USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1166 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 145 SER OG : rot 138:sc= 0.826 USER MOD Set 1.2: A 148 THR OG1 : rot 170:sc= 0.167 USER MOD Set 2.1: A 94 HIS : no HE2:sc= -0.214 K(o=-1.2,f=-4) USER MOD Set 2.2: A 137 TYR OH : rot -18:sc= -0.961! USER MOD Set 3.1: A 87 THR OG1 : rot 180:sc= 1 USER MOD Set 3.2: A 124 THR OG1 : rot 122:sc= 1.2 USER MOD Set 4.1: A 101 LYS NZ :NH3+ -164:sc= -0.358 (180deg=-0.15) USER MOD Set 4.2: A 111 MET CE :methyl -168:sc= -5.2! (180deg=-6.28!) USER MOD Set 5.1: A 95 GLN : amide:sc= -0.383 X(o=-0.38,f=-0.1) USER MOD Set 5.2: A 99 GLN : amide:sc= 0 X(o=-0.38,f=-0.25) USER MOD Set 6.1: A 1 MET CE :methyl -150:sc= -0.324 (180deg=-1.43!) USER MOD Set 6.2: A 43 GLN : amide:sc= 0 X(o=-0.32,f=-0.32) USER MOD Single : A 1 MET N :NH3+ -130:sc= 1.19 (180deg=-0.129) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 150:sc= -0.117 USER MOD Single : A 5 LYS NZ :NH3+ 141:sc= -0.353 (180deg=-2.51!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc=-0.00949 USER MOD Single : A 20 THR OG1 : rot 150:sc= 0.213 USER MOD Single : A 22 GLN : amide:sc= -1.28 K(o=-1.3,f=-2.5!) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 26 ASN :FLIP amide:sc= 0.322 F(o=-0.2,f=0.32) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot -3:sc= -0.345 USER MOD Single : A 58 THR OG1 : rot -100:sc= -0.586 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -0.223 X(o=-0.22,f=-0.079) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot -10:sc= 0.937 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.168 USER MOD Single : A 85 ASN : amide:sc= -2.19 K(o=-2.2,f=-5.5!) USER MOD Single : A 86 ASN : amide:sc= -0.0243 X(o=-0.024,f=-0.14) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -50:sc= -5.4! USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ -119:sc= -0.923 (180deg=-3.86!) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -1.4 K(o=-1.4,f=-11!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0.028) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot -170:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 63:sc= 1.06 USER MOD Single : A 165 GLN : amide:sc= -0.057 X(o=-0.057,f=-0.099) USER MOD Single : A 166 HIS : no HD1:sc= -0.208 K(o=-0.21,f=-0.78) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.703 -20.588 -17.274 1.00 53.12 N ATOM 2 CA MET A 1 -8.392 -20.015 -16.872 1.00 34.34 C ATOM 3 C MET A 1 -8.109 -20.269 -15.394 1.00 44.15 C ATOM 4 O MET A 1 -9.006 -20.634 -14.634 1.00 14.53 O ATOM 5 CB MET A 1 -8.412 -18.512 -17.154 1.00 13.25 C ATOM 6 CG MET A 1 -9.487 -17.762 -16.384 1.00 74.12 C ATOM 7 SD MET A 1 -11.059 -17.705 -17.265 1.00 44.20 S ATOM 8 CE MET A 1 -10.587 -16.811 -18.744 1.00 25.41 C ATOM 0 H1 MET A 1 -9.582 -21.163 -18.132 1.00 53.12 H new ATOM 0 H2 MET A 1 -10.071 -21.185 -16.506 1.00 53.12 H new ATOM 0 H3 MET A 1 -10.375 -19.817 -17.465 1.00 53.12 H new ATOM 0 HA MET A 1 -7.600 -20.496 -17.445 1.00 34.34 H new ATOM 0 HB2 MET A 1 -7.438 -18.091 -16.905 1.00 13.25 H new ATOM 0 HB3 MET A 1 -8.564 -18.353 -18.222 1.00 13.25 H new ATOM 0 HG2 MET A 1 -9.635 -18.239 -15.415 1.00 74.12 H new ATOM 0 HG3 MET A 1 -9.147 -16.745 -16.190 1.00 74.12 H new ATOM 0 HE1 MET A 1 -11.440 -16.242 -19.113 1.00 25.41 H new ATOM 0 HE2 MET A 1 -9.770 -16.129 -18.511 1.00 25.41 H new ATOM 0 HE3 MET A 1 -10.263 -17.517 -19.508 1.00 25.41 H new ATOM 18 N THR A 2 -6.856 -20.074 -14.995 1.00 64.12 N ATOM 19 CA THR A 2 -6.455 -20.283 -13.610 1.00 60.44 C ATOM 20 C THR A 2 -6.473 -18.965 -12.836 1.00 35.42 C ATOM 21 O THR A 2 -6.247 -17.897 -13.405 1.00 33.22 O ATOM 22 CB THR A 2 -5.063 -20.934 -13.555 1.00 12.24 C ATOM 23 OG1 THR A 2 -5.126 -22.188 -12.898 1.00 2.34 O ATOM 24 CG2 THR A 2 -4.012 -20.103 -12.843 1.00 44.32 C ATOM 0 H THR A 2 -6.102 -19.772 -15.612 1.00 64.12 H new ATOM 0 HA THR A 2 -7.170 -20.957 -13.138 1.00 60.44 H new ATOM 0 HB THR A 2 -4.764 -21.034 -14.598 1.00 12.24 H new ATOM 0 HG1 THR A 2 -4.232 -22.590 -12.873 1.00 2.34 H new ATOM 0 HG21 THR A 2 -3.061 -20.636 -12.850 1.00 44.32 H new ATOM 0 HG22 THR A 2 -3.896 -19.147 -13.354 1.00 44.32 H new ATOM 0 HG23 THR A 2 -4.323 -19.928 -11.813 1.00 44.32 H new ATOM 32 N GLU A 3 -6.745 -19.051 -11.538 1.00 53.23 N ATOM 33 CA GLU A 3 -6.792 -17.868 -10.688 1.00 61.11 C ATOM 34 C GLU A 3 -5.513 -17.742 -9.866 1.00 30.50 C ATOM 35 O GLU A 3 -5.099 -18.687 -9.194 1.00 51.41 O ATOM 36 CB GLU A 3 -8.009 -17.929 -9.761 1.00 73.31 C ATOM 37 CG GLU A 3 -9.143 -17.011 -10.187 1.00 62.31 C ATOM 38 CD GLU A 3 -10.387 -17.192 -9.338 1.00 11.31 C ATOM 39 OE1 GLU A 3 -10.248 -17.378 -8.111 1.00 21.53 O ATOM 40 OE2 GLU A 3 -11.502 -17.146 -9.902 1.00 22.11 O ATOM 0 H GLU A 3 -6.936 -19.927 -11.052 1.00 53.23 H new ATOM 0 HA GLU A 3 -6.878 -16.990 -11.328 1.00 61.11 H new ATOM 0 HB2 GLU A 3 -8.377 -18.954 -9.724 1.00 73.31 H new ATOM 0 HB3 GLU A 3 -7.699 -17.665 -8.750 1.00 73.31 H new ATOM 0 HG2 GLU A 3 -8.811 -15.975 -10.123 1.00 62.31 H new ATOM 0 HG3 GLU A 3 -9.389 -17.203 -11.231 1.00 62.31 H new ATOM 47 N TYR A 4 -4.892 -16.568 -9.925 1.00 40.23 N ATOM 48 CA TYR A 4 -3.660 -16.319 -9.189 1.00 31.13 C ATOM 49 C TYR A 4 -3.837 -15.175 -8.197 1.00 4.24 C ATOM 50 O TYR A 4 -3.870 -14.006 -8.581 1.00 25.43 O ATOM 51 CB TYR A 4 -2.522 -15.993 -10.157 1.00 44.32 C ATOM 52 CG TYR A 4 -1.962 -17.204 -10.869 1.00 62.24 C ATOM 53 CD1 TYR A 4 -1.380 -18.245 -10.156 1.00 64.43 C ATOM 54 CD2 TYR A 4 -2.014 -17.305 -12.253 1.00 15.23 C ATOM 55 CE1 TYR A 4 -0.865 -19.353 -10.802 1.00 32.51 C ATOM 56 CE2 TYR A 4 -1.502 -18.410 -12.907 1.00 34.45 C ATOM 57 CZ TYR A 4 -0.929 -19.430 -12.177 1.00 22.25 C ATOM 58 OH TYR A 4 -0.416 -20.531 -12.825 1.00 25.12 O ATOM 0 H TYR A 4 -5.223 -15.775 -10.475 1.00 40.23 H new ATOM 0 HA TYR A 4 -3.412 -17.223 -8.633 1.00 31.13 H new ATOM 0 HB2 TYR A 4 -2.882 -15.280 -10.899 1.00 44.32 H new ATOM 0 HB3 TYR A 4 -1.719 -15.502 -9.607 1.00 44.32 H new ATOM 0 HD1 TYR A 4 -1.329 -18.187 -9.079 1.00 64.43 H new ATOM 0 HD2 TYR A 4 -2.462 -16.508 -12.828 1.00 15.23 H new ATOM 0 HE1 TYR A 4 -0.415 -20.153 -10.233 1.00 32.51 H new ATOM 0 HE2 TYR A 4 -1.550 -18.474 -13.984 1.00 34.45 H new ATOM 0 HH TYR A 4 -0.918 -20.687 -13.652 1.00 25.12 H new ATOM 68 N LYS A 5 -3.948 -15.519 -6.918 1.00 11.21 N ATOM 69 CA LYS A 5 -4.117 -14.519 -5.870 1.00 5.02 C ATOM 70 C LYS A 5 -2.776 -13.886 -5.510 1.00 54.32 C ATOM 71 O LYS A 5 -2.017 -14.428 -4.707 1.00 15.11 O ATOM 72 CB LYS A 5 -4.750 -15.152 -4.628 1.00 3.24 C ATOM 73 CG LYS A 5 -6.235 -14.855 -4.484 1.00 5.05 C ATOM 74 CD LYS A 5 -6.544 -14.185 -3.154 1.00 23.04 C ATOM 75 CE LYS A 5 -7.946 -14.522 -2.673 1.00 73.55 C ATOM 76 NZ LYS A 5 -8.192 -15.990 -2.660 1.00 64.12 N ATOM 0 H LYS A 5 -3.924 -16.482 -6.583 1.00 11.21 H new ATOM 0 HA LYS A 5 -4.780 -13.739 -6.245 1.00 5.02 H new ATOM 0 HB2 LYS A 5 -4.606 -16.232 -4.667 1.00 3.24 H new ATOM 0 HB3 LYS A 5 -4.228 -14.793 -3.741 1.00 3.24 H new ATOM 0 HG2 LYS A 5 -6.559 -14.210 -5.301 1.00 5.05 H new ATOM 0 HG3 LYS A 5 -6.802 -15.782 -4.566 1.00 5.05 H new ATOM 0 HD2 LYS A 5 -5.816 -14.503 -2.408 1.00 23.04 H new ATOM 0 HD3 LYS A 5 -6.444 -13.105 -3.258 1.00 23.04 H new ATOM 0 HE2 LYS A 5 -8.092 -14.121 -1.670 1.00 73.55 H new ATOM 0 HE3 LYS A 5 -8.678 -14.037 -3.319 1.00 73.55 H new ATOM 0 HZ1 LYS A 5 -8.750 -16.241 -1.819 1.00 64.12 H new ATOM 0 HZ2 LYS A 5 -8.715 -16.262 -3.517 1.00 64.12 H new ATOM 0 HZ3 LYS A 5 -7.283 -16.494 -2.635 1.00 64.12 H new ATOM 90 N LEU A 6 -2.489 -12.737 -6.114 1.00 64.30 N ATOM 91 CA LEU A 6 -1.237 -12.034 -5.861 1.00 21.31 C ATOM 92 C LEU A 6 -1.404 -10.991 -4.761 1.00 20.12 C ATOM 93 O LEU A 6 -2.117 -10.001 -4.933 1.00 3.21 O ATOM 94 CB LEU A 6 -0.738 -11.364 -7.142 1.00 24.25 C ATOM 95 CG LEU A 6 -0.743 -12.256 -8.384 1.00 30.55 C ATOM 96 CD1 LEU A 6 -0.191 -11.502 -9.585 1.00 63.21 C ATOM 97 CD2 LEU A 6 0.061 -13.526 -8.131 1.00 4.22 C ATOM 0 H LEU A 6 -3.106 -12.274 -6.781 1.00 64.30 H new ATOM 0 HA LEU A 6 -0.502 -12.767 -5.529 1.00 21.31 H new ATOM 0 HB2 LEU A 6 -1.356 -10.488 -7.340 1.00 24.25 H new ATOM 0 HB3 LEU A 6 0.278 -11.006 -6.975 1.00 24.25 H new ATOM 0 HG LEU A 6 -1.773 -12.539 -8.602 1.00 30.55 H new ATOM 0 HD11 LEU A 6 -0.202 -12.152 -10.460 1.00 63.21 H new ATOM 0 HD12 LEU A 6 -0.807 -10.624 -9.778 1.00 63.21 H new ATOM 0 HD13 LEU A 6 0.832 -11.189 -9.379 1.00 63.21 H new ATOM 0 HD21 LEU A 6 0.047 -14.150 -9.025 1.00 