USER MOD reduce.3.24.130724 H: found=0, std=0, add=1732, rem=0, adj=57 USER MOD reduce.3.24.130724 removed 1738 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+ -132:sc= 1.85 (180deg=-0.0427) USER MOD Set 1.2: A 108 CYS SG : rot 82:sc= 1.58 USER MOD Set 1.3: B 96 ASN : amide:sc= -2.51! K(o=0.91!,f=-0.66) USER MOD Set 2.1: B 62 HIS : no HD1:sc= -0.387 X(o=-0.44,f=-0.067) USER MOD Set 2.2: B 63 GLN : amide:sc= -0.052 X(o=-0.44,f=-0.067) USER MOD Set 3.1: B 47 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: B 49 THR OG1 : rot 180:sc=-0.00573 USER MOD Set 4.1: A 96 ASN : amide:sc= -1.98 K(o=1.3,f=-0.31) USER MOD Set 4.2: B 101 LYS NZ :NH3+ -126:sc= 1.71 (180deg=0.0323) USER MOD Set 4.3: B 108 CYS SG : rot 81:sc= 1.58 USER MOD Set 5.1: A 62 HIS : no HD1:sc= -0.509 X(o=-0.56,f=-0.12) USER MOD Set 5.2: A 63 GLN : amide:sc= -0.0502 X(o=-0.56,f=-0.12) USER MOD Set 6.1: A 47 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 49 THR OG1 : rot 180:sc=-0.00103 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 48:sc= -0.0821 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -169:sc= -0.003 (180deg=-0.109) USER MOD Single : A 22 CYS SG : rot 30:sc= 0.734 USER MOD Single : A 23 MET CE :methyl -175:sc= -0.641 (180deg=-0.715) USER MOD Single : A 24 SER OG : rot -150:sc= -0.0644 USER MOD Single : A 26 THR OG1 : rot 179:sc= 0.637 USER MOD Single : A 28 LYS NZ :NH3+ 174:sc= 0.278 (180deg=0.179) USER MOD Single : A 29 ASN : amide:sc= -0.948 X(o=-0.95,f=-0.89) USER MOD Single : A 30 MET CE :methyl -164:sc= -1.37 (180deg=-2.38) USER MOD Single : A 37 SER OG : rot 52:sc= 0.0513 USER MOD Single : A 39 SER OG : rot 180:sc= 0.00195 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot -150:sc= 0.218 USER MOD Single : A 53 LYS NZ :NH3+ -165:sc= 1.04 (180deg=0.731) USER MOD Single : A 57 TYR OH : rot 15:sc= -1.24 USER MOD Single : A 58 CYS SG : rot 70:sc= -6.56! USER MOD Single : A 60 HIS : no HD1:sc=-0.00441 X(o=-0.0044,f=-0.35) USER MOD Single : A 61 HIS : no HE2:sc= 1.06 K(o=1.1,f=-4.8!) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 TYR OH : rot 50:sc= 0.365 USER MOD Single : A 81 CYS SG : rot 79:sc= -0.736 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -0.177 K(o=-0.18,f=-3.1!) USER MOD Single : A 87 THR OG1 : rot 171:sc= -0.528 USER MOD Single : A 97 TYR OH : rot 180:sc= -0.635 USER MOD Single : A 107 THR OG1 : rot 74:sc= 1.08 USER MOD Single : A 109 LYS NZ :NH3+ -141:sc= 0.46 (180deg=-0.47) USER MOD Single : A 110 THR OG1 : rot 63:sc= 0.819 USER MOD Single : A 113 ASN : amide:sc= -0.0641 X(o=-0.064,f=-0.51) USER MOD Single : A 114 MET CE :methyl -137:sc= -1.55 (180deg=-2.9!) USER MOD Single : B 2 SER OG : rot 27:sc= 0.0973 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot 48:sc= -0.0505 USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.107) USER MOD Single : B 22 CYS SG : rot 60:sc= 0.862 USER MOD Single : B 23 MET CE :methyl -175:sc= -0.668 (180deg=-0.724) USER MOD Single : B 24 SER OG : rot -150:sc= -0.0633 USER MOD Single : B 26 THR OG1 : rot 177:sc= 0.452 USER MOD Single : B 28 LYS NZ :NH3+ 173:sc= 0.196 (180deg=0.151) USER MOD Single : B 29 ASN : amide:sc= -0.945 X(o=-0.95,f=-0.9) USER MOD Single : B 30 MET CE :methyl -167:sc= -1.54 (180deg=-2.45) USER MOD Single : B 37 SER OG : rot 49:sc= 0.0973 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 48 SER OG : rot -152:sc= 0.189 USER MOD Single : B 53 LYS NZ :NH3+ -165:sc= 1.03 (180deg=0.621) USER MOD Single : B 57 TYR OH : rot 31:sc= -1.13 USER MOD Single : B 58 CYS SG : rot 74:sc= -6.57! USER MOD Single : B 60 HIS : no HD1:sc= 0.00181 X(o=0.0018,f=-0.31) USER MOD Single : B 61 HIS : no HE2:sc= 1.01 K(o=1,f=-4.8!) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 76 TYR OH : rot 51:sc= 0.756 USER MOD Single : B 81 CYS SG : rot 78:sc= -0.772 USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 85 GLN : amide:sc= -0.157 K(o=-0.16,f=-3.1!) USER MOD Single : B 87 THR OG1 : rot 180:sc= -0.525 USER MOD Single : B 97 TYR OH : rot 180:sc= -0.371 USER MOD Single : B 107 THR OG1 : rot 74:sc= 1.1 USER MOD Single : B 109 LYS NZ :NH3+ -139:sc= 0.493 (180deg=-0.494) USER MOD Single : B 110 THR OG1 : rot 62:sc= 0.824 USER MOD Single : B 113 ASN : amide:sc= -0.0496 X(o=-0.05,f=-0.55) USER MOD Single : B 114 MET CE :methyl -132:sc= -1.69 (180deg=-3.01!) USER MOD ----------------------------------------------------------------- ATOM 14 N LEU A 3 -16.365 -13.434 -13.026 1.00 0.51 N ATOM 15 CA LEU A 3 -16.488 -11.987 -12.795 1.00 25.21 C ATOM 16 C LEU A 3 -16.951 -11.739 -11.349 1.00 52.52 C ATOM 17 O LEU A 3 -18.064 -12.132 -10.970 1.00 12.42 O ATOM 18 CB LEU A 3 -17.509 -11.386 -13.806 1.00 0.13 C ATOM 19 CG LEU A 3 -17.192 -11.633 -15.319 1.00 12.51 C ATOM 20 CD1 LEU A 3 -18.374 -11.210 -16.218 1.00 4.43 C ATOM 21 CD2 LEU A 3 -15.886 -10.920 -15.742 1.00 31.31 C ATOM 0 HA LEU A 3 -15.522 -11.504 -12.943 1.00 25.21 H new ATOM 0 HB2 LEU A 3 -18.494 -11.799 -13.588 1.00 0.13 H new ATOM 0 HB3 LEU A 3 -17.569 -10.311 -13.637 1.00 0.13 H new ATOM 0 HG LEU A 3 -17.043 -12.705 -15.452 1.00 12.51 H new ATOM 0 HD11 LEU A 3 -18.121 -11.395 -17.262 1.00 4.43 H new ATOM 0 HD12 LEU A 3 -19.259 -11.788 -15.951 1.00 4.43 H new ATOM 0 HD13 LEU A 3 -18.577 -10.149 -16.076 1.00 4.43 H new ATOM 0 HD21 LEU A 3 -15.693 -11.110 -16.798 1.00 31.31 H new ATOM 0 HD22 LEU A 3 -15.988 -9.847 -15.580 1.00 31.31 H new ATOM 0 HD23 LEU A 3 -15.055 -11.299 -15.147 1.00 31.31 H new ATOM 33 N VAL A 4 -16.092 -11.095 -10.549 1.00 53.25 N ATOM 34 CA VAL A 4 -16.436 -10.661 -9.191 1.00 4.12 C ATOM 35 C VAL A 4 -17.094 -9.264 -9.263 1.00 52.23 C ATOM 36 O VAL A 4 -16.452 -8.260 -9.593 1.00 51.33 O ATOM 37 CB VAL A 4 -15.181 -10.706 -8.220 1.00 74.05 C ATOM 38 CG1 VAL A 4 -14.753 -12.175 -7.960 1.00 42.42 C ATOM 39 CG2 VAL A 4 -13.984 -9.884 -8.765 1.00 41.15 C ATOM 0 H VAL A 4 -15.139 -10.861 -10.826 1.00 53.25 H new ATOM 0 HA VAL A 4 -17.155 -11.356 -8.758 1.00 4.12 H new ATOM 0 HB VAL A 4 -15.485 -10.247 -7.279 1.00 74.05 H new ATOM 0 HG11 VAL A 4 -13.891 -12.190 -7.293 1.00 42.42 H new ATOM 0 HG12 VAL A 4 -15.578 -12.718 -7.500 1.00 42.42 H new ATOM 0 HG13 VAL A 4 -14.488 -12.650 -8.905 1.00 42.42 H new ATOM 0 HG21 VAL A 4 -13.151 -9.946 -8.065 1.00 41.15 H new ATOM 0 HG22 VAL A 4 -13.677 -10.285 -9.731 1.00 41.15 H new ATOM 0 HG23 VAL A 4 -14.282 -8.842 -8.883 1.00 41.15 H new ATOM 49 N LYS A 5 -18.412 -9.247 -9.031 1.00 41.33 N ATOM 50 CA LYS A 5 -19.238 -8.035 -9.111 1.00 15.44 C ATOM 51 C LYS A 5 -19.004 -7.157 -7.870 1.00 24.11 C ATOM 52 O LYS A 5 -19.401 -7.524 -6.760 1.00 24.13 O ATOM 53 CB LYS A 5 -20.727 -8.434 -9.231 1.00 14.42 C ATOM 54 CG LYS A 5 -21.051 -9.368 -10.418 1.00 21.24 C ATOM 55 CD LYS A 5 -22.562 -9.676 -10.539 1.00 51.51 C ATOM 56 CE LYS A 5 -22.878 -10.581 -11.742 1.00 21.42 C ATOM 57 NZ LYS A 5 -24.340 -10.815 -11.891 1.00 13.12 N ATOM 0 H LYS A 5 -18.941 -10.082 -8.780 1.00 41.33 H new ATOM 0 HA LYS A 5 -18.958 -7.459 -9.993 1.00 15.44 H new ATOM 0 HB2 LYS A 5 -21.034 -8.924 -8.307 1.00 14.42 H new ATOM 0 HB3 LYS A 5 -21.325 -7.528 -9.325 1.00 14.42 H new ATOM 0 HG2 LYS A 5 -20.703 -8.908 -11.343 1.00 21.24 H new ATOM 0 HG3 LYS A 5 -20.502 -10.302 -10.300 1.00 21.24 H new ATOM 0 HD2 LYS A 5 -22.907 -10.158 -9.624 1.00 51.51 H new ATOM 0 HD3 LYS A 5 -23.115 -8.741 -10.635 1.00 51.51 H new ATOM 0 HE2 LYS A 5 -22.489 -10.124 -12.652 1.00 21.42 H new ATOM 0 HE3 LYS A 5 -22.368 -11.537 -11.621 1.00 21.42 H new ATOM 0 HZ1 LYS A 5 -24.511 -11.429 -12.713 1.00 13.12 H new ATOM 0 HZ2 LYS A 5 -24.707 -11.274 -11.033 1.00 13.12 H new ATOM 0 HZ3 LYS A 5 -24.825 -9.906 -12.032 1.00 13.12 H new ATOM 71 N LEU A 6 -18.317 -6.026 -8.068 1.00 5.52 N ATOM 72 CA LEU A 6 -17.975 -5.089 -6.995 1.00 75.15 C ATOM 73 C LEU A 6 -18.943 -3.901 -7.009 1.00 24.12 C ATOM 74 O LEU A 6 -18.732 -2.932 -7.752 1.00 25.22 O ATOM 75 CB LEU A 6 -16.507 -4.588 -7.149 1.00 31.24 C ATOM 76 CG LEU A 6 -15.398 -5.683 -7.217 1.00 33.13 C ATOM 77 CD1 LEU A 6 -13.999 -5.038 -7.332 1.00 23.41 C ATOM 78 CD2 LEU A 6 -15.470 -6.648 -6.014 1.00 15.24 C ATOM 0 H LEU A 6 -17.981 -5.734 -8.986 1.00 5.52 H new ATOM 0 HA LEU A 6 -18.062 -5.608 -6.041 1.00 75.15 H new ATOM 0 HB2 LEU A 6 -16.446 -3.985 -8.055 1.00 31.24 H new ATOM 0 HB3 LEU A 6 -16.283 -3.928 -6.311 1.00 31.24 H new ATOM 0 HG LEU A 6 -15.576 -6.276 -8.114 1.00 33.13 H new ATOM 0 HD11 LEU A 6 -13.241 -5.820 -7.378 1.00 23.41 H new ATOM 0 HD12 LEU A 6 -13.951 -4.432 -8.237 1.00 23.41 H new ATOM 0 HD13 LEU A 6 -13.817 -4.407 -6.462 1.00 23.41 H new ATOM 0 HD21 LEU A 6 -14.681 -7.395 -6.099 1.00 15.24 H new ATOM 0 HD22 LEU A 6 -15.340 -6.087 -5.089 1.00 15.24 H new ATOM 0 HD23 LEU A 6 -16.440 -7.145 -6.003 1.00 15.24 H new ATOM 90 N GLU A 7 -20.032 -3.999 -6.227 1.00 40.11 N ATOM 91 CA GLU A 7 -20.922 -2.856 -5.994 1.00 70.42 C ATOM 92 C GLU A 7 -20.186 -1.823 -5.145 1.00 43.44 C ATOM 93 O GLU A 7 -19.946 -2.061 -3.963 1.00 33.41 O ATOM 94 CB GLU A 7 -22.253 -3.252 -5.295 1.00 65.43 C ATOM 95 CG GLU A 7 -23.212 -4.079 -6.155 1.00 52.03 C ATOM 96 CD GLU A 7 -22.804 -5.553 -6.271 1.00 73.12 C ATOM 97 OE1 GLU A 7 -23.089 -6.319 -5.331 1.00 75.33 O ATOM 98 OE2 GLU A 7 -22.205 -5.947 -7.299 1.00 11.31 O ATOM 0 H GLU A 7 -20.313 -4.855 -5.749 1.00 40.11 H new ATOM 0 HA GLU A 7 -21.189 -2.446 -6.968 1.00 70.42 H new ATOM 0 HB2 GLU A 7 -22.018 -3.817 -4.393 1.00 65.43 H new ATOM 0 HB3 GLU A 7 -22.764 -2.343 -4.978 1.00 65.43 H new ATOM 0 HG2 GLU A 7 -24.214 -4.019 -5.730 1.00 52.03 H new ATOM 0 HG3 GLU A 7 -23.262 -3.643 -7.153 1.00 52.03 H new ATOM 105 N SER A 8 -19.818 -0.699 -5.760 1.00 43.45 N ATOM 106 CA SER A 8 -19.177 0.425 -5.068 1.00 13.13 C ATOM 107 C SER A 8 -20.107 1.021 -3.981 1.00 42.43 C ATOM 108 O SER A 8 -21.232 0.552 -3.769 1.00 74.20 O ATOM 109 CB SER A 8 -18.794 1.497 -6.113 1.00 15.10 C ATOM 110 OG SER A 8 -19.927 1.884 -6.879 1.00 44.10 O ATOM 0 H SER A 8 -19.956 -0.539 -6.758 1.00 43.45 H new ATOM 0 HA SER A 8 -18.280 0.070 -4.561 1.00 13.13 H new ATOM 0 HB2 SER A 8 -18.375 2.368 -5.610 1.00 15.10 H new ATOM 0 HB3 SER A 8 -18.019 1.107 -6.773 1.00 15.10 H new ATOM 0 HG SER A 8 -20.679 2.071 -6.279 1.00 44.10 H new ATOM 116 N SER A 9 -19.627 2.064 -3.301 1.00 3.30 N ATOM 117 CA SER A 9 -20.421 2.814 -2.314 1.00 72.31 C ATOM 118 C SER A 9 -21.582 3.575 -3.010 1.00 13.31 C ATOM 119 O SER A 9 -22.541 4.002 -2.357 1.00 64.12 O ATOM 120 CB SER A 9 -19.492 3.777 -1.539 1.00 12.21 C ATOM 121 OG SER A 9 -20.155 4.343 -0.426 1.00 62.31 O ATOM 0 H SER A 9 -18.677 2.416 -3.416 1.00 3.30 H new ATOM 0 HA SER A 9 -20.872 2.121 -1.604 1.00 72.31 H new ATOM 0 HB2 SER A 9 -18.606 3.239 -1.203 1.00 12.21 H new ATOM 0 HB3 SER A 9 -19.150 4.570 -2.204 1.00 12.21 H new ATOM 0 HG SER A 9 -19.544 4.946 0.047 1.00 62.31 H new ATOM 127 N ASP A 10 -21.470 3.731 -4.347 1.00 55.50 N ATOM 128 CA ASP A 10 -22.504 4.341 -5.211 1.00 4.11 C ATOM 129 C ASP A 10 -23.385 3.233 -5.868 1.00 13.21 C ATOM 130 O ASP A 10 -24.203 3.509 -6.757 1.00 41.43 O ATOM 131 CB ASP A 10 -21.773 5.215 -6.265 1.00 51.44 C ATOM 132 CG ASP A 10 -22.702 6.068 -7.149 1.00 32.11 C ATOM 133 OD1 ASP A 10 -23.367 6.981 -6.617 1.00 5.54 O ATOM 134 OD2 ASP A 10 -22.749 5.847 -8.378 1.00 51.44 O ATOM 0 H ASP A 10 -20.644 3.431 -4.865 1.00 55.50 H new ATOM 0 HA ASP A 10 -23.183 4.968 -4.633 1.00 4.11 H new ATOM 0 HB2 ASP A 10 -21.077 5.876 -5.749 1.00 51.44 H new ATOM 0 HB3 ASP A 10 -21.179 4.565 -6.907 1.00 51.44 H new ATOM 139 N GLU A 11 -23.178 1.967 -5.416 1.00 32.05 N ATOM 140 CA GLU A 11 -23.960 0.765 -5.806 1.00 14.01 C ATOM 141 C GLU A 11 -23.743 0.341 -7.276 1.00 31.40 C ATOM 142 O GLU A 11 -24.443 -0.552 -7.768 1.00 11.31 O ATOM 143 CB GLU A 11 -25.475 0.945 -5.494 1.00 43.14 C ATOM 144 CG GLU A 11 -25.805 1.160 -4.004 1.00 52.43 C ATOM 145 CD GLU A 11 -27.315 1.305 -3.744 1.00 43.14 C ATOM 146 OE1 GLU A 11 -27.840 2.435 -3.832 1.00 51.12 O ATOM 147 OE2 GLU A 11 -27.987 0.291 -3.467 1.00 4.20 O ATOM 0 H GLU A 11 -22.438 1.749 -4.749 1.00 32.05 H new ATOM 0 HA GLU A 11 -23.576 -0.050 -5.193 1.00 14.01 H new ATOM 0 HB2 GLU A 11 -25.850 1.797 -6.062 1.00 43.14 H new ATOM 0 HB3 GLU A 11 -26.012 0.065 -5.848 1.00 43.14 H new ATOM 0 HG2 GLU A 11 -25.420 0.320 -3.426 1.00 52.43 H new ATOM 0 HG3 GLU A 11 -25.292 2.053 -3.648 1.00 52.43 H new ATOM 154 N LYS A 12 -22.755 0.952 -7.960 1.00 63.43 N ATOM 155 CA LYS A 12 -22.424 0.597 -9.352 1.00 73.34 C ATOM 156 C LYS A 12 -21.713 -0.763 -9.382 1.00 55.32 C ATOM 157 O LYS A 12 -20.678 -0.936 -8.732 1.00 64.32 O ATOM 158 CB LYS A 12 -21.539 1.695 -10.007 1.00 20.32 C ATOM 159 CG LYS A 12 -22.212 3.083 -10.205 1.00 4.40 C ATOM 160 CD LYS A 12 -23.160 3.191 -11.434 1.00 61.42 C ATOM 161 CE LYS A 12 -24.540 2.537 -11.234 1.00 52.32 C ATOM 162 NZ LYS A 12 -25.410 2.731 -12.421 1.00 44.45 N ATOM 0 H LYS A 12 -22.173 1.693 -7.570 1.00 63.43 H new ATOM 0 HA LYS A 12 -23.347 0.527 -9.927 1.00 73.34 H new ATOM 0 HB2 LYS A 12 -20.648 1.829 -9.394 1.00 20.32 H new ATOM 0 HB3 LYS A 12 -21.205 1.333 -10.979 1.00 20.32 H new ATOM 0 HG2 LYS A 12 -22.779 3.325 -9.306 1.00 4.40 H new ATOM 0 HG3 LYS A 12 -21.431 3.837 -10.302 1.00 4.40 H new ATOM 0 HD2 LYS A 12 -23.303 4.244 -11.676 1.00 61.42 H new ATOM 0 HD3 LYS A 12 -22.674 2.729 -12.294 1.00 61.42 H new ATOM 0 HE2 LYS A 12 -24.415 1.471 -11.044 1.00 52.32 H new ATOM 0 HE3 LYS A 12 -25.022 2.964 -10.354 1.00 52.32 H new ATOM 0 HZ1 LYS A 12 -26.331 2.279 -12.254 1.00 44.45 H new ATOM 0 HZ2 LYS A 12 -25.549 3.748 -12.587 1.00 44.45 H new ATOM 0 HZ3 LYS A 12 -24.960 2.302 -13.255 1.00 44.45 H new ATOM 176 N VAL A 13 -22.293 -1.707 -10.134 1.00 54.04 N ATOM 177 CA VAL A 13 -21.821 -3.094 -10.217 1.00 21.32 C ATOM 178 C VAL A 13 -20.644 -3.186 -11.207 1.00 62.04 C ATOM 179 O VAL A 13 -20.850 -3.138 -12.425 1.00 75.21 O ATOM 180 CB VAL A 13 -22.995 -4.050 -10.670 1.00 53.42 C ATOM 181 CG1 VAL A 13 -22.564 -5.532 -10.664 1.00 41.12 C ATOM 182 CG2 VAL A 13 -24.251 -3.824 -9.793 1.00 40.01 C ATOM 0 H VAL A 13 -23.115 -1.526 -10.710 1.00 54.04 H new ATOM 0 HA VAL A 13 -21.481 -3.411 -9.231 1.00 21.32 H new ATOM 0 HB VAL A 13 -23.249 -3.798 -11.700 1.00 53.42 H new ATOM 0 HG11 VAL A 13 -23.400 -6.155 -10.982 1.00 41.12 H new ATOM 0 HG12 VAL A 13 -21.727 -5.670 -11.349 1.00 41.12 H new ATOM 0 HG13 VAL A 13 -22.260 -5.818 -9.657 1.00 41.12 H new ATOM 0 HG21 VAL A 13 -25.048 -4.491 -10.120 1.00 40.01 H new ATOM 0 HG22 VAL A 13 -24.009 -4.032 -8.751 1.00 40.01 H new ATOM 0 HG23 VAL A 13 -24.581 -2.790 -9.890 1.00 40.01 H new ATOM 192 N PHE A 14 -19.416 -3.256 -10.670 1.00 23.40 N ATOM 193 CA PHE A 14 -18.187 -3.427 -11.463 1.00 71.24 C ATOM 194 C PHE A 14 -17.843 -4.921 -11.559 1.00 11.41 C ATOM 195 O PHE A 14 -17.136 -5.466 -10.705 1.00 12.10 O ATOM 196 CB PHE A 14 -17.018 -2.620 -10.832 1.00 20.22 C ATOM 197 CG PHE A 14 -17.237 -1.111 -10.852 1.00 32.11 C ATOM 198 CD1 PHE A 14 -17.028 -0.382 -12.022 1.00 33.23 C ATOM 199 CD2 PHE A 14 -17.656 -0.419 -9.714 1.00 0.52 C ATOM 200 CE1 PHE A 14 -17.233 0.982 -12.050 1.00 2.14 C ATOM 201 CE2 PHE A 14 -17.857 0.947 -9.747 1.00 73.31 C ATOM 202 CZ PHE A 14 -17.645 1.644 -10.913 1.00 72.54 C ATOM 0 H PHE A 14 -19.246 -3.195 -9.666 1.00 23.40 H new ATOM 0 HA PHE A 14 -18.348 -3.042 -12.470 1.00 71.24 H new ATOM 0 HB2 PHE A 14 -16.878 -2.945 -9.801 1.00 20.22 H new ATOM 0 HB3 PHE A 14 -16.097 -2.852 -11.367 1.00 20.22 H new ATOM 0 HD1 PHE A 14 -16.702 -0.891 -12.917 1.00 33.23 H new ATOM 0 HD2 PHE A 14 -17.825 -0.960 -8.795 1.00 0.52 H new ATOM 0 HE1 PHE A 14 -17.070 1.533 -12.965 1.00 2.14 H new ATOM 0 HE2 PHE A 14 -18.180 1.467 -8.858 1.00 73.31 H new ATOM 0 HZ PHE A 14 -17.802 2.712 -10.938 1.00 72.54 H new ATOM 212 N GLU A 15 -18.398 -5.576 -12.592 1.00 3.21 N ATOM 213 CA GLU A 15 -18.199 -7.014 -12.847 1.00 32.14 C ATOM 214 C GLU A 15 -16.800 -7.228 -13.460 1.00 11.00 C ATOM 215 O GLU A 15 -16.651 -7.394 -14.683 1.00 14.50 O ATOM 216 CB GLU A 15 -19.319 -7.553 -13.792 1.00 23.21 C ATOM 217 CG GLU A 15 -20.748 -7.098 -13.423 1.00 0.13 C ATOM 218 CD GLU A 15 -21.813 -7.485 -14.466 1.00 41.13 C ATOM 219 OE1 GLU A 15 -21.731 -6.997 -15.616 1.00 13.11 O ATOM 220 OE2 GLU A 15 -22.744 -8.256 -14.144 1.00 23.13 O ATOM 0 H GLU A 15 -19.001 -5.121 -13.278 1.00 3.21 H new ATOM 0 HA GLU A 15 -18.261 -7.569 -11.911 1.00 32.14 H new ATOM 0 HB2 GLU A 15 -19.102 -7.232 -14.811 1.00 23.21 H new ATOM 0 HB3 GLU A 15 -19.286 -8.643 -13.787 1.00 23.21 H new ATOM 0 HG2 GLU A 15 -21.020 -7.532 -12.461 1.00 0.13 H new ATOM 0 HG3 GLU A 15 -20.753 -6.015 -13.297 1.00 0.13 H new ATOM 227 N ILE A 16 -15.778 -7.152 -12.599 1.00 4.11 N ATOM 228 CA ILE A 16 -14.366 -7.236 -13.005 1.00 23.15 C ATOM 229 C ILE A 16 -13.897 -8.695 -12.915 1.00 21.14 C ATOM 230 O ILE A 16 -14.396 -9.459 -12.088 1.00 23.53 O ATOM 231 CB ILE A 16 -13.459 -6.288 -12.117 1.00 25.13 C ATOM 232 CG1 ILE A 16 -11.982 -6.266 -12.637 1.00 41.03 C ATOM 233 CG2 ILE A 16 -13.525 -6.673 -10.616 1.00 31.24 C ATOM 234 CD1 ILE A 16 -11.041 -5.369 -11.857 1.00 60.12 C ATOM 0 H ILE A 16 -15.906 -7.030 -11.594 1.00 4.11 H new ATOM 0 HA ILE A 16 -14.272 -6.896 -14.036 1.00 23.15 H new ATOM 0 HB ILE A 16 -13.857 -5.277 -12.208 1.00 25.13 H new ATOM 0 HG12 ILE A 16 -11.590 -7.283 -12.617 1.00 41.03 H new ATOM 0 HG13 ILE A 16 -11.984 -5.946 -13.679 1.00 41.03 H new ATOM 0 HG21 ILE A 16 -12.890 -6.000 -10.040 1.00 31.24 H new ATOM 0 HG22 ILE A 16 -14.553 -6.592 -10.264 1.00 31.24 H new ATOM 0 HG23 ILE A 16 -13.178 -7.698 -10.488 1.00 31.24 H new ATOM 0 HD11 ILE A 16 -10.043 -5.422 -12.293 1.00 60.12 H new ATOM 0 HD12 ILE A 16 -11.401 -4.341 -11.898 1.00 60.12 H new ATOM 0 HD13 ILE A 16 -11.001 -5.699 -10.819 1.00 60.12 H new ATOM 246 N GLU A 17 -12.953 -9.067 -13.786 1.00 31.45 N ATOM 247 CA GLU A 17 -12.406 -10.430 -13.851 1.00 41.11 C ATOM 248 C GLU A 17 -11.598 -10.735 -12.573 1.00 5.35 C ATOM 249 O GLU A 17 -10.802 -9.903 -12.113 1.00 31.40 O ATOM 250 CB GLU A 17 -11.541 -10.580 -15.130 1.00 41.31 C ATOM 251 CG GLU A 17 -12.269 -10.133 -16.423 1.00 11.21 C ATOM 252 CD GLU A 17 -11.374 -10.108 -17.665 1.00 42.10 C ATOM 253 OE1 GLU A 17 -10.502 -9.222 -17.756 1.00 34.30 O ATOM 254 OE2 GLU A 17 -11.539 -10.952 -18.571 1.00 52.32 O ATOM 0 H GLU A 17 -12.544 -8.430 -14.469 1.00 31.45 H new ATOM 0 HA GLU A 17 -13.218 -11.155 -13.906 1.00 41.11 H new ATOM 0 HB2 GLU A 17 -10.630 -9.993 -15.014 1.00 41.31 H new ATOM 0 HB3 GLU A 17 -11.238 -11.622 -15.234 1.00 41.31 H new ATOM 0 HG2 GLU A 17 -13.108 -10.804 -16.606 1.00 11.21 H new ATOM 0 HG3 GLU A 17 -12.685 -9.138 -16.268 1.00 11.21 H new ATOM 261 N LYS A 18 -11.829 -11.934 -12.031 1.00 14.41 N ATOM 262 CA LYS A 18 -11.281 -12.392 -10.742 1.00 31.25 C ATOM 263 C LYS A 18 -9.736 -12.479 -10.774 1.00 63.22 C ATOM 264 O LYS A 18 -9.081 -12.239 -9.754 1.00 12.23 O ATOM 265 CB LYS A 18 -11.938 -13.754 -10.385 1.00 33.34 C ATOM 266 CG LYS A 18 -11.412 -14.434 -9.102 1.00 4.41 C ATOM 267 CD LYS A 18 -12.242 -15.683 -8.723 1.00 11.33 C ATOM 268 CE LYS A 18 -11.624 -16.479 -7.571 1.00 1.04 C ATOM 269 NZ LYS A 18 -10.328 -17.098 -7.951 1.00 2.24 N ATOM 0 H LYS A 18 -12.416 -12.634 -12.484 1.00 14.41 H new ATOM 0 HA LYS A 18 -11.519 -11.666 -9.965 1.00 31.25 H new ATOM 0 HB2 LYS A 18 -13.012 -13.602 -10.280 1.00 33.34 H new ATOM 0 HB3 LYS A 18 -11.793 -14.437 -11.222 1.00 33.34 H new ATOM 0 HG2 LYS A 18 -10.370 -14.721 -9.246 1.00 4.41 H new ATOM 0 HG3 LYS A 18 -11.435 -13.720 -8.278 1.00 4.41 H new ATOM 0 HD2 LYS A 18 -13.250 -15.373 -8.445 1.00 11.33 H new ATOM 0 HD3 LYS A 18 -12.336 -16.329 -9.596 1.00 11.33 H new ATOM 0 HE2 LYS A 18 -11.474 -15.820 -6.716 1.00 1.04 H new ATOM 0 HE3 LYS A 18 -12.318 -17.258 -7.256 1.00 1.04 H new ATOM 0 HZ1 LYS A 18 -10.037 -17.773 -7.216 1.00 2.24 H new ATOM 0 HZ2 LYS A 18 -10.434 -17.597 -8.857 1.00 2.24 H new ATOM 0 HZ3 LYS A 18 -9.604 -16.357 -8.047 1.00 2.24 H new ATOM 283 N GLU A 19 -9.175 -12.786 -11.967 1.00 62.45 N ATOM 284 CA GLU A 19 -7.710 -12.842 -12.195 1.00 74.14 C ATOM 285 C GLU A 19 -7.031 -11.476 -11.916 1.00 35.00 C ATOM 286 O GLU A 19 -5.873 -11.415 -11.489 1.00 1.21 O ATOM 287 CB GLU A 19 -7.390 -13.261 -13.649 1.00 20.34 C ATOM 288 CG GLU A 19 -7.966 -14.611 -14.106 1.00 32.22 C ATOM 289 CD GLU A 19 -7.451 -15.032 -15.494 1.00 40.55 C ATOM 290 OE1 GLU A 19 -7.392 -14.177 -16.402 1.00 44.23 O ATOM 291 OE2 GLU A 19 -7.092 -16.213 -15.689 1.00 64.40 O ATOM 0 H GLU A 19 -9.724 -13.002 -12.799 1.00 62.45 H new ATOM 0 HA GLU A 19 -7.317 -13.584 -11.500 1.00 74.14 H new ATOM 0 HB2 GLU A 19 -7.761 -12.485 -14.319 1.00 20.34 H new ATOM 0 HB3 GLU A 19 -6.307 -13.293 -13.766 1.00 20.34 H new ATOM 0 HG2 GLU A 19 -7.706 -15.379 -13.377 1.00 32.22 H new ATOM 0 HG3 GLU A 19 -9.054 -14.549 -14.129 1.00 32.22 H new ATOM 298 N ILE A 20 -7.776 -10.398 -12.191 1.00 74.51 N ATOM 299 CA ILE A 20 -7.325 -9.014 -11.961 1.00 3.40 C ATOM 300 C ILE A 20 -7.408 -8.693 -10.455 1.00 3.42 C ATOM 301 O ILE A 20 -6.494 -8.095 -9.875 1.00 75.44 O ATOM 302 CB ILE A 20 -8.218 -8.002 -12.767 1.00 24.33 C ATOM 303 CG1 ILE A 20 -8.349 -8.427 -14.264 1.00 13.01 C ATOM 304 CG2 ILE A 20 -7.665 -6.566 -12.649 1.00 62.14 C ATOM 305 CD1 ILE A 20 -9.360 -7.616 -15.049 1.00 51.13 C ATOM 0 H ILE A 20 -8.716 -10.459 -12.582 1.00 74.51 H new ATOM 0 HA ILE A 20 -6.295 -8.917 -12.303 1.00 3.40 H new ATOM 0 HB ILE A 20 -9.216 -8.019 -12.329 1.00 24.33 H new ATOM 0 HG12 ILE A 20 -7.374 -8.336 -14.743 1.00 13.01 H new ATOM 0 HG13 ILE A 20 -8.629 -9.479 -14.309 1.00 13.01 H new ATOM 0 HG21 ILE A 20 -8.300 -5.884 -13.215 1.00 62.14 H new ATOM 0 HG22 ILE A 20 -7.653 -6.266 -11.601 1.00 62.14 H new ATOM 0 HG23 ILE A 20 -6.651 -6.533 -13.047 1.00 62.14 H new ATOM 0 HD11 ILE A 20 -9.392 -7.972 -16.079 1.00 51.13 H new ATOM 0 HD12 ILE A 20 -10.345 -7.726 -14.596 1.00 51.13 H new ATOM 0 HD13 ILE A 20 -9.071 -6.565 -15.038 1.00 51.13 H new ATOM 317 N ALA A 21 -8.511 -9.159 -9.838 1.00 3.34 N ATOM 318 CA ALA A 21 -8.816 -8.953 -8.408 1.00 35.15 C ATOM 319 C ALA A 21 -7.919 -9.805 -7.477 1.00 54.35 C ATOM 320 O ALA A 21 -8.058 -9.747 -6.252 1.00 41.50 O ATOM 321 CB ALA A 21 -10.307 -9.255 -8.167 1.00 64.14 C ATOM 0 H ALA A 21 -9.226 -9.698 -10.326 1.00 3.34 H new ATOM 0 HA ALA A 21 -8.602 -7.913 -8.161 1.00 35.15 H new ATOM 0 HB1 ALA A 21 -10.543 -9.106 -7.113 1.00 64.14 H new ATOM 0 HB2 ALA A 21 -10.917 -8.585 -8.774 1.00 64.14 H new ATOM 0 HB3 ALA A 21 -10.518 -10.288 -8.443 1.00 64.14 H new ATOM 327 N CYS A 22 -7.021 -10.615 -8.074 1.00 43.11 N ATOM 328 CA CYS A 22 -5.980 -11.356 -7.335 1.00 60.40 C ATOM 329 C CYS A 22 -4.842 -10.416 -6.870 1.00 41.33 C ATOM 330 O CYS A 22 -4.199 -10.678 -5.847 1.00 24.20 O ATOM 331 CB CYS A 22 -5.415 -12.475 -8.227 1.00 44.01 C ATOM 332 SG CYS A 22 -6.669 -13.621 -8.832 1.00 51.03 S ATOM 0 H CYS A 22 -6.998 -10.773 -9.081 1.00 43.11 H new ATOM 0 HA CYS A 22 -6.433 -11.792 -6.445 1.00 60.40 H new ATOM 0 HB2 CYS A 22 -4.904 -12.026 -9.079 1.00 44.01 H new ATOM 0 HB3 CYS A 22 -4.666 -13.033 -7.665 1.00 44.01 H new ATOM 0 HG CYS A 22 -7.801 -12.995 -8.964 1.00 51.03 H new ATOM 338 N MET A 23 -4.595 -9.331 -7.648 1.00 4.41 N ATOM 339 CA MET A 23 -3.613 -8.280 -7.276 1.00 24.50 C ATOM 340 C MET A 23 -4.120 -7.495 -6.056 1.00 73.12 C ATOM 341 O MET A 23 -3.326 -6.977 -5.256 1.00 1.33 O ATOM 342 CB MET A 23 -3.343 -7.311 -8.458 1.00 44.44 C ATOM 343 CG MET A 23 -2.772 -7.972 -9.719 1.00 11.53 C ATOM 344 SD MET A 23 -2.228 -6.762 -10.950 1.00 45.14 S ATOM 345 CE MET A 23 -3.732 -5.829 -11.249 1.00 23.32 C ATOM 0 H MET A 23 -5.063 -9.161 -8.538 1.00 4.41 H new ATOM 0 HA MET A 23 -2.673 -8.772 -7.025 1.00 24.50 H new ATOM 0 HB2 MET A 23 -4.276 -6.811 -8.719 1.00 44.44 H new ATOM 0 HB3 MET A 23 -2.649 -6.539 -8.125 1.00 44.44 H new ATOM 0 HG2 MET A 23 -1.931 -8.608 -9.443 1.00 11.53 H new ATOM 0 HG3 MET A 23 -3.529 -8.619 -10.161 1.00 11.53 H new ATOM 0 HE1 MET A 23 -3.561 -5.111 -12.051 1.00 23.32 H new ATOM 0 HE2 MET A 23 -4.532 -6.511 -11.537 1.00 23.32 H new ATOM 0 HE3 MET A 23 -4.017 -5.298 -10.341 1.00 23.32 H new ATOM 355 N SER A 24 -5.452 -7.405 -5.949 1.00 23.24 N ATOM 356 CA SER A 24 -6.122 -6.963 -4.738 1.00 3.55 C ATOM 357 C SER A 24 -5.995 -8.055 -3.666 1.00 51.31 C ATOM 358 O SER A 24 -6.697 -9.068 -3.735 1.00 23.51 O ATOM 359 CB SER A 24 -7.612 -6.684 -5.013 1.00 71.20 C ATOM 360 OG SER A 24 -7.793 -5.617 -5.907 1.00 23.00 O ATOM 0 H SER A 24 -6.091 -7.640 -6.709 1.00 23.24 H new ATOM 0 HA SER A 24 -5.654 -6.041 -4.391 1.00 3.55 H new ATOM 0 HB2 SER A 24 -8.079 -7.581 -5.420 1.00 71.20 H new ATOM 0 HB3 SER A 24 -8.118 -6.459 -4.074 1.00 71.20 H new ATOM 0 HG SER A 24 -8.639 -5.164 -5.709 1.00 23.00 H new ATOM 366 N VAL A 25 -5.083 -7.854 -2.701 1.00 75.14 N ATOM 367 CA VAL A 25 -4.901 -8.790 -1.575 1.00 41.44 C ATOM 368 C VAL A 25 -6.165 -8.799 -0.687 1.00 22.02 C ATOM 369 O VAL A 25 -6.513 -9.837 -0.150 1.00 44.50 O ATOM 370 CB VAL A 25 -3.609 -8.473 -0.724 1.00 43.43 C