 1.00 42.12 C ATOM 1721 CG2 VAL A 111 0.473 11.220 -4.076 1.00 42.42 C ATOM 0 H VAL A 111 2.157 10.466 -5.867 1.00 53.22 H new ATOM 0 HA VAL A 111 1.964 13.247 -5.470 1.00 41.33 H new ATOM 0 HB VAL A 111 2.463 11.165 -3.299 1.00 14.32 H new ATOM 0 HG11 VAL A 111 1.139 12.726 -1.879 1.00 42.12 H new ATOM 0 HG12 VAL A 111 2.603 13.502 -2.527 1.00 42.12 H new ATOM 0 HG13 VAL A 111 1.015 13.854 -3.250 1.00 42.12 H new ATOM 0 HG21 VAL A 111 0.011 10.895 -3.144 1.00 42.42 H new ATOM 0 HG22 VAL A 111 -0.188 11.923 -4.583 1.00 42.42 H new ATOM 0 HG23 VAL A 111 0.643 10.355 -4.717 1.00 42.42 H new ATOM 1731 N ALA A 112 4.849 11.791 -4.712 1.00 54.52 N ATOM 1732 CA ALA A 112 6.288 11.971 -4.475 1.00 40.33 C ATOM 1733 C ALA A 112 6.939 12.824 -5.589 1.00 72.11 C ATOM 1734 O ALA A 112 7.878 13.575 -5.332 1.00 30.12 O ATOM 1735 CB ALA A 112 6.965 10.599 -4.368 1.00 12.21 C ATOM 0 H ALA A 112 4.578 10.816 -4.837 1.00 54.52 H new ATOM 0 HA ALA A 112 6.423 12.509 -3.537 1.00 40.33 H new ATOM 0 HB1 ALA A 112 8.032 10.733 -4.192 1.00 12.21 H new ATOM 0 HB2 ALA A 112 6.528 10.041 -3.540 1.00 12.21 H new ATOM 0 HB3 ALA A 112 6.816 10.047 -5.296 1.00 12.21 H new ATOM 1741 N ASN A 113 6.410 12.690 -6.822 1.00 32.34 N ATOM 1742 CA ASN A 113 6.856 13.456 -8.010 1.00 24.42 C ATOM 1743 C ASN A 113 6.234 14.867 -8.049 1.00 32.21 C ATOM 1744 O ASN A 113 6.788 15.765 -8.694 1.00 31.42 O ATOM 1745 CB ASN A 113 6.523 12.668 -9.315 1.00 52.43 C ATOM 1746 CG ASN A 113 7.392 11.415 -9.515 1.00 40.12 C ATOM 1747 OD1 ASN A 113 7.965 10.880 -8.572 1.00 1.43 O ATOM 1748 ND2 ASN A 113 7.479 10.923 -10.738 1.00 3.15 N ATOM 0 H ASN A 113 5.651 12.039 -7.026 1.00 32.34 H new ATOM 0 HA ASN A 113 7.936 13.582 -7.939 1.00 24.42 H new ATOM 0 HB2 ASN A 113 5.474 12.373 -9.294 1.00 52.43 H new ATOM 0 HB3 ASN A 113 6.651 13.329 -10.172 1.00 52.43 H new ATOM 0 HD21 ASN A 113 8.031 10.083 -10.912 1.00 3.15 H new ATOM 0 HD22 ASN A 113 6.995 11.383 -11.509 1.00 3.15 H new ATOM 1755 N MET A 114 5.064 15.053 -7.393 1.00 41.11 N ATOM 1756 CA MET A 114 4.422 16.384 -7.294 1.00 25.02 C ATOM 1757 C MET A 114 5.229 17.272 -6.335 1.00 73.25 C ATOM 1758 O MET A 114 5.594 18.404 -6.673 1.00 2.04 O ATOM 1759 CB MET A 114 2.948 16.301 -6.795 1.00 22.11 C ATOM 1760 CG MET A 114 1.966 15.569 -7.716 1.00 21.22 C ATOM 1761 SD MET A 114 0.233 15.822 -7.239 1.00 74.51 S ATOM 1762 CE MET A 114 0.216 15.390 -5.491 1.00 55.25 C ATOM 0 H MET A 114 4.550 14.305 -6.928 1.00 41.11 H new ATOM 0 HA MET A 114 4.407 16.811 -8.297 1.00 25.02 H new ATOM 0 HB2 MET A 114 2.942 15.806 -5.824 1.00 22.11 H new ATOM 0 HB3 MET A 114 2.581 17.315 -6.638 1.00 22.11 H new ATOM 0 HG2 MET A 114 2.110 15.913 -8.740 1.00 21.22 H new ATOM 0 HG3 MET A 114 2.190 14.502 -7.704 1.00 21.22 H new ATOM 0 HE1 MET A 114 -0.642 15.859 -5.009 1.00 55.25 H new ATOM 0 HE2 MET A 114 0.145 14.308 -5.384 1.00 55.25 H new ATOM 0 HE3 MET A 114 1.134 15.742 -5.020 1.00 55.25 H new ATOM 1772 N ILE A 115 5.519 16.726 -5.139 1.00 12.15 N ATOM 1773 CA ILE A 115 6.248 17.449 -4.080 1.00 72.22 C ATOM 1774 C ILE A 115 7.763 17.492 -4.385 1.00 34.01 C ATOM 1775 O ILE A 115 8.443 18.460 -4.017 1.00 52.14 O ATOM 1776 CB ILE A 115 6.009 16.804 -2.653 1.00 22.00 C ATOM 1777 CG1 ILE A 115 6.614 15.359 -2.559 1.00 12.40 C ATOM 1778 CG2 ILE A 115 4.499 16.786 -2.300 1.00 70.31 C ATOM 1779 CD1 ILE A 115 6.595 14.740 -1.174 1.00 43.53 C ATOM 0 H ILE A 115 5.256 15.775 -4.880 1.00 12.15 H new ATOM 0 HA ILE A 115 5.856 18.466 -4.063 1.00 72.22 H new ATOM 0 HB ILE A 115 6.528 17.427 -1.925 1.00 22.00 H new ATOM 0 HG12 ILE A 115 6.065 14.707 -3.238 1.00 12.40 H new ATOM 0 HG13 ILE A 115 7.645 15.390 -2.911 1.00 12.40 H new ATOM 0 HG21 ILE A 115 4.361 16.339 -1.316 1.00 70.31 H new ATOM 0 HG22 ILE A 115 4.115 17.806 -2.292 1.00 70.31 H new ATOM 0 HG23 ILE A 115 3.958 16.201 -3.044 1.00 70.31 H new ATOM 0 HD11 ILE A 115 7.034 13.743 -1.215 1.00 43.53 H new ATOM 0 HD12 ILE A 115 7.171 15.363 -0.489 1.00 43.53 H new ATOM 0 HD13 ILE A 115 5.566 14.669 -0.821 1.00 43.53 H new ATOM 1791 N ARG A 116 8.253 16.431 -5.077 1.00 64.32 N ATOM 1792 CA ARG A 116 9.686 16.191 -5.343 1.00 45.12 C ATOM 1793 C ARG A 116 10.483 16.162 -4.028 1.00 43.25 C ATOM 1794 O ARG A 116 11.308 17.041 -3.745 1.00 54.33 O ATOM 1795 CB ARG A 116 10.241 17.203 -6.377 1.00 55.44 C ATOM 1796 CG ARG A 116 9.538 17.119 -7.746 1.00 1.11 C ATOM 1797 CD ARG A 116 10.022 18.173 -8.747 1.00 10.41 C ATOM 1798 NE ARG A 116 9.305 18.044 -10.032 1.00 62.14 N ATOM 1799 CZ ARG A 116 9.014 19.055 -10.866 1.00 63.13 C ATOM 1800 NH1 ARG A 116 9.363 20.306 -10.586 1.00 61.35 N ATOM 1801 NH2 ARG A 116 8.352 18.803 -11.982 1.00 72.31 N ATOM 0 H ARG A 116 7.649 15.709 -5.470 1.00 64.32 H new ATOM 0 HA ARG A 116 9.802 15.207 -5.797 1.00 45.12 H new ATOM 0 HB2 ARG A 116 10.133 18.213 -5.982 1.00 55.44 H new ATOM 0 HB3 ARG A 116 11.308 17.026 -6.512 1.00 55.44 H new ATOM 0 HG2 ARG A 116 9.699 16.127 -8.168 1.00 1.11 H new ATOM 0 HG3 ARG A 116 8.464 17.233 -7.601 1.00 1.11 H new ATOM 0 HD2 ARG A 116 9.865 19.170 -8.336 1.00 10.41 H new ATOM 0 HD3 ARG A 116 11.094 18.061 -8.911 1.00 10.41 H new ATOM 0 HE ARG A 116 9.006 17.109 -10.309 1.00 62.14 H new ATOM 0 HH11 ARG A 116 9.863 20.515 -9.722 1.00 61.35 H new ATOM 0 HH12 ARG A 116 9.131 21.058 -11.235 1.00 61.35 H new ATOM 0 HH21 ARG A 116 8.068 17.848 -12.202 1.00 72.31 H new ATOM 0 HH22 ARG A 116 8.125 19.563 -12.623 1.00 72.31 H new ATOM 1815 N GLY A 117 10.156 15.151 -3.202 1.00 43.25 N ATOM 1816 CA GLY A 117 10.772 14.971 -1.888 1.00 53.10 C ATOM 1817 C GLY A 117 12.106 14.215 -1.959 1.00 2.25 C ATOM 1818 O GLY A 117 12.997 14.469 -1.124 1.00 61.22 O ATOM 1819 OXT GLY A 117 12.267 13.353 -2.849 1.00 37.57 O ATOM 0 H GLY A 117 9.459 14.442 -3.432 1.00 43.25 H new ATOM 0 HA2 GLY A 117 10.936 15.947 -1.431 1.00 53.10 H new ATOM 0 HA3 GLY A 117 10.085 14.427 -1.240 1.00 53.10 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 14.868 -15.127 15.928 1.00 33.14 N ATOM 1825 CA SER B 2 16.179 -14.596 15.493 1.00 1.30 C ATOM 1826 C SER B 2 16.020 -13.208 14.860 1.00 34.33 C ATOM 1827 O SER B 2 14.993 -12.918 14.226 1.00 50.03 O ATOM 1828 CB SER B 2 16.840 -15.573 14.496 1.00 14.32 C ATOM 1829 OG SER B 2 16.905 -16.877 15.043 1.00 23.11 O ATOM 0 HA SER B 2 16.822 -14.497 16.368 1.00 1.30 H new ATOM 0 HB2 SER B 2 16.272 -15.591 13.566 1.00 14.32 H new ATOM 0 HB3 SER B 2 17.844 -15.226 14.250 1.00 14.32 H new ATOM 0 HG SER B 2 16.205 -16.983 15.720 1.00 23.11 H new ATOM 1837 N LEU B 3 17.052 -12.358 15.031 1.00 61.14 N ATOM 1838 CA LEU B 3 17.073 -10.998 14.475 1.00 55.02 C ATOM 1839 C LEU B 3 17.515 -11.031 13.002 1.00 74.44 C ATOM 1840 O LEU B 3 18.639 -11.450 12.697 1.00 43.53 O ATOM 1841 CB LEU B 3 18.041 -10.098 15.291 1.00 64.34 C ATOM 1842 CG LEU B 3 17.712 -9.933 16.805 1.00 11.13 C ATOM 1843 CD1 LEU B 3 18.779 -9.074 17.521 1.00 63.32 C ATOM 1844 CD2 LEU B 3 16.297 -9.351 17.004 1.00 5.52 C ATOM 0 H LEU B 3 17.891 -12.598 15.558 1.00 61.14 H new ATOM 0 HA LEU B 3 16.066 -10.585 14.536 1.00 55.02 H new ATOM 0 HB2 LEU B 3 19.047 -10.507 15.201 1.00 64.34 H new ATOM 0 HB3 LEU B 3 18.057 -9.109 14.834 1.00 64.34 H new ATOM 0 HG LEU B 3 17.731 -10.924 17.259 1.00 11.13 H new ATOM 0 HD11 LEU B 3 18.521 -8.978 18.576 1.00 63.32 H new ATOM 0 HD12 LEU B 3 19.754 -9.553 17.428 1.00 63.32 H new ATOM 0 HD13 LEU B 3 18.816 -8.085 17.065 1.00 63.32 H new ATOM 0 HD21 LEU B 3 16.093 -9.246 18.070 1.00 5.52 H new ATOM 0 HD22 LEU B 3 16.235 -8.374 16.525 1.00 5.52 H new ATOM 0 HD23 LEU B 3 15.562 -10.021 16.558 1.00 5.52 H new ATOM 1856 N VAL B 4 16.628 -10.600 12.092 1.00 32.41 N ATOM 1857 CA VAL B 4 16.982 -10.366 10.685 1.00 64.32 C ATOM 1858 C VAL B 4 17.579 -8.952 10.547 1.00 10.14 C ATOM 1859 O VAL B 4 16.963 -7.948 10.932 1.00 32.12 O ATOM 1860 CB VAL B 4 15.767 -10.586 9.699 1.00 41.03 C ATOM 1861 CG1 VAL B 4 15.380 -12.084 9.644 1.00 73.01 C ATOM 1862 CG2 VAL B 4 14.542 -9.711 10.074 1.00 72.25 C ATOM 0 H VAL B 4 15.651 -10.405 12.310 1.00 32.41 H new ATOM 0 HA VAL B 4 17.727 -11.107 10.393 1.00 64.32 H new ATOM 0 HB VAL B 4 16.090 -10.270 8.707 1.00 41.03 H new ATOM 0 HG11 VAL B 4 14.542 -12.218 8.961 1.00 73.01 H new ATOM 0 HG12 VAL B 4 16.231 -12.667 9.293 1.00 73.01 H new ATOM 0 HG13 VAL B 4 15.094 -12.423 10.640 1.00 73.01 H new ATOM 0 HG21 VAL B 4 13.732 -9.897 9.368 1.00 72.25 H new ATOM 0 HG22 VAL B 4 14.210 -9.962 11.081 1.00 72.25 H new ATOM 0 HG23 VAL B 4 14.822 -8.658 10.036 1.00 72.25 H new ATOM 1872 N LYS B 5 18.814 -8.909 10.048 1.00 31.42 N ATOM 1873 CA LYS B 5 19.597 -7.683 9.907 1.00 53.03 C ATOM 1874 C LYS B 5 19.223 -7.011 8.584 1.00 53.34 C ATOM 1875 O LYS B 5 19.304 -7.641 7.527 1.00 73.14 O ATOM 1876 CB LYS B 5 21.100 -8.041 9.953 1.00 24.22 C ATOM 1877 CG LYS B 5 21.503 -8.867 11.197 1.00 75.12 C ATOM 1878 CD LYS B 5 22.998 -9.245 11.212 1.00 2.11 C ATOM 1879 CE LYS B 5 23.370 -10.084 12.442 1.00 71.50 C ATOM 1880 NZ LYS B 5 24.804 -10.451 12.457 1.00 12.42 N ATOM 0 H LYS B 5 19.307 -9.741 9.725 1.00 31.42 H new ATOM 0 HA LYS B 5 19.385 -6.988 10.720 1.00 53.03 H new ATOM 0 HB2 LYS B 5 21.359 -8.603 9.055 1.00 24.22 H new ATOM 0 HB3 LYS B 5 21.685 -7.121 9.933 1.00 24.22 H new ATOM 0 HG2 LYS B 5 21.269 -8.297 12.096 1.00 75.12 H new ATOM 0 HG3 LYS B 5 20.904 -9.777 11.232 1.00 75.12 H new ATOM 0 HD2 LYS B 5 23.239 -9.803 10.307 1.00 2.11 H new ATOM 0 HD3 LYS B 5 23.601 -8.337 11.197 1.00 2.11 H new ATOM 0 HE2 LYS B 5 23.131 -9.525 13.347 1.00 71.50 H new ATOM 0 HE3 LYS B 5 22.765 -10.990 12.458 1.00 71.50 H new ATOM 0 HZ1 LYS B 5 25.009 -11.017 13.305 1.00 12.42 H new ATOM 0 HZ2 LYS B 5 25.029 -11.007 11.607 1.00 12.42 H new ATOM 0 HZ3 LYS B 5 25.383 -9.587 12.469 1.00 12.42 H new ATOM 1894 N LEU B 6 18.762 -5.759 8.651 1.00 32.42 N ATOM 1895 CA LEU B 6 18.277 -5.018 7.476 1.00 71.22 C ATOM 1896 C LEU B 6 19.123 -3.758 7.273 1.00 65.33 C ATOM 1897 O LEU B 6 18.989 -2.792 8.037 1.00 52.31 O ATOM 1898 CB LEU B 6 16.776 -4.642 7.662 1.00 41.54 C ATOM 1899 CG LEU B 6 15.796 -5.833 7.929 1.00 11.11 C ATOM 1900 CD1 LEU B 6 14.364 -5.328 8.184 1.00 44.34 C ATOM 1901 CD2 LEU B 6 15.829 -6.867 6.778 1.00 43.34 C ATOM 0 H LEU B 6 18.713 -5.228 9.520 1.00 32.42 H new ATOM 0 HA LEU B 6 18.368 -5.649 6.592 1.00 71.22 H new ATOM 0 HB2 LEU B 6 16.698 -3.941 8.493 1.00 41.54 H new ATOM 0 HB3 LEU B 6 16.441 -4.116 6.768 1.00 41.54 H new ATOM 0 HG LEU B 6 16.137 -6.340 8.832 1.00 11.11 H new ATOM 0 HD11 LEU B 6 13.706 -6.177 8.366 1.00 44.34 H new ATOM 0 HD12 LEU B 6 14.359 -4.672 9.054 1.00 44.34 H new ATOM 0 HD13 LEU B 6 14.012 -4.777 7.312 1.00 44.34 H new ATOM 0 HD21 LEU B 6 15.136 -7.679 6.998 1.00 43.34 H new ATOM 0 HD22 LEU B 6 15.536 -6.383 5.846 1.00 43.34 H new ATOM 0 HD23 LEU B 6 16.838 -7.268 6.678 1.00 43.34 H new ATOM 1913 N GLU B 7 20.031 -3.785 6.281 1.00 74.45 N ATOM 1914 CA GLU B 7 20.741 -2.574 5.845 1.00 44.13 C ATOM 1915 C GLU B 7 19.770 -1.676 5.079 1.00 63.33 C ATOM 1916 O GLU B 7 18.899 -2.156 4.347 1.00 50.43 O ATOM 1917 CB GLU B 7 21.982 -2.876 4.955 1.00 35.00 C ATOM 1918 CG GLU B 7 23.160 -3.541 5.685 1.00 12.23 C ATOM 1919 CD GLU B 7 22.907 -5.017 5.983 1.00 45.01 C ATOM 1920 OE1 GLU B 7 22.677 -5.380 7.160 1.00 62.54 O ATOM 1921 OE2 GLU B 7 22.916 -5.815 5.017 1.00 40.23 O ATOM 0 H GLU B 7 20.288 -4.629 5.770 1.00 74.45 H new ATOM 0 HA GLU B 7 21.112 -2.077 6.741 1.00 44.13 H new ATOM 0 HB2 GLU B 7 21.672 -3.522 4.133 1.00 35.00 H new ATOM 0 HB3 GLU B 7 22.329 -1.942 4.513 1.00 35.00 H new ATOM 0 HG2 GLU B 7 24.060 -3.446 5.077 1.00 12.23 H new ATOM 0 HG3 GLU B 7 23.349 -3.012 6.619 1.00 12.23 H new ATOM 1928 N SER B 8 19.925 -0.379 5.277 1.00 23.44 N ATOM 1929 CA SER B 8 19.178 0.646 4.555 1.00 3.20 C ATOM 1930 C SER B 8 19.950 1.075 3.295 1.00 15.25 C ATOM 1931 O SER B 8 21.019 0.525 2.988 1.00 43.24 O ATOM 1932 CB SER B 8 18.965 1.828 5.517 1.00 65.20 C ATOM 1933 OG SER B 8 20.196 2.240 6.099 1.00 20.54 O ATOM 0 H SER B 8 20.584 0.002 5.955 1.00 23.44 H new ATOM 0 HA SER B 8 18.212 0.266 4.223 1.00 3.20 H new ATOM 0 HB2 SER B 8 18.516 2.663 4.979 1.00 65.20 H new ATOM 0 HB3 SER B 8 18.265 1.541 6.302 1.00 65.20 H new ATOM 0 HG SER B 8 20.271 1.868 7.002 1.00 20.54 H new ATOM 1939 N SER B 9 19.397 2.058 2.563 1.00 32.32 N ATOM 1940 CA SER B 9 20.108 2.751 1.473 1.00 64.02 C ATOM 1941 C SER B 9 21.274 3.589 2.043 1.00 44.13 C ATOM 1942 O SER B 9 22.244 3.884 1.345 1.00 51.44 O ATOM 1943 CB SER B 9 19.119 3.640 0.691 1.00 50.23 C ATOM 1944 OG SER B 9 18.455 4.558 1.546 1.00 70.23 O ATOM 0 H SER B 9 18.445 2.395 2.710 1.00 32.32 H new ATOM 0 HA SER B 9 20.527 2.013 0.789 1.00 64.02 H new ATOM 0 HB2 SER B 9 19.655 4.187 -0.085 1.00 50.23 H new ATOM 0 HB3 SER B 9 18.383 3.012 0.188 1.00 50.23 H new ATOM 0 HG SER B 9 17.538 4.696 1.229 1.00 70.23 H new ATOM 1950 N ASP B 10 21.151 3.949 3.334 1.00 50.03 N ATOM 1951 CA ASP B 10 22.190 4.661 4.105 1.00 45.52 C ATOM 1952 C ASP B 10 23.215 3.655 4.718 1.00 12.25 C ATOM 1953 O ASP B 10 24.208 4.058 5.342 1.00 20.33 O ATOM 1954 CB ASP B 10 21.474 5.492 5.203 1.00 32.42 C ATOM 1955 CG ASP B 10 22.408 6.352 6.078 1.00 52.45 C ATOM 1956 OD1 ASP B 10 22.707 7.502 5.706 1.00 2.40 O ATOM 1957 OD2 ASP B 10 22.819 5.886 7.163 1.00 12.52 O ATOM 0 H ASP B 10 20.313 3.750 3.881 1.00 50.03 H new ATOM 0 HA ASP B 10 22.761 5.325 3.456 1.00 45.52 H new ATOM 0 HB2 ASP B 10 20.744 6.145 4.726 1.00 32.42 H new ATOM 0 HB3 ASP B 10 20.919 4.812 5.849 1.00 32.42 H new ATOM 1962 N GLU B 11 22.937 2.342 4.520 1.00 54.45 