4.22 H new ATOM 0 HD22 LEU A 6 1.090 -13.263 -7.888 1.00 4.22 H new ATOM 0 HD23 LEU A 6 -0.379 -14.075 -7.299 1.00 4.22 H new ATOM 109 N VAL A 7 -0.742 -11.218 -3.631 1.00 5.02 N ATOM 110 CA VAL A 7 -0.811 -10.301 -2.504 1.00 33.30 C ATOM 111 C VAL A 7 0.352 -9.314 -2.530 1.00 52.42 C ATOM 112 O VAL A 7 1.514 -9.706 -2.427 1.00 42.32 O ATOM 113 CB VAL A 7 -0.797 -11.069 -1.168 1.00 73.42 C ATOM 114 CG1 VAL A 7 -0.863 -10.107 0.006 1.00 72.44 C ATOM 115 CG2 VAL A 7 -1.945 -12.066 -1.114 1.00 23.33 C ATOM 0 H VAL A 7 -0.150 -12.033 -3.473 1.00 5.02 H new ATOM 0 HA VAL A 7 -1.748 -9.750 -2.590 1.00 33.30 H new ATOM 0 HB VAL A 7 0.140 -11.622 -1.100 1.00 73.42 H new ATOM 0 HG11 VAL A 7 -0.852 -10.670 0.939 1.00 72.44 H new ATOM 0 HG12 VAL A 7 -0.004 -9.437 -0.024 1.00 72.44 H new ATOM 0 HG13 VAL A 7 -1.781 -9.522 -0.054 1.00 72.44 H new ATOM 0 HG21 VAL A 7 -1.919 -12.599 -0.164 1.00 23.33 H new ATOM 0 HG22 VAL A 7 -2.893 -11.535 -1.207 1.00 23.33 H new ATOM 0 HG23 VAL A 7 -1.847 -12.779 -1.933 1.00 23.33 H new ATOM 125 N VAL A 8 0.032 -8.032 -2.670 1.00 22.53 N ATOM 126 CA VAL A 8 1.046 -6.990 -2.712 1.00 15.42 C ATOM 127 C VAL A 8 1.328 -6.442 -1.316 1.00 42.10 C ATOM 128 O VAL A 8 0.413 -6.249 -0.517 1.00 1.34 O ATOM 129 CB VAL A 8 0.612 -5.833 -3.630 1.00 4.45 C ATOM 130 CG1 VAL A 8 1.709 -4.787 -3.729 1.00 50.03 C ATOM 131 CG2 VAL A 8 0.240 -6.355 -5.010 1.00 74.53 C ATOM 0 H VAL A 8 -0.925 -7.691 -2.756 1.00 22.53 H new ATOM 0 HA VAL A 8 1.955 -7.441 -3.110 1.00 15.42 H new ATOM 0 HB VAL A 8 -0.269 -5.362 -3.194 1.00 4.45 H new ATOM 0 HG11 VAL A 8 1.382 -3.978 -4.382 1.00 50.03 H new ATOM 0 HG12 VAL A 8 1.923 -4.389 -2.737 1.00 50.03 H new ATOM 0 HG13 VAL A 8 2.610 -5.243 -4.139 1.00 50.03 H new ATOM 0 HG21 VAL A 8 -0.064 -5.522 -5.644 1.00 74.53 H new ATOM 0 HG22 VAL A 8 1.101 -6.854 -5.454 1.00 74.53 H new ATOM 0 HG23 VAL A 8 -0.584 -7.063 -4.921 1.00 74.53 H new ATOM 141 N VAL A 9 2.602 -6.191 -1.032 1.00 54.43 N ATOM 142 CA VAL A 9 3.006 -5.663 0.265 1.00 62.44 C ATOM 143 C VAL A 9 4.144 -4.657 0.117 1.00 54.12 C ATOM 144 O VAL A 9 4.833 -4.631 -0.903 1.00 3.33 O ATOM 145 CB VAL A 9 3.443 -6.790 1.224 1.00 32.33 C ATOM 146 CG1 VAL A 9 2.339 -7.825 1.370 1.00 30.30 C ATOM 147 CG2 VAL A 9 4.731 -7.442 0.743 1.00 11.52 C ATOM 0 H VAL A 9 3.372 -6.345 -1.683 1.00 54.43 H new ATOM 0 HA VAL A 9 2.136 -5.161 0.688 1.00 62.44 H new ATOM 0 HB VAL A 9 3.632 -6.349 2.203 1.00 32.33 H new ATOM 0 HG11 VAL A 9 2.666 -8.612 2.050 1.00 30.30 H new ATOM 0 HG12 VAL A 9 1.444 -7.348 1.770 1.00 30.30 H new ATOM 0 HG13 VAL A 9 2.115 -8.258 0.395 1.00 30.30 H new ATOM 0 HG21 VAL A 9 5.019 -8.233 1.435 1.00 11.52 H new ATOM 0 HG22 VAL A 9 4.576 -7.866 -0.249 1.00 11.52 H new ATOM 0 HG23 VAL A 9 5.523 -6.694 0.698 1.00 11.52 H new ATOM 157 N GLY A 10 4.336 -3.830 1.139 1.00 52.44 N ATOM 158 CA GLY A 10 5.391 -2.836 1.099 1.00 14.13 C ATOM 159 C GLY A 10 5.624 -2.180 2.445 1.00 34.53 C ATOM 160 O GLY A 10 6.286 -2.748 3.313 1.00 21.01 O ATOM 0 H GLY A 10 3.780 -3.831 1.994 1.00 52.44 H new ATOM 0 HA2 GLY A 10 6.315 -3.306 0.763 1.00 14.13 H new ATOM 0 HA3 GLY A 10 5.137 -2.071 0.365 1.00 14.13 H new ATOM 164 N ALA A 11 5.077 -0.982 2.619 1.00 72.42 N ATOM 165 CA ALA A 11 5.227 -0.247 3.869 1.00 73.20 C ATOM 166 C ALA A 11 4.426 1.051 3.841 1.00 52.52 C ATOM 167 O ALA A 11 4.920 2.087 3.395 1.00 63.14 O ATOM 168 CB ALA A 11 6.695 0.043 4.139 1.00 4.41 C ATOM 0 H ALA A 11 4.525 -0.499 1.910 1.00 72.42 H new ATOM 0 HA ALA A 11 4.837 -0.868 4.676 1.00 73.20 H new ATOM 0 HB1 ALA A 11 6.791 0.592 5.076 1.00 4.41 H new ATOM 0 HB2 ALA A 11 7.244 -0.896 4.211 1.00 4.41 H new ATOM 0 HB3 ALA A 11 7.104 0.641 3.324 1.00 4.41 H new ATOM 174 N GLY A 12 3.187 0.986 4.317 1.00 53.15 N ATOM 175 CA GLY A 12 2.337 2.161 4.336 1.00 30.41 C ATOM 176 C GLY A 12 1.943 2.610 2.942 1.00 43.52 C ATOM 177 O GLY A 12 0.841 2.320 2.478 1.00 53.20 O ATOM 0 H GLY A 12 2.757 0.140 4.690 1.00 53.15 H new ATOM 0 HA2 GLY A 12 1.438 1.947 4.914 1.00 30.41 H new ATOM 0 HA3 GLY A 12 2.856 2.974 4.844 1.00 30.41 H new ATOM 181 N GLY A 13 2.847 3.318 2.274 1.00 34.13 N ATOM 182 CA GLY A 13 2.574 3.795 0.932 1.00 11.03 C ATOM 183 C GLY A 13 3.485 3.165 -0.104 1.00 41.51 C ATOM 184 O GLY A 13 3.084 2.237 -0.807 1.00 50.11 O ATOM 0 H GLY A 13 3.765 3.570 2.639 1.00 34.13 H new ATOM 0 HA2 GLY A 13 1.536 3.580 0.677 1.00 11.03 H new ATOM 0 HA3 GLY A 13 2.691 4.878 0.904 1.00 11.03 H new ATOM 188 N VAL A 14 4.715 3.669 -0.190 1.00 31.33 N ATOM 189 CA VAL A 14 5.705 3.158 -1.139 1.00 51.43 C ATOM 190 C VAL A 14 5.086 2.849 -2.501 1.00 44.55 C ATOM 191 O VAL A 14 5.529 1.940 -3.202 1.00 24.24 O ATOM 192 CB VAL A 14 6.393 1.890 -0.597 1.00 70.05 C ATOM 193 CG1 VAL A 14 7.304 2.233 0.572 1.00 25.43 C ATOM 194 CG2 VAL A 14 5.356 0.855 -0.187 1.00 3.12 C ATOM 0 H VAL A 14 5.052 4.437 0.391 1.00 31.33 H new ATOM 0 HA VAL A 14 6.446 3.947 -1.266 1.00 51.43 H new ATOM 0 HB VAL A 14 7.006 1.464 -1.392 1.00 70.05 H new ATOM 0 HG11 VAL A 14 7.780 1.325 0.941 1.00 25.43 H new ATOM 0 HG12 VAL A 14 8.069 2.936 0.243 1.00 25.43 H new ATOM 0 HG13 VAL A 14 6.716 2.684 1.371 1.00 25.43 H new ATOM 0 HG21 VAL A 14 5.860 -0.034 0.193 1.00 3.12 H new ATOM 0 HG22 VAL A 14 4.716 1.270 0.591 1.00 3.12 H new ATOM 0 HG23 VAL A 14 4.749 0.586 -1.051 1.00 3.12 H new ATOM 204 N GLY A 15 4.060 3.612 -2.872 1.00 71.14 N ATOM 205 CA GLY A 15 3.400 3.404 -4.149 1.00 74.12 C ATOM 206 C GLY A 15 2.992 1.959 -4.369 1.00 42.22 C ATOM 207 O GLY A 15 2.996 1.469 -5.499 1.00 42.30 O ATOM 0 H GLY A 15 3.674 4.371 -2.310 1.00 71.14 H new ATOM 0 HA2 GLY A 15 2.516 4.039 -4.204 1.00 74.12 H new ATOM 0 HA3 GLY A 15 4.067 3.715 -4.953 1.00 74.12 H new ATOM 211 N LYS A 16 2.641 1.276 -3.284 1.00 25.31 N ATOM 212 CA LYS A 16 2.230 -0.122 -3.357 1.00 55.54 C ATOM 213 C LYS A 16 0.891 -0.262 -4.074 1.00 34.01 C ATOM 214 O LYS A 16 0.682 -1.201 -4.843 1.00 53.43 O ATOM 215 CB LYS A 16 2.134 -0.719 -1.952 1.00 75.21 C ATOM 216 CG LYS A 16 1.112 -0.026 -1.065 1.00 3.25 C ATOM 217 CD LYS A 16 1.373 -0.300 0.407 1.00 22.10 C ATOM 218 CE LYS A 16 1.213 -1.776 0.734 1.00 35.34 C ATOM 219 NZ LYS A 16 1.266 -2.029 2.200 1.00 53.12 N ATOM 0 H LYS A 16 2.633 1.668 -2.343 1.00 25.31 H new ATOM 0 HA LYS A 16 2.983 -0.666 -3.927 1.00 55.54 H new ATOM 0 HB2 LYS A 16 1.877 -1.775 -2.032 1.00 75.21 H new ATOM 0 HB3 LYS A 16 3.113 -0.665 -1.475 1.00 75.21 H new ATOM 0 HG2 LYS A 16 1.141 1.048 -1.247 1.00 3.25 H new ATOM 0 HG3 LYS A 16 0.111 -0.367 -1.327 1.00 3.25 H new ATOM 0 HD2 LYS A 16 2.381 0.024 0.666 1.00 22.10 H new ATOM 0 HD3 LYS A 16 0.684 0.286 1.015 1.00 22.10 H new ATOM 0 HE2 LYS A 16 0.263 -2.135 0.338 1.00 35.34 H new ATOM 0 HE3 LYS A 16 2.000 -2.345 0.239 1.00 35.34 H new ATOM 0 HZ1 LYS A 16 1.153 -3.047 2.381 1.00 53.12 H new ATOM 0 HZ2 LYS A 16 2.182 -1.710 2.574 1.00 53.12 H new ATOM 0 HZ3 LYS A 16 0.499 -1.507 2.670 1.00 53.12 H new ATOM 233 N SER A 17 -0.015 0.676 -3.817 1.00 21.24 N ATOM 234 CA SER A 17 -1.336 0.654 -4.437 1.00 20.54 C ATOM 235 C SER A 17 -1.288 1.229 -5.849 1.00 34.10 C ATOM 236 O SER A 17 -1.989 0.758 -6.746 1.00 14.21 O ATOM 237 CB SER A 17 -2.333 1.443 -3.587 1.00 15.11 C ATOM 238 OG SER A 17 -2.126 2.839 -3.720 1.00 20.41 O ATOM 0 H SER A 17 0.141 1.461 -3.184 1.00 21.24 H new ATOM 0 HA SER A 17 -1.662 -0.384 -4.500 1.00 20.54 H new ATOM 0 HB2 SER A 17 -3.350 1.193 -3.888 1.00 15.11 H new ATOM 0 HB3 SER A 17 -2.231 1.155 -2.541 1.00 15.11 H new ATOM 0 HG SER A 17 -2.777 3.320 -3.168 1.00 20.41 H new ATOM 244 N ALA A 18 -0.457 2.249 -6.040 1.00 14.35 N ATOM 245 CA ALA A 18 -0.315 2.893 -7.341 1.00 71.25 C ATOM 246 C ALA A 18 -0.010 1.873 -8.436 1.00 54.23 C ATOM 247 O ALA A 18 -0.666 1.853 -9.478 1.00 1.55 O ATOM 248 CB ALA A 18 0.773 3.954 -7.287 1.00 55.32 C ATOM 0 H ALA A 18 0.130 2.648 -5.308 1.00 14.35 H new ATOM 0 HA ALA A 18 -1.264 3.371 -7.585 1.00 71.25 H new ATOM 0 HB1 ALA A 18 0.869 4.427 -8.264 1.00 55.32 H new ATOM 0 HB2 ALA A 18 0.510 4.707 -6.544 1.00 55.32 H new ATOM 0 HB3 ALA A 18 1.721 3.490 -7.014 1.00 55.32 H new ATOM 254 N LEU A 19 0.987 1.028 -8.194 1.00 42.13 N ATOM 255 CA LEU A 19 1.375 0.007 -9.163 1.00 44.21 C ATOM 256 C LEU A 19 0.193 -0.892 -9.512 1.00 74.20 C ATOM 257 O LEU A 19 0.099 -1.403 -10.627 1.00 74.42 O ATOM 258 CB LEU A 19 2.525 -0.836 -8.612 1.00 32.05 C ATOM 259 CG LEU A 19 3.842 -0.084 -8.415 1.00 42.43 C ATOM 260 CD1 LEU A 19 4.846 -0.952 -7.675 1.00 42.14 