ATOM 371 CG1 VAL A 25 -3.388 -9.510 0.414 1.00 34.51 C ATOM 372 CG2 VAL A 25 -2.358 -8.370 -1.639 1.00 32.05 C ATOM 0 H VAL A 25 -4.457 -7.049 -2.677 1.00 75.14 H new ATOM 0 HA VAL A 25 -4.753 -9.785 -1.996 1.00 41.44 H new ATOM 0 HB VAL A 25 -3.765 -7.506 -0.246 1.00 43.43 H new ATOM 0 HG11 VAL A 25 -2.488 -9.251 0.972 1.00 34.51 H new ATOM 0 HG12 VAL A 25 -4.247 -9.502 1.086 1.00 34.51 H new ATOM 0 HG13 VAL A 25 -3.274 -10.505 -0.017 1.00 34.51 H new ATOM 0 HG21 VAL A 25 -1.480 -8.151 -1.031 1.00 32.05 H new ATOM 0 HG22 VAL A 25 -2.211 -9.315 -2.162 1.00 32.05 H new ATOM 0 HG23 VAL A 25 -2.504 -7.572 -2.366 1.00 32.05 H new ATOM 382 N THR A 26 -6.878 -7.646 -0.597 1.00 40.41 N ATOM 383 CA THR A 26 -8.134 -7.541 0.187 1.00 54.33 C ATOM 384 C THR A 26 -9.235 -8.440 -0.410 1.00 3.20 C ATOM 385 O THR A 26 -9.840 -9.250 0.309 1.00 33.13 O ATOM 386 CB THR A 26 -8.654 -6.069 0.258 1.00 15.44 C ATOM 387 OG1 THR A 26 -7.664 -5.243 0.869 1.00 42.11 O ATOM 388 CG2 THR A 26 -9.978 -5.928 1.038 1.00 61.14 C ATOM 0 H THR A 26 -6.604 -6.778 -1.057 1.00 40.41 H new ATOM 0 HA THR A 26 -7.901 -7.876 1.198 1.00 54.33 H new ATOM 0 HB THR A 26 -8.849 -5.755 -0.768 1.00 15.44 H new ATOM 0 HG1 THR A 26 -7.984 -4.317 0.900 1.00 42.11 H new ATOM 0 HG21 THR A 26 -10.284 -4.882 1.050 1.00 61.14 H new ATOM 0 HG22 THR A 26 -10.750 -6.526 0.555 1.00 61.14 H new ATOM 0 HG23 THR A 26 -9.836 -6.276 2.061 1.00 61.14 H new ATOM 396 N ILE A 27 -9.453 -8.309 -1.740 1.00 11.34 N ATOM 397 CA ILE A 27 -10.486 -9.078 -2.450 1.00 51.03 C ATOM 398 C ILE A 27 -10.119 -10.570 -2.409 1.00 52.32 C ATOM 399 O ILE A 27 -10.974 -11.399 -2.100 1.00 53.41 O ATOM 400 CB ILE A 27 -10.708 -8.590 -3.933 1.00 62.33 C ATOM 401 CG1 ILE A 27 -11.136 -7.082 -3.953 1.00 24.42 C ATOM 402 CG2 ILE A 27 -11.759 -9.467 -4.671 1.00 35.44 C ATOM 403 CD1 ILE A 27 -11.330 -6.499 -5.344 1.00 12.42 C ATOM 0 H ILE A 27 -8.923 -7.675 -2.338 1.00 11.34 H new ATOM 0 HA ILE A 27 -11.435 -8.914 -1.939 1.00 51.03 H new ATOM 0 HB ILE A 27 -9.762 -8.694 -4.464 1.00 62.33 H new ATOM 0 HG12 ILE A 27 -12.066 -6.974 -3.395 1.00 24.42 H new ATOM 0 HG13 ILE A 27 -10.380 -6.496 -3.430 1.00 24.42 H new ATOM 0 HG21 ILE A 27 -11.887 -9.102 -5.690 1.00 35.44 H new ATOM 0 HG22 ILE A 27 -11.416 -10.501 -4.696 1.00 35.44 H new ATOM 0 HG23 ILE A 27 -12.712 -9.413 -4.144 1.00 35.44 H new ATOM 0 HD11 ILE A 27 -11.625 -5.453 -5.262 1.00 12.42 H new ATOM 0 HD12 ILE A 27 -10.396 -6.570 -5.902 1.00 12.42 H new ATOM 0 HD13 ILE A 27 -12.108 -7.056 -5.866 1.00 12.42 H new ATOM 415 N LYS A 28 -8.821 -10.864 -2.642 1.00 61.21 N ATOM 416 CA LYS A 28 -8.270 -12.225 -2.564 1.00 1.00 C ATOM 417 C LYS A 28 -8.564 -12.868 -1.189 1.00 61.15 C ATOM 418 O LYS A 28 -9.139 -13.944 -1.139 1.00 4.45 O ATOM 419 CB LYS A 28 -6.736 -12.237 -2.835 1.00 54.43 C ATOM 420 CG LYS A 28 -6.084 -13.619 -2.605 1.00 63.35 C ATOM 421 CD LYS A 28 -4.559 -13.641 -2.821 1.00 24.04 C ATOM 422 CE LYS A 28 -3.949 -14.990 -2.397 1.00 2.13 C ATOM 423 NZ LYS A 28 -4.604 -16.140 -3.083 1.00 20.14 N ATOM 0 H LYS A 28 -8.128 -10.158 -2.890 1.00 61.21 H new ATOM 0 HA LYS A 28 -8.761 -12.813 -3.339 1.00 1.00 H new ATOM 0 HB2 LYS A 28 -6.553 -11.924 -3.863 1.00 54.43 H new ATOM 0 HB3 LYS A 28 -6.254 -11.504 -2.188 1.00 54.43 H new ATOM 0 HG2 LYS A 28 -6.300 -13.946 -1.588 1.00 63.35 H new ATOM 0 HG3 LYS A 28 -6.545 -14.342 -3.277 1.00 63.35 H new ATOM 0 HD2 LYS A 28 -4.336 -13.454 -3.871 1.00 24.04 H new ATOM 0 HD3 LYS A 28 -4.098 -12.836 -2.249 1.00 24.04 H new ATOM 0 HE2 LYS A 28 -2.883 -14.993 -2.623 1.00 2.13 H new ATOM 0 HE3 LYS A 28 -4.046 -15.109 -1.318 1.00 2.13 H new ATOM 0 HZ1 LYS A 28 -4.099 -17.018 -2.848 1.00 20.14 H new ATOM 0 HZ2 LYS A 28 -5.592 -16.215 -2.768 1.00 20.14 H new ATOM 0 HZ3 LYS A 28 -4.579 -15.991 -4.112 1.00 20.14 H new ATOM 437 N ASN A 29 -8.211 -12.154 -0.092 1.00 31.31 N ATOM 438 CA ASN A 29 -8.374 -12.652 1.303 1.00 25.11 C ATOM 439 C ASN A 29 -9.839 -12.996 1.599 1.00 42.21 C ATOM 440 O ASN A 29 -10.123 -13.969 2.296 1.00 41.15 O ATOM 441 CB ASN A 29 -7.874 -11.611 2.351 1.00 52.43 C ATOM 442 CG ASN A 29 -6.354 -11.426 2.377 1.00 51.52 C ATOM 443 OD1 ASN A 29 -5.585 -12.340 2.076 1.00 63.55 O ATOM 444 ND2 ASN A 29 -5.908 -10.234 2.755 1.00 61.12 N ATOM 0 H ASN A 29 -7.806 -11.219 -0.145 1.00 31.31 H new ATOM 0 HA ASN A 29 -7.766 -13.553 1.385 1.00 25.11 H new ATOM 0 HB2 ASN A 29 -8.342 -10.649 2.143 1.00 52.43 H new ATOM 0 HB3 ASN A 29 -8.208 -11.920 3.341 1.00 52.43 H new ATOM 0 HD21 ASN A 29 -4.905 -10.056 2.802 1.00 61.12 H new ATOM 0 HD22 ASN A 29 -6.569 -9.496 2.998 1.00 61.12 H new ATOM 451 N MET A 30 -10.755 -12.185 1.041 1.00 13.33 N ATOM 452 CA MET A 30 -12.201 -12.404 1.187 1.00 74.15 C ATOM 453 C MET A 30 -12.657 -13.637 0.381 1.00 12.03 C ATOM 454 O MET A 30 -13.472 -14.410 0.866 1.00 62.33 O ATOM 455 CB MET A 30 -12.998 -11.135 0.784 1.00 33.23 C ATOM 456 CG MET A 30 -12.787 -9.935 1.726 1.00 51.51 C ATOM 457 SD MET A 30 -13.847 -8.523 1.319 1.00 51.43 S ATOM 458 CE MET A 30 -13.211 -8.008 -0.279 1.00 74.33 C ATOM 0 H MET A 30 -10.515 -11.367 0.481 1.00 13.33 H new ATOM 0 HA MET A 30 -12.409 -12.603 2.238 1.00 74.15 H new ATOM 0 HB2 MET A 30 -12.711 -10.845 -0.227 1.00 33.23 H new ATOM 0 HB3 MET A 30 -14.060 -11.379 0.756 1.00 33.23 H new ATOM 0 HG2 MET A 30 -12.983 -10.246 2.752 1.00 51.51 H new ATOM 0 HG3 MET A 30 -11.743 -9.624 1.681 1.00 51.51 H new ATOM 0 HE1 MET A 30 -13.569 -7.004 -0.507 1.00 74.33 H new ATOM 0 HE2 MET A 30 -12.121 -8.008 -0.254 1.00 74.33 H new ATOM 0 HE3 MET A 30 -13.556 -8.699 -1.048 1.00 74.33 H new ATOM 468 N ILE A 31 -12.083 -13.832 -0.823 1.00 72.14 N ATOM 469 CA ILE A 31 -12.381 -15.005 -1.674 1.00 2.14 C ATOM 470 C ILE A 31 -11.868 -16.294 -0.994 1.00 32.51 C ATOM 471 O ILE A 31 -12.556 -17.312 -1.004 1.00 0.12 O ATOM 472 CB ILE A 31 -11.746 -14.867 -3.115 1.00 73.41 C ATOM 473 CG1 ILE A 31 -12.302 -13.604 -3.855 1.00 44.43 C ATOM 474 CG2 ILE A 31 -11.993 -16.145 -3.957 1.00 52.20 C ATOM 475 CD1 ILE A 31 -11.661 -13.313 -5.205 1.00 31.45 C ATOM 0 H ILE A 31 -11.406 -13.188 -1.231 1.00 72.14 H new ATOM 0 HA ILE A 31 -13.463 -15.058 -1.794 1.00 2.14 H new ATOM 0 HB ILE A 31 -10.670 -14.744 -2.993 1.00 73.41 H new ATOM 0 HG12 ILE A 31 -13.375 -13.729 -3.999 1.00 44.43 H new ATOM 0 HG13 ILE A 31 -12.166 -12.735 -3.211 1.00 44.43 H new ATOM 0 HG21 ILE A 31 -11.546 -16.023 -4.943 1.00 52.20 H new ATOM 0 HG22 ILE A 31 -11.542 -17.003 -3.458 1.00 52.20 H new ATOM 0 HG23 ILE A 31 -13.065 -16.309 -4.063 1.00 52.20 H new ATOM 0 HD11 ILE A 31 -12.113 -12.420 -5.638 1.00 31.45 H new ATOM 0 HD12 ILE A 31 -10.591 -13.150 -5.072 1.00 31.45 H new ATOM 0 HD13 ILE A 31 -11.819 -14.160 -5.873 1.00 31.45 H new ATOM 487 N GLU A 32 -10.672 -16.212 -0.372 1.00 74.20 N ATOM 488 CA GLU A 32 -10.053 -17.354 0.332 1.00 1.51 C ATOM 489 C GLU A 32 -10.897 -17.732 1.567 1.00 73.03 C ATOM 490 O GLU A 32 -11.144 -18.912 1.830 1.00 53.11 O ATOM 491 CB GLU A 32 -8.594 -17.024 0.783 1.00 20.10 C ATOM 492 CG GLU A 32 -7.622 -16.570 -0.335 1.00 41.32 C ATOM 493 CD GLU A 32 -7.522 -17.511 -1.552 1.00 64.02 C ATOM 494 OE1 GLU A 32 -7.527 -17.015 -2.706 1.00 32.11 O ATOM 495 OE2 GLU A 32 -7.413 -18.743 -1.361 1.00 20.53 O ATOM 0 H GLU A 32 -10.113 -15.359 -0.344 1.00 74.20 H new ATOM 0 HA GLU A 32 -10.017 -18.193 -0.363 1.00 1.51 H new ATOM 0 HB2 GLU A 32 -8.637 -16.240 1.539 1.00 20.10 H new ATOM 0 HB3 GLU A 32 -8.175 -17.908 1.264 1.00 20.10 H new ATOM 0 HG2 GLU A 32 -7.933 -15.585 -0.684 1.00 41.32 H new ATOM 0 HG3 GLU A 32 -6.628 -16.456 0.097 1.00 41.32 H new ATOM 502 N ASP A 33 -11.356 -16.686 2.284 1.00 23.22 N ATOM 503 CA ASP A 33 -12.118 -16.806 3.545 1.00 15.42 C ATOM 504 C ASP A 33 -13.520 -17.409 3.304 1.00 12.23 C ATOM 505 O ASP A 33 -13.995 -18.238 4.087 1.00 63.14 O ATOM 506 CB ASP A 33 -12.232 -15.405 4.204 1.00 72.33 C ATOM 507 CG ASP A 33 -12.877 -15.452 5.593 1.00 22.34 C ATOM 508 OD1 ASP A 33 -12.201 -15.876 6.552 1.00 73.34 O ATOM 509 OD2 ASP A 33 -14.054 -15.061 5.738 1.00 72.14 O ATOM 0 H ASP A 33 -11.205 -15.718 1.999 1.00 23.22 H new ATOM 0 HA ASP A 33 -11.586 -17.484 4.213 1.00 15.42 H new ATOM 0 HB2 ASP A 33 -11.238 -14.965 4.285 1.00 72.33 H new ATOM 0 HB3 ASP A 33 -12.819 -14.752 3.558 1.00 72.33 H new ATOM 514 N ILE A 34 -14.159 -16.976 2.207 1.00 1.55 N ATOM 515 CA ILE A 34 -15.481 -17.481 1.768 1.00 10.42 C ATOM 516 C ILE A 34 -15.310 -18.835 1.026 1.00 54.15 C ATOM 517 O ILE A 34 -16.257 -19.625 0.900 1.00 44.15 O ATOM 518 CB ILE A 34 -16.207 -16.400 0.858 1.00 55.51 C ATOM 519 CG1 ILE A 34 -16.391 -15.057 1.650 1.00 75.45 C ATOM 520 CG2 ILE A 34 -17.576 -16.904 0.320 1.00 0.11 C ATOM 521 CD1 ILE A 34 -16.927 -13.895 0.824 1.00 10.13 C ATOM 0 H ILE A 34 -13.775 -16.260 1.591 1.00 1.55 H new ATOM 0 HA ILE A 34 -16.112 -17.654 2.640 1.00 10.42 H new ATOM 0 HB ILE A 34 -15.568 -16.224 -0.007 1.00 55.51 H new ATOM 0 HG12 ILE A 34 -17.069 -15.234 2.485 1.00 75.45 H new ATOM 0 HG13 ILE A 34 -15.430 -14.768 2.076 1.00 75.45 H new ATOM 0 HG21 ILE A 34 -18.032 -16.129 -0.296 1.00 0.11 H new ATOM 0 HG22 ILE A 34 -17.423 -17.801 -0.280 1.00 0.11 H new ATOM 0 HG23 ILE A 34 -18.233 -17.135 1.158 1.00 0.11 H new ATOM 0 HD11 ILE A 34 -17.020 -13.012 1.456 1.00 10.13 H new ATOM 0 HD12 ILE A 34 -16.240 -13.684 0.004 1.00 10.13 H new ATOM 0 HD13 ILE A 34 -17.905 -14.157 0.420 1.00 10.13 H new ATOM 533 N GLY A 35 -14.076 -19.109 0.572 1.00 51.32 N ATOM 534 CA GLY A 35 -13.765 -20.305 -0.212 1.00 35.45 C ATOM 535 C GLY A 35 -13.866 -20.011 -1.699 1.00 33.52 C ATOM 536 O GLY A 35 -12.868 -20.056 -2.426 1.00 12.50 O ATOM 0 H GLY A 35 -13.271 -18.506 0.740 1.00 51.32 H new ATOM 0 HA2 GLY A 35 -12.760 -20.653 0.028 1.00 35.45 H new ATOM 0 HA3 GLY A 35 -14.452 -21.109 0.053 1.00 35.45 H new ATOM 540 N GLU A 36 -15.088 -19.673 -2.140 1.00 41.13 N ATOM 541 CA GLU A 36 -15.382 -19.207 -3.509 1.00 71.25 C ATOM 542 C GLU A 36 -16.338 -18.009 -3.403 1.00 44.43 C ATOM 543 O GLU A 36 -17.370 -18.111 -2.724 1.00 50.13 O ATOM 544 CB GLU A 36 -16.042 -20.338 -4.355 1.00 52.43 C ATOM 545 CG GLU A 36 -15.174 -21.598 -4.541 1.00 24.31 C ATOM 546 CD GLU A 36 -15.854 -22.691 -5.384 1.00 32.12 C ATOM 547 OE1 GLU A 36 -15.605 -22.757 -6.610 1.00 63.42 O ATOM 548 OE2 GLU A 36 -16.639 -23.483 -4.830 1.00 22.14 O ATOM 0 H GLU A 36 -15.916 -19.716 -1.546 1.00 41.13 H new ATOM 0 HA GLU A 36 -14.455 -18.921 -4.006 1.00 71.25 H new ATOM 0 HB2 GLU A 36 -16.980 -20.627 -3.880 1.00 52.43 H new ATOM 0 HB3 GLU A 36 -16.292 -19.938 -5.338 1.00 52.43 H new ATOM 0 HG2 GLU A 36 -14.234 -21.316 -5.016 1.00 24.31 H new ATOM 0 HG3 GLU A 36 -14.926 -22.007 -3.562 1.00 24.31 H new ATOM 555 N SER A 37 -15.986 -16.882 -4.053 1.00 73.43 N ATOM 556 CA SER A 37 -16.807 -15.654 -4.049 1.00 10.12 C ATOM 557 C SER A 37 -18.053 -15.808 -4.959 1.00 12.21 C ATOM 558 O SER A 37 -18.084 -15.315 -6.095 1.00 65.42 O ATOM 559 CB SER A 37 -15.933 -14.441 -4.467 1.00 61.51 C ATOM 560 OG SER A 37 -15.213 -14.713 -5.665 1.00 2.42 O ATOM 0 H SER A 37 -15.126 -16.797 -4.595 1.00 73.43 H new ATOM 0 HA SER A 37 -17.178 -15.478 -3.039 1.00 10.12 H new ATOM 0 HB2 SER A 37 -16.566 -13.566 -4.611 1.00 61.51 H new ATOM 0 HB3 SER A 37 -15.234 -14.200 -3.666 1.00 61.51 H new ATOM 0 HG SER A 37 -15.832 -15.037 -6.352 1.00 2.42 H new ATOM 566 N ASP A 38 -19.052 -16.550 -4.441 1.00 20.31 N ATOM 567 CA ASP A 38 -20.354 -16.768 -5.106 1.00 43.30 C ATOM 568 C ASP A 38 -21.226 -15.509 -4.977 1.00 73.42 C ATOM 569 O ASP A 38 -21.977 -15.148 -5.892 1.00 51.35 O ATOM 570 CB ASP A 38 -21.070 -17.988 -4.467 1.00 14.12 C ATOM 571 CG ASP A 38 -22.432 -18.297 -5.116 1.00 24.03 C ATOM 572 OD1 ASP A 38 -23.481 -17.850 -4.594 1.00 74.24 O ATOM 573 OD2 ASP A 38 -22.455 -18.989 -6.156 1.00 61.23 O ATOM 0 H ASP A 38 -18.977 -17.020 -3.539 1.00 20.31 H new ATOM 0 HA ASP A 38 -20.189 -16.970 -6.164 1.00 43.30 H new ATOM 0 HB2 ASP A 38 -20.427 -18.864 -4.551 1.00 14.12 H new ATOM 0 HB3 ASP A 38 -21.215 -17.800 -3.403 1.00 14.12 H new ATOM 578 N SER A 39 -21.110 -14.860 -3.820 1.00 71.33 N ATOM 579 CA SER A 39 -21.812 -13.616 -3.517 1.00 20.42 C ATOM 580 C SER A 39 -21.019 -12.418 -4.086 1.00 41.03 C ATOM 581 O SER A 39 -19.779 -12.391 -3.954 1.00 74.30 O ATOM 582 CB SER A 39 -21.982 -13.492 -1.987 1.00 21.42 C ATOM 583 OG SER A 39 -20.738 -13.597 -1.306 1.00 32.31 O ATOM 0 H SER A 39 -20.518 -15.188 -3.057 1.00 71.33 H new ATOM 0 HA SER A 39 -22.799 -13.620 -3.980 1.00 20.42 H new ATOM 0 HB2 SER A 39 -22.446 -12.535 -1.750 1.00 21.42 H new ATOM 0 HB3 SER A 39 -22.657 -14.271 -1.632 1.00 21.42 H new ATOM 0 HG SER A 39 -20.885 -13.512 -0.341 1.00 32.31 H new ATOM 589 N PRO A 40 -21.699 -11.428 -4.759 1.00 54.35 N ATOM 590 CA PRO A 40 -21.051 -10.160 -5.179 1.00 43.22 C ATOM 591 C PRO A 40 -20.501 -9.389 -3.963 1.00 30.52 C ATOM 592 O PRO A 40 -21.112 -9.421 -2.892 1.00 2.14 O ATOM 593 CB PRO A 40 -22.194 -9.373 -5.868 1.00 2.15 C ATOM 594 CG PRO A 40 -23.219 -10.396 -6.242 1.00 52.04 C ATOM 595 CD PRO A 40 -23.133 -11.468 -5.177 1.00 42.35 C ATOM 0 HA PRO A 40 -20.196 -10.321 -5.835 1.00 43.22 H new ATOM 0 HB2 PRO A 40 -22.614 -8.624 -5.197 1.00 2.15 H new ATOM 0 HB3 PRO A 40 -21.830 -8.843 -6.748 1.00 2.15 H new ATOM 0 HG2 PRO A 40 -24.216 -9.957 -6.277 1.00 52.04 H new ATOM 0 HG3 PRO A 40 -23.018 -10.809 -7.231 1.00 52.04 H new ATOM 0 HD2 PRO A 40 -23.801 -11.259 -4.341 1.00 42.35 H new ATOM 0 HD3 PRO A 40 -23.410 -12.447 -5.569 1.00 42.35 H new ATOM 603 N ILE A 41 -19.352 -8.723 -4.122 1.00 74.32 N ATOM 604 CA ILE A 41 -18.673 -8.024 -3.018 1.00 62.52 C ATOM 605 C ILE A 41 -19.041 -6.516 -3.029 1.00 74.54 C ATOM 606 O ILE A 41 -18.540 -5.765 -3.877 1.00 2.35 O ATOM 607 CB ILE A 41 -17.110 -8.211 -3.103 1.00 13.14 C ATOM 608 CG1 ILE A 41 -16.715 -9.732 -3.127 1.00 12.12 C ATOM 609 CG2 ILE A 41 -16.390 -7.467 -1.952 1.00 22.43 C ATOM 610 CD1 ILE A 41 -17.119 -10.531 -1.890 1.00 71.40 C ATOM 0 H ILE A 41 -18.865 -8.652 -5.016 1.00 74.32 H new ATOM 0 HA ILE A 41 -19.013 -8.462 -2.079 1.00 62.52 H new ATOM 0 HB ILE A 41 -16.780 -7.768 -4.043 1.00 13.14 H new ATOM 0 HG12 ILE A 41 -17.170 -10.195 -4.003 1.00 12.12 H new ATOM 0 HG13 ILE A 41 -15.635 -9.808 -3.251 1.00 12.12 H new ATOM 0 HG21 ILE A 41 -15.314 -7.616 -2.040 1.00 22.43 H new ATOM 0 HG22 ILE A 41 -16.615 -6.402 -2.010 1.00 22.43 H new ATOM 0 HG23 ILE A 41 -16.734 -7.858 -0.995 1.00 22.43 H new ATOM 0 HD11 ILE A 41 -16.801 -11.567 -2.006 1.00 71.40 H new ATOM 0 HD12 ILE A 41 -16.643 -10.102 -1.008 1.00 71.40 H new ATOM 0 HD13 ILE A 41 -18.202 -10.495 -1.771 1.00 71.40 H new ATOM 622 N PRO A 42 -19.940 -6.047 -2.104 1.00 75.35 N ATOM 623 CA PRO A 42 -20.270 -4.620 -1.985 1.00 5.11 C ATOM 624 C PRO A 42 -19.217 -3.854 -1.142 1.00 74.42 C ATOM 625 O PRO A 42 -19.073 -4.096 0.064 1.00 34.51 O ATOM 626 CB PRO A 42 -21.664 -4.648 -1.320 1.00 33.00 C ATOM 627 CG PRO A 42 -21.657 -5.876 -0.453 1.00 54.43 C ATOM 628 CD PRO A 42 -20.709 -6.864 -1.117 1.00 50.22 C ATOM 0 HA PRO A 42 -20.271 -4.091 -2.938 1.00 5.11 H new ATOM 0 HB2 PRO A 42 -21.837 -3.749 -0.729 1.00 33.00 H new ATOM 0 HB3 PRO A 42 -22.457 -4.697 -2.067 1.00 33.00 H new ATOM 0 HG2 PRO A 42 -21.324 -5.637 0.557 1.00 54.43 H new ATOM 0 HG3 PRO A 42 -22.659 -6.297 -0.367 1.00 54.43 H new ATOM 0 HD2 PRO A 42 -20.047 -7.329 -0.387 1.00 50.22 H new ATOM 0 HD3 PRO A 42 -21.256 -7.668 -1.609 1.00 50.22 H new ATOM 636 N LEU A 43 -18.453 -2.979 -1.814 1.00 11.12 N ATOM 637 CA LEU A 43 -17.442 -2.108 -1.189 1.00 72.21 C ATOM 638 C LEU A 43 -18.101 -0.772 -0.755 1.00 13.25 C ATOM 639 O LEU A 43 -18.243 0.138 -1.582 1.00 32.35 O ATOM 640 CB LEU A 43 -16.291 -1.854 -2.207 1.00 2.04 C ATOM 641 CG LEU A 43 -15.598 -3.134 -2.782 1.00 35.41 C ATOM 642 CD1 LEU A 43 -14.590 -2.776 -3.895 1.00 71.31 C ATOM 643 CD2 LEU A 43 -14.931 -3.967 -1.657 1.00 62.31 C ATOM 0 H LEU A 43 -18.521 -2.854 -2.824 1.00 11.12 H new ATOM 0 HA LEU A 43 -17.029 -2.589 -0.302 1.00 72.21 H new ATOM 0 HB2 LEU A 43 -16.689 -1.274 -3.040 1.00 2.04 H new ATOM 0 HB3 LEU A 43 -15.532 -1.239 -1.723 1.00 2.04 H new ATOM 0 HG LEU A 43 -16.373 -3.754 -3.232 1.00 35.41 H new ATOM 0 HD11 LEU A 43 -14.126 -3.687 -4.273 1.00 71.31 H new ATOM 0 HD12 LEU A 43 -15.110 -2.270 -4.708 1.00 71.31 H new ATOM 0 HD13 LEU A 43 -13.821 -2.118 -3.491 1.00 71.31 H new ATOM 0 HD21 LEU A 43 -14.459 -4.849 -2.089 1.00 62.31 H new ATOM 0 HD22 LEU A 43 -14.177 -3.361 -1.154 1.00 62.31 H new ATOM 0 HD23 LEU A 43 -15.688 -4.277 -0.936 1.00 62.31 H new ATOM 655 N PRO A 44 -18.515 -0.617 0.548 1.00 51.42 N ATOM 656 CA PRO A 44 -19.338 0.532 1.005 1.00 23.21 C ATOM 657 C PRO A 44 -18.496 1.767 1.418 1.00 12.34 C ATOM 658 O PRO A 44 -18.966 2.611 2.190 1.00 42.54 O ATOM 659 CB PRO A 44 -20.081 -0.092 2.205 1.00 23.23 C ATOM 660 CG PRO A 44 -19.070 -1.007 2.835 1.00 14.32 C ATOM 661 CD PRO A 44 -18.202 -1.526 1.693 1.00 11.41 C ATOM 0 HA PRO A 44 -19.988 0.935 0.228 1.00 23.21 H new ATOM 0 HB2 PRO A 44 -20.416 0.672 2.906 1.00 23.23 H new ATOM 0 HB3 PRO A 44 -20.967 -0.640 1.883 1.00 23.23 H new ATOM 0 HG2 PRO A 44 -18.468 -0.475 3.572 1.00 14.32 H new ATOM 0 HG3 PRO A 44 -19.560 -1.829 3.357 1.00 14.32 H new ATOM 0 HD2 PRO A 44 -17.143 -1.491 1.951 1.00 11.41 H new ATOM 0 HD3 PRO A 44 -18.438 -2.563 1.454 1.00 11.41 H new ATOM 669 N ASN A 45 -17.275 1.881 0.858 1.00 4.31 N ATOM 670 CA ASN A 45 -16.306 2.947 1.199 1.00 71.10 C ATOM 671 C ASN A 45 -15.875 3.695 -0.074 1.00 10.54 C ATOM 672 O ASN A 45 -16.070 4.911 -0.189 1.00 4.44 O ATOM 673 CB ASN A 45 -15.079 2.320 1.916 1.00 53.42 C ATOM 674 CG ASN A 45 -13.962 3.323 2.250 1.00 71.03 C ATOM 675 OD1 ASN A 45 -13.025 3.514 1.472 1.00 53.34 O ATOM 676 ND2 ASN A 45 -14.048 3.962 3.409 1.00 54.44 N ATOM 0 H ASN A 45 -16.929 1.232 0.151 1.00 4.31 H new ATOM 0 HA ASN A 45 -16.775 3.666 1.871 1.00 71.10 H new ATOM 0 HB2 ASN A 45 -15.415 1.847 2.839 1.00 53.42 H new ATOM 0 HB3 ASN A 45 -14.667 1.532 1.285 1.00 53.42 H new ATOM 0 HD21 ASN A 45 -13.327 4.632 3.677 1.00 54.44 H new ATOM 0 HD22 ASN A 45 -14.835 3.783 4.033 1.00 54.44 H new ATOM 683 N VAL A 46 -15.294 2.950 -1.030 1.00 33.25 N ATOM 684 CA VAL A 46 -14.796 3.518 -2.292 1.00 11.04 C ATOM 685 C VAL A 46 -15.971 3.820 -3.253 1.00 53.43 C ATOM 686 O VAL A 46 -16.809 2.952 -3.526 1.00 41.23 O ATOM 687 CB VAL A 46 -13.719 2.578 -2.966 1.00 73.11 C ATOM 688 CG1 VAL A 46 -14.269 1.160 -3.251 1.00 64.55 C ATOM 689 CG2 VAL A 46 -13.128 3.225 -4.246 1.00 20.44 C ATOM 0 H VAL A 46 -15.157 1.942 -0.949 1.00 33.25 H new ATOM 0 HA VAL A 46 -14.297 4.460 -2.065 1.00 11.04 H new ATOM 0 HB VAL A 46 -12.909 2.460 -2.246 1.00 73.11 H new ATOM 0 HG11 VAL A 46 -13.490 0.554 -3.714 1.00 64.55 H new ATOM 0 HG12 VAL A 46 -14.582 0.696 -2.315 1.00 64.55 H new ATOM 0 HG13 VAL A 46 -15.123 1.230 -3.925 1.00 64.55 H new ATOM 0 HG21 VAL A 46 -12.391 2.554 -4.686 1.00 20.44 H new ATOM 0 HG22 VAL A 46 -13.927 3.406 -4.964 1.00 20.44 H new ATOM 0 HG23 VAL A 46 -12.650 4.170 -3.989 1.00 20.44 H new ATOM 699 N THR A 47 -16.026 5.071 -3.741 1.00 2.21 N ATOM 700 CA THR A 47 -17.087 5.558 -4.641 1.00 40.24 C ATOM 701 C THR A 47 -16.898 4.998 -6.068 1.00 32.03 C ATOM 702 O THR A 47 -15.826 4.474 -6.392 1.00 45.43 O ATOM 703 CB THR A 47 -17.083 7.118 -4.668 1.00 24.20 C ATOM 704 OG1 THR A 47 -15.798 7.599 -5.108 1.00 72.13 O ATOM 705 CG2 THR A 47 -17.411 7.717 -3.285 1.00 33.14 C ATOM 0 H THR A 47 -15.328 5.781 -3.520 1.00 2.21 H new ATOM 0 HA THR A 47 -18.048 5.209 -4.265 1.00 40.24 H new ATOM 0 HB THR A 47 -17.858 7.436 -5.365 1.00 24.20 H new ATOM 0 HG1 THR A 47 -15.803 8.579 -5.124 1.00 72.13 H new ATOM 0 HG21 THR A 47 -17.398 8.805 -3.347 1.00 33.14 H new ATOM 0 HG22 THR A 47 -18.400 7.384 -2.969 1.00 33.14 H new ATOM 0 HG23 THR A 47 -16.668 7.386 -2.560 1.00 33.14 H new ATOM 713 N SER A 48 -17.939 5.141 -6.914 1.00 25.14 N ATOM 714 CA SER A 48 -17.980 4.538 -8.264 1.00 51.31 C ATOM 715 C SER A 48 -16.902 5.109 -9.191 1.00 51.14 C ATOM 716 O SER A 48 -16.214 4.351 -9.862 1.00 61.34 O ATOM 717 CB SER A 48 -19.364 4.734 -8.906 1.00 12.42 C ATOM 718 OG SER A 48 -19.727 6.104 -8.962 1.00 0.42 O ATOM 0 H SER A 48 -18.775 5.677 -6.681 1.00 25.14 H new ATOM 0 HA SER A 48 -17.783 3.474 -8.135 1.00 51.31 H new ATOM 0 HB2 SER A 48 -19.360 4.317 -9.913 1.00 12.42 H new ATOM 0 HB3 SER A 48 -20.111 4.183 -8.335 1.00 12.42 H new ATOM 0 HG SER A 48 -20.702 6.187 -8.905 1.00 0.42 H new ATOM 724 N THR A 49 -16.770 6.445 -9.199 1.00 44.01 N ATOM 725 CA THR A 49 -15.833 7.166 -10.076 1.00 54.32 C ATOM 726 C THR A 49 -14.375 6.732 -9.809 1.00 14.44 C ATOM 727 O THR A 49 -13.628 6.391 -10.736 1.00 70.40 O ATOM 728 CB THR A 49 -15.977 8.709 -9.862 1.00 32.04 C ATOM 729 OG1 THR A 49 -15.829 9.018 -8.464 1.00 22.14 O ATOM 730 CG2 THR A 49 -17.340 9.237 -10.353 1.00 22.14 C ATOM 0 H THR A 49 -17.314 7.059 -8.593 1.00 44.01 H new ATOM 0 HA THR A 49 -16.079 6.920 -11.109 1.00 54.32 H new ATOM 0 HB THR A 49 -15.196 9.195 -10.447 1.00 32.04 H new ATOM 0 HG1 THR A 49 -15.918 9.985 -8.332 1.00 22.14 H new ATOM 0 HG21 THR A 49 -17.396 10.312 -10.185 1.00 22.14 H new ATOM 0 HG22 THR A 49 -17.448 9.030 -11.418 1.00 22.14 H new ATOM 0 HG23 THR A 49 -18.141 8.742 -9.804 1.00 22.14 H new ATOM 738 N ILE A 50 -14.005 6.715 -8.520 1.00 74.32 N ATOM 739 CA ILE A 50 -12.648 6.360 -8.081 1.00 21.34 C ATOM 740 C ILE A 50 -12.366 4.872 -8.358 1.00 3.12 C ATOM 741 O ILE A 50 -11.339 4.536 -8.953 1.00 70.02 O ATOM 742 CB ILE A 50 -12.447 6.695 -6.554 1.00 72.33 C ATOM 743 CG1 ILE A 50 -12.684 8.222 -6.296 1.00 72.32 C ATOM 744 CG2 ILE A 50 -11.053 6.253 -6.043 1.00 21.21 C ATOM 745 CD1 ILE A 50 -11.748 9.159 -7.057 1.00 51.14 C ATOM 0 H ILE A 50 -14.637 6.947 -7.754 1.00 74.32 H new ATOM 0 HA ILE A 50 -11.935 6.956 -8.651 1.00 21.34 H new ATOM 0 HB ILE A 50 -13.187 6.127 -5.989 1.00 72.33 H new ATOM 0 HG12 ILE A 50 -13.712 8.465 -6.563 1.00 72.32 H new ATOM 0 HG13 ILE A 50 -12.578 8.415 -5.229 1.00 72.32 H new ATOM 0 HG21 ILE A 50 -10.957 6.503 -4.986 1.00 21.21 H new ATOM 0 HG22 ILE A 50 -10.942 5.176 -6.173 1.00 21.21 H new ATOM 0 HG23 ILE A 50 -10.278 6.768 -6.610 1.00 21.21 H new ATOM 0 HD11 ILE A 50 -11.991 10.193 -6.812 1.00 51.14 H new ATOM 0 HD12 ILE A 50 -10.716 8.952 -6.774 1.00 51.14 H new ATOM 0 HD13 ILE A 50 -11.868 9.002 -8.129 1.00 51.14 H new ATOM 757 N LEU A 51 -13.331 4.004 -7.982 1.00 63.33 N ATOM 758 CA LEU A 51 -13.218 2.540 -8.152 1.00 63.21 C ATOM 759 C LEU A 51 -13.135 2.161 -9.648 1.00 60.45 C ATOM 760 O LEU A 51 -12.402 1.248 -10.013 1.00 61.32 O ATOM 761 CB LEU A 51 -14.413 1.808 -7.470 1.00 35.40 C ATOM 762 CG LEU A 51 -14.305 0.250 -7.385 1.00 50.33 C ATOM 763 CD1 LEU A 51 -13.030 -0.187 -6.624 1.00 1.03 C ATOM 764 CD2 LEU A 51 -15.569 -0.374 -6.753 1.00 3.43 C ATOM 0 H LEU A 51 -14.208 4.299 -7.553 1.00 63.33 H new ATOM 0 HA LEU A 51 -12.296 2.218 -7.667 1.00 63.21 H new ATOM 0 HB2 LEU A 51 -14.524 2.200 -6.459 1.00 35.40 H new ATOM 0 HB3 LEU A 51 -15.325 2.060 -8.012 1.00 35.40 H new ATOM 0 HG LEU A 51 -14.228 -0.124 -8.406 1.00 50.33 H new ATOM 0 HD11 LEU A 51 -12.986 -1.275 -6.583 1.00 1.03 H new ATOM 0 HD12 LEU A 51 -12.149 0.193 -7.142 1.00 1.03 H new ATOM 0 HD13 LEU A 51 -13.056 0.213 -5.611 1.00 1.03 H new ATOM 0 HD21 LEU A 51 -15.458 -1.457 -6.711 1.00 3.43 H new ATOM 0 HD22 LEU A 51 -15.702 0.017 -5.744 1.00 3.43 H new ATOM 0 HD23 LEU A 51 -16.440 -0.122 -7.358 1.00 3.43 H new ATOM 776 N GLU A 52 -13.861 2.920 -10.493 1.00 43.23 N ATOM 777 CA GLU A 52 -13.906 2.712 -11.958 1.00 40.34 C ATOM 778 C GLU A 52 -12.502 2.835 -12.557 1.00 42.31 C ATOM 779 O GLU A 52 -12.040 1.940 -13.272 1.00 75.35 O ATOM 780 CB GLU A 52 -14.849 3.756 -12.618 1.00 31.20 C ATOM 781 CG GLU A 52 -14.974 3.651 -14.147 1.00 40.52 C ATOM 782 CD GLU A 52 -15.858 4.752 -14.746 1.00 72.40 C ATOM 783 OE1 GLU A 52 -17.083 4.547 -14.872 1.00 41.22 O ATOM 784 OE2 GLU A 52 -15.331 5.832 -15.078 1.00 12.14 O ATOM 0 H GLU A 52 -14.437 3.700 -10.178 1.00 43.23 H new ATOM 0 HA GLU A 52 -14.288 1.710 -12.153 1.00 40.34 H new ATOM 0 HB2 GLU A 52 -15.842 3.653 -12.180 1.00 31.20 H new ATOM 0 HB3 GLU A 52 -14.492 4.755 -12.366 1.00 31.20 H new ATOM 0 HG2 GLU A 52 -13.981 3.705 -14.593 1.00 40.52 H new ATOM 0 HG3 GLU A 52 -15.388 2.677 -14.408 1.00 40.52 H new ATOM 791 N LYS A 53 -11.835 3.954 -12.210 1.00 13.32 N ATOM 792 CA LYS A 53 -10.481 4.267 -12.688 1.00 52.40 C ATOM 793 C LYS A 53 -9.453 3.244 -12.166 1.00 54.32 C ATOM 794 O LYS A 53 -8.683 2.695 -12.957 1.00 3.22 O ATOM 795 CB LYS A 53 -10.070 5.716 -12.279 1.00 61.11 C ATOM 796 CG LYS A 53 -10.725 6.836 -13.122 1.00 25.35 C ATOM 797 CD LYS A 53 -10.225 8.255 -12.736 1.00 72.54 C ATOM 798 CE LYS A 53 -10.646 8.687 -11.317 1.00 13.04 C ATOM 799 NZ LYS A 53 -12.122 8.746 -11.173 1.00 34.34 N ATOM 0 H LYS A 53 -12.224 4.664 -11.590 1.00 13.32 H new ATOM 0 HA LYS A 53 -10.492 4.206 -13.776 1.00 52.40 H new ATOM 0 HB2 LYS A 53 -10.328 5.870 -11.231 1.00 61.11 H new ATOM 0 HB3 LYS A 53 -8.987 