N ATOM 1963 CA GLU B 11 23.830 1.202 4.865 1.00 42.31 C ATOM 1964 C GLU B 11 23.893 0.884 6.374 1.00 11.25 C ATOM 1965 O GLU B 11 24.596 -0.057 6.767 1.00 44.33 O ATOM 1966 CB GLU B 11 25.263 1.385 4.283 1.00 4.43 C ATOM 1967 CG GLU B 11 25.334 1.423 2.743 1.00 74.33 C ATOM 1968 CD GLU B 11 26.742 1.750 2.210 1.00 45.23 C ATOM 1969 OE1 GLU B 11 26.954 2.860 1.684 1.00 3.21 O ATOM 1970 OE2 GLU B 11 27.650 0.906 2.332 1.00 41.33 O ATOM 0 H GLU B 11 22.058 2.036 4.103 1.00 54.45 H new ATOM 0 HA GLU B 11 23.369 0.337 4.389 1.00 42.31 H new ATOM 0 HB2 GLU B 11 25.684 2.311 4.675 1.00 4.43 H new ATOM 0 HB3 GLU B 11 25.893 0.571 4.642 1.00 4.43 H new ATOM 0 HG2 GLU B 11 25.017 0.458 2.347 1.00 74.33 H new ATOM 0 HG3 GLU B 11 24.630 2.167 2.371 1.00 74.33 H new ATOM 1977 N LYS B 12 23.168 1.649 7.224 1.00 44.42 N ATOM 1978 CA LYS B 12 23.068 1.326 8.663 1.00 21.34 C ATOM 1979 C LYS B 12 22.155 0.100 8.853 1.00 25.44 C ATOM 1980 O LYS B 12 21.069 0.026 8.259 1.00 24.03 O ATOM 1981 CB LYS B 12 22.589 2.533 9.532 1.00 44.21 C ATOM 1982 CG LYS B 12 23.686 3.614 9.785 1.00 41.14 C ATOM 1983 CD LYS B 12 23.429 4.482 11.053 1.00 43.30 C ATOM 1984 CE LYS B 12 22.304 5.517 10.889 1.00 13.34 C ATOM 1985 NZ LYS B 12 22.674 6.622 9.965 1.00 51.43 N ATOM 0 H LYS B 12 22.651 2.482 6.942 1.00 44.42 H new ATOM 0 HA LYS B 12 24.071 1.091 9.018 1.00 21.34 H new ATOM 0 HB2 LYS B 12 21.737 3.004 9.042 1.00 44.21 H new ATOM 0 HB3 LYS B 12 22.236 2.157 10.493 1.00 44.21 H new ATOM 0 HG2 LYS B 12 24.653 3.121 9.883 1.00 41.14 H new ATOM 0 HG3 LYS B 12 23.747 4.267 8.915 1.00 41.14 H new ATOM 0 HD2 LYS B 12 23.184 3.824 11.887 1.00 43.30 H new ATOM 0 HD3 LYS B 12 24.350 5.002 11.317 1.00 43.30 H new ATOM 0 HE2 LYS B 12 21.409 5.019 10.515 1.00 13.34 H new ATOM 0 HE3 LYS B 12 22.053 5.933 11.865 1.00 13.34 H new ATOM 0 HZ1 LYS B 12 21.976 7.389 10.044 1.00 51.43 H new ATOM 0 HZ2 LYS B 12 23.616 6.984 10.217 1.00 51.43 H new ATOM 0 HZ3 LYS B 12 22.689 6.267 8.988 1.00 51.43 H new ATOM 1999 N VAL B 13 22.638 -0.850 9.667 1.00 4.21 N ATOM 2000 CA VAL B 13 21.994 -2.151 9.917 1.00 45.13 C ATOM 2001 C VAL B 13 20.917 -2.012 11.014 1.00 42.44 C ATOM 2002 O VAL B 13 21.121 -1.290 11.998 1.00 52.32 O ATOM 2003 CB VAL B 13 23.066 -3.214 10.367 1.00 64.51 C ATOM 2004 CG1 VAL B 13 22.446 -4.624 10.544 1.00 51.23 C ATOM 2005 CG2 VAL B 13 24.263 -3.245 9.384 1.00 75.13 C ATOM 0 H VAL B 13 23.510 -0.733 10.184 1.00 4.21 H new ATOM 0 HA VAL B 13 21.524 -2.485 8.992 1.00 45.13 H new ATOM 0 HB VAL B 13 23.439 -2.905 11.344 1.00 64.51 H new ATOM 0 HG11 VAL B 13 23.220 -5.326 10.855 1.00 51.23 H new ATOM 0 HG12 VAL B 13 21.665 -4.585 11.304 1.00 51.23 H new ATOM 0 HG13 VAL B 13 22.016 -4.954 9.598 1.00 51.23 H new ATOM 0 HG21 VAL B 13 24.989 -3.987 9.717 1.00 75.13 H new ATOM 0 HG22 VAL B 13 23.908 -3.507 8.387 1.00 75.13 H new ATOM 0 HG23 VAL B 13 24.735 -2.263 9.355 1.00 75.13 H new ATOM 2015 N PHE B 14 19.776 -2.699 10.828 1.00 52.33 N ATOM 2016 CA PHE B 14 18.665 -2.719 11.798 1.00 70.52 C ATOM 2017 C PHE B 14 18.235 -4.170 12.038 1.00 25.04 C ATOM 2018 O PHE B 14 17.562 -4.782 11.202 1.00 63.41 O ATOM 2019 CB PHE B 14 17.490 -1.841 11.295 1.00 14.01 C ATOM 2020 CG PHE B 14 17.848 -0.357 11.251 1.00 64.01 C ATOM 2021 CD1 PHE B 14 17.786 0.419 12.408 1.00 50.54 C ATOM 2022 CD2 PHE B 14 18.282 0.250 10.072 1.00 21.41 C ATOM 2023 CE1 PHE B 14 18.146 1.747 12.385 1.00 64.34 C ATOM 2024 CE2 PHE B 14 18.636 1.579 10.055 1.00 14.40 C ATOM 2025 CZ PHE B 14 18.567 2.327 11.210 1.00 2.45 C ATOM 0 H PHE B 14 19.597 -3.260 9.995 1.00 52.33 H new ATOM 0 HA PHE B 14 18.993 -2.297 12.748 1.00 70.52 H new ATOM 0 HB2 PHE B 14 17.195 -2.170 10.299 1.00 14.01 H new ATOM 0 HB3 PHE B 14 16.628 -1.985 11.947 1.00 14.01 H new ATOM 0 HD1 PHE B 14 17.452 -0.027 13.333 1.00 50.54 H new ATOM 0 HD2 PHE B 14 18.341 -0.330 9.163 1.00 21.41 H new ATOM 0 HE1 PHE B 14 18.098 2.335 13.290 1.00 64.34 H new ATOM 0 HE2 PHE B 14 18.968 2.037 9.135 1.00 14.40 H new ATOM 0 HZ PHE B 14 18.844 3.371 11.193 1.00 2.45 H new ATOM 2035 N GLU B 15 18.684 -4.719 13.174 1.00 10.34 N ATOM 2036 CA GLU B 15 18.460 -6.120 13.555 1.00 31.01 C ATOM 2037 C GLU B 15 17.104 -6.247 14.272 1.00 23.33 C ATOM 2038 O GLU B 15 17.021 -6.130 15.500 1.00 2.44 O ATOM 2039 CB GLU B 15 19.620 -6.605 14.463 1.00 31.30 C ATOM 2040 CG GLU B 15 21.028 -6.260 13.932 1.00 31.22 C ATOM 2041 CD GLU B 15 22.154 -6.681 14.888 1.00 3.11 C ATOM 2042 OE1 GLU B 15 22.888 -7.643 14.590 1.00 33.42 O ATOM 2043 OE2 GLU B 15 22.300 -6.051 15.955 1.00 24.30 O ATOM 0 H GLU B 15 19.221 -4.195 13.865 1.00 10.34 H new ATOM 0 HA GLU B 15 18.438 -6.748 12.664 1.00 31.01 H new ATOM 0 HB2 GLU B 15 19.500 -6.165 15.453 1.00 31.30 H new ATOM 0 HB3 GLU B 15 19.544 -7.686 14.583 1.00 31.30 H new ATOM 0 HG2 GLU B 15 21.176 -6.748 12.969 1.00 31.22 H new ATOM 0 HG3 GLU B 15 21.091 -5.186 13.758 1.00 31.22 H new ATOM 2050 N ILE B 16 16.042 -6.422 13.483 1.00 54.13 N ATOM 2051 CA ILE B 16 14.664 -6.553 13.991 1.00 12.04 C ATOM 2052 C ILE B 16 14.279 -8.044 14.060 1.00 32.01 C ATOM 2053 O ILE B 16 14.818 -8.858 13.309 1.00 51.42 O ATOM 2054 CB ILE B 16 13.650 -5.751 13.079 1.00 35.11 C ATOM 2055 CG1 ILE B 16 12.209 -5.755 13.688 1.00 53.32 C ATOM 2056 CG2 ILE B 16 13.649 -6.288 11.622 1.00 43.20 C ATOM 2057 CD1 ILE B 16 11.180 -4.982 12.888 1.00 11.43 C ATOM 0 H ILE B 16 16.108 -6.478 12.467 1.00 54.13 H new ATOM 0 HA ILE B 16 14.614 -6.128 14.993 1.00 12.04 H new ATOM 0 HB ILE B 16 13.990 -4.716 13.046 1.00 35.11 H new ATOM 0 HG12 ILE B 16 11.873 -6.787 13.784 1.00 53.32 H new ATOM 0 HG13 ILE B 16 12.254 -5.339 14.695 1.00 53.32 H new ATOM 0 HG21 ILE B 16 12.941 -5.714 11.023 1.00 43.20 H new ATOM 0 HG22 ILE B 16 14.648 -6.189 11.197 1.00 43.20 H new ATOM 0 HG23 ILE B 16 13.357 -7.338 11.621 1.00 43.20 H new ATOM 0 HD11 ILE B 16 10.212 -5.041 13.386 1.00 11.43 H new ATOM 0 HD12 ILE B 16 11.486 -3.939 12.813 1.00 11.43 H new ATOM 0 HD13 ILE B 16 11.100 -5.410 11.889 1.00 11.43 H new ATOM 2069 N GLU B 17 13.365 -8.385 14.978 1.00 31.10 N ATOM 2070 CA GLU B 17 12.818 -9.744 15.124 1.00 51.10 C ATOM 2071 C GLU B 17 12.105 -10.170 13.813 1.00 3.31 C ATOM 2072 O GLU B 17 11.352 -9.376 13.228 1.00 10.43 O ATOM 2073 CB GLU B 17 11.823 -9.788 16.320 1.00 74.23 C ATOM 2074 CG GLU B 17 12.421 -9.597 17.748 1.00 4.53 C ATOM 2075 CD GLU B 17 12.946 -8.186 18.083 1.00 31.43 C ATOM 2076 OE1 GLU B 17 12.434 -7.192 17.538 1.00 23.02 O ATOM 2077 OE2 GLU B 17 13.853 -8.058 18.936 1.00 1.33 O ATOM 0 H GLU B 17 12.979 -7.720 15.648 1.00 31.10 H new ATOM 0 HA GLU B 17 13.634 -10.440 15.321 1.00 51.10 H new ATOM 0 HB2 GLU B 17 11.070 -9.016 16.162 1.00 74.23 H new ATOM 0 HB3 GLU B 17 11.306 -10.747 16.295 1.00 74.23 H new ATOM 0 HG2 GLU B 17 11.656 -9.860 18.478 1.00 4.53 H new ATOM 0 HG3 GLU B 17 13.239 -10.306 17.875 1.00 4.53 H new ATOM 2084 N LYS B 18 12.354 -11.418 13.372 1.00 31.41 N ATOM 2085 CA LYS B 18 11.868 -11.932 12.069 1.00 13.40 C ATOM 2086 C LYS B 18 10.327 -11.995 12.025 1.00 62.21 C ATOM 2087 O LYS B 18 9.713 -11.599 11.029 1.00 2.10 O ATOM 2088 CB LYS B 18 12.459 -13.336 11.774 1.00 43.33 C ATOM 2089 CG LYS B 18 12.113 -13.875 10.359 1.00 24.54 C ATOM 2090 CD LYS B 18 12.647 -15.301 10.096 1.00 73.12 C ATOM 2091 CE LYS B 18 11.974 -16.359 10.988 1.00 53.31 C ATOM 2092 NZ LYS B 18 12.494 -17.726 10.723 1.00 10.12 N ATOM 0 H LYS B 18 12.896 -12.099 13.904 1.00 31.41 H new ATOM 0 HA LYS B 18 12.205 -11.236 11.301 1.00 13.40 H new ATOM 0 HB2 LYS B 18 13.543 -13.294 11.882 1.00 43.33 H new ATOM 0 HB3 LYS B 18 12.091 -14.039 12.521 1.00 43.33 H new ATOM 0 HG2 LYS B 18 11.030 -13.872 10.232 1.00 24.54 H new ATOM 0 HG3 LYS B 18 12.524 -13.198 9.610 1.00 24.54 H new ATOM 0 HD2 LYS B 18 12.486 -15.558 9.049 1.00 73.12 H new ATOM 0 HD3 LYS B 18 13.723 -15.319 10.266 1.00 73.12 H new ATOM 0 HE2 LYS B 18 12.137 -16.106 12.036 1.00 53.31 H new ATOM 0 HE3 LYS B 18 10.897 -16.342 10.820 1.00 53.31 H new ATOM 0 HZ1 LYS B 18 12.199 -18.364 11.489 1.00 10.12 H new ATOM 0 HZ2 LYS B 18 12.115 -18.073 9.819 1.00 10.12 H new ATOM 0 HZ3 LYS B 18 13.533 -17.699 10.675 1.00 10.12 H new ATOM 2106 N GLU B 19 9.737 -12.513 13.118 1.00 22.30 N ATOM 2107 CA GLU B 19 8.273 -12.603 13.308 1.00 21.31 C ATOM 2108 C GLU B 19 7.585 -11.226 13.163 1.00 2.44 C ATOM 2109 O GLU B 19 6.436 -11.152 12.737 1.00 10.51 O ATOM 2110 CB GLU B 19 7.918 -13.230 14.697 1.00 4.04 C ATOM 2111 CG GLU B 19 8.475 -12.480 15.952 1.00 12.04 C ATOM 2112 CD GLU B 19 9.838 -13.006 16.458 1.00 32.20 C ATOM 2113 OE1 GLU B 19 9.897 -13.606 17.549 1.00 44.23 O ATOM 2114 OE2 GLU B 19 10.855 -12.836 15.764 1.00 22.43 O ATOM 0 H GLU B 19 10.268 -12.886 13.905 1.00 22.30 H new ATOM 0 HA GLU B 19 7.896 -13.255 12.520 1.00 21.31 H new ATOM 0 HB2 GLU B 19 6.833 -13.283 14.782 1.00 4.04 H new ATOM 0 HB3 GLU B 19 8.290 -14.254 14.716 1.00 4.04 H new ATOM 0 HG2 GLU B 19 8.574 -11.421 15.713 1.00 12.04 H new ATOM 0 HG3 GLU B 19 7.747 -12.558 16.759 1.00 12.04 H new ATOM 2121 N ILE B 20 8.303 -10.144 13.531 1.00 72.12 N ATOM 2122 CA ILE B 20 7.814 -8.759 13.380 1.00 74.34 C ATOM 2123 C ILE B 20 7.932 -8.317 11.901 1.00 10.23 C ATOM 2124 O ILE B 20 7.011 -7.708 11.341 1.00 12.33 O ATOM 2125 CB ILE B 20 8.612 -7.765 14.308 1.00 71.33 C ATOM 2126 CG1 ILE B 20 8.528 -8.224 15.802 1.00 25.32 C ATOM 2127 CG2 ILE B 20 8.102 -6.319 14.133 1.00 32.21 C ATOM 2128 CD1 ILE B 20 9.166 -7.295 16.824 1.00 55.25 C ATOM 0 H ILE B 20 9.235 -10.206 13.940 1.00 72.12 H new ATOM 0 HA ILE B 20 6.767 -8.734 13.683 1.00 74.34 H new ATOM 0 HB ILE B 20 9.661 -7.781 14.011 1.00 71.33 H new ATOM 0 HG12 ILE B 20 7.478 -8.352 16.063 1.00 25.32 H new ATOM 0 HG13 ILE B 20 8.999 -9.203 15.887 1.00 25.32 H new ATOM 0 HG21 ILE B 20 8.668 -5.652 14.784 1.00 32.21 H new ATOM 0 HG22 ILE B 20 8.232 -6.010 13.096 1.00 32.21 H new ATOM 0 HG23 ILE B 20 7.045 -6.272 14.396 1.00 32.21 H new ATOM 0 HD11 ILE B 20 9.046 -7.715 17.823 1.00 55.25 H new ATOM 0 HD12 ILE B 20 10.227 -7.184 16.602 1.00 55.25 H new ATOM 0 HD13 ILE B 20 8.682 -6.319 16.781 1.00 55.25 H new ATOM 2140 N ALA B 21 9.071 -8.683 11.280 1.00 14.02 N ATOM 2141 CA ALA B 21 9.383 -8.359 9.872 1.00 12.34 C ATOM 2142 C ALA B 21 8.518 -9.166 8.871 1.00 44.31 C ATOM 2143 O ALA B 21 8.633 -8.976 7.657 1.00 12.41 O ATOM 2144 CB ALA B 21 10.883 -8.596 9.613 1.00 45.24 C ATOM 0 H ALA B 21 9.806 -9.216 11.744 1.00 14.02 H new ATOM 0 HA ALA B 21 9.143 -7.308 9.709 1.00 12.34 H new ATOM 0 HB1 ALA B 21 11.115 -8.358 8.575 1.00 45.24 H new ATOM 0 HB2 ALA B 21 11.471 -7.958 10.272 1.00 45.24 H new ATOM 0 HB3 ALA B 21 11.125 -9.641 9.808 1.00 45.24 H new ATOM 2150 N CYS B 22 7.664 -10.073 9.392 1.00 54.50 N ATOM 2151 CA CYS B 22 6.701 -10.833 8.582 1.00 30.05 C ATOM 2152 C CYS B 22 5.523 -9.952 8.101 1.00 55.33 C ATOM 2153 O CYS B 22 4.885 -10.283 7.095 1.00 13.02 O ATOM 2154 CB CYS B 22 6.201 -12.050 9.380 1.00 21.11 C ATOM 2155 SG CYS B 22 7.517 -13.220 9.795 1.00 51.43 S ATOM 0 H CYS B 22 7.627 -10.295 10.387 1.00 54.50 H new ATOM 0 HA CYS B 22 7.211 -11.182 7.684 1.00 30.05 H new ATOM 0 HB2 CYS B 22 5.728 -11.704 10.299 1.00 21.11 H new ATOM 0 HB3 CYS B 22 5.434 -12.566 8.802 1.00 21.11 H new ATOM 0 HG CYS B 22 8.414 -12.624 10.522 1.00 51.43 H new ATOM 2161 N MET B 23 5.226 -8.833 8.818 1.00 21.15 N ATOM 2162 CA MET B 23 4.206 -7.848 8.357 1.00 2.53 C ATOM 2163 C MET B 23 4.696 -7.098 7.106 1.00 33.14 C ATOM 2164 O MET B 23 3.884 -6.611 6.304 1.00 33.12 O ATOM 2165 CB MET B 23 3.796 -6.851 9.476 1.00 53.11 C ATOM 2166 CG MET B 23 2.923 -7.468 10.576 1.00 12.14 C ATOM 2167 SD MET B 23 2.339 -6.252 11.779 1.00 54.15 S ATOM 2168 CE MET B 23 3.878 -5.645 12.458 1.00 3.21 C ATOM 0 H MET B 23 5.670 -8.592 9.704 1.00 21.15 H new ATOM 0 HA MET B 23 3.312 -8.415 8.095 1.00 2.53 H new ATOM 0 HB2 MET B 23 4.698 -6.441 9.930 1.00 53.11 H new ATOM 0 HB3 MET B 23 3.258 -6.017 9.025 1.00 53.11 H new ATOM 0 HG2 MET B 23 2.064 -7.959 10.118 1.00 12.14 H new ATOM 0 HG3 MET B 23 3.493 -8.239 11.094 1.00 12.14 H new ATOM 0 HE1 MET B 23 3.777 -5.522 13.536 1.00 3.21 H new ATOM 0 HE2 MET B 23 4.675 -6.358 12.247 1.00 3.21 H new ATOM 0 HE3 MET B 23 4.122 -4.684 12.005 1.00 3.21 H new ATOM 2178 N SER B 24 6.025 -7.019 6.957 1.00 73.51 N ATOM 2179 CA SER B 24 6.661 -6.604 5.711 1.00 52.23 C ATOM 2180 C SER B 24 6.542 -7.764 4.717 1.00 21.51 C ATOM 2181 O SER B 24 7.283 -8.738 4.822 1.00 41.34 O ATOM 2182 CB SER B 24 8.144 -6.231 5.959 1.00 24.45 C ATOM 2183 OG SER B 24 8.772 -5.817 4.763 1.00 12.43 O ATOM 0 H SER B 24 6.686 -7.243 7.701 1.00 73.51 H new ATOM 0 HA SER B 24 6.170 -5.719 5.307 1.00 52.23 H new ATOM 0 HB2 SER B 24 8.202 -5.433 6.699 1.00 24.45 H new ATOM 0 HB3 SER B 24 8.674 -7.089 6.373 1.00 24.45 H new ATOM 0 HG SER B 24 8.090 -5.609 4.091 1.00 12.43 H new ATOM 2189 N VAL B 25 5.557 -7.673 3.797 1.00 14.54 N ATOM 2190 CA VAL B 25 5.252 -8.751 2.831 1.00 73.43 C ATOM 2191 C VAL B 25 6.438 -8.976 1.867 1.00 52.23 C ATOM 2192 O VAL B 25 6.722 -10.109 1.503 1.00 41.13 O ATOM 2193 CB VAL B 25 3.923 -8.465 2.028 1.00 32.52 C ATOM 2194 CG1 VAL B 25 3.555 -9.624 1.062 1.00 30.50 C ATOM 2195 CG2 VAL B 25 2.754 -8.162 2.999 1.00 4.25 C ATOM 0 H VAL B 25 4.954 -6.855 3.703 1.00 14.54 H new ATOM 0 HA VAL B 25 5.094 -9.665 3.404 1.00 73.43 H new ATOM 0 HB VAL B 25 4.103 -7.585 1.411 1.00 32.52 H new ATOM 0 HG11 VAL B 25 2.634 -9.379 0.534 1.00 30.50 H new ATOM 0 HG12 VAL B 25 4.360 -9.766 0.341 1.00 30.50 H new ATOM 0 HG13 VAL B 25 3.413 -10.542 1.632 1.00 30.50 