C ATOM 261 CD2 LEU A 19 4.406 0.362 -9.756 1.00 24.23 C ATOM 0 H LEU A 19 1.540 1.029 -7.337 1.00 42.13 H new ATOM 0 HA LEU A 19 1.704 0.511 -10.071 1.00 44.21 H new ATOM 0 HB2 LEU A 19 2.219 -1.259 -7.655 1.00 32.05 H new ATOM 0 HB3 LEU A 19 2.699 -1.672 -9.289 1.00 32.05 H new ATOM 0 HG LEU A 19 3.646 0.803 -7.812 1.00 42.43 H new ATOM 0 HD11 LEU A 19 5.777 -0.400 -7.544 1.00 42.14 H new ATOM 0 HD12 LEU A 19 4.444 -1.222 -6.699 1.00 42.14 H new ATOM 0 HD13 LEU A 19 5.039 -1.857 -8.251 1.00 42.14 H new ATOM 0 HD21 LEU A 19 5.343 0.896 -9.597 1.00 24.23 H new ATOM 0 HD22 LEU A 19 4.587 -0.511 -10.383 1.00 24.23 H new ATOM 0 HD23 LEU A 19 3.692 1.021 -10.250 1.00 24.23 H new ATOM 273 N THR A 20 -0.705 -1.082 -8.551 1.00 32.02 N ATOM 274 CA THR A 20 -1.879 -1.920 -8.759 1.00 62.24 C ATOM 275 C THR A 20 -2.881 -1.234 -9.683 1.00 33.40 C ATOM 276 O THR A 20 -3.448 -1.864 -10.576 1.00 4.50 O ATOM 277 CB THR A 20 -2.542 -2.247 -7.420 1.00 21.23 C ATOM 278 OG1 THR A 20 -1.607 -2.816 -6.523 1.00 55.02 O ATOM 279 CG2 THR A 20 -3.702 -3.211 -7.548 1.00 21.40 C ATOM 0 H THR A 20 -0.642 -0.667 -7.621 1.00 32.02 H new ATOM 0 HA THR A 20 -1.554 -2.847 -9.231 1.00 62.24 H new ATOM 0 HB THR A 20 -2.920 -1.296 -7.044 1.00 21.23 H new ATOM 0 HG1 THR A 20 -1.852 -2.583 -5.603 1.00 55.02 H new ATOM 0 HG21 THR A 20 -4.128 -3.401 -6.563 1.00 21.40 H new ATOM 0 HG22 THR A 20 -4.465 -2.779 -8.196 1.00 21.40 H new ATOM 0 HG23 THR A 20 -3.350 -4.149 -7.978 1.00 21.40 H new ATOM 287 N ILE A 21 -3.094 0.060 -9.464 1.00 73.15 N ATOM 288 CA ILE A 21 -4.028 0.828 -10.280 1.00 20.41 C ATOM 289 C ILE A 21 -3.517 0.976 -11.708 1.00 43.21 C ATOM 290 O ILE A 21 -4.277 0.841 -12.667 1.00 4.11 O ATOM 291 CB ILE A 21 -4.273 2.228 -9.685 1.00 71.53 C ATOM 292 CG1 ILE A 21 -4.621 2.129 -8.200 1.00 23.10 C ATOM 293 CG2 ILE A 21 -5.383 2.940 -10.441 1.00 33.35 C ATOM 294 CD1 ILE A 21 -5.771 1.192 -7.904 1.00 4.21 C ATOM 0 H ILE A 21 -2.633 0.598 -8.730 1.00 73.15 H new ATOM 0 HA ILE A 21 -4.968 0.276 -10.290 1.00 20.41 H new ATOM 0 HB ILE A 21 -3.356 2.808 -9.786 1.00 71.53 H new ATOM 0 HG12 ILE A 21 -3.741 1.794 -7.652 1.00 23.10 H new ATOM 0 HG13 ILE A 21 -4.869 3.123 -7.827 1.00 23.10 H new ATOM 0 HG21 ILE A 21 -5.543 3.927 -10.008 1.00 33.35 H new ATOM 0 HG22 ILE A 21 -5.101 3.045 -11.489 1.00 33.35 H new ATOM 0 HG23 ILE A 21 -6.303 2.359 -10.370 1.00 33.35 H new ATOM 0 HD11 ILE A 21 -5.959 1.174 -6.830 1.00 4.21 H new ATOM 0 HD12 ILE A 21 -6.665 1.538 -8.423 1.00 4.21 H new ATOM 0 HD13 ILE A 21 -5.519 0.188 -8.245 1.00 4.21 H new ATOM 306 N GLN A 22 -2.224 1.254 -11.845 1.00 32.43 N ATOM 307 CA GLN A 22 -1.612 1.417 -13.159 1.00 31.35 C ATOM 308 C GLN A 22 -1.779 0.153 -13.996 1.00 30.24 C ATOM 309 O GLN A 22 -2.061 0.219 -15.192 1.00 42.32 O ATOM 310 CB GLN A 22 -0.127 1.759 -13.015 1.00 1.30 C ATOM 311 CG GLN A 22 0.341 2.858 -13.953 1.00 44.34 C ATOM 312 CD GLN A 22 -0.497 4.117 -13.842 1.00 32.14 C ATOM 313 OE1 GLN A 22 -1.206 4.491 -14.776 1.00 52.15 O ATOM 314 NE2 GLN A 22 -0.419 4.779 -12.693 1.00 3.42 N ATOM 0 H GLN A 22 -1.580 1.371 -11.062 1.00 32.43 H new ATOM 0 HA GLN A 22 -2.117 2.237 -13.669 1.00 31.35 H new ATOM 0 HB2 GLN A 22 0.068 2.064 -11.987 1.00 1.30 H new ATOM 0 HB3 GLN A 22 0.463 0.861 -13.199 1.00 1.30 H new ATOM 0 HG2 GLN A 22 1.381 3.098 -13.734 1.00 44.34 H new ATOM 0 HG3 GLN A 22 0.307 2.493 -14.980 1.00 44.34 H new ATOM 0 HE21 GLN A 22 0.182 4.433 -11.945 1.00 3.42 H new ATOM 0 HE22 GLN A 22 -0.960 5.633 -12.559 1.00 3.42 H new ATOM 323 N LEU A 23 -1.602 -0.998 -13.358 1.00 72.43 N ATOM 324 CA LEU A 23 -1.732 -2.280 -14.041 1.00 44.30 C ATOM 325 C LEU A 23 -3.201 -2.646 -14.263 1.00 75.34 C ATOM 326 O LEU A 23 -3.505 -3.597 -14.982 1.00 53.31 O ATOM 327 CB LEU A 23 -1.035 -3.378 -13.234 1.00 74.31 C ATOM 328 CG LEU A 23 -1.222 -4.799 -13.770 1.00 72.11 C ATOM 329 CD1 LEU A 23 -0.778 -4.886 -15.222 1.00 3.31 C ATOM 330 CD2 LEU A 23 -0.451 -5.795 -12.915 1.00 65.10 C ATOM 0 H LEU A 23 -1.368 -1.070 -12.368 1.00 72.43 H new ATOM 0 HA LEU A 23 -1.255 -2.191 -15.017 1.00 44.30 H new ATOM 0 HB2 LEU A 23 0.032 -3.158 -13.198 1.00 74.31 H new ATOM 0 HB3 LEU A 23 -1.403 -3.342 -12.209 1.00 74.31 H new ATOM 0 HG LEU A 23 -2.282 -5.049 -13.721 1.00 72.11 H new ATOM 0 HD11 LEU A 23 -0.919 -5.904 -15.585 1.00 3.31 H new ATOM 0 HD12 LEU A 23 -1.372 -4.200 -15.826 1.00 3.31 H new ATOM 0 HD13 LEU A 23 0.275 -4.616 -15.297 1.00 3.31 H new ATOM 0 HD21 LEU A 23 -0.595 -6.801 -13.310 1.00 65.10 H new ATOM 0 HD22 LEU A 23 0.610 -5.546 -12.934 1.00 65.10 H new ATOM 0 HD23 LEU A 23 -0.816 -5.752 -11.889 1.00 65.10 H new ATOM 342 N ILE A 24 -4.108 -1.895 -13.640 1.00 64.45 N ATOM 343 CA ILE A 24 -5.536 -2.158 -13.774 1.00 54.35 C ATOM 344 C ILE A 24 -6.240 -1.047 -14.555 1.00 53.53 C ATOM 345 O ILE A 24 -6.617 -1.234 -15.713 1.00 2.52 O ATOM 346 CB ILE A 24 -6.207 -2.315 -12.391 1.00 3.43 C ATOM 347 CG1 ILE A 24 -5.594 -3.499 -11.637 1.00 54.01 C ATOM 348 CG2 ILE A 24 -7.713 -2.490 -12.536 1.00 4.22 C ATOM 349 CD1 ILE A 24 -6.023 -4.850 -12.168 1.00 24.12 C ATOM 0 H ILE A 24 -3.878 -1.103 -13.040 1.00 64.45 H new ATOM 0 HA ILE A 24 -5.634 -3.092 -14.327 1.00 54.35 H new ATOM 0 HB ILE A 24 -6.029 -1.407 -11.816 1.00 3.43 H new ATOM 0 HG12 ILE A 24 -4.508 -3.427 -11.688 1.00 54.01 H new ATOM 0 HG13 ILE A 24 -5.869 -3.429 -10.584 1.00 54.01 H new ATOM 0 HG21 ILE A 24 -8.163 -2.599 -11.549 1.00 4.22 H new ATOM 0 HG22 ILE A 24 -8.135 -1.616 -13.033 1.00 4.22 H new ATOM 0 HG23 ILE A 24 -7.920 -3.380 -13.129 1.00 4.22 H new ATOM 0 HD11 ILE A 24 -5.548 -5.638 -11.584 1.00 24.12 H new ATOM 0 HD12 ILE A 24 -7.106 -4.944 -12.091 1.00 24.12 H new ATOM 0 HD13 ILE A 24 -5.724 -4.942 -13.212 1.00 24.12 H new ATOM 361 N GLN A 25 -6.423 0.102 -13.913 1.00 1.00 N ATOM 362 CA GLN A 25 -7.092 1.234 -14.547 1.00 5.01 C ATOM 363 C GLN A 25 -6.133 2.033 -15.427 1.00 14.35 C ATOM 364 O GLN A 25 -6.563 2.778 -16.306 1.00 63.11 O ATOM 365 CB GLN A 25 -7.704 2.145 -13.482 1.00 63.10 C ATOM 366 CG GLN A 25 -8.596 1.410 -12.495 1.00 43.52 C ATOM 367 CD GLN A 25 -9.204 2.333 -11.457 1.00 3.41 C ATOM 368 OE1 GLN A 25 -9.800 3.356 -11.792 1.00 31.43 O ATOM 369 NE2 GLN A 25 -9.054 1.975 -10.186 1.00 75.33 N ATOM 0 H GLN A 25 -6.118 0.275 -12.955 1.00 1.00 H new ATOM 0 HA GLN A 25 -7.882 0.839 -15.186 1.00 5.01 H new ATOM 0 HB2 GLN A 25 -6.902 2.641 -12.935 1.00 63.10 H new ATOM 0 HB3 GLN A 25 -8.285 2.925 -13.973 1.00 63.10 H new ATOM 0 HG2 GLN A 25 -9.395 0.905 -13.039 1.00 43.52 H new ATOM 0 HG3 GLN A 25 -8.015 0.637 -11.992 1.00 43.52 H new ATOM 0 HE21 GLN A 25 -8.552 1.118 -9.953 1.00 75.33 H new ATOM 0 HE22 GLN A 25 -9.441 2.557 -9.443 1.00 75.33 H new ATOM 378 N ASN A 26 -4.834 1.874 -15.188 1.00 72.24 N ATOM 379 CA ASN A 26 -3.822 2.585 -15.966 1.00 70.33 C ATOM 380 C ASN A 26 -3.855 4.081 -15.665 1.00 2.05 C ATOM 381 O ASN A 26 -3.826 4.909 -16.575 1.00 71.13 O ATOM 382 CB ASN A 26 -4.031 2.345 -17.464 1.00 72.12 C ATOM 383 CG ASN A 26 -4.260 0.882 -17.789 1.00 31.15 C ATOM 384 OD1 ASN A 26 -5.421 0.577 -18.360 1.00 32.43 O flip ATOM 385 ND2 ASN A 26 -3.405 0.036 -17.532 1.00 72.35 N flip ATOM 0 H ASN A 26 -4.458 1.261 -14.464 1.00 72.24 H new ATOM 0 HA ASN A 26 -2.844 2.198 -15.680 1.00 70.33 H new ATOM 0 HB2 ASN A 26 -4.885 2.928 -17.807 1.00 72.12 H new ATOM 0 HB3 ASN A 26 -3.160 2.704 -18.012 1.00 72.12 H new ATOM 0 HD21 ASN A 26 -2.527 0.315 -17.093 1.00 72.35 H new ATOM 0 HD22 ASN A 26 -3.573 -0.944 -17.758 1.00 72.35 H new ATOM 588 N TYR A 40 -8.001 -5.790 -7.146 1.00 74.23 N ATOM 589 CA TYR A 40 -8.499 -5.811 -8.516 1.00 23.11 C ATOM 590 C TYR A 40 -8.087 -7.097 -9.226 1.00 31.21 C ATOM 591 O TYR A 40 -7.297 -7.883 -8.701 1.00 24.03 O ATOM 592 CB TYR A 40 -7.976 -4.600 -9.290 1.00 40.12 C ATOM 593 CG TYR A 40 -8.093 -3.299 -8.528 1.00 31.23 C ATOM 594 CD1 TYR A 40 -7.165 -2.958 -7.552 1.00 73.32 C ATOM 595 CD2 TYR A 40 -9.131 -2.413 -8.784 1.00 34.13 C ATOM 596 CE1 TYR A 40 -7.269 -1.771 -6.852 1.00 54.21 C ATOM 597 CE2 TYR A 40 -9.242 -1.224 -8.090 1.00 34.11 C ATOM 598 CZ TYR A 40 -8.310 -0.906 -7.125 1.00 1.02 C ATOM 599 OH TYR A 40 -8.420 0.278 -6.430 1.00 64.54 O ATOM 0 HA TYR A 40 -9.588 -5.769 -8.480 1.00 23.11 H new ATOM 0 HB2 TYR A 40 -6.930 -4.768 -9.548 1.00 40.12 H new ATOM 0 HB3 TYR A 40 -8.525 -4.513 -10.227 1.00 40.12 H new ATOM 0 HD1 TYR A 40 -6.349 -3.632 -7.337 1.00 73.32 H new ATOM 0 HD2 TYR A 40 -9.864 -2.658 -9.539 1.00 34.13 H new ATOM 