5.808 -12.357 1.00 61.11 H new ATOM 0 HG2 LYS A 53 -10.518 6.658 -14.177 1.00 25.35 H new ATOM 0 HG3 LYS A 53 -11.807 6.791 -12.998 1.00 25.35 H new ATOM 0 HD2 LYS A 53 -9.138 8.281 -12.808 1.00 72.54 H new ATOM 0 HD3 LYS A 53 -10.610 8.976 -13.457 1.00 72.54 H new ATOM 0 HE2 LYS A 53 -10.238 7.987 -10.588 1.00 13.04 H new ATOM 0 HE3 LYS A 53 -10.220 9.665 -11.094 1.00 13.04 H new ATOM 0 HZ1 LYS A 53 -12.366 9.274 -10.311 1.00 34.34 H new ATOM 0 HZ2 LYS A 53 -12.533 9.225 -12.000 1.00 34.34 H new ATOM 0 HZ3 LYS A 53 -12.503 7.781 -11.108 1.00 34.34 H new ATOM 813 N VAL A 54 -9.473 2.977 -10.845 1.00 32.51 N ATOM 814 CA VAL A 54 -8.480 2.092 -10.196 1.00 55.04 C ATOM 815 C VAL A 54 -8.555 0.662 -10.791 1.00 21.23 C ATOM 816 O VAL A 54 -7.524 0.093 -11.150 1.00 1.43 O ATOM 817 CB VAL A 54 -8.650 2.068 -8.622 1.00 71.03 C ATOM 818 CG1 VAL A 54 -7.644 1.103 -7.949 1.00 43.02 C ATOM 819 CG2 VAL A 54 -8.499 3.492 -8.030 1.00 61.41 C ATOM 0 H VAL A 54 -10.167 3.362 -10.204 1.00 32.51 H new ATOM 0 HA VAL A 54 -7.490 2.499 -10.402 1.00 55.04 H new ATOM 0 HB VAL A 54 -9.655 1.702 -8.413 1.00 71.03 H new ATOM 0 HG11 VAL A 54 -7.794 1.116 -6.869 1.00 43.02 H new ATOM 0 HG12 VAL A 54 -7.802 0.092 -8.325 1.00 43.02 H new ATOM 0 HG13 VAL A 54 -6.627 1.420 -8.178 1.00 43.02 H new ATOM 0 HG21 VAL A 54 -8.620 3.451 -6.947 1.00 61.41 H new ATOM 0 HG22 VAL A 54 -7.510 3.883 -8.270 1.00 61.41 H new ATOM 0 HG23 VAL A 54 -9.261 4.145 -8.455 1.00 61.41 H new ATOM 829 N LEU A 55 -9.789 0.136 -10.959 1.00 43.34 N ATOM 830 CA LEU A 55 -10.026 -1.208 -11.552 1.00 32.15 C ATOM 831 C LEU A 55 -9.673 -1.248 -13.054 1.00 25.14 C ATOM 832 O LEU A 55 -9.281 -2.300 -13.573 1.00 30.13 O ATOM 833 CB LEU A 55 -11.499 -1.660 -11.366 1.00 2.41 C ATOM 834 CG LEU A 55 -11.991 -1.880 -9.899 1.00 63.53 C ATOM 835 CD1 LEU A 55 -13.443 -2.404 -9.894 1.00 24.31 C ATOM 836 CD2 LEU A 55 -11.047 -2.811 -9.095 1.00 14.41 C ATOM 0 H LEU A 55 -10.644 0.623 -10.691 1.00 43.34 H new ATOM 0 HA LEU A 55 -9.368 -1.895 -11.019 1.00 32.15 H new ATOM 0 HB2 LEU A 55 -12.144 -0.915 -11.832 1.00 2.41 H new ATOM 0 HB3 LEU A 55 -11.640 -2.591 -11.914 1.00 2.41 H new ATOM 0 HG LEU A 55 -11.970 -0.914 -9.395 1.00 63.53 H new ATOM 0 HD11 LEU A 55 -13.773 -2.553 -8.866 1.00 24.31 H new ATOM 0 HD12 LEU A 55 -14.093 -1.678 -10.382 1.00 24.31 H new ATOM 0 HD13 LEU A 55 -13.490 -3.352 -10.431 1.00 24.31 H new ATOM 0 HD21 LEU A 55 -11.432 -2.933 -8.082 1.00 14.41 H new ATOM 0 HD22 LEU A 55 -10.994 -3.784 -9.583 1.00 14.41 H new ATOM 0 HD23 LEU A 55 -10.051 -2.371 -9.054 1.00 14.41 H new ATOM 848 N ASP A 56 -9.831 -0.098 -13.738 1.00 24.21 N ATOM 849 CA ASP A 56 -9.521 0.035 -15.180 1.00 61.31 C ATOM 850 C ASP A 56 -7.998 -0.071 -15.394 1.00 0.12 C ATOM 851 O ASP A 56 -7.529 -0.762 -16.311 1.00 2.32 O ATOM 852 CB ASP A 56 -10.056 1.390 -15.723 1.00 22.24 C ATOM 853 CG ASP A 56 -10.102 1.459 -17.259 1.00 11.04 C ATOM 854 OD1 ASP A 56 -9.098 1.849 -17.891 1.00 22.13 O ATOM 855 OD2 ASP A 56 -11.160 1.127 -17.847 1.00 3.10 O ATOM 0 H ASP A 56 -10.175 0.762 -13.312 1.00 24.21 H new ATOM 0 HA ASP A 56 -10.011 -0.770 -15.728 1.00 61.31 H new ATOM 0 HB2 ASP A 56 -11.058 1.560 -15.329 1.00 22.24 H new ATOM 0 HB3 ASP A 56 -9.425 2.197 -15.349 1.00 22.24 H new ATOM 860 N TYR A 57 -7.244 0.599 -14.501 1.00 52.34 N ATOM 861 CA TYR A 57 -5.772 0.560 -14.487 1.00 41.41 C ATOM 862 C TYR A 57 -5.281 -0.837 -14.073 1.00 25.03 C ATOM 863 O TYR A 57 -4.253 -1.313 -14.568 1.00 52.32 O ATOM 864 CB TYR A 57 -5.197 1.634 -13.523 1.00 2.12 C ATOM 865 CG TYR A 57 -3.659 1.699 -13.510 1.00 31.40 C ATOM 866 CD1 TYR A 57 -2.961 2.504 -14.412 1.00 25.03 C ATOM 867 CD2 TYR A 57 -2.903 0.924 -12.616 1.00 32.14 C ATOM 868 CE1 TYR A 57 -1.580 2.533 -14.422 1.00 33.25 C ATOM 869 CE2 TYR A 57 -1.525 0.955 -12.622 1.00 42.43 C ATOM 870 CZ TYR A 57 -0.868 1.759 -13.527 1.00 60.24 C ATOM 871 OH TYR A 57 0.508 1.772 -13.551 1.00 42.14 O ATOM 0 H TYR A 57 -7.642 1.184 -13.767 1.00 52.34 H new ATOM 0 HA TYR A 57 -5.417 0.778 -15.494 1.00 41.41 H new ATOM 0 HB2 TYR A 57 -5.590 2.610 -13.806 1.00 2.12 H new ATOM 0 HB3 TYR A 57 -5.551 1.429 -12.513 1.00 2.12 H new ATOM 0 HD1 TYR A 57 -3.510 3.114 -15.114 1.00 25.03 H new ATOM 0 HD2 TYR A 57 -3.413 0.289 -11.907 1.00 32.14 H new ATOM 0 HE1 TYR A 57 -1.058 3.160 -15.129 1.00 33.25 H new ATOM 0 HE2 TYR A 57 -0.964 0.353 -11.922 1.00 42.43 H new ATOM 0 HH TYR A 57 0.819 2.538 -14.078 1.00 42.14 H new ATOM 881 N CYS A 58 -6.012 -1.474 -13.138 1.00 11.43 N ATOM 882 CA CYS A 58 -5.711 -2.839 -12.685 1.00 24.13 C ATOM 883 C CYS A 58 -5.837 -3.831 -13.845 1.00 31.53 C ATOM 884 O CYS A 58 -5.010 -4.742 -13.987 1.00 1.21 O ATOM 885 CB CYS A 58 -6.646 -3.250 -11.532 1.00 43.23 C ATOM 886 SG CYS A 58 -6.445 -2.242 -10.068 1.00 65.54 S ATOM 0 H CYS A 58 -6.822 -1.057 -12.680 1.00 11.43 H new ATOM 0 HA CYS A 58 -4.684 -2.856 -12.321 1.00 24.13 H new ATOM 0 HB2 CYS A 58 -7.680 -3.185 -11.871 1.00 43.23 H new ATOM 0 HB3 CYS A 58 -6.459 -4.293 -11.276 1.00 43.23 H new ATOM 0 HG CYS A 58 -6.906 -1.048 -10.297 1.00 65.54 H new ATOM 892 N ARG A 59 -6.873 -3.631 -14.683 1.00 61.54 N ATOM 893 CA ARG A 59 -7.099 -4.470 -15.870 1.00 54.22 C ATOM 894 C ARG A 59 -5.967 -4.257 -16.878 1.00 3.14 C ATOM 895 O ARG A 59 -5.448 -5.215 -17.429 1.00 3.24 O ATOM 896 CB ARG A 59 -8.481 -4.205 -16.525 1.00 31.14 C ATOM 897 CG ARG A 59 -8.811 -5.216 -17.649 1.00 40.41 C ATOM 898 CD ARG A 59 -10.277 -5.189 -18.116 1.00 72.14 C ATOM 899 NE ARG A 59 -10.615 -6.459 -18.786 1.00 34.24 N ATOM 900 CZ ARG A 59 -11.555 -6.642 -19.720 1.00 45.22 C ATOM 901 NH1 ARG A 59 -12.302 -5.638 -20.153 1.00 24.40 N ATOM 902 NH2 ARG A 59 -11.760 -7.860 -20.186 1.00 55.43 N ATOM 0 H ARG A 59 -7.566 -2.893 -14.557 1.00 61.54 H new ATOM 0 HA ARG A 59 -7.102 -5.511 -15.546 1.00 54.22 H new ATOM 0 HB2 ARG A 59 -9.256 -4.252 -15.760 1.00 31.14 H new ATOM 0 HB3 ARG A 59 -8.497 -3.195 -16.934 1.00 31.14 H new ATOM 0 HG2 ARG A 59 -8.166 -5.014 -18.504 1.00 40.41 H new ATOM 0 HG3 ARG A 59 -8.572 -6.220 -17.300 1.00 40.41 H new ATOM 0 HD2 ARG A 59 -10.937 -5.031 -17.263 1.00 72.14 H new ATOM 0 HD3 ARG A 59 -10.435 -4.354 -18.799 1.00 72.14 H new ATOM 0 HE ARG A 59 -10.078 -7.281 -18.509 1.00 34.24 H new ATOM 0 HH11 ARG A 59 -12.167 -4.701 -19.774 1.00 24.40 H new ATOM 0 HH12 ARG A 59 -13.013 -5.802 -20.866 1.00 24.40 H new ATOM 0 HH21 ARG A 59 -11.206 -8.641 -19.834 1.00 55.43 H new ATOM 0 HH22 ARG A 59 -12.472 -8.020 -20.898 1.00 55.43 H new ATOM 916 N HIS A 60 -5.573 -2.981 -17.056 1.00 11.41 N ATOM 917 CA HIS A 60 -4.419 -2.581 -17.891 1.00 42.43 C ATOM 918 C HIS A 60 -3.134 -3.320 -17.459 1.00 4.21 C ATOM 919 O HIS A 60 -2.374 -3.808 -18.296 1.00 35.24 O ATOM 920 CB HIS A 60 -4.221 -1.042 -17.786 1.00 61.13 C ATOM 921 CG HIS A 60 -2.960 -0.509 -18.413 1.00 71.14 C ATOM 922 ND1 HIS A 60 -2.821 -0.277 -19.762 1.00 11.44 N ATOM 923 CD2 HIS A 60 -1.773 -0.163 -17.860 1.00 43.03 C ATOM 924 CE1 HIS A 60 -1.612 0.185 -20.004 1.00 34.24 C ATOM 925 NE2 HIS A 60 -0.961 0.261 -18.868 1.00 15.11 N ATOM 0 H HIS A 60 -6.050 -2.191 -16.621 1.00 11.41 H new ATOM 0 HA HIS A 60 -4.623 -2.854 -18.926 1.00 42.43 H new ATOM 0 HB2 HIS A 60 -5.075 -0.550 -18.253 1.00 61.13 H new ATOM 0 HB3 HIS A 60 -4.229 -0.763 -16.732 1.00 61.13 H new ATOM 0 HD2 HIS A 60 -1.517 -0.214 -16.812 1.00 43.03 H new ATOM 0 HE1 HIS A 60 -1.222 0.456 -20.974 1.00 34.24 H new ATOM 0 HE2 HIS A 60 -0.000 0.586 -18.757 1.00 15.11 H new ATOM 934 N HIS A 61 -2.939 -3.403 -16.135 1.00 12.24 N ATOM 935 CA HIS A 61 -1.753 -4.019 -15.527 1.00 23.43 C ATOM 936 C HIS A 61 -1.800 -5.557 -15.624 1.00 53.34 C ATOM 937 O HIS A 61 -0.756 -6.212 -15.609 1.00 45.10 O ATOM 938 CB HIS A 61 -1.642 -3.580 -14.044 1.00 20.31 C ATOM 939 CG HIS A 61 -0.368 -4.031 -13.381 1.00 25.00 C ATOM 940 ND1 HIS A 61 -0.253 -5.217 -12.682 1.00 72.31 N ATOM 941 CD2 HIS A 61 0.856 -3.457 -13.338 1.00 1.14 C ATOM 942 CE1 HIS A 61 0.984 -5.349 -12.247 1.00 71.43 C ATOM 943 NE2 HIS A 61 1.680 -4.296 -12.628 1.00 0.33 N ATOM 0 H HIS A 61 -3.605 -3.042 -15.452 1.00 12.24 H new ATOM 0 HA HIS A 61 -0.874 -3.681 -16.076 1.00 23.43 H new ATOM 0 HB2 HIS A 61 -1.707 -2.493 -13.989 1.00 20.31 H new ATOM 0 HB3 HIS A 61 -2.492 -3.979 -13.490 1.00 20.31 H new ATOM 0 HD1 HIS A 61 -1.007 -5.886 -12.527 1.00 72.31 H new ATOM 0 HD2 HIS A 61 1.134 -2.512 -13.781 1.00 1.14 H new ATOM 0 HE1 HIS A 61 1.364 -6.181 -11.674 1.00 71.43 H new ATOM 952 N HIS A 62 -3.014 -6.127 -15.687 1.00 1.44 N ATOM 953 CA HIS A 62 -3.191 -7.586 -15.809 1.00 1.52 C ATOM 954 C HIS A 62 -2.995 -8.042 -17.265 1.00 74.23 C ATOM 955 O HIS A 62 -2.406 -9.104 -17.520 1.00 15.45 O ATOM 956 CB HIS A 62 -4.579 -8.019 -15.278 1.00 31.13 C ATOM 957 CG HIS A 62 -4.791 -9.515 -15.320 1.00 22.30 C ATOM 958 ND1 HIS A 62 -4.196 -10.384 -14.431 1.00 70.01 N ATOM 959 CD2 HIS A 62 -5.489 -10.290 -16.180 1.00 23.41 C ATOM 960 CE1 HIS A 62 -4.512 -11.623 -14.753 1.00 0.11 C ATOM 961 NE2 HIS A 62 -5.297 -11.595 -15.808 1.00 4.33 N ATOM 0 H HIS A 62 -3.888 -5.602 -15.656 1.00 1.44 H new ATOM 0 HA HIS A 62 -2.429 -8.071 -15.198 1.00 1.52 H new ATOM 0 HB2 HIS A 62 -4.693 -7.671 -14.251 1.00 31.13 H new ATOM 0 HB3 HIS A 62 -5.355 -7.532 -15.868 1.00 31.13 H new ATOM 0 HD2 HIS A 62 -6.089 -9.944 -17.009 1.00 23.41 H new ATOM 0 HE1 HIS A 62 -4.181 -12.512 -14.237 1.00 0.11 H new ATOM 0 HE2 HIS A 62 -5.697 -12.410 -16.273 1.00 4.33 H new ATOM 970 N GLN A 63 -3.500 -7.230 -18.202 1.00 20.14 N ATOM 971 CA GLN A 63 -3.394 -7.494 -19.647 1.00 64.33 C ATOM 972 C GLN A 63 -1.944 -7.289 -20.115 1.00 53.24 C ATOM 973 O GLN A 63 -1.435 -8.024 -20.967 1.00 74.12 O ATOM 974 CB GLN A 63 -4.351 -6.567 -20.454 1.00 53.25 C ATOM 975 CG GLN A 63 -5.862 -6.710 -20.140 1.00 72.21 C ATOM 976 CD GLN A 63 -6.369 -8.153 -20.189 1.00 32.02 C ATOM 977 OE1 GLN A 63 -6.425 -8.847 -19.167 1.00 54.11 O ATOM 978 NE2 GLN A 63 -6.727 -8.620 -21.376 1.00 72.33 N ATOM 0 H GLN A 63 -3.996 -6.367 -17.981 1.00 20.14 H new ATOM 0 HA GLN A 63 -3.687 -8.528 -19.828 1.00 64.33 H new ATOM 0 HB2 GLN A 63 -4.059 -5.532 -20.274 1.00 53.25 H new ATOM 0 HB3 GLN A 63 -4.201 -6.760 -21.516 1.00 53.25 H new ATOM 0 HG2 GLN A 63 -6.058 -6.299 -19.150 1.00 72.21 H new ATOM 0 HG3 GLN A 63 -6.430 -6.111 -20.852 1.00 72.21 H new ATOM 0 HE21 GLN A 63 -6.668 -8.020 -22.199 1.00 72.33 H new ATOM 0 HE22 GLN A 63 -7.061 -9.579 -21.467 1.00 72.33 H new ATOM 987 N HIS A 64 -1.294 -6.264 -19.544 1.00 44.41 N ATOM 988 CA HIS A 64 0.105 -5.920 -19.823 1.00 45.44 C ATOM 989 C HIS A 64 0.865 -5.829 -18.482 1.00 2.02 C ATOM 990 O HIS A 64 0.918 -4.753 -17.867 1.00 70.10 O ATOM 991 CB HIS A 64 0.193 -4.582 -20.611 1.00 12.30 C ATOM 992 CG HIS A 64 -0.425 -4.619 -21.990 1.00 73.35 C ATOM 993 ND1 HIS A 64 0.314 -4.814 -23.137 1.00 12.12 N ATOM 994 CD2 HIS A 64 -1.713 -4.479 -22.407 1.00 2.34 C ATOM 995 CE1 HIS A 64 -0.479 -4.782 -24.187 1.00 54.03 C ATOM 996 NE2 HIS A 64 -1.713 -4.585 -23.777 1.00 1.34 N ATOM 0 H HIS A 64 -1.734 -5.642 -18.865 1.00 44.41 H new ATOM 0 HA HIS A 64 0.561 -6.691 -20.444 1.00 45.44 H new ATOM 0 HB2 HIS A 64 -0.296 -3.801 -20.029 1.00 12.30 H new ATOM 0 HB3 HIS A 64 1.242 -4.300 -20.705 1.00 12.30 H new ATOM 0 HD2 HIS A 64 -2.575 -4.315 -21.778 1.00 2.34 H new ATOM 0 HE1 HIS A 64 -0.168 -4.898 -25.215 1.00 54.03 H new ATOM 0 HE2 HIS A 64 -2.535 -4.521 -24.377 1.00 1.34 H new ATOM 1094 N ILE A 73 7.464 5.647 -19.072 1.00 11.30 N ATOM 1095 CA ILE A 73 6.291 6.454 -18.712 1.00 24.12 C ATOM 1096 C ILE A 73 5.264 6.420 -19.874 1.00 41.24 C ATOM 1097 O ILE A 73 5.313 7.275 -20.769 1.00 54.11 O ATOM 1098 CB ILE A 73 6.672 7.936 -18.289 1.00 54.43 C ATOM 1099 CG1 ILE A 73 7.738 7.916 -17.135 1.00 62.20 C ATOM 1100 CG2 ILE A 73 5.418 8.747 -17.869 1.00 21.21 C ATOM 1101 CD1 ILE A 73 8.267 9.280 -16.711 1.00 4.50 C ATOM 0 HA ILE A 73 5.833 6.013 -17.827 1.00 24.12 H new ATOM 0 HB ILE A 73 7.106 8.433 -19.156 1.00 54.43 H new ATOM 0 HG12 ILE A 73 7.297 7.429 -16.265 1.00 62.20 H new ATOM 0 HG13 ILE A 73 8.580 7.301 -17.452 1.00 62.20 H new ATOM 0 HG21 ILE A 73 5.716 9.757 -17.586 1.00 21.21 H new ATOM 0 HG22 ILE A 73 4.720 8.796 -18.704 1.00 21.21 H new ATOM 0 HG23 ILE A 73 4.936 8.259 -17.021 1.00 21.21 H new ATOM 0 HD11 ILE A 73 8.996 9.155 -15.910 1.00 4.50 H new ATOM 0 HD12 ILE A 73 8.743 9.766 -17.562 1.00 4.50 H new ATOM 0 HD13 ILE A 73 7.441 9.897 -16.357 1.00 4.50 H new ATOM 1113 N PRO A 74 4.390 5.369 -19.929 1.00 13.32 N ATOM 1114 CA PRO A 74 3.359 5.244 -20.985 1.00 24.41 C ATOM 1115 C PRO A 74 2.286 6.351 -20.861 1.00 11.30 C ATOM 1116 O PRO A 74 1.876 6.660 -19.743 1.00 61.23 O ATOM 1117 CB PRO A 74 2.760 3.827 -20.752 1.00 54.14 C ATOM 1118 CG PRO A 74 3.727 3.131 -19.837 1.00 42.42 C ATOM 1119 CD PRO A 74 4.333 4.219 -18.987 1.00 14.32 C ATOM 0 HA PRO A 74 3.766 5.362 -21.989 1.00 24.41 H new ATOM 0 HB2 PRO A 74 1.769 3.888 -20.303 1.00 54.14 H new ATOM 0 HB3 PRO A 74 2.651 3.287 -21.693 1.00 54.14 H new ATOM 0 HG2 PRO A 74 3.219 2.389 -19.221 1.00 42.42 H new ATOM 0 HG3 PRO A 74 4.494 2.604 -20.404 1.00 42.42 H new ATOM 0 HD2 PRO A 74 3.720 4.440 -18.113 1.00 14.32 H new ATOM 0 HD3 PRO A 74 5.322 3.945 -18.621 1.00 14.32 H new ATOM 1127 N PRO A 75 1.830 6.968 -22.007 1.00 72.41 N ATOM 1128 CA PRO A 75 0.853 8.096 -22.011 1.00 42.05 C ATOM 1129 C PRO A 75 -0.403 7.839 -21.146 1.00 24.22 C ATOM 1130 O PRO A 75 -0.787 8.712 -20.374 1.00 62.34 O ATOM 1131 CB PRO A 75 0.491 8.275 -23.520 1.00 3.42 C ATOM 1132 CG PRO A 75 1.058 7.070 -24.219 1.00 44.02 C ATOM 1133 CD PRO A 75 2.251 6.647 -23.396 1.00 14.44 C ATOM 0 HA PRO A 75 1.284 8.991 -21.563 1.00 42.05 H new ATOM 0 HB2 PRO A 75 -0.588 8.337 -23.659 1.00 3.42 H new ATOM 0 HB3 PRO A 75 0.917 9.196 -23.919 1.00 3.42 H new ATOM 0 HG2 PRO A 75 0.321 6.270 -24.281 1.00 44.02 H new ATOM 0 HG3 PRO A 75 1.352 7.312 -25.240 1.00 44.02 H new ATOM 0 HD2 PRO A 75 2.469 5.586 -23.517 1.00 14.44 H new ATOM 0 HD3 PRO A 75 3.151 7.191 -23.681 1.00 14.44 H new ATOM 1141 N TYR A 76 -1.007 6.630 -21.263 1.00 20.04 N ATOM 1142 CA TYR A 76 -2.199 6.248 -20.454 1.00 41.41 C ATOM 1143 C TYR A 76 -1.885 6.337 -18.949 1.00 73.33 C ATOM 1144 O TYR A 76 -2.563 7.047 -18.209 1.00 3.33 O ATOM 1145 CB TYR A 76 -2.718 4.817 -20.819 1.00 73.24 C ATOM 1146 CG TYR A 76 -3.739 4.243 -19.810 1.00 54.43 C ATOM 1147 CD1 TYR A 76 -5.071 4.674 -19.786 1.00 61.12 C ATOM 1148 CD2 TYR A 76 -3.345 3.315 -18.833 1.00 43.22 C ATOM 1149 CE1 TYR A 76 -5.962 4.199 -18.828 1.00 62.25 C ATOM 1150 CE2 TYR A 76 -4.234 2.836 -17.893 1.00 13.34 C ATOM 1151 CZ TYR A 76 -5.531 3.282 -17.884 1.00 34.54 C ATOM 1152 OH TYR A 76 -6.387 2.821 -16.906 1.00 71.03 O ATOM 0 H TYR A 76 -0.692 5.903 -21.906 1.00 20.04 H new ATOM 0 HA TYR A 76 -2.993 6.956 -20.692 1.00 41.41 H new ATOM 0 HB2 TYR A 76 -3.178 4.849 -21.807 1.00 73.24 H new ATOM 0 HB3 TYR A 76 -1.867 4.139 -20.885 1.00 73.24 H new ATOM 0 HD1 TYR A 76 -5.412 5.386 -20.523 1.00 61.12 H new ATOM 0 HD2 TYR A 76 -2.322 2.968 -18.817 1.00 43.22 H new ATOM 0 HE1 TYR A 76 -6.985 4.544 -18.821 1.00 62.25 H new ATOM 0 HE2 TYR A 76 -3.908 2.109 -17.164 1.00 13.34 H new ATOM 0 HH TYR A 76 -7.223 2.518 -17.319 1.00 71.03 H new ATOM 1162 N ASP A 77 -0.828 5.620 -18.544 1.00 65.32 N ATOM 1163 CA ASP A 77 -0.406 5.470 -17.134 1.00 21.44 C ATOM 1164 C ASP A 77 -0.002 6.832 -16.526 1.00 73.21 C ATOM 1165 O ASP A 77 -0.160 7.063 -15.325 1.00 75.41 O ATOM 1166 CB ASP A 77 0.786 4.470 -17.064 1.00 4.11 C ATOM 1167 CG ASP A 77 0.469 3.071 -17.640 1.00 11.55 C ATOM 1168 OD1 ASP A 77 0.532 2.066 -16.898 1.00 43.30 O ATOM 1169 OD2 ASP A 77 0.160 2.968 -18.852 1.00 62.40 O ATOM 0 H ASP A 77 -0.227 5.116 -19.196 1.00 65.32 H new ATOM 0 HA ASP A 77 -1.244 5.085 -16.553 1.00 21.44 H new ATOM 0 HB2 ASP A 77 1.632 4.891 -17.606 1.00 4.11 H new ATOM 0 HB3 ASP A 77 1.095 4.362 -16.024 1.00 4.11 H new ATOM 1174 N ARG A 78 0.507 7.716 -17.396 1.00 73.15 N ATOM 1175 CA ARG A 78 0.951 9.076 -17.040 1.00 54.14 C ATOM 1176 C ARG A 78 -0.253 9.992 -16.758 1.00 4.44 C ATOM 1177 O ARG A 78 -0.370 10.584 -15.676 1.00 23.31 O ATOM 1178 CB ARG A 78 1.770 9.639 -18.231 1.00 74.42 C ATOM 1179 CG ARG A 78 2.276 11.083 -18.059 1.00 63.24 C ATOM 1180 CD ARG A 78 2.767 11.689 -19.388 1.00 1.21 C ATOM 1181 NE ARG A 78 1.687 11.770 -20.398 1.00 60.01 N ATOM 1182 CZ ARG A 78 1.871 12.004 -21.714 1.00 2.04 C ATOM 1183 NH1 ARG A 78 3.094 12.176 -22.214 1.00 12.52 N ATOM 1184 NH2 ARG A 78 0.823 12.033 -22.525 1.00 33.54 N ATOM 0 H ARG A 78 0.625 7.504 -18.387 1.00 73.15 H new ATOM 0 HA ARG A 78 1.559 9.037 -16.136 1.00 54.14 H new ATOM 0 HB2 ARG A 78 2.628 8.989 -18.400 1.00 74.42 H new ATOM 0 HB3 ARG A 78 1.153 9.592 -19.129 1.00 74.42 H new ATOM 0 HG2 ARG A 78 1.475 11.701 -17.654 1.00 63.24 H new ATOM 0 HG3 ARG A 78 3.089 11.098 -17.333 1.00 63.24 H new ATOM 0 HD2 ARG A 78 3.167 12.686 -19.205 1.00 1.21 H new ATOM 0 HD3 ARG A 78 3.585 11.085 -19.781 1.00 1.21 H new ATOM 0 HE ARG A 78 0.729 11.639 -20.073 1.00 60.01 H new ATOM 0 HH11 ARG A 78 3.907 12.132 -21.600 1.00 12.52 H new ATOM 0 HH12 ARG A 78 3.217 12.352 -23.211 1.00 12.52 H new ATOM 0 HH21 ARG A 78 -0.114 11.879 -22.153 1.00 33.54 H new ATOM 0 HH22 ARG A 78 0.954 12.209 -23.521 1.00 33.54 H new ATOM 1198 N ASP A 79 -1.158 10.061 -17.747 1.00 63.44 N ATOM 1199 CA ASP A 79 -2.320 10.966 -17.731 1.00 31.53 C ATOM 1200 C ASP A 79 -3.381 10.491 -16.731 1.00 12.42 C ATOM 1201 O ASP A 79 -4.217 11.283 -16.292 1.00 43.11 O ATOM 1202 CB ASP A 79 -2.919 11.131 -19.152 1.00 75.34 C ATOM 1203 CG ASP A 79 -1.952 11.805 -20.145 1.00 51.12 C ATOM 1204 OD1 ASP A 79 -1.458 12.914 -19.855 1.00 12.10 O ATOM 1205 OD2 ASP A 79 -1.693 11.252 -21.229 1.00 50.30 O ATOM 0 H ASP A 79 -1.104 9.486 -18.588 1.00 63.44 H new ATOM 0 HA ASP A 79 -1.974 11.946 -17.402 1.00 31.53 H new ATOM 0 HB2 ASP A 79 -3.199 10.151 -19.537 1.00 75.34 H new ATOM 0 HB3 ASP A 79 -3.833 11.721 -19.088 1.00 75.34 H new ATOM 1210 N PHE A 80 -3.336 9.192 -16.399 1.00 54.41 N ATOM 1211 CA PHE A 80 -4.187 8.580 -15.366 1.00 24.23 C ATOM 1212 C PHE A 80 -3.989 9.287 -14.003 1.00 24.24 C ATOM 1213 O PHE A 80 -4.959 9.589 -13.296 1.00 21.41 O ATOM 1214 CB PHE A 80 -3.848 7.060 -15.246 1.00 21.41 C ATOM 1215 CG PHE A 80 -4.762 6.301 -14.301 1.00 20.14 C ATOM 1216 CD1 PHE A 80 -5.937 5.718 -14.766 1.00 51.13 C ATOM 1217 CD2 PHE A 80 -4.463 6.197 -12.941 1.00 72.40 C ATOM 1218 CE1 PHE A 80 -6.778 5.058 -13.900 1.00 75.24 C ATOM 1219 CE2 PHE A 80 -5.308 5.538 -12.083 1.00 33.11 C ATOM 1220 CZ PHE A 80 -6.459 4.970 -12.558 1.00 54.15 C ATOM 0 H PHE A 80 -2.701 8.529 -16.845 1.00 54.41 H new ATOM 0 HA PHE A 80 -5.232 8.694 -15.655 1.00 24.23 H new ATOM 0 HB2 PHE A 80 -3.905 6.605 -16.235 1.00 21.41 H new ATOM 0 HB3 PHE A 80 -2.818 6.953 -14.905 1.00 21.41 H new ATOM 0 HD1 PHE A 80 -6.190 5.784 -15.814 1.00 51.13 H new ATOM 0 HD2 PHE A 80 -3.555 6.641 -12.559 1.00 72.40 H new ATOM 0 HE1 PHE A 80 -7.688 4.608 -14.269 1.00 75.24 H new ATOM 0 HE2 PHE A 80 -5.065 5.468 -11.033 1.00 33.11 H new ATOM 0 HZ PHE A 80 -7.121 4.451 -11.881 1.00 54.15 H new ATOM 1230 N CYS A 81 -2.713 9.563 -13.676 1.00 31.41 N ATOM 1231 CA CYS A 81 -2.309 10.168 -12.390 1.00 11.42 C ATOM 1232 C CYS A 81 -2.647 11.677 -12.318 1.00 15.21 C ATOM 1233 O CYS A 81 -2.569 12.278 -11.236 1.00 0.15 O ATOM 1234 CB CYS A 81 -0.795 9.943 -12.173 1.00 14.21 C ATOM 1235 SG CYS A 81 -0.313 8.204 -12.161 1.00 73.12 S ATOM 0 H CYS A 81 -1.928 9.372 -14.299 1.00 31.41 H new ATOM 0 HA CYS A 81 -2.875 9.681 -11.596 1.00 11.42 H new ATOM 0 HB2 CYS A 81 -0.244 10.458 -12.960 1.00 14.21 H new ATOM 0 HB3 CYS A 81 -0.501 10.399 -11.227 1.00 14.21 H new ATOM 0 HG CYS A 81 -0.255 7.761 -13.382 1.00 73.12 H new ATOM 1241 N LYS A 82 -3.019 12.277 -13.472 1.00 14.04 N ATOM 1242 CA LYS A 82 -3.377 13.705 -13.564 1.00 3.42 C ATOM 1243 C LYS A 82 -4.814 13.941 -13.052 1.00 70.20 C ATOM 1244 O LYS A 82 -5.768 14.034 -13.833 1.00 30.33 O ATOM 1245 CB LYS A 82 -3.241 14.211 -15.018 1.00 53.20 C ATOM 1246 CG LYS A 82 -1.817 14.153 -15.600 1.00 34.13 C ATOM 1247 CD LYS A 82 -1.761 14.750 -17.024 1.00 44.51 C ATOM 1248 CE LYS A 82 -2.199 16.223 -17.056 1.00 34.23 C ATOM 1249 NZ LYS A 82 -2.218 16.779 -18.433 1.00 4.03 N ATOM 0 H LYS A 82 -3.078 11.783 -14.362 1.00 14.04 H new ATOM 0 HA LYS A 82 -2.686 14.266 -12.935 1.00 3.42 H new ATOM 0 HB2 LYS A 82 -3.901 13.622 -15.654 1.00 53.20 H new ATOM 0 HB3 LYS A 82 -3.593 15.242 -15.062 1.00 53.20 H new ATOM 0 HG2 LYS A 82 -1.134 14.699 -14.949 1.00 34.13 H new ATOM 0 HG3 LYS A 82 -1.475 13.118 -15.625 1.00 34.13 H new ATOM 0 HD2 LYS A 82 -0.745 14.667 -17.411 1.00 44.51 H new ATOM 0 HD3 LYS A 82 -2.403 14.168 -17.685 1.00 44.51 H new ATOM 0 HE2 LYS A 82 -3.193 16.313 -16.617 1.00 34.23 H new ATOM 0 HE3 LYS A 82 -1.523 16.814 -16.438 1.00 34.23 H new ATOM 0 HZ1 LYS A 82 -2.520 17.774 -18.402 1.00 4.03 H new ATOM 0 HZ2 LYS A 82 -1.265 16.719 -18.845 1.00 4.03 H new ATOM 0 HZ3 LYS A 82 -2.883 16.234 -19.018 1.00 4.03 H new ATOM 1263 N VAL A 83 -4.956 13.981 -11.731 1.00 34.02 N ATOM 1264 CA VAL A 83 -6.229 14.249 -11.044 1.00 35.54 C ATOM 1265 C VAL A 83 -6.010 15.347 -9.986 1.00 53.13 C ATOM 1266 O VAL A 83 -4.866 15.762 -9.755 1.00 33.43 O ATOM 1267 CB VAL A 83 -6.799 12.928 -10.378 1.00 41.32 C ATOM 1268 CG1 VAL A 83 -7.234 11.883 -11.446 1.00 44.25 C ATOM 1269 CG2 VAL A 83 -5.768 12.314 -9.396 1.00 71.13 C ATOM 0 H VAL A 83 -4.178 13.826 -11.089 1.00 34.02 H new ATOM 0 HA VAL A 83 -6.965 14.593 -11.771 1.00 35.54 H new ATOM 0 HB VAL A 83 -7.688 13.208 -9.813 1.00 41.32 H new ATOM 0 HG11 VAL A 83 -7.619 10.993 -10.948 1.00 44.25 H new ATOM 0 HG12 VAL A 83 -8.013 12.311 -12.078 1.00 44.25 H new ATOM 0 HG13 VAL A 83 -6.376 11.613 -12.061 1.00 44.25 H new ATOM 0 HG21 VAL A 83 -6.183 11.409 -8.952 1.00 71.13 H new ATOM 0 HG22 VAL A 83 -4.854 12.068 -9.936 1.00 71.13 H new ATOM 0 HG23 VAL A 83 -5.542 13.033 -8.609 1.00 71.13 H new ATOM 1279 N ASP A 84 -7.100 15.817 -9.360 1.00 4.31 N ATOM 1280 CA ASP A 84 -7.028 16.797 -8.247 1.00 44.41 C ATOM 1281 C ASP A 84 -6.327 16.172 -7.029 1.00 71.44 C ATOM 1282 O ASP A 84 -6.245 14.953 -6.937 1.00 21.34 O ATOM 1283 CB ASP A 84 -8.452 17.266 -7.853 1.00 52.43 C ATOM 1284 CG ASP A 84 -9.151 18.028 -8.984 1.00 73.53 C ATOM 1285 OD1 ASP A 84 -9.772 17.383 -9.857 1.00 65.25 O ATOM 1286 OD2 ASP A 84 -9.062 19.277 -9.020 1.00 61.24 O ATOM 0 H ASP A 84 -8.050 15.537 -9.602 1.00 4.31 H new ATOM 0 HA ASP A 84 -6.451 17.659 -8.582 1.00 44.41 H new ATOM 0 HB2 ASP A 84 -9.053 16.400 -7.577 1.00 52.43 H new ATOM 0 HB3 ASP A 84 -8.390 17.905 -6.972 1.00 52.43 H new ATOM 1291 N GLN A 85 -5.835 17.025 -6.106 1.00 53.21 N ATOM 1292 CA GLN A 85 -5.149 16.574 -4.869 1.00 61.51 C ATOM 1293 C GLN A 85 -6.079 15.682 -3.981 1.00 32.32 C ATOM 1294 O GLN A 85 -5.645 14.596 -3.578 1.00 61.10 O ATOM 1295 CB GLN A 85 -4.540 17.781 -4.050 1.00 5.04 C ATOM 1296 CG GLN A 85 -2.996 17.771 -3.838 1.00 74.42 C ATOM 1297 CD GLN A 85 -2.431 16.543 -3.095 1.00 3.00 C ATOM 1298 OE1 GLN A 85 -2.864 15.407 -3.273 1.00 3.55 O ATOM 1299 NE2 GLN A 85 -1.472 16.772 -2.215 1.00 2.44 N ATOM 0 H GLN A 85 -5.899 18.039 -6.193 1.00 53.21 H new ATOM 0 HA GLN A 85 -4.311 15.953 -5.184 1.00 61.51 H new ATOM 0 HB2 GLN A 85 -4.808 18.707 -4.558 1.00 5.04 H new ATOM 0 HB3 GLN A 85 -5.018 17.804 -3.071 1.00 5.04 H new ATOM 0 HG2 GLN A 85 -2.513 17.836 -4.813 1.00 74.42 H new ATOM 0 HG3 GLN A 85 -2.718 18.668 -3.284 1.00 74.42 H new ATOM 0 HE21 GLN A 85 -1.122 17.720 -2.077 1.00 2.44 H new ATOM 0 HE22 GLN A 85 -1.082 16.001 -1.673 1.00 2.44 H new ATOM 1308 N PRO A 86 -7.373 16.091 -3.665 1.00 53.21 N ATOM 1309 CA PRO A 86 -8.316 15.197 -2.930 1.00 22.25 C ATOM 1310 C PRO A 86 -8.588 13.883 -3.703 1.00 33.11 C ATOM 1311 O PRO A 86 -8.602 12.812 -3.100 1.00 31.14 O ATOM 1312 CB PRO A 86 -9.605 16.054 -2.773 1.00 54.13 C ATOM 1313 CG PRO A 86 -9.493 17.112 -3.833 1.00 4.10 C ATOM 1314 CD PRO A 86 -8.014 17.416 -3.934 1.00 44.32 C ATOM 0 HA PRO A 86 -7.915 14.872 -1.970 1.00 22.25 H new ATOM 0 HB2 PRO A 86 -10.501 15.449 -2.911 1.00 54.13 H new ATOM 0 HB3 PRO A 86 -9.668 16.495 -1.778 1.00 54.13 H new ATOM 0 HG2 PRO A 86 -9.889 16.759 -4.785 1.00 4.10 H new ATOM 0 HG3 PRO A 86 -10.061 18.002 -3.563 1.00 4.10 H new ATOM 0 HD2 PRO A 86 -7.748 17.799 -4.919 1.00 44.32 H new ATOM 0 HD3 PRO A 86 -7.707 18.167 -3.206 1.00 44.32 H new ATOM 1322 N THR A 87 -8.745 13.999 -5.037 1.00 31.00 N ATOM 1323 CA THR A 87 -8.994 12.854 -5.940 1.00 64.14 C ATOM 1324 C THR A 87 -7.776 11.896 -5.986 1.00 22.30 C ATOM 1325 O THR A 87 -7.932 10.685 -6.164 1.00 60.22 O ATOM 1326 CB THR A 87 -9.320 13.380 -7.380 1.00 5.11 C ATOM 1327 OG1 THR A 87 -10.285 14.443 -7.293 1.00 0.22 O ATOM 1328 CG2 THR A 87 -9.865 12.278 -8.314 1.00 54.12 C ATOM 0 H THR A 87 -8.703 14.895 -5.523 1.00 31.00 H new ATOM 0 HA THR A 87 -9.845 12.293 -5.554 1.00 64.14 H new ATOM 0 HB THR A 87 -8.384 13.736 -7.810 1.00 5.11 H new ATOM 0 HG1 