H new ATOM 0 HG21 VAL B 25 1.847 -7.967 2.427 1.00 4.25 H new ATOM 0 HG22 VAL B 25 2.593 -9.019 3.654 1.00 4.25 H new ATOM 0 HG23 VAL B 25 2.998 -7.286 3.601 1.00 4.25 H new ATOM 2205 N THR B 26 7.137 -7.884 1.501 1.00 73.41 N ATOM 2206 CA THR B 26 8.326 -7.935 0.622 1.00 70.44 C ATOM 2207 C THR B 26 9.458 -8.781 1.243 1.00 23.22 C ATOM 2208 O THR B 26 9.934 -9.736 0.618 1.00 44.12 O ATOM 2209 CB THR B 26 8.835 -6.489 0.321 1.00 75.14 C ATOM 2210 OG1 THR B 26 7.765 -5.753 -0.273 1.00 74.52 O ATOM 2211 CG2 THR B 26 10.056 -6.452 -0.622 1.00 71.20 C ATOM 0 H THR B 26 6.895 -6.941 1.805 1.00 73.41 H new ATOM 0 HA THR B 26 8.029 -8.413 -0.311 1.00 70.44 H new ATOM 0 HB THR B 26 9.157 -6.051 1.266 1.00 75.14 H new ATOM 0 HG1 THR B 26 8.046 -4.825 -0.416 1.00 74.52 H new ATOM 0 HG21 THR B 26 10.356 -5.417 -0.788 1.00 71.20 H new ATOM 0 HG22 THR B 26 10.882 -7.001 -0.170 1.00 71.20 H new ATOM 0 HG23 THR B 26 9.794 -6.911 -1.575 1.00 71.20 H new ATOM 2219 N ILE B 27 9.833 -8.448 2.496 1.00 64.01 N ATOM 2220 CA ILE B 27 10.901 -9.155 3.235 1.00 30.41 C ATOM 2221 C ILE B 27 10.460 -10.605 3.542 1.00 33.13 C ATOM 2222 O ILE B 27 11.251 -11.536 3.404 1.00 62.32 O ATOM 2223 CB ILE B 27 11.277 -8.391 4.565 1.00 61.30 C ATOM 2224 CG1 ILE B 27 11.777 -6.944 4.234 1.00 23.45 C ATOM 2225 CG2 ILE B 27 12.334 -9.168 5.403 1.00 51.13 C ATOM 2226 CD1 ILE B 27 12.077 -6.086 5.451 1.00 24.12 C ATOM 0 H ILE B 27 9.406 -7.685 3.022 1.00 64.01 H new ATOM 0 HA ILE B 27 11.792 -9.183 2.608 1.00 30.41 H new ATOM 0 HB ILE B 27 10.377 -8.321 5.175 1.00 61.30 H new ATOM 0 HG12 ILE B 27 12.678 -7.015 3.625 1.00 23.45 H new ATOM 0 HG13 ILE B 27 11.022 -6.442 3.629 1.00 23.45 H new ATOM 0 HG21 ILE B 27 12.564 -8.607 6.309 1.00 51.13 H new ATOM 0 HG22 ILE B 27 11.937 -10.146 5.673 1.00 51.13 H new ATOM 0 HG23 ILE B 27 13.243 -9.295 4.815 1.00 51.13 H new ATOM 0 HD11 ILE B 27 12.417 -5.102 5.128 1.00 24.12 H new ATOM 0 HD12 ILE B 27 11.174 -5.979 6.052 1.00 24.12 H new ATOM 0 HD13 ILE B 27 12.856 -6.561 6.048 1.00 24.12 H new ATOM 2238 N LYS B 28 9.167 -10.764 3.898 1.00 32.33 N ATOM 2239 CA LYS B 28 8.545 -12.072 4.203 1.00 31.40 C ATOM 2240 C LYS B 28 8.689 -13.035 3.008 1.00 14.23 C ATOM 2241 O LYS B 28 9.163 -14.152 3.175 1.00 5.14 O ATOM 2242 CB LYS B 28 7.045 -11.877 4.552 1.00 3.31 C ATOM 2243 CG LYS B 28 6.286 -13.166 4.948 1.00 15.34 C ATOM 2244 CD LYS B 28 4.758 -12.953 5.100 1.00 71.01 C ATOM 2245 CE LYS B 28 4.071 -12.502 3.791 1.00 72.15 C ATOM 2246 NZ LYS B 28 4.196 -13.502 2.694 1.00 72.14 N ATOM 0 H LYS B 28 8.519 -9.981 3.983 1.00 32.33 H new ATOM 0 HA LYS B 28 9.058 -12.508 5.060 1.00 31.40 H new ATOM 0 HB2 LYS B 28 6.970 -11.164 5.373 1.00 3.31 H new ATOM 0 HB3 LYS B 28 6.544 -11.429 3.694 1.00 3.31 H new ATOM 0 HG2 LYS B 28 6.466 -13.932 4.194 1.00 15.34 H new ATOM 0 HG3 LYS B 28 6.689 -13.543 5.888 1.00 15.34 H new ATOM 0 HD2 LYS B 28 4.301 -13.882 5.441 1.00 71.01 H new ATOM 0 HD3 LYS B 28 4.577 -12.206 5.873 1.00 71.01 H new ATOM 0 HE2 LYS B 28 3.015 -12.316 3.987 1.00 72.15 H new ATOM 0 HE3 LYS B 28 4.506 -11.557 3.465 1.00 72.15 H new ATOM 0 HZ1 LYS B 28 4.648 -13.058 1.869 1.00 72.14 H new ATOM 0 HZ2 LYS B 28 4.776 -14.302 3.018 1.00 72.14 H new ATOM 0 HZ3 LYS B 28 3.251 -13.845 2.428 1.00 72.14 H new ATOM 2260 N ASN B 29 8.321 -12.548 1.800 1.00 31.12 N ATOM 2261 CA ASN B 29 8.361 -13.344 0.550 1.00 65.31 C ATOM 2262 C ASN B 29 9.805 -13.741 0.189 1.00 53.41 C ATOM 2263 O ASN B 29 10.031 -14.835 -0.326 1.00 63.20 O ATOM 2264 CB ASN B 29 7.708 -12.576 -0.639 1.00 12.40 C ATOM 2265 CG ASN B 29 6.202 -12.324 -0.467 1.00 55.11 C ATOM 2266 OD1 ASN B 29 5.501 -13.059 0.230 1.00 74.15 O ATOM 2267 ND2 ASN B 29 5.687 -11.286 -1.117 1.00 75.12 N ATOM 0 H ASN B 29 7.988 -11.593 1.664 1.00 31.12 H new ATOM 0 HA ASN B 29 7.784 -14.251 0.731 1.00 65.31 H new ATOM 0 HB2 ASN B 29 8.215 -11.619 -0.762 1.00 12.40 H new ATOM 0 HB3 ASN B 29 7.869 -13.142 -1.556 1.00 12.40 H new ATOM 0 HD21 ASN B 29 4.690 -11.083 -1.045 1.00 75.12 H new ATOM 0 HD22 ASN B 29 6.289 -10.692 -1.688 1.00 75.12 H new ATOM 2274 N MET B 30 10.767 -12.833 0.476 1.00 25.45 N ATOM 2275 CA MET B 30 12.213 -13.081 0.248 1.00 35.41 C ATOM 2276 C MET B 30 12.720 -14.224 1.149 1.00 54.40 C ATOM 2277 O MET B 30 13.462 -15.100 0.694 1.00 34.21 O ATOM 2278 CB MET B 30 13.051 -11.793 0.510 1.00 51.42 C ATOM 2279 CG MET B 30 12.825 -10.656 -0.488 1.00 64.41 C ATOM 2280 SD MET B 30 13.797 -9.192 -0.068 1.00 21.02 S ATOM 2281 CE MET B 30 13.376 -8.079 -1.402 1.00 71.23 C ATOM 0 H MET B 30 10.566 -11.914 0.869 1.00 25.45 H new ATOM 0 HA MET B 30 12.337 -13.371 -0.795 1.00 35.41 H new ATOM 0 HB2 MET B 30 12.823 -11.427 1.511 1.00 51.42 H new ATOM 0 HB3 MET B 30 14.108 -12.058 0.501 1.00 51.42 H new ATOM 0 HG2 MET B 30 13.091 -10.994 -1.490 1.00 64.41 H new ATOM 0 HG3 MET B 30 11.767 -10.396 -0.509 1.00 64.41 H new ATOM 0 HE1 MET B 30 13.616 -7.056 -1.112 1.00 71.23 H new ATOM 0 HE2 MET B 30 13.945 -8.347 -2.292 1.00 71.23 H new ATOM 0 HE3 MET B 30 12.310 -8.155 -1.616 1.00 71.23 H new ATOM 2291 N ILE B 31 12.286 -14.196 2.424 1.00 23.11 N ATOM 2292 CA ILE B 31 12.680 -15.194 3.430 1.00 35.32 C ATOM 2293 C ILE B 31 12.078 -16.570 3.079 1.00 64.45 C ATOM 2294 O ILE B 31 12.794 -17.564 3.070 1.00 4.34 O ATOM 2295 CB ILE B 31 12.259 -14.743 4.886 1.00 13.20 C ATOM 2296 CG1 ILE B 31 12.973 -13.403 5.273 1.00 43.03 C ATOM 2297 CG2 ILE B 31 12.565 -15.843 5.933 1.00 11.14 C ATOM 2298 CD1 ILE B 31 12.573 -12.831 6.624 1.00 72.22 C ATOM 0 H ILE B 31 11.653 -13.481 2.782 1.00 23.11 H new ATOM 0 HA ILE B 31 13.767 -15.278 3.419 1.00 35.32 H new ATOM 0 HB ILE B 31 11.181 -14.579 4.884 1.00 13.20 H new ATOM 0 HG12 ILE B 31 14.050 -13.568 5.269 1.00 43.03 H new ATOM 0 HG13 ILE B 31 12.762 -12.660 4.504 1.00 43.03 H new ATOM 0 HG21 ILE B 31 12.263 -15.498 6.922 1.00 11.14 H new ATOM 0 HG22 ILE B 31 12.014 -16.749 5.680 1.00 11.14 H new ATOM 0 HG23 ILE B 31 13.634 -16.057 5.934 1.00 11.14 H new ATOM 0 HD11 ILE B 31 13.119 -11.905 6.803 1.00 72.22 H new ATOM 0 HD12 ILE B 31 11.502 -12.628 6.630 1.00 72.22 H new ATOM 0 HD13 ILE B 31 12.811 -13.550 7.408 1.00 72.22 H new ATOM 2310 N GLU B 32 10.771 -16.584 2.736 1.00 30.43 N ATOM 2311 CA GLU B 32 10.023 -17.813 2.371 1.00 24.12 C ATOM 2312 C GLU B 32 10.623 -18.484 1.127 1.00 51.43 C ATOM 2313 O GLU B 32 10.695 -19.714 1.052 1.00 75.12 O ATOM 2314 CB GLU B 32 8.525 -17.484 2.117 1.00 33.33 C ATOM 2315 CG GLU B 32 7.756 -16.980 3.354 1.00 31.53 C ATOM 2316 CD GLU B 32 6.328 -16.530 3.021 1.00 34.43 C ATOM 2317 OE1 GLU B 32 6.174 -15.454 2.404 1.00 32.41 O ATOM 2318 OE2 GLU B 32 5.359 -17.241 3.372 1.00 15.43 O ATOM 0 H GLU B 32 10.200 -15.739 2.704 1.00 30.43 H new ATOM 0 HA GLU B 32 10.102 -18.506 3.208 1.00 24.12 H new ATOM 0 HB2 GLU B 32 8.461 -16.728 1.334 1.00 33.33 H new ATOM 0 HB3 GLU B 32 8.030 -18.378 1.738 1.00 33.33 H new ATOM 0 HG2 GLU B 32 7.718 -17.773 4.101 1.00 31.53 H new ATOM 0 HG3 GLU B 32 8.300 -16.148 3.801 1.00 31.53 H new ATOM 2325 N ASP B 33 11.055 -17.640 0.175 1.00 52.10 N ATOM 2326 CA ASP B 33 11.687 -18.062 -1.091 1.00 64.30 C ATOM 2327 C ASP B 33 12.961 -18.892 -0.822 1.00 52.45 C ATOM 2328 O ASP B 33 13.170 -19.962 -1.411 1.00 11.31 O ATOM 2329 CB ASP B 33 12.022 -16.787 -1.922 1.00 2.42 C ATOM 2330 CG ASP B 33 12.710 -17.071 -3.267 1.00 64.23 C ATOM 2331 OD1 ASP B 33 13.957 -17.033 -3.340 1.00 23.44 O ATOM 2332 OD2 ASP B 33 11.999 -17.310 -4.266 1.00 71.43 O ATOM 0 H ASP B 33 10.974 -16.627 0.263 1.00 52.10 H new ATOM 0 HA ASP B 33 11.000 -18.698 -1.650 1.00 64.30 H new ATOM 0 HB2 ASP B 33 11.100 -16.236 -2.108 1.00 2.42 H new ATOM 0 HB3 ASP B 33 12.666 -16.139 -1.328 1.00 2.42 H new ATOM 2337 N ILE B 34 13.772 -18.390 0.119 1.00 22.55 N ATOM 2338 CA ILE B 34 15.071 -18.980 0.504 1.00 64.22 C ATOM 2339 C ILE B 34 14.885 -20.020 1.646 1.00 12.40 C ATOM 2340 O ILE B 34 15.793 -20.807 1.954 1.00 52.14 O ATOM 2341 CB ILE B 34 16.062 -17.812 0.914 1.00 50.20 C ATOM 2342 CG1 ILE B 34 16.168 -16.777 -0.262 1.00 21.23 C ATOM 2343 CG2 ILE B 34 17.467 -18.339 1.314 1.00 22.44 C ATOM 2344 CD1 ILE B 34 17.037 -15.562 0.011 1.00 2.24 C ATOM 0 H ILE B 34 13.544 -17.547 0.646 1.00 22.55 H new ATOM 0 HA ILE B 34 15.502 -19.519 -0.340 1.00 64.22 H new ATOM 0 HB ILE B 34 15.653 -17.321 1.797 1.00 50.20 H new ATOM 0 HG12 ILE B 34 16.558 -17.291 -1.141 1.00 21.23 H new ATOM 0 HG13 ILE B 34 15.164 -16.435 -0.513 1.00 21.23 H new ATOM 0 HG21 ILE B 34 18.107 -17.499 1.586 1.00 22.44 H new ATOM 0 HG22 ILE B 34 17.374 -19.014 2.165 1.00 22.44 H new ATOM 0 HG23 ILE B 34 17.908 -18.874 0.473 1.00 22.44 H new ATOM 0 HD11 ILE B 34 17.041 -14.913 -0.865 1.00 2.24 H new ATOM 0 HD12 ILE B 34 16.639 -15.015 0.866 1.00 2.24 H new ATOM 0 HD13 ILE B 34 18.055 -15.884 0.228 1.00 2.24 H new ATOM 2356 N GLY B 35 13.671 -20.059 2.221 1.00 5.22 N ATOM 2357 CA GLY B 35 13.369 -20.885 3.384 1.00 40.10 C ATOM 2358 C GLY B 35 13.464 -20.054 4.650 1.00 73.52 C ATOM 2359 O GLY B 35 12.442 -19.646 5.205 1.00 1.43 O ATOM 0 H GLY B 35 12.876 -19.515 1.886 1.00 5.22 H new ATOM 0 HA2 GLY B 35 12.368 -21.307 3.291 1.00 40.10 H new ATOM 0 HA3 GLY B 35 14.065 -21.723 3.436 1.00 40.10 H new ATOM 2363 N GLU B 36 14.708 -19.767 5.077 1.00 73.40 N ATOM 2364 CA GLU B 36 15.008 -18.824 6.178 1.00 51.31 C ATOM 2365 C GLU B 36 16.298 -18.054 5.838 1.00 2.04 C ATOM 2366 O GLU B 36 17.400 -18.609 5.919 1.00 30.31 O ATOM 2367 CB GLU B 36 15.120 -19.560 7.557 1.00 44.34 C ATOM 2368 CG GLU B 36 13.767 -20.057 8.124 1.00 11.34 C ATOM 2369 CD GLU B 36 13.874 -20.820 9.454 1.00 10.45 C ATOM 2370 OE1 GLU B 36 13.980 -20.174 10.516 1.00 30.21 O ATOM 2371 OE2 GLU B 36 13.843 -22.071 9.444 1.00 62.34 O ATOM 0 H GLU B 36 15.542 -20.185 4.666 1.00 73.40 H new ATOM 0 HA GLU B 36 14.185 -18.117 6.277 1.00 51.31 H new ATOM 0 HB2 GLU B 36 15.790 -20.413 7.448 1.00 44.34 H new ATOM 0 HB3 GLU B 36 15.578 -18.885 8.280 1.00 44.34 H new ATOM 0 HG2 GLU B 36 13.109 -19.199 8.264 1.00 11.34 H new ATOM 0 HG3 GLU B 36 13.294 -20.704 7.386 1.00 11.34 H new ATOM 2378 N SER B 37 16.133 -16.787 5.403 1.00 14.13 N ATOM 2379 CA SER B 37 17.246 -15.890 5.057 1.00 61.10 C ATOM 2380 C SER B 37 18.049 -15.506 6.320 1.00 51.20 C ATOM 2381 O SER B 37 17.601 -14.679 7.128 1.00 3.40 O ATOM 2382 CB SER B 37 16.704 -14.623 4.351 1.00 35.41 C ATOM 2383 OG SER B 37 15.961 -14.959 3.193 1.00 22.14 O ATOM 0 H SER B 37 15.215 -16.359 5.283 1.00 14.13 H new ATOM 0 HA SER B 37 17.917 -16.412 4.375 1.00 61.10 H new ATOM 0 HB2 SER B 37 16.074 -14.061 5.040 1.00 35.41 H new ATOM 0 HB3 SER B 37 17.535 -13.973 4.077 1.00 35.41 H new ATOM 0 HG SER B 37 15.629 -14.140 2.768 1.00 22.14 H new ATOM 2389 N ASP B 38 19.212 -16.156 6.495 1.00 73.32 N ATOM 2390 CA ASP B 38 20.121 -15.904 7.630 1.00 61.23 C ATOM 2391 C ASP B 38 21.017 -14.686 7.331 1.00 11.12 C ATOM 2392 O ASP B 38 21.380 -13.932 8.244 1.00 4.13 O ATOM 2393 CB ASP B 38 20.982 -17.168 7.935 1.00 10.34 C ATOM 2394 CG ASP B 38 22.051 -17.474 6.865 1.00 22.10 C ATOM 2395 OD1 ASP B 38 21.687 -17.685 5.690 1.00 42.33 O ATOM 2396 OD2 ASP B 38 23.259 -17.505 7.197 1.00 2.35 O ATOM 0 H ASP B 38 19.550 -16.873 5.853 1.00 73.32 H new ATOM 0 HA ASP B 38 19.524 -15.684 8.515 1.00 61.23 H new ATOM 0 HB2 ASP B 38 21.475 -17.035 8.898 1.00 10.34 H new ATOM 0 HB3 ASP B 38 20.322 -18.030 8.031 1.00 10.34 H new ATOM 2401 N SER B 39 21.370 -14.511 6.038 1.00 74.11 N ATOM 2402 CA SER B 39 22.198 -13.392 5.570 1.00 64.25 C ATOM 2403 C SER B 39 21.389 -12.070 5.634 1.00 11.44 C ATOM 2404 O SER B 39 20.179 -12.086 5.355 1.00 12.34 O ATOM 2405 CB SER B 39 22.693 -13.673 4.127 1.00 65.03 C ATOM 2406 OG SER B 39 21.610 -13.874 3.233 1.00 74.11 O ATOM 0 H SER B 39 21.085 -15.147 5.293 1.00 74.11 H new ATOM 0 HA SER B 39 23.068 -13.289 6.218 1.00 64.25 H new ATOM 0 HB2 SER B 39 23.301 -12.837 3.781 1.00 65.03 H new ATOM 0 HB3 SER B 39 23.334 -14.555 4.127 1.00 65.03 H new ATOM 0 HG SER B 39 21.957 -14.047 2.333 1.00 74.11 H new ATOM 2412 N PRO B 40 22.034 -10.924 6.038 1.00 11.15 N ATOM 2413 CA PRO B 40 21.367 -9.598 6.075 1.00 23.25 C ATOM 2414 C PRO B 40 20.777 -9.171 4.707 1.00 3.11 C ATOM 2415 O PRO B 40 21.389 -9.422 3.659 1.00 14.24 O ATOM 2416 CB PRO B 40 22.499 -8.639 6.505 1.00 33.14 C ATOM 2417 CG PRO B 40 23.499 -9.487 7.213 1.00 4.23 C ATOM 2418 CD PRO B 40 23.444 -10.835 6.525 1.00 1.51 C ATOM 0 HA PRO B 40 20.510 -9.602 6.748 1.00 23.25 H new ATOM 0 HB2 PRO B 40 22.945 -8.147 5.640 1.00 33.14 H new ATOM 0 HB3 PRO B 40 22.119 -7.853 7.158 1.00 33.14 H new ATOM 0 HG2 PRO B 40 24.497 -9.054 7.149 1.00 4.23 H new ATOM 0 HG3 PRO B 40 23.258 -9.577 8.272 1.00 4.23 H new ATOM 0 HD2 PRO B 40 24.157 -10.895 5.702 1.00 1.51 H new ATOM 0 HD3 PRO B 40 23.683 -11.646 7.213 1.00 1.51 H new ATOM 2426 N ILE B 41 19.580 -8.551 4.741 1.00 60.33 N ATOM 2427 CA ILE B 41 18.866 -8.086 3.538 1.00 1.05 C ATOM 2428 C ILE B 41 19.161 -6.574 3.337 1.00 62.23 C ATOM 2429 O ILE B 41 18.665 -5.744 4.113 1.00 74.22 O ATOM 2430 CB ILE B 41 17.292 -8.330 3.620 1.00 21.44 C ATOM 2431 CG1 ILE B 41 16.909 -9.851 3.859 1.00 20.41 C ATOM 2432 CG2 ILE B 41 16.588 -7.788 2.343 1.00 64.22 C ATOM 2433 CD1 ILE B 41 17.126 -10.382 5.279 1.00 43.14 C ATOM 0 H ILE B 41 19.080 -8.359 5.609 1.00 60.33 H new ATOM 0 HA ILE B 41 19.226 -8.667 2.689 1.00 1.05 H new ATOM 0 HB ILE B 41 16.938 -7.778 4.491 1.00 21.44 H new ATOM 0 HG12 ILE B 41 15.859 -9.986 3.598 1.00 20.41 H new ATOM 0 HG13 ILE B 41 17.490 -10.464 3.170 1.00 20.41 H new ATOM 0 HG21 ILE B 41 