0 HE1 TYR A 40 -6.540 -1.521 -6.095 1.00 54.21 H new ATOM 0 HE2 TYR A 40 -10.056 -0.546 -8.302 1.00 34.11 H new ATOM 0 HH TYR A 40 -9.207 0.770 -6.745 1.00 64.54 H new ATOM 609 N ARG A 41 -8.625 -7.304 -10.424 1.00 32.21 N ATOM 610 CA ARG A 41 -8.313 -8.493 -11.208 1.00 41.10 C ATOM 611 C ARG A 41 -8.023 -8.125 -12.661 1.00 25.24 C ATOM 612 O ARG A 41 -8.415 -7.057 -13.130 1.00 23.12 O ATOM 613 CB ARG A 41 -9.470 -9.491 -11.144 1.00 12.21 C ATOM 614 CG ARG A 41 -9.612 -10.173 -9.793 1.00 23.11 C ATOM 615 CD ARG A 41 -11.007 -10.745 -9.600 1.00 44.12 C ATOM 616 NE ARG A 41 -11.026 -12.199 -9.737 1.00 53.22 N ATOM 617 CZ ARG A 41 -12.137 -12.913 -9.911 1.00 52.03 C ATOM 618 NH1 ARG A 41 -13.318 -12.310 -9.970 1.00 12.43 N ATOM 619 NH2 ARG A 41 -12.065 -14.231 -10.026 1.00 61.43 N ATOM 0 H ARG A 41 -9.279 -6.663 -10.873 1.00 32.21 H new ATOM 0 HA ARG A 41 -7.422 -8.954 -10.783 1.00 41.10 H new ATOM 0 HB2 ARG A 41 -10.399 -8.972 -11.379 1.00 12.21 H new ATOM 0 HB3 ARG A 41 -9.326 -10.251 -11.912 1.00 12.21 H new ATOM 0 HG2 ARG A 41 -8.875 -10.972 -9.709 1.00 23.11 H new ATOM 0 HG3 ARG A 41 -9.398 -9.457 -8.999 1.00 23.11 H new ATOM 0 HD2 ARG A 41 -11.379 -10.469 -8.613 1.00 44.12 H new ATOM 0 HD3 ARG A 41 -11.684 -10.303 -10.331 1.00 44.12 H new ATOM 0 HE ARG A 41 -10.137 -12.697 -9.697 1.00 53.22 H new ATOM 0 HH11 ARG A 41 -13.378 -11.296 -9.882 1.00 12.43 H new ATOM 0 HH12 ARG A 41 -14.166 -12.861 -10.103 1.00 12.43 H new ATOM 0 HH21 ARG A 41 -11.159 -14.698 -9.981 1.00 61.43 H new ATOM 0 HH22 ARG A 41 -12.915 -14.779 -10.159 1.00 61.43 H new ATOM 633 N LYS A 42 -7.335 -9.017 -13.366 1.00 41.20 N ATOM 634 CA LYS A 42 -6.993 -8.784 -14.764 1.00 43.20 C ATOM 635 C LYS A 42 -6.760 -10.102 -15.495 1.00 15.52 C ATOM 636 O LYS A 42 -6.273 -11.070 -14.912 1.00 75.14 O ATOM 637 CB LYS A 42 -5.746 -7.905 -14.868 1.00 41.44 C ATOM 638 CG LYS A 42 -5.649 -7.139 -16.176 1.00 54.31 C ATOM 639 CD LYS A 42 -4.559 -6.082 -16.121 1.00 21.20 C ATOM 640 CE LYS A 42 -4.496 -5.271 -17.407 1.00 34.13 C ATOM 641 NZ LYS A 42 -3.216 -5.485 -18.137 1.00 64.45 N ATOM 0 H LYS A 42 -7.004 -9.907 -12.993 1.00 41.20 H new ATOM 0 HA LYS A 42 -7.832 -8.271 -15.234 1.00 43.20 H new ATOM 0 HB2 LYS A 42 -5.742 -7.196 -14.040 1.00 41.44 H new ATOM 0 HB3 LYS A 42 -4.860 -8.531 -14.757 1.00 41.44 H new ATOM 0 HG2 LYS A 42 -5.444 -7.833 -16.991 1.00 54.31 H new ATOM 0 HG3 LYS A 42 -6.606 -6.665 -16.394 1.00 54.31 H new ATOM 0 HD2 LYS A 42 -4.741 -5.415 -15.279 1.00 21.20 H new ATOM 0 HD3 LYS A 42 -3.596 -6.561 -15.945 1.00 21.20 H new ATOM 0 HE2 LYS A 42 -5.331 -5.546 -18.051 1.00 34.13 H new ATOM 0 HE3 LYS A 42 -4.608 -4.212 -17.174 1.00 34.13 H new ATOM 0 HZ1 LYS A 42 -3.213 -4.915 -19.007 1.00 64.45 H new ATOM 0 HZ2 LYS A 42 -2.420 -5.199 -17.533 1.00 64.45 H new ATOM 0 HZ3 LYS A 42 -3.120 -6.491 -18.382 1.00 64.45 H new ATOM 655 N GLN A 43 -7.107 -10.128 -16.777 1.00 54.31 N ATOM 656 CA GLN A 43 -6.934 -11.325 -17.592 1.00 11.33 C ATOM 657 C GLN A 43 -5.847 -11.114 -18.642 1.00 24.10 C ATOM 658 O GLN A 43 -5.949 -10.224 -19.486 1.00 22.14 O ATOM 659 CB GLN A 43 -8.251 -11.700 -18.274 1.00 63.13 C ATOM 660 CG GLN A 43 -8.308 -13.145 -18.735 1.00 14.02 C ATOM 661 CD GLN A 43 -9.516 -13.425 -19.595 1.00 70.34 C ATOM 662 OE1 GLN A 43 -10.630 -13.584 -19.096 1.00 5.02 O ATOM 663 NE2 GLN A 43 -9.298 -13.486 -20.898 1.00 40.04 N ATOM 0 H GLN A 43 -7.510 -9.334 -17.274 1.00 54.31 H new ATOM 0 HA GLN A 43 -6.629 -12.140 -16.936 1.00 11.33 H new ATOM 0 HB2 GLN A 43 -9.073 -11.515 -17.583 1.00 63.13 H new ATOM 0 HB3 GLN A 43 -8.404 -11.047 -19.133 1.00 63.13 H new ATOM 0 HG2 GLN A 43 -7.403 -13.381 -19.295 1.00 14.02 H new ATOM 0 HG3 GLN A 43 -8.324 -13.801 -17.865 1.00 14.02 H new ATOM 0 HE21 GLN A 43 -8.356 -13.347 -21.265 1.00 40.04 H new ATOM 0 HE22 GLN A 43 -10.072 -13.672 -21.536 1.00 40.04 H new ATOM 672 N VAL A 44 -4.807 -11.940 -18.583 1.00 1.52 N ATOM 673 CA VAL A 44 -3.702 -11.844 -19.527 1.00 51.22 C ATOM 674 C VAL A 44 -3.232 -13.228 -19.964 1.00 42.31 C ATOM 675 O VAL A 44 -3.784 -14.243 -19.542 1.00 74.35 O ATOM 676 CB VAL A 44 -2.512 -11.074 -18.923 1.00 35.32 C ATOM 677 CG1 VAL A 44 -2.912 -9.645 -18.588 1.00 44.11 C ATOM 678 CG2 VAL A 44 -1.983 -11.788 -17.688 1.00 25.33 C ATOM 0 H VAL A 44 -4.708 -12.683 -17.891 1.00 1.52 H new ATOM 0 HA VAL A 44 -4.073 -11.299 -20.395 1.00 51.22 H new ATOM 0 HB VAL A 44 -1.714 -11.040 -19.665 1.00 35.32 H new ATOM 0 HG11 VAL A 44 -2.058 -9.118 -18.163 1.00 44.11 H new ATOM 0 HG12 VAL A 44 -3.237 -9.136 -19.495 1.00 44.11 H new ATOM 0 HG13 VAL A 44 -3.728 -9.655 -17.866 1.00 44.11 H new ATOM 0 HG21 VAL A 44 -1.143 -11.229 -17.276 1.00 25.33 H new ATOM 0 HG22 VAL A 44 -2.774 -11.857 -16.941 1.00 25.33 H new ATOM 0 HG23 VAL A 44 -1.653 -12.790 -17.961 1.00 25.33 H new ATOM 688 N VAL A 45 -2.208 -13.259 -20.811 1.00 40.23 N ATOM 689 CA VAL A 45 -1.664 -14.518 -21.304 1.00 13.02 C ATOM 690 C VAL A 45 -0.170 -14.619 -21.016 1.00 32.33 C ATOM 691 O VAL A 45 0.650 -14.033 -21.723 1.00 53.42 O ATOM 692 CB VAL A 45 -1.896 -14.678 -22.819 1.00 5.33 C ATOM 693 CG1 VAL A 45 -1.492 -16.070 -23.279 1.00 64.00 C ATOM 694 CG2 VAL A 45 -3.349 -14.394 -23.168 1.00 21.52 C ATOM 0 H VAL A 45 -1.739 -12.427 -21.170 1.00 40.23 H new ATOM 0 HA VAL A 45 -2.189 -15.316 -20.779 1.00 13.02 H new ATOM 0 HB VAL A 45 -1.271 -13.954 -23.342 1.00 5.33 H new ATOM 0 HG11 VAL A 45 -1.663 -16.163 -24.351 1.00 64.00 H new ATOM 0 HG12 VAL A 45 -0.435 -16.232 -23.065 1.00 64.00 H new ATOM 0 HG13 VAL A 45 -2.087 -16.815 -22.751 1.00 64.00 H new ATOM 0 HG21 VAL A 45 -3.495 -14.512 -24.242 1.00 21.52 H new ATOM 0 HG22 VAL A 45 -3.994 -15.093 -22.635 1.00 21.52 H new ATOM 0 HG23 VAL A 45 -3.600 -13.374 -22.877 1.00 21.52 H new ATOM 704 N ILE A 46 0.174 -15.365 -19.972 1.00 2.53 N ATOM 705 CA ILE A 46 1.568 -15.543 -19.587 1.00 34.04 C ATOM 706 C ILE A 46 1.995 -16.999 -19.743 1.00 14.24 C ATOM 707 O ILE A 46 1.335 -17.907 -19.237 1.00 52.42 O ATOM 708 CB ILE A 46 1.813 -15.099 -18.131 1.00 12.31 C ATOM 709 CG1 ILE A 46 1.140 -13.751 -17.863 1.00 72.31 C ATOM 710 CG2 ILE A 46 3.305 -15.015 -17.845 1.00 63.24 C ATOM 711 CD1 ILE A 46 1.269 -13.287 -16.429 1.00 55.23 C ATOM 0 H ILE A 46 -0.494 -15.856 -19.378 1.00 2.53 H new ATOM 0 HA ILE A 46 2.163 -14.917 -20.252 1.00 34.04 H new ATOM 0 HB ILE A 46 1.375 -15.842 -17.465 1.00 12.31 H new ATOM 0 HG12 ILE A 46 1.576 -12.999 -18.521 1.00 72.31 H new ATOM 0 HG13 ILE A 46 0.083 -13.824 -18.119 1.00 72.31 H new ATOM 0 HG21 ILE A 46 3.461 -14.700 -16.813 1.00 63.24 H new ATOM 0 HG22 ILE A 46 3.761 -15.993 -17.999 1.00 63.24 H new ATOM 0 HG23 ILE A 46 3.764 -14.291 -18.518 1.00 63.24 H new ATOM 0 HD11 ILE A 46 0.769 -12.325 -16.311 1.00 55.23 H new ATOM 0 HD12 ILE A 46 0.807 -14.019 -15.767 1.00 55.23 H new ATOM 0 HD13 ILE A 46 2.324 -13.181 -16.174 1.00 55.23 H new ATOM 723 N ASP A 47 3.101 -17.215 -20.448 1.00 4.42 N ATOM 724 CA ASP A 47 3.616 -18.561 -20.676 1.00 44.24 C ATOM 725 C ASP A 47 2.685 -19.353 -21.590 1.00 15.54 C ATOM 726 O ASP A 47 2.568 -20.573 -21.466 1.00 45.44 O ATOM 727 CB ASP A 47 3.796 -19.298 -19.347 1.00 74.23 C ATOM 728 CG ASP A 47 5.064 -20.129 -19.315 1.00 44.04 C ATOM 729 OD1 ASP A 47 6.096 -19.656 -19.835 1.00 23.12 O ATOM 730 OD2 ASP A 47 5.024 -21.252 -18.770 1.00 4.43 O ATOM 0 H ASP A 47 3.659 -16.474 -20.872 1.00 4.42 H new ATOM 0 HA ASP A 47 4.586 -18.471 -21.165 1.00 44.24 H new ATOM 0 HB2 ASP A 47 3.819 -18.574 -18.533 1.00 74.23 H new ATOM 0 HB3 ASP A 47 2.936 -19.945 -19.174 1.00 74.23 H new ATOM 735 N GLY A 48 2.027 -18.652 -22.506 1.00 4.22 N ATOM 736 CA GLY A 48 1.117 -19.306 -23.428 1.00 40.34 C ATOM 737 C GLY A 48 -0.047 -19.975 -22.723 1.00 3.44 C ATOM 738 O GLY A 48 -0.564 -20.990 -23.190 1.00 3.12 O ATOM 0 H GLY A 48 2.107 -17.642 -22.627 1.00 4.22 H new ATOM 0 HA2 GLY A 48 0.734 -18.572 -24.137 1.00 40.34 H new ATOM 0 HA3 GLY A 48 1.664 -20.051 -24.005 1.00 40.34 H new ATOM 742 N GLU A 49 -0.460 -19.403 -21.597 1.00 20.43 N ATOM 743 CA GLU A 49 -1.571 -19.951 -20.825 1.00 73.11 C ATOM 744 C GLU A 49 -2.395 -18.834 -20.192 1.00 60.11 C ATOM 745 O GLU A 49 -1.922 -18.129 -19.301 1.00 43.24 O ATOM 746 CB GLU A 49 -1.049 -20.895 -19.740 1.00 30.23 C ATOM 747 CG GLU A 49 -2.148 -21.498 -18.877 1.00 62.20 C ATOM 748 CD GLU A 49 -2.132 -23.014 -18.883 1.00 13.51 C ATOM 749 OE1 GLU A 49 -2.019 -23.603 -19.979 1.00 43.20 O ATOM 750 OE2 GLU A 49 -2.231 -23.614 -17.791 