THR A 87 -10.382 14.870 -8.170 1.00 0.22 H new ATOM 0 HG21 THR A 87 -10.072 12.703 -9.296 1.00 54.12 H new ATOM 0 HG22 THR A 87 -9.124 11.484 -8.411 1.00 54.12 H new ATOM 0 HG23 THR A 87 -10.784 11.868 -7.895 1.00 54.12 H new ATOM 1336 N LEU A 88 -6.572 12.471 -5.804 1.00 34.31 N ATOM 1337 CA LEU A 88 -5.294 11.734 -5.808 1.00 43.53 C ATOM 1338 C LEU A 88 -5.214 10.886 -4.531 1.00 72.01 C ATOM 1339 O LEU A 88 -4.891 9.697 -4.589 1.00 24.22 O ATOM 1340 CB LEU A 88 -4.103 12.749 -5.925 1.00 2.15 C ATOM 1341 CG LEU A 88 -2.714 12.202 -6.424 1.00 22.15 C ATOM 1342 CD1 LEU A 88 -1.759 13.366 -6.769 1.00 35.42 C ATOM 1343 CD2 LEU A 88 -2.052 11.253 -5.401 1.00 43.54 C ATOM 0 H LEU A 88 -6.458 13.473 -5.648 1.00 34.31 H new ATOM 0 HA LEU A 88 -5.232 11.064 -6.665 1.00 43.53 H new ATOM 0 HB2 LEU A 88 -4.410 13.548 -6.600 1.00 2.15 H new ATOM 0 HB3 LEU A 88 -3.952 13.201 -4.945 1.00 2.15 H new ATOM 0 HG LEU A 88 -2.910 11.622 -7.326 1.00 22.15 H new ATOM 0 HD11 LEU A 88 -0.805 12.965 -7.112 1.00 35.42 H new ATOM 0 HD12 LEU A 88 -2.200 13.977 -7.557 1.00 35.42 H new ATOM 0 HD13 LEU A 88 -1.597 13.979 -5.882 1.00 35.42 H new ATOM 0 HD21 LEU A 88 -1.097 10.904 -5.794 1.00 43.54 H new ATOM 0 HD22 LEU A 88 -1.886 11.786 -4.465 1.00 43.54 H new ATOM 0 HD23 LEU A 88 -2.705 10.399 -5.222 1.00 43.54 H new ATOM 1355 N PHE A 89 -5.549 11.518 -3.385 1.00 73.14 N ATOM 1356 CA PHE A 89 -5.625 10.829 -2.086 1.00 63.24 C ATOM 1357 C PHE A 89 -6.703 9.727 -2.110 1.00 53.31 C ATOM 1358 O PHE A 89 -6.531 8.700 -1.476 1.00 1.53 O ATOM 1359 CB PHE A 89 -5.899 11.829 -0.933 1.00 35.21 C ATOM 1360 CG PHE A 89 -4.734 12.775 -0.604 1.00 4.41 C ATOM 1361 CD1 PHE A 89 -3.444 12.282 -0.381 1.00 3.04 C ATOM 1362 CD2 PHE A 89 -4.935 14.154 -0.482 1.00 42.41 C ATOM 1363 CE1 PHE A 89 -2.402 13.134 -0.051 1.00 31.43 C ATOM 1364 CE2 PHE A 89 -3.891 15.003 -0.155 1.00 72.31 C ATOM 1365 CZ PHE A 89 -2.625 14.493 0.061 1.00 33.41 C ATOM 0 H PHE A 89 -5.772 12.512 -3.338 1.00 73.14 H new ATOM 0 HA PHE A 89 -4.657 10.362 -1.905 1.00 63.24 H new ATOM 0 HB2 PHE A 89 -6.772 12.428 -1.192 1.00 35.21 H new ATOM 0 HB3 PHE A 89 -6.154 11.265 -0.036 1.00 35.21 H new ATOM 0 HD1 PHE A 89 -3.257 11.222 -0.467 1.00 3.04 H new ATOM 0 HD2 PHE A 89 -5.921 14.563 -0.646 1.00 42.41 H new ATOM 0 HE1 PHE A 89 -1.413 12.735 0.119 1.00 31.43 H new ATOM 0 HE2 PHE A 89 -4.066 16.065 -0.069 1.00 72.31 H new ATOM 0 HZ PHE A 89 -1.811 15.155 0.317 1.00 33.41 H new ATOM 1375 N GLU A 90 -7.788 9.955 -2.878 1.00 1.23 N ATOM 1376 CA GLU A 90 -8.861 8.952 -3.080 1.00 14.33 C ATOM 1377 C GLU A 90 -8.334 7.703 -3.817 1.00 34.23 C ATOM 1378 O GLU A 90 -8.736 6.583 -3.502 1.00 74.35 O ATOM 1379 CB GLU A 90 -10.048 9.561 -3.869 1.00 65.11 C ATOM 1380 CG GLU A 90 -10.876 10.601 -3.096 1.00 43.23 C ATOM 1381 CD GLU A 90 -11.539 10.026 -1.834 1.00 54.21 C ATOM 1382 OE1 GLU A 90 -12.544 9.289 -1.966 1.00 55.50 O ATOM 1383 OE2 GLU A 90 -11.071 10.320 -0.713 1.00 40.53 O ATOM 0 H GLU A 90 -7.947 10.832 -3.374 1.00 1.23 H new ATOM 0 HA GLU A 90 -9.209 8.650 -2.092 1.00 14.33 H new ATOM 0 HB2 GLU A 90 -9.661 10.027 -4.775 1.00 65.11 H new ATOM 0 HB3 GLU A 90 -10.709 8.753 -4.183 1.00 65.11 H new ATOM 0 HG2 GLU A 90 -10.231 11.433 -2.813 1.00 43.23 H new ATOM 0 HG3 GLU A 90 -11.647 11.004 -3.753 1.00 43.23 H new ATOM 1390 N LEU A 91 -7.440 7.919 -4.805 1.00 42.30 N ATOM 1391 CA LEU A 91 -6.785 6.822 -5.551 1.00 65.12 C ATOM 1392 C LEU A 91 -5.824 6.032 -4.631 1.00 13.13 C ATOM 1393 O LEU A 91 -5.728 4.805 -4.738 1.00 73.40 O ATOM 1394 CB LEU A 91 -6.023 7.368 -6.797 1.00 43.54 C ATOM 1395 CG LEU A 91 -6.882 8.095 -7.891 1.00 62.42 C ATOM 1396 CD1 LEU A 91 -5.996 8.571 -9.070 1.00 22.14 C ATOM 1397 CD2 LEU A 91 -8.047 7.206 -8.395 1.00 5.31 C ATOM 0 H LEU A 91 -7.153 8.850 -5.107 1.00 42.30 H new ATOM 0 HA LEU A 91 -7.563 6.144 -5.901 1.00 65.12 H new ATOM 0 HB2 LEU A 91 -5.258 8.062 -6.450 1.00 43.54 H new ATOM 0 HB3 LEU A 91 -5.505 6.534 -7.271 1.00 43.54 H new ATOM 0 HG LEU A 91 -7.324 8.974 -7.422 1.00 62.42 H new ATOM 0 HD11 LEU A 91 -6.617 9.071 -9.813 1.00 22.14 H new ATOM 0 HD12 LEU A 91 -5.241 9.266 -8.701 1.00 22.14 H new ATOM 0 HD13 LEU A 91 -5.505 7.711 -9.527 1.00 22.14 H new ATOM 0 HD21 LEU A 91 -8.617 7.747 -9.151 1.00 5.31 H new ATOM 0 HD22 LEU A 91 -7.645 6.291 -8.829 1.00 5.31 H new ATOM 0 HD23 LEU A 91 -8.700 6.954 -7.560 1.00 5.31 H new ATOM 1409 N ILE A 92 -5.138 6.759 -3.714 1.00 35.32 N ATOM 1410 CA ILE A 92 -4.257 6.157 -2.681 1.00 1.53 C ATOM 1411 C ILE A 92 -5.096 5.287 -1.720 1.00 3.52 C ATOM 1412 O ILE A 92 -4.740 4.144 -1.438 1.00 21.25 O ATOM 1413 CB ILE A 92 -3.474 7.255 -1.845 1.00 64.01 C ATOM 1414 CG1 ILE A 92 -2.592 8.145 -2.778 1.00 64.43 C ATOM 1415 CG2 ILE A 92 -2.613 6.608 -0.722 1.00 13.55 C ATOM 1416 CD1 ILE A 92 -1.828 9.257 -2.073 1.00 42.14 C ATOM 0 H ILE A 92 -5.180 7.777 -3.670 1.00 35.32 H new ATOM 0 HA ILE A 92 -3.520 5.545 -3.201 1.00 1.53 H new ATOM 0 HB ILE A 92 -4.216 7.894 -1.367 1.00 64.01 H new ATOM 0 HG12 ILE A 92 -1.877 7.505 -3.296 1.00 64.43 H new ATOM 0 HG13 ILE A 92 -3.231 8.591 -3.540 1.00 64.43 H new ATOM 0 HG21 ILE A 92 -2.090 7.388 -0.169 1.00 13.55 H new ATOM 0 HG22 ILE A 92 -3.259 6.053 -0.042 1.00 13.55 H new ATOM 0 HG23 ILE A 92 -1.885 5.929 -1.167 1.00 13.55 H new ATOM 0 HD11 ILE A 92 -1.246 9.818 -2.804 1.00 42.14 H new ATOM 0 HD12 ILE A 92 -2.533 9.926 -1.579 1.00 42.14 H new ATOM 0 HD13 ILE A 92 -1.158 8.824 -1.331 1.00 42.14 H new ATOM 1428 N LEU A 93 -6.238 5.850 -1.270 1.00 55.30 N ATOM 1429 CA LEU A 93 -7.137 5.212 -0.290 1.00 53.53 C ATOM 1430 C LEU A 93 -7.818 3.970 -0.888 1.00 25.32 C ATOM 1431 O LEU A 93 -7.978 2.980 -0.198 1.00 31.00 O ATOM 1432 CB LEU A 93 -8.209 6.226 0.220 1.00 52.52 C ATOM 1433 CG LEU A 93 -7.678 7.404 1.105 1.00 33.15 C ATOM 1434 CD1 LEU A 93 -8.802 8.424 1.409 1.00 34.54 C ATOM 1435 CD2 LEU A 93 -7.020 6.880 2.405 1.00 0.50 C ATOM 0 H LEU A 93 -6.562 6.766 -1.580 1.00 55.30 H new ATOM 0 HA LEU A 93 -6.531 4.892 0.557 1.00 53.53 H new ATOM 0 HB2 LEU A 93 -8.719 6.650 -0.645 1.00 52.52 H new ATOM 0 HB3 LEU A 93 -8.956 5.676 0.793 1.00 52.52 H new ATOM 0 HG LEU A 93 -6.906 7.924 0.537 1.00 33.15 H new ATOM 0 HD11 LEU A 93 -8.404 9.231 2.025 1.00 34.54 H new ATOM 0 HD12 LEU A 93 -9.183 8.835 0.474 1.00 34.54 H new ATOM 0 HD13 LEU A 93 -9.611 7.925 1.942 1.00 34.54 H new ATOM 0 HD21 LEU A 93 -6.662 7.722 2.997 1.00 0.50 H new ATOM 0 HD22 LEU A 93 -7.753 6.317 2.982 1.00 0.50 H new ATOM 0 HD23 LEU A 93 -6.181 6.232 2.152 1.00 0.50 H new ATOM 1447 N ALA A 94 -8.191 4.046 -2.180 1.00 14.23 N ATOM 1448 CA ALA A 94 -8.874 2.946 -2.900 1.00 1.52 C ATOM 1449 C ALA A 94 -7.915 1.776 -3.158 1.00 61.31 C ATOM 1450 O ALA A 94 -8.282 0.602 -3.013 1.00 2.54 O ATOM 1451 CB ALA A 94 -9.448 3.465 -4.227 1.00 44.20 C ATOM 0 H ALA A 94 -8.029 4.871 -2.757 1.00 14.23 H new ATOM 0 HA ALA A 94 -9.689 2.582 -2.275 1.00 1.52 H new ATOM 0 HB1 ALA A 94 -9.948 2.650 -4.750 1.00 44.20 H new ATOM 0 HB2 ALA A 94 -10.164 4.262 -4.027 1.00 44.20 H new ATOM 0 HB3 ALA A 94 -8.639 3.852 -4.847 1.00 44.20 H new ATOM 1457 N ALA A 95 -6.675 2.130 -3.536 1.00 74.52 N ATOM 1458 CA ALA A 95 -5.598 1.164 -3.783 1.00 53.53 C ATOM 1459 C ALA A 95 -5.141 0.498 -2.472 1.00 43.13 C ATOM 1460 O ALA A 95 -4.787 -0.670 -2.467 1.00 34.33 O ATOM 1461 CB ALA A 95 -4.422 1.859 -4.473 1.00 41.22 C ATOM 0 H ALA A 95 -6.393 3.100 -3.679 1.00 74.52 H new ATOM 0 HA ALA A 95 -5.980 0.381 -4.438 1.00 53.53 H new ATOM 0 HB1 ALA A 95 -3.627 1.136 -4.653 1.00 41.22 H new ATOM 0 HB2 ALA A 95 -4.754 2.278 -5.423 1.00 41.22 H new ATOM 0 HB3 ALA A 95 -4.047 2.659 -3.835 1.00 41.22 H new ATOM 1467 N ASN A 96 -5.155 1.268 -1.370 1.00 71.14 N ATOM 1468 CA ASN A 96 -4.812 0.766 -0.015 1.00 13.11 C ATOM 1469 C ASN A 96 -5.973 -0.100 0.537 1.00 2.21 C ATOM 1470 O ASN A 96 -5.750 -1.104 1.216 1.00 15.50 O ATOM 1471 CB ASN A 96 -4.525 1.977 0.926 1.00 73.22 C ATOM 1472 CG ASN A 96 -3.849 1.622 2.261 1.00 72.13 C ATOM 1473 OD1 ASN A 96 -4.024 0.543 2.824 1.00 4.12 O ATOM 1474 ND2 ASN A 96 -3.073 2.550 2.789 1.00 71.01 N ATOM 0 H ASN A 96 -5.404 2.257 -1.387 1.00 71.14 H new ATOM 0 HA ASN A 96 -3.919 0.143 -0.068 1.00 13.11 H new ATOM 0 HB2 ASN A 96 -3.893 2.688 0.394 1.00 73.22 H new ATOM 0 HB3 ASN A 96 -5.467 2.484 1.137 1.00 73.22 H new ATOM 0 HD21 ASN A 96 -2.606 2.378 3.679 1.00 71.01 H new ATOM 0 HD22 ASN A 96 -2.940 3.439 2.307 1.00 71.01 H new ATOM 1481 N TYR A 97 -7.209 0.304 0.197 1.00 33.54 N ATOM 1482 CA TYR A 97 -8.457 -0.358 0.642 1.00 0.01 C ATOM 1483 C TYR A 97 -8.566 -1.771 0.064 1.00 11.24 C ATOM 1484 O TYR A 97 -9.064 -2.687 0.725 1.00 72.34 O ATOM 1485 CB TYR A 97 -9.680 0.499 0.208 1.00 13.15 C ATOM 1486 CG TYR A 97 -11.059 -0.031 0.622 1.00 50.14 C ATOM 1487 CD1 TYR A 97 -11.998 -0.449 -0.331 1.00 25.30 C ATOM 1488 CD2 TYR A 97 -11.439 -0.077 1.967 1.00 21.52 C ATOM 1489 CE1 TYR A 97 -13.255 -0.879 0.045 1.00 34.52 C ATOM 1490 CE2 TYR A 97 -12.690 -0.521 2.343 1.00 45.31 C ATOM 1491 CZ TYR A 97 -13.593 -0.915 1.382 1.00 10.13 C ATOM 1492 OH TYR A 97 -14.859 -1.293 1.763 1.00 74.21 O ATOM 0 H TYR A 97 -7.376 1.111 -0.404 1.00 33.54 H new ATOM 0 HA TYR A 97 -8.440 -0.443 1.729 1.00 0.01 H new ATOM 0 HB2 TYR A 97 -9.560 1.501 0.620 1.00 13.15 H new ATOM 0 HB3 TYR A 97 -9.662 0.597 -0.877 1.00 13.15 H new ATOM 0 HD1 TYR A 97 -11.734 -0.434 -1.378 1.00 25.30 H new ATOM 0 HD2 TYR A 97 -10.740 0.241 2.726 1.00 21.52 H new ATOM 0 HE1 TYR A 97 -13.970 -1.186 -0.704 1.00 34.52 H new ATOM 0 HE2 TYR A 97 -12.960 -0.559 3.388 1.00 45.31 H new ATOM 0 HH TYR A 97 -14.929 -1.265 2.740 1.00 74.21 H new ATOM 1502 N LEU A 98 -8.112 -1.925 -1.192 1.00 12.03 N ATOM 1503 CA LEU A 98 -8.149 -3.211 -1.906 1.00 14.32 C ATOM 1504 C LEU A 98 -6.765 -3.894 -1.945 1.00 24.33 C ATOM 1505 O LEU A 98 -6.677 -5.048 -2.356 1.00 43.31 O ATOM 1506 CB LEU A 98 -8.715 -3.015 -3.333 1.00 74.50 C ATOM 1507 CG LEU A 98 -10.195 -2.524 -3.415 1.00 21.14 C ATOM 1508 CD1 LEU A 98 -10.663 -2.398 -4.883 1.00 12.04 C ATOM 1509 CD2 LEU A 98 -11.136 -3.448 -2.598 1.00 10.53 C ATOM 0 H LEU A 98 -7.710 -1.163 -1.739 1.00 12.03 H new ATOM 0 HA LEU A 98 -8.812 -3.877 -1.355 1.00 14.32 H new ATOM 0 HB2 LEU A 98 -8.084 -2.298 -3.858 1.00 74.50 H new ATOM 0 HB3 LEU A 98 -8.636 -3.961 -3.868 1.00 74.50 H new ATOM 0 HG LEU A 98 -10.241 -1.530 -2.971 1.00 21.14 H new ATOM 0 HD11 LEU A 98 -11.697 -2.054 -4.907 1.00 12.04 H new ATOM 0 HD12 LEU A 98 -10.030 -1.681 -5.406 1.00 12.04 H new ATOM 0 HD13 LEU A 98 -10.592 -3.370 -5.372 1.00 12.04 H new ATOM 0 HD21 LEU A 98 -12.160 -3.082 -2.673 1.00 10.53 H new ATOM 0 HD22 LEU A 98 -11.083 -4.462 -2.993 1.00 10.53 H new ATOM 0 HD23 LEU A 98 -10.827 -3.449 -1.553 1.00 10.53 H new ATOM 1521 N ASP A 99 -5.713 -3.186 -1.484 1.00 25.34 N ATOM 1522 CA ASP A 99 -4.299 -3.656 -1.511 1.00 72.13 C ATOM 1523 C ASP A 99 -3.774 -3.823 -2.954 1.00 72.12 C ATOM 1524 O ASP A 99 -2.902 -4.661 -3.226 1.00 54.12 O ATOM 1525 CB ASP A 99 -4.091 -4.958 -0.682 1.00 52.23 C ATOM 1526 CG ASP A 99 -4.391 -4.814 0.819 1.00 5.31 C ATOM 1527 OD1 ASP A 99 -4.848 -5.798 1.444 1.00 33.10 O ATOM 1528 OD2 ASP A 99 -4.165 -3.732 1.375 1.00 13.33 O ATOM 0 H ASP A 99 -5.816 -2.257 -1.075 1.00 25.34 H new ATOM 0 HA ASP A 99 -3.708 -2.874 -1.034 1.00 72.13 H new ATOM 0 HB2 ASP A 99 -4.728 -5.741 -1.093 1.00 52.23 H new ATOM 0 HB3 ASP A 99 -3.060 -5.290 -0.803 1.00 52.23 H new ATOM 1533 N ILE A 100 -4.301 -2.984 -3.868 1.00 44.31 N ATOM 1534 CA ILE A 100 -3.808 -2.870 -5.246 1.00 65.25 C ATOM 1535 C ILE A 100 -2.480 -2.089 -5.240 1.00 13.44 C ATOM 1536 O ILE A 100 -2.464 -0.867 -5.415 1.00 54.42 O ATOM 1537 CB ILE A 100 -4.868 -2.161 -6.182 1.00 64.21 C ATOM 1538 CG1 ILE A 100 -6.219 -2.928 -6.109 1.00 44.34 C ATOM 1539 CG2 ILE A 100 -4.355 -2.049 -7.645 1.00 1.30 C ATOM 1540 CD1 ILE A 100 -7.382 -2.294 -6.847 1.00 54.13 C ATOM 0 H ILE A 100 -5.085 -2.365 -3.665 1.00 44.31 H new ATOM 0 HA ILE A 100 -3.644 -3.871 -5.646 1.00 65.25 H new ATOM 0 HB ILE A 100 -5.022 -1.142 -5.827 1.00 64.21 H new ATOM 0 HG12 ILE A 100 -6.066 -3.932 -6.505 1.00 44.34 H new ATOM 0 HG13 ILE A 100 -6.496 -3.038 -5.060 1.00 44.34 H new ATOM 0 HG21 ILE A 100 -5.110 -1.557 -8.259 1.00 1.30 H new ATOM 0 HG22 ILE A 100 -3.435 -1.465 -7.664 1.00 1.30 H new ATOM 0 HG23 ILE A 100 -4.160 -3.046 -8.040 1.00 1.30 H new ATOM 0 HD11 ILE A 100 -8.270 -2.914 -6.727 1.00 54.13 H new ATOM 0 HD12 ILE A 100 -7.574 -1.302 -6.439 1.00 54.13 H new ATOM 0 HD13 ILE A 100 -7.138 -2.210 -7.906 1.00 54.13 H new ATOM 1552 N LYS A 101 -1.383 -2.814 -4.978 1.00 30.43 N ATOM 1553 CA LYS A 101 -0.029 -2.246 -4.931 1.00 31.31 C ATOM 1554 C LYS A 101 0.431 -1.686 -6.311 1.00 41.24 C ATOM 1555 O LYS A 101 1.073 -0.639 -6.320 1.00 54.22 O ATOM 1556 CB LYS A 101 0.983 -3.283 -4.344 1.00 11.41 C ATOM 1557 CG LYS A 101 2.378 -2.705 -3.943 1.00 74.12 C ATOM 1558 CD LYS A 101 3.420 -2.684 -5.094 1.00 24.50 C ATOM 1559 CE LYS A 101 4.679 -1.865 -4.744 1.00 4.52 C ATOM 1560 NZ LYS A 101 5.344 -2.343 -3.508 1.00 72.32 N ATOM 0 H LYS A 101 -1.411 -3.816 -4.792 1.00 30.43 H new ATOM 0 HA LYS A 101 -0.055 -1.389 -4.258 1.00 31.31 H new ATOM 0 HB2 LYS A 101 0.534 -3.746 -3.465 1.00 11.41 H new ATOM 0 HB3 LYS A 101 1.134 -4.074 -5.079 1.00 11.41 H new ATOM 0 HG2 LYS A 101 2.244 -1.689 -3.573 1.00 74.12 H new ATOM 0 HG3 LYS A 101 2.778 -3.294 -3.118 1.00 74.12 H new ATOM 0 HD2 LYS A 101 3.712 -3.707 -5.333 1.00 24.50 H new ATOM 0 HD3 LYS A 101 2.958 -2.267 -5.989 1.00 24.50 H new ATOM 0 HE2 LYS A 101 5.383 -1.916 -5.574 1.00 4.52 H new ATOM 0 HE3 LYS A 101 4.404 -0.817 -4.623 1.00 4.52 H new ATOM 0 HZ1 LYS A 101 5.550 -1.533 -2.889 1.00 72.32 H new ATOM 0 HZ2 LYS A 101 4.717 -3.007 -3.011 1.00 72.32 H new ATOM 0 HZ3 LYS A 101 6.232 -2.824 -3.756 1.00 72.32 H new ATOM 1574 N PRO A 102 0.152 -2.362 -7.500 1.00 52.22 N ATOM 1575 CA PRO A 102 0.495 -1.802 -8.846 1.00 65.21 C ATOM 1576 C PRO A 102 0.098 -0.306 -9.034 1.00 74.22 C ATOM 1577 O PRO A 102 0.925 0.506 -9.459 1.00 74.13 O ATOM 1578 CB PRO A 102 -0.276 -2.727 -9.841 1.00 1.32 C ATOM 1579 CG PRO A 102 -1.139 -3.629 -8.996 1.00 23.34 C ATOM 1580 CD PRO A 102 -0.437 -3.731 -7.667 1.00 41.34 C ATOM 0 HA PRO A 102 1.574 -1.795 -9.002 1.00 65.21 H new ATOM 0 HB2 PRO A 102 -0.884 -2.138 -10.528 1.00 1.32 H new ATOM 0 HB3 PRO A 102 0.417 -3.309 -10.448 1.00 1.32 H new ATOM 0 HG2 PRO A 102 -2.141 -3.216 -8.879 1.00 23.34 H new ATOM 0 HG3 PRO A 102 -1.250 -4.610 -9.457 1.00 23.34 H new ATOM 0 HD2 PRO A 102 -1.129 -3.975 -6.861 1.00 41.34 H new ATOM 0 HD3 PRO A 102 0.331 -4.504 -7.673 1.00 41.34 H new ATOM 1588 N LEU A 103 -1.158 0.032 -8.691 1.00 2.00 N ATOM 1589 CA LEU A 103 -1.678 1.411 -8.814 1.00 33.42 C ATOM 1590 C LEU A 103 -1.121 2.286 -7.679 1.00 75.24 C ATOM 1591 O LEU A 103 -0.656 3.401 -7.926 1.00 74.11 O ATOM 1592 CB LEU A 103 -3.245 1.401 -8.832 1.00 43.45 C ATOM 1593 CG LEU A 103 -3.992 2.773 -9.093 1.00 34.12 C ATOM 1594 CD1 LEU A 103 -4.270 3.573 -7.792 1.00 24.21 C ATOM 1595 CD2 LEU A 103 -3.223 3.646 -10.123 1.00 64.44 C ATOM 0 H LEU A 103 -1.838 -0.634 -8.324 1.00 2.00 H new ATOM 0 HA LEU A 103 -1.345 1.842 -9.758 1.00 33.42 H new ATOM 0 HB2 LEU A 103 -3.566 0.695 -9.597 1.00 43.45 H new ATOM 0 HB3 LEU A 103 -3.588 1.011 -7.874 1.00 43.45 H new ATOM 0 HG LEU A 103 -4.964 2.513 -9.513 1.00 34.12 H new ATOM 0 HD11 LEU A 103 -4.783 4.502 -8.039 1.00 24.21 H new ATOM 0 HD12 LEU A 103 -4.896 2.979 -7.126 1.00 24.21 H new ATOM 0 HD13 LEU A 103 -3.326 3.801 -7.296 1.00 24.21 H new ATOM 0 HD21 LEU A 103 -3.761 4.581 -10.281 1.00 64.44 H new ATOM 0 HD22 LEU A 103 -2.224 3.862 -9.744 1.00 64.44 H new ATOM 0 HD23 LEU A 103 -3.144 3.109 -11.068 1.00 64.44 H new ATOM 1607 N LEU A 104 -1.148 1.732 -6.456 1.00 44.10 N ATOM 1608 CA LEU A 104 -0.706 2.414 -5.221 1.00 51.32 C ATOM 1609 C LEU A 104 0.721 2.976 -5.351 1.00 75.43 C ATOM 1610 O LEU A 104 0.986 4.106 -4.938 1.00 41.13 O ATOM 1611 CB LEU A 104 -0.768 1.407 -4.050 1.00 62.40 C ATOM 1612 CG LEU A 104 -0.288 1.899 -2.653 1.00 10.11 C ATOM 1613 CD1 LEU A 104 -1.230 2.973 -2.054 1.00 72.43 C ATOM 1614 CD2 LEU A 104 -0.104 0.699 -1.709 1.00 74.54 C ATOM 0 H LEU A 104 -1.482 0.783 -6.291 1.00 44.10 H new ATOM 0 HA LEU A 104 -1.370 3.259 -5.038 1.00 51.32 H new ATOM 0 HB2 LEU A 104 -1.800 1.069 -3.951 1.00 62.40 H new ATOM 0 HB3 LEU A 104 -0.172 0.536 -4.323 1.00 62.40 H new ATOM 0 HG LEU A 104 0.678 2.388 -2.778 1.00 10.11 H new ATOM 0 HD11 LEU A 104 -0.853 3.285 -1.080 1.00 72.43 H new ATOM 0 HD12 LEU A 104 -1.270 3.835 -2.720 1.00 72.43 H new ATOM 0 HD13 LEU A 104 -2.231 2.556 -1.940 1.00 72.43 H new ATOM 0 HD21 LEU A 104 0.232 1.051 -0.734 1.00 74.54 H new ATOM 0 HD22 LEU A 104 -1.053 0.174 -1.598 1.00 74.54 H new ATOM 0 HD23 LEU A 104 0.640 0.019 -2.125 1.00 74.54 H new ATOM 1626 N ASP A 105 1.615 2.170 -5.956 1.00 44.02 N ATOM 1627 CA ASP A 105 3.042 2.505 -6.115 1.00 45.22 C ATOM 1628 C ASP A 105 3.197 3.729 -7.027 1.00 53.30 C ATOM 1629 O ASP A 105 3.832 4.709 -6.651 1.00 54.42 O ATOM 1630 CB ASP A 105 3.829 1.298 -6.683 1.00 10.22 C ATOM 1631 CG ASP A 105 5.349 1.570 -6.747 1.00 14.31 C ATOM 1632 OD1 ASP A 105 6.044 1.365 -5.724 1.00 21.03 O ATOM 1633 OD2 ASP A 105 5.857 2.010 -7.806 1.00 33.32 O ATOM 0 H ASP A 105 1.365 1.263 -6.350 1.00 44.02 H new ATOM 0 HA ASP A 105 3.454 2.745 -5.135 1.00 45.22 H new ATOM 0 HB2 ASP A 105 3.644 0.421 -6.062 1.00 10.22 H new ATOM 0 HB3 ASP A 105 3.461 1.064 -7.682 1.00 10.22 H new ATOM 1638 N VAL A 106 2.550 3.655 -8.199 1.00 64.23 N ATOM 1639 CA VAL A 106 2.558 4.731 -9.209 1.00 70.11 C ATOM 1640 C VAL A 106 2.017 6.058 -8.615 1.00 43.44 C ATOM 1641 O VAL A 106 2.607 7.125 -8.811 1.00 4.14 O ATOM 1642 CB VAL A 106 1.705 4.302 -10.465 1.00 63.31 C ATOM 1643 CG1 VAL A 106 1.639 5.412 -11.541 1.00 1.25 C ATOM 1644 CG2 VAL A 106 2.251 2.984 -11.063 1.00 61.11 C ATOM 0 H VAL A 106 2.001 2.842 -8.478 1.00 64.23 H new ATOM 0 HA VAL A 106 3.589 4.899 -9.521 1.00 70.11 H new ATOM 0 HB VAL A 106 0.684 4.137 -10.122 1.00 63.31 H new ATOM 0 HG11 VAL A 106 1.041 5.066 -12.384 1.00 1.25 H new ATOM 0 HG12 VAL A 106 1.183 6.306 -11.114 1.00 1.25 H new ATOM 0 HG13 VAL A 106 2.647 5.647 -11.884 1.00 1.25 H new ATOM 0 HG21 VAL A 106 1.652 2.702 -11.929 1.00 61.11 H new ATOM 0 HG22 VAL A 106 3.287 3.125 -11.370 1.00 61.11 H new ATOM 0 HG23 VAL A 106 2.199 2.195 -10.313 1.00 61.11 H new ATOM 1654 N THR A 107 0.932 5.943 -7.830 1.00 32.43 N ATOM 1655 CA THR A 107 0.225 7.092 -7.229 1.00 35.45 C ATOM 1656 C THR A 107 1.046 7.716 -6.060 1.00 34.14 C ATOM 1657 O THR A 107 1.028 8.939 -5.851 1.00 52.33 O ATOM 1658 CB THR A 107 -1.201 6.630 -6.749 1.00 22.31 C ATOM 1659 OG1 THR A 107 -1.862 5.927 -7.815 1.00 75.43 O ATOM 1660 CG2 THR A 107 -2.100 7.798 -6.328 1.00 63.32 C ATOM 0 H THR A 107 0.516 5.043 -7.591 1.00 32.43 H new ATOM 0 HA THR A 107 0.110 7.872 -7.982 1.00 35.45 H new ATOM 0 HB THR A 107 -1.043 5.992 -5.880 1.00 22.31 H new ATOM 0 HG1 THR A 107 -1.467 5.036 -7.913 1.00 75.43 H new ATOM 0 HG21 THR A 107 -3.069 7.414 -6.008 1.00 63.32 H new ATOM 0 HG22 THR A 107 -1.633 8.338 -5.504 1.00 63.32 H new ATOM 0 HG23 THR A 107 -2.238 8.473 -7.172 1.00 63.32 H new ATOM 1668 N CYS A 108 1.801 6.861 -5.335 1.00 33.23 N ATOM 1669 CA CYS A 108 2.710 7.298 -4.248 1.00 12.11 C ATOM 1670 C CYS A 108 3.988 7.931 -4.829 1.00 41.12 C ATOM 1671 O CYS A 108 4.608 8.789 -4.200 1.00 32.32 O ATOM 1672 CB CYS A 108 3.059 6.123 -3.310 1.00 22.33 C ATOM 1673 SG CYS A 108 1.629 5.454 -2.428 1.00 52.24 S ATOM 0 H CYS A 108 1.799 5.852 -5.485 1.00 33.23 H new ATOM 0 HA CYS A 108 2.191 8.054 -3.659 1.00 12.11 H new ATOM 0 HB2 CYS A 108 3.520 5.327 -3.894 1.00 22.33 H new ATOM 0 HB3 CYS A 108 3.800 6.456 -2.584 1.00 22.33 H new ATOM 0 HG CYS A 108 0.989 4.628 -3.202 1.00 52.24 H new ATOM 1679 N LYS A 109 4.376 7.482 -6.033 1.00 14.12 N ATOM 1680 CA LYS A 109 5.510 8.056 -6.781 1.00 23.31 C ATOM 1681 C LYS A 109 5.121 9.424 -7.377 1.00 4.41 C ATOM 1682 O LYS A 109 5.972 10.291 -7.506 1.00 4.54 O ATOM 1683 CB LYS A 109 6.044 7.054 -7.862 1.00 61.45 C ATOM 1684 CG LYS A 109 7.193 6.112 -7.377 1.00 63.22 C ATOM 1685 CD LYS A 109 6.878 5.371 -6.051 1.00 44.22 C ATOM 1686 CE LYS A 109 8.010 4.433 -5.598 1.00 15.43 C ATOM 1687 NZ LYS A 109 8.229 3.310 -6.548 1.00 2.22 N ATOM 0 H LYS A 109 3.914 6.712 -6.517 1.00 14.12 H new ATOM 0 HA LYS A 109 6.336 8.227 -6.091 1.00 23.31 H new ATOM 0 HB2 LYS A 109 5.213 6.440 -8.209 1.00 61.45 H new ATOM 0 HB3 LYS A 109 6.399 7.624 -8.720 1.00 61.45 H new ATOM 0 HG2 LYS A 109 7.399 5.376 -8.154 1.00 63.22 H new ATOM 0 HG3 LYS A 109 8.102 6.700 -7.247 1.00 63.22 H new ATOM 0 HD2 LYS A 109 6.688 6.105 -5.268 1.00 44.22 H new ATOM 0 HD3 LYS A 109 5.963 4.792 -6.174 1.00 44.22 H new ATOM 0 HE2 LYS A 109 8.933 5.004 -5.496 1.00 15.43 H new ATOM 0 HE3 LYS A 109 7.773 4.031 -4.613 1.00 15.43 H new ATOM 0 HZ1 LYS A 109 8.432 2.440 -6.016 1.00 2.22 H new ATOM 0 HZ2 LYS A 109 7.375 3.172 -7.125 1.00 2.22 H new ATOM 0 HZ3 LYS A 109 9.034 3.532 -7.168 1.00 2.22 H new ATOM 1701 N THR A 110 3.820 9.603 -7.708 1.00 1.11 N ATOM 1702 CA THR A 110 3.282 10.889 -8.205 1.00 25.12 C ATOM 1703 C THR A 110 3.476 12.015 -7.152 1.00 53.03 C ATOM 1704 O THR A 110 4.020 13.081 -7.470 1.00 20.34 O ATOM 1705 CB THR A 110 1.765 10.749 -8.589 1.00 41.33 C ATOM 1706 OG1 THR A 110 1.602 9.693 -9.546 1.00 23.25 O ATOM 1707 CG2 THR A 110 1.174 12.048 -9.177 1.00 23.22 C ATOM 0 H THR A 110 3.119 8.865 -7.638 1.00 1.11 H new ATOM 0 HA THR A 110 3.838 11.161 -9.102 1.00 25.12 H new ATOM 0 HB THR A 110 1.227 10.526 -7.668 1.00 41.33 H new ATOM 0 HG1 THR A 110 1.881 8.843 -9.146 1.00 23.25 H new ATOM 0 HG21 THR A 110 0.124 11.891 -9.423 1.00 23.22 H new ATOM 0 HG22 THR A 110 1.259 12.851 -8.444 1.00 23.22 H new ATOM 0 HG23 THR A 110 1.721 12.321 -10.079 1.00 23.22 H new ATOM 1715 N VAL A 111 3.069 11.741 -5.888 1.00 2.43 N ATOM 1716 CA VAL A 111 3.238 12.702 -4.767 1.00 34.22 C ATOM 1717 C VAL A 111 4.720 12.867 -4.380 1.00 11.12 C ATOM 1718 O VAL A 111 5.138 13.955 -3.960 1.00 65.21 O ATOM 1719 CB VAL A 111 2.369 12.336 -3.498 1.00 0.33 C ATOM 1720 CG1 VAL A 111 0.864 12.413 -3.821 1.00 34.51 C ATOM 1721 CG2 VAL A 111 2.741 10.955 -2.912 1.00 13.14 C ATOM 0 H VAL A 111 2.622 10.865 -5.619 1.00 2.43 H new ATOM 0 HA VAL A 111 2.868 13.658 -5.138 1.00 34.22 H new ATOM 0 HB VAL A 111 2.594 13.077 -2.731 1.00 0.33 H new ATOM 0 HG11 VAL A 111 0.288 12.157 -2.932 1.00 34.51 H new ATOM 0 HG12 VAL A 111 0.611 13.425 -4.138 1.00 34.51 H new ATOM 0 HG13 VAL A 111 0.627 11.712 -4.621 1.00 34.51 H new ATOM 0 HG21 VAL A 111 2.117 10.749 -2.042 1.00 13.14 H new ATOM 0 HG22 VAL A 111 2.579 10.184 -3.666 1.00 13.14 H new ATOM 0 HG23 VAL A 111 3.790 10.957 -2.614 1.00 13.14 H new ATOM 1731 N ALA A 112 5.499 11.777 -4.537 1.00 73.44 N ATOM 1732 CA ALA A 112 6.952 11.782 -4.290 1.00 70.25 C ATOM 1733 C ALA A 112 7.674 12.744 -5.248 1.00 55.42 C ATOM 1734 O ALA A 112 8.582 13.458 -4.835 1.00 3.34 O ATOM 1735 CB ALA A 112 7.520 10.365 -4.427 1.00 73.44 C ATOM 0 H ALA A 112 5.138 10.872 -4.838 1.00 73.44 H new ATOM 0 HA ALA A 112 7.121 12.132 -3.272 1.00 70.25 H new ATOM 0 HB1 ALA A 112 8.594 10.384 -4.242 1.00 73.44 H new ATOM 0 HB2 ALA A 112 7.038 9.708 -3.702 1.00 73.44 H new ATOM 0 HB3 ALA A 112 7.332 9.993 -5.434 1.00 73.44 H new ATOM 1741 N ASN A 113 7.222 12.768 -6.522 1.00 35.13 N ATOM 1742 CA ASN A 113 7.786 13.648 -7.574 1.00 4.31 C ATOM 1743 C ASN A 113 7.537 15.135 -7.253 1.00 11.41 C ATOM 1744 O ASN A 113 8.366 15.990 -7.579 1.00 2.12 O ATOM 1745 CB ASN A 113 7.189 13.312 -8.974 1.00 61.12 C ATOM 1746 CG ASN A 113 7.562 11.920 -9.500 1.00 13.15 C ATOM 1747 OD1 ASN A 113 8.618 11.373 -9.179 1.00 42.15 O ATOM 1748 ND2 ASN A 113 6.694 11.335 -10.319 1.00 42.01 N ATOM 0 H ASN A 113 6.457 12.179 -6.851 1.00 35.13 H new ATOM 0 HA ASN A 113 8.861 13.467 -7.597 1.00 4.31 H new ATOM 0 HB2 ASN A 113 6.103 13.389 -8.921 1.00 61.12 H new ATOM 0 HB3 ASN A 113 7.527 14.061 -9.690 1.00 61.12 H new ATOM 0 HD21 ASN A 113 6.895 10.410 -10.699 1.00 42.01 H new ATOM 0 HD22 ASN A 113 5.827 11.811 -10.568 1.00 42.01 H new ATOM 1755 N MET A 114 6.397 15.418 -6.586 1.00 13.24 N ATOM 1756 CA MET A 114 5.995 16.797 -6.233 1.00 53.24 C ATOM 1757 C MET A 114 6.951 17.409 -5.185 1.00 31.23 C ATOM 1758 O MET A 114 7.238 18.610 -5.231 1.00 21.33 O ATOM 1759 CB MET A 114 4.525 16.844 -5.716 1.00 41.40 C ATOM 1760 CG MET A 114 3.473 16.310 -6.705 1.00 62.14 C ATOM 1761 SD MET A 114 1.766 16.711 -6.227 1.00 43.14 S ATOM 1762 CE MET A 114 1.653 16.095 -4.540 1.00 1.23 C ATOM 0 H MET A 114 5.735 14.705 -6.280 1.00 13.24 H new ATOM 0 HA MET A 114 6.057 17.394 -7.143 1.00 53.24 H new ATOM 0 HB2 MET A 114 4.461 16.267 -4.793 1.00 41.40 H new ATOM 0 HB3 MET A 114 4.276 17.875 -5.465 1.00 41.40 H new ATOM 0 HG2 MET A 114 3.672 16.723 -7.694 1.00 62.14 H new ATOM 0 HG3 MET A 114 3.576 15.228 -6.784 1.00 62.14 H new ATOM 0 HE1 MET A 