15.515 -7.963 2.417 1.00 64.22 H new ATOM 0 HG22 ILE B 41 16.775 -6.718 2.251 1.00 64.22 H new ATOM 0 HG23 ILE B 41 16.980 -8.302 1.465 1.00 64.22 H new ATOM 0 HD11 ILE B 41 16.831 -11.430 5.325 1.00 43.14 H new ATOM 0 HD12 ILE B 41 18.179 -10.290 5.545 1.00 43.14 H new ATOM 0 HD13 ILE B 41 16.523 -9.804 5.980 1.00 43.14 H new ATOM 2445 N PRO B 42 20.020 -6.193 2.328 1.00 62.51 N ATOM 2446 CA PRO B 42 20.277 -4.777 1.981 1.00 41.31 C ATOM 2447 C PRO B 42 19.102 -4.186 1.159 1.00 54.23 C ATOM 2448 O PRO B 42 18.702 -4.759 0.141 1.00 3.02 O ATOM 2449 CB PRO B 42 21.608 -4.836 1.158 1.00 13.20 C ATOM 2450 CG PRO B 42 22.079 -6.268 1.243 1.00 31.31 C ATOM 2451 CD PRO B 42 20.831 -7.087 1.466 1.00 72.32 C ATOM 0 HA PRO B 42 20.363 -4.127 2.852 1.00 41.31 H new ATOM 0 HB2 PRO B 42 21.441 -4.540 0.122 1.00 13.20 H new ATOM 0 HB3 PRO B 42 22.353 -4.154 1.569 1.00 13.20 H new ATOM 0 HG2 PRO B 42 22.588 -6.569 0.328 1.00 31.31 H new ATOM 0 HG3 PRO B 42 22.788 -6.401 2.061 1.00 31.31 H new ATOM 0 HD2 PRO B 42 20.324 -7.320 0.530 1.00 72.32 H new ATOM 0 HD3 PRO B 42 21.049 -8.036 1.955 1.00 72.32 H new ATOM 2459 N LEU B 43 18.555 -3.051 1.622 1.00 75.23 N ATOM 2460 CA LEU B 43 17.368 -2.395 1.025 1.00 24.15 C ATOM 2461 C LEU B 43 17.772 -1.043 0.372 1.00 43.04 C ATOM 2462 O LEU B 43 17.854 -0.021 1.069 1.00 10.22 O ATOM 2463 CB LEU B 43 16.282 -2.194 2.127 1.00 2.30 C ATOM 2464 CG LEU B 43 15.734 -3.501 2.798 1.00 34.53 C ATOM 2465 CD1 LEU B 43 14.844 -3.179 4.019 1.00 43.35 C ATOM 2466 CD2 LEU B 43 14.989 -4.390 1.767 1.00 72.12 C ATOM 0 H LEU B 43 18.925 -2.552 2.431 1.00 75.23 H new ATOM 0 HA LEU B 43 16.953 -3.028 0.240 1.00 24.15 H new ATOM 0 HB2 LEU B 43 16.698 -1.556 2.907 1.00 2.30 H new ATOM 0 HB3 LEU B 43 15.442 -1.655 1.688 1.00 2.30 H new ATOM 0 HG LEU B 43 16.590 -4.069 3.164 1.00 34.53 H new ATOM 0 HD11 LEU B 43 14.481 -4.108 4.460 1.00 43.35 H new ATOM 0 HD12 LEU B 43 15.426 -2.629 4.759 1.00 43.35 H new ATOM 0 HD13 LEU B 43 13.996 -2.573 3.701 1.00 43.35 H new ATOM 0 HD21 LEU B 43 14.620 -5.289 2.261 1.00 72.12 H new ATOM 0 HD22 LEU B 43 14.149 -3.836 1.348 1.00 72.12 H new ATOM 0 HD23 LEU B 43 15.674 -4.671 0.967 1.00 72.12 H new ATOM 2478 N PRO B 44 18.054 -1.017 -0.978 1.00 23.03 N ATOM 2479 CA PRO B 44 18.507 0.202 -1.689 1.00 31.42 C ATOM 2480 C PRO B 44 17.324 1.107 -2.114 1.00 61.32 C ATOM 2481 O PRO B 44 16.987 1.207 -3.304 1.00 25.11 O ATOM 2482 CB PRO B 44 19.276 -0.391 -2.899 1.00 41.44 C ATOM 2483 CG PRO B 44 18.535 -1.661 -3.231 1.00 12.24 C ATOM 2484 CD PRO B 44 17.956 -2.177 -1.915 1.00 31.42 C ATOM 0 HA PRO B 44 19.119 0.864 -1.076 1.00 31.42 H new ATOM 0 HB2 PRO B 44 19.280 0.298 -3.743 1.00 41.44 H new ATOM 0 HB3 PRO B 44 20.317 -0.593 -2.647 1.00 41.44 H new ATOM 0 HG2 PRO B 44 17.743 -1.471 -3.956 1.00 12.24 H new ATOM 0 HG3 PRO B 44 19.205 -2.397 -3.676 1.00 12.24 H new ATOM 0 HD2 PRO B 44 16.923 -2.501 -2.037 1.00 31.42 H new ATOM 0 HD3 PRO B 44 18.518 -3.034 -1.544 1.00 31.42 H new ATOM 2492 N ASN B 45 16.698 1.743 -1.112 1.00 53.11 N ATOM 2493 CA ASN B 45 15.573 2.676 -1.313 1.00 0.25 C ATOM 2494 C ASN B 45 15.312 3.434 -0.007 1.00 53.30 C ATOM 2495 O ASN B 45 15.538 4.647 0.079 1.00 55.24 O ATOM 2496 CB ASN B 45 14.290 1.919 -1.778 1.00 23.02 C ATOM 2497 CG ASN B 45 13.056 2.823 -1.947 1.00 31.22 C ATOM 2498 OD1 ASN B 45 12.274 3.021 -1.013 1.00 2.44 O ATOM 2499 ND2 ASN B 45 12.866 3.367 -3.143 1.00 62.53 N ATOM 0 H ASN B 45 16.958 1.625 -0.133 1.00 53.11 H new ATOM 0 HA ASN B 45 15.835 3.385 -2.099 1.00 0.25 H new ATOM 0 HB2 ASN B 45 14.497 1.423 -2.726 1.00 23.02 H new ATOM 0 HB3 ASN B 45 14.059 1.138 -1.054 1.00 23.02 H new ATOM 0 HD21 ASN B 45 12.057 3.966 -3.308 1.00 62.53 H new ATOM 0 HD22 ASN B 45 13.529 3.186 -3.897 1.00 62.53 H new ATOM 2506 N VAL B 46 14.863 2.681 1.012 1.00 31.04 N ATOM 2507 CA VAL B 46 14.478 3.237 2.316 1.00 24.10 C ATOM 2508 C VAL B 46 15.735 3.622 3.137 1.00 2.33 C ATOM 2509 O VAL B 46 16.631 2.798 3.340 1.00 34.44 O ATOM 2510 CB VAL B 46 13.554 2.224 3.107 1.00 45.24 C ATOM 2511 CG1 VAL B 46 14.221 0.834 3.305 1.00 33.15 C ATOM 2512 CG2 VAL B 46 13.089 2.831 4.451 1.00 20.42 C ATOM 0 H VAL B 46 14.758 1.668 0.952 1.00 31.04 H new ATOM 0 HA VAL B 46 13.900 4.146 2.149 1.00 24.10 H new ATOM 0 HB VAL B 46 12.671 2.053 2.491 1.00 45.24 H new ATOM 0 HG11 VAL B 46 13.543 0.180 3.853 1.00 33.15 H new ATOM 0 HG12 VAL B 46 14.442 0.395 2.332 1.00 33.15 H new ATOM 0 HG13 VAL B 46 15.147 0.952 3.869 1.00 33.15 H new ATOM 0 HG21 VAL B 46 12.456 2.114 4.974 1.00 20.42 H new ATOM 0 HG22 VAL B 46 13.959 3.063 5.066 1.00 20.42 H new ATOM 0 HG23 VAL B 46 12.524 3.744 4.262 1.00 20.42 H new ATOM 2522 N THR B 47 15.795 4.896 3.573 1.00 14.41 N ATOM 2523 CA THR B 47 16.928 5.440 4.355 1.00 24.33 C ATOM 2524 C THR B 47 16.923 4.875 5.781 1.00 72.50 C ATOM 2525 O THR B 47 15.932 4.290 6.205 1.00 24.04 O ATOM 2526 CB THR B 47 16.857 6.994 4.413 1.00 21.51 C ATOM 2527 OG1 THR B 47 15.646 7.397 5.069 1.00 24.32 O ATOM 2528 CG2 THR B 47 16.917 7.614 3.009 1.00 54.55 C ATOM 0 H THR B 47 15.059 5.579 3.394 1.00 14.41 H new ATOM 0 HA THR B 47 17.851 5.142 3.858 1.00 24.33 H new ATOM 0 HB THR B 47 17.720 7.351 4.975 1.00 21.51 H new ATOM 0 HG1 THR B 47 15.604 8.375 5.106 1.00 24.32 H new ATOM 0 HG21 THR B 47 16.865 8.700 3.088 1.00 54.55 H new ATOM 0 HG22 THR B 47 17.852 7.330 2.525 1.00 54.55 H new ATOM 0 HG23 THR B 47 16.077 7.253 2.416 1.00 54.55 H new ATOM 2536 N SER B 48 18.027 5.078 6.522 1.00 24.10 N ATOM 2537 CA SER B 48 18.188 4.533 7.881 1.00 75.14 C ATOM 2538 C SER B 48 17.215 5.197 8.868 1.00 42.04 C ATOM 2539 O SER B 48 16.678 4.530 9.743 1.00 62.43 O ATOM 2540 CB SER B 48 19.639 4.714 8.357 1.00 13.33 C ATOM 2541 OG SER B 48 20.018 6.073 8.326 1.00 0.14 O ATOM 0 H SER B 48 18.827 5.621 6.198 1.00 24.10 H new ATOM 0 HA SER B 48 17.955 3.469 7.847 1.00 75.14 H new ATOM 0 HB2 SER B 48 19.743 4.327 9.371 1.00 13.33 H new ATOM 0 HB3 SER B 48 20.308 4.132 7.723 1.00 13.33 H new ATOM 0 HG SER B 48 20.111 6.408 9.242 1.00 0.14 H new ATOM 2547 N THR B 49 16.998 6.514 8.687 1.00 60.25 N ATOM 2548 CA THR B 49 16.098 7.316 9.534 1.00 75.05 C ATOM 2549 C THR B 49 14.645 6.803 9.424 1.00 54.51 C ATOM 2550 O THR B 49 13.974 6.559 10.434 1.00 10.43 O ATOM 2551 CB THR B 49 16.156 8.824 9.111 1.00 61.43 C ATOM 2552 OG1 THR B 49 17.526 9.242 9.020 1.00 71.21 O ATOM 2553 CG2 THR B 49 15.409 9.750 10.097 1.00 15.24 C ATOM 0 H THR B 49 17.445 7.053 7.945 1.00 60.25 H new ATOM 0 HA THR B 49 16.428 7.219 10.568 1.00 75.05 H new ATOM 0 HB THR B 49 15.659 8.906 8.144 1.00 61.43 H new ATOM 0 HG1 THR B 49 17.563 10.184 8.754 1.00 71.21 H new ATOM 0 HG21 THR B 49 15.483 10.782 9.754 1.00 15.24 H new ATOM 0 HG22 THR B 49 14.360 9.458 10.147 1.00 15.24 H new ATOM 0 HG23 THR B 49 15.857 9.664 11.087 1.00 15.24 H new ATOM 2561 N ILE B 50 14.195 6.618 8.171 1.00 41.23 N ATOM 2562 CA ILE B 50 12.828 6.183 7.861 1.00 24.42 C ATOM 2563 C ILE B 50 12.637 4.701 8.238 1.00 53.54 C ATOM 2564 O ILE B 50 11.654 4.360 8.887 1.00 44.14 O ATOM 2565 CB ILE B 50 12.488 6.435 6.344 1.00 12.12 C ATOM 2566 CG1 ILE B 50 12.602 7.958 6.010 1.00 54.21 C ATOM 2567 CG2 ILE B 50 11.094 5.886 5.956 1.00 5.45 C ATOM 2568 CD1 ILE B 50 11.664 8.875 6.790 1.00 33.30 C ATOM 0 H ILE B 50 14.773 6.767 7.344 1.00 41.23 H new ATOM 0 HA ILE B 50 12.134 6.776 8.456 1.00 24.42 H new ATOM 0 HB ILE B 50 13.218 5.887 5.749 1.00 12.12 H new ATOM 0 HG12 ILE B 50 13.628 8.276 6.194 1.00 54.21 H new ATOM 0 HG13 ILE B 50 12.412 8.094 4.945 1.00 54.21 H new ATOM 0 HG21 ILE B 50 10.906 6.084 4.901 1.00 5.45 H new ATOM 0 HG22 ILE B 50 11.064 4.811 6.135 1.00 5.45 H new ATOM 0 HG23 ILE B 50 10.329 6.376 6.559 1.00 5.45 H new ATOM 0 HD11 ILE B 50 11.825 9.908 6.482 1.00 33.30 H new ATOM 0 HD12 ILE B 50 10.630 8.594 6.589 1.00 33.30 H new ATOM 0 HD13 ILE B 50 11.866 8.779 7.857 1.00 33.30 H new ATOM 2580 N LEU B 51 13.621 3.851 7.865 1.00 24.45 N ATOM 2581 CA LEU B 51 13.598 2.394 8.142 1.00 61.32 C ATOM 2582 C LEU B 51 13.544 2.132 9.654 1.00 14.24 C ATOM 2583 O LEU B 51 12.842 1.228 10.098 1.00 2.31 O ATOM 2584 CB LEU B 51 14.838 1.679 7.524 1.00 72.21 C ATOM 2585 CG LEU B 51 14.855 0.113 7.609 1.00 41.44 C ATOM 2586 CD1 LEU B 51 13.631 -0.513 6.897 1.00 64.31 C ATOM 2587 CD2 LEU B 51 16.179 -0.467 7.061 1.00 61.13 C ATOM 0 H LEU B 51 14.455 4.155 7.363 1.00 24.45 H new ATOM 0 HA LEU B 51 12.701 1.986 7.677 1.00 61.32 H new ATOM 0 HB2 LEU B 51 14.909 1.965 6.475 1.00 72.21 H new ATOM 0 HB3 LEU B 51 15.732 2.058 8.019 1.00 72.21 H new ATOM 0 HG LEU B 51 14.788 -0.153 8.664 1.00 41.44 H new ATOM 0 HD11 LEU B 51 13.679 -1.599 6.978 1.00 64.31 H new ATOM 0 HD12 LEU B 51 12.715 -0.154 7.366 1.00 64.31 H new ATOM 0 HD13 LEU B 51 13.636 -0.227 5.845 1.00 64.31 H new ATOM 0 HD21 LEU B 51 16.158 -1.554 7.135 1.00 61.13 H new ATOM 0 HD22 LEU B 51 16.299 -0.176 6.017 1.00 61.13 H new ATOM 0 HD23 LEU B 51 17.015 -0.080 7.644 1.00 61.13 H new ATOM 2599 N GLU B 52 14.272 2.969 10.423 1.00 54.32 N ATOM 2600 CA GLU B 52 14.306 2.896 11.891 1.00 71.34 C ATOM 2601 C GLU B 52 12.893 3.064 12.458 1.00 21.03 C ATOM 2602 O GLU B 52 12.436 2.229 13.231 1.00 74.03 O ATOM 2603 CB GLU B 52 15.240 3.989 12.474 1.00 74.01 C ATOM 2604 CG GLU B 52 15.432 3.906 14.000 1.00 23.21 C ATOM 2605 CD GLU B 52 16.409 4.958 14.542 1.00 1.54 C ATOM 2606 OE1 GLU B 52 15.975 6.063 14.909 1.00 71.41 O ATOM 2607 OE2 GLU B 52 17.619 4.687 14.608 1.00 11.43 O ATOM 0 H GLU B 52 14.852 3.714 10.038 1.00 54.32 H new ATOM 0 HA GLU B 52 14.695 1.919 12.177 1.00 71.34 H new ATOM 0 HB2 GLU B 52 16.215 3.914 11.992 1.00 74.01 H new ATOM 0 HB3 GLU B 52 14.835 4.969 12.223 1.00 74.01 H new ATOM 0 HG2 GLU B 52 14.466 4.030 14.489 1.00 23.21 H new ATOM 0 HG3 GLU B 52 15.796 2.912 14.261 1.00 23.21 H new ATOM 2614 N LYS B 53 12.210 4.133 12.004 1.00 72.21 N ATOM 2615 CA LYS B 53 10.858 4.491 12.467 1.00 43.21 C ATOM 2616 C LYS B 53 9.815 3.428 12.067 1.00 41.20 C ATOM 2617 O LYS B 53 9.013 3.002 12.901 1.00 44.52 O ATOM 2618 CB LYS B 53 10.433 5.873 11.905 1.00 43.51 C ATOM 2619 CG LYS B 53 11.241 7.069 12.450 1.00 72.30 C ATOM 2620 CD LYS B 53 10.665 8.431 11.999 1.00 34.41 C ATOM 2621 CE LYS B 53 9.238 8.681 12.531 1.00 22.34 C ATOM 2622 NZ LYS B 53 9.193 8.716 14.018 1.00 33.00 N ATOM 0 H LYS B 53 12.583 4.774 11.303 1.00 72.21 H new ATOM 0 HA LYS B 53 10.896 4.539 13.555 1.00 43.21 H new ATOM 0 HB2 LYS B 53 10.528 5.853 10.819 1.00 43.51 H new ATOM 0 HB3 LYS B 53 9.378 6.032 12.130 1.00 43.51 H new ATOM 0 HG2 LYS B 53 11.255 7.027 13.539 1.00 72.30 H new ATOM 0 HG3 LYS B 53 12.275 6.987 12.115 1.00 72.30 H new ATOM 0 HD2 LYS B 53 11.322 9.230 12.343 1.00 34.41 H new ATOM 0 HD3 LYS B 53 10.655 8.474 10.910 1.00 34.41 H new ATOM 0 HE2 LYS B 53 8.864 9.625 12.135 1.00 22.34 H new ATOM 0 HE3 LYS B 53 8.573 7.897 12.167 1.00 22.34 H new ATOM 0 HZ1 LYS B 53 8.239 8.986 14.330 1.00 33.00 H new ATOM 0 HZ2 LYS B 53 9.427 7.775 14.395 1.00 33.00 H new ATOM 0 HZ3 LYS B 53 9.882 9.411 14.370 1.00 33.00 H new ATOM 2636 N VAL B 54 9.850 3.022 10.785 1.00 72.43 N ATOM 2637 CA VAL B 54 8.877 2.085 10.197 1.00 4.11 C ATOM 2638 C VAL B 54 8.940 0.720 10.914 1.00 33.42 C ATOM 2639 O VAL B 54 7.900 0.176 11.309 1.00 33.34 O ATOM 2640 CB VAL B 54 9.111 1.931 8.639 1.00 31.43 C ATOM 2641 CG1 VAL B 54 8.220 0.828 8.027 1.00 41.43 C ATOM 2642 CG2 VAL B 54 8.866 3.279 7.909 1.00 2.11 C ATOM 0 H VAL B 54 10.560 3.337 10.124 1.00 72.43 H new ATOM 0 HA VAL B 54 7.876 2.493 10.339 1.00 4.11 H new ATOM 0 HB VAL B 54 10.151 1.635 8.500 1.00 31.43 H new ATOM 0 HG11 VAL B 54 8.413 0.757 6.957 1.00 41.43 H new ATOM 0 HG12 VAL B 54 8.446 -0.127 8.501 1.00 41.43 H new ATOM 0 HG13 VAL B 54 7.171 1.075 8.191 1.00 41.43 H new ATOM 0 HG21 VAL B 54 9.033 3.149 6.840 1.00 2.11 H new ATOM 0 HG22 VAL B 54 7.840 3.604 8.080 1.00 2.11 H new ATOM 0 HG23 VAL B 54 9.554 4.032 8.295 1.00 2.11 H new ATOM 2652 N LEU B 55 10.172 0.205 11.114 1.00 1.31 N ATOM 2653 CA LEU B 55 10.402 -1.062 11.837 1.00 50.02 C ATOM 2654 C LEU B 55 9.993 -0.937 13.318 1.00 72.43 C ATOM 2655 O LEU B 55 9.323 -1.823 13.846 1.00 43.40 O ATOM 2656 CB LEU B 55 11.885 -1.516 11.741 1.00 60.32 C ATOM 2657 CG LEU B 55 12.424 -1.893 10.326 1.00 72.24 C ATOM 2658 CD1 LEU B 55 13.897 -2.340 10.413 1.00 64.53 C ATOM 2659 CD2 LEU B 55 11.541 -2.963 9.632 1.00 42.31 C ATOM 0 H LEU B 55 11.027 0.651 10.782 1.00 1.31 H new ATOM 0 HA LEU B 55 9.779 -1.818 11.359 1.00 50.02 H new ATOM 0 HB2 LEU B 55 12.510 -0.716 12.139 1.00 60.32 H new ATOM 0 HB3 LEU B 55 12.017 -2.379 12.394 1.00 60.32 H new ATOM 0 HG LEU B 55 12.375 -1.000 9.702 1.00 72.24 H new ATOM 0 HD11 LEU B 55 14.258 -2.600 9.418 1.00 64.53 H new ATOM 0 HD12 LEU B 55 14.501 -1.527 10.817 1.00 64.53 H new ATOM 0 HD13 LEU B 55 13.975 -3.210 11.065 1.00 64.53 H new ATOM 0 HD21 LEU B 55 11.954 -3.194 8.650 1.00 42.31 H new ATOM 0 HD22 LEU B 55 11.521 -3.868 10.240 1.00 42.31 H new ATOM 0 HD23 LEU B 55 10.527 -2.580 9.518 1.00 42.31 H new ATOM 2671 N ASP B 56 10.384 0.192 13.957 1.00 23.02 N ATOM 2672 CA ASP B 56 10.160 0.452 15.406 1.00 4.33 C ATOM 2673 C ASP B 56 8.654 0.490 15.735 1.00 43.33 C ATOM 2674 O ASP B 56 8.224 0.012 16.797 1.00 64.42 O ATOM 2675 CB ASP B 56 10.854 1.784 15.819 1.00 50.23 C ATOM 2676 CG ASP B 56 10.806 2.078 17.329 1.00 52.11 C ATOM 2677 OD1 ASP B 56 11.607 1.490 18.087 1.00 70.52 O ATOM 2678 OD2 ASP B 56 9.990 2.916 17.765 1.00 5.13 O ATOM 0 H ASP B 56 10.867 0.954 13.482 1.00 23.02 H new ATOM 0 HA ASP B 56 10.601 -0.364 15.978 1.00 4.33 H new ATOM 0 HB2 ASP B 56 11.896 1.752 15.499 1.00 50.23 H new ATOM 0 HB3 ASP B 56 10.381 2.608 15.284 1.00 50.23 H new ATOM 2683 N TYR B 57 7.869 1.044 14.794 1.00 11.31 N ATOM 2684 CA TYR B 57 6.402 1.073 14.874 1.00 21.42 C ATOM 2685 C TYR B 57 5.844 -0.350 14.749 1.00 0.13 C ATOM 2686 O TYR B 57 4.951 -0.745 15.506 1.00 12.12 O ATOM 2687 CB TYR B 57 5.806 1.983 13.764 1.00 14.23 C ATOM 2688 CG TYR B 57 4.262 2.043 13.758 1.00 74.52 C ATOM 2689 CD1 TYR B 57 3.499 1.105 13.040 1.00 2.11 C ATOM 2690 CD2 TYR B 57 3.574 3.014 14.486 1.00 52.21 C ATOM 2691 CE1 TYR B 57 2.122 1.136 13.052 1.00 45.22 C ATOM 2692 CE2 TYR B 57 2.194 3.052 14.494 1.00 13.34 C ATOM 2693 CZ TYR B 57 1.473 2.111 13.780 1.00 74.42 C ATOM 2694 OH TYR B 57 0.096 2.136 13.808 1.00 42.51 O ATOM 0 H TYR B 57 8.239 1.486 13.953 1.00 11.31 H new ATOM 0 HA TYR B 57 6.116 1.485 15.842 1.00 21.42 H new ATOM 0 HB2 TYR B 57 6.198 2.993 13.888 1.00 14.23 H new ATOM 0 HB3 TYR B 57 6.149 1.625 12.793 1.00 14.23 H new ATOM 0 HD1 TYR B 57 4.004 0.343 12.466 1.00 2.11 H new ATOM 0 HD2 TYR B 57 4.129 3.747 15.052 1.00 52.21 H new ATOM 0 HE1 TYR B 57 1.556 0.403 12.496 1.00 45.22 H new ATOM 0 HE2 TYR B 57 1.678 3.815 15.057 1.00 13.34 H new ATOM 0 HH TYR B 57 -0.206 2.883 14.366 1.00 42.51 H new ATOM 2704 N CYS B 58 6.370 -1.099 13.757 1.00 22.21 N ATOM 2705 CA CYS B 58 5.948 -2.481 13.480 1.00 55.42 C ATOM 2706 C CYS B 58 6.202 -3.401 14.689 1.00 45.10 C ATOM 2707 O CYS B 58 5.441 -4.348 14.914 1.00 63.14 O ATOM 2708 CB CYS B 58 6.660 -3.015 12.218 1.00 13.14 C ATOM 2709 SG CYS B 58 6.190 -2.142 10.713 1.00 64.11 S ATOM 0 H CYS B 58 7.098 -0.760 13.128 1.00 22.21 H new ATOM 0 HA CYS B 58 4.874 -2.477 13.296 1.00 55.42 H new ATOM 0 HB2 CYS B 58 7.738 -2.934 12.356 1.00 13.14 H new ATOM 0 HB3 CYS B 58 6.432 -4.075 12.102 1.00 13.14 H new ATOM 0 HG CYS B 58 6.724 -0.957 10.714 1.00 64.11 H new ATOM 2715 N ARG B 59 7.272 -3.105 15.469 1.00 72.22 N ATOM 2716 CA ARG B 59 7.587 -3.849 16.707 1.00 0.34 C ATOM 2717 C ARG B 59 6.438 -3.698 17.711 1.00 31.33 C ATOM 2718 O ARG B 59 5.994 -4.682 18.305 1.00 0.41 O ATOM 2719 CB ARG B 59 8.936 -3.392 17.331 1.00 11.45 C ATOM 2720 CG ARG B 59 10.152 -3.518 16.384 1.00 4.12 C ATOM 2721 CD ARG B 59 11.501 -3.194 17.060 1.00 31.34 C ATOM 2722 NE ARG B 59 11.980 -4.298 17.921 1.00 70.52 N ATOM 2723 CZ ARG B 59 12.162 -4.245 19.250 1.00 72.15 C ATOM 2724 NH1 ARG B 59 11.902 -3.136 19.938 1.00 63.04 N ATOM 2725 NH2 ARG B 59 12.635 -5.311 19.878 1.00 4.12 N ATOM 0 H ARG B 59 7.930 -2.354 15.259 1.00 72.22 H new ATOM 0 HA ARG B 59 7.699 -4.902 16.450 1.00 0.34 H new ATOM 0 HB2 ARG B 59 8.843 -2.353 17.647 1.00 11.45 H new ATOM 0 HB3 ARG B 59 9.126 -3.982 18.228 1.00 11.45 H new ATOM 0 HG2 ARG B 59 10.189 -4.533 15.987 1.00 4.12 H new ATOM 0 HG3 ARG B 59 10.011 -2.849 15.535 1.00 4.12 H new ATOM 0 HD2 ARG B 59 12.247 -2.985 16.294 1.00 31.34 H new ATOM 0 HD3 ARG B 59 11.396 -2.289 17.659 1.00 31.34 H new ATOM 0 HE ARG B 59 12.192 -5.183 17.461 1.00 70.52 H new ATOM 0 HH11 ARG B 59 11.558 -2.306 19.456 1.00 63.04 H new ATOM 0 HH12 ARG B 59 12.047 -3.116 20.947 1.00 63.04 H new ATOM 0 HH21 ARG B 59 12.856 -6.157 19.352 1.00 4.12 H new ATOM 0 HH22 ARG B 59 12.779 -5.286 20.888 1.00 4.12 H new ATOM 2739 N HIS B 60 5.927 -2.457 17.834 1.00 30.14 N ATOM 2740 CA HIS B 60 4.791 -2.140 18.711 1.00 44.14 C ATOM 2741 C HIS B 60 3.499 -2.825 18.213 1.00 61.33 C ATOM 2742 O HIS B 60 2.720 -3.353 19.015 1.00 33.14 O ATOM 2743 CB HIS B 60 4.573 -0.609 18.816 1.00 71.11 C ATOM 2744 CG HIS B 60 3.459 -0.267 19.761 1.00 64.32 C ATOM 2745 ND1 HIS B 60 2.200 0.099 19.348 1.00 63.51 N ATOM 2746 CD2 HIS B 60 3.401 -0.340 21.107 1.00 11.34 C ATOM 2747 CE1 HIS B 60 1.425 0.223 20.399 1.00 71.21 C ATOM 2748 NE2 HIS B 60 2.128 -0.035 21.479 1.00 73.01 N ATOM 0 H HIS B 60 6.292 -1.650 17.328 1.00 30.14 H new ATOM 0 HA HIS B 60 5.029 -2.523 19.703 1.00 44.14 H new ATOM 0 HB2 HIS B 60 5.494 -0.133 19.153 1.00 71.11 H new ATOM 0 HB3 HIS B 60 4.348 -0.206 17.829 1.00 71.11 H new ATOM 0 HD1 HIS B 60 1.915 0.250 18.380 1.00 63.51 H new ATOM 0 HD2 HIS B 60 4.216 -0.594 21.768 1.00 11.34 H new ATOM 0 HE1 HIS B 60 0.379 0.493 20.380 1.00 71.21 H new ATOM 2757 N HIS B 61 3.292 -2.809 16.880 1.00 42.44 N ATOM 2758 CA HIS B 61 2.100 -3.394 16.242 1.00 12.32 C ATOM 2759 C HIS B 61 2.132 -4.940 16.292 1.00 1.13 C ATOM 2760 O HIS B 61 1.106 -5.591 16.113 1.00 61.44 O ATOM 2761 CB HIS B 61 1.959 -2.907 14.774 1.00 2.30 C ATOM 2762 CG HIS B 61 0.644 -3.309 14.139 1.00 34.42 C ATOM 2763 ND1 HIS B 61 0.437 -4.535 13.534 1.00 13.43 N ATOM 2764 CD2 HIS B 61 -0.552 -2.674 14.102 1.00 24.42 C ATOM 2765 CE1 HIS B 61 -0.822 -4.634 13.158 1.00 20.51 C ATOM 2766 NE2 HIS B 61 -1.440 -3.520 13.488 1.00 2.35 N ATOM 0 H HIS B 61 3.946 -2.391 16.219 1.00 42.44 H new ATOM 0 HA HIS B 61 1.231 -3.055 16.806 1.00 12.32 H new ATOM 0 HB2 HIS B 61 2.052 -1.821 14.747 1.00 2.30 H new ATOM 0 HB3 HIS B 61 2.780 -3.312 14.183 1.00 2.30 H new ATOM 0 HD1 HIS B 61 1.149 -5.252 13.399 1.00 13.43 H new ATOM 0 HD2 HIS B 61 -0.766 -1.687 14.484 1.00 24.42 H new ATOM 0 HE1 HIS B 61 -1.270 -5.484 12.664 1.00 20.51 H new ATOM 0 HE2 HIS B 61 -2.425 -3.318 13.314 1.00 2.35 H new ATOM 2775 N HIS B 62 3.321 -5.524 16.498 1.00 25.55 N ATOM 2776 CA HIS B 62 3.457 -6.979 16.682 1.00 0.23 C ATOM 2777 C HIS B 62 3.073 -7.368 18.119 1.00 72.41 C ATOM 2778 O HIS B 62 2.411 -8.389 18.338 1.00 0.10 O ATOM 2779 CB HIS B 62 4.896 -7.436 16.363 1.00 2.14 C ATOM 2780 CG HIS B 62 5.105 -8.922 16.505 1.00 41.24 C ATOM 2781 ND1 HIS B 62 4.731 -9.827 15.544 1.00 31.22 N ATOM 2782 CD2 HIS B 62 5.642 -9.655 17.508 1.00 2.33 C ATOM 2783 CE1 HIS B 62 5.026 -11.042 15.945 1.00 2.32 C ATOM 2784 NE2 HIS B 62 5.579 -10.970 17.137 1.00 55.13 N ATOM 0 H HIS B 62 4.203 -5.013 16.542 1.00 25.55 H new ATOM 0 HA HIS B 62 2.780 -7.482 15.991 1.00 0.23 H new ATOM 0 HB2 HIS B 62 5.145 -7.139 15.344 1.00 2.14 H new ATOM 0 HB3 HIS B 62 5.588 -6.916 17.025 1.00 2.14 H new ATOM 0 HD2 HIS B 62 6.047 -9.271 18.433 1.00 2.33 H new ATOM 0 HE1 HIS B 62 4.845 -11.950 15.389 1.00 2.32 H new ATOM 0 HE2 HIS B 62 5.906 -11.762 17.691 1.00 55.13 H new ATOM 2793 N GLN B 63 3.507 -6.538 19.088 1.00 61.41 N ATOM 2794 CA GLN B 63 3.196 -6.737 20.519 1.00 4.22 C ATOM 2795 C GLN B 63 1.708 -6.441 20.801 1.00 70.40 C ATOM 2796 O GLN B 63 1.123 -6.967 21.754 1.00 3.04 O ATOM 2797 CB GLN B 63 4.103 -5.834 21.400 1.00 42.15 C ATOM 2798 CG GLN B 63 5.624 -6.023 21.188 1.00 63.03 C ATOM 2799 CD GLN B 63 6.094 -7.463 21.388 1.00 11.31 C ATOM 2800 OE1 GLN B 63 6.154 -8.256 20.444 1.00 0.14 O ATOM 2801 NE2 GLN B 63 6.439 -7.815 22.615 1.00 4.34 N ATOM 0 H GLN B 63 4.080 -5.715 18.903 1.00 61.41 H new ATOM 0 HA GLN B 63 3.391 -7.780 20.770 1.00 4.22 H new ATOM 0 HB2 GLN B 63 3.852 -4.792 21.204 1.00 42.15 H new ATOM 0 HB3 GLN B 63 3.872 -6.026 22.448 1.00 42.15 H new ATOM 0 HG2 GLN B 63 5.885 -5.701 20.180 1.00 63.03 H new ATOM 0 HG3 GLN B 63 6.162 -5.374 21.879 1.00 63.03 H new ATOM 0 HE21 GLN B 63 6.379 -7.138 23.376 1.00 4.34 H new ATOM 0 HE22 GLN B 63 6.765 -8.763 22.801 1.00 4.34 H new ATOM 2810 N HIS B 64 1.113 -5.578 19.956 1.00 73.11 N ATOM 2811 CA HIS B 64 -0.323 -5.253 19.984 1.00 32.42 C ATOM 2812 C HIS B 64 -0.898 -5.443 18.564 1.00 24.40 C ATOM 2813 O HIS B 64 -1.002 -4.470 17.798 1.00 3.21 O ATOM 2814 CB HIS B 64 -0.553 -3.800 20.490 1.00 40.14 C ATOM 2815 CG HIS B 64 -0.075 -3.545 21.896 1.00 12.25 C ATOM 2816 ND1 HIS B 64 -0.891 -3.656 22.998 1.00 2.20 N ATOM 2817 CD2 HIS B 64 1.142 -3.184 22.371 1.00 15.44 C ATOM 2818 CE1 HIS B 64 -0.201 -3.376 24.084 1.00 64.33 C ATOM 2819 NE2 HIS B 64 1.031 -3.084 23.730 1.00 71.40 N ATOM 0 H HIS B 64 1.624 -5.081 19.226 1.00 73.11 H new ATOM 0 HA HIS B 64 -0.837 -5.919 20.677 1.00 32.42 H new ATOM 0 HB2 HIS B 64 -0.045 -3.110 19.816 1.00 40.14 H new ATOM 0 HB3 HIS B 64 -1.618 -3.574 20.435 1.00 40.14 H new ATOM 0 HD2 HIS B 64 2.032 -3.008 21.786 1.00 15.44 H new ATOM 0 HE1 HIS B 64 -0.583 -3.385 25.094 1.00 64.33 H new ATOM 0 HE2 HIS B 64 1.784 -2.824 24.367 1.00 71.40 H new ATOM 2828 N PRO B 65 -1.223 -6.721 18.165 1.00 31.04 N ATOM 2829 CA PRO B 65 -1.697 -7.040 16.799 1.00 11.04 C ATOM 2830 C PRO B 65 -3.154 -6.581 16.570 1.00 20.22 C ATOM 2831 O PRO B 65 -4.106 -7.357 16.745 1.00 14.21 O ATOM 2832 CB PRO B 65 -1.521 -8.582 16.718 1.00 24.13 C ATOM 2833 CG PRO B 65 -1.687 -9.061 18.135 1.00 4.43 C ATOM 2834 CD PRO B 65 -1.141 -7.950 19.017 1.00 22.40 C ATOM 0 HA PRO B 65 -1.144 -6.520 16.016 1.00 11.04 H new ATOM 0 HB2 PRO B 65 -2.264 -9.031 16.059 1.00 24.13 H new ATOM 0 HB3 PRO B 65 -0.541 -8.848 16.322 1.00 24.13 H new ATOM 0 HG2 PRO B 65 -2.735 -9.259 18.360 1.00 4.43 H new ATOM 0 HG3 PRO B 65 -1.144 -9.992 18.299 1.00 4.43 H new ATOM 0 HD2 PRO B 65 -1.729 -7.841 19.928 1.00 22.40 H new ATOM 0 HD3 PRO B 65 -0.115 -8.154 19.322 1.00 22.40 H new ATOM 2842 N GLY B 66 -3.314 -5.295 16.227 1.00 42.22 N ATOM 2843 CA GLY B 66 -4.635 -4.721 15.998 1.00 55.22 C ATOM 2844 C GLY B 66 -4.570 -3.260 15.593 1.00 2.42 C ATOM 2845 O GLY B 66 -4.118 -2.947 14.485 1.00 55.53 O ATOM 0 H GLY B 66 -2.543 -4.639 16.104 1.00 42.22 H new ATOM 0 HA2 GLY B 66 -5.144 -5.289 15.219 1.00 55.22 H new ATOM 0 HA3 GLY B 66 -5.232 -4.817 16.905 1.00 55.22 H new ATOM 2849 N GLY B 67 -4.977 -2.366 16.513 1.00 23.25 N ATOM 2850 CA GLY B 67 -5.162 -0.943 16.208 1.00 13.15 C ATOM 2851 C GLY B 67 -6.624 -0.659 15.896 1.00 51.00 C ATOM 2852 O GLY B 67 -7.020 -0.612 14.731 1.00 32.45 O ATOM 0 H GLY B 67 -5.185 -2.612 17.481 1.00 23.25 H new ATOM 0 HA2 GLY B 67 -4.839 -0.337 17.054 1.00 13.15 H new ATOM 0 HA3 GLY B 67 -4.540 -0.662 15.358 1.00 13.15 H new ATOM 2856 N SER B 68 -7.426 -0.498 16.955 1.00 40.00 N ATOM 2857 CA SER B 68 -8.898 -0.397 16.868 1.00 13.41 C ATOM 2858 C SER B 68 -9.370 1.041 16.560 1.00 30.43 C ATOM 2859 O SER B 68 -10.474 1.238 16.038 1.00 63.02 O ATOM 2860 CB SER B 68 -9.508 -0.880 18.205 1.00 42.12 C ATOM 2861 OG SER B 68 -9.021 -2.167 18.552 1.00 20.02 O ATOM 0 H SER B 68 -7.073 -0.433 17.910 1.00 40.00 H new ATOM 0 HA SER B 68 -9.235 -1.024 16.043 1.00 13.41 H new ATOM 0 HB2 SER B 68 -9.266 -0.170 18.996 1.00 42.12 H new ATOM 0 HB3 SER B 68 -10.595 -0.908 18.124 1.00 42.12 H new ATOM 0 HG SER B 68 -9.420 -2.450 19.401 1.00 20.02 H new ATOM 2867 N GLY B 69 -8.537 2.040 16.903 1.00 1.33 N ATOM 2868 CA GLY B 69 -8.922 3.452 16.836 1.00 4.41 C ATOM 2869 C GLY B 69 -9.574 3.913 18.139 1.00 62.32 C ATOM 2870 O GLY B 69 -9.149 4.898 18.749 1.00 12.32 O ATOM 0 H GLY B 69 -7.584 1.887 17.232 1.00 1.33 H new ATOM 0 HA2 GLY B 69 -8.042 4.062 16.632 1.00 4.41 H new ATOM 0 HA3 GLY B 69 -9.614 3.603 16.007 1.00 4.41 H new ATOM 2874 N LEU B 70 -10.600 3.153 18.582 1.00 2.50 N ATOM 2875 CA LEU B 70 -11.335 3.397 19.845 1.00 72.15 C ATOM 2876 C LEU B 70 -10.567 2.894 21.088 1.00 61.14 C ATOM 2877 O LEU B 70 -11.059 3.019 22.210 1.00 71.12 O ATOM 2878 CB LEU B 70 -12.773 2.768 19.758 1.00 53.42 C ATOM 2879 CG LEU B 70 -12.898 1.251 19.316 1.00 21.53 C ATOM 2880 CD1 LEU B 70 -12.434 0.252 20.406 1.00 41.32 C ATOM 2881 CD2 LEU B 70 -14.341 0.926 18.857 1.00 23.13 C ATOM 0 H LEU B 70 -10.946 2.343 18.067 1.00 2.50 H new ATOM 0 HA LEU B 70 -11.430 4.476 19.970 1.00 72.15 H new ATOM 0 HB2 LEU B 70 -13.241 2.870 20.737 1.00 53.42 H new ATOM 0 HB3 LEU B 70 -13.358 3.368 19.061 1.00 53.42 H new ATOM 0 HG LEU B 70 -12.218 1.125 18.473 1.00 21.53 H new ATOM 0 HD11 LEU B 70 -12.547 -0.767 20.037 1.00 41.32 H new ATOM 0 HD12 LEU B 70 -11.387 0.437 20.647 1.00 41.32 H new ATOM 0 HD13 LEU B 70 -13.041 0.383 21.302 1.00 41.32 H new ATOM 0 HD21 LEU B 70 -14.401 -0.121 18.559 1.00 23.13 H new ATOM 0 HD22 LEU B 70 -15.034 1.110 19.678 1.00 23.13 H new ATOM 0 HD23 LEU B 70 -14.605 1.560 18.011 1.00 23.13 H new ATOM 2893 N ASP B 71 -9.355 2.334 20.878 1.00 32.54 N ATOM 2894 CA ASP B 71 -8.530 1.740 21.959 1.00 52.22 C ATOM 2895 C ASP B 71 -7.709 2.804 22.723 1.00 74.02 C ATOM 2896 O ASP B 71 -6.796 2.436 23.463 1.00 73.01 O ATOM 2897 CB ASP B 71 -7.579 0.658 21.354 1.00 31.01 C ATOM 2898 CG ASP B 71 -6.561 1.242 20.346 1.00 22.31 C ATOM 2899 OD1 ASP B 71 -6.884 1.328 19.154 1.00 10.12 O ATOM 2900 OD2 ASP B 71 -5.435 1.615 20.747 1.00 1.13 O ATOM 0 H ASP B 71 -8.920 2.280 19.957 1.00 32.54 H new ATOM 0 HA ASP B 71 -9.207 1.281 22.680 1.00 52.22 H new ATOM 0 HB2 ASP B 71 -7.039 0.164 22.162 1.00 31.01 H new ATOM 0 HB3 ASP B 71 -8.177 -0.106 20.857 1.00 31.01 H new ATOM 2905 N ASP B 72 -8.044 4.103 22.507 1.00 54.21 N ATOM 2906 CA ASP B 72 -7.364 5.292 23.080 1.00 34.01 C ATOM 2907 C ASP B 72 -6.153 5.729 22.222 1.00 42.13 C ATOM 2908 O ASP B 72 -5.868 6.931 22.136 1.00 53.11 O ATOM 2909 CB ASP B 72 -6.982 5.127 24.590 1.00 2.15 C ATOM 2910 CG ASP B 72 -6.370 6.394 25.232 1.00 12.32 C ATOM 2911 OD1 ASP B 72 -5.151 6.418 25.501 1.00 52.30 O ATOM 2912 OD2 ASP B 72 -7.107 7.367 25.465 1.00 11.02 O ATOM 0 H ASP B 72 -8.826 4.359 21.905 1.00 54.21 H new ATOM 0 HA ASP B 72 -8.098 6.097 23.050 1.00 34.01 H new ATOM 0 HB2 ASP B 72 -7.874 4.844 25.150 1.00 2.15 H new ATOM 0 HB3 ASP B 72 -6.272 4.306 24.686 1.00 2.15 H new ATOM 2917 N ILE B 73 -5.483 4.747 21.564 1.00 60.20 N ATOM 2918 CA ILE B 73 -4.281 4.964 20.719 1.00 34.25 C ATOM 2919 C ILE B 73 -3.090 5.483 21.574 1.00 23.53 C ATOM 2920 O ILE B 73 -3.089 6.652 21.986 1.00 12.34 O ATOM 2921 CB ILE B 73 -4.535 5.912 19.470 1.00 24.55 C ATOM 2922 CG1 ILE B 73 -5.618 5.304 18.510 1.00 34.35 C ATOM 2923 CG2 ILE B 73 -3.217 6.209 18.692 1.00 62.43 C ATOM 2924 CD1 ILE B 73 -5.220 3.992 17.839 1.00 53.01 C ATOM 0 H ILE B 73 -5.768 3.768 21.607 1.00 60.20 H new ATOM 0 HA ILE B 73 -4.028 3.988 20.305 1.00 34.25 H new ATOM 0 HB ILE B 73 -4.911 6.859 19.857 1.00 24.55 H new ATOM 0 HG12 ILE B 73 -6.535 5.141 19.077 1.00 34.35 H new ATOM 0 HG13 ILE B 73 -5.848 6.036 17.736 1.00 34.35 H new ATOM 0 HG21 ILE B 73 -3.433 6.860 17.845 1.00 62.43 H new ATOM 0 HG22 ILE B 73 -2.506 6.701 19.356 1.00 62.43 H new ATOM 0 HG23 ILE B 73 -2.789 5.274 18.330 1.00 62.43 H new ATOM 0 HD11 ILE B 73 -6.032 3.651 17.196 1.00 53.01 H new ATOM 0 HD12 ILE B 73 -4.323 4.147 17.239 1.00 53.01 H new ATOM 0 HD13 ILE B 73 -5.021 3.239 18.602 1.00 53.01 H new ATOM 2936 N PRO B 74 -2.076 4.602 21.880 1.00 63.41 N ATOM 2937 CA PRO B 74 -0.847 4.999 22.624 1.00 75.11 C ATOM 2938 C PRO B 74 -0.135 6.232 21.997 1.00 51.12 C ATOM 2939 O PRO B 74 -0.068 6.340 20.763 1.00 53.24 O ATOM 2940 CB PRO B 74 0.043 3.723 22.574 1.00 22.24 C ATOM 2941 CG PRO B 74 -0.593 2.831 21.546 1.00 11.23 C ATOM 2942 CD PRO B 74 -2.059 3.154 21.552 1.00 43.02 C ATOM 0 HA PRO B 74 -1.070 5.319 23.642 1.00 75.11 H new ATOM 0 HB2 PRO B 74 1.068 3.970 22.299 1.00 22.24 H new ATOM 0 HB3 PRO B 74 0.083 3.234 23.547 1.00 22.24 H new ATOM 0 HG2 PRO B 74 -0.161 3.005 20.560 1.00 11.23 H new ATOM 0 HG3 PRO B 74 -0.426 1.781 21.786 1.00 11.23 H new ATOM 0 HD2 PRO B 74 -2.521 2.953 20.586 1.00 43.02 H new ATOM 0 HD3 PRO B 74 -2.600 2.565 22.293 1.00 43.02 H new ATOM 2950 N PRO B 75 0.390 7.181 22.860 1.00 45.52 N ATOM 2951 CA PRO B 75 1.004 8.459 22.409 1.00 72.32 C ATOM 2952 C PRO B 75 2.062 8.311 21.295 1.00 62.23 C ATOM 2953 O PRO B 75 2.138 9.164 20.422 1.00 72.32 O ATOM 2954 CB PRO B 75 1.640 9.030 23.700 1.00 50.11 C ATOM 2955 CG PRO B 75 0.782 8.488 24.800 1.00 41.20 C ATOM 2956 CD PRO B 75 0.396 7.090 24.356 1.00 14.53 C ATOM 0 HA PRO B 75 0.253 9.103 21.953 1.00 72.32 H new ATOM 0 HB2 PRO B 75 2.676 8.711 23.809 1.00 50.11 H new ATOM 0 HB3 PRO B 75 1.641 10.120 23.695 1.00 50.11 H new ATOM 0 HG2 PRO B 75 1.323 8.465 25.746 1.00 41.20 H new ATOM 0 HG3 PRO B 75 -0.100 9.110 24.953 1.00 41.20 H new ATOM 0 HD2 PRO B 75 1.110 6.346 24.709 1.00 14.53 H new ATOM 0 HD3 PRO B 75 -0.581 6.802 24.744 1.00 14.53 H new ATOM 2964 N TYR B 76 2.858 7.220 21.335 1.00 34.13 N ATOM 2965 CA TYR B 76 3.887 6.940 20.302 1.00 13.23 C ATOM 2966 C TYR B 76 3.261 6.839 18.895 1.00 20.15 C ATOM 2967 O TYR B 76 3.753 7.453 17.955 1.00 30.42 O ATOM 2968 CB TYR B 76 4.687 5.637 20.627 1.00 33.01 C ATOM 2969 CG TYR B 76 5.535 5.115 19.443 1.00 2.23 C ATOM 2970 CD1 TYR B 76 5.120 4.015 18.673 1.00 55.44 C ATOM 2971 CD2 TYR B 76 6.705 5.772 19.052 1.00 55.34 C ATOM 2972 CE1 TYR B 76 5.835 3.601 17.573 1.00 3.03 C ATOM 2973 CE2 TYR B 76 7.427 5.348 17.957 1.00 21.12 C ATOM 2974 CZ TYR B 76 6.983 4.268 17.218 1.00 1.41 C ATOM 2975 OH TYR B 76 7.692 3.862 16.109 1.00 34.32 O ATOM 0 H TYR B 76 2.810 6.516 22.072 1.00 34.13 H new ATOM 0 HA TYR B 76 4.581 7.780 20.311 1.00 13.23 H new ATOM 0 HB2 TYR B 76 5.343 5.827 21.476 1.00 33.01 H new ATOM 0 HB3 TYR B 76 3.988 4.859 20.932 1.00 33.01 H new ATOM 0 HD1 TYR B 76 4.221 3.484 18.950 1.00 55.44 H new ATOM 0 HD2 TYR B 76 7.049 6.626 19.617 1.00 55.34 H new ATOM 0 HE1 TYR B 76 5.496 2.756 16.992 1.00 3.03 H new ATOM 0 HE2 TYR B 76 8.337 5.858 17.677 1.00 21.12 H new ATOM 0 HH TYR B 76 8.552 3.485 16.390 1.00 34.32 H new ATOM 2985 N ASP B 77 2.189 6.042 18.782 1.00 4.23 N ATOM 2986 CA ASP B 77 1.548 5.696 17.491 1.00 55.12 C ATOM 2987 C ASP B 77 0.834 6.921 16.879 1.00 4.10 C ATOM 2988 O ASP B 77 0.745 7.058 15.654 1.00 71.24 O ATOM 2989 CB ASP B 77 0.549 4.521 17.705 1.00 64.25 C ATOM 2990 CG ASP B 77 1.230 3.222 18.202 1.00 11.23 C ATOM 2991 OD1 ASP B 77 1.146 2.173 17.519 1.00 2.02 O ATOM 2992 OD2 ASP B 77 1.860 3.250 19.289 1.00 14.13 O ATOM 0 H ASP B 77 1.733 5.612 19.587 1.00 4.23 H new ATOM 0 HA ASP B 77 2.320 5.383 16.788 1.00 55.12 H new ATOM 0 HB2 ASP B 77 -0.209 4.825 18.427 1.00 64.25 H new ATOM 0 HB3 ASP B 77 0.033 4.317 16.767 1.00 64.25 H new ATOM 2997 N ARG B 78 0.335 7.796 17.762 1.00 24.54 N ATOM 2998 CA ARG B 78 -0.297 9.079 17.396 1.00 2.32 C ATOM 2999 C ARG B 78 0.767 10.084 16.902 1.00 14.52 C ATOM 3000 O ARG B 78 0.638 10.697 15.839 1.00 33.35 O ATOM 3001 CB ARG B 78 -1.019 9.642 18.650 1.00 11.50 C ATOM 3002 CG ARG B 78 -1.678 11.032 18.474 1.00 33.13 C ATOM 3003 CD ARG B 78 -2.102 11.641 19.819 1.00 12.03 C ATOM 3004 NE ARG B 78 -0.948 11.802 20.732 1.00 73.14 N ATOM 3005 CZ ARG B 78 -1.024 11.913 22.065 1.00 61.04 C ATOM 3006 NH1 ARG B 78 -2.191 11.885 22.695 1.00 52.50 N ATOM 3007 NH2 ARG B 78 0.083 12.075 22.763 1.00 70.32 N ATOM 0 H ARG B 78 0.358 7.633 18.769 1.00 24.54 H new ATOM 0 HA ARG B 78 -1.012 8.921 16.589 1.00 2.32 H new ATOM 0 HB2 ARG B 78 -1.787 8.931 18.955 1.00 11.50 H new ATOM 0 HB3 ARG B 78 -0.299 9.702 19.466 1.00 11.50 H new ATOM 0 HG2 ARG B 78 -0.979 11.704 17.976 1.00 33.13 H new ATOM 0 HG3 ARG B 78 -2.550 10.941 17.826 1.00 33.13 H new ATOM 0 HD2 ARG B 78 -2.570 12.611 19.649 1.00 12.03 H new ATOM 0 HD3 ARG B 78 -2.851 11.003 20.288 1.00 12.03 H new ATOM 0 HE ARG B 78 -0.019 11.831 20.312 1.00 73.14 H new ATOM 0 HH11 ARG B 78 -3.055 11.777 22.164 1.00 52.50 H new ATOM 0 HH12 ARG B 78 -2.224 11.971 23.711 1.00 52.50 H new ATOM 0 HH21 ARG B 78 0.985 12.115 22.288 1.00 70.32 H new ATOM 0 HH22 ARG B 78 0.038 12.161 23.778 1.00 70.32 H new ATOM 3021 N ASP B 79 1.822 10.218 17.710 1.00 73.52 N ATOM 3022 CA ASP B 79 2.934 11.164 17.502 1.00 52.21 C ATOM 3023 C ASP B 79 3.925 10.681 16.434 1.00 3.12 C ATOM 3024 O ASP B 79 4.804 11.440 16.026 1.00 13.50 O ATOM 3025 CB ASP B 79 3.636 11.511 18.838 1.00 22.21 C ATOM 3026 CG ASP B 79 2.770 12.445 19.712 1.00 43.30 C ATOM 3027 OD1 ASP B 79 2.143 11.986 20.689 1.00 20.24 O ATOM 3028 OD2 ASP B 79 2.684 13.651 19.396 1.00 73.24 O ATOM 0 H ASP B 79 1.934 9.656 18.554 1.00 73.52 H new ATOM 0 HA ASP B 79 2.500 12.086 17.114 1.00 52.21 H new ATOM 0 HB2 ASP B 79 3.849 10.593 19.386 1.00 22.21 H new ATOM 0 HB3 ASP B 79 4.594 11.989 18.633 1.00 22.21 H new ATOM 3033 N PHE B 80 3.837 9.396 16.057 1.00 51.34 N ATOM 3034 CA PHE B 80 4.601 8.833 14.923 1.00 33.03 C ATOM 3035 C PHE B 80 4.373 9.673 13.638 1.00 25.53 C ATOM 3036 O PHE B 80 5.294 9.871 12.827 1.00 53.31 O ATOM 3037 CB PHE B 80 4.187 7.351 14.693 1.00 42.52 C ATOM 3038 CG PHE B 80 5.003 6.656 13.613 1.00 53.23 C ATOM 3039 CD1 PHE B 80 6.233 6.089 13.918 1.00 31.15 C ATOM 3040 CD2 PHE B 80 4.557 6.600 12.289 1.00 52.23 C ATOM 3041 CE1 PHE B 80 6.992 5.489 12.939 1.00 10.54 C ATOM 3042 CE2 PHE B 80 5.318 5.998 11.315 1.00 30.10 C ATOM 3043 CZ PHE B 80 6.536 5.442 11.638 1.00 32.44 C ATOM 0 H PHE B 80 3.237 8.717 16.525 1.00 51.34 H new ATOM 0 HA PHE B 80 5.664 8.868 15.162 1.00 33.03 H new ATOM 0 HB2 PHE B 80 4.294 6.802 15.629 1.00 42.52 H new ATOM 0 HB3 PHE B 80 3.132 7.314 14.421 1.00 42.52 H new ATOM 0 HD1 PHE B 80 6.598 6.119 14.934 1.00 31.15 H new ATOM 0 HD2 PHE B 80 3.603 7.035 12.028 1.00 52.23 H new ATOM 0 HE1 PHE B 80 7.948 5.054 13.190 1.00 10.54 H new ATOM 0 HE2 PHE B 80 4.961 5.961 10.296 1.00 30.10 H new ATOM 0 HZ PHE B 80 7.134 4.969 10.873 1.00 32.44 H new ATOM 3053 N CYS B 81 3.134 10.176 13.509 1.00 15.01 N ATOM 3054 CA CYS B 81 2.684 11.016 12.395 1.00 15.45 C ATOM 3055 C CYS B 81 3.341 12.423 12.405 1.00 14.14 C ATOM 3056 O CYS B 81 3.297 13.130 11.390 1.00 2.41 O ATOM 3057 CB CYS B 81 1.151 11.147 12.480 1.00 20.32 C ATOM 3058 SG CYS B 81 0.295 9.559 12.568 1.00 30.31 S ATOM 0 H CYS B 81 2.401 10.003 14.197 1.00 15.01 H new ATOM 0 HA CYS B 81 2.985 10.541 11.461 1.00 15.45 H new ATOM 0 HB2 CYS B 81 0.893 11.739 13.358 1.00 20.32 H new ATOM 0 HB3 CYS B 81 0.793 11.696 11.609 1.00 20.32 H new ATOM 0 HG CYS B 81 -0.424 9.394 11.498 1.00 30.31 H new ATOM 3064 N LYS B 82 3.928 12.828 13.563 1.00 24.54 N ATOM 3065 CA LYS B 82 4.604 14.143 13.720 1.00 42.22 C ATOM 3066 C LYS B 82 5.979 14.128 13.020 1.00 61.20 C ATOM 3067 O LYS B 82 7.022 13.925 13.655 1.00 4.32 O ATOM 3068 CB LYS B 82 4.783 14.523 15.218 1.00 53.43 C ATOM 3069 CG LYS B 82 3.503 14.494 16.065 1.00 22.24 C ATOM 3070 CD LYS B 82 2.412 15.462 15.574 1.00 61.14 C ATOM 3071 CE LYS B 82 1.217 15.501 16.538 1.00 44.32 C ATOM 3072 NZ LYS B 82 1.622 15.970 17.893 1.00 72.03 N ATOM 0 H LYS B 82 3.946 12.256 14.408 1.00 24.54 H new ATOM 0 HA LYS B 82 3.967 14.894 13.254 1.00 42.22 H new ATOM 0 HB2 LYS B 82 5.508 13.842 15.663 1.00 53.43 H new ATOM 0 HB3 LYS B 82 5.211 15.524 15.272 1.00 53.43 H new ATOM 0 HG2 LYS B 82 3.102 13.480 16.067 1.00 22.24 H new ATOM 0 HG3 LYS B 82 3.755 14.739 17.097 1.00 22.24 H new ATOM 0 HD2 LYS B 82 2.831 16.463 15.472 1.00 61.14 H new ATOM 0 HD3 LYS B 82 2.072 15.157 14.584 1.00 61.14 H new ATOM 0 HE2 LYS B 82 0.448 16.162 16.138 1.00 44.32 H new ATOM 0 HE3 LYS B 82 0.776 14.507 16.613 1.00 44.32 H new ATOM 0 HZ1 LYS B 82 0.796 16.369 18.383 1.00 72.03 H new ATOM 0 HZ2 LYS B 82 1.996 15.169 18.440 1.00 72.03 H new ATOM 0 HZ3 LYS B 82 2.357 16.700 17.802 1.00 72.03 H new ATOM 3086 N VAL B 83 5.949 14.268 11.697 1.00 21.41 N ATOM 3087 CA VAL B 83 7.143 14.333 10.835 1.00 74.14 C ATOM 3088 C VAL B 83 6.949 15.453 9.801 1.00 62.23 C ATOM 3089 O VAL B 83 5.816 15.907 9.576 1.00 34.10 O ATOM 3090 CB VAL B 83 7.412 12.954 10.104 1.00 52.11 C ATOM 3091 CG1 VAL B 83 7.902 11.871 11.089 1.00 31.13 C ATOM 3092 CG2 VAL B 83 6.150 12.473 9.346 1.00 63.42 C ATOM 0 H VAL B 83 5.076 14.342 11.175 1.00 21.41 H new ATOM 0 HA VAL B 83 8.012 14.544 11.458 1.00 74.14 H new ATOM 0 HB VAL B 83 8.207 13.122 9.377 1.00 52.11 H new ATOM 0 HG11 VAL B 83 8.075 10.940 10.549 1.00 31.13 H new ATOM 0 HG12 VAL B 83 8.831 12.198 11.556 1.00 31.13 H new ATOM 0 HG13 VAL B 83 7.146 11.709 11.858 1.00 31.13 H new ATOM 0 HG21 VAL B 83 6.361 11.524 8.853 1.00 63.42 H new ATOM 0 HG22 VAL B 83 5.330 12.340 10.052 1.00 63.42 H new ATOM 0 HG23 VAL B 83 5.869 13.216 8.599 1.00 63.42 H new ATOM 3102 N ASP B 84 8.056 15.876 9.172 1.00 41.32 N ATOM 3103 CA ASP B 84 8.059 16.943 8.147 1.00 62.11 C ATOM 3104 C ASP B 84 7.236 16.495 6.909 1.00 33.42 C ATOM 3105 O ASP B 84 7.057 15.287 6.696 1.00 62.24 O ATOM 3106 CB ASP B 84 9.530 17.280 7.780 1.00 42.22 C ATOM 3107 CG ASP B 84 9.706 18.512 6.875 1.00 11.05 C ATOM 3108 OD1 ASP B 84 10.503 18.463 5.917 1.00 63.24 O ATOM 3109 OD2 ASP B 84 9.049 19.543 7.132 1.00 33.54 O ATOM 0 H ASP B 84 8.981 15.489 9.358 1.00 41.32 H new ATOM 0 HA ASP B 84 7.587 17.845 8.535 1.00 62.11 H new ATOM 0 HB2 ASP B 84 10.091 17.440 8.701 1.00 42.22 H new ATOM 0 HB3 ASP B 84 9.972 16.416 7.283 1.00 42.22 H new ATOM 3114 N GLN B 85 6.748 17.476 6.118 1.00 13.00 N ATOM 3115 CA GLN B 85 5.759 17.250 5.026 1.00 53.43 C ATOM 3116 C GLN B 85 6.254 16.164 4.003 1.00 44.14 C ATOM 3117 O GLN B 85 5.523 15.189 3.775 1.00 61.11 O ATOM 3118 CB GLN B 85 5.380 18.612 4.327 1.00 51.03 C ATOM 3119 CG GLN B 85 3.912 18.741 3.832 1.00 31.52 C ATOM 3120 CD GLN B 85 3.491 17.778 2.705 1.00 42.41 C ATOM 3121 OE1 GLN B 85 2.332 17.366 2.649 1.00 21.05 O ATOM 3122 NE2 GLN B 85 4.392 17.450 1.776 1.00 73.05 N ATOM 0 H GLN B 85 7.026 18.453 6.215 1.00 13.00 H new ATOM 0 HA GLN B 85 4.848 16.850 5.472 1.00 53.43 H new ATOM 0 HB2 GLN B 85 5.579 19.424 5.027 1.00 51.03 H new ATOM 0 HB3 GLN B 85 6.044 18.756 3.474 1.00 51.03 H new ATOM 0 HG2 GLN B 85 3.248 18.586 4.682 1.00 31.52 H new ATOM 0 HG3 GLN B 85 3.754 19.763 3.487 1.00 31.52 H new ATOM 0 HE21 GLN B 85 5.346 17.804 1.844 1.00 73.05 H new ATOM 0 HE22 GLN B 85 4.126 16.846 0.998 1.00 73.05 H new ATOM 3131 N PRO B 86 7.486 16.284 3.369 1.00 50.32 N ATOM 3132 CA PRO B 86 7.991 15.224 2.453 1.00 5.42 C ATOM 3133 C PRO B 86 8.365 13.928 3.202 1.00 23.55 C ATOM 3134 O PRO B 86 8.212 12.843 2.651 1.00 12.21 O ATOM 3135 CB PRO B 86 9.229 15.883 1.786 1.00 23.23 C ATOM 3136 CG PRO B 86 9.712 16.882 2.792 1.00 1.45 C ATOM 3137 CD PRO B 86 8.457 17.425 3.448 1.00 62.42 C ATOM 0 HA PRO B 86 7.238 14.906 1.732 1.00 5.42 H new ATOM 0 HB2 PRO B 86 9.998 15.144 1.560 1.00 23.23 H new ATOM 0 HB3 PRO B 86 8.963 16.365 0.845 1.00 23.23 H new ATOM 0 HG2 PRO B 86 10.369 16.416 3.526 1.00 1.45 H new ATOM 0 HG3 PRO B 86 10.282 17.678 2.314 1.00 1.45 H new ATOM 0 HD2 PRO B 86 8.642 17.721 4.480 1.00 62.42 H new ATOM 0 HD3 PRO B 86 8.082 18.305 2.926 1.00 62.42 H new ATOM 3145 N THR B 87 8.809 14.073 4.472 1.00 44.04 N ATOM 3146 CA THR B 87 9.239 12.950 5.334 1.00 21.12 C ATOM 3147 C THR B 87 8.070 11.974 5.618 1.00 22.43 C ATOM 3148 O THR B 87 8.274 10.766 5.778 1.00 61.42 O ATOM 3149 CB THR B 87 9.829 13.500 6.676 1.00 51.21 C ATOM 3150 OG1 THR B 87 10.818 14.502 6.388 1.00 22.10 O ATOM 3151 CG2 THR B 87 10.470 12.406 7.553 1.00 33.21 C ATOM 0 H THR B 87 8.879 14.982 4.930 1.00 44.04 H new ATOM 0 HA THR B 87 10.013 12.394 4.804 1.00 21.12 H new ATOM 0 HB THR B 87 8.993 13.918 7.238 1.00 51.21 H new ATOM 0 HG1 THR B 87 11.287 14.745 7.213 1.00 22.10 H new ATOM 0 HG21 THR B 87 10.859 12.854 8.467 1.00 33.21 H new ATOM 0 HG22 THR B 87 9.720 11.657 7.807 1.00 33.21 H new ATOM 0 HG23 THR B 87 11.285 11.932 7.006 1.00 33.21 H new ATOM 3159 N LEU B 88 6.842 12.527 5.656 1.00 43.34 N ATOM 3160 CA LEU B 88 5.600 11.756 5.838 1.00 75.15 C ATOM 3161 C LEU B 88 5.371 10.845 4.611 1.00 22.13 C ATOM 3162 O LEU B 88 4.984 9.677 4.746 1.00 63.11 O ATOM 3163 CB LEU B 88 4.412 12.748 6.075 1.00 51.14 C ATOM 3164 CG LEU B 88 3.172 12.202 6.874 1.00 20.51 C ATOM 3165 CD1 LEU B 88 2.277 13.358 