1.00 64.13 O ATOM 0 H GLU A 49 -0.043 -18.562 -21.199 1.00 20.43 H new ATOM 0 HA GLU A 49 -2.213 -20.511 -21.505 1.00 73.11 H new ATOM 0 HB2 GLU A 49 -0.485 -21.700 -20.211 1.00 30.23 H new ATOM 0 HB3 GLU A 49 -0.354 -20.351 -19.101 1.00 30.23 H new ATOM 0 HG2 GLU A 49 -2.037 -21.142 -17.853 1.00 62.20 H new ATOM 0 HG3 GLU A 49 -3.117 -21.148 -19.233 1.00 62.20 H new ATOM 757 N THR A 50 -3.629 -18.678 -20.659 1.00 42.31 N ATOM 758 CA THR A 50 -4.521 -17.648 -20.137 1.00 21.11 C ATOM 759 C THR A 50 -4.809 -17.880 -18.658 1.00 43.45 C ATOM 760 O THR A 50 -5.259 -18.957 -18.265 1.00 42.41 O ATOM 761 CB THR A 50 -5.829 -17.627 -20.929 1.00 4.31 C ATOM 762 OG1 THR A 50 -5.578 -17.406 -22.305 1.00 32.51 O ATOM 763 CG2 THR A 50 -6.797 -16.561 -20.461 1.00 44.22 C ATOM 0 H THR A 50 -4.035 -19.252 -21.398 1.00 42.31 H new ATOM 0 HA THR A 50 -4.026 -16.683 -20.245 1.00 21.11 H new ATOM 0 HB THR A 50 -6.283 -18.604 -20.762 1.00 4.31 H new ATOM 0 HG1 THR A 50 -6.427 -17.398 -22.795 1.00 32.51 H new ATOM 0 HG21 THR A 50 -7.703 -16.602 -21.065 1.00 44.22 H new ATOM 0 HG22 THR A 50 -7.050 -16.733 -19.415 1.00 44.22 H new ATOM 0 HG23 THR A 50 -6.335 -15.579 -20.565 1.00 44.22 H new ATOM 771 N CYS A 51 -4.548 -16.865 -17.841 1.00 12.43 N ATOM 772 CA CYS A 51 -4.779 -16.962 -16.405 1.00 72.04 C ATOM 773 C CYS A 51 -5.205 -15.614 -15.830 1.00 71.12 C ATOM 774 O CYS A 51 -4.834 -14.561 -16.349 1.00 54.41 O ATOM 775 CB CYS A 51 -3.518 -17.457 -15.696 1.00 32.42 C ATOM 776 SG CYS A 51 -2.968 -19.096 -16.227 1.00 51.20 S ATOM 0 H CYS A 51 -4.177 -15.966 -18.149 1.00 12.43 H new ATOM 0 HA CYS A 51 -5.584 -17.678 -16.240 1.00 72.04 H new ATOM 0 HB2 CYS A 51 -2.713 -16.742 -15.868 1.00 32.42 H new ATOM 0 HB3 CYS A 51 -3.702 -17.478 -14.622 1.00 32.42 H new ATOM 0 HG CYS A 51 -3.812 -19.579 -17.090 1.00 51.20 H new ATOM 782 N LEU A 52 -5.985 -15.656 -14.756 1.00 42.51 N ATOM 783 CA LEU A 52 -6.464 -14.440 -14.108 1.00 32.43 C ATOM 784 C LEU A 52 -5.433 -13.913 -13.113 1.00 11.33 C ATOM 785 O LEU A 52 -4.730 -14.687 -12.464 1.00 1.31 O ATOM 786 CB LEU A 52 -7.794 -14.707 -13.398 1.00 2.44 C ATOM 787 CG LEU A 52 -8.978 -13.873 -13.895 1.00 64.55 C ATOM 788 CD1 LEU A 52 -8.863 -12.438 -13.406 1.00 13.44 C ATOM 789 CD2 LEU A 52 -9.064 -13.916 -15.413 1.00 21.23 C ATOM 0 H LEU A 52 -6.300 -16.520 -14.315 1.00 42.51 H new ATOM 0 HA LEU A 52 -6.618 -13.682 -14.876 1.00 32.43 H new ATOM 0 HB2 LEU A 52 -8.042 -15.763 -13.510 1.00 2.44 H new ATOM 0 HB3 LEU A 52 -7.662 -14.522 -12.332 1.00 2.44 H new ATOM 0 HG LEU A 52 -9.894 -14.302 -13.488 1.00 64.55 H new ATOM 0 HD11 LEU A 52 -9.713 -11.861 -13.769 1.00 13.44 H new ATOM 0 HD12 LEU A 52 -8.854 -12.425 -12.316 1.00 13.44 H new ATOM 0 HD13 LEU A 52 -7.939 -11.999 -13.782 1.00 13.44 H new ATOM 0 HD21 LEU A 52 -9.912 -13.317 -15.747 1.00 21.23 H new ATOM 0 HD22 LEU A 52 -8.145 -13.515 -15.841 1.00 21.23 H new ATOM 0 HD23 LEU A 52 -9.197 -14.947 -15.741 1.00 21.23 H new ATOM 801 N LEU A 53 -5.347 -12.591 -13.000 1.00 61.41 N ATOM 802 CA LEU A 53 -4.402 -11.961 -12.084 1.00 31.23 C ATOM 803 C LEU A 53 -5.134 -11.172 -11.003 1.00 22.13 C ATOM 804 O LEU A 53 -5.507 -10.017 -11.209 1.00 30.10 O ATOM 805 CB LEU A 53 -3.454 -11.036 -12.852 1.00 14.43 C ATOM 806 CG LEU A 53 -2.540 -11.736 -13.859 1.00 44.13 C ATOM 807 CD1 LEU A 53 -1.577 -10.741 -14.487 1.00 62.11 C ATOM 808 CD2 LEU A 53 -1.777 -12.869 -13.189 1.00 31.45 C ATOM 0 H LEU A 53 -5.920 -11.935 -13.531 1.00 61.41 H new ATOM 0 HA LEU A 53 -3.821 -12.749 -11.604 1.00 31.23 H new ATOM 0 HB2 LEU A 53 -4.048 -10.290 -13.381 1.00 14.43 H new ATOM 0 HB3 LEU A 53 -2.834 -10.499 -12.134 1.00 14.43 H new ATOM 0 HG LEU A 53 -3.159 -12.160 -14.650 1.00 44.13 H new ATOM 0 HD11 LEU A 53 -0.935 -11.257 -15.201 1.00 62.11 H new ATOM 0 HD12 LEU A 53 -2.142 -9.964 -15.003 1.00 62.11 H new ATOM 0 HD13 LEU A 53 -0.963 -10.288 -13.709 1.00 62.11 H new ATOM 0 HD21 LEU A 53 -1.132 -13.356 -13.920 1.00 31.45 H new ATOM 0 HD22 LEU A 53 -1.169 -12.468 -12.378 1.00 31.45 H new ATOM 0 HD23 LEU A 53 -2.483 -13.596 -12.788 1.00 31.45 H new ATOM 820 N ASP A 54 -5.336 -11.803 -9.852 1.00 74.12 N ATOM 821 CA ASP A 54 -6.023 -11.161 -8.738 1.00 71.12 C ATOM 822 C ASP A 54 -5.035 -10.411 -7.849 1.00 41.23 C ATOM 823 O ASP A 54 -4.424 -10.995 -6.954 1.00 3.52 O ATOM 824 CB ASP A 54 -6.783 -12.200 -7.911 1.00 62.44 C ATOM 825 CG ASP A 54 -8.135 -11.695 -7.450 1.00 2.10 C ATOM 826 OD1 ASP A 54 -8.179 -10.642 -6.779 1.00 14.22 O ATOM 827 OD2 ASP A 54 -9.152 -12.351 -7.759 1.00 4.14 O ATOM 0 H ASP A 54 -5.034 -12.759 -9.666 1.00 74.12 H new ATOM 0 HA ASP A 54 -6.734 -10.443 -9.148 1.00 71.12 H new ATOM 0 HB2 ASP A 54 -6.919 -13.104 -8.505 1.00 62.44 H new ATOM 0 HB3 ASP A 54 -6.186 -12.476 -7.042 1.00 62.44 H new ATOM 832 N ILE A 55 -4.883 -9.114 -8.102 1.00 61.11 N ATOM 833 CA ILE A 55 -3.969 -8.287 -7.324 1.00 61.03 C ATOM 834 C ILE A 55 -4.682 -7.648 -6.137 1.00 21.13 C ATOM 835 O ILE A 55 -5.497 -6.741 -6.305 1.00 55.22 O ATOM 836 CB ILE A 55 -3.340 -7.176 -8.187 1.00 73.21 C ATOM 837 CG1 ILE A 55 -2.851 -7.748 -9.520 1.00 2.44 C ATOM 838 CG2 ILE A 55 -2.195 -6.509 -7.439 1.00 61.23 C ATOM 839 CD1 ILE A 55 -1.839 -8.861 -9.365 1.00 20.43 C ATOM 0 H ILE A 55 -5.381 -8.615 -8.839 1.00 61.11 H new ATOM 0 HA ILE A 55 -3.180 -8.945 -6.961 1.00 61.03 H new ATOM 0 HB ILE A 55 -4.101 -6.424 -8.394 1.00 73.21 H new ATOM 0 HG12 ILE A 55 -3.707 -8.122 -10.082 1.00 2.44 H new ATOM 0 HG13 ILE A 55 -2.409 -6.945 -10.110 1.00 2.44 H new ATOM 0 HG21 ILE A 55 -1.761 -5.727 -8.061 1.00 61.23 H new ATOM 0 HG22 ILE A 55 -2.571 -6.071 -6.514 1.00 61.23 H new ATOM 0 HG23 ILE A 55 -1.432 -7.251 -7.205 1.00 61.23 H new ATOM 0 HD11 ILE A 55 -1.537 -9.218 -10.350 1.00 20.43 H new ATOM 0 HD12 ILE A 55 -0.965 -8.487 -8.831 1.00 20.43 H new ATOM 0 HD13 ILE A 55 -2.284 -9.682 -8.802 1.00 20.43 H new ATOM 851 N LEU A 56 -4.372 -8.128 -4.937 1.00 1.13 N ATOM 852 CA LEU A 56 -4.982 -7.607 -3.722 1.00 50.34 C ATOM 853 C LEU A 56 -3.997 -6.727 -2.958 1.00 20.24 C ATOM 854 O LEU A 56 -2.932 -7.185 -2.543 1.00 22.12 O ATOM 855 CB LEU A 56 -5.457 -8.768 -2.846 1.00 42.24 C ATOM 856 CG LEU A 56 -5.711 -8.421 -1.377 1.00 45.30 C ATOM 857 CD1 LEU A 56 -7.108 -8.854 -0.960 1.00 52.21 C ATOM 858 CD2 LEU A 56 -4.659 -9.070 -0.495 1.00 12.14 C ATOM 0 H LEU A 56 -3.700 -8.879 -4.781 1.00 1.13 H new ATOM 0 HA LEU A 56 -5.840 -6.992 -3.994 1.00 50.34 H new ATOM 0 HB2 LEU A 56 -6.377 -9.169 -3.271 1.00 42.24 H new ATOM 0 HB3 LEU A 56 -4.712 -9.563 -2.890 1.00 42.24 H new ATOM 0 HG LEU A 56 -5.642 -7.340 -1.256 1.00 45.30 H new ATOM 0 HD11 LEU A 56 -7.270 -8.599 0.087 1.00 52.21 H new ATOM 0 HD12 LEU A 56 -7.847 -8.342 -1.577 1.00 52.21 H new ATOM 0 HD13 LEU A 56 -7.209 -9.931 -1.091 1.00 52.21 H new ATOM 0 HD21 LEU A 56 -4.851 -8.816 0.547 1.00 12.14 H new ATOM 0 HD22 LEU A 56 -4.699 -10.152 -0.618 1.00 12.14 H new ATOM 0 HD23 LEU A 56 -3.671 -8.709 -0.781 1.00 12.14 H new ATOM 870 N ASP A 57 -4.361 -5.462 -2.774 1.00 40.34 N ATOM 871 CA ASP A 57 -3.512 -4.518 -2.058 1.00 44.45 C ATOM 872 C ASP A 57 -3.994 -4.335 -0.623 1.00 65.23 C ATOM 873 O ASP A 57 -5.000 -3.670 -0.376 1.00 53.24 O ATOM 874 CB ASP A 57 -3.493 -3.167 -2.777 1.00 33.31 C ATOM 875 CG ASP A 57 -2.134 -2.499 -2.717 1.00 4.05 C ATOM 876 OD1 ASP A 57 -1.268 -2.836 -3.552 1.00 33.45 O ATOM 877 OD2 ASP A 57 -1.935 -1.637 -1.835 1.00 5.35 O ATOM 0 H ASP A 57 -5.239 -5.067 -3.111 1.00 40.34 H new ATOM 0 HA ASP A 57 -2.500 -4.923 -2.035 1.00 44.45 H new ATOM 0 HB2 ASP A 57 -3.779 -3.309 -3.819 1.00 33.31 H new ATOM 0 HB3 ASP A 57 -4.238 -2.510 -2.329 1.00 33.31 H new ATOM 882 N THR A 58 -3.271 -4.932 0.319 1.00 4.54 N ATOM 883 CA THR A 58 -3.626 -4.837 1.731 1.00 12.52 C ATOM 884 C THR A 58 -3.182 -3.500 2.313 1.00 10.24 C ATOM 885 O THR A 58 -2.707 -2.623 1.591 1.00 2.34 O ATOM 886 CB THR A 58 -2.990 -5.985 2.515 1.00 35.02 C ATOM 887 OG1 THR A 58 -1.620 -5.724 2.764 1.00 73.51 O ATOM 888 CG2 THR A 58 -3.081 -7.320 1.807 1.00 62.25 C ATOM 0 H THR A 58 -2.436 -5.487 0.131 1.00 4.54 H new ATOM 0 HA THR A 58 -4.711 -4.907 1.814 1.00 12.52 H new ATOM 0 HB THR A 58 -3.557 -6.047 3.444 1.00 35.02 H new ATOM 0 HG1 THR A 58 -1.071 -6.216 2.119 1.00 73.51 H new ATOM 0 HG21 THR A 58 -2.610 -8.089 2.419 1.00 62.25 H new ATOM 0 HG22 THR A 58 -4.128 -7.575 1.645 1.00 62.25 H new ATOM 0 HG23 THR A 58 -2.570 -7.258 0.846 1.00 62.25 H new ATOM 896 N ALA A 59 -3.340 -3.349 3.626 1.00 