114 0.702 15.579 -4.404 1.00 1.23 H new ATOM 0 HE2 MET A 114 2.472 15.402 -4.350 1.00 1.23 H new ATOM 0 HE3 MET A 114 1.716 16.930 -3.843 1.00 1.23 H new ATOM 1772 N ILE A 115 7.436 16.577 -4.243 1.00 32.55 N ATOM 1773 CA ILE A 115 8.399 17.019 -3.202 1.00 11.12 C ATOM 1774 C ILE A 115 9.864 16.751 -3.632 1.00 63.12 C ATOM 1775 O ILE A 115 10.804 17.261 -3.005 1.00 72.33 O ATOM 1776 CB ILE A 115 8.107 16.342 -1.808 1.00 52.55 C ATOM 1777 CG1 ILE A 115 8.253 14.790 -1.898 1.00 55.30 C ATOM 1778 CG2 ILE A 115 6.705 16.743 -1.288 1.00 50.14 C ATOM 1779 CD1 ILE A 115 8.065 14.052 -0.586 1.00 32.11 C ATOM 0 H ILE A 115 7.179 15.592 -4.177 1.00 32.55 H new ATOM 0 HA ILE A 115 8.266 18.095 -3.089 1.00 11.12 H new ATOM 0 HB ILE A 115 8.847 16.703 -1.093 1.00 52.55 H new ATOM 0 HG12 ILE A 115 7.526 14.413 -2.617 1.00 55.30 H new ATOM 0 HG13 ILE A 115 9.242 14.555 -2.291 1.00 55.30 H new ATOM 0 HG21 ILE A 115 6.524 16.265 -0.325 1.00 50.14 H new ATOM 0 HG22 ILE A 115 6.656 17.826 -1.171 1.00 50.14 H new ATOM 0 HG23 ILE A 115 5.946 16.421 -2.001 1.00 50.14 H new ATOM 0 HD11 ILE A 115 8.185 12.981 -0.750 1.00 32.11 H new ATOM 0 HD12 ILE A 115 8.809 14.394 0.134 1.00 32.11 H new ATOM 0 HD13 ILE A 115 7.066 14.250 -0.197 1.00 32.11 H new ATOM 1791 N ARG A 116 10.050 15.938 -4.688 1.00 11.24 N ATOM 1792 CA ARG A 116 11.375 15.656 -5.277 1.00 50.14 C ATOM 1793 C ARG A 116 11.743 16.833 -6.200 1.00 33.11 C ATOM 1794 O ARG A 116 11.334 16.881 -7.367 1.00 43.41 O ATOM 1795 CB ARG A 116 11.346 14.275 -6.024 1.00 33.12 C ATOM 1796 CG ARG A 116 12.717 13.649 -6.428 1.00 62.25 C ATOM 1797 CD ARG A 116 13.366 14.284 -7.678 1.00 70.24 C ATOM 1798 NE ARG A 116 14.610 13.601 -8.066 1.00 21.10 N ATOM 1799 CZ ARG A 116 15.355 13.898 -9.136 1.00 61.15 C ATOM 1800 NH1 ARG A 116 15.006 14.875 -9.976 1.00 32.13 N ATOM 1801 NH2 ARG A 116 16.453 13.205 -9.368 1.00 24.21 N ATOM 0 H ARG A 116 9.284 15.456 -5.159 1.00 11.24 H new ATOM 0 HA ARG A 116 12.144 15.570 -4.509 1.00 50.14 H new ATOM 0 HB2 ARG A 116 10.823 13.560 -5.389 1.00 33.12 H new ATOM 0 HB3 ARG A 116 10.750 14.394 -6.929 1.00 33.12 H new ATOM 0 HG2 ARG A 116 13.406 13.742 -5.589 1.00 62.25 H new ATOM 0 HG3 ARG A 116 12.577 12.583 -6.608 1.00 62.25 H new ATOM 0 HD2 ARG A 116 12.661 14.250 -8.508 1.00 70.24 H new ATOM 0 HD3 ARG A 116 13.577 15.335 -7.482 1.00 70.24 H new ATOM 0 HE ARG A 116 14.931 12.838 -7.470 1.00 21.10 H new ATOM 0 HH11 ARG A 116 14.156 15.413 -9.808 1.00 32.13 H new ATOM 0 HH12 ARG A 116 15.590 15.084 -10.786 1.00 32.13 H new ATOM 0 HH21 ARG A 116 16.725 12.453 -8.735 1.00 24.21 H new ATOM 0 HH22 ARG A 116 17.030 13.421 -10.181 1.00 24.21 H new ATOM 1815 N GLY A 117 12.442 17.816 -5.624 1.00 5.24 N ATOM 1816 CA GLY A 117 12.877 19.015 -6.339 1.00 13.21 C ATOM 1817 C GLY A 117 12.969 20.222 -5.401 1.00 64.03 C ATOM 1818 O GLY A 117 12.252 20.248 -4.375 1.00 24.32 O ATOM 1819 OXT GLY A 117 13.720 21.166 -5.703 1.00 37.55 O ATOM 0 H GLY A 117 12.722 17.800 -4.643 1.00 5.24 H new ATOM 0 HA2 GLY A 117 13.849 18.834 -6.798 1.00 13.21 H new ATOM 0 HA3 GLY A 117 12.178 19.232 -7.147 1.00 13.21 H new ATOM 1824 N SER B 2 16.508 -16.032 12.395 1.00 11.03 N ATOM 1825 CA SER B 2 15.513 -15.402 13.285 1.00 35.24 C ATOM 1826 C SER B 2 15.451 -13.888 13.049 1.00 12.31 C ATOM 1827 O SER B 2 14.365 -13.304 13.046 1.00 32.32 O ATOM 1828 CB SER B 2 15.854 -15.704 14.754 1.00 11.11 C ATOM 1829 OG SER B 2 15.948 -17.099 14.977 1.00 3.24 O ATOM 0 HA SER B 2 14.532 -15.820 13.058 1.00 35.24 H new ATOM 0 HB2 SER B 2 16.797 -15.226 15.018 1.00 11.11 H new ATOM 0 HB3 SER B 2 15.089 -15.279 15.403 1.00 11.11 H new ATOM 0 HG SER B 2 16.197 -17.548 14.142 1.00 3.24 H new ATOM 1837 N LEU B 3 16.628 -13.255 12.877 1.00 23.34 N ATOM 1838 CA LEU B 3 16.731 -11.804 12.648 1.00 12.25 C ATOM 1839 C LEU B 3 17.184 -11.545 11.202 1.00 23.25 C ATOM 1840 O LEU B 3 18.286 -11.954 10.811 1.00 22.33 O ATOM 1841 CB LEU B 3 17.745 -11.185 13.656 1.00 62.53 C ATOM 1842 CG LEU B 3 17.429 -11.445 15.165 1.00 42.11 C ATOM 1843 CD1 LEU B 3 18.602 -11.024 16.070 1.00 32.44 C ATOM 1844 CD2 LEU B 3 16.117 -10.750 15.591 1.00 15.22 C ATOM 0 H LEU B 3 17.528 -13.734 12.893 1.00 23.34 H new ATOM 0 HA LEU B 3 15.758 -11.338 12.802 1.00 12.25 H new ATOM 0 HB2 LEU B 3 18.737 -11.579 13.436 1.00 62.53 H new ATOM 0 HB3 LEU B 3 17.786 -10.108 13.490 1.00 62.53 H new ATOM 0 HG LEU B 3 17.291 -12.519 15.288 1.00 42.11 H new ATOM 0 HD11 LEU B 3 18.346 -11.219 17.111 1.00 32.44 H new ATOM 0 HD12 LEU B 3 19.491 -11.594 15.802 1.00 32.44 H new ATOM 0 HD13 LEU B 3 18.800 -9.960 15.938 1.00 32.44 H new ATOM 0 HD21 LEU B 3 15.925 -10.950 16.645 1.00 15.22 H new ATOM 0 HD22 LEU B 3 16.208 -9.675 15.436 1.00 15.22 H new ATOM 0 HD23 LEU B 3 15.291 -11.134 14.993 1.00 15.22 H new ATOM 1856 N VAL B 4 16.317 -10.893 10.415 1.00 71.43 N ATOM 1857 CA VAL B 4 16.647 -10.441 9.060 1.00 25.22 C ATOM 1858 C VAL B 4 17.274 -9.029 9.141 1.00 64.04 C ATOM 1859 O VAL B 4 16.611 -8.040 9.484 1.00 72.34 O ATOM 1860 CB VAL B 4 15.388 -10.500 8.096 1.00 54.41 C ATOM 1861 CG1 VAL B 4 14.983 -11.973 7.829 1.00 43.15 C ATOM 1862 CG2 VAL B 4 14.180 -9.703 8.656 1.00 41.34 C ATOM 0 H VAL B 4 15.365 -10.665 10.703 1.00 71.43 H new ATOM 0 HA VAL B 4 17.379 -11.118 8.619 1.00 25.22 H new ATOM 0 HB VAL B 4 15.678 -10.029 7.157 1.00 54.41 H new ATOM 0 HG11 VAL B 4 14.118 -11.998 7.166 1.00 43.15 H new ATOM 0 HG12 VAL B 4 15.814 -12.500 7.361 1.00 43.15 H new ATOM 0 HG13 VAL B 4 14.732 -12.458 8.772 1.00 43.15 H new ATOM 0 HG21 VAL B 4 13.344 -9.774 7.961 1.00 41.34 H new ATOM 0 HG22 VAL B 4 13.886 -10.117 9.620 1.00 41.34 H new ATOM 0 HG23 VAL B 4 14.461 -8.657 8.781 1.00 41.34 H new ATOM 1872 N LYS B 5 18.587 -8.983 8.904 1.00 23.34 N ATOM 1873 CA LYS B 5 19.388 -7.758 8.986 1.00 41.22 C ATOM 1874 C LYS B 5 19.133 -6.881 7.747 1.00 34.05 C ATOM 1875 O LYS B 5 19.527 -7.237 6.632 1.00 42.42 O ATOM 1876 CB LYS B 5 20.885 -8.129 9.100 1.00 73.43 C ATOM 1877 CG LYS B 5 21.228 -9.064 10.283 1.00 73.01 C ATOM 1878 CD LYS B 5 22.739 -9.368 10.385 1.00 43.04 C ATOM 1879 CE LYS B 5 23.075 -10.304 11.554 1.00 31.22 C ATOM 1880 NZ LYS B 5 24.539 -10.526 11.691 1.00 71.54 N ATOM 0 H LYS B 5 19.132 -9.806 8.646 1.00 23.34 H new ATOM 0 HA LYS B 5 19.100 -7.190 9.871 1.00 41.22 H new ATOM 0 HB2 LYS B 5 21.199 -8.608 8.173 1.00 73.43 H new ATOM 0 HB3 LYS B 5 21.467 -7.212 9.198 1.00 73.43 H new ATOM 0 HG2 LYS B 5 20.890 -8.606 11.213 1.00 73.01 H new ATOM 0 HG3 LYS B 5 20.680 -10.000 10.172 1.00 73.01 H new ATOM 0 HD2 LYS B 5 23.079 -9.820 9.453 1.00 43.04 H new ATOM 0 HD3 LYS B 5 23.287 -8.433 10.504 1.00 43.04 H new ATOM 0 HE2 LYS B 5 22.685 -9.881 12.480 1.00 31.22 H new ATOM 0 HE3 LYS B 5 22.576 -11.262 11.406 1.00 31.22 H new ATOM 0 HZ1 LYS B 5 24.720 -11.164 12.492 1.00 71.54 H new ATOM 0 HZ2 LYS B 5 24.908 -10.954 10.818 1.00 71.54 H new ATOM 0 HZ3 LYS B 5 25.014 -9.616 11.859 1.00 71.54 H new ATOM 1894 N LEU B 6 18.427 -5.766 7.956 1.00 63.34 N ATOM 1895 CA LEU B 6 18.062 -4.826 6.892 1.00 21.14 C ATOM 1896 C LEU B 6 19.011 -3.621 6.910 1.00 41.31 C ATOM 1897 O LEU B 6 18.790 -2.665 7.668 1.00 10.05 O ATOM 1898 CB LEU B 6 16.586 -4.354 7.063 1.00 54.02 C ATOM 1899 CG LEU B 6 15.496 -5.471 7.129 1.00 22.44 C ATOM 1900 CD1 LEU B 6 14.088 -4.851 7.259 1.00 1.30 C ATOM 1901 CD2 LEU B 6 15.578 -6.426 5.917 1.00 2.13 C ATOM 0 H LEU B 6 18.089 -5.488 8.877 1.00 63.34 H new ATOM 0 HA LEU B 6 18.152 -5.333 5.931 1.00 21.14 H new ATOM 0 HB2 LEU B 6 16.522 -3.761 7.976 1.00 54.02 H new ATOM 0 HB3 LEU B 6 16.343 -3.690 6.234 1.00 54.02 H new ATOM 0 HG LEU B 6 15.689 -6.069 8.020 1.00 22.44 H new ATOM 0 HD11 LEU B 6 13.343 -5.646 7.303 1.00 1.30 H new ATOM 0 HD12 LEU B 6 14.036 -4.254 8.169 1.00 1.30 H new ATOM 0 HD13 LEU B 6 13.889 -4.215 6.396 1.00 1.30 H new ATOM 0 HD21 LEU B 6 14.803 -7.188 6.001 1.00 2.13 H new ATOM 0 HD22 LEU B 6 15.432 -5.860 4.997 1.00 2.13 H new ATOM 0 HD23 LEU B 6 16.557 -6.905 5.897 1.00 2.13 H new ATOM 1913 N GLU B 7 20.093 -3.690 6.115 1.00 62.25 N ATOM 1914 CA GLU B 7 20.961 -2.525 5.886 1.00 33.31 C ATOM 1915 C GLU B 7 20.197 -1.502 5.049 1.00 14.22 C ATOM 1916 O GLU B 7 19.939 -1.746 3.873 1.00 63.05 O ATOM 1917 CB GLU B 7 22.293 -2.894 5.175 1.00 31.13 C ATOM 1918 CG GLU B 7 23.278 -3.704 6.024 1.00 30.55 C ATOM 1919 CD GLU B 7 22.887 -5.181 6.144 1.00 22.42 C ATOM 1920 OE1 GLU B 7 23.179 -5.946 5.206 1.00 41.14 O ATOM 1921 OE2 GLU B 7 22.289 -5.580 7.167 1.00 53.31 O ATOM 0 H GLU B 7 20.385 -4.535 5.624 1.00 62.25 H new ATOM 0 HA GLU B 7 21.229 -2.113 6.859 1.00 33.31 H new ATOM 0 HB2 GLU B 7 22.061 -3.462 4.274 1.00 31.13 H new ATOM 0 HB3 GLU B 7 22.783 -1.975 4.855 1.00 31.13 H new ATOM 0 HG2 GLU B 7 24.273 -3.631 5.585 1.00 30.55 H new ATOM 0 HG3 GLU B 7 23.336 -3.267 7.021 1.00 30.55 H new ATOM 1928 N SER B 8 19.818 -0.384 5.671 1.00 53.41 N ATOM 1929 CA SER B 8 19.148 0.728 4.983 1.00 23.21 C ATOM 1930 C SER B 8 20.057 1.343 3.884 1.00 0.23 C ATOM 1931 O SER B 8 21.181 0.882 3.644 1.00 34.12 O ATOM 1932 CB SER B 8 18.753 1.791 6.036 1.00 10.25 C ATOM 1933 OG SER B 8 19.877 2.188 6.808 1.00 53.12 O ATOM 0 H SER B 8 19.966 -0.221 6.667 1.00 53.41 H new ATOM 0 HA SER B 8 18.254 0.357 4.481 1.00 23.21 H new ATOM 0 HB2 SER B 8 18.325 2.660 5.537 1.00 10.25 H new ATOM 0 HB3 SER B 8 17.981 1.388 6.692 1.00 10.25 H new ATOM 0 HG SER B 8 20.629 2.388 6.212 1.00 53.12 H new ATOM 1939 N SER B 9 19.552 2.392 3.221 1.00 52.44 N ATOM 1940 CA SER B 9 20.326 3.171 2.242 1.00 35.15 C ATOM 1941 C SER B 9 21.480 3.932 2.945 1.00 2.11 C ATOM 1942 O SER B 9 22.445 4.356 2.303 1.00 33.13 O ATOM 1943 CB SER B 9 19.385 4.138 1.477 1.00 32.43 C ATOM 1944 OG SER B 9 20.039 4.734 0.370 1.00 70.40 O ATOM 0 H SER B 9 18.596 2.725 3.347 1.00 52.44 H new ATOM 0 HA SER B 9 20.777 2.493 1.517 1.00 35.15 H new ATOM 0 HB2 SER B 9 18.506 3.594 1.132 1.00 32.43 H new ATOM 0 HB3 SER B 9 19.033 4.916 2.154 1.00 32.43 H new ATOM 0 HG SER B 9 19.418 5.336 -0.091 1.00 70.40 H new ATOM 1950 N ASP B 10 21.365 4.077 4.280 1.00 31.02 N ATOM 1951 CA ASP B 10 22.392 4.691 5.147 1.00 1.12 C ATOM 1952 C ASP B 10 23.297 3.589 5.788 1.00 43.33 C ATOM 1953 O ASP B 10 24.125 3.873 6.664 1.00 44.45 O ATOM 1954 CB ASP B 10 21.649 5.541 6.211 1.00 4.41 C ATOM 1955 CG ASP B 10 22.561 6.401 7.107 1.00 64.14 C ATOM 1956 OD1 ASP B 10 23.195 7.345 6.593 1.00 72.04 O ATOM 1957 OD2 ASP B 10 22.623 6.157 8.325 1.00 41.42 O ATOM 0 H ASP B 10 20.542 3.766 4.796 1.00 31.02 H new ATOM 0 HA ASP B 10 23.061 5.334 4.575 1.00 1.12 H new ATOM 0 HB2 ASP B 10 20.942 6.196 5.702 1.00 4.41 H new ATOM 0 HB3 ASP B 10 21.066 4.874 6.845 1.00 4.41 H new ATOM 1962 N GLU B 11 23.115 2.319 5.324 1.00 11.33 N ATOM 1963 CA GLU B 11 23.920 1.127 5.712 1.00 34.24 C ATOM 1964 C GLU B 11 23.720 0.695 7.183 1.00 14.12 C ATOM 1965 O GLU B 11 24.439 -0.189 7.671 1.00 73.44 O ATOM 1966 CB GLU B 11 25.432 1.329 5.393 1.00 54.22 C ATOM 1967 CG GLU B 11 25.744 1.533 3.896 1.00 1.43 C ATOM 1968 CD GLU B 11 27.248 1.669 3.602 1.00 50.55 C ATOM 1969 OE1 GLU B 11 27.808 2.761 3.812 1.00 42.43 O ATOM 1970 OE2 GLU B 11 27.875 0.686 3.152 1.00 44.11 O ATOM 0 H GLU B 11 22.383 2.092 4.651 1.00 11.33 H new ATOM 0 HA GLU B 11 23.542 0.308 5.100 1.00 34.24 H new ATOM 0 HB2 GLU B 11 25.796 2.193 5.949 1.00 54.22 H new ATOM 0 HB3 GLU B 11 25.986 0.462 5.753 1.00 54.22 H new ATOM 0 HG2 GLU B 11 25.345 0.691 3.331 1.00 1.43 H new ATOM 0 HG3 GLU B 11 25.229 2.427 3.543 1.00 1.43 H new ATOM 1977 N LYS B 12 22.726 1.287 7.874 1.00 61.43 N ATOM 1978 CA LYS B 12 22.412 0.927 9.269 1.00 0.11 C ATOM 1979 C LYS B 12 21.723 -0.447 9.300 1.00 21.42 C ATOM 1980 O LYS B 12 20.682 -0.633 8.665 1.00 61.41 O ATOM 1981 CB LYS B 12 21.514 2.010 9.929 1.00 64.53 C ATOM 1982 CG LYS B 12 22.155 3.420 10.103 1.00 51.11 C ATOM 1983 CD LYS B 12 23.122 3.566 11.309 1.00 70.01 C ATOM 1984 CE LYS B 12 24.518 2.965 11.084 1.00 44.31 C ATOM 1985 NZ LYS B 12 25.367 3.108 12.293 1.00 30.30 N ATOM 0 H LYS B 12 22.127 2.017 7.488 1.00 61.43 H new ATOM 0 HA LYS B 12 23.339 0.873 9.840 1.00 0.11 H new ATOM 0 HB2 LYS B 12 20.609 2.116 9.331 1.00 64.53 H new ATOM 0 HB3 LYS B 12 21.207 1.649 10.911 1.00 64.53 H new ATOM 0 HG2 LYS B 12 22.698 3.669 9.191 1.00 51.11 H new ATOM 0 HG3 LYS B 12 21.356 4.154 10.209 1.00 51.11 H new ATOM 0 HD2 LYS B 12 23.230 4.625 11.546 1.00 70.01 H new ATOM 0 HD3 LYS B 12 22.671 3.089 12.179 1.00 70.01 H new ATOM 0 HE2 LYS B 12 24.425 1.910 10.825 1.00 44.31 H new ATOM 0 HE3 LYS B 12 24.998 3.460 10.239 1.00 44.31 H new ATOM 0 HZ1 LYS B 12 26.303 2.693 12.111 1.00 30.30 H new ATOM 0 HZ2 LYS B 12 25.474 4.116 12.525 1.00 30.30 H new ATOM 0 HZ3 LYS B 12 24.919 2.615 13.092 1.00 30.30 H new ATOM 1999 N VAL B 13 22.330 -1.386 10.039 1.00 61.43 N ATOM 2000 CA VAL B 13 21.895 -2.785 10.114 1.00 13.33 C ATOM 2001 C VAL B 13 20.721 -2.918 11.105 1.00 23.14 C ATOM 2002 O VAL B 13 20.922 -2.904 12.325 1.00 55.53 O ATOM 2003 CB VAL B 13 23.097 -3.715 10.557 1.00 21.44 C ATOM 2004 CG1 VAL B 13 22.702 -5.208 10.545 1.00 15.11 C ATOM 2005 CG2 VAL B 13 24.347 -3.455 9.678 1.00 20.23 C ATOM 0 H VAL B 13 23.151 -1.190 10.611 1.00 61.43 H new ATOM 0 HA VAL B 13 21.561 -3.102 9.126 1.00 13.33 H new ATOM 0 HB VAL B 13 23.348 -3.460 11.587 1.00 21.44 H new ATOM 0 HG11 VAL B 13 23.554 -5.812 10.855 1.00 15.11 H new ATOM 0 HG12 VAL B 13 21.873 -5.370 11.233 1.00 15.11 H new ATOM 0 HG13 VAL B 13 22.400 -5.496 9.538 1.00 15.11 H new ATOM 0 HG21 VAL B 13 25.160 -4.105 10.001 1.00 20.23 H new ATOM 0 HG22 VAL B 13 24.108 -3.663 8.635 1.00 20.23 H new ATOM 0 HG23 VAL B 13 24.653 -2.414 9.779 1.00 20.23 H new ATOM 2015 N PHE B 14 19.494 -2.991 10.571 1.00 53.42 N ATOM 2016 CA PHE B 14 18.273 -3.186 11.368 1.00 31.25 C ATOM 2017 C PHE B 14 17.954 -4.683 11.460 1.00 0.33 C ATOM 2018 O PHE B 14 17.243 -5.233 10.609 1.00 44.15 O ATOM 2019 CB PHE B 14 17.090 -2.390 10.754 1.00 40.04 C ATOM 2020 CG PHE B 14 17.288 -0.875 10.793 1.00 22.13 C ATOM 2021 CD1 PHE B 14 17.091 -0.165 11.978 1.00 53.42 C ATOM 2022 CD2 PHE B 14 17.677 -0.162 9.657 1.00 22.31 C ATOM 2023 CE1 PHE B 14 17.284 1.203 12.026 1.00 72.10 C ATOM 2024 CE2 PHE B 14 17.865 1.207 9.709 1.00 45.52 C ATOM 2025 CZ PHE B 14 17.667 1.887 10.890 1.00 15.02 C ATOM 0 H PHE B 14 19.319 -2.916 9.569 1.00 53.42 H new ATOM 0 HA PHE B 14 18.434 -2.805 12.377 1.00 31.25 H new ATOM 0 HB2 PHE B 14 16.950 -2.703 9.719 1.00 40.04 H new ATOM 0 HB3 PHE B 14 16.175 -2.643 11.290 1.00 40.04 H new ATOM 0 HD1 PHE B 14 16.784 -0.691 12.870 1.00 53.42 H new ATOM 0 HD2 PHE B 14 17.833 -0.687 8.726 1.00 22.31 H new ATOM 0 HE1 PHE B 14 17.135 1.737 12.953 1.00 72.10 H new ATOM 0 HE2 PHE B 14 18.168 1.744 8.822 1.00 45.52 H new ATOM 0 HZ PHE B 14 17.812 2.957 10.927 1.00 15.02 H new ATOM 2035 N GLU B 15 18.532 -5.335 12.482 1.00 44.50 N ATOM 2036 CA GLU B 15 18.357 -6.777 12.736 1.00 73.12 C ATOM 2037 C GLU B 15 16.961 -7.020 13.341 1.00 51.45 C ATOM 2038 O GLU B 15 16.811 -7.191 14.557 1.00 34.12 O ATOM 2039 CB GLU B 15 19.482 -7.287 13.687 1.00 62.53 C ATOM 2040 CG GLU B 15 20.902 -6.825 13.297 1.00 3.51 C ATOM 2041 CD GLU B 15 21.985 -7.230 14.307 1.00 32.43 C ATOM 2042 OE1 GLU B 15 21.909 -6.785 15.470 1.00 71.03 O ATOM 2043 OE2 GLU B 15 22.930 -7.964 13.945 1.00 33.00 O ATOM 0 H GLU B 15 19.138 -4.874 13.161 1.00 44.50 H new ATOM 0 HA GLU B 15 18.431 -7.332 11.801 1.00 73.12 H new ATOM 0 HB2 GLU B 15 19.267 -6.946 14.700 1.00 62.53 H new ATOM 0 HB3 GLU B 15 19.459 -8.377 13.706 1.00 62.53 H new ATOM 0 HG2 GLU B 15 21.154 -7.241 12.322 1.00 3.51 H new ATOM 0 HG3 GLU B 15 20.905 -5.740 13.191 1.00 3.51 H new ATOM 2050 N ILE B 16 15.939 -6.963 12.484 1.00 61.32 N ATOM 2051 CA ILE B 16 14.533 -7.073 12.902 1.00 21.21 C ATOM 2052 C ILE B 16 14.088 -8.543 12.819 1.00 72.43 C ATOM 2053 O ILE B 16 14.600 -9.298 11.991 1.00 64.22 O ATOM 2054 CB ILE B 16 13.603 -6.139 12.027 1.00 41.13 C ATOM 2055 CG1 ILE B 16 12.131 -6.149 12.561 1.00 72.23 C ATOM 2056 CG2 ILE B 16 13.664 -6.513 10.523 1.00 51.32 C ATOM 2057 CD1 ILE B 16 11.165 -5.264 11.798 1.00 74.31 C ATOM 0 H ILE B 16 16.060 -6.839 11.479 1.00 61.32 H new ATOM 0 HA ILE B 16 14.442 -6.736 13.935 1.00 21.21 H new ATOM 0 HB ILE B 16 13.983 -5.121 12.119 1.00 41.13 H new ATOM 0 HG12 ILE B 16 11.759 -7.173 12.536 1.00 72.23 H new ATOM 0 HG13 ILE B 16 12.138 -5.838 13.606 1.00 72.23 H new ATOM 0 HG21 ILE B 16 13.012 -5.849 9.956 1.00 51.32 H new ATOM 0 HG22 ILE B 16 14.688 -6.410 10.164 1.00 51.32 H new ATOM 0 HG23 ILE B 16 13.335 -7.544 10.391 1.00 51.32 H new ATOM 0 HD11 ILE B 16 10.173 -5.339 12.243 1.00 74.31 H new ATOM 0 HD12 ILE B 16 11.506 -4.230 11.844 1.00 74.31 H new ATOM 0 HD13 ILE B 16 11.121 -5.586 10.758 1.00 74.31 H new ATOM 2069 N GLU B 17 13.155 -8.937 13.697 1.00 61.52 N ATOM 2070 CA GLU B 17 12.633 -10.310 13.756 1.00 1.13 C ATOM 2071 C GLU B 17 11.835 -10.626 12.477 1.00 33.32 C ATOM 2072 O GLU B 17 11.031 -9.804 12.013 1.00 60.52 O ATOM 2073 CB GLU B 17 11.770 -10.499 15.033 1.00 32.20 C ATOM 2074 CG GLU B 17 12.475 -10.050 16.330 1.00 1.34 C ATOM 2075 CD GLU B 17 11.583 -10.129 17.573 1.00 45.34 C ATOM 2076 OE1 GLU B 17 10.679 -9.276 17.718 1.00 33.42 O ATOM 2077 OE2 GLU B 17 11.795 -11.025 18.422 1.00 13.54 O ATOM 0 H GLU B 17 12.740 -8.312 14.388 1.00 61.52 H new ATOM 0 HA GLU B 17 13.465 -11.012 13.812 1.00 1.13 H new ATOM 0 HB2 GLU B 17 10.843 -9.937 14.921 1.00 32.20 H new ATOM 0 HB3 GLU B 17 11.497 -11.550 15.124 1.00 32.20 H new ATOM 0 HG2 GLU B 17 13.358 -10.670 16.487 1.00 1.34 H new ATOM 0 HG3 GLU B 17 12.823 -9.024 16.208 1.00 1.34 H new ATOM 2084 N LYS B 18 12.086 -11.822 11.932 1.00 63.14 N ATOM 2085 CA LYS B 18 11.538 -12.282 10.646 1.00 3.42 C ATOM 2086 C LYS B 18 9.998 -12.397 10.687 1.00 34.42 C ATOM 2087 O LYS B 18 9.330 -12.165 9.675 1.00 21.14 O ATOM 2088 CB LYS B 18 12.214 -13.629 10.272 1.00 43.03 C ATOM 2089 CG LYS B 18 11.697 -14.310 8.986 1.00 35.41 C ATOM 2090 CD LYS B 18 12.546 -15.546 8.596 1.00 62.53 C ATOM 2091 CE LYS B 18 11.925 -16.350 7.445 1.00 52.20 C ATOM 2092 NZ LYS B 18 10.642 -16.994 7.835 1.00 73.25 N ATOM 0 H LYS B 18 12.688 -12.513 12.380 1.00 63.14 H new ATOM 0 HA LYS B 18 11.759 -11.545 9.874 1.00 3.42 H new ATOM 0 HB2 LYS B 18 13.285 -13.458 10.164 1.00 43.03 H new ATOM 0 HB3 LYS B 18 12.084 -14.321 11.104 1.00 43.03 H new ATOM 0 HG2 LYS B 18 10.660 -14.614 9.130 1.00 35.41 H new ATOM 0 HG3 LYS B 18 11.708 -13.591 8.167 1.00 35.41 H new ATOM 0 HD2 LYS B 18 13.545 -15.219 8.308 1.00 62.53 H new ATOM 0 HD3 LYS B 18 12.660 -16.193 9.466 1.00 62.53 H new ATOM 0 HE2 LYS B 18 11.754 -15.690 6.594 1.00 52.20 H new ATOM 0 HE3 LYS B 18 12.629 -17.116 7.118 1.00 52.20 H new ATOM 0 HZ1 LYS B 18 10.355 -17.670 7.099 1.00 73.25 H new ATOM 0 HZ2 LYS B 18 10.766 -17.496 8.737 1.00 73.25 H new ATOM 0 HZ3 LYS B 18 9.907 -16.266 7.942 1.00 73.25 H new ATOM 2106 N GLU B 19 9.452 -12.709 11.886 1.00 51.02 N ATOM 2107 CA GLU B 19 7.990 -12.796 12.121 1.00 12.11 C ATOM 2108 C GLU B 19 7.280 -11.448 11.857 1.00 10.14 C ATOM 2109 O GLU B 19 6.117 -11.411 11.437 1.00 12.33 O ATOM 2110 CB GLU B 19 7.699 -13.238 13.574 1.00 34.22 C ATOM 2111 CG GLU B 19 8.337 -14.569 14.004 1.00 52.33 C ATOM 2112 CD GLU B 19 7.890 -15.007 15.407 1.00 24.22 C ATOM 2113 OE1 GLU B 19 7.991 -14.198 16.353 1.00 43.13 O ATOM 2114 OE2 GLU B 19 7.431 -16.159 15.570 1.00 13.40 O ATOM 0 H GLU B 19 10.011 -12.907 12.716 1.00 51.02 H new ATOM 0 HA GLU B 19 7.602 -13.536 11.421 1.00 12.11 H new ATOM 0 HB2 GLU B 19 8.045 -12.455 14.249 1.00 34.22 H new ATOM 0 HB3 GLU B 19 6.619 -13.315 13.702 1.00 34.22 H new ATOM 0 HG2 GLU B 19 8.075 -15.344 13.284 1.00 52.33 H new ATOM 0 HG3 GLU B 19 9.422 -14.471 13.986 1.00 52.33 H new ATOM 2121 N ILE B 20 8.002 -10.354 12.128 1.00 72.11 N ATOM 2122 CA ILE B 20 7.521 -8.980 11.908 1.00 24.22 C ATOM 2123 C ILE B 20 7.584 -8.649 10.402 1.00 31.55 C ATOM 2124 O ILE B 20 6.650 -8.072 9.832 1.00 74.20 O ATOM 2125 CB ILE B 20 8.404 -7.955 12.710 1.00 11.21 C ATOM 2126 CG1 ILE B 20 8.557 -8.386 14.205 1.00 72.32 C ATOM 2127 CG2 ILE B 20 7.818 -6.531 12.607 1.00 75.04 C ATOM 2128 CD1 ILE B 20 9.562 -7.564 14.985 1.00 2.41 C ATOM 0 H ILE B 20 8.947 -10.396 12.510 1.00 72.11 H new ATOM 0 HA ILE B 20 6.492 -8.906 12.259 1.00 24.22 H new ATOM 0 HB ILE B 20 9.398 -7.949 12.263 1.00 11.21 H new ATOM 0 HG12 ILE B 20 7.586 -8.313 14.694 1.00 72.32 H new ATOM 0 HG13 ILE B 20 8.854 -9.434 14.241 1.00 72.32 H new ATOM 0 HG21 ILE B 20 8.444 -5.838 13.169 1.00 75.04 H new ATOM 0 HG22 ILE B 20 7.787 -6.225 11.561 1.00 75.04 H new ATOM 0 HG23 ILE B 20 6.808 -6.522 13.018 1.00 75.04 H new ATOM 0 HD11 ILE B 20 9.609 -7.926 16.012 1.00 2.41 H new ATOM 0 HD12 ILE B 20 10.545 -7.656 14.522 1.00 2.41 H new ATOM 0 HD13 ILE B 20 9.256 -6.518 14.983 1.00 2.41 H new ATOM 2140 N ALA B 21 8.693 -9.089 9.772 1.00 41.35 N ATOM 2141 CA ALA B 21 8.982 -8.870 8.340 1.00 65.15 C ATOM 2142 C ALA B 21 8.093 -9.732 7.410 1.00 20.10 C ATOM 2143 O ALA B 21 8.220 -9.659 6.185 1.00 33.50 O ATOM 2144 CB ALA B 21 10.476 -9.145 8.088 1.00 73.15 C ATOM 0 H ALA B 21 9.424 -9.614 10.252 1.00 41.35 H new ATOM 0 HA ALA B 21 8.747 -7.833 8.099 1.00 65.15 H new ATOM 0 HB1 ALA B 21 10.702 -8.987 7.034 1.00 73.15 H new ATOM 0 HB2 ALA B 21 11.078 -8.468 8.694 1.00 73.15 H new ATOM 0 HB3 ALA B 21 10.707 -10.176 8.358 1.00 73.15 H new ATOM 2150 N CYS B 22 7.215 -10.563 8.008 1.00 12.33 N ATOM 2151 CA CYS B 22 6.182 -11.319 7.274 1.00 12.30 C ATOM 2152 C CYS B 22 5.024 -10.400 6.823 1.00 64.43 C ATOM 2153 O CYS B 22 4.377 -10.668 5.804 1.00 20.23 O ATOM 2154 CB CYS B 22 5.648 -12.455 8.167 1.00 65.32 C ATOM 2155 SG CYS B 22 6.924 -13.603 8.728 1.00 0.32 S ATOM 0 H CYS B 22 7.203 -10.728 9.014 1.00 12.33 H new ATOM 0 HA CYS B 22 6.634 -11.741 6.377 1.00 12.30 H new ATOM 0 HB2 CYS B 22 5.156 -12.020 9.037 1.00 65.32 H new ATOM 0 HB3 CYS B 22 4.889 -13.011 7.617 1.00 65.32 H new ATOM 0 HG CYS B 22 7.817 -12.956 9.417 1.00 0.32 H new ATOM 2161 N MET B 23 4.763 -9.322 7.608 1.00 71.03 N ATOM 2162 CA MET B 23 3.763 -8.285 7.250 1.00 52.30 C ATOM 2163 C MET B 23 4.248 -7.484 6.032 1.00 71.31 C ATOM 2164 O MET B 23 3.441 -6.970 5.243 1.00 33.32 O ATOM 2165 CB MET B 23 3.483 -7.331 8.441 1.00 75.33 C ATOM 2166 CG MET B 23 2.936 -8.014 9.700 1.00 30.23 C ATOM 2167 SD MET B 23 2.377 -6.830 10.950 1.00 14.15 S ATOM 2168 CE MET B 23 3.861 -5.861 11.238 1.00 54.34 C ATOM 0 H MET B 23 5.234 -9.150 8.496 1.00 71.03 H new ATOM 0 HA MET B 23 2.830 -8.790 7.001 1.00 52.30 H new ATOM 0 HB2 MET B 23 4.407 -6.814 8.698 1.00 75.33 H new ATOM 0 HB3 MET B 23 2.771 -6.571 8.119 1.00 75.33 H new ATOM 0 HG2 MET B 23 2.106 -8.664 9.424 1.00 30.23 H new ATOM 0 HG3 MET B 23 3.710 -8.650 10.129 1.00 30.23 H new ATOM 0 HE1 MET B 23 3.683 -5.155 12.049 1.00 54.34 H new ATOM 0 HE2 MET B 23 4.682 -6.525 11.509 1.00 54.34 H new ATOM 0 HE3 MET B 23 4.120 -5.314 10.331 1.00 54.34 H new ATOM 2178 N SER B 24 5.578 -7.371 5.917 1.00 32.40 N ATOM 2179 CA SER B 24 6.231 -6.904 4.704 1.00 44.13 C ATOM 2180 C SER B 24 6.117 -7.990 3.626 1.00 23.32 C ATOM 2181 O SER B 24 6.836 -8.992 3.683 1.00 54.11 O ATOM 2182 CB SER B 24 7.717 -6.600 4.971 1.00 1.32 C ATOM 2183 OG SER B 24 7.885 -5.536 5.872 1.00 42.22 O ATOM 0 H SER B 24 6.226 -7.604 6.669 1.00 32.40 H new ATOM 0 HA SER B 24 5.744 -5.988 4.368 1.00 44.13 H new ATOM 0 HB2 SER B 24 8.203 -7.491 5.368 1.00 1.32 H new ATOM 0 HB3 SER B 24 8.212 -6.359 4.030 1.00 1.32 H new ATOM 0 HG SER B 24 8.722 -5.067 5.672 1.00 42.22 H new ATOM 2189 N VAL B 25 5.196 -7.798 2.668 1.00 75.03 N ATOM 2190 CA VAL B 25 5.021 -8.729 1.539 1.00 44.13 C ATOM 2191 C VAL B 25 6.277 -8.708 0.640 1.00 51.31 C ATOM 2192 O VAL B 25 6.644 -9.738 0.098 1.00 64.40 O ATOM 2193 CB VAL B 25 3.713 -8.432 0.703 1.00 25.22 C ATOM 2194 CG1 VAL B 25 3.502 -9.465 -0.439 1.00 73.34 C ATOM 2195 CG2 VAL B 25 2.468 -8.357 1.627 1.00 50.11 C ATOM 0 H VAL B 25 4.558 -7.003 2.652 1.00 75.03 H new ATOM 0 HA VAL B 25 4.896 -9.729 1.953 1.00 44.13 H new ATOM 0 HB VAL B 25 3.846 -7.458 0.231 1.00 25.22 H new ATOM 0 HG11 VAL B 25 2.591 -9.221 -0.986 1.00 73.34 H new ATOM 0 HG12 VAL B 25 4.353 -9.435 -1.119 1.00 73.34 H new ATOM 0 HG13 VAL B 25 3.413 -10.465 -0.014 1.00 73.34 H new ATOM 0 HG21 VAL B 25 1.581 -8.152 1.027 1.00 50.11 H new ATOM 0 HG22 VAL B 25 2.343 -9.307 2.146 1.00 50.11 H new ATOM 0 HG23 VAL B 25 2.604 -7.560 2.357 1.00 50.11 H new ATOM 2205 N THR B 26 6.963 -7.538 0.545 1.00 4.52 N ATOM 2206 CA THR B 26 8.212 -7.405 -0.249 1.00 51.44 C ATOM 2207 C THR B 26 9.337 -8.284 0.338 1.00 5.45 C ATOM 2208 O THR B 26 9.952 -9.079 -0.390 1.00 61.24 O ATOM 2209 CB THR B 26 8.696 -5.919 -0.332 1.00 51.32 C ATOM 2210 OG1 THR B 26 7.698 -5.120 -0.970 1.00 21.02 O ATOM 2211 CG2 THR B 26 10.027 -5.755 -1.093 1.00 53.15 C ATOM 0 H THR B 26 6.672 -6.676 1.007 1.00 4.52 H new ATOM 0 HA THR B 26 7.981 -7.745 -1.258 1.00 51.44 H new ATOM 0 HB THR B 26 8.863 -5.591 0.694 1.00 