7.366 1.00 54.14 C ATOM 3166 CD2 LEU B 88 2.348 11.190 6.055 1.00 33.23 C ATOM 0 H LEU B 88 6.685 13.530 5.560 1.00 43.34 H new ATOM 0 HA LEU B 88 5.673 11.109 6.712 1.00 75.15 H new ATOM 0 HB2 LEU B 88 4.799 13.619 6.604 1.00 51.14 H new ATOM 0 HB3 LEU B 88 4.062 13.095 5.103 1.00 51.14 H new ATOM 0 HG LEU B 88 3.565 11.672 7.742 1.00 20.51 H new ATOM 0 HD11 LEU B 88 1.427 12.952 7.915 1.00 54.14 H new ATOM 0 HD12 LEU B 88 2.854 14.011 8.021 1.00 54.14 H new ATOM 0 HD13 LEU B 88 1.917 13.929 6.510 1.00 54.14 H new ATOM 0 HD21 LEU B 88 1.503 10.842 6.650 1.00 33.23 H new ATOM 0 HD22 LEU B 88 1.980 11.670 5.148 1.00 33.23 H new ATOM 0 HD23 LEU B 88 2.977 10.341 5.787 1.00 33.23 H new ATOM 3178 N PHE B 89 5.639 11.393 3.418 1.00 33.44 N ATOM 3179 CA PHE B 89 5.539 10.652 2.151 1.00 15.52 C ATOM 3180 C PHE B 89 6.680 9.630 2.001 1.00 12.12 C ATOM 3181 O PHE B 89 6.492 8.611 1.347 1.00 61.31 O ATOM 3182 CB PHE B 89 5.461 11.624 0.952 1.00 50.41 C ATOM 3183 CG PHE B 89 4.148 12.413 0.939 1.00 42.42 C ATOM 3184 CD1 PHE B 89 2.952 11.782 0.598 1.00 52.34 C ATOM 3185 CD2 PHE B 89 4.098 13.760 1.292 1.00 14.34 C ATOM 3186 CE1 PHE B 89 1.754 12.471 0.612 1.00 52.24 C ATOM 3187 CE2 PHE B 89 2.899 14.446 1.295 1.00 1.25 C ATOM 3188 CZ PHE B 89 1.728 13.803 0.958 1.00 40.42 C ATOM 0 H PHE B 89 5.932 12.363 3.303 1.00 33.44 H new ATOM 0 HA PHE B 89 4.612 10.079 2.166 1.00 15.52 H new ATOM 0 HB2 PHE B 89 6.301 12.318 0.992 1.00 50.41 H new ATOM 0 HB3 PHE B 89 5.556 11.062 0.023 1.00 50.41 H new ATOM 0 HD1 PHE B 89 2.962 10.739 0.319 1.00 52.34 H new ATOM 0 HD2 PHE B 89 5.007 14.274 1.567 1.00 14.34 H new ATOM 0 HE1 PHE B 89 0.837 11.964 0.351 1.00 52.24 H new ATOM 0 HE2 PHE B 89 2.879 15.492 1.563 1.00 1.25 H new ATOM 0 HZ PHE B 89 0.792 14.343 0.965 1.00 40.42 H new ATOM 3198 N GLU B 90 7.855 9.911 2.608 1.00 75.21 N ATOM 3199 CA GLU B 90 8.972 8.938 2.677 1.00 23.43 C ATOM 3200 C GLU B 90 8.540 7.674 3.460 1.00 35.35 C ATOM 3201 O GLU B 90 8.949 6.560 3.122 1.00 50.50 O ATOM 3202 CB GLU B 90 10.224 9.560 3.352 1.00 33.34 C ATOM 3203 CG GLU B 90 10.762 10.840 2.687 1.00 73.43 C ATOM 3204 CD GLU B 90 11.213 10.651 1.227 1.00 14.33 C ATOM 3205 OE1 GLU B 90 12.287 10.043 1.008 1.00 42.43 O ATOM 3206 OE2 GLU B 90 10.520 11.132 0.299 1.00 31.34 O ATOM 0 H GLU B 90 8.056 10.804 3.058 1.00 75.21 H new ATOM 0 HA GLU B 90 9.230 8.663 1.654 1.00 23.43 H new ATOM 0 HB2 GLU B 90 9.983 9.784 4.391 1.00 33.34 H new ATOM 0 HB3 GLU B 90 11.019 8.814 3.363 1.00 33.34 H new ATOM 0 HG2 GLU B 90 9.987 11.606 2.720 1.00 73.43 H new ATOM 0 HG3 GLU B 90 11.604 11.213 3.270 1.00 73.43 H new ATOM 3213 N LEU B 91 7.713 7.879 4.514 1.00 14.41 N ATOM 3214 CA LEU B 91 7.121 6.785 5.315 1.00 74.14 C ATOM 3215 C LEU B 91 6.136 5.944 4.462 1.00 4.05 C ATOM 3216 O LEU B 91 6.067 4.727 4.622 1.00 11.45 O ATOM 3217 CB LEU B 91 6.391 7.348 6.574 1.00 63.35 C ATOM 3218 CG LEU B 91 7.282 8.038 7.661 1.00 65.20 C ATOM 3219 CD1 LEU B 91 6.407 8.689 8.761 1.00 20.21 C ATOM 3220 CD2 LEU B 91 8.292 7.038 8.277 1.00 5.33 C ATOM 0 H LEU B 91 7.439 8.809 4.831 1.00 14.41 H new ATOM 0 HA LEU B 91 7.935 6.139 5.645 1.00 74.14 H new ATOM 0 HB2 LEU B 91 5.645 8.069 6.239 1.00 63.35 H new ATOM 0 HB3 LEU B 91 5.852 6.528 7.048 1.00 63.35 H new ATOM 0 HG LEU B 91 7.853 8.827 7.171 1.00 65.20 H new ATOM 0 HD11 LEU B 91 7.049 9.162 9.504 1.00 20.21 H new ATOM 0 HD12 LEU B 91 5.758 9.440 8.312 1.00 20.21 H new ATOM 0 HD13 LEU B 91 5.798 7.924 9.242 1.00 20.21 H new ATOM 0 HD21 LEU B 91 8.896 7.547 9.028 1.00 5.33 H new ATOM 0 HD22 LEU B 91 7.751 6.215 8.744 1.00 5.33 H new ATOM 0 HD23 LEU B 91 8.941 6.647 7.493 1.00 5.33 H new ATOM 3232 N ILE B 92 5.381 6.621 3.562 1.00 35.52 N ATOM 3233 CA ILE B 92 4.423 5.963 2.639 1.00 3.12 C ATOM 3234 C ILE B 92 5.178 5.126 1.583 1.00 74.30 C ATOM 3235 O ILE B 92 4.806 3.980 1.308 1.00 74.10 O ATOM 3236 CB ILE B 92 3.487 7.015 1.915 1.00 51.42 C ATOM 3237 CG1 ILE B 92 2.682 7.842 2.968 1.00 71.43 C ATOM 3238 CG2 ILE B 92 2.527 6.333 0.895 1.00 45.43 C ATOM 3239 CD1 ILE B 92 1.732 8.878 2.393 1.00 74.12 C ATOM 0 H ILE B 92 5.419 7.635 3.456 1.00 35.52 H new ATOM 0 HA ILE B 92 3.794 5.307 3.241 1.00 3.12 H new ATOM 0 HB ILE B 92 4.127 7.693 1.351 1.00 51.42 H new ATOM 0 HG12 ILE B 92 2.109 7.151 3.586 1.00 71.43 H new ATOM 0 HG13 ILE B 92 3.389 8.347 3.626 1.00 71.43 H new ATOM 0 HG21 ILE B 92 1.903 7.090 0.421 1.00 45.43 H new ATOM 0 HG22 ILE B 92 3.112 5.816 0.134 1.00 45.43 H new ATOM 0 HG23 ILE B 92 1.894 5.615 1.416 1.00 45.43 H new ATOM 0 HD11 ILE B 92 1.223 9.396 3.206 1.00 74.12 H new ATOM 0 HD12 ILE B 92 2.295 9.599 1.800 1.00 74.12 H new ATOM 0 HD13 ILE B 92 0.995 8.384 1.760 1.00 74.12 H new ATOM 3251 N LEU B 93 6.258 5.717 1.027 1.00 62.25 N ATOM 3252 CA LEU B 93 7.104 5.072 0.001 1.00 1.43 C ATOM 3253 C LEU B 93 7.801 3.827 0.579 1.00 12.40 C ATOM 3254 O LEU B 93 7.914 2.815 -0.102 1.00 20.31 O ATOM 3255 CB LEU B 93 8.156 6.076 -0.563 1.00 71.34 C ATOM 3256 CG LEU B 93 7.589 7.301 -1.358 1.00 32.14 C ATOM 3257 CD1 LEU B 93 8.726 8.263 -1.776 1.00 43.13 C ATOM 3258 CD2 LEU B 93 6.748 6.849 -2.580 1.00 32.13 C ATOM 0 H LEU B 93 6.567 6.656 1.278 1.00 62.25 H new ATOM 0 HA LEU B 93 6.460 4.757 -0.820 1.00 1.43 H new ATOM 0 HB2 LEU B 93 8.750 6.453 0.270 1.00 71.34 H new ATOM 0 HB3 LEU B 93 8.835 5.529 -1.216 1.00 71.34 H new ATOM 0 HG LEU B 93 6.919 7.846 -0.693 1.00 32.14 H new ATOM 0 HD11 LEU B 93 8.306 9.105 -2.326 1.00 43.13 H new ATOM 0 HD12 LEU B 93 9.238 8.630 -0.886 1.00 43.13 H new ATOM 0 HD13 LEU B 93 9.436 7.733 -2.410 1.00 43.13 H new ATOM 0 HD21 LEU B 93 6.371 7.726 -3.107 1.00 32.13 H new ATOM 0 HD22 LEU B 93 7.372 6.261 -3.253 1.00 32.13 H new ATOM 0 HD23 LEU B 93 5.909 6.242 -2.240 1.00 32.13 H new ATOM 3270 N ALA B 94 8.231 3.930 1.855 1.00 5.12 N ATOM 3271 CA ALA B 94 8.893 2.834 2.586 1.00 42.04 C ATOM 3272 C ALA B 94 7.898 1.717 2.935 1.00 30.34 C ATOM 3273 O ALA B 94 8.218 0.534 2.822 1.00 21.32 O ATOM 3274 CB ALA B 94 9.543 3.373 3.864 1.00 32.32 C ATOM 0 H ALA B 94 8.127 4.781 2.407 1.00 5.12 H new ATOM 0 HA ALA B 94 9.662 2.413 1.939 1.00 42.04 H new ATOM 0 HB1 ALA B 94 10.029 2.556 4.397 1.00 32.32 H new ATOM 0 HB2 ALA B 94 10.284 4.129 3.604 1.00 32.32 H new ATOM 0 HB3 ALA B 94 8.779 3.818 4.501 1.00 32.32 H new ATOM 3280 N ALA B 95 6.689 2.127 3.362 1.00 74.42 N ATOM 3281 CA ALA B 95 5.609 1.204 3.750 1.00 53.14 C ATOM 3282 C ALA B 95 5.124 0.379 2.551 1.00 61.34 C ATOM 3283 O ALA B 95 4.758 -0.780 2.703 1.00 21.13 O ATOM 3284 CB ALA B 95 4.440 1.986 4.344 1.00 53.01 C ATOM 0 H ALA B 95 6.434 3.111 3.447 1.00 74.42 H new ATOM 0 HA ALA B 95 6.007 0.518 4.498 1.00 53.14 H new ATOM 0 HB1 ALA B 95 3.647 1.295 4.628 1.00 53.01 H new ATOM 0 HB2 ALA B 95 4.778 2.532 5.225 1.00 53.01 H new ATOM 0 HB3 ALA B 95 4.060 2.690 3.604 1.00 53.01 H new ATOM 3290 N ASN B 96 5.111 1.021 1.371 1.00 50.32 N ATOM 3291 CA ASN B 96 4.715 0.389 0.100 1.00 41.41 C ATOM 3292 C ASN B 96 5.870 -0.463 -0.467 1.00 54.33 C ATOM 3293 O ASN B 96 5.639 -1.531 -1.028 1.00 25.23 O ATOM 3294 CB ASN B 96 4.273 1.481 -0.912 1.00 33.23 C ATOM 3295 CG ASN B 96 3.814 0.931 -2.267 1.00 31.31 C ATOM 3296 OD1 ASN B 96 3.330 -0.195 -2.380 1.00 64.21 O ATOM 3297 ND2 ASN B 96 3.921 1.733 -3.300 1.00 51.30 N ATOM 0 H ASN B 96 5.377 2.001 1.271 1.00 50.32 H new ATOM 0 HA ASN B 96 3.872 -0.278 0.280 1.00 41.41 H new ATOM 0 HB2 ASN B 96 3.460 2.060 -0.473 1.00 33.23 H new ATOM 0 HB3 ASN B 96 5.103 2.169 -1.074 1.00 33.23 H new ATOM 0 HD21 ASN B 96 3.600 1.427 -4.219 1.00 51.30 H new ATOM 0 HD22 ASN B 96 4.325 2.662 -3.184 1.00 51.30 H new ATOM 3304 N TYR B 97 7.113 0.022 -0.294 1.00 31.13 N ATOM 3305 CA TYR B 97 8.342 -0.694 -0.720 1.00 64.14 C ATOM 3306 C TYR B 97 8.495 -2.024 0.045 1.00 24.20 C ATOM 3307 O TYR B 97 8.956 -3.029 -0.508 1.00 32.30 O ATOM 3308 CB TYR B 97 9.581 0.222 -0.496 1.00 2.23 C ATOM 3309 CG TYR B 97 10.957 -0.435 -0.731 1.00 15.33 C ATOM 3310 CD1 TYR B 97 11.850 -0.654 0.330 1.00 54.21 C ATOM 3311 CD2 TYR B 97 11.358 -0.831 -2.010 1.00 22.13 C ATOM 3312 CE1 TYR B 97 13.085 -1.237 0.120 1.00 63.23 C ATOM 3313 CE2 TYR B 97 12.592 -1.419 -2.220 1.00 30.43 C ATOM 3314 CZ TYR B 97 13.451 -1.617 -1.153 1.00 61.45 C ATOM 3315 OH TYR B 97 14.687 -2.190 -1.369 1.00 35.42 O ATOM 0 H TYR B 97 7.300 0.923 0.146 1.00 31.13 H new ATOM 0 HA TYR B 97 8.265 -0.932 -1.781 1.00 64.14 H new ATOM 0 HB2 TYR B 97 9.495 1.085 -1.156 1.00 2.23 H new ATOM 0 HB3 TYR B 97 9.550 0.599 0.526 1.00 2.23 H new ATOM 0 HD1 TYR B 97 11.566 -0.361 1.330 1.00 54.21 H new ATOM 0 HD2 TYR B 97 10.694 -0.675 -2.847 1.00 22.13 H new ATOM 0 HE1 TYR B 97 13.760 -1.394 0.949 1.00 63.23 H new ATOM 0 HE2 TYR B 97 12.885 -1.723 -3.214 1.00 30.43 H new ATOM 0 HH TYR B 97 14.788 -2.400 -2.321 1.00 35.42 H new ATOM 3325 N LEU B 98 8.102 -2.001 1.326 1.00 73.33 N ATOM 3326 CA LEU B 98 8.175 -3.163 2.224 1.00 50.44 C ATOM 3327 C LEU B 98 6.826 -3.912 2.282 1.00 11.40 C ATOM 3328 O LEU B 98 6.770 -5.045 2.773 1.00 54.14 O ATOM 3329 CB LEU B 98 8.614 -2.696 3.638 1.00 51.24 C ATOM 3330 CG LEU B 98 10.040 -2.059 3.735 1.00 11.01 C ATOM 3331 CD1 LEU B 98 10.349 -1.566 5.168 1.00 15.33 C ATOM 3332 CD2 LEU B 98 11.123 -3.041 3.225 1.00 72.52 C ATOM 0 H LEU B 98 7.721 -1.167 1.773 1.00 73.33 H new ATOM 0 HA LEU B 98 8.914 -3.863 1.834 1.00 50.44 H new ATOM 0 HB2 LEU B 98 7.887 -1.970 4.002 1.00 51.24 H new ATOM 0 HB3 LEU B 98 8.573 -3.552 4.311 1.00 51.24 H new ATOM 0 HG LEU B 98 10.055 -1.183 3.086 1.00 11.01 H new ATOM 0 HD11 LEU B 98 11.348 -1.130 5.195 1.00 15.33 H new ATOM 0 HD12 LEU B 98 9.616 -0.813 5.460 1.00 15.33 H new ATOM 0 HD13 LEU B 98 10.301 -2.407 5.860 1.00 15.33 H new ATOM 0 HD21 LEU B 98 12.104 -2.573 3.303 1.00 72.52 H new ATOM 0 HD22 LEU B 98 11.104 -3.949 3.828 1.00 72.52 H new ATOM 0 HD23 LEU B 98 10.924 -3.294 2.184 1.00 72.52 H new ATOM 3344 N ASP B 99 5.763 -3.265 1.757 1.00 5.41 N ATOM 3345 CA ASP B 99 4.374 -3.798 1.751 1.00 2.33 C ATOM 3346 C ASP B 99 3.856 -4.076 3.180 1.00 41.12 C ATOM 3347 O ASP B 99 3.059 -4.992 3.398 1.00 20.13 O ATOM 3348 CB ASP B 99 4.256 -5.051 0.834 1.00 4.33 C ATOM 3349 CG ASP B 99 4.326 -4.717 -0.665 1.00 40.14 C ATOM 3350 OD1 ASP B 99 3.264 -4.625 -1.318 1.00 60.31 O ATOM 3351 OD2 ASP B 99 5.440 -4.525 -1.195 1.00 61.23 O ATOM 0 H ASP B 99 5.841 -2.347 1.319 1.00 5.41 H new ATOM 0 HA ASP B 99 3.729 -3.025 1.332 1.00 2.33 H new ATOM 0 HB2 ASP B 99 5.055 -5.750 1.081 1.00 4.33 H new ATOM 0 HB3 ASP B 99 3.314 -5.558 1.043 1.00 4.33 H new ATOM 3356 N ILE B 100 4.298 -3.244 4.147 1.00 50.21 N ATOM 3357 CA ILE B 100 3.800 -3.300 5.532 1.00 32.43 C ATOM 3358 C ILE B 100 2.397 -2.679 5.575 1.00 1.33 C ATOM 3359 O ILE B 100 2.258 -1.460 5.684 1.00 0.04 O ATOM 3360 CB ILE B 100 4.755 -2.562 6.552 1.00 4.21 C ATOM 3361 CG1 ILE B 100 6.203 -3.112 6.415 1.00 63.52 C ATOM 3362 CG2 ILE B 100 4.230 -2.703 8.008 1.00 4.24 C ATOM 3363 CD1 ILE B 100 7.220 -2.553 7.393 1.00 24.04 C ATOM 0 H ILE B 100 5.002 -2.523 3.989 1.00 50.21 H new ATOM 0 HA ILE B 100 3.767 -4.345 5.839 1.00 32.43 H new ATOM 0 HB ILE B 100 4.768 -1.498 6.315 1.00 4.21 H new ATOM 0 HG12 ILE B 100 6.172 -4.195 6.533 1.00 63.52 H new ATOM 0 HG13 ILE B 100 6.553 -2.911 5.402 1.00 63.52 H new ATOM 0 HG21 ILE B 100 4.905 -2.186 8.690 1.00 4.24 H new ATOM 0 HG22 ILE B 100 3.235 -2.264 8.080 1.00 4.24 H new ATOM 0 HG23 ILE B 100 4.181 -3.758 8.276 1.00 4.24 H new ATOM 0 HD11 ILE B 100 8.193 -3.007 7.205 1.00 24.04 H new ATOM 0 HD12 ILE B 100 7.293 -1.473 7.265 1.00 24.04 H new ATOM 0 HD13 ILE B 100 6.906 -2.777 8.412 1.00 24.04 H new ATOM 3375 N LYS B 101 1.377 -3.547 5.450 1.00 21.40 N ATOM 3376 CA LYS B 101 -0.046 -3.157 5.384 1.00 62.34 C ATOM 3377 C LYS B 101 -0.466 -2.263 6.604 1.00 62.03 C ATOM 3378 O LYS B 101 -1.070 -1.209 6.369 1.00 63.32 O ATOM 3379 CB LYS B 101 -0.946 -4.441 5.246 1.00 11.22 C ATOM 3380 CG LYS B 101 -2.297 -4.260 4.502 1.00 55.20 C ATOM 3381 CD LYS B 101 -3.311 -3.329 5.210 1.00 53.03 C ATOM 3382 CE LYS B 101 -4.635 -3.213 4.444 1.00 41.20 C ATOM 3383 NZ LYS B 101 -4.426 -2.764 3.051 1.00 3.45 N ATOM 0 H LYS B 101 1.519 -4.555 5.391 1.00 21.40 H new ATOM 0 HA LYS B 101 -0.196 -2.541 4.497 1.00 62.34 H new ATOM 0 HB2 LYS B 101 -0.370 -5.208 4.727 1.00 11.22 H new ATOM 0 HB3 LYS B 101 -1.155 -4.821 6.246 1.00 11.22 H new ATOM 0 HG2 LYS B 101 -2.097 -3.865 3.506 1.00 55.20 H new ATOM 0 HG3 LYS B 101 -2.756 -5.240 4.370 1.00 55.20 H new ATOM 0 HD2 LYS B 101 -3.507 -3.707 6.213 1.00 53.03 H new ATOM 0 HD3 LYS B 101 -2.872 -2.338 5.323 1.00 53.03 H new ATOM 0 HE2 LYS B 101 -5.140 -4.179 4.443 1.00 41.20 H new ATOM 0 HE3 LYS B 101 -5.292 -2.511 4.958 1.00 41.20 H new ATOM 0 HZ1 LYS B 101 -5.344 -2.698 2.566 1.00 3.45 H new ATOM 0 HZ2 LYS B 101 -3.967 -1.831 3.052 1.00 3.45 H new ATOM 0 HZ3 LYS B 101 -3.820 -3.447 2.553 1.00 3.45 H new ATOM 3397 N PRO B 102 -0.171 -2.646 7.915 1.00 33.53 N ATOM 3398 CA PRO B 102 -0.572 -1.813 9.085 1.00 72.13 C ATOM 3399 C PRO B 102 -0.019 -0.371 9.026 1.00 33.00 C ATOM 3400 O PRO B 102 -0.783 0.587 9.144 1.00 44.23 O ATOM 3401 CB PRO B 102 -0.002 -2.595 10.308 1.00 42.25 C ATOM 3402 CG PRO B 102 1.017 -3.541 9.742 1.00 31.30 C ATOM 3403 CD PRO B 102 0.507 -3.904 8.372 1.00 12.13 C ATOM 0 HA PRO B 102 -1.652 -1.675 9.127 1.00 72.13 H new ATOM 0 HB2 PRO B 102 0.452 -1.916 11.030 1.00 42.25 H new ATOM 0 HB3 PRO B 102 -0.791 -3.136 10.830 1.00 42.25 H new ATOM 0 HG2 PRO B 102 1.999 -3.072 9.684 1.00 31.30 H new ATOM 0 HG3 PRO B 102 1.123 -4.426 10.369 