22.23 N ATOM 897 CA ALA A 59 -2.956 -2.117 4.304 1.00 21.00 C ATOM 898 C ALA A 59 -1.586 -2.244 4.950 1.00 42.21 C ATOM 899 O ALA A 59 -1.080 -3.347 5.156 1.00 31.21 O ATOM 900 CB ALA A 59 -3.984 -1.737 5.354 1.00 54.32 C ATOM 0 H ALA A 59 -3.731 -4.064 4.239 1.00 22.23 H new ATOM 0 HA ALA A 59 -2.910 -1.332 3.550 1.00 21.00 H new ATOM 0 HB1 ALA A 59 -3.677 -0.815 5.847 1.00 54.32 H new ATOM 0 HB2 ALA A 59 -4.953 -1.588 4.877 1.00 54.32 H new ATOM 0 HB3 ALA A 59 -4.062 -2.535 6.093 1.00 54.32 H new ATOM 1002 N MET A 67 -5.892 -10.577 9.957 1.00 53.43 N ATOM 1003 CA MET A 67 -6.312 -10.600 8.561 1.00 63.33 C ATOM 1004 C MET A 67 -5.120 -10.826 7.636 1.00 64.02 C ATOM 1005 O MET A 67 -5.267 -11.364 6.539 1.00 42.41 O ATOM 1006 CB MET A 67 -7.016 -9.292 8.196 1.00 2.23 C ATOM 1007 CG MET A 67 -8.507 -9.300 8.493 1.00 72.55 C ATOM 1008 SD MET A 67 -9.047 -7.831 9.391 1.00 34.25 S ATOM 1009 CE MET A 67 -9.358 -8.523 11.014 1.00 25.34 C ATOM 0 HA MET A 67 -7.010 -11.428 8.432 1.00 63.33 H new ATOM 0 HB2 MET A 67 -6.549 -8.473 8.743 1.00 2.23 H new ATOM 0 HB3 MET A 67 -6.866 -9.092 7.135 1.00 2.23 H new ATOM 0 HG2 MET A 67 -9.059 -9.371 7.556 1.00 72.55 H new ATOM 0 HG3 MET A 67 -8.752 -10.188 9.076 1.00 72.55 H new ATOM 0 HE1 MET A 67 -9.700 -7.736 11.686 1.00 25.34 H new ATOM 0 HE2 MET A 67 -10.124 -9.295 10.940 1.00 25.34 H new ATOM 0 HE3 MET A 67 -8.439 -8.960 11.405 1.00 25.34 H new ATOM 1019 N ARG A 68 -3.940 -10.411 8.087 1.00 63.54 N ATOM 1020 CA ARG A 68 -2.723 -10.569 7.299 1.00 22.41 C ATOM 1021 C ARG A 68 -2.431 -12.042 7.034 1.00 33.44 C ATOM 1022 O ARG A 68 -1.921 -12.403 5.974 1.00 35.15 O ATOM 1023 CB ARG A 68 -1.537 -9.925 8.022 1.00 63.32 C ATOM 1024 CG ARG A 68 -0.542 -9.258 7.087 1.00 35.42 C ATOM 1025 CD ARG A 68 -0.754 -7.754 7.028 1.00 75.42 C ATOM 1026 NE ARG A 68 0.131 -7.114 6.059 1.00 73.34 N ATOM 1027 CZ ARG A 68 -0.001 -7.238 4.740 1.00 44.34 C ATOM 1028 NH1 ARG A 68 -0.977 -7.979 4.230 1.00 72.43 N ATOM 1029 NH2 ARG A 68 0.847 -6.620 3.927 1.00 34.11 N ATOM 0 H ARG A 68 -3.801 -9.963 8.993 1.00 63.54 H new ATOM 0 HA ARG A 68 -2.873 -10.070 6.342 1.00 22.41 H new ATOM 0 HB2 ARG A 68 -1.912 -9.184 8.728 1.00 63.32 H new ATOM 0 HB3 ARG A 68 -1.020 -10.688 8.605 1.00 63.32 H new ATOM 0 HG2 ARG A 68 0.473 -9.470 7.423 1.00 35.42 H new ATOM 0 HG3 ARG A 68 -0.642 -9.680 6.087 1.00 35.42 H new ATOM 0 HD2 ARG A 68 -1.791 -7.544 6.766 1.00 75.42 H new ATOM 0 HD3 ARG A 68 -0.582 -7.325 8.015 1.00 75.42 H new ATOM 0 HE ARG A 68 0.895 -6.538 6.413 1.00 73.34 H new ATOM 0 HH11 ARG A 68 -1.631 -8.457 4.849 1.00 72.43 H new ATOM 0 HH12 ARG A 68 -1.073 -8.070 3.219 1.00 72.43 H new ATOM 0 HH21 ARG A 68 1.600 -6.050 4.313 1.00 34.11 H new ATOM 0 HH22 ARG A 68 0.746 -6.715 2.916 1.00 34.11 H new ATOM 1043 N ASP A 69 -2.760 -12.890 8.004 1.00 30.02 N ATOM 1044 CA ASP A 69 -2.534 -14.324 7.875 1.00 20.03 C ATOM 1045 C ASP A 69 -3.530 -14.943 6.898 1.00 61.23 C ATOM 1046 O ASP A 69 -3.227 -15.930 6.229 1.00 62.00 O ATOM 1047 CB ASP A 69 -2.647 -15.005 9.240 1.00 42.32 C ATOM 1048 CG ASP A 69 -2.359 -16.492 9.172 1.00 44.34 C ATOM 1049 OD1 ASP A 69 -1.181 -16.860 8.981 1.00 61.35 O ATOM 1050 OD2 ASP A 69 -3.312 -17.289 9.308 1.00 32.12 O ATOM 0 H ASP A 69 -3.184 -12.608 8.888 1.00 30.02 H new ATOM 0 HA ASP A 69 -1.527 -14.476 7.486 1.00 20.03 H new ATOM 0 HB2 ASP A 69 -1.952 -14.535 9.936 1.00 42.32 H new ATOM 0 HB3 ASP A 69 -3.650 -14.850 9.638 1.00 42.32 H new ATOM 1055 N GLN A 70 -4.719 -14.355 6.824 1.00 50.55 N ATOM 1056 CA GLN A 70 -5.759 -14.848 5.931 1.00 52.32 C ATOM 1057 C GLN A 70 -5.423 -14.531 4.477 1.00 14.34 C ATOM 1058 O GLN A 70 -5.382 -15.423 3.629 1.00 44.13 O ATOM 1059 CB GLN A 70 -7.111 -14.231 6.301 1.00 31.52 C ATOM 1060 CG GLN A 70 -8.239 -15.247 6.403 1.00 33.12 C ATOM 1061 CD GLN A 70 -8.320 -16.153 5.190 1.00 0.40 C ATOM 1062 OE1 GLN A 70 -8.825 -15.757 4.139 1.00 70.11 O ATOM 1063 NE2 GLN A 70 -7.823 -17.375 5.330 1.00 41.44 N ATOM 0 H GLN A 70 -4.986 -13.537 7.372 1.00 50.55 H new ATOM 0 HA GLN A 70 -5.818 -15.931 6.043 1.00 52.32 H new ATOM 0 HB2 GLN A 70 -7.015 -13.711 7.254 1.00 31.52 H new ATOM 0 HB3 GLN A 70 -7.375 -13.482 5.555 1.00 31.52 H new ATOM 0 HG2 GLN A 70 -8.096 -15.855 7.297 1.00 33.12 H new ATOM 0 HG3 GLN A 70 -9.186 -14.722 6.523 1.00 33.12 H new ATOM 0 HE21 GLN A 70 -7.414 -17.660 6.220 1.00 41.44 H new ATOM 0 HE22 GLN A 70 -7.850 -18.029 4.548 1.00 41.44 H new ATOM 1072 N TYR A 71 -5.183 -13.255 4.196 1.00 74.31 N ATOM 1073 CA TYR A 71 -4.850 -12.816 2.846 1.00 32.50 C ATOM 1074 C TYR A 71 -3.530 -13.425 2.382 1.00 42.13 C ATOM 1075 O TYR A 71 -3.377 -13.783 1.215 1.00 40.44 O ATOM 1076 CB TYR A 71 -4.770 -11.290 2.792 1.00 52.21 C ATOM 1077 CG TYR A 71 -5.994 -10.598 3.347 1.00 53.41 C ATOM 1078 CD1 TYR A 71 -7.269 -11.090 3.095 1.00 1.01 C ATOM 1079 CD2 TYR A 71 -5.876 -9.452 4.123 1.00 25.11 C ATOM 1080 CE1 TYR A 71 -8.390 -10.458 3.599 1.00 51.41 C ATOM 1081 CE2 TYR A 71 -6.991 -8.815 4.630 1.00 11.24 C ATOM 1082 CZ TYR A 71 -8.246 -9.322 4.367 1.00 74.44 C ATOM 1083 OH TYR A 71 -9.360 -8.690 4.870 1.00 30.43 O ATOM 0 H TYR A 71 -5.213 -12.505 4.887 1.00 74.31 H new ATOM 0 HA TYR A 71 -5.638 -13.157 2.175 1.00 32.50 H new ATOM 0 HB2 TYR A 71 -3.893 -10.961 3.350 1.00 52.21 H new ATOM 0 HB3 TYR A 71 -4.625 -10.979 1.757 1.00 52.21 H new ATOM 0 HD1 TYR A 71 -7.386 -11.981 2.496 1.00 1.01 H new ATOM 0 HD2 TYR A 71 -4.895 -9.052 4.333 1.00 25.11 H new ATOM 0 HE1 TYR A 71 -9.374 -10.852 3.392 1.00 51.41 H new ATOM 0 HE2 TYR A 71 -6.881 -7.924 5.230 1.00 11.24 H new ATOM 0 HH TYR A 71 -9.085 -7.906 5.390 1.00 30.43 H new ATOM 1093 N MET A 72 -2.580 -13.537 3.304 1.00 3.23 N ATOM 1094 CA MET A 72 -1.272 -14.102 2.989 1.00 1.12 C ATOM 1095 C MET A 72 -1.377 -15.597 2.704 1.00 64.01 C ATOM 1096 O MET A 72 -0.704 -16.118 1.815 1.00 71.14 O ATOM 1097 CB MET A 72 -0.297 -13.858 4.142 1.00 30.32 C ATOM 1098 CG MET A 72 0.197 -12.424 4.230 1.00 23.12 C ATOM 1099 SD MET A 72 1.141 -12.105 5.733 1.00 44.22 S ATOM 1100 CE MET A 72 2.451 -11.062 5.094 1.00 11.04 C ATOM 0 H MET A 72 -2.691 -13.244 4.275 1.00 3.23 H new ATOM 0 HA MET A 72 -0.897 -13.606 2.094 1.00 1.12 H new ATOM 0 HB2 MET A 72 -0.784 -14.124 5.080 1.00 30.32 H new ATOM 0 HB3 MET A 72 0.560 -14.522 4.028 1.00 30.32 H new ATOM 0 HG2 MET A 72 0.818 -12.204 3.362 1.00 23.12 H new ATOM 0 HG3 MET A 72 -0.656 -11.747 4.191 1.00 23.12 H new ATOM 0 HE1 MET A 72 3.121 -10.780 5.907 1.00 11.04 H new ATOM 0 HE2 MET A 72 3.012 -11.606 4.334 1.00 11.04 H new ATOM 0 HE3 MET A 72 2.019 -10.164 4.652 1.00 11.04 H new ATOM 1110 N ARG A 73 -2.223 -16.281 3.468 1.00 51.54 N ATOM 1111 CA ARG A 73 -2.414 -17.717 3.300 1.00 73.43 C ATOM 1112 C ARG A 73 -3.202 -18.028 2.027 1.00 51.54 C ATOM 1113 O ARG A 73 -3.251 -19.176 1.585 1.00 21.24 O ATOM 1114 CB ARG A 73 -3.139 -18.299 4.514 1.00 2.42 C ATOM 1115 CG ARG A 73 -2.211 -18.633 5.671 1.00 4.52 C ATOM 1116 CD ARG A 73 -2.992 -18.944 6.936 1.00 12.42 C ATOM 1117 NE ARG A 73 -3.778 -20.169 6.808 1.00 13.43 N ATOM 1118 CZ ARG A 73 -4.802 -20.478 7.600 1.00 0.53 C ATOM 1119 NH1 ARG A 73 -5.165 -19.659 8.579 1.00 64.32 N ATOM 1120 NH2 ARG A 73 -5.466 -21.611 7.413 1.00 70.33 N ATOM 0 H ARG A 73 -2.787 -15.864 4.209 1.00 51.54 H new ATOM 0 HA ARG A 73 -1.429 -18.176 3.212 1.00 73.43 H new ATOM 0 HB2 ARG A 73 -3.890 -17.586 4.855 1.00 2.42 H new ATOM 0 HB3 ARG A 73 -3.670 -19.202 4.212 1.00 2.42 H new ATOM 0 HG2 ARG A 73 -1.590 -19.488 5.406 1.00 4.52 H new ATOM 0 HG3 ARG A 73 -1.538 -17.795 5.854 1.00 4.52 H new ATOM 0 HD2 ARG A 73 -2.301 -19.043 7.773 1.00 12.42 H new ATOM 0 HD3 ARG A 73 -3.655 -18.110 7.167 1.00 12.42 H new ATOM 0 HE ARG A 73 -3.527 -20.826 6.069 1.00 13.43 H new ATOM 0 HH11 ARG A 73 -4.658 -18.786 8.728 1.00 64.32 H new ATOM 0 HH12 ARG A 73 -5.951 -19.902 9.182 1.00 64.32 H new ATOM 0 HH21 ARG A 73 -5.192 -22.245 6.662 1.00 70.33 H new ATOM 0 HH22 ARG A 73 -6.251 -21.848 8.020 1.00 70.33 H new ATOM 1134 N THR A 74 -3.819 -17.004 1.445 1.00 63.32 N ATOM 1135 CA THR A 74 -4.603 -17.177 0.228 1.00 54.33 C ATOM 1136 C THR A 74 -3.830 -16.710 -1.003 1.00 1.33 C ATOM 1137 O THR A 74 -4.193 -17.036 -2.133 1.00 40.21 O ATOM 1138 CB THR A 74 -5.919 -16.408 0.336 1.00 25.23 C ATOM 1139 OG1 THR A 74 -5.680 -15.020 0.481 1.00 52.41 O ATOM 1140 CG2 THR A 74 -6.776 -16.851 1.503 1.00 2.12 C ATOM 0 H THR A 74 -3.791 -16.047 1.797 1.00 63.32 H new ATOM 0 HA THR A 74 -4.813 -18.241 