51.32 H new ATOM 0 HG1 THR B 26 7.986 -4.183 -0.981 1.00 21.02 H new ATOM 0 HG21 THR B 26 10.306 -4.702 -1.114 1.00 53.15 H new ATOM 0 HG22 THR B 26 10.807 -6.327 -0.590 1.00 53.15 H new ATOM 0 HG23 THR B 26 9.910 -6.120 -2.113 1.00 53.15 H new ATOM 2219 N ILE B 27 9.557 -8.161 1.670 1.00 51.03 N ATOM 2220 CA ILE B 27 10.611 -8.920 2.369 1.00 24.30 C ATOM 2221 C ILE B 27 10.274 -10.418 2.320 1.00 2.01 C ATOM 2222 O ILE B 27 11.141 -11.226 1.998 1.00 53.31 O ATOM 2223 CB ILE B 27 10.835 -8.437 3.854 1.00 73.42 C ATOM 2224 CG1 ILE B 27 11.238 -6.923 3.883 1.00 14.23 C ATOM 2225 CG2 ILE B 27 11.909 -9.303 4.578 1.00 55.32 C ATOM 2226 CD1 ILE B 27 11.431 -6.346 5.276 1.00 63.42 C ATOM 0 H ILE B 27 9.017 -7.543 2.276 1.00 51.03 H new ATOM 0 HA ILE B 27 11.552 -8.736 1.851 1.00 24.30 H new ATOM 0 HB ILE B 27 9.894 -8.559 4.390 1.00 73.42 H new ATOM 0 HG12 ILE B 27 12.163 -6.796 3.320 1.00 14.23 H new ATOM 0 HG13 ILE B 27 10.470 -6.346 3.368 1.00 14.23 H new ATOM 0 HG21 ILE B 27 12.039 -8.943 5.599 1.00 55.32 H new ATOM 0 HG22 ILE B 27 11.584 -10.343 4.598 1.00 55.32 H new ATOM 0 HG23 ILE B 27 12.856 -9.229 4.044 1.00 55.32 H new ATOM 0 HD11 ILE B 27 11.708 -5.295 5.199 1.00 63.42 H new ATOM 0 HD12 ILE B 27 10.502 -6.436 5.839 1.00 63.42 H new ATOM 0 HD13 ILE B 27 12.221 -6.893 5.790 1.00 63.42 H new ATOM 2238 N LYS B 28 8.982 -10.738 2.563 1.00 60.10 N ATOM 2239 CA LYS B 28 8.459 -12.113 2.482 1.00 64.13 C ATOM 2240 C LYS B 28 8.756 -12.741 1.101 1.00 72.52 C ATOM 2241 O LYS B 28 9.348 -13.806 1.041 1.00 74.44 O ATOM 2242 CB LYS B 28 6.927 -12.153 2.763 1.00 4.12 C ATOM 2243 CG LYS B 28 6.300 -13.544 2.531 1.00 22.10 C ATOM 2244 CD LYS B 28 4.781 -13.593 2.772 1.00 35.24 C ATOM 2245 CE LYS B 28 4.184 -14.949 2.350 1.00 63.22 C ATOM 2246 NZ LYS B 28 4.866 -16.102 3.007 1.00 60.11 N ATOM 0 H LYS B 28 8.277 -10.048 2.820 1.00 60.10 H new ATOM 0 HA LYS B 28 8.967 -12.697 3.249 1.00 64.13 H new ATOM 0 HB2 LYS B 28 6.746 -11.848 3.794 1.00 4.12 H new ATOM 0 HB3 LYS B 28 6.428 -11.426 2.122 1.00 4.12 H new ATOM 0 HG2 LYS B 28 6.506 -13.858 1.508 1.00 22.10 H new ATOM 0 HG3 LYS B 28 6.786 -14.265 3.189 1.00 22.10 H new ATOM 0 HD2 LYS B 28 4.573 -13.416 3.827 1.00 35.24 H new ATOM 0 HD3 LYS B 28 4.297 -12.792 2.213 1.00 35.24 H new ATOM 0 HE2 LYS B 28 3.123 -14.969 2.599 1.00 63.22 H new ATOM 0 HE3 LYS B 28 4.260 -15.055 1.268 1.00 63.22 H new ATOM 0 HZ1 LYS B 28 4.355 -16.980 2.785 1.00 60.11 H new ATOM 0 HZ2 LYS B 28 5.843 -16.172 2.658 1.00 60.11 H new ATOM 0 HZ3 LYS B 28 4.876 -15.958 4.037 1.00 60.11 H new ATOM 2260 N ASN B 29 8.383 -12.025 0.011 1.00 74.24 N ATOM 2261 CA ASN B 29 8.541 -12.511 -1.389 1.00 41.41 C ATOM 2262 C ASN B 29 10.009 -12.825 -1.701 1.00 73.44 C ATOM 2263 O ASN B 29 10.304 -13.787 -2.414 1.00 43.42 O ATOM 2264 CB ASN B 29 8.008 -11.472 -2.425 1.00 42.25 C ATOM 2265 CG ASN B 29 6.482 -11.319 -2.434 1.00 11.54 C ATOM 2266 OD1 ASN B 29 5.739 -12.248 -2.113 1.00 42.35 O ATOM 2267 ND2 ASN B 29 6.005 -10.139 -2.817 1.00 22.30 N ATOM 0 H ASN B 29 7.965 -11.097 0.074 1.00 74.24 H new ATOM 0 HA ASN B 29 7.950 -13.423 -1.473 1.00 41.41 H new ATOM 0 HB2 ASN B 29 8.458 -10.502 -2.214 1.00 42.25 H new ATOM 0 HB3 ASN B 29 8.338 -11.767 -3.421 1.00 42.25 H new ATOM 0 HD21 ASN B 29 4.998 -9.983 -2.851 1.00 22.30 H new ATOM 0 HD22 ASN B 29 6.646 -9.390 -3.077 1.00 22.30 H new ATOM 2274 N MET B 30 10.916 -12.002 -1.142 1.00 1.25 N ATOM 2275 CA MET B 30 12.366 -12.193 -1.302 1.00 70.33 C ATOM 2276 C MET B 30 12.846 -13.425 -0.505 1.00 11.43 C ATOM 2277 O MET B 30 13.656 -14.190 -1.002 1.00 72.24 O ATOM 2278 CB MET B 30 13.145 -10.907 -0.900 1.00 60.25 C ATOM 2279 CG MET B 30 12.884 -9.704 -1.828 1.00 52.33 C ATOM 2280 SD MET B 30 13.896 -8.255 -1.428 1.00 35.20 S ATOM 2281 CE MET B 30 13.287 -7.786 0.194 1.00 13.32 C ATOM 0 H MET B 30 10.666 -11.194 -0.572 1.00 1.25 H new ATOM 0 HA MET B 30 12.574 -12.382 -2.355 1.00 70.33 H new ATOM 0 HB2 MET B 30 12.873 -10.633 0.119 1.00 60.25 H new ATOM 0 HB3 MET B 30 14.213 -11.127 -0.897 1.00 60.25 H new ATOM 0 HG2 MET B 30 13.078 -10.001 -2.859 1.00 52.33 H new ATOM 0 HG3 MET B 30 11.831 -9.430 -1.768 1.00 52.33 H new ATOM 0 HE1 MET B 30 13.655 -6.792 0.447 1.00 13.32 H new ATOM 0 HE2 MET B 30 12.197 -7.778 0.185 1.00 13.32 H new ATOM 0 HE3 MET B 30 13.638 -8.503 0.936 1.00 13.32 H new ATOM 2291 N ILE B 31 12.286 -13.633 0.705 1.00 3.14 N ATOM 2292 CA ILE B 31 12.606 -14.811 1.545 1.00 44.34 C ATOM 2293 C ILE B 31 12.108 -16.103 0.858 1.00 12.54 C ATOM 2294 O ILE B 31 12.806 -17.116 0.861 1.00 4.21 O ATOM 2295 CB ILE B 31 11.980 -14.691 2.992 1.00 3.54 C ATOM 2296 CG1 ILE B 31 12.524 -13.424 3.733 1.00 33.44 C ATOM 2297 CG2 ILE B 31 12.247 -15.969 3.826 1.00 75.25 C ATOM 2298 CD1 ILE B 31 11.889 -13.152 5.091 1.00 2.12 C ATOM 0 H ILE B 31 11.607 -12.999 1.125 1.00 3.14 H new ATOM 0 HA ILE B 31 13.690 -14.852 1.657 1.00 44.34 H new ATOM 0 HB ILE B 31 10.901 -14.583 2.878 1.00 3.54 H new ATOM 0 HG12 ILE B 31 13.600 -13.534 3.867 1.00 33.44 H new ATOM 0 HG13 ILE B 31 12.369 -12.554 3.095 1.00 33.44 H new ATOM 0 HG21 ILE B 31 11.805 -15.857 4.816 1.00 75.25 H new ATOM 0 HG22 ILE B 31 11.803 -16.829 3.326 1.00 75.25 H new ATOM 0 HG23 ILE B 31 13.322 -16.121 3.924 1.00 75.25 H new ATOM 0 HD11 ILE B 31 12.330 -12.255 5.526 1.00 2.12 H new ATOM 0 HD12 ILE B 31 10.816 -13.005 4.968 1.00 2.12 H new ATOM 0 HD13 ILE B 31 12.066 -14.001 5.752 1.00 2.12 H new ATOM 2310 N GLU B 32 10.912 -16.028 0.236 1.00 54.15 N ATOM 2311 CA GLU B 32 10.307 -17.165 -0.481 1.00 14.21 C ATOM 2312 C GLU B 32 11.145 -17.519 -1.721 1.00 64.15 C ATOM 2313 O GLU B 32 11.384 -18.694 -2.011 1.00 35.22 O ATOM 2314 CB GLU B 32 8.842 -16.858 -0.922 1.00 5.43 C ATOM 2315 CG GLU B 32 7.869 -16.427 0.198 1.00 45.14 C ATOM 2316 CD GLU B 32 7.818 -17.361 1.424 1.00 51.24 C ATOM 2317 OE1 GLU B 32 7.858 -16.860 2.576 1.00 14.24 O ATOM 2318 OE2 GLU B 32 7.726 -18.592 1.248 1.00 75.01 O ATOM 0 H GLU B 32 10.343 -15.181 0.218 1.00 54.15 H new ATOM 0 HA GLU B 32 10.288 -18.009 0.208 1.00 14.21 H new ATOM 0 HB2 GLU B 32 8.869 -16.070 -1.675 1.00 5.43 H new ATOM 0 HB3 GLU B 32 8.436 -17.747 -1.405 1.00 5.43 H new ATOM 0 HG2 GLU B 32 8.148 -15.428 0.534 1.00 45.14 H new ATOM 0 HG3 GLU B 32 6.866 -16.353 -0.223 1.00 45.14 H new ATOM 2325 N ASP B 33 11.600 -16.466 -2.424 1.00 33.51 N ATOM 2326 CA ASP B 33 12.357 -16.588 -3.685 1.00 64.35 C ATOM 2327 C ASP B 33 13.756 -17.181 -3.433 1.00 22.53 C ATOM 2328 O ASP B 33 14.222 -18.048 -4.177 1.00 73.12 O ATOM 2329 CB ASP B 33 12.471 -15.197 -4.358 1.00 12.33 C ATOM 2330 CG ASP B 33 13.047 -15.272 -5.780 1.00 30.24 C ATOM 2331 OD1 ASP B 33 12.279 -15.583 -6.718 1.00 52.23 O ATOM 2332 OD2 ASP B 33 14.251 -15.026 -5.973 1.00 63.42 O ATOM 0 H ASP B 33 11.452 -15.500 -2.132 1.00 33.51 H new ATOM 0 HA ASP B 33 11.823 -17.266 -4.350 1.00 64.35 H new ATOM 0 HB2 ASP B 33 11.485 -14.733 -4.394 1.00 12.33 H new ATOM 0 HB3 ASP B 33 13.104 -14.553 -3.747 1.00 12.33 H new ATOM 2337 N ILE B 34 14.396 -16.710 -2.356 1.00 31.51 N ATOM 2338 CA ILE B 34 15.724 -17.181 -1.917 1.00 11.43 C ATOM 2339 C ILE B 34 15.593 -18.550 -1.193 1.00 61.22 C ATOM 2340 O ILE B 34 16.560 -19.319 -1.093 1.00 51.14 O ATOM 2341 CB ILE B 34 16.422 -16.090 -1.003 1.00 1.14 C ATOM 2342 CG1 ILE B 34 16.573 -14.738 -1.782 1.00 14.30 C ATOM 2343 CG2 ILE B 34 17.801 -16.560 -0.487 1.00 14.51 C ATOM 2344 CD1 ILE B 34 17.097 -13.573 -0.950 1.00 13.22 C ATOM 0 H ILE B 34 14.006 -15.983 -1.756 1.00 31.51 H new ATOM 0 HA ILE B 34 16.361 -17.329 -2.789 1.00 11.43 H new ATOM 0 HB ILE B 34 15.779 -15.938 -0.136 1.00 1.14 H new ATOM 0 HG12 ILE B 34 17.245 -14.895 -2.625 1.00 14.30 H new ATOM 0 HG13 ILE B 34 15.602 -14.463 -2.195 1.00 14.30 H new ATOM 0 HG21 ILE B 34 18.242 -15.781 0.135 1.00 14.51 H new ATOM 0 HG22 ILE B 34 17.679 -17.469 0.103 1.00 14.51 H new ATOM 0 HG23 ILE B 34 18.457 -16.763 -1.334 1.00 14.51 H new ATOM 0 HD11 ILE B 34 17.167 -12.682 -1.575 1.00 13.22 H new ATOM 0 HD12 ILE B 34 16.415 -13.382 -0.121 1.00 13.22 H new ATOM 0 HD13 ILE B 34 18.084 -13.820 -0.558 1.00 13.22 H new ATOM 2356 N GLY B 35 14.368 -18.866 -0.734 1.00 2.34 N ATOM 2357 CA GLY B 35 14.097 -20.081 0.036 1.00 12.14 C ATOM 2358 C GLY B 35 14.199 -19.798 1.523 1.00 45.03 C ATOM 2359 O GLY B 35 13.210 -19.877 2.259 1.00 44.44 O ATOM 0 H GLY B 35 13.545 -18.284 -0.889 1.00 2.34 H new ATOM 0 HA2 GLY B 35 13.101 -20.456 -0.202 1.00 12.14 H new ATOM 0 HA3 GLY B 35 14.806 -20.861 -0.242 1.00 12.14 H new ATOM 2363 N GLU B 36 15.414 -19.436 1.955 1.00 44.05 N ATOM 2364 CA GLU B 36 15.698 -18.956 3.319 1.00 40.33 C ATOM 2365 C GLU B 36 16.632 -17.748 3.206 1.00 64.11 C ATOM 2366 O GLU B 36 17.651 -17.823 2.507 1.00 62.41 O ATOM 2367 CB GLU B 36 16.367 -20.068 4.176 1.00 1.50 C ATOM 2368 CG GLU B 36 15.503 -21.327 4.367 1.00 32.31 C ATOM 2369 CD GLU B 36 16.192 -22.418 5.197 1.00 61.52 C ATOM 2370 OE1 GLU B 36 15.915 -22.527 6.412 1.00 40.24 O ATOM 2371 OE2 GLU B 36 17.013 -23.173 4.634 1.00 32.15 O ATOM 0 H GLU B 36 16.242 -19.468 1.360 1.00 44.05 H new ATOM 0 HA GLU B 36 14.766 -18.679 3.812 1.00 40.33 H new ATOM 0 HB2 GLU B 36 17.308 -20.355 3.707 1.00 1.50 H new ATOM 0 HB3 GLU B 36 16.612 -19.658 5.156 1.00 1.50 H new ATOM 0 HG2 GLU B 36 14.568 -21.047 4.853 1.00 32.31 H new ATOM 0 HG3 GLU B 36 15.245 -21.733 3.389 1.00 32.31 H new ATOM 2378 N SER B 37 16.272 -16.640 3.873 1.00 72.33 N ATOM 2379 CA SER B 37 17.079 -15.413 3.892 1.00 1.32 C ATOM 2380 C SER B 37 18.314 -15.585 4.816 1.00 4.24 C ATOM 2381 O SER B 37 18.304 -15.171 5.985 1.00 33.52 O ATOM 2382 CB SER B 37 16.191 -14.215 4.322 1.00 34.25 C ATOM 2383 OG SER B 37 15.479 -14.507 5.521 1.00 63.04 O ATOM 0 H SER B 37 15.411 -16.571 4.415 1.00 72.33 H new ATOM 0 HA SER B 37 17.459 -15.210 2.891 1.00 1.32 H new ATOM 0 HB2 SER B 37 16.813 -13.333 4.471 1.00 34.25 H new ATOM 0 HB3 SER B 37 15.486 -13.977 3.526 1.00 34.25 H new ATOM 0 HG SER B 37 16.098 -14.869 6.189 1.00 63.04 H new ATOM 2389 N ASP B 38 19.347 -16.265 4.282 1.00 21.33 N ATOM 2390 CA ASP B 38 20.659 -16.429 4.949 1.00 61.25 C ATOM 2391 C ASP B 38 21.475 -15.138 4.807 1.00 20.35 C ATOM 2392 O ASP B 38 22.190 -14.728 5.724 1.00 32.43 O ATOM 2393 CB ASP B 38 21.428 -17.627 4.324 1.00 71.53 C ATOM 2394 CG ASP B 38 22.847 -17.824 4.897 1.00 63.03 C ATOM 2395 OD1 ASP B 38 23.825 -17.354 4.274 1.00 63.24 O ATOM 2396 OD2 ASP B 38 22.987 -18.451 5.965 1.00 55.11 O ATOM 0 H ASP B 38 19.297 -16.720 3.370 1.00 21.33 H new ATOM 0 HA ASP B 38 20.501 -16.633 6.008 1.00 61.25 H new ATOM 0 HB2 ASP B 38 20.852 -18.539 4.483 1.00 71.53 H new ATOM 0 HB3 ASP B 38 21.499 -17.479 3.246 1.00 71.53 H new ATOM 2401 N SER B 39 21.353 -14.514 3.632 1.00 3.13 N ATOM 2402 CA SER B 39 22.018 -13.250 3.323 1.00 34.54 C ATOM 2403 C SER B 39 21.205 -12.076 3.905 1.00 70.42 C ATOM 2404 O SER B 39 19.967 -12.067 3.771 1.00 1.41 O ATOM 2405 CB SER B 39 22.166 -13.105 1.793 1.00 33.22 C ATOM 2406 OG SER B 39 20.912 -13.197 1.133 1.00 64.22 O ATOM 0 H SER B 39 20.786 -14.876 2.865 1.00 3.13 H new ATOM 0 HA SER B 39 23.011 -13.239 3.773 1.00 34.54 H new ATOM 0 HB2 SER B 39 22.630 -12.146 1.561 1.00 33.22 H new ATOM 0 HB3 SER B 39 22.833 -13.881 1.417 1.00 33.22 H new ATOM 0 HG SER B 39 21.043 -13.099 0.167 1.00 64.22 H new ATOM 2412 N PRO B 40 21.869 -11.083 4.588 1.00 45.44 N ATOM 2413 CA PRO B 40 21.198 -9.834 5.025 1.00 70.34 C ATOM 2414 C PRO B 40 20.622 -9.072 3.815 1.00 44.04 C ATOM 2415 O PRO B 40 21.213 -9.105 2.731 1.00 5.31 O ATOM 2416 CB PRO B 40 22.330 -9.029 5.711 1.00 23.52 C ATOM 2417 CG PRO B 40 23.383 -10.034 6.063 1.00 51.11 C ATOM 2418 CD PRO B 40 23.308 -11.093 4.989 1.00 52.54 C ATOM 0 HA PRO B 40 20.353 -10.014 5.690 1.00 70.34 H new ATOM 0 HB2 PRO B 40 22.726 -8.263 5.044 1.00 23.52 H new ATOM 0 HB3 PRO B 40 21.963 -8.517 6.601 1.00 23.52 H new ATOM 0 HG2 PRO B 40 24.371 -9.574 6.091 1.00 51.11 H new ATOM 0 HG3 PRO B 40 23.202 -10.462 7.049 1.00 51.11 H new ATOM 0 HD2 PRO B 40 23.960 -10.858 4.148 1.00 52.54 H new ATOM 0 HD3 PRO B 40 23.613 -12.069 5.366 1.00 52.54 H new ATOM 2426 N ILE B 41 19.472 -8.420 3.987 1.00 54.13 N ATOM 2427 CA ILE B 41 18.781 -7.728 2.887 1.00 21.40 C ATOM 2428 C ILE B 41 19.128 -6.217 2.907 1.00 41.32 C ATOM 2429 O ILE B 41 18.637 -5.488 3.778 1.00 14.35 O ATOM 2430 CB ILE B 41 17.222 -7.943 2.973 1.00 3.33 C ATOM 2431 CG1 ILE B 41 16.856 -9.472 2.983 1.00 11.03 C ATOM 2432 CG2 ILE B 41 16.484 -7.202 1.832 1.00 3.24 C ATOM 2433 CD1 ILE B 41 17.275 -10.252 1.736 1.00 72.05 C ATOM 0 H ILE B 41 18.992 -8.354 4.884 1.00 54.13 H new ATOM 0 HA ILE B 41 19.123 -8.154 1.944 1.00 21.40 H new ATOM 0 HB ILE B 41 16.886 -7.514 3.917 1.00 3.33 H new ATOM 0 HG12 ILE B 41 17.321 -9.934 3.854 1.00 11.03 H new ATOM 0 HG13 ILE B 41 15.778 -9.570 3.107 1.00 11.03 H new ATOM 0 HG21 ILE B 41 15.411 -7.372 1.922 1.00 3.24 H new ATOM 0 HG22 ILE B 41 16.689 -6.134 1.900 1.00 3.24 H new ATOM 0 HG23 ILE B 41 16.831 -7.578 0.870 1.00 3.24 H new ATOM 0 HD11 ILE B 41 16.977 -11.295 1.842 1.00 72.05 H new ATOM 0 HD12 ILE B 41 16.790 -9.824 0.859 1.00 72.05 H new ATOM 0 HD13 ILE B 41 18.357 -10.194 1.617 1.00 72.05 H new ATOM 2445 N PRO B 42 19.994 -5.723 1.966 1.00 3.34 N ATOM 2446 CA PRO B 42 20.294 -4.286 1.856 1.00 12.32 C ATOM 2447 C PRO B 42 19.211 -3.543 1.031 1.00 3.35 C ATOM 2448 O PRO B 42 19.028 -3.809 -0.163 1.00 72.45 O ATOM 2449 CB PRO B 42 21.678 -4.278 1.168 1.00 73.02 C ATOM 2450 CG PRO B 42 21.688 -5.502 0.290 1.00 64.03 C ATOM 2451 CD PRO B 42 20.751 -6.512 0.944 1.00 51.44 C ATOM 0 HA PRO B 42 20.301 -3.764 2.813 1.00 12.32 H new ATOM 0 HB2 PRO B 42 21.821 -3.371 0.581 1.00 73.02 H new ATOM 0 HB3 PRO B 42 22.483 -4.313 1.902 1.00 73.02 H new ATOM 0 HG2 PRO B 42 21.353 -5.259 -0.718 1.00 64.03 H new ATOM 0 HG3 PRO B 42 22.696 -5.908 0.202 1.00 64.03 H new ATOM 0 HD2 PRO B 42 20.079 -6.960 0.212 1.00 51.44 H new ATOM 0 HD3 PRO B 42 21.308 -7.327 1.406 1.00 51.44 H new ATOM 2459 N LEU B 43 18.461 -2.667 1.714 1.00 10.44 N ATOM 2460 CA LEU B 43 17.427 -1.810 1.109 1.00 62.12 C ATOM 2461 C LEU B 43 18.058 -0.457 0.677 1.00 70.50 C ATOM 2462 O LEU B 43 18.183 0.453 1.505 1.00 65.34 O ATOM 2463 CB LEU B 43 16.284 -1.588 2.142 1.00 4.12 C ATOM 2464 CG LEU B 43 15.623 -2.887 2.713 1.00 51.31 C ATOM 2465 CD1 LEU B 43 14.615 -2.556 3.836 1.00 54.04 C ATOM 2466 CD2 LEU B 43 14.964 -3.726 1.590 1.00 32.03 C ATOM 0 H LEU B 43 18.556 -2.530 2.720 1.00 10.44 H new ATOM 0 HA LEU B 43 17.011 -2.290 0.223 1.00 62.12 H new ATOM 0 HB2 LEU B 43 16.680 -1.008 2.975 1.00 4.12 H new ATOM 0 HB3 LEU B 43 15.508 -0.983 1.673 1.00 4.12 H new ATOM 0 HG LEU B 43 16.415 -3.494 3.151 1.00 51.31 H new ATOM 0 HD11 LEU B 43 14.173 -3.479 4.212 1.00 54.04 H new ATOM 0 HD12 LEU B 43 15.131 -2.043 4.648 1.00 54.04 H new ATOM 0 HD13 LEU B 43 13.829 -1.912 3.441 1.00 54.04 H new ATOM 0 HD21 LEU B 43 14.514 -4.621 2.020 1.00 32.03 H new ATOM 0 HD22 LEU B 43 14.193 -3.133 1.098 1.00 32.03 H new ATOM 0 HD23 LEU B 43 15.720 -4.015 0.860 1.00 32.03 H new ATOM 2478 N PRO B 44 18.463 -0.287 -0.628 1.00 52.03 N ATOM 2479 CA PRO B 44 19.246 0.886 -1.091 1.00 22.33 C ATOM 2480 C PRO B 44 18.349 2.077 -1.528 1.00 44.50 C ATOM 2481 O PRO B 44 18.741 2.886 -2.376 1.00 11.34 O ATOM 2482 CB PRO B 44 20.024 0.268 -2.273 1.00 41.50 C ATOM 2483 CG PRO B 44 19.041 -0.674 -2.910 1.00 24.20 C ATOM 2484 CD PRO B 44 18.174 -1.204 -1.773 1.00 13.34 C ATOM 0 HA PRO B 44 19.876 1.330 -0.321 1.00 22.33 H new ATOM 0 HB2 PRO B 44 20.355 1.033 -2.975 1.00 41.50 H new ATOM 0 HB3 PRO B 44 20.915 -0.258 -1.931 1.00 41.50 H new ATOM 0 HG2 PRO B 44 18.435 -0.160 -3.657 1.00 24.20 H new ATOM 0 HG3 PRO B 44 19.555 -1.488 -3.422 1.00 24.20 H new ATOM 0 HD2 PRO B 44 17.117 -1.188 -2.038 1.00 13.34 H new ATOM 0 HD3 PRO B 44 18.426 -2.236 -1.529 1.00 13.34 H new ATOM 2492 N ASN B 45 17.161 2.192 -0.909 1.00 11.12 N ATOM 2493 CA ASN B 45 16.158 3.228 -1.237 1.00 14.23 C ATOM 2494 C ASN B 45 15.732 3.956 0.046 1.00 42.00 C ATOM 2495 O ASN B 45 15.910 5.173 0.174 1.00 5.32 O ATOM 2496 CB ASN B 45 14.935 2.570 -1.936 1.00 23.35 C ATOM 2497 CG ASN B 45 13.790 3.546 -2.242 1.00 63.45 C ATOM 2498 OD1 ASN B 45 12.858 3.702 -1.447 1.00 34.15 O ATOM 2499 ND2 ASN B 45 13.846 4.206 -3.389 1.00 43.54 N ATOM 0 H ASN B 45 16.865 1.565 -0.161 1.00 11.12 H new ATOM 0 HA ASN B 45 16.592 3.958 -1.920 1.00 14.23 H new ATOM 0 HB2 ASN B 45 15.266 2.111 -2.868 1.00 23.35 H new ATOM 0 HB3 ASN B 45 14.556 1.768 -1.303 1.00 23.35 H new ATOM 0 HD21 ASN B 45 13.107 4.864 -3.635 1.00 43.54 H new ATOM 0 HD22 ASN B 45 14.629 4.056 -4.026 1.00 43.54 H new ATOM 2506 N VAL B 46 15.179 3.189 1.001 1.00 50.50 N ATOM 2507 CA VAL B 46 14.686 3.742 2.273 1.00 51.41 C ATOM 2508 C VAL B 46 15.869 4.061 3.223 1.00 74.50 C ATOM 2509 O VAL B 46 16.730 3.212 3.471 1.00 51.34 O ATOM 2510 CB VAL B 46 13.633 2.784 2.952 1.00 0.23 C ATOM 2511 CG1 VAL B 46 14.209 1.374 3.227 1.00 14.04 C ATOM 2512 CG2 VAL B 46 13.042 3.420 4.235 1.00 30.43 C ATOM 0 H VAL B 46 15.062 2.179 0.915 1.00 50.50 H new ATOM 0 HA VAL B 46 14.169 4.677 2.058 1.00 51.41 H new ATOM 0 HB VAL B 46 12.818 2.652 2.240 1.00 0.23 H new ATOM 0 HG11 VAL B 46 13.445 0.754 3.695 1.00 14.04 H new ATOM 0 HG12 VAL B 46 14.521 0.919 2.287 1.00 14.04 H new ATOM 0 HG13 VAL B 46 15.068 1.455 3.893 1.00 14.04 H new ATOM 0 HG21 VAL B 46 12.319 2.736 4.680 1.00 30.43 H new ATOM 0 HG22 VAL B 46 13.844 3.615 4.947 1.00 30.43 H new ATOM 0 HG23 VAL B 46 12.546 4.357 3.981 1.00 30.43 H new ATOM 2522 N THR B 47 15.901 5.308 3.723 1.00 71.54 N ATOM 2523 CA THR B 47 16.959 5.812 4.614 1.00 62.33 C ATOM 2524 C THR B 47 16.791 5.240 6.039 1.00 71.32 C ATOM 2525 O THR B 47 15.730 4.697 6.365 1.00 2.33 O ATOM 2526 CB THR B 47 16.925 7.373 4.652 1.00 54.31 C ATOM 2527 OG1 THR B 47 15.628 7.825 5.089 1.00 60.42 O ATOM 2528 CG2 THR B 47 17.250 7.987 3.271 1.00 0.30 C ATOM 0 H THR B 47 15.183 6.003 3.517 1.00 71.54 H new ATOM 0 HA THR B 47 17.924 5.486 4.226 1.00 62.33 H new ATOM 0 HB THR B 47 17.689 7.703 5.355 1.00 54.31 H new ATOM 0 HG1 THR B 47 15.614 8.805 5.112 1.00 60.42 H new ATOM 0 HG21 THR B 47 17.216 9.074 3.339 1.00 0.30 H new ATOM 0 HG22 THR B 47 18.246 7.674 2.959 1.00 0.30 H new ATOM 0 HG23 THR B 47 16.517 7.646 2.540 1.00 0.30 H new ATOM 2536 N SER B 48 17.836 5.396 6.874 1.00 11.40 N ATOM 2537 CA SER B 48 17.905 4.788 8.219 1.00 33.32 C ATOM 2538 C SER B 48 16.818 5.316 9.157 1.00 44.53 C ATOM 2539 O SER B 48 16.145 4.535 9.814 1.00 0.25 O ATOM 2540 CB SER B 48 19.282 5.044 8.847 1.00 63.22 C ATOM 2541 OG SER B 48 19.602 6.431 8.867 1.00 43.32 O ATOM 0 H SER B 48 18.659 5.949 6.635 1.00 11.40 H new ATOM 0 HA SER B 48 17.743 3.718 8.089 1.00 33.32 H new ATOM 0 HB2 SER B 48 19.297 4.653 9.864 1.00 63.22 H new ATOM 0 HB3 SER B 48 20.044 4.503 8.286 1.00 63.22 H new ATOM 0 HG SER B 48 20.575 6.543 8.836 1.00 43.32 H new ATOM 2547 N THR B 49 16.668 6.644 9.186 1.00 44.40 N ATOM 2548 CA THR B 49 15.725 7.344 10.066 1.00 73.23 C ATOM 2549 C THR B 49 14.273 6.890 9.800 1.00 73.02 C ATOM 2550 O THR B 49 13.541 6.510 10.725 1.00 32.41 O ATOM 2551 CB THR B 49 15.858 8.883 9.853 1.00 14.25 C ATOM 2552 OG1 THR B 49 15.718 9.181 8.451 1.00 62.01 O ATOM 2553 CG2 THR B 49 17.211 9.428 10.359 1.00 23.51 C ATOM 0 H THR B 49 17.206 7.273 8.590 1.00 44.40 H new ATOM 0 HA THR B 49 15.967 7.098 11.100 1.00 73.23 H new ATOM 0 HB THR B 49 15.071 9.367 10.431 1.00 14.25 H new ATOM 0 HG1 THR B 49 15.799 10.148 8.312 1.00 62.01 H new ATOM 0 HG21 THR B 49 17.256 10.504 10.189 1.00 23.51 H new ATOM 0 HG22 THR B 49 17.309 9.225 11.425 1.00 23.51 H new ATOM 0 HG23 THR B 49 18.024 8.941 9.820 1.00 23.51 H new ATOM 2561 N ILE B 50 13.888 6.896 8.512 1.00 70.22 N ATOM 2562 CA ILE B 50 12.534 6.516 8.078 1.00 1.30 C ATOM 2563 C ILE B 50 12.282 5.021 8.357 1.00 44.44 C ATOM 2564 O ILE B 50 11.263 4.664 8.959 1.00 23.31 O ATOM 2565 CB ILE B 50 12.316 6.847 6.553 1.00 55.13 C ATOM 2566 CG1 ILE B 50 12.514 8.377 6.295 1.00 42.25 C ATOM 2567 CG2 ILE B 50 10.927 6.376 6.055 1.00 23.23 C ATOM 2568 CD1 ILE B 50 11.541 9.283 7.046 1.00 24.55 C ATOM 0 H ILE B 50 14.505 7.164 7.745 1.00 70.22 H new ATOM 0 HA ILE B 50 11.814 7.100 8.651 1.00 1.30 H new ATOM 0 HB ILE B 50 13.065 6.297 5.983 1.00 55.13 H new ATOM 0 HG12 ILE B 50 13.532 8.650 6.574 1.00 42.25 H new ATOM 0 HG13 ILE B 50 12.415 8.567 5.226 1.00 42.25 H new ATOM 0 HG21 ILE B 50 10.816 6.623 4.999 1.00 23.23 H new ATOM 0 HG22 ILE B 50 10.840 5.298 6.187 1.00 23.23 H new ATOM 0 HG23 ILE B 50 10.146 6.876 6.628 1.00 23.23 H new ATOM 0 HD11 ILE B 50 11.754 10.325 6.805 1.00 24.55 H new ATOM 0 HD12 ILE B 50 10.519 9.044 6.750 1.00 24.55 H new ATOM 0 HD13 ILE B 50 11.654 9.128 8.119 1.00 24.55 H new ATOM 2580 N LEU B 51 13.260 4.174 7.975 1.00 12.00 N ATOM 2581 CA LEU B 51 13.172 2.708 8.135 1.00 13.42 C ATOM 2582 C LEU B 51 13.103 2.314 9.628 1.00 52.10 C ATOM 2583 O LEU B 51 12.393 1.382 9.989 1.00 52.24 O ATOM 2584 CB LEU B 51 14.377 2.001 7.441 1.00 53.35 C ATOM 2585 CG LEU B 51 14.295 0.442 7.346 1.00 61.23 C ATOM 2586 CD1 LEU B 51 13.025 -0.012 6.587 1.00 14.42 C ATOM 2587 CD2 LEU B 51 15.569 -0.154 6.704 1.00 0.51 C ATOM 0 H LEU B 51 14.132 4.487 7.548 1.00 12.00 H new ATOM 0 HA LEU B 51 12.252 2.376 7.653 1.00 13.42 H new ATOM 0 HB2 LEU B 51 14.476 2.402 6.432 1.00 53.35 H new ATOM 0 HB3 LEU B 51 15.287 2.265 7.980 1.00 53.35 H new ATOM 0 HG LEU B 51 14.228 0.059 8.364 1.00 61.23 H new ATOM 0 HD11 LEU B 51 12.999 -1.101 6.539 1.00 14.42 H new ATOM 0 HD12 LEU B 51 12.140 0.349 7.110 1.00 14.42 H new ATOM 0 HD13 LEU B 51 13.040 0.395 5.576 1.00 14.42 H new ATOM 0 HD21 LEU B 51 15.478 -1.239 6.654 1.00 0.51 H new ATOM 0 HD22 LEU B 51 15.691 0.247 5.698 1.00 0.51 H new ATOM 0 HD23 LEU B 51 16.438 0.109 7.307 1.00 0.51 H new ATOM 2599 N GLU B 52 13.819 3.080 10.474 1.00 42.21 N ATOM 2600 CA GLU B 52 13.878 2.860 11.935 1.00 70.32 C ATOM 2601 C GLU B 52 12.478 2.960 12.546 1.00 3.33 C ATOM 2602 O GLU B 52 12.031 2.053 13.254 1.00 4.15 O ATOM 2603 CB GLU B 52 14.812 3.911 12.596 1.00 31.03 C ATOM 2604 CG GLU B 52 14.950 3.790 14.123 1.00 44.42 C ATOM 2605 CD GLU B 52 15.827 4.894 14.723 1.00 4.43 C ATOM 2606 OE1 GLU B 52 17.037 4.663 14.939 1.00 2.35 O ATOM 2607 OE2 GLU B 52 15.306 6.002 14.973 1.00 65.11 O ATOM 0 H GLU B 52 14.377 3.875 10.162 1.00 42.21 H new ATOM 0 HA GLU B 52 14.274 1.861 12.118 1.00 70.32 H new ATOM 0 HB2 GLU B 52 15.803 3.826 12.149 1.00 31.03 H new ATOM 0 HB3 GLU B 52 14.439 4.907 12.358 1.00 31.03 H new ATOM 0 HG2 GLU B 52 13.960 3.829 14.578 1.00 44.42 H new ATOM 0 HG3 GLU B 52 15.376 2.818 14.370 1.00 44.42 H new ATOM 2614 N LYS B 53 11.792 4.072 12.215 1.00 20.33 N ATOM 2615 CA LYS B 53 10.436 4.355 12.703 1.00 43.11 C ATOM 2616 C LYS B 53 9.426 3.314 12.185 1.00 53.33 C ATOM 2617 O LYS B 53 8.670 2.746 12.978 1.00 2.44 O ATOM 2618 CB LYS B 53 9.993 5.795 12.305 1.00 55.55 C ATOM 2619 CG LYS B 53 10.639 6.918 13.142 1.00 32.31 C ATOM 2620 CD LYS B 53 10.111 8.326 12.765 1.00 74.54 C ATOM 2621 CE LYS B 53 10.511 8.760 11.347 1.00 25.55 C ATOM 2622 NZ LYS B 53 11.981 8.809 11.193 1.00 63.54 N ATOM 0 H LYS B 53 12.166 4.796 11.602 1.00 20.33 H new ATOM 0 HA LYS B 53 10.456 4.290 13.791 1.00 43.11 H new ATOM 0 HB2 LYS B 53 10.234 5.958 11.254 1.00 55.55 H new ATOM 0 HB3 LYS B 53 8.909 5.867 12.399 1.00 55.55 H new ATOM 0 HG2 LYS B 53 10.447 6.734 14.199 1.00 32.31 H new ATOM 0 HG3 LYS B 53 11.720 6.891 13.005 1.00 32.31 H new ATOM 0 HD2 LYS B 53 9.024 8.334 12.848 1.00 74.54 H new ATOM 0 HD3 LYS B 53 10.491 9.054 13.482 1.00 74.54 H new ATOM 0 HE2 LYS B 53 10.090 8.065 10.620 1.00 25.55 H new ATOM 0 HE3 LYS B 53 10.088 9.741 11.132 1.00 25.55 H new ATOM 0 HZ1 LYS B 53 12.222 9.338 10.331 1.00 63.54 H new ATOM 0 HZ2 LYS B 53 12.401 9.282 12.019 1.00 63.54 H new ATOM 0 HZ3 LYS B 53 12.355 7.841 11.121 1.00 63.54 H new ATOM 2636 N VAL B 54 9.442 3.057 10.860 1.00 11.01 N ATOM 2637 CA VAL B 54 8.459 2.160 10.211 1.00 23.22 C ATOM 2638 C VAL B 54 8.563 0.729 10.796 1.00 12.22 C ATOM 2639 O VAL B 54 7.546 0.140 11.164 1.00 22.12 O ATOM 2640 CB VAL B 54 8.617 2.149 8.635 1.00 41.31 C ATOM 2641 CG1 VAL B 54 7.624 1.169 7.962 1.00 1.24 C ATOM 2642 CG2 VAL B 54 8.436 3.573 8.054 1.00 73.24 C ATOM 0 H VAL B 54 10.125 3.458 10.217 1.00 11.01 H new ATOM 0 HA VAL B 54 7.464 2.549 10.426 1.00 23.22 H new ATOM 0 HB VAL B 54 9.627 1.803 8.417 1.00 41.31 H new ATOM 0 HG11 VAL B 54 7.766 1.192 6.882 1.00 1.24 H new ATOM 0 HG12 VAL B 54 7.804 0.159 8.330 1.00 1.24 H new ATOM 0 HG13 VAL B 54 6.602 1.465 8.200 1.00 1.24 H new ATOM 0 HG21 VAL B 54 8.549 3.541 6.970 1.00 73.24 H new ATOM 0 HG22 VAL B 54 7.442 3.945 8.305 1.00 73.24 H new ATOM 0 HG23 VAL B 54 9.189 4.237 8.478 1.00 73.24 H new ATOM 2652 N LEU B 55 9.807 0.221 10.942 1.00 33.03 N ATOM 2653 CA LEU B 55 10.074 -1.122 11.523 1.00 21.10 C ATOM 2654 C LEU B 55 9.728 -1.185 13.030 1.00 24.30 C ATOM 2655 O LEU B 55 9.358 -2.252 13.537 