1.00 31.30 H new ATOM 0 HD2 PRO B 102 1.318 -4.190 7.703 1.00 12.13 H new ATOM 0 HD3 PRO B 102 -0.186 -4.744 8.410 1.00 12.13 H new ATOM 3411 N LEU B 103 1.304 -0.240 8.794 1.00 23.31 N ATOM 3412 CA LEU B 103 1.991 1.068 8.794 1.00 72.40 C ATOM 3413 C LEU B 103 1.530 1.909 7.588 1.00 61.11 C ATOM 3414 O LEU B 103 1.314 3.115 7.717 1.00 23.44 O ATOM 3415 CB LEU B 103 3.542 0.866 8.817 1.00 52.10 C ATOM 3416 CG LEU B 103 4.453 2.137 9.078 1.00 31.21 C ATOM 3417 CD1 LEU B 103 4.812 2.915 7.788 1.00 50.34 C ATOM 3418 CD2 LEU B 103 3.808 3.080 10.119 1.00 31.32 C ATOM 0 H LEU B 103 1.921 -1.030 8.603 1.00 23.31 H new ATOM 0 HA LEU B 103 1.724 1.618 9.696 1.00 72.40 H new ATOM 0 HB2 LEU B 103 3.771 0.127 9.585 1.00 52.10 H new ATOM 0 HB3 LEU B 103 3.837 0.434 7.861 1.00 52.10 H new ATOM 0 HG LEU B 103 5.391 1.753 9.478 1.00 31.21 H new ATOM 0 HD11 LEU B 103 5.437 3.772 8.042 1.00 50.34 H new ATOM 0 HD12 LEU B 103 5.354 2.259 7.107 1.00 50.34 H new ATOM 0 HD13 LEU B 103 3.898 3.262 7.306 1.00 50.34 H new ATOM 0 HD21 LEU B 103 4.455 3.943 10.278 1.00 31.32 H new ATOM 0 HD22 LEU B 103 2.838 3.416 9.753 1.00 31.32 H new ATOM 0 HD23 LEU B 103 3.676 2.547 11.061 1.00 31.32 H new ATOM 3430 N LEU B 104 1.357 1.237 6.435 1.00 63.25 N ATOM 3431 CA LEU B 104 0.870 1.862 5.190 1.00 55.24 C ATOM 3432 C LEU B 104 -0.504 2.507 5.411 1.00 3.42 C ATOM 3433 O LEU B 104 -0.712 3.664 5.040 1.00 55.24 O ATOM 3434 CB LEU B 104 0.782 0.796 4.066 1.00 4.25 C ATOM 3435 CG LEU B 104 0.283 1.283 2.669 1.00 64.02 C ATOM 3436 CD1 LEU B 104 1.254 2.309 2.036 1.00 23.05 C ATOM 3437 CD2 LEU B 104 0.041 0.076 1.741 1.00 73.32 C ATOM 0 H LEU B 104 1.552 0.240 6.340 1.00 63.25 H new ATOM 0 HA LEU B 104 1.572 2.641 4.893 1.00 55.24 H new ATOM 0 HB2 LEU B 104 1.771 0.355 3.938 1.00 4.25 H new ATOM 0 HB3 LEU B 104 0.119 -0.000 4.405 1.00 4.25 H new ATOM 0 HG LEU B 104 -0.665 1.802 2.808 1.00 64.02 H new ATOM 0 HD11 LEU B 104 0.870 2.622 1.065 1.00 23.05 H new ATOM 0 HD12 LEU B 104 1.342 3.177 2.689 1.00 23.05 H new ATOM 0 HD13 LEU B 104 2.235 1.851 1.908 1.00 23.05 H new ATOM 0 HD21 LEU B 104 -0.307 0.428 0.770 1.00 73.32 H new ATOM 0 HD22 LEU B 104 0.971 -0.478 1.615 1.00 73.32 H new ATOM 0 HD23 LEU B 104 -0.713 -0.576 2.182 1.00 73.32 H new ATOM 3449 N ASP B 105 -1.406 1.745 6.067 1.00 23.34 N ATOM 3450 CA ASP B 105 -2.797 2.165 6.281 1.00 61.15 C ATOM 3451 C ASP B 105 -2.855 3.377 7.205 1.00 31.10 C ATOM 3452 O ASP B 105 -3.417 4.395 6.829 1.00 73.35 O ATOM 3453 CB ASP B 105 -3.664 1.001 6.834 1.00 72.40 C ATOM 3454 CG ASP B 105 -5.170 1.352 6.818 1.00 14.50 C ATOM 3455 OD1 ASP B 105 -5.798 1.232 5.740 1.00 13.14 O ATOM 3456 OD2 ASP B 105 -5.730 1.753 7.864 1.00 53.23 O ATOM 0 H ASP B 105 -1.187 0.829 6.458 1.00 23.34 H new ATOM 0 HA ASP B 105 -3.212 2.450 5.314 1.00 61.15 H new ATOM 0 HB2 ASP B 105 -3.493 0.105 6.238 1.00 72.40 H new ATOM 0 HB3 ASP B 105 -3.355 0.770 7.853 1.00 72.40 H new ATOM 3461 N VAL B 106 -2.193 3.270 8.369 1.00 34.25 N ATOM 3462 CA VAL B 106 -2.154 4.339 9.388 1.00 21.44 C ATOM 3463 C VAL B 106 -1.615 5.662 8.789 1.00 40.55 C ATOM 3464 O VAL B 106 -2.232 6.719 8.961 1.00 3.14 O ATOM 3465 CB VAL B 106 -1.285 3.890 10.625 1.00 23.32 C ATOM 3466 CG1 VAL B 106 -1.098 5.034 11.660 1.00 32.41 C ATOM 3467 CG2 VAL B 106 -1.904 2.636 11.294 1.00 12.30 C ATOM 0 H VAL B 106 -1.667 2.437 8.633 1.00 34.25 H new ATOM 0 HA VAL B 106 -3.173 4.519 9.729 1.00 21.44 H new ATOM 0 HB VAL B 106 -0.293 3.637 10.251 1.00 23.32 H new ATOM 0 HG11 VAL B 106 -0.493 4.676 12.493 1.00 32.41 H new ATOM 0 HG12 VAL B 106 -0.597 5.877 11.184 1.00 32.41 H new ATOM 0 HG13 VAL B 106 -2.072 5.353 12.030 1.00 32.41 H new ATOM 0 HG21 VAL B 106 -1.292 2.339 12.146 1.00 12.30 H new ATOM 0 HG22 VAL B 106 -2.913 2.866 11.635 1.00 12.30 H new ATOM 0 HG23 VAL B 106 -1.942 1.820 10.572 1.00 12.30 H new ATOM 3477 N THR B 107 -0.498 5.566 8.043 1.00 30.24 N ATOM 3478 CA THR B 107 0.192 6.734 7.458 1.00 33.14 C ATOM 3479 C THR B 107 -0.625 7.368 6.293 1.00 1.43 C ATOM 3480 O THR B 107 -0.630 8.598 6.135 1.00 50.34 O ATOM 3481 CB THR B 107 1.633 6.336 6.988 1.00 22.22 C ATOM 3482 OG1 THR B 107 2.320 5.695 8.075 1.00 43.34 O ATOM 3483 CG2 THR B 107 2.473 7.544 6.540 1.00 22.31 C ATOM 0 H THR B 107 -0.048 4.676 7.828 1.00 30.24 H new ATOM 0 HA THR B 107 0.278 7.494 8.235 1.00 33.14 H new ATOM 0 HB THR B 107 1.516 5.672 6.132 1.00 22.22 H new ATOM 0 HG1 THR B 107 2.075 4.747 8.103 1.00 43.34 H new ATOM 0 HG21 THR B 107 3.460 7.204 6.226 1.00 22.31 H new ATOM 0 HG22 THR B 107 1.978 8.042 5.706 1.00 22.31 H new ATOM 0 HG23 THR B 107 2.577 8.243 7.370 1.00 22.31 H new ATOM 3491 N CYS B 108 -1.343 6.527 5.511 1.00 53.01 N ATOM 3492 CA CYS B 108 -2.212 6.997 4.402 1.00 63.43 C ATOM 3493 C CYS B 108 -3.484 7.678 4.955 1.00 5.04 C ATOM 3494 O CYS B 108 -3.944 8.688 4.399 1.00 2.04 O ATOM 3495 CB CYS B 108 -2.589 5.826 3.462 1.00 34.10 C ATOM 3496 SG CYS B 108 -1.187 5.143 2.545 1.00 10.24 S ATOM 0 H CYS B 108 -1.338 5.514 5.628 1.00 53.01 H new ATOM 0 HA CYS B 108 -1.652 7.732 3.824 1.00 63.43 H new ATOM 0 HB2 CYS B 108 -3.046 5.032 4.052 1.00 34.10 H new ATOM 0 HB3 CYS B 108 -3.342 6.170 2.753 1.00 34.10 H new ATOM 0 HG CYS B 108 -0.540 4.307 3.301 1.00 10.24 H new ATOM 3502 N LYS B 109 -4.023 7.124 6.066 1.00 64.52 N ATOM 3503 CA LYS B 109 -5.201 7.684 6.758 1.00 41.12 C ATOM 3504 C LYS B 109 -4.830 9.026 7.408 1.00 64.32 C ATOM 3505 O LYS B 109 -5.659 9.922 7.472 1.00 22.20 O ATOM 3506 CB LYS B 109 -5.768 6.697 7.828 1.00 73.44 C ATOM 3507 CG LYS B 109 -6.295 5.356 7.260 1.00 50.51 C ATOM 3508 CD LYS B 109 -7.492 5.511 6.290 1.00 12.52 C ATOM 3509 CE LYS B 109 -7.882 4.176 5.614 1.00 54.32 C ATOM 3510 NZ LYS B 109 -8.150 3.094 6.598 1.00 11.13 N ATOM 0 H LYS B 109 -3.653 6.280 6.504 1.00 64.52 H new ATOM 0 HA LYS B 109 -5.985 7.844 6.017 1.00 41.12 H new ATOM 0 HB2 LYS B 109 -4.986 6.484 8.556 1.00 73.44 H new ATOM 0 HB3 LYS B 109 -6.578 7.191 8.365 1.00 73.44 H new ATOM 0 HG2 LYS B 109 -5.482 4.849 6.740 1.00 50.51 H new ATOM 0 HG3 LYS B 109 -6.593 4.714 8.089 1.00 50.51 H new ATOM 0 HD2 LYS B 109 -8.350 5.902 6.836 1.00 12.52 H new ATOM 0 HD3 LYS B 109 -7.242 6.244 5.523 1.00 12.52 H new ATOM 0 HE2 LYS B 109 -8.768 4.330 4.998 1.00 54.32 H new ATOM 0 HE3 LYS B 109 -7.080 3.864 4.945 1.00 54.32 H new ATOM 0 HZ1 LYS B 109 -8.552 2.270 6.107 1.00 11.13 H new ATOM 0 HZ2 LYS B 109 -7.261 2.820 7.063 1.00 11.13 H new ATOM 0 HZ3 LYS B 109 -8.824 3.434 7.313 1.00 11.13 H new ATOM 3524 N THR B 110 -3.558 9.147 7.865 1.00 14.24 N ATOM 3525 CA THR B 110 -3.022 10.391 8.452 1.00 13.32 C ATOM 3526 C THR B 110 -3.113 11.560 7.452 1.00 33.33 C ATOM 3527 O THR B 110 -3.599 12.635 7.806 1.00 54.20 O ATOM 3528 CB THR B 110 -1.538 10.216 8.936 1.00 73.42 C ATOM 3529 OG1 THR B 110 -1.479 9.219 9.967 1.00 21.32 O ATOM 3530 CG2 THR B 110 -0.929 11.533 9.469 1.00 65.30 C ATOM 0 H THR B 110 -2.881 8.385 7.835 1.00 14.24 H new ATOM 0 HA THR B 110 -3.638 10.621 9.322 1.00 13.32 H new ATOM 0 HB THR B 110 -0.953 9.907 8.070 1.00 73.42 H new ATOM 0 HG1 THR B 110 -1.747 8.351 9.599 1.00 21.32 H new ATOM 0 HG21 THR B 110 0.097 11.355 9.790 1.00 65.30 H new ATOM 0 HG22 THR B 110 -0.937 12.284 8.679 1.00 65.30 H new ATOM 0 HG23 THR B 110 -1.517 11.890 10.314 1.00 65.30 H new ATOM 3538 N VAL B 111 -2.671 11.320 6.198 1.00 2.42 N ATOM 3539 CA VAL B 111 -2.682 12.351 5.136 1.00 52.30 C ATOM 3540 C VAL B 111 -4.126 12.742 4.796 1.00 63.23 C ATOM 3541 O VAL B 111 -4.440 13.925 4.628 1.00 32.01 O ATOM 3542 CB VAL B 111 -1.954 11.889 3.819 1.00 41.40 C ATOM 3543 CG1 VAL B 111 -1.773 13.083 2.851 1.00 0.34 C ATOM 3544 CG2 VAL B 111 -0.606 11.218 4.131 1.00 74.20 C ATOM 0 H VAL B 111 -2.301 10.419 5.896 1.00 2.42 H new ATOM 0 HA VAL B 111 -2.134 13.206 5.532 1.00 52.30 H new ATOM 0 HB VAL B 111 -2.582 11.145 3.329 1.00 41.40 H new ATOM 0 HG11 VAL B 111 -1.268 12.745 1.946 1.00 0.34 H new ATOM 0 HG12 VAL B 111 -2.749 13.491 2.590 1.00 0.34 H new ATOM 0 HG13 VAL B 111 -1.174 13.855 3.334 1.00 0.34 H new ATOM 0 HG21 VAL B 111 -0.129 10.911 3.201 1.00 74.20 H new ATOM 0 HG22 VAL B 111 0.039 11.924 4.654 1.00 74.20 H new ATOM 0 HG23 VAL B 111 -0.772 10.343 4.760 1.00 74.20 H new ATOM 3554 N ALA B 112 -4.984 11.712 4.721 1.00 33.31 N ATOM 3555 CA ALA B 112 -6.423 11.862 4.477 1.00 61.04 C ATOM 3556 C ALA B 112 -7.092 12.710 5.586 1.00 31.52 C ATOM 3557 O ALA B 112 -8.029 13.462 5.323 1.00 32.11 O ATOM 3558 CB ALA B 112 -7.070 10.473 4.380 1.00 51.41 C ATOM 0 H ALA B 112 -4.692 10.741 4.830 1.00 33.31 H new ATOM 0 HA ALA B 112 -6.569 12.390 3.535 1.00 61.04 H new ATOM 0 HB1 ALA B 112 -8.139 10.582 4.199 1.00 51.41 H new ATOM 0 HB2 ALA B 112 -6.617 9.917 3.559 1.00 51.41 H new ATOM 0 HB3 ALA B 112 -6.913 9.933 5.314 1.00 51.41 H new ATOM 3564 N ASN B 113 -6.586 12.564 6.824 1.00 15.11 N ATOM 3565 CA ASN B 113 -7.064 13.308 8.012 1.00 2.02 C ATOM 3566 C ASN B 113 -6.464 14.729 8.077 1.00 72.01 C ATOM 3567 O ASN B 113 -7.045 15.608 8.718 1.00 71.32 O ATOM 3568 CB ASN B 113 -6.740 12.510 9.312 1.00 74.11 C ATOM 3569 CG ASN B 113 -7.600 11.250 9.499 1.00 25.13 C ATOM 3570 OD1 ASN B 113 -8.161 10.704 8.550 1.00 21.13 O ATOM 3571 ND2 ASN B 113 -7.681 10.758 10.723 1.00 71.24 N ATOM 0 H ASN B 113 -5.824 11.919 7.034 1.00 15.11 H new ATOM 0 HA ASN B 113 -8.145 13.418 7.925 1.00 2.02 H new ATOM 0 HB2 ASN B 113 -5.689 12.222 9.297 1.00 74.11 H new ATOM 0 HB3 ASN B 113 -6.879 13.164 10.173 1.00 74.11 H new ATOM 0 HD21 ASN B 113 -8.217 9.908 10.896 1.00 71.24 H new ATOM 0 HD22 ASN B 113 -7.207 11.228 11.494 1.00 71.24 H new ATOM 3578 N MET B 114 -5.286 14.945 7.442 1.00 50.34 N ATOM 3579 CA MET B 114 -4.674 16.291 7.367 1.00 72.50 C ATOM 3580 C MET B 114 -5.500 17.171 6.418 1.00 15.24 C ATOM 3581 O MET B 114 -5.933 18.268 6.784 1.00 20.33 O ATOM 3582 CB MET B 114 -3.194 16.252 6.869 1.00 41.23 C ATOM 3583 CG MET B 114 -2.204 15.519 7.783 1.00 10.54 C ATOM 3584 SD MET B 114 -0.472 15.817 7.328 1.00 13.23 S ATOM 3585 CE MET B 114 -0.428 15.388 5.580 1.00 45.44 C ATOM 0 H MET B 114 -4.747 14.212 6.980 1.00 50.34 H new ATOM 0 HA MET B 114 -4.670 16.702 8.376 1.00 72.50 H new ATOM 0 HB2 MET B 114 -3.173 15.779 5.887 1.00 41.23 H new ATOM 0 HB3 MET B 114 -2.847 17.277 6.736 1.00 41.23 H new ATOM 0 HG2 MET B 114 -2.364 15.837 8.813 1.00 10.54 H new ATOM 0 HG3 MET B 114 -2.406 14.449 7.745 1.00 10.54 H new ATOM 0 HE1 MET B 114 0.379 15.934 5.092 1.00 45.44 H new ATOM 0 HE2 MET B 114 -0.258 14.317 5.472 1.00 45.44 H new ATOM 0 HE3 MET B 114 -1.378 15.653 5.116 1.00 45.44 H new ATOM 3595 N ILE B 115 -5.752 16.640 5.209 1.00 34.45 N ATOM 3596 CA ILE B 115 -6.480 17.361 4.152 1.00 13.25 C ATOM 3597 C ILE B 115 -7.997 17.379 4.447 1.00 2.03 C ATOM 3598 O ILE B 115 -8.690 18.343 4.095 1.00 60.23 O ATOM 3599 CB ILE B 115 -6.216 16.730 2.722 1.00 63.32 C ATOM 3600 CG1 ILE B 115 -6.804 15.282 2.613 1.00 23.13 C ATOM 3601 CG2 ILE B 115 -4.702 16.729 2.388 1.00 3.34 C ATOM 3602 CD1 ILE B 115 -6.758 14.674 1.225 1.00 41.53 C ATOM 0 H ILE B 115 -5.457 15.702 4.938 1.00 34.45 H new ATOM 0 HA ILE B 115 -6.106 18.385 4.144 1.00 13.25 H new ATOM 0 HB ILE B 115 -6.731 17.354 1.991 1.00 63.32 H new ATOM 0 HG12 ILE B 115 -6.257 14.632 3.296 1.00 23.13 H new ATOM 0 HG13 ILE B 115 -7.840 15.301 2.951 1.00 23.13 H new ATOM 0 HG21 ILE B 115 -4.547 16.291 1.402 1.00 3.34 H new ATOM 0 HG22 ILE B 115 -4.328 17.753 2.393 1.00 3.34 H new ATOM 0 HG23 ILE B 115 -4.165 16.143 3.134 1.00 3.34 H new ATOM 0 HD11 ILE B 115 -7.187 13.672 1.252 1.00 41.53 H new ATOM 0 HD12 ILE B 115 -7.330 15.295 0.536 1.00 41.53 H new ATOM 0 HD13 ILE B 115 -5.723 14.616 0.887 1.00 41.53 H new ATOM 3614 N ARG B 116 -8.475 16.303 5.121 1.00 3.15 N ATOM 3615 CA ARG B 116 -9.905 16.025 5.353 1.00 72.02 C ATOM 3616 C ARG B 116 -10.676 16.019 4.020 1.00 50.22 C ATOM 3617 O ARG B 116 -11.461 16.928 3.723 1.00 44.34 O ATOM 3618 CB ARG B 116 -10.500 16.998 6.405 1.00 44.43 C ATOM 3619 CG ARG B 116 -9.816 16.897 7.785 1.00 13.55 C ATOM 3620 CD ARG B 116 -10.324 17.929 8.796 1.00 61.21 C ATOM 3621 NE ARG B 116 -9.620 17.806 10.085 1.00 73.24 N ATOM 3622 CZ ARG B 116 -9.352 18.817 10.929 1.00 60.33 C ATOM 3623 NH1 ARG B 116 -9.724 20.066 10.648 1.00 75.54 N ATOM 3624 NH2 ARG B 116 -8.716 18.563 12.061 1.00 5.40 N ATOM 0 H ARG B 116 -7.862 15.594 5.524 1.00 3.15 H new ATOM 0 HA ARG B 116 -10.010 15.026 5.777 1.00 72.02 H new ATOM 0 HB2 ARG B 116 -10.410 18.020 6.036 1.00 44.43 H new ATOM 0 HB3 ARG B 116 -11.564 16.793 6.519 1.00 44.43 H new ATOM 0 HG2 ARG B 116 -9.975 15.897 8.188 1.00 13.55 H new ATOM 0 HG3 ARG B 116 -8.741 17.023 7.659 1.00 13.55 H new ATOM 0 HD2 ARG B 116 -10.183 18.933 8.396 1.00 61.21 H new ATOM 0 HD3 ARG B 116 -11.395 17.795 8.949 1.00 61.21 H new ATOM 0 HE ARG B 116 -9.310 16.874 10.360 1.00 73.24 H new ATOM 0 HH11 ARG B 116 -10.221 20.267 9.780 1.00 75.54 H new ATOM 0 HH12 ARG B 116 -9.512 20.820 11.301 1.00 75.54 H new ATOM 0 HH21 ARG B 116 -8.435 17.608 12.285 1.00 5.40 H new ATOM 0 HH22 ARG B 116 -8.507 19.322 12.710 1.00 5.40 H new ATOM 3638 N GLY B 117 -10.358 15.009 3.194 1.00 15.13 N ATOM 3639 CA GLY B 117 -10.974 14.836 1.877 1.00 75.04 C ATOM 3640 C GLY B 117 -12.291 14.060 1.944 1.00 31.44 C ATOM 3641 O GLY B 117 -13.192 14.317 1.122 1.00 52.21 O ATOM 3642 OXT GLY B 117 -12.431 13.178 2.822 1.00 37.57 O ATOM 0 H GLY B 117 -9.668 14.294 3.423 1.00 15.13 H new ATOM 0 HA2 GLY B 117 -11.155 15.815 1.433 1.00 75.04 H new ATOM 0 HA3 GLY B 117 -10.280 14.311 1.221 1.00 75.04 H new TER 3646 GLY B 117