1.00 32.21 O ATOM 2656 CB LEU B 55 11.554 -1.545 11.322 1.00 65.21 C ATOM 2657 CG LEU B 55 12.043 -1.747 9.852 1.00 40.51 C ATOM 2658 CD1 LEU B 55 13.503 -2.247 9.838 1.00 30.41 C ATOM 2659 CD2 LEU B 55 11.113 -2.691 9.046 1.00 41.23 C ATOM 0 H LEU B 55 10.651 0.722 10.664 1.00 33.03 H new ATOM 0 HA LEU B 55 9.426 -1.817 10.989 1.00 21.10 H new ATOM 0 HB2 LEU B 55 12.188 -0.791 11.789 1.00 65.21 H new ATOM 0 HB3 LEU B 55 11.716 -2.477 11.864 1.00 65.21 H new ATOM 0 HG LEU B 55 12.003 -0.778 9.355 1.00 40.51 H new ATOM 0 HD11 LEU B 55 13.831 -2.384 8.808 1.00 30.41 H new ATOM 0 HD12 LEU B 55 14.143 -1.514 10.328 1.00 30.41 H new ATOM 0 HD13 LEU B 55 13.567 -3.197 10.368 1.00 30.41 H new ATOM 0 HD21 LEU B 55 11.496 -2.799 8.031 1.00 41.23 H new ATOM 0 HD22 LEU B 55 11.081 -3.668 9.528 1.00 41.23 H new ATOM 0 HD23 LEU B 55 10.108 -2.270 9.012 1.00 41.23 H new ATOM 2671 N ASP B 56 9.876 -0.041 13.731 1.00 73.30 N ATOM 2672 CA ASP B 56 9.572 0.063 15.178 1.00 25.30 C ATOM 2673 C ASP B 56 8.051 -0.063 15.398 1.00 13.33 C ATOM 2674 O ASP B 56 7.593 -0.771 16.309 1.00 20.54 O ATOM 2675 CB ASP B 56 10.101 1.406 15.759 1.00 51.14 C ATOM 2676 CG ASP B 56 10.167 1.422 17.301 1.00 21.05 C ATOM 2677 OD1 ASP B 56 9.135 1.639 17.966 1.00 22.24 O ATOM 2678 OD2 ASP B 56 11.268 1.219 17.864 1.00 15.33 O ATOM 0 H ASP B 56 10.206 0.830 13.316 1.00 73.30 H new ATOM 0 HA ASP B 56 10.076 -0.749 15.703 1.00 25.30 H new ATOM 0 HB2 ASP B 56 11.096 1.600 15.358 1.00 51.14 H new ATOM 0 HB3 ASP B 56 9.457 2.218 15.422 1.00 51.14 H new ATOM 2683 N TYR B 57 7.283 0.607 14.516 1.00 3.11 N ATOM 2684 CA TYR B 57 5.811 0.546 14.510 1.00 11.33 C ATOM 2685 C TYR B 57 5.340 -0.857 14.088 1.00 44.04 C ATOM 2686 O TYR B 57 4.325 -1.352 14.585 1.00 30.31 O ATOM 2687 CB TYR B 57 5.214 1.618 13.555 1.00 50.23 C ATOM 2688 CG TYR B 57 3.673 1.656 13.553 1.00 23.34 C ATOM 2689 CD1 TYR B 57 2.967 2.443 14.468 1.00 41.32 C ATOM 2690 CD2 TYR B 57 2.925 0.870 12.663 1.00 21.01 C ATOM 2691 CE1 TYR B 57 1.584 2.443 14.492 1.00 44.52 C ATOM 2692 CE2 TYR B 57 1.544 0.873 12.683 1.00 54.22 C ATOM 2693 CZ TYR B 57 0.880 1.657 13.600 1.00 1.02 C ATOM 2694 OH TYR B 57 -0.494 1.642 13.639 1.00 25.43 O ATOM 0 H TYR B 57 7.669 1.207 13.787 1.00 3.11 H new ATOM 0 HA TYR B 57 5.458 0.753 15.520 1.00 11.33 H new ATOM 0 HB2 TYR B 57 5.593 2.599 13.842 1.00 50.23 H new ATOM 0 HB3 TYR B 57 5.565 1.425 12.541 1.00 50.23 H new ATOM 0 HD1 TYR B 57 3.510 3.061 15.167 1.00 41.32 H new ATOM 0 HD2 TYR B 57 3.441 0.249 11.946 1.00 21.01 H new ATOM 0 HE1 TYR B 57 1.055 3.056 15.207 1.00 44.52 H new ATOM 0 HE2 TYR B 57 0.989 0.265 11.984 1.00 54.22 H new ATOM 0 HH TYR B 57 -0.822 2.514 13.942 1.00 25.43 H new ATOM 2704 N CYS B 58 6.075 -1.474 13.144 1.00 40.12 N ATOM 2705 CA CYS B 58 5.794 -2.841 12.681 1.00 33.15 C ATOM 2706 C CYS B 58 5.946 -3.840 13.833 1.00 51.14 C ATOM 2707 O CYS B 58 5.135 -4.763 13.976 1.00 22.01 O ATOM 2708 CB CYS B 58 6.728 -3.227 11.520 1.00 54.44 C ATOM 2709 SG CYS B 58 6.505 -2.210 10.064 1.00 12.35 S ATOM 0 H CYS B 58 6.875 -1.040 12.685 1.00 40.12 H new ATOM 0 HA CYS B 58 4.765 -2.872 12.323 1.00 33.15 H new ATOM 0 HB2 CYS B 58 7.763 -3.149 11.854 1.00 54.44 H new ATOM 0 HB3 CYS B 58 6.556 -4.270 11.256 1.00 54.44 H new ATOM 0 HG CYS B 58 7.021 -1.035 10.272 1.00 12.35 H new ATOM 2715 N ARG B 59 6.989 -3.635 14.664 1.00 44.24 N ATOM 2716 CA ARG B 59 7.237 -4.485 15.839 1.00 73.14 C ATOM 2717 C ARG B 59 6.111 -4.305 16.857 1.00 40.31 C ATOM 2718 O ARG B 59 5.609 -5.278 17.395 1.00 11.21 O ATOM 2719 CB ARG B 59 8.618 -4.206 16.490 1.00 65.21 C ATOM 2720 CG ARG B 59 8.971 -5.223 17.604 1.00 12.13 C ATOM 2721 CD ARG B 59 10.441 -5.169 18.056 1.00 34.04 C ATOM 2722 NE ARG B 59 10.827 -6.426 18.725 1.00 33.03 N ATOM 2723 CZ ARG B 59 11.789 -6.572 19.644 1.00 23.32 C ATOM 2724 NH1 ARG B 59 12.497 -5.532 20.077 1.00 42.43 N ATOM 2725 NH2 ARG B 59 12.039 -7.781 20.117 1.00 61.22 N ATOM 0 H ARG B 59 7.671 -2.887 14.540 1.00 44.24 H new ATOM 0 HA ARG B 59 7.255 -5.521 15.500 1.00 73.14 H new ATOM 0 HB2 ARG B 59 9.390 -4.234 15.721 1.00 65.21 H new ATOM 0 HB3 ARG B 59 8.621 -3.200 16.908 1.00 65.21 H new ATOM 0 HG2 ARG B 59 8.329 -5.040 18.466 1.00 12.13 H new ATOM 0 HG3 ARG B 59 8.747 -6.229 17.248 1.00 12.13 H new ATOM 0 HD2 ARG B 59 11.086 -4.997 17.194 1.00 34.04 H new ATOM 0 HD3 ARG B 59 10.587 -4.330 18.736 1.00 34.04 H new ATOM 0 HE ARG B 59 10.311 -7.265 18.462 1.00 33.03 H new ATOM 0 HH11 ARG B 59 12.311 -4.599 19.708 1.00 42.43 H new ATOM 0 HH12 ARG B 59 13.225 -5.667 20.778 1.00 42.43 H new ATOM 0 HH21 ARG B 59 11.503 -8.581 19.781 1.00 61.22 H new ATOM 0 HH22 ARG B 59 12.768 -7.914 20.818 1.00 61.22 H new ATOM 2739 N HIS B 60 5.699 -3.038 17.049 1.00 64.02 N ATOM 2740 CA HIS B 60 4.551 -2.662 17.898 1.00 71.13 C ATOM 2741 C HIS B 60 3.272 -3.412 17.475 1.00 30.20 C ATOM 2742 O HIS B 60 2.525 -3.917 18.317 1.00 33.12 O ATOM 2743 CB HIS B 60 4.336 -1.124 17.800 1.00 1.13 C ATOM 2744 CG HIS B 60 3.083 -0.621 18.452 1.00 65.33 C ATOM 2745 ND1 HIS B 60 2.977 -0.392 19.801 1.00 5.53 N ATOM 2746 CD2 HIS B 60 1.886 -0.270 17.922 1.00 3.33 C ATOM 2747 CE1 HIS B 60 1.771 0.048 20.071 1.00 14.00 C ATOM 2748 NE2 HIS B 60 1.088 0.136 18.953 1.00 52.41 N ATOM 0 H HIS B 60 6.158 -2.237 16.615 1.00 64.02 H new ATOM 0 HA HIS B 60 4.766 -2.942 18.929 1.00 71.13 H new ATOM 0 HB2 HIS B 60 5.191 -0.622 18.253 1.00 1.13 H new ATOM 0 HB3 HIS B 60 4.320 -0.840 16.748 1.00 1.13 H new ATOM 0 HD2 HIS B 60 1.614 -0.305 16.877 1.00 3.33 H new ATOM 0 HE1 HIS B 60 1.400 0.298 21.054 1.00 14.00 H new ATOM 0 HE2 HIS B 60 0.123 0.454 18.869 1.00 52.41 H new ATOM 2757 N HIS B 61 3.065 -3.485 16.154 1.00 63.44 N ATOM 2758 CA HIS B 61 1.886 -4.118 15.550 1.00 20.54 C ATOM 2759 C HIS B 61 1.964 -5.658 15.635 1.00 51.51 C ATOM 2760 O HIS B 61 0.934 -6.332 15.632 1.00 14.22 O ATOM 2761 CB HIS B 61 1.757 -3.665 14.075 1.00 54.52 C ATOM 2762 CG HIS B 61 0.491 -4.133 13.412 1.00 13.23 C ATOM 2763 ND1 HIS B 61 0.393 -5.318 12.710 1.00 33.33 N ATOM 2764 CD2 HIS B 61 -0.740 -3.574 13.374 1.00 23.32 C ATOM 2765 CE1 HIS B 61 -0.840 -5.467 12.276 1.00 31.52 C ATOM 2766 NE2 HIS B 61 -1.548 -4.425 12.662 1.00 70.41 N ATOM 0 H HIS B 61 3.717 -3.103 15.469 1.00 63.44 H new ATOM 0 HA HIS B 61 1.003 -3.805 16.107 1.00 20.54 H new ATOM 0 HB2 HIS B 61 1.799 -2.577 14.033 1.00 54.52 H new ATOM 0 HB3 HIS B 61 2.612 -4.039 13.512 1.00 54.52 H new ATOM 0 HD1 HIS B 61 1.157 -5.975 12.553 1.00 33.33 H new ATOM 0 HD2 HIS B 61 -1.032 -2.635 13.820 1.00 23.32 H new ATOM 0 HE1 HIS B 61 -1.210 -6.303 11.700 1.00 31.52 H new ATOM 2775 N HIS B 62 3.195 -6.206 15.674 1.00 33.21 N ATOM 2776 CA HIS B 62 3.404 -7.664 15.786 1.00 75.20 C ATOM 2777 C HIS B 62 3.212 -8.130 17.243 1.00 72.20 C ATOM 2778 O HIS B 62 2.637 -9.202 17.492 1.00 63.33 O ATOM 2779 CB HIS B 62 4.809 -8.063 15.261 1.00 62.14 C ATOM 2780 CG HIS B 62 5.071 -9.551 15.310 1.00 33.14 C ATOM 2781 ND1 HIS B 62 4.463 -10.437 14.449 1.00 42.11 N ATOM 2782 CD2 HIS B 62 5.812 -10.312 16.161 1.00 14.22 C ATOM 2783 CE1 HIS B 62 4.806 -11.667 14.766 1.00 44.33 C ATOM 2784 NE2 HIS B 62 5.624 -11.621 15.798 1.00 73.10 N ATOM 0 H HIS B 62 4.057 -5.663 15.630 1.00 33.21 H new ATOM 0 HA HIS B 62 2.658 -8.163 15.167 1.00 75.20 H new ATOM 0 HB2 HIS B 62 4.916 -7.717 14.233 1.00 62.14 H new ATOM 0 HB3 HIS B 62 5.568 -7.549 15.851 1.00 62.14 H new ATOM 0 HD2 HIS B 62 6.431 -9.953 16.970 1.00 14.22 H new ATOM 0 HE1 HIS B 62 4.473 -12.564 14.265 1.00 44.33 H new ATOM 0 HE2 HIS B 62 6.049 -12.429 16.253 1.00 73.10 H new ATOM 2793 N GLN B 63 3.705 -7.310 18.190 1.00 23.52 N ATOM 2794 CA GLN B 63 3.606 -7.580 19.639 1.00 33.54 C ATOM 2795 C GLN B 63 2.157 -7.404 20.113 1.00 30.51 C ATOM 2796 O GLN B 63 1.668 -8.155 20.962 1.00 14.44 O ATOM 2797 CB GLN B 63 4.557 -6.648 20.453 1.00 65.50 C ATOM 2798 CG GLN B 63 6.061 -6.758 20.104 1.00 43.44 C ATOM 2799 CD GLN B 63 6.593 -8.190 20.116 1.00 5.33 C ATOM 2800 OE1 GLN B 63 6.624 -8.872 19.087 1.00 30.23 O ATOM 2801 NE2 GLN B 63 6.985 -8.667 21.284 1.00 72.34 N ATOM 0 H GLN B 63 4.186 -6.437 17.972 1.00 23.52 H new ATOM 0 HA GLN B 63 3.915 -8.611 19.812 1.00 33.54 H new ATOM 0 HB2 GLN B 63 4.242 -5.616 20.302 1.00 65.50 H new ATOM 0 HB3 GLN B 63 4.431 -6.867 21.513 1.00 65.50 H new ATOM 0 HG2 GLN B 63 6.228 -6.326 19.117 1.00 43.44 H new ATOM 0 HG3 GLN B 63 6.634 -6.161 20.814 1.00 43.44 H new ATOM 0 HE21 GLN B 63 6.946 -8.077 22.115 1.00 72.34 H new ATOM 0 HE22 GLN B 63 7.326 -9.626 21.355 1.00 72.34 H new ATOM 2810 N HIS B 64 1.487 -6.389 19.553 1.00 20.42 N ATOM 2811 CA HIS B 64 0.082 -6.078 19.840 1.00 63.14 C ATOM 2812 C HIS B 64 -0.689 -5.996 18.503 1.00 32.20 C ATOM 2813 O HIS B 64 -0.763 -4.917 17.891 1.00 64.21 O ATOM 2814 CB HIS B 64 -0.033 -4.747 20.634 1.00 53.11 C ATOM 2815 CG HIS B 64 0.594 -4.775 22.007 1.00 22.15 C ATOM 2816 ND1 HIS B 64 -0.131 -4.995 23.157 1.00 75.30 N ATOM 2817 CD2 HIS B 64 1.879 -4.592 22.413 1.00 4.13 C ATOM 2818 CE1 HIS B 64 0.673 -4.955 24.199 1.00 23.11 C ATOM 2819 NE2 HIS B 64 1.897 -4.712 23.780 1.00 41.21 N ATOM 0 H HIS B 64 1.912 -5.752 18.879 1.00 20.42 H new ATOM 0 HA HIS B 64 -0.351 -6.864 20.459 1.00 63.14 H new ATOM 0 HB2 HIS B 64 0.433 -3.952 20.053 1.00 53.11 H new ATOM 0 HB3 HIS B 64 -1.088 -4.491 20.736 1.00 53.11 H new ATOM 0 HD2 HIS B 64 2.728 -4.390 21.777 1.00 4.13 H new ATOM 0 HE1 HIS B 64 0.377 -5.098 25.228 1.00 23.11 H new ATOM 0 HE2 HIS B 64 2.722 -4.627 24.373 1.00 41.21 H new ATOM 2917 N ILE B 73 -7.487 5.363 19.211 1.00 51.14 N ATOM 2918 CA ILE B 73 -6.327 6.191 18.847 1.00 21.23 C ATOM 2919 C ILE B 73 -5.289 6.179 20.005 1.00 60.41 C ATOM 2920 O ILE B 73 -5.338 7.041 20.900 1.00 52.42 O ATOM 2921 CB ILE B 73 -6.741 7.664 18.424 1.00 31.41 C ATOM 2922 CG1 ILE B 73 -7.809 7.622 17.271 1.00 10.42 C ATOM 2923 CG2 ILE B 73 -5.507 8.504 18.002 1.00 61.05 C ATOM 2924 CD1 ILE B 73 -8.357 8.978 16.844 1.00 25.33 C ATOM 0 HA ILE B 73 -5.862 5.756 17.963 1.00 21.23 H new ATOM 0 HB ILE B 73 -7.184 8.150 19.293 1.00 31.41 H new ATOM 0 HG12 ILE B 73 -7.363 7.138 16.402 1.00 10.42 H new ATOM 0 HG13 ILE B 73 -8.642 6.996 17.592 1.00 10.42 H new ATOM 0 HG21 ILE B 73 -5.829 9.506 17.719 1.00 61.05 H new ATOM 0 HG22 ILE B 73 -4.809 8.569 18.836 1.00 61.05 H new ATOM 0 HG23 ILE B 73 -5.015 8.028 17.154 1.00 61.05 H new ATOM 0 HD11 ILE B 73 -9.085 8.841 16.045 1.00 25.33 H new ATOM 0 HD12 ILE B 73 -8.838 9.460 17.695 1.00 25.33 H new ATOM 0 HD13 ILE B 73 -7.540 9.605 16.487 1.00 25.33 H new ATOM 2936 N PRO B 74 -4.393 5.140 20.052 1.00 4.31 N ATOM 2937 CA PRO B 74 -3.353 5.030 21.103 1.00 20.22 C ATOM 2938 C PRO B 74 -2.301 6.159 20.979 1.00 44.34 C ATOM 2939 O PRO B 74 -1.903 6.479 19.860 1.00 54.53 O ATOM 2940 CB PRO B 74 -2.726 3.632 20.857 1.00 3.34 C ATOM 2941 CG PRO B 74 -3.679 2.917 19.941 1.00 21.43 C ATOM 2942 CD PRO B 74 -4.323 3.992 19.107 1.00 72.33 C ATOM 0 HA PRO B 74 -3.759 5.133 22.109 1.00 20.22 H new ATOM 0 HB2 PRO B 74 -1.738 3.720 20.404 1.00 3.34 H new ATOM 0 HB3 PRO B 74 -2.600 3.089 21.793 1.00 3.34 H new ATOM 0 HG2 PRO B 74 -3.154 2.196 19.314 1.00 21.43 H new ATOM 0 HG3 PRO B 74 -4.425 2.361 20.508 1.00 21.43 H new ATOM 0 HD2 PRO B 74 -3.730 4.230 18.224 1.00 72.33 H new ATOM 0 HD3 PRO B 74 -5.311 3.695 18.756 1.00 72.33 H new ATOM 2950 N PRO B 75 -1.852 6.781 22.124 1.00 42.24 N ATOM 2951 CA PRO B 75 -0.895 7.927 22.134 1.00 24.34 C ATOM 2952 C PRO B 75 0.367 7.699 21.263 1.00 2.23 C ATOM 2953 O PRO B 75 0.750 8.593 20.516 1.00 40.53 O ATOM 2954 CB PRO B 75 -0.534 8.105 23.644 1.00 33.31 C ATOM 2955 CG PRO B 75 -1.083 6.889 24.337 1.00 62.54 C ATOM 2956 CD PRO B 75 -2.268 6.453 23.512 1.00 51.13 C ATOM 0 HA PRO B 75 -1.344 8.817 21.692 1.00 24.34 H new ATOM 0 HB2 PRO B 75 0.544 8.182 23.783 1.00 33.31 H new ATOM 0 HB3 PRO B 75 -0.973 9.018 24.047 1.00 33.31 H new ATOM 0 HG2 PRO B 75 -0.334 6.099 24.395 1.00 62.54 H new ATOM 0 HG3 PRO B 75 -1.381 7.121 25.359 1.00 62.54 H new ATOM 0 HD2 PRO B 75 -2.472 5.389 23.631 1.00 51.13 H new ATOM 0 HD3 PRO B 75 -3.175 6.985 23.797 1.00 51.13 H new ATOM 2964 N TYR B 76 0.980 6.493 21.355 1.00 34.40 N ATOM 2965 CA TYR B 76 2.168 6.136 20.536 1.00 44.32 C ATOM 2966 C TYR B 76 1.848 6.221 19.032 1.00 35.53 C ATOM 2967 O TYR B 76 2.509 6.942 18.290 1.00 74.04 O ATOM 2968 CB TYR B 76 2.693 4.711 20.889 1.00 31.01 C ATOM 2969 CG TYR B 76 3.755 4.167 19.907 1.00 45.42 C ATOM 2970 CD1 TYR B 76 5.086 4.595 19.955 1.00 52.33 C ATOM 2971 CD2 TYR B 76 3.413 3.237 18.910 1.00 70.24 C ATOM 2972 CE1 TYR B 76 6.028 4.112 19.061 1.00 71.30 C ATOM 2973 CE2 TYR B 76 4.355 2.757 18.019 1.00 21.42 C ATOM 2974 CZ TYR B 76 5.658 3.199 18.100 1.00 15.42 C ATOM 2975 OH TYR B 76 6.605 2.716 17.224 1.00 23.30 O ATOM 0 H TYR B 76 0.673 5.752 21.986 1.00 34.40 H new ATOM 0 HA TYR B 76 2.951 6.858 20.769 1.00 44.32 H new ATOM 0 HB2 TYR B 76 3.118 4.731 21.892 1.00 31.01 H new ATOM 0 HB3 TYR B 76 1.850 4.021 20.914 1.00 31.01 H new ATOM 0 HD1 TYR B 76 5.385 5.315 20.702 1.00 52.33 H new ATOM 0 HD2 TYR B 76 2.393 2.890 18.838 1.00 70.24 H new ATOM 0 HE1 TYR B 76 7.052 4.452 19.118 1.00 71.30 H new ATOM 0 HE2 TYR B 76 4.071 2.039 17.263 1.00 21.42 H new ATOM 0 HH TYR B 76 7.380 2.389 17.727 1.00 23.30 H new ATOM 2985 N ASP B 77 0.803 5.483 18.634 1.00 22.13 N ATOM 2986 CA ASP B 77 0.373 5.331 17.228 1.00 4.45 C ATOM 2987 C ASP B 77 -0.060 6.690 16.629 1.00 35.14 C ATOM 2988 O ASP B 77 0.083 6.926 15.425 1.00 14.53 O ATOM 2989 CB ASP B 77 -0.799 4.308 17.160 1.00 1.34 C ATOM 2990 CG ASP B 77 -0.449 2.910 17.726 1.00 1.22 C ATOM 2991 OD1 ASP B 77 -0.490 1.908 16.977 1.00 31.33 O ATOM 2992 OD2 ASP B 77 -0.131 2.807 18.935 1.00 23.50 O ATOM 0 H ASP B 77 0.219 4.963 19.289 1.00 22.13 H new ATOM 0 HA ASP B 77 1.213 4.964 16.639 1.00 4.45 H new ATOM 0 HB2 ASP B 77 -1.650 4.709 17.711 1.00 1.34 H new ATOM 0 HB3 ASP B 77 -1.113 4.200 16.122 1.00 1.34 H new ATOM 2997 N ARG B 78 -0.574 7.566 17.506 1.00 10.53 N ATOM 2998 CA ARG B 78 -1.043 8.918 17.157 1.00 41.21 C ATOM 2999 C ARG B 78 0.146 9.856 16.875 1.00 20.43 C ATOM 3000 O ARG B 78 0.250 10.452 15.793 1.00 3.13 O ATOM 3001 CB ARG B 78 -1.870 9.466 18.351 1.00 14.02 C ATOM 3002 CG ARG B 78 -2.413 10.899 18.172 1.00 35.12 C ATOM 3003 CD ARG B 78 -2.914 11.501 19.497 1.00 13.40 C ATOM 3004 NE ARG B 78 -1.830 11.608 20.497 1.00 11.31 N ATOM 3005 CZ ARG B 78 -2.010 11.783 21.816 1.00 22.25 C ATOM 3006 NH1 ARG B 78 -3.231 11.891 22.331 1.00 12.51 N ATOM 3007 NH2 ARG B 78 -0.955 11.839 22.614 1.00 73.42 N ATOM 0 H ARG B 78 -0.678 7.351 18.498 1.00 10.53 H new ATOM 0 HA ARG B 78 -1.654 8.870 16.255 1.00 41.21 H new ATOM 0 HB2 ARG B 78 -2.711 8.796 18.528 1.00 14.02 H new ATOM 0 HB3 ARG B 78 -1.248 9.440 19.246 1.00 14.02 H new ATOM 0 HG2 ARG B 78 -1.629 11.534 17.760 1.00 35.12 H new ATOM 0 HG3 ARG B 78 -3.228 10.889 17.448 1.00 35.12 H new ATOM 0 HD2 ARG B 78 -3.335 12.489 19.311 1.00 13.40 H new ATOM 0 HD3 ARG B 78 -3.717 10.882 19.897 1.00 13.40 H new ATOM 0 HE ARG B 78 -0.870 11.544 20.158 1.00 11.31 H new ATOM 0 HH11 ARG B 78 -4.048 11.841 21.722 1.00 12.51 H new ATOM 0 HH12 ARG B 78 -3.351 12.024 23.335 1.00 12.51 H new ATOM 0 HH21 ARG B 78 -0.016 11.749 22.225 1.00 73.42 H new ATOM 0 HH22 ARG B 78 -1.081 11.972 23.617 1.00 73.42 H new ATOM 3021 N ASP B 79 1.054 9.937 17.861 1.00 55.23 N ATOM 3022 CA ASP B 79 2.199 10.868 17.844 1.00 23.35 C ATOM 3023 C ASP B 79 3.265 10.420 16.835 1.00 41.13 C ATOM 3024 O ASP B 79 4.093 11.227 16.400 1.00 72.24 O ATOM 3025 CB ASP B 79 2.803 11.038 19.262 1.00 55.31 C ATOM 3026 CG ASP B 79 1.827 11.689 20.264 1.00 31.14 C ATOM 3027 OD1 ASP B 79 1.248 12.750 19.946 1.00 24.31 O ATOM 3028 OD2 ASP B 79 1.643 11.164 21.377 1.00 63.24 O ATOM 0 H ASP B 79 1.016 9.356 18.698 1.00 55.23 H new ATOM 0 HA ASP B 79 1.830 11.842 17.522 1.00 23.35 H new ATOM 0 HB2 ASP B 79 3.105 10.062 19.641 1.00 55.31 H new ATOM 0 HB3 ASP B 79 3.705 11.647 19.195 1.00 55.31 H new ATOM 3033 N PHE B 80 3.235 9.120 16.496 1.00 63.15 N ATOM 3034 CA PHE B 80 4.081 8.524 15.451 1.00 22.42 C ATOM 3035 C PHE B 80 3.859 9.240 14.096 1.00 32.02 C ATOM 3036 O PHE B 80 4.818 9.567 13.381 1.00 4.31 O ATOM 3037 CB PHE B 80 3.767 6.999 15.327 1.00 73.02 C ATOM 3038 CG PHE B 80 4.687 6.263 14.369 1.00 24.12 C ATOM 3039 CD1 PHE B 80 5.870 5.691 14.820 1.00 32.43 C ATOM 3040 CD2 PHE B 80 4.383 6.173 13.011 1.00 63.15 C ATOM 3041 CE1 PHE B 80 6.719 5.057 13.945 1.00 74.11 C ATOM 3042 CE2 PHE B 80 5.233 5.539 12.141 1.00 64.00 C ATOM 3043 CZ PHE B 80 6.396 4.982 12.604 1.00 73.51 C ATOM 0 H PHE B 80 2.615 8.447 16.946 1.00 63.15 H new ATOM 0 HA PHE B 80 5.128 8.648 15.729 1.00 22.42 H new ATOM 0 HB2 PHE B 80 3.841 6.540 16.313 1.00 73.02 H new ATOM 0 HB3 PHE B 80 2.736 6.875 14.995 1.00 73.02 H new ATOM 0 HD1 PHE B 80 6.125 5.745 15.868 1.00 32.43 H new ATOM 0 HD2 PHE B 80 3.467 6.608 12.640 1.00 63.15 H new ATOM 0 HE1 PHE B 80 7.638 4.618 14.305 1.00 74.11 H new ATOM 0 HE2 PHE B 80 4.986 5.479 11.091 1.00 64.00 H new ATOM 0 HZ PHE B 80 7.063 4.482 11.917 1.00 73.51 H new ATOM 3053 N CYS B 81 2.578 9.499 13.779 1.00 15.21 N ATOM 3054 CA CYS B 81 2.153 10.107 12.500 1.00 70.41 C ATOM 3055 C CYS B 81 2.454 11.625 12.443 1.00 21.13 C ATOM 3056 O CYS B 81 2.346 12.238 11.372 1.00 74.54 O ATOM 3057 CB CYS B 81 0.644 9.845 12.285 1.00 41.41 C ATOM 3058 SG CYS B 81 0.204 8.092 12.261 1.00 51.25 S ATOM 0 H CYS B 81 1.801 9.292 14.406 1.00 15.21 H new ATOM 0 HA CYS B 81 2.727 9.642 11.699 1.00 70.41 H new ATOM 0 HB2 CYS B 81 0.082 10.340 13.077 1.00 41.41 H new ATOM 0 HB3 CYS B 81 0.336 10.300 11.344 1.00 41.41 H new ATOM 0 HG CYS B 81 0.179 7.634 13.477 1.00 51.25 H new ATOM 3064 N LYS B 82 2.826 12.218 13.598 1.00 62.55 N ATOM 3065 CA LYS B 82 3.168 13.649 13.697 1.00 54.30 C ATOM 3066 C LYS B 82 4.601 13.900 13.176 1.00 72.45 C ATOM 3067 O LYS B 82 5.564 13.983 13.954 1.00 11.31 O ATOM 3068 CB LYS B 82 3.043 14.146 15.153 1.00 0.01 C ATOM 3069 CG LYS B 82 1.630 14.058 15.753 1.00 63.24 C ATOM 3070 CD LYS B 82 1.577 14.661 17.177 1.00 52.55 C ATOM 3071 CE LYS B 82 1.987 16.141 17.203 1.00 4.01 C ATOM 3072 NZ LYS B 82 1.949 16.715 18.573 1.00 41.12 N ATOM 0 H LYS B 82 2.897 11.718 14.484 1.00 62.55 H new ATOM 0 HA LYS B 82 2.464 14.206 13.079 1.00 54.30 H new ATOM 0 HB2 LYS B 82 3.723 13.567 15.778 1.00 0.01 H new ATOM 0 HB3 LYS B 82 3.375 15.183 15.196 1.00 0.01 H new ATOM 0 HG2 LYS B 82 0.927 14.585 15.108 1.00 63.24 H new ATOM 0 HG3 LYS B 82 1.313 13.016 15.787 1.00 63.24 H new ATOM 0 HD2 LYS B 82 0.567 14.560 17.574 1.00 52.55 H new ATOM 0 HD3 LYS B 82 2.236 14.093 17.834 1.00 52.55 H new ATOM 0 HE2 LYS B 82 2.993 16.244 16.797 1.00 4.01 H new ATOM 0 HE3 LYS B 82 1.322 16.711 16.555 1.00 4.01 H new ATOM 0 HZ1 LYS B 82 2.233 17.715 18.539 1.00 41.12 H new ATOM 0 HZ2 LYS B 82 0.984 16.643 18.953 1.00 41.12 H new ATOM 0 HZ3 LYS B 82 2.603 16.190 19.188 1.00 41.12 H new ATOM 3086 N VAL B 83 4.727 13.966 11.852 1.00 44.11 N ATOM 3087 CA VAL B 83 5.988 14.253 11.150 1.00 43.50 C ATOM 3088 C VAL B 83 5.733 15.333 10.083 1.00 21.32 C ATOM 3089 O VAL B 83 4.568 15.675 9.822 1.00 53.42 O ATOM 3090 CB VAL B 83 6.584 12.948 10.482 1.00 52.31 C ATOM 3091 CG1 VAL B 83 7.052 11.912 11.543 1.00 63.21 C ATOM 3092 CG2 VAL B 83 5.561 12.318 9.503 1.00 14.51 C ATOM 0 H VAL B 83 3.941 13.819 11.219 1.00 44.11 H new ATOM 0 HA VAL B 83 6.720 14.613 11.873 1.00 43.50 H new ATOM 0 HB VAL B 83 7.466 13.246 9.915 1.00 52.31 H new ATOM 0 HG11 VAL B 83 7.454 11.032 11.040 1.00 63.21 H new ATOM 0 HG12 VAL B 83 7.825 12.357 12.169 1.00 63.21 H new ATOM 0 HG13 VAL B 83 6.205 11.620 12.164 1.00 63.21 H new ATOM 0 HG21 VAL B 83 5.991 11.422 9.055 1.00 14.51 H new ATOM 0 HG22 VAL B 83 4.654 12.053 10.046 1.00 14.51 H new ATOM 0 HG23 VAL B 83 5.318 13.035 8.719 1.00 14.51 H new ATOM 3102 N ASP B 84 6.811 15.864 9.481 1.00 52.04 N ATOM 3103 CA ASP B 84 6.716 16.841 8.366 1.00 34.20 C ATOM 3104 C ASP B 84 6.026 16.203 7.153 1.00 71.13 C ATOM 3105 O ASP B 84 5.988 14.982 7.050 1.00 43.42 O ATOM 3106 CB ASP B 84 8.127 17.331 7.955 1.00 65.34 C ATOM 3107 CG ASP B 84 8.848 18.072 9.084 1.00 41.21 C ATOM 3108 OD1 ASP B 84 9.411 17.405 9.974 1.00 14.33 O ATOM 3109 OD2 ASP B 84 8.853 19.322 9.089 1.00 33.44 O ATOM 0 H ASP B 84 7.769 15.635 9.746 1.00 52.04 H new ATOM 0 HA ASP B 84 6.126 17.691 8.709 1.00 34.20 H new ATOM 0 HB2 ASP B 84 8.728 16.476 7.645 1.00 65.34 H new ATOM 0 HB3 ASP B 84 8.041 17.990 7.091 1.00 65.34 H new ATOM 3114 N GLN B 85 5.507 17.045 6.241 1.00 52.13 N ATOM 3115 CA GLN B 85 4.824 16.588 5.007 1.00 41.42 C ATOM 3116 C GLN B 85 5.768 15.732 4.104 1.00 51.21 C ATOM 3117 O GLN B 85 5.359 14.642 3.691 1.00 74.22 O ATOM 3118 CB GLN B 85 4.189 17.790 4.209 1.00 22.53 C ATOM 3119 CG GLN B 85 2.650 17.739 4.004 1.00 24.11 C ATOM 3120 CD GLN B 85 2.110 16.514 3.241 1.00 74.43 C ATOM 3121 OE1 GLN B 85 2.582 15.390 3.378 1.00 62.15 O ATOM 3122 NE2 GLN B 85 1.125 16.738 2.392 1.00 51.41 N ATOM 0 H GLN B 85 5.547 18.060 6.334 1.00 52.13 H new ATOM 0 HA GLN B 85 4.004 15.941 5.319 1.00 41.42 H new ATOM 0 HB2 GLN B 85 4.435 18.715 4.730 1.00 22.53 H new ATOM 0 HB3 GLN B 85 4.664 17.840 3.229 1.00 22.53 H new ATOM 0 HG2 GLN B 85 2.172 17.772 4.983 1.00 24.11 H new ATOM 0 HG3 GLN B 85 2.345 18.639 3.470 1.00 24.11 H new ATOM 0 HE21 GLN B 85 0.744 17.679 2.290 1.00 51.41 H new ATOM 0 HE22 GLN B 85 0.745 15.971 1.838 1.00 51.41 H new ATOM 3131 N PRO B 86 7.045 16.179 3.777 1.00 53.25 N ATOM 3132 CA PRO B 86 8.002 15.310 3.031 1.00 51.14 C ATOM 3133 C PRO B 86 8.316 14.003 3.799 1.00 44.30 C ATOM 3134 O PRO B 86 8.356 12.936 3.193 1.00 22.50 O ATOM 3135 CB PRO B 86 9.259 16.205 2.851 1.00 73.04 C ATOM 3136 CG PRO B 86 9.133 17.264 3.906 1.00 24.13 C ATOM 3137 CD PRO B 86 7.649 17.520 4.040 1.00 61.34 C ATOM 0 HA PRO B 86 7.600 14.969 2.077 1.00 51.14 H new ATOM 0 HB2 PRO B 86 10.176 15.629 2.977 1.00 73.04 H new ATOM 0 HB3 PRO B 86 9.293 16.643 1.853 1.00 73.04 H new ATOM 0 HG2 PRO B 86 9.561 16.930 4.851 1.00 24.13 H new ATOM 0 HG3 PRO B 86 9.664 18.171 3.618 1.00 24.13 H new ATOM 0 HD2 PRO B 86 7.392 17.889 5.033 1.00 61.34 H new ATOM 0 HD3 PRO B 86 7.303 18.265 3.324 1.00 61.34 H new ATOM 3145 N THR B 87 8.477 14.112 5.137 1.00 62.45 N ATOM 3146 CA THR B 87 8.755 12.961 6.028 1.00 24.24 C ATOM 3147 C THR B 87 7.555 11.976 6.068 1.00 2.10 C ATOM 3148 O THR B 87 7.738 10.765 6.229 1.00 74.41 O ATOM 3149 CB THR B 87 9.078 13.468 7.477 1.00 31.05 C ATOM 3150 OG1 THR B 87 10.019 14.552 7.415 1.00 1.11 O ATOM 3151 CG2 THR B 87 9.649 12.362 8.388 1.00 55.44 C ATOM 0 H THR B 87 8.418 15.002 5.631 1.00 62.45 H new ATOM 0 HA THR B 87 9.618 12.428 5.630 1.00 24.24 H new ATOM 0 HB THR B 87 8.134 13.797 7.911 1.00 31.05 H new ATOM 0 HG1 THR B 87 10.216 14.866 8.322 1.00 1.11 H new ATOM 0 HG21 THR B 87 9.852 12.774 9.377 1.00 55.44 H new ATOM 0 HG22 THR B 87 8.925 11.552 8.474 1.00 55.44 H new ATOM 0 HG23 THR B 87 10.574 11.978 7.958 1.00 55.44 H new ATOM 3159 N LEU B 88 6.336 12.526 5.897 1.00 13.22 N ATOM 3160 CA LEU B 88 5.072 11.765 5.909 1.00 40.23 C ATOM 3161 C LEU B 88 4.997 10.924 4.626 1.00 43.03 C ATOM 3162 O LEU B 88 4.700 9.726 4.679 1.00 31.31 O ATOM 3163 CB LEU B 88 3.864 12.758 6.044 1.00 3.34 C ATOM 3164 CG LEU B 88 2.491 12.186 6.553 1.00 15.04 C ATOM 3165 CD1 LEU B 88 1.521 13.332 6.924 1.00 24.31 C ATOM 3166 CD2 LEU B 88 1.835 11.238 5.526 1.00 62.30 C ATOM 0 H LEU B 88 6.201 13.525 5.745 1.00 13.22 H new ATOM 0 HA LEU B 88 5.029 11.088 6.762 1.00 40.23 H new ATOM 0 HB2 LEU B 88 4.164 13.558 6.721 1.00 3.34 H new ATOM 0 HB3 LEU B 88 3.695 13.213 5.068 1.00 3.34 H new ATOM 0 HG LEU B 88 2.704 11.600 7.447 1.00 15.04 H new ATOM 0 HD11 LEU B 88 0.578 12.912 7.273 1.00 24.31 H new ATOM 0 HD12 LEU B 88 1.962 13.940 7.714 1.00 24.31 H new ATOM 0 HD13 LEU B 88 1.339 13.953 6.047 1.00 24.31 H new ATOM 0 HD21 LEU B 88 0.890 10.869 5.924 1.00 62.30 H new ATOM 0 HD22 LEU B 88 1.652 11.778 4.597 1.00 62.30 H new ATOM 0 HD23 LEU B 88 2.500 10.396 5.331 1.00 62.30 H new ATOM 3178 N PHE B 89 5.308 11.571 3.483 1.00 43.43 N ATOM 3179 CA PHE B 89 5.387 10.895 2.178 1.00 34.14 C ATOM 3180 C PHE B 89 6.486 9.815 2.186 1.00 62.34 C ATOM 3181 O PHE B 89 6.329 8.787 1.548 1.00 31.53 O ATOM 3182 CB PHE B 89 5.632 11.909 1.032 1.00 71.21 C ATOM 3183 CG PHE B 89 4.448 12.836 0.718 1.00 51.04 C ATOM 3184 CD1 PHE B 89 3.166 12.321 0.505 1.00 62.52 C ATOM 3185 CD2 PHE B 89 4.623 14.218 0.601 1.00 24.41 C ATOM 3186 CE1 PHE B 89 2.105 13.156 0.186 1.00 73.11 C ATOM 3187 CE2 PHE B 89 3.561 15.049 0.283 1.00 12.13 C ATOM 3188 CZ PHE B 89 2.304 14.517 0.078 1.00 33.24 C ATOM 0 H PHE B 89 5.510 12.570 3.442 1.00 43.43 H new ATOM 0 HA PHE B 89 4.427 10.410 1.999 1.00 34.14 H new ATOM 0 HB2 PHE B 89 6.496 12.523 1.289 1.00 71.21 H new ATOM 0 HB3 PHE B 89 5.891 11.357 0.128 1.00 71.21 H new ATOM 0 HD1 PHE B 89 2.999 11.257 0.590 1.00 62.52 H new ATOM 0 HD2 PHE B 89 5.602 14.645 0.761 1.00 24.41 H new ATOM 0 HE1 PHE B 89 1.122 12.740 0.022 1.00 73.11 H new ATOM 0 HE2 PHE B 89 3.717 16.114 0.195 1.00 12.13 H new ATOM 0 HZ PHE B 89 1.476 15.166 -0.167 1.00 33.24 H new ATOM 3198 N GLU B 90 7.575 10.058 2.944 1.00 70.40 N ATOM 3199 CA GLU B 90 8.664 9.071 3.130 1.00 72.14 C ATOM 3200 C GLU B 90 8.162 7.809 3.863 1.00 51.33 C ATOM 3201 O GLU B 90 8.577 6.698 3.531 1.00 31.51 O ATOM 3202 CB GLU B 90 9.850 9.688 3.916 1.00 14.11 C ATOM 3203 CG GLU B 90 10.642 10.770 3.167 1.00 61.20 C ATOM 3204 CD GLU B 90 11.297 10.254 1.876 1.00 65.32 C ATOM 3205 OE1 GLU B 90 12.368 9.623 1.953 1.00 73.45 O ATOM 3206 OE2 GLU B 90 10.741 10.481 0.777 1.00 31.35 O ATOM 0 H GLU B 90 7.726 10.936 3.441 1.00 70.40 H new ATOM 0 HA GLU B 90 9.007 8.785 2.136 1.00 72.14 H new ATOM 0 HB2 GLU B 90 9.467 10.117 4.842 1.00 14.11 H new ATOM 0 HB3 GLU B 90 10.535 8.887 4.195 1.00 14.11 H new ATOM 0 HG2 GLU B 90 9.975 11.597 2.923 1.00 61.20 H new ATOM 0 HG3 GLU B 90 11.415 11.167 3.825 1.00 61.20 H new ATOM 3213 N LEU B 91 7.275 8.001 4.860 1.00 34.22 N ATOM 3214 CA LEU B 91 6.645 6.888 5.605 1.00 0.23 C ATOM 3215 C LEU B 91 5.691 6.085 4.689 1.00 42.11 C ATOM 3216 O LEU B 91 5.614 4.857 4.791 1.00 31.43 O ATOM 3217 CB LEU B 91 5.882 7.410 6.861 1.00 61.42 C ATOM 3218 CG LEU B 91 6.736 8.146 7.954 1.00 72.52 C ATOM 3219 CD1 LEU B 91 5.851 8.597 9.145 1.00 54.13 C ATOM 3220 CD2 LEU B 91 7.919 7.276 8.441 1.00 22.52 C ATOM 0 H LEU B 91 6.975 8.925 5.171 1.00 34.22 H new ATOM 0 HA LEU B 91 7.440 6.224 5.944 1.00 0.23 H new ATOM 0 HB2 LEU B 91 5.101 8.092 6.525 1.00 61.42 H new ATOM 0 HB3 LEU B 91 5.384 6.563 7.333 1.00 61.42 H new ATOM 0 HG LEU B 91 7.157 9.037 7.489 1.00 72.52 H new ATOM 0 HD11 LEU B 91 6.469 9.104 9.886 1.00 54.13 H new ATOM 0 HD12 LEU B 91 5.080 9.280 8.787 1.00 54.13 H new ATOM 0 HD13 LEU B 91 5.381 7.725 9.600 1.00 54.13 H new ATOM 0 HD21 LEU B 91 8.485 7.821 9.196 1.00 22.52 H new ATOM 0 HD22 LEU B 91 7.537 6.350 8.872 1.00 22.52 H new ATOM 0 HD23 LEU B 91 8.570 7.043 7.598 1.00 22.52 H new ATOM 3232 N ILE B 92 4.986 6.806 3.780 1.00 63.11 N ATOM 3233 CA ILE B 92 4.110 6.195 2.751 1.00 34.25 C ATOM 3234 C ILE B 92 4.959 5.348 1.778 1.00 12.24 C ATOM 3235 O ILE B 92 4.620 4.200 1.487 1.00 23.31 O ATOM 3236 CB ILE B 92 3.300 7.281 1.928 1.00 44.43 C ATOM 3237 CG1 ILE B 92 2.409 8.150 2.875 1.00 24.21 C ATOM 3238 CG2 ILE B 92 2.442 6.627 0.808 1.00 30.03 C ATOM 3239 CD1 ILE B 92 1.620 9.253 2.183 1.00 0.02 C ATOM 0 H ILE B 92 5.010 7.825 3.741 1.00 63.11 H new ATOM 0 HA ILE B 92 3.389 5.566 3.273 1.00 34.25 H new ATOM 0 HB ILE B 92 4.027 7.936 1.447 1.00 44.43 H new ATOM 0 HG12 ILE B 92 1.710 7.494 3.394 1.00 24.21 H new ATOM 0 HG13 ILE B 92 3.046 8.602 3.635 1.00 24.21 H new ATOM 0 HG21 ILE B 92 1.901 7.402 0.265 1.00 30.03 H new ATOM 0 HG22 ILE B 92 3.093 6.088 0.119 1.00 30.03 H new ATOM 0 HG23 ILE B 92 1.730 5.932 1.254 1.00 30.03 H new ATOM 0 HD11 ILE B 92 1.034 9.799 2.922 1.00 0.02 H new ATOM 0 HD12 ILE B 92 2.309 9.937 1.688 1.00 0.02 H new ATOM 0 HD13 ILE B 92 0.952 8.813 1.443 1.00 0.02 H new ATOM 3251 N LEU B 93 6.087 5.934 1.327 1.00 50.34 N ATOM 3252 CA LEU B 93 6.992 5.321 0.334 1.00 62.22 C ATOM 3253 C LEU B 93 7.699 4.087 0.918 1.00 3.43 C ATOM 3254 O LEU B 93 7.873 3.108 0.216 1.00 24.54 O ATOM 3255 CB LEU B 93 8.038 6.358 -0.176 1.00 33.22 C ATOM 3256 CG LEU B 93 7.476 7.529 -1.049 1.00 2.42 C ATOM 3257 CD1 LEU B 93 8.571 8.579 -1.350 1.00 41.34 C ATOM 3258 CD2 LEU B 93 6.826 6.999 -2.350 1.00 4.34 C ATOM 0 H LEU B 93 6.397 6.852 1.644 1.00 50.34 H new ATOM 0 HA LEU B 93 6.387 4.997 -0.513 1.00 62.22 H new ATOM 0 HB2 LEU B 93 8.546 6.787 0.688 1.00 33.22 H new ATOM 0 HB3 LEU B 93 8.792 5.827 -0.758 1.00 33.22 H new ATOM 0 HG LEU B 93 6.695 8.026 -0.473 1.00 2.42 H new ATOM 0 HD11 LEU B 93 8.150 9.380 -1.958 1.00 41.34 H new ATOM 0 HD12 LEU B 93 8.945 8.993 -0.414 1.00 41.34 H new ATOM 0 HD13 LEU B 93 9.390 8.105 -1.891 1.00 41.34 H new ATOM 0 HD21 LEU B 93 6.445 7.837 -2.934 1.00 4.34 H new ATOM 0 HD22 LEU B 93 7.570 6.458 -2.934 1.00 4.34 H new ATOM 0 HD23 LEU B 93 6.004 6.329 -2.099 1.00 4.34 H new ATOM 3270 N ALA B 94 8.079 4.159 2.207 1.00 14.50 N ATOM 3271 CA ALA B 94 8.786 3.068 2.914 1.00 11.13 C ATOM 3272 C ALA B 94 7.849 1.879 3.171 1.00 12.31 C ATOM 3273 O ALA B 94 8.234 0.712 3.009 1.00 10.02 O ATOM 3274 CB ALA B 94 9.358 3.586 4.241 1.00 62.33 C ATOM 0 H ALA B 94 7.905 4.977 2.792 1.00 14.50 H new ATOM 0 HA ALA B 94 9.604 2.725 2.281 1.00 11.13 H new ATOM 0 HB1 ALA B 94 9.877 2.776 4.754 1.00 62.33 H new ATOM 0 HB2 ALA B 94 10.058 4.398 4.043 1.00 62.33 H new ATOM 0 HB3 ALA B 94 8.546 3.952 4.869 1.00 62.33 H new ATOM 3280 N ALA B 95 6.609 2.207 3.565 1.00 44.11 N ATOM 3281 CA ALA B 95 5.549 1.220 3.813 1.00 62.14 C ATOM 3282 C ALA B 95 5.097 0.555 2.500 1.00 15.13 C ATOM 3283 O ALA B 95 4.765 -0.618 2.487 1.00 43.51 O ATOM 3284 CB ALA B 95 4.365 1.889 4.513 1.00 21.21 C ATOM 0 H ALA B 95 6.313 3.170 3.721 1.00 44.11 H new ATOM 0 HA ALA B 95 5.948 0.440 4.462 1.00 62.14 H new ATOM 0 HB1 ALA B 95 3.584 1.150 4.693 1.00 21.21 H new ATOM 0 HB2 ALA B 95 4.694 2.308 5.464 1.00 21.21 H new ATOM 0 HB3 ALA B 95 3.972 2.686 3.882 1.00 21.21 H new ATOM 3290 N ASN B 96 5.090 1.336 1.405 1.00 13.24 N ATOM 3291 CA ASN B 96 4.759 0.838 0.046 1.00 25.50 C ATOM 3292 C ASN B 96 5.935 0.001 -0.512 1.00 3.21 C ATOM 3293 O ASN B 96 5.733 -1.003 -1.192 1.00 55.20 O ATOM 3294 CB ASN B 96 4.447 2.052 -0.884 1.00 24.12 C ATOM 3295 CG ASN B 96 3.763 1.694 -2.214 1.00 23.11 C ATOM 3296 OD1 ASN B 96 3.951 0.622 -2.786 1.00 12.01 O ATOM 3297 ND2 ASN B 96 2.964 2.611 -2.727 1.00 51.45 N ATOM 0 H ASN B 96 5.313 2.331 1.431 1.00 13.24 H new ATOM 0 HA ASN B 96 3.880 0.195 0.092 1.00 25.50 H new ATOM 0 HB2 ASN B 96 3.810 2.751 -0.342 1.00 24.12 H new ATOM 0 HB3 ASN B 96 5.380 2.573 -1.101 1.00 24.12 H new ATOM 0 HD21 ASN B 96 2.490 2.436 -3.613 1.00 51.45 H new ATOM 0 HD22 ASN B 96 2.821 3.494 -2.237 1.00 51.45 H new ATOM 3304 N TYR B 97 7.164 0.430 -0.173 1.00 53.10 N ATOM 3305 CA TYR B 97 8.423 -0.205 -0.627 1.00 33.54 C ATOM 3306 C TYR B 97 8.568 -1.617 -0.048 1.00 73.54 C ATOM 3307 O TYR B 97 9.109 -2.512 -0.700 1.00 23.14 O ATOM 3308 CB TYR B 97 9.637 0.689 -0.223 1.00 71.22 C ATOM 3309 CG TYR B 97 11.024 0.157 -0.618 1.00 43.41 C ATOM 3310 CD1 TYR B 97 11.947 -0.247 0.353 1.00 1.34 C ATOM 3311 CD2 TYR B 97 11.408 0.047 -1.961 1.00 60.21 C ATOM 3312 CE1 TYR B 97 13.190 -0.734 0.006 1.00 3.34 C ATOM 3313 CE2 TYR B 97 12.660 -0.441 -2.310 1.00 1.21 C ATOM 3314 CZ TYR B 97 13.545 -0.832 -1.318 1.00 22.30 C ATOM 3315 OH TYR B 97 14.786 -1.341 -1.641 1.00 3.41 O ATOM 0 H TYR B 97 7.317 1.237 0.431 1.00 53.10 H new ATOM 0 HA TYR B 97 8.397 -0.298 -1.713 1.00 33.54 H new ATOM 0 HB2 TYR B 97 9.505 1.673 -0.674 1.00 71.22 H new ATOM 0 HB3 TYR B 97 9.617 0.828 0.858 1.00 71.22 H new ATOM 0 HD1 TYR B 97 11.680 -0.176 1.397 1.00 1.34 H new ATOM 0 HD2 TYR B 97 10.719 0.347 -2.737 1.00 60.21 H new ATOM 0 HE1 TYR B 97 13.884 -1.038 0.775 1.00 3.34 H new ATOM 0 HE2 TYR B 97 12.943 -0.516 -3.350 1.00 1.21 H new ATOM 0 HH TYR B 97 14.893 -1.349 -2.615 1.00 3.41 H new ATOM 3325 N LEU B 98 8.101 -1.797 1.197 1.00 32.22 N ATOM 3326 CA LEU B 98 8.158 -3.091 1.898 1.00 62.43 C ATOM 3327 C LEU B 98 6.790 -3.800 1.937 1.00 72.54 C ATOM 3328 O LEU B 98 6.726 -4.959 2.338 1.00 70.53 O ATOM 3329 CB LEU B 98 8.735 -2.901 3.321 1.00 52.31 C ATOM 3330 CG LEU B 98 10.208 -2.383 3.392 1.00 70.54 C ATOM 3331 CD1 LEU B 98 10.686 -2.259 4.856 1.00 42.14 C ATOM 3332 CD2 LEU B 98 11.155 -3.284 2.559 1.00 1.30 C ATOM 0 H LEU B 98 7.674 -1.051 1.746 1.00 32.22 H new ATOM 0 HA LEU B 98 8.824 -3.743 1.333 1.00 62.43 H new ATOM 0 HB2 LEU B 98 8.097 -2.202 3.861 1.00 52.31 H new ATOM 0 HB3 LEU B 98 8.679 -3.855 3.846 1.00 52.31 H new ATOM 0 HG LEU B 98 10.234 -1.385 2.955 1.00 70.54 H new ATOM 0 HD11 LEU B 98 11.714 -1.897 4.874 1.00 42.14 H new ATOM 0 HD12 LEU B 98 10.045 -1.558 5.390 1.00 42.14 H new ATOM 0 HD13 LEU B 98 10.637 -3.235 5.339 1.00 42.14 H new ATOM 0 HD21 LEU B 98 12.173 -2.901 2.626 1.00 1.30 H new ATOM 0 HD22 LEU B 98 11.124 -4.302 2.948 1.00 1.30 H new ATOM 0 HD23 LEU B 98 10.835 -3.283 1.517 1.00 1.30 H new ATOM 3344 N ASP B 99 5.723 -3.110 1.484 1.00 52.44 N ATOM 3345 CA ASP B 99 4.316 -3.608 1.516 1.00 33.13 C ATOM 3346 C ASP B 99 3.807 -3.790 2.964 1.00 31.33 C ATOM 3347 O ASP B 99 2.953 -4.648 3.237 1.00 3.13 O ATOM 3348 CB ASP B 99 4.123 -4.911 0.690 1.00 2.43 C ATOM 3349 CG ASP B 99 4.420 -4.774 -0.812 1.00 50.02 C ATOM 3350 OD1 ASP B 99 4.867 -5.768 -1.433 1.00 70.40 O ATOM 3351 OD2 ASP B 99 4.224 -3.686 -1.370 1.00 25.40 O ATOM 0 H ASP B 99 5.807 -2.178 1.079 1.00 52.44 H new ATOM 0 HA ASP B 99 3.710 -2.837 1.040 1.00 33.13 H new ATOM 0 HB2 ASP B 99 4.768 -5.686 1.104 1.00 2.43 H new ATOM 0 HB3 ASP B 99 3.095 -5.253 0.813 1.00 2.43 H new ATOM 3356 N ILE B 100 4.326 -2.949 3.877 1.00 32.45 N ATOM 3357 CA ILE B 100 3.840 -2.855 5.261 1.00 30.42 C ATOM 3358 C ILE B 100 2.497 -2.100 5.271 1.00 54.32 C ATOM 3359 O ILE B 100 2.459 -0.880 5.452 1.00 74.40 O ATOM 3360 CB ILE B 100 4.893 -2.134 6.193 1.00 2.41 C ATOM 3361 CG1 ILE B 100 6.259 -2.878 6.102 1.00 41.42 C ATOM 3362 CG2 ILE B 100 4.391 -2.041 7.661 1.00 24.41 C ATOM 3363 CD1 ILE B 100 7.414 -2.226 6.836 1.00 64.52 C ATOM 0 H ILE B 100 5.097 -2.314 3.672 1.00 32.45 H new ATOM 0 HA ILE B 100 3.697 -3.861 5.655 1.00 30.42 H new ATOM 0 HB ILE B 100 5.025 -1.109 5.846 1.00 2.41 H new ATOM 0 HG12 ILE B 100 6.128 -3.887 6.492 1.00 41.42 H new ATOM 0 HG13 ILE B 100 6.529 -2.975 5.051 1.00 41.42 H new ATOM 0 HG21 ILE B 100 5.142 -1.539 8.271 1.00 24.41 H new ATOM 0 HG22 ILE B 100 3.460 -1.474 7.692 1.00 24.41 H new ATOM 0 HG23 ILE B 100 4.218 -3.044 8.051 1.00 24.41 H new ATOM 0 HD11 ILE B 100 8.314 -2.827 6.706 1.00 64.52 H new ATOM 0 HD12 ILE B 100 7.584 -1.227 6.434 1.00 64.52 H new ATOM 0 HD13 ILE B 100 7.176 -2.154 7.897 1.00 64.52 H new ATOM 3375 N LYS B 101 1.412 -2.844 5.010 1.00 64.11 N ATOM 3376 CA LYS B 101 0.047 -2.300 4.975 1.00 54.05 C ATOM 3377 C LYS B 101 -0.418 -1.760 6.362 1.00 54.40 C ATOM 3378 O LYS B 101 -1.083 -0.727 6.380 1.00 61.53 O ATOM 3379 CB LYS B 101 -0.949 -3.351 4.384 1.00 14.33 C ATOM 3380 CG LYS B 101 -2.353 -2.797 3.992 1.00 65.44 C ATOM 3381 CD LYS B 101 -3.397 -2.808 5.143 1.00 63.31 C ATOM 3382 CE LYS B 101 -4.669 -2.001 4.803 1.00 13.03 C ATOM 3383 NZ LYS B 101 -5.330 -2.469 3.560 1.00 5.53 N ATOM 0 H LYS B 101 1.457 -3.844 4.816 1.00 64.11 H new ATOM 0 HA LYS B 101 0.055 -1.436 4.310 1.00 54.05 H new ATOM 0 HB2 LYS B 101 -0.495 -3.800 3.501 1.00 14.33 H new ATOM 0 HB3 LYS B 101 -1.083 -4.149 5.114 1.00 14.33 H new ATOM 0 HG2 LYS B 101 -2.238 -1.774 3.633 1.00 65.44 H new ATOM 0 HG3 LYS B 101 -2.742 -3.385 3.161 1.00 65.44 H new ATOM 0 HD2 LYS B 101 -3.674 -3.838 5.366 1.00 63.31 H new ATOM 0 HD3 LYS B 101 -2.942 -2.398 6.045 1.00 63.31 H new ATOM 0 HE2 LYS B 101 -5.372 -2.073 5.633 1.00 13.03 H new ATOM 0 HE3 LYS B 101 -4.408 -0.948 4.696 1.00 13.03 H new ATOM 0 HZ1 LYS B 101 -5.455 -1.667 2.910 1.00 5.53 H new ATOM 0 HZ2 LYS B 101 -4.740 -3.194 3.105 1.00 5.53 H new ATOM 0 HZ3 LYS B 101 -6.259 -2.875 3.792 1.00 5.53 H new ATOM 3397 N PRO B 102 -0.117 -2.438 7.544 1.00 10.24 N ATOM 3398 CA PRO B 102 -0.457 -1.888 8.896 1.00 73.23 C ATOM 3399 C PRO B 102 -0.086 -0.387 9.087 1.00 62.44 C ATOM 3400 O PRO B 102 -0.921 0.410 9.520 1.00 33.25 O ATOM 3401 CB PRO B 102 0.339 -2.804 9.880 1.00 30.51 C ATOM 3402 CG PRO B 102 1.206 -3.691 9.021 1.00 42.00 C ATOM 3403 CD PRO B 102 0.491 -3.800 7.699 1.00 62.31 C ATOM 0 HA PRO B 102 -1.534 -1.899 9.062 1.00 73.23 H new ATOM 0 HB2 PRO B 102 0.946 -2.208 10.561 1.00 30.51 H new ATOM 0 HB3 PRO B 102 -0.339 -3.398 10.493 1.00 30.51 H new ATOM 0 HG2 PRO B 102 2.200 -3.263 8.895 1.00 42.00 H new ATOM 0 HG3 PRO B 102 1.337 -4.672 9.478 1.00 42.00 H new ATOM 0 HD2 PRO B 102 1.177 -4.033 6.885 1.00 62.31 H new ATOM 0 HD3 PRO B 102 -0.267 -4.583 7.711 1.00 62.31 H new ATOM 3411 N LEU B 103 1.164 -0.024 8.738 1.00 4.10 N ATOM 3412 CA LEU B 103 1.659 1.362 8.867 1.00 63.44 C ATOM 3413 C LEU B 103 1.078 2.234 7.742 1.00 41.21 C ATOM 3414 O LEU B 103 0.594 3.339 7.999 1.00 1.20 O ATOM 3415 CB LEU B 103 3.226 1.381 8.874 1.00 15.31 C ATOM 3416 CG LEU B 103 3.951 2.762 9.141 1.00 73.23 C ATOM 3417 CD1 LEU B 103 4.205 3.575 7.843 1.00 63.34 C ATOM 3418 CD2 LEU B 103 3.175 3.615 10.182 1.00 31.24 C ATOM 0 H LEU B 103 1.853 -0.675 8.362 1.00 4.10 H new ATOM 0 HA LEU B 103 1.325 1.780 9.816 1.00 63.44 H new ATOM 0 HB2 LEU B 103 3.565 0.674 9.631 1.00 15.31 H new ATOM 0 HB3 LEU B 103 3.569 1.005 7.910 1.00 15.31 H new ATOM 0 HG LEU B 103 4.929 2.516 9.553 1.00 73.23 H new ATOM 0 HD11 LEU B 103 4.705 4.511 8.092 1.00 63.34 H new ATOM 0 HD12 LEU B 103 4.835 2.996 7.168 1.00 63.34 H new ATOM 0 HD13 LEU B 103 3.254 3.790 7.356 1.00 63.34 H new ATOM 0 HD21 LEU B 103 3.699 4.557 10.343 1.00 31.24 H new ATOM 0 HD22 LEU B 103 2.170 3.817 9.810 1.00 31.24 H new ATOM 0 HD23 LEU B 103 3.111 3.070 11.124 1.00 31.24 H new ATOM 3430 N LEU B 104 1.107 1.689 6.515 1.00 41.30 N ATOM 3431 CA LEU B 104 0.643 2.370 5.288 1.00 12.44 C ATOM 3432 C LEU B 104 -0.794 2.902 5.431 1.00 75.55 C ATOM 3433 O LEU B 104 -1.081 4.031 5.029 1.00 33.11 O ATOM 3434 CB LEU B 104 0.714 1.373 4.111 1.00 75.52 C ATOM 3435 CG LEU B 104 0.217 1.865 2.720 1.00 71.43 C ATOM 3436 CD1 LEU B 104 1.135 2.960 2.121 1.00 32.43 C ATOM 3437 CD2 LEU B 104 0.048 0.667 1.771 1.00 51.22 C ATOM 0 H LEU B 104 1.459 0.747 6.341 1.00 41.30 H new ATOM 0 HA LEU B 104 1.290 3.228 5.107 1.00 12.44 H new ATOM 0 HB2 LEU B 104 1.750 1.053 4.004 1.00 75.52 H new ATOM 0 HB3 LEU B 104 0.134 0.491 4.382 1.00 75.52 H new ATOM 0 HG LEU B 104 -0.757 2.337 2.854 1.00 71.43 H new ATOM 0 HD11 LEU B 104 0.746 3.270 1.151 1.00 32.43 H new ATOM 0 HD12 LEU B 104 1.163 3.818 2.792 1.00 32.43 H new ATOM 0 HD13 LEU B 104 2.143 2.563 1.998 1.00 32.43 H new ATOM 0 HD21 LEU B 104 -0.300 1.019 0.800 1.00 51.22 H new ATOM 0 HD22 LEU B 104 1.005 0.160 1.652 1.00 51.22 H new ATOM 0 HD23 LEU B 104 -0.681 -0.027 2.188 1.00 51.22 H new ATOM 3449 N ASP B 105 -1.669 2.074 6.032 1.00 3.45 N ATOM 3450 CA ASP B 105 -3.099 2.386 6.201 1.00 70.01 C ATOM 3451 C ASP B 105 -3.267 3.600 7.124 1.00 34.40 C ATOM 3452 O ASP B 105 -3.919 4.573 6.760 1.00 31.44 O ATOM 3453 CB ASP B 105 -3.865 1.161 6.765 1.00 10.22 C ATOM 3454 CG ASP B 105 -5.388 1.407 6.840 1.00 25.33 C ATOM 3455 OD1 ASP B 105 -6.086 1.203 5.815 1.00 42.34 O ATOM 3456 OD2 ASP B 105 -5.895 1.832 7.904 1.00 14.35 O ATOM 0 H ASP B 105 -1.402 1.167 6.415 1.00 3.45 H new ATOM 0 HA ASP B 105 -3.520 2.627 5.225 1.00 70.01 H new ATOM 0 HB2 ASP B 105 -3.670 0.292 6.136 1.00 10.22 H new ATOM 0 HB3 ASP B 105 -3.488 0.926 7.760 1.00 10.22 H new ATOM 3461 N VAL B 106 -2.611 3.529 8.292 1.00 13.44 N ATOM 3462 CA VAL B 106 -2.631 4.596 9.311 1.00 22.04 C ATOM 3463 C VAL B 106 -2.122 5.938 8.722 1.00 42.31 C ATOM 3464 O VAL B 106 -2.735 6.990 8.926 1.00 22.01 O ATOM 3465 CB VAL B 106 -1.763 4.177 10.559 1.00 54.12 C ATOM 3466 CG1 VAL B 106 -1.712 5.284 11.643 1.00 14.14 C ATOM 3467 CG2 VAL B 106 -2.279 2.847 11.157 1.00 2.13 C ATOM 0 H VAL B 106 -2.046 2.723 8.561 1.00 13.44 H new ATOM 0 HA VAL B 106 -3.662 4.739 9.633 1.00 22.04 H new ATOM 0 HB VAL B 106 -0.742 4.033 10.206 1.00 54.12 H new ATOM 0 HG11 VAL B 106 -1.102 4.945 12.480 1.00 14.14 H new ATOM 0 HG12 VAL B 106 -1.276 6.189 11.219 1.00 14.14 H new ATOM 0 HG13 VAL B 106 -2.722 5.498 11.993 1.00 14.14 H new ATOM 0 HG21 VAL B 106 -1.668 2.574 12.017 1.00 2.13 H new ATOM 0 HG22 VAL B 106 -3.316 2.968 11.472 1.00 2.13 H new ATOM 0 HG23 VAL B 106 -2.218 2.061 10.404 1.00 2.13 H new ATOM 3477 N THR B 107 -1.039 5.852 7.932 1.00 30.00 N ATOM 3478 CA THR B 107 -0.357 7.018 7.333 1.00 24.25 C ATOM 3479 C THR B 107 -1.199 7.633 6.172 1.00 34.42 C ATOM 3480 O THR B 107 -1.202 8.856 5.970 1.00 12.12 O ATOM 3481 CB THR B 107 1.072 6.584 6.841 1.00 33.40 C ATOM 3482 OG1 THR B 107 1.754 5.884 7.895 1.00 62.51 O ATOM 3483 CG2 THR B 107 1.948 7.772 6.424 1.00 35.14 C ATOM 0 H THR B 107 -0.605 4.962 7.687 1.00 30.00 H new ATOM 0 HA THR B 107 -0.250 7.796 8.089 1.00 24.25 H new ATOM 0 HB THR B 107 0.918 5.949 5.969 1.00 33.40 H new ATOM 0 HG1 THR B 107 1.375 4.985 7.990 1.00 62.51 H new ATOM 0 HG21 THR B 107 2.921 7.408 6.094 1.00 35.14 H new ATOM 0 HG22 THR B 107 1.466 8.310 5.608 1.00 35.14 H new ATOM 0 HG23 THR B 107 2.080 8.443 7.273 1.00 35.14 H new ATOM 3491 N CYS B 108 -1.943 6.770 5.447 1.00 65.33 N ATOM 3492 CA CYS B 108 -2.868 7.198 4.368 1.00 33.02 C ATOM 3493 C CYS B 108 -4.154 7.801 4.960 1.00 32.43 C ATOM 3494 O CYS B 108 -4.799 8.645 4.337 1.00 14.31 O ATOM 3495 CB CYS B 108 -3.197 6.021 3.423 1.00 42.41 C ATOM 3496 SG CYS B 108 -1.758 5.394 2.527 1.00 53.31 S ATOM 0 H CYS B 108 -1.922 5.760 5.590 1.00 65.33 H new ATOM 0 HA CYS B 108 -2.369 7.970 3.782 1.00 33.02 H new ATOM 0 HB2 CYS B 108 -3.635 5.210 4.004 1.00 42.41 H new ATOM 0 HB3 CYS B 108 -3.951 6.342 2.705 1.00 42.41 H new ATOM 0 HG CYS B 108 -1.085 4.590 3.295 1.00 53.31 H new ATOM 3502 N LYS B 109 -4.524 7.339 6.166 1.00 11.31 N ATOM 3503 CA LYS B 109 -5.662 7.888 6.926 1.00 44.34 C ATOM 3504 C LYS B 109 -5.292 9.254 7.529 1.00 3.20 C ATOM 3505 O LYS B 109 -6.158 10.104 7.681 1.00 62.23 O ATOM 3506 CB LYS B 109 -6.167 6.871 8.006 1.00 22.05 C ATOM 3507 CG LYS B 109 -7.303 5.917 7.525 1.00 42.13 C ATOM 3508 CD LYS B 109 -6.986 5.190 6.193 1.00 64.02 C ATOM 3509 CE LYS B 109 -8.100 4.226 5.751 1.00 64.13 C ATOM 3510 NZ LYS B 109 -8.270 3.095 6.702 1.00 63.33 N ATOM 0 H LYS B 109 -4.044 6.575 6.642 1.00 11.31 H new ATOM 0 HA LYS B 109 -6.496 8.049 6.243 1.00 44.34 H new ATOM 0 HB2 LYS B 109 -5.323 6.268 8.340 1.00 22.05 H new ATOM 0 HB3 LYS B 109 -6.523 7.429 8.872 1.00 22.05 H new ATOM 0 HG2 LYS B 109 -7.492 5.173 8.299 1.00 42.13 H new ATOM 0 HG3 LYS B 109 -8.221 6.492 7.405 1.00 42.13 H new ATOM 0 HD2 LYS B 109 -6.824 5.932 5.411 1.00 64.02 H new ATOM 0 HD3 LYS B 109 -6.055 4.634 6.302 1.00 64.02 H new ATOM 0 HE2 LYS B 109 -9.039 4.772 5.666 1.00 64.13 H new ATOM 0 HE3 LYS B 109 -7.868 3.835 4.760 1.00 64.13 H new ATOM 0 HZ1 LYS B 109 -8.424 2.215 6.170 1.00 63.33 H new ATOM 0 HZ2 LYS B 109 -7.415 3.002 7.287 1.00 63.33 H new ATOM 0 HZ3 LYS B 109 -9.090 3.277 7.315 1.00 63.33 H new ATOM 3524 N THR B 110 -3.993 9.453 7.851 1.00 15.32 N ATOM 3525 CA THR B 110 -3.472 10.742 8.353 1.00 4.10 C ATOM 3526 C THR B 110 -3.697 11.869 7.311 1.00 44.20 C ATOM 3527 O THR B 110 -4.263 12.923 7.640 1.00 40.45 O ATOM 3528 CB THR B 110 -1.951 10.629 8.720 1.00 54.13 C ATOM 3529 OG1 THR B 110 -1.753 9.563 9.663 1.00 71.24 O ATOM 3530 CG2 THR B 110 -1.385 11.933 9.318 1.00 10.41 C ATOM 0 H THR B 110 -3.281 8.727 7.770 1.00 15.32 H new ATOM 0 HA THR B 110 -4.022 10.996 9.259 1.00 4.10 H new ATOM 0 HB THR B 110 -1.418 10.427 7.791 1.00 54.13 H new ATOM 0 HG1 THR B 110 -2.029 8.714 9.259 1.00 71.24 H new ATOM 0 HG21 THR B 110 -0.329 11.797 9.553 1.00 10.41 H new ATOM 0 HG22 THR B 110 -1.495 12.742 8.596 1.00 10.41 H new ATOM 0 HG23 THR B 110 -1.930 12.183 10.228 1.00 10.41 H new ATOM 3538 N VAL B 111 -3.295 11.613 6.042 1.00 72.21 N ATOM 3539 CA VAL B 111 -3.489 12.580 4.930 1.00 22.03 C ATOM 3540 C VAL B 111 -4.978 12.716 4.555 1.00 32.23 C ATOM 3541 O VAL B 111 -5.420 13.797 4.140 1.00 54.45 O ATOM 3542 CB VAL B 111 -2.623 12.241 3.653 1.00 54.22 C ATOM 3543 CG1 VAL B 111 -1.117 12.343 3.964 1.00 3.23 C ATOM 3544 CG2 VAL B 111 -2.973 10.861 3.054 1.00 40.12 C ATOM 0 H VAL B 111 -2.835 10.747 5.762 1.00 72.21 H new ATOM 0 HA VAL B 111 -3.134 13.540 5.305 1.00 22.03 H new ATOM 0 HB VAL B 111 -2.869 12.986 2.896 1.00 54.22 H new ATOM 0 HG11 VAL B 111 -0.544 12.105 3.068 1.00 3.23 H new ATOM 0 HG12 VAL B 111 -0.880 13.357 4.288 1.00 3.23 H new ATOM 0 HG13 VAL B 111 -0.861 11.640 4.756 1.00 3.23 H new ATOM 0 HG21 VAL B 111 -2.350 10.676 2.179 1.00 40.12 H new ATOM 0 HG22 VAL B 111 -2.793 10.085 3.798 1.00 40.12 H new ATOM 0 HG23 VAL B 111 -4.023 10.847 2.762 1.00 40.12 H new ATOM 3554 N ALA B 112 -5.736 11.612 4.711 1.00 53.14 N ATOM 3555 CA ALA B 112 -7.189 11.594 4.470 1.00 21.21 C ATOM 3556 C ALA B 112 -7.922 12.538 5.440 1.00 5.30 C ATOM 3557 O ALA B 112 -8.838 13.245 5.033 1.00 1.34 O ATOM 3558 CB ALA B 112 -7.735 10.166 4.591 1.00 25.31 C ATOM 0 H ALA B 112 -5.358 10.712 5.007 1.00 53.14 H new ATOM 0 HA ALA B 112 -7.368 11.949 3.455 1.00 21.21 H new ATOM 0 HB1 ALA B 112 -8.810 10.171 4.410 1.00 25.31 H new ATOM 0 HB2 ALA B 112 -7.246 9.526 3.856 1.00 25.31 H new ATOM 0 HB3 ALA B 112 -7.537 9.785 5.593 1.00 25.31 H new ATOM 3564 N ASN B 113 -7.469 12.560 6.712 1.00 22.11 N ATOM 3565 CA ASN B 113 -8.039 13.426 7.773 1.00 23.24 C ATOM 3566 C ASN B 113 -7.820 14.918 7.454 1.00 44.35 C ATOM 3567 O ASN B 113 -8.664 15.753 7.781 1.00 13.42 O ATOM 3568 CB ASN B 113 -7.428 13.090 9.167 1.00 21.41 C ATOM 3569 CG ASN B 113 -7.784 11.692 9.690 1.00 71.44 C ATOM 3570 OD1 ASN B 113 -8.846 11.145 9.389 1.00 75.31 O ATOM 3571 ND2 ASN B 113 -6.893 11.101 10.482 1.00 54.20 N ATOM 0 H ASN B 113 -6.696 11.978 7.035 1.00 22.11 H new ATOM 0 HA ASN B 113 -9.111 13.229 7.805 1.00 23.24 H new ATOM 0 HB2 ASN B 113 -6.343 13.177 9.106 1.00 21.41 H new ATOM 0 HB3 ASN B 113 -7.768 13.833 9.889 1.00 21.41 H new ATOM 0 HD21 ASN B 113 -7.081 10.171 10.857 1.00 54.20 H new ATOM 0 HD22 ASN B 113 -6.022 11.578 10.714 1.00 54.20 H new ATOM 3578 N MET B 114 -6.684 15.229 6.793 1.00 23.12 N ATOM 3579 CA MET B 114 -6.313 16.621 6.443 1.00 61.02 C ATOM 3580 C MET B 114 -7.283 17.226 5.407 1.00 70.30 C ATOM 3581 O MET B 114 -7.586 18.424 5.464 1.00 71.53 O ATOM 3582 CB MET B 114 -4.853 16.702 5.911 1.00 64.11 C ATOM 3583 CG MET B 114 -3.774 16.218 6.894 1.00 63.11 C ATOM 3584 SD MET B 114 -2.094 16.694 6.393 1.00 25.43 S ATOM 3585 CE MET B 114 -1.947 15.998 4.740 1.00 40.43 C ATOM 0 H MET B 114 -6.004 14.532 6.489 1.00 23.12 H new ATOM 0 HA MET B 114 -6.383 17.205 7.361 1.00 61.02 H new ATOM 0 HB2 MET B 114 -4.782 16.111 4.998 1.00 64.11 H new ATOM 0 HB3 MET B 114 -4.638 17.736 5.640 1.00 64.11 H new ATOM 0 HG2 MET B 114 -3.982 16.626 7.883 1.00 63.11 H new ATOM 0 HG3 MET B 114 -3.828 15.133 6.979 1.00 63.11 H new ATOM 0 HE1 MET B 114 -1.005 15.456 4.656 1.00 40.43 H new ATOM 0 HE2 MET B 114 -2.776 15.315 4.558 1.00 40.43 H new ATOM 0 HE3 MET B 114 -1.970 16.801 4.004 1.00 40.43 H new ATOM 3595 N ILE B 115 -7.761 16.393 4.462 1.00 22.20 N ATOM 3596 CA ILE B 115 -8.741 16.823 3.435 1.00 34.23 C ATOM 3597 C ILE B 115 -10.192 16.514 3.879 1.00 64.52 C ATOM 3598 O ILE B 115 -11.150 17.000 3.266 1.00 64.21 O ATOM 3599 CB ILE B 115 -8.446 16.168 2.031 1.00 22.23 C ATOM 3600 CG1 ILE B 115 -8.562 14.611 2.100 1.00 12.22 C ATOM 3601 CG2 ILE B 115 -7.055 16.604 1.506 1.00 55.05 C ATOM 3602 CD1 ILE B 115 -8.368 13.899 0.772 1.00 20.31 C ATOM 0 H ILE B 115 -7.485 15.414 4.385 1.00 22.20 H new ATOM 0 HA ILE B 115 -8.635 17.903 3.329 1.00 34.23 H new ATOM 0 HB ILE B 115 -9.199 16.522 1.327 1.00 22.23 H new ATOM 0 HG12 ILE B 115 -7.823 14.237 2.808 1.00 12.22 H new ATOM 0 HG13 ILE B 115 -9.544 14.351 2.496 1.00 12.22 H new ATOM 0 HG21 ILE B 115 -6.871 16.141 0.536 1.00 55.05 H new ATOM 0 HG22 ILE B 115 -7.029 17.689 1.401 1.00 55.05 H new ATOM 0 HG23 ILE B 115 -6.285 16.289 2.210 1.00 55.05 H new ATOM 0 HD11 ILE B 115 -8.466 12.823 0.918 1.00 20.31 H new ATOM 0 HD12 ILE B 115 -9.123 14.239 0.063 1.00 20.31 H new ATOM 0 HD13 ILE B 115 -7.376 14.123 0.381 1.00 20.31 H new ATOM 3614 N ARG B 116 -10.347 15.694 4.934 1.00 1.44 N ATOM 3615 CA ARG B 116 -11.661 15.383 5.533 1.00 32.15 C ATOM 3616 C ARG B 116 -12.042 16.551 6.468 1.00 61.20 C ATOM 3617 O ARG B 116 -11.633 16.600 7.635 1.00 64.13 O ATOM 3618 CB ARG B 116 -11.597 14.000 6.268 1.00 55.14 C ATOM 3619 CG ARG B 116 -12.958 13.337 6.658 1.00 34.00 C ATOM 3620 CD ARG B 116 -13.610 13.941 7.916 1.00 45.23 C ATOM 3621 NE ARG B 116 -14.848 13.242 8.289 1.00 40.23 N ATOM 3622 CZ ARG B 116 -15.593 13.521 9.367 1.00 15.41 C ATOM 3623 NH1 ARG B 116 -15.246 14.490 10.212 1.00 42.25 N ATOM 3624 NH2 ARG B 116 -16.696 12.832 9.584 1.00 64.43 N ATOM 0 H ARG B 116 -9.566 15.228 5.396 1.00 1.44 H new ATOM 0 HA ARG B 116 -12.437 15.287 4.774 1.00 32.15 H new ATOM 0 HB2 ARG B 116 -11.052 13.303 5.631 1.00 55.14 H new ATOM 0 HB3 ARG B 116 -11.010 14.127 7.177 1.00 55.14 H new ATOM 0 HG2 ARG B 116 -13.650 13.432 5.821 1.00 34.00 H new ATOM 0 HG3 ARG B 116 -12.798 12.271 6.820 1.00 34.00 H new ATOM 0 HD2 ARG B 116 -12.905 13.896 8.746 1.00 45.23 H new ATOM 0 HD3 ARG B 116 -13.828 14.994 7.740 1.00 45.23 H new ATOM 0 HE ARG B 116 -15.164 12.487 7.681 1.00 40.23 H new ATOM 0 HH11 ARG B 116 -14.400 15.035 10.044 1.00 42.25 H new ATOM 0 HH12 ARG B 116 -15.826 14.688 11.027 1.00 42.25 H new ATOM 0 HH21 ARG B 116 -16.974 12.096 8.935 1.00 64.43 H new ATOM 0 HH22 ARG B 116 -17.272 13.035 10.401 1.00 64.43 H new