0.114 1.00 54.33 H new ATOM 0 HB THR A 74 -6.454 -16.621 -0.589 1.00 25.23 H new ATOM 0 HG1 THR A 74 -4.727 -14.868 0.649 1.00 52.41 H new ATOM 0 HG21 THR A 74 -7.695 -16.266 1.522 1.00 2.12 H new ATOM 0 HG22 THR A 74 -7.021 -17.908 1.394 1.00 2.12 H new ATOM 0 HG23 THR A 74 -6.230 -16.699 2.434 1.00 2.12 H new ATOM 1148 N GLY A 75 -2.765 -15.944 -0.782 1.00 32.13 N ATOM 1149 CA GLY A 75 -1.969 -15.450 -1.887 1.00 3.30 C ATOM 1150 C GLY A 75 -0.933 -16.451 -2.356 1.00 21.12 C ATOM 1151 O GLY A 75 -0.113 -16.923 -1.566 1.00 61.11 O ATOM 0 H GLY A 75 -2.441 -15.658 0.142 1.00 32.13 H new ATOM 0 HA2 GLY A 75 -2.627 -15.198 -2.719 1.00 3.30 H new ATOM 0 HA3 GLY A 75 -1.469 -14.530 -1.586 1.00 3.30 H new ATOM 1155 N GLU A 76 -0.966 -16.773 -3.645 1.00 42.41 N ATOM 1156 CA GLU A 76 -0.019 -17.723 -4.219 1.00 1.23 C ATOM 1157 C GLU A 76 1.357 -17.084 -4.395 1.00 40.12 C ATOM 1158 O GLU A 76 2.363 -17.783 -4.522 1.00 33.14 O ATOM 1159 CB GLU A 76 -0.533 -18.233 -5.567 1.00 1.42 C ATOM 1160 CG GLU A 76 -1.934 -18.820 -5.502 1.00 65.35 C ATOM 1161 CD GLU A 76 -2.032 -20.172 -6.181 1.00 10.24 C ATOM 1162 OE1 GLU A 76 -1.607 -20.281 -7.351 1.00 33.22 O ATOM 1163 OE2 GLU A 76 -2.535 -21.122 -5.544 1.00 4.34 O ATOM 0 H GLU A 76 -1.637 -16.391 -4.311 1.00 42.41 H new ATOM 0 HA GLU A 76 0.077 -18.563 -3.531 1.00 1.23 H new ATOM 0 HB2 GLU A 76 -0.525 -17.412 -6.284 1.00 1.42 H new ATOM 0 HB3 GLU A 76 0.153 -18.992 -5.944 1.00 1.42 H new ATOM 0 HG2 GLU A 76 -2.234 -18.919 -4.459 1.00 65.35 H new ATOM 0 HG3 GLU A 76 -2.635 -18.130 -5.972 1.00 65.35 H new ATOM 1170 N GLY A 77 1.395 -15.754 -4.399 1.00 25.52 N ATOM 1171 CA GLY A 77 2.651 -15.046 -4.559 1.00 64.42 C ATOM 1172 C GLY A 77 2.670 -13.731 -3.803 1.00 31.35 C ATOM 1173 O GLY A 77 1.628 -13.105 -3.611 1.00 13.30 O ATOM 0 H GLY A 77 0.577 -15.154 -4.294 1.00 25.52 H new ATOM 0 HA2 GLY A 77 3.468 -15.676 -4.208 1.00 64.42 H new ATOM 0 HA3 GLY A 77 2.827 -14.857 -5.618 1.00 64.42 H new ATOM 1177 N PHE A 78 3.856 -13.313 -3.369 1.00 33.43 N ATOM 1178 CA PHE A 78 3.999 -12.064 -2.628 1.00 62.44 C ATOM 1179 C PHE A 78 4.905 -11.087 -3.369 1.00 13.52 C ATOM 1180 O PHE A 78 5.966 -11.463 -3.866 1.00 35.55 O ATOM 1181 CB PHE A 78 4.557 -12.337 -1.231 1.00 62.13 C ATOM 1182 CG PHE A 78 3.563 -12.979 -0.305 1.00 11.53 C ATOM 1183 CD1 PHE A 78 2.320 -12.403 -0.096 1.00 64.24 C ATOM 1184 CD2 PHE A 78 3.872 -14.156 0.358 1.00 24.34 C ATOM 1185 CE1 PHE A 78 1.402 -12.989 0.754 1.00 62.21 C ATOM 1186 CE2 PHE A 78 2.958 -14.747 1.210 1.00 2.31 C ATOM 1187 CZ PHE A 78 1.722 -14.163 1.409 1.00 54.41 C ATOM 0 H PHE A 78 4.729 -13.819 -3.517 1.00 33.43 H new ATOM 0 HA PHE A 78 3.011 -11.612 -2.536 1.00 62.44 H new ATOM 0 HB2 PHE A 78 5.431 -12.982 -1.317 1.00 62.13 H new ATOM 0 HB3 PHE A 78 4.896 -11.398 -0.793 1.00 62.13 H new ATOM 0 HD1 PHE A 78 2.066 -11.484 -0.604 1.00 64.24 H new ATOM 0 HD2 PHE A 78 4.837 -14.616 0.207 1.00 24.34 H new ATOM 0 HE1 PHE A 78 0.436 -12.530 0.906 1.00 62.21 H new ATOM 0 HE2 PHE A 78 3.210 -15.665 1.720 1.00 2.31 H new ATOM 0 HZ PHE A 78 1.007 -14.623 2.075 1.00 54.41 H new ATOM 1197 N LEU A 79 4.480 -9.829 -3.437 1.00 33.21 N ATOM 1198 CA LEU A 79 5.251 -8.794 -4.116 1.00 75.21 C ATOM 1199 C LEU A 79 5.668 -7.698 -3.139 1.00 11.45 C ATOM 1200 O LEU A 79 4.825 -7.049 -2.523 1.00 22.42 O ATOM 1201 CB LEU A 79 4.433 -8.189 -5.260 1.00 14.11 C ATOM 1202 CG LEU A 79 5.208 -7.958 -6.559 1.00 71.44 C ATOM 1203 CD1 LEU A 79 5.013 -9.130 -7.509 1.00 63.14 C ATOM 1204 CD2 LEU A 79 4.772 -6.658 -7.217 1.00 14.10 C ATOM 0 H LEU A 79 3.604 -9.502 -3.029 1.00 33.21 H new ATOM 0 HA LEU A 79 6.151 -9.254 -4.524 1.00 75.21 H new ATOM 0 HB2 LEU A 79 3.589 -8.846 -5.470 1.00 14.11 H new ATOM 0 HB3 LEU A 79 4.020 -7.237 -4.927 1.00 14.11 H new ATOM 0 HG LEU A 79 6.269 -7.881 -6.319 1.00 71.44 H new ATOM 0 HD11 LEU A 79 5.571 -8.950 -8.428 1.00 63.14 H new ATOM 0 HD12 LEU A 79 5.375 -10.044 -7.038 1.00 63.14 H new ATOM 0 HD13 LEU A 79 3.954 -9.237 -7.742 1.00 63.14 H new ATOM 0 HD21 LEU A 79 5.334 -6.511 -8.139 1.00 14.10 H new ATOM 0 HD22 LEU A 79 3.707 -6.705 -7.444 1.00 14.10 H new ATOM 0 HD23 LEU A 79 4.962 -5.826 -6.539 1.00 14.10 H new ATOM 1216 N CYS A 80 6.976 -7.498 -3.004 1.00 14.33 N ATOM 1217 CA CYS A 80 7.502 -6.478 -2.102 1.00 0.32 C ATOM 1218 C CYS A 80 7.820 -5.193 -2.859 1.00 23.03 C ATOM 1219 O CYS A 80 8.830 -5.106 -3.559 1.00 54.13 O ATOM 1220 CB CYS A 80 8.757 -6.990 -1.393 1.00 72.21 C ATOM 1221 SG CYS A 80 8.423 -7.904 0.130 1.00 62.51 S ATOM 0 H CYS A 80 7.689 -8.027 -3.506 1.00 14.33 H new ATOM 0 HA CYS A 80 6.737 -6.260 -1.357 1.00 0.32 H new ATOM 0 HB2 CYS A 80 9.310 -7.634 -2.077 1.00 72.21 H new ATOM 0 HB3 CYS A 80 9.402 -6.142 -1.161 1.00 72.21 H new ATOM 0 HG CYS A 80 9.545 -8.298 0.655 1.00 62.51 H new ATOM 1227 N VAL A 81 6.954 -4.195 -2.714 1.00 34.34 N ATOM 1228 CA VAL A 81 7.144 -2.914 -3.382 1.00 71.14 C ATOM 1229 C VAL A 81 7.686 -1.865 -2.418 1.00 64.52 C ATOM 1230 O VAL A 81 6.971 -1.389 -1.536 1.00 50.31 O ATOM 1231 CB VAL A 81 5.826 -2.401 -3.998 1.00 2.22 C ATOM 1232 CG1 VAL A 81 6.056 -1.104 -4.760 1.00 14.43 C ATOM 1233 CG2 VAL A 81 5.215 -3.458 -4.904 1.00 1.43 C ATOM 0 H VAL A 81 6.113 -4.250 -2.139 1.00 34.34 H new ATOM 0 HA VAL A 81 7.869 -3.077 -4.179 1.00 71.14 H new ATOM 0 HB VAL A 81 5.125 -2.197 -3.188 1.00 2.22 H new ATOM 0 HG11 VAL A 81 5.113 -0.760 -5.186 1.00 14.43 H new ATOM 0 HG12 VAL A 81 6.444 -0.346 -4.080 1.00 14.43 H new ATOM 0 HG13 VAL A 81 6.775 -1.275 -5.561 1.00 14.43 H new ATOM 0 HG21 VAL A 81 4.286 -3.079 -5.330 1.00 1.43 H new ATOM 0 HG22 VAL A 81 5.912 -3.696 -5.707 1.00 1.43 H new ATOM 0 HG23 VAL A 81 5.008 -4.358 -4.325 1.00 1.43 H new ATOM 1243 N PHE A 82 8.954 -1.506 -2.593 1.00 62.50 N ATOM 1244 CA PHE A 82 9.592 -0.510 -1.740 1.00 45.44 C ATOM 1245 C PHE A 82 10.059 0.689 -2.565 1.00 33.43 C ATOM 1246 O PHE A 82 10.340 0.563 -3.757 1.00 62.34 O ATOM 1247 CB PHE A 82 10.770 -1.136 -0.980 1.00 43.22 C ATOM 1248 CG PHE A 82 12.098 -1.002 -1.676 1.00 23.14 C ATOM 1249 CD1 PHE A 82 12.318 -1.608 -2.902 1.00 75.01 C ATOM 1250 CD2 PHE A 82 13.122 -0.266 -1.103 1.00 24.34 C ATOM 1251 CE1 PHE A 82 13.536 -1.484 -3.544 1.00 73.04 C ATOM 1252 CE2 PHE A 82 14.342 -0.137 -1.739 1.00 42.24 C ATOM 1253 CZ PHE A 82 14.550 -0.747 -2.961 1.00 54.15 C ATOM 0 H PHE A 82 9.560 -1.890 -3.318 1.00 62.50 H new ATOM 0 HA PHE A 82 8.860 -0.157 -1.014 1.00 45.44 H new ATOM 0 HB2 PHE A 82 10.840 -0.672 0.004 1.00 43.22 H new ATOM 0 HB3 PHE A 82 10.562 -2.194 -0.819 1.00 43.22 H new ATOM 0 HD1 PHE A 82 11.529 -2.184 -3.362 1.00 75.01 H new ATOM 0 HD2 PHE A 82 12.965 0.213 -0.148 1.00 24.34 H new ATOM 0 HE1 PHE A 82 13.695 -1.962 -4.499 1.00 73.04 H new ATOM 0 HE2 PHE A 82 15.132 0.440 -1.281 1.00 42.24 H new ATOM 0 HZ PHE A 82 15.503 -0.648 -3.460 1.00 54.15 H new ATOM 1263 N ALA A 83 10.142 1.847 -1.922 1.00 32.21 N ATOM 1264 CA ALA A 83 10.576 3.064 -2.598 1.00 44.11 C ATOM 1265 C ALA A 83 12.069 3.301 -2.392 1.00 53.31 C ATOM 1266 O ALA A 83 12.545 3.376 -1.259 1.00 63.02 O ATOM 1267 CB ALA A 83 9.777 4.257 -2.099 1.00 33.05 C ATOM 0 H ALA A 83 9.915 1.970 -0.935 1.00 32.21 H new ATOM 0 HA ALA A 83 10.397 2.942 -3.666 1.00 44.11 H new ATOM 0 HB1 ALA A 83 10.111 5.159 -2.612 1.00 33.05 H new ATOM 0 HB2 ALA A 83 8.718 4.096 -2.301 1.00 33.05 H new ATOM 0 HB3 ALA A 83 9.928 4.373 -1.026 1.00 33.05 H new ATOM 1273 N ILE A 84 12.804 3.419 -3.494 1.00 24.15 N ATOM 1274 CA ILE A 84 14.242 3.651 -3.430 1.00 62.30 C ATOM 1275 C ILE A 84 14.560 4.957 -2.709 1.00 4.10 C ATOM 1276 O ILE A 84 15.667 5.145 -2.206 1.00 30.02 O ATOM 1277 CB ILE A 84 14.871 3.688 -4.837 1.00 4.03 C ATOM 1278 CG1 ILE A 84 14.075 4.619 -5.752 1.00 44.35 C ATOM 1279 CG2 ILE A 84 14.935 2.286 -5.425 1.00 71.40 C ATOM 1280 CD1 ILE A 84 14.940 5.396 -6.722 1.00 14.50 C ATOM 0 H ILE A 84 12.428 3.358 -4.440 1.00 24.15 H new ATOM 0 HA ILE A 84 14.669 2.818 -2.871 1.00 62.30 H new ATOM 0 HB ILE A 84 15.887 4.074 -4.754 1.00 4.03 H new ATOM 0 HG12 ILE A 84 13.350 4.030 -6.315 1.00 44.35 H new ATOM 0 HG13 ILE A 84 13.509 5.321 -5.140 1.00 44.35 H new ATOM 0 HG21 ILE A 84 15.381 2.328 -6.419 1.00 71.40 H new ATOM 0 HG22 ILE A 84 15.542 1.649 -4.781 1.00 71.40 H new ATOM 0 HG23 ILE A 84 13.928 1.875 -5.497 1.00 71.40 H new ATOM 0 HD11 ILE A 84 14.310 6.036 -7.340 1.00 14.50 H new ATOM 0 HD12 ILE A 84 15.647 6.011 -6.166 1.00 14.50 H new ATOM 0 HD13 ILE A 84 15.486 4.701 -7.359 1.00 14.50 H new ATOM 1292 N ASN A 85 13.582 5.857 -2.661 1.00 11.12 N ATOM 1293 CA ASN A 85 13.760 7.145 -2.000 1.00 10.21 C ATOM 1294 C ASN A 85 13.474 7.033 -0.505 1.00 71.25 C ATOM 1295 O ASN A 85 13.974 7.827 0.293 1.00 45.24 O ATOM 1296 CB ASN A 85 12.847 8.201 -2.631 1.00 1.13 C ATOM 1297 CG ASN A 85 12.783 8.087 -4.142 1.00 54.34 C ATOM 1298 OD1 ASN A 85 11.722 8.253 -4.745 1.00 13.42 O ATOM 1299 ND2 ASN A 85 13.922 7.802 -4.763 1.00 20.11 N ATOM 0 H ASN A 85 12.659 5.718 -3.072 1.00 11.12 H new ATOM 0 HA ASN A 85 14.798 7.451 -2.131 1.00 10.21 H new ATOM 0 HB2 ASN A 85 11.843 8.101 -2.220 1.00 1.13 H new ATOM 0 HB3 ASN A 85 13.205 9.194 -2.360 1.00 1.13 H new ATOM 0 HD21 ASN A 85 13.940 7.713 -5.779 1.00 20.11 H new ATOM 0 HD22 ASN A 85 14.778 7.672 -4.224 1.00 20.11 H new ATOM 1306 N ASN A 86 12.665 6.046 -0.131 1.00 53.32 N ATOM 1307 CA ASN A 86 12.312 5.833 1.267 1.00 31.21 C ATOM 1308 C ASN A 86 13.023 4.604 1.827 1.00 53.45 C ATOM 1309 O ASN A 86 12.582 3.473 1.621 1.00 35.51 O ATOM 1310 CB ASN A 86 10.796 5.676 1.413 1.00 13.14 C ATOM 1311 CG ASN A 86 10.199 6.692 2.367 1.00 2.22 C ATOM 1312 OD1 ASN A 86 10.491 7.885 2.285 1.00 71.11 O ATOM 1313 ND2 ASN A 86 9.357 6.223 3.280 1.00 23.32 N ATOM 0 H ASN A 86 12.242 5.381 -0.778 1.00 53.32 H new ATOM 0 HA ASN A 86 12.635 6.705 1.836 1.00 31.21 H new ATOM 0 HB2 ASN A 86 10.327 5.781 0.435 1.00 13.14 H new ATOM 0 HB3 ASN A 86 10.570 4.671 1.769 1.00 13.14 H new ATOM 0 HD21 ASN A 86 8.924 6.859 3.949 1.00 23.32 H new ATOM 0 HD22 ASN A 86 9.143 5.226 3.312 1.00 23.32 H new ATOM 1320 N THR A 87 14.121 4.833 2.540 1.00 44.32 N ATOM 1321 CA THR A 87 14.889 3.744 3.132 1.00 42.03 C ATOM 1322 C THR A 87 14.056 2.987 4.162 1.00 21.52 C ATOM 1323 O THR A 87 14.288 1.803 4.413 1.00 33.21 O ATOM 1324 CB THR A 87 16.161 4.286 3.786 1.00 70.12 C ATOM 1325 OG1 THR A 87 16.811 5.208 2.930 1.00 25.34 O ATOM 1326 CG2 THR A 87 17.160 3.205 4.139 1.00 0.34 C ATOM 0 H THR A 87 14.499 5.763 2.722 1.00 44.32 H new ATOM 0 HA THR A 87 15.164 3.052 2.336 1.00 42.03 H new ATOM 0 HB THR A 87 15.830 4.767 4.706 1.00 70.12 H new ATOM 0 HG1 THR A 87 17.621 5.545 3.367 1.00 25.34 H new ATOM 0 HG21 THR A 87 18.038 3.658 4.599 1.00 0.34 H new ATOM 0 HG22 THR A 87 16.705 2.503 4.838 1.00 0.34 H new ATOM 0 HG23 THR A 87 17.457 2.674 3.234 1.00 0.34 H new ATOM 1334 N LYS A 88 13.086 3.676 4.756 1.00 72.35 N ATOM 1335 CA LYS A 88 12.216 3.069 5.759 1.00 2.30 C ATOM 1336 C LYS A 88 11.557 1.804 5.218 1.00 1.12 C ATOM 1337 O LYS A 88 11.481 0.787 5.908 1.00 5.33 O ATOM 1338 CB LYS A 88 11.142 4.065 6.200 1.00 51.03 C ATOM 1339 CG LYS A 88 11.623 5.050 7.252 1.00 51.13 C ATOM 1340 CD LYS A 88 10.458 5.695 7.985 1.00 3.34 C ATOM 1341 CE LYS A 88 10.761 5.880 9.462 1.00 4.04 C ATOM 1342 NZ LYS A 88 10.158 7.131 10.001 1.00 44.25 N ATOM 0 H LYS A 88 12.882 4.656 4.560 1.00 72.35 H new ATOM 0 HA LYS A 88 12.830 2.798 6.618 1.00 2.30 H new ATOM 0 HB2 LYS A 88 10.792 4.619 5.329 1.00 51.03 H new ATOM 0 HB3 LYS A 88 10.287 3.515 6.593 1.00 51.03 H new ATOM 0 HG2 LYS A 88 12.264 4.535 7.967 1.00 51.13 H new ATOM 0 HG3 LYS A 88 12.229 5.823 6.779 1.00 51.13 H new ATOM 0 HD2 LYS A 88 10.235 6.662 7.535 1.00 3.34 H new ATOM 0 HD3 LYS A 88 9.568 5.077 7.870 1.00 3.34 H new ATOM 0 HE2 LYS A 88 10.381 5.024 10.020 1.00 4.04 H new ATOM 0 HE3 LYS A 88 11.841 5.904 9.611 1.00 4.04 H new ATOM 0 HZ1 LYS A 88 10.388 7.220 11.011 1.00 44.25 H new ATOM 0 HZ2 LYS A 88 10.539 7.950 9.486 1.00 44.25 H new ATOM 0 HZ3 LYS A 88 9.125 7.098 9.883 1.00 44.25 H new ATOM 1356 N SER A 89 11.082 1.877 3.980 1.00 75.31 N ATOM 1357 CA SER A 89 10.428 0.739 3.342 1.00 24.42 C ATOM 1358 C SER A 89 11.333 -0.488 3.353 1.00 44.35 C ATOM 1359 O SER A 89 10.900 -1.588 3.697 1.00 13.34 O ATOM 1360 CB SER A 89 10.042 1.088 1.903 1.00 51.21 C ATOM 1361 OG SER A 89 9.004 0.246 1.433 1.00 62.11 O ATOM 0 H SER A 89 11.137 2.712 3.397 1.00 75.31 H new ATOM 0 HA SER A 89 9.526 0.507 3.909 1.00 24.42 H new ATOM 0 HB2 SER A 89 9.721 2.128 1.852 1.00 51.21 H new ATOM 0 HB3 SER A 89 10.914 0.991 1.256 1.00 51.21 H new ATOM 0 HG SER A 89 9.239 -0.690 1.605 1.00 62.11 H new ATOM 1367 N PHE A 90 12.594 -0.293 2.979 1.00 65.31 N ATOM 1368 CA PHE A 90 13.564 -1.383 2.948 1.00 41.45 C ATOM 1369 C PHE A 90 13.597 -2.129 4.280 1.00 43.12 C ATOM 1370 O PHE A 90 13.930 -3.313 4.330 1.00 13.52 O ATOM 1371 CB PHE A 90 14.956 -0.841 2.618 1.00 42.42 C ATOM 1372 CG PHE A 90 15.859 -1.857 1.978 1.00 72.24 C ATOM 1373 CD1 PHE A 90 15.420 -2.614 0.904 1.00 45.15 C ATOM 1374 CD2 PHE A 90 17.146 -2.055 2.451 1.00 12.43 C ATOM 1375 CE1 PHE A 90 16.247 -3.550 0.314 1.00 24.13 C ATOM 1376 CE2 PHE A 90 17.979 -2.989 1.865 1.00 72.10 C ATOM 1377 CZ PHE A 90 17.529 -3.738 0.795 1.00 42.22 C ATOM 0 H PHE A 90 12.969 0.611 2.693 1.00 65.31 H new ATOM 0 HA PHE A 90 13.258 -2.085 2.172 1.00 41.45 H new ATOM 0 HB2 PHE A 90 14.855 0.015 1.951 1.00 42.42 H new ATOM 0 HB3 PHE A 90 15.422 -0.478 3.534 1.00 42.42 H new ATOM 0 HD1 PHE A 90 14.419 -2.471 0.524 1.00 45.15 H new ATOM 0 HD2 PHE A 90 17.503 -1.472 3.288 1.00 12.43 H new ATOM 0 HE1 PHE A 90 15.892 -4.134 -0.522 1.00 24.13 H new ATOM 0 HE2 PHE A 90 18.980 -3.133 2.243 1.00 72.10 H new ATOM 0 HZ PHE A 90 18.178 -4.469 0.335 1.00 42.22 H new ATOM 1387 N GLU A 91 13.246 -1.429 5.355 1.00 43.13 N ATOM 1388 CA GLU A 91 13.234 -2.028 6.684 1.00 52.03 C ATOM 1389 C GLU A 91 12.049 -2.976 6.844 1.00 21.30 C ATOM 1390 O GLU A 91 12.178 -4.054 7.424 1.00 72.43 O ATOM 1391 CB GLU A 91 13.177 -0.937 7.755 1.00 61.21 C ATOM 1392 CG GLU A 91 14.184 0.181 7.538 1.00 71.31 C ATOM 1393 CD GLU A 91 14.876 0.603 8.820 1.00 51.25 C ATOM 1394 OE1 GLU A 91 15.321 -0.287 9.574 1.00 44.42 O ATOM 1395 OE2 GLU A 91 14.973 1.822 9.068 1.00 5.42 O ATOM 0 H GLU A 91 12.967 -0.448 5.331 1.00 43.13 H new ATOM 0 HA GLU A 91 14.153 -2.601 6.806 1.00 52.03 H new ATOM 0 HB2 GLU A 91 12.173 -0.512 7.776 1.00 61.21 H new ATOM 0 HB3 GLU A 91 13.352 -1.388 8.732 1.00 61.21 H new ATOM 0 HG2 GLU A 91 14.933 -0.145 6.816 1.00 71.31 H new ATOM 0 HG3 GLU A 91 13.676 1.042 7.104 1.00 71.31 H new ATOM 1402 N ASP A 92 10.896 -2.566 6.324 1.00 32.45 N ATOM 1403 CA ASP A 92 9.687 -3.379 6.408 1.00 31.33 C ATOM 1404 C ASP A 92 9.731 -4.530 5.408 1.00 44.15 C ATOM 1405 O ASP A 92 9.218 -5.617 5.676 1.00 1.40 O ATOM 1406 CB ASP A 92 8.448 -2.515 6.155 1.00 61.43 C ATOM 1407 CG ASP A 92 8.485 -1.210 6.925 1.00 1.33 C ATOM 1408 OD1 ASP A 92 8.282 -1.241 8.157 1.00 1.42 O ATOM 1409 OD2 ASP A 92 8.718 -0.156 6.297 1.00 24.55 O ATOM 0 H ASP A 92 10.773 -1.676 5.840 1.00 32.45 H new ATOM 0 HA ASP A 92 9.632 -3.798 7.413 1.00 31.33 H new ATOM 0 HB2 ASP A 92 8.369 -2.302 5.089 1.00 61.43 H new ATOM 0 HB3 ASP A 92 7.555 -3.074 6.436 1.00 61.43 H new ATOM 1414 N ILE A 93 10.352 -4.289 4.255 1.00 0.54 N ATOM 1415 CA ILE A 93 10.464 -5.312 3.217 1.00 55.43 C ATOM 1416 C ILE A 93 11.003 -6.618 3.798 1.00 13.25 C ATOM 1417 O ILE A 93 10.538 -7.703 3.450 1.00 54.41 O ATOM 1418 CB ILE A 93 11.379 -4.844 2.062 1.00 41.15 C ATOM 1419 CG1 ILE A 93 10.727 -3.685 1.306 1.00 4.23 C ATOM 1420 CG2 ILE A 93 11.687 -5.994 1.110 1.00 41.13 C ATOM 1421 CD1 ILE A 93 9.500 -4.090 0.516 1.00 51.22 C ATOM 0 H ILE A 93 10.784 -3.397 4.016 1.00 0.54 H new ATOM 0 HA ILE A 93 9.463 -5.482 2.821 1.00 55.43 H new ATOM 0 HB ILE A 93 12.320 -4.499 2.491 1.00 41.15 H new ATOM 0 HG12 ILE A 93 10.450 -2.908 2.018 1.00 4.23 H new ATOM 0 HG13 ILE A 93 11.459 -3.248 0.626 1.00 4.23 H new ATOM 0 HG21 ILE A 93 12.332 -5.638 0.307 1.00 41.13 H new ATOM 0 HG22 ILE A 93 12.192 -6.792 1.655 1.00 41.13 H new ATOM 0 HG23 ILE A 93 10.757 -6.375 0.687 1.00 41.13 H new ATOM 0 HD11 ILE A 93 9.091 -3.218 0.006 1.00 51.22 H new ATOM 0 HD12 ILE A 93 9.774 -4.845 -0.221 1.00 51.22 H new ATOM 0 HD13 ILE A 93 8.750 -4.499 1.193 1.00 51.22 H new ATOM 1433 N HIS A 94 11.979 -6.501 4.691 1.00 1.33 N ATOM 1434 CA HIS A 94 12.575 -7.669 5.328 1.00 64.33 C ATOM 1435 C HIS A 94 11.647 -8.216 6.408 1.00 41.42 C ATOM 1436 O HIS A 94 11.493 -9.429 6.555 1.00 21.53 O ATOM 1437 CB HIS A 94 13.936 -7.306 5.933 1.00 21.52 C ATOM 1438 CG HIS A 94 14.470 -8.334 6.882 1.00 52.42 C ATOM 1439 ND1 HIS A 94 15.422 -9.267 6.527 1.00 45.43 N ATOM 1440 CD2 HIS A 94 14.177 -8.577 8.183 1.00 24.23 C ATOM 1441 CE1 HIS A 94 15.688 -10.039 7.565 1.00 11.21 C ATOM 1442 NE2 HIS A 94 14.947 -9.640 8.583 1.00 60.12 N ATOM 0 H HIS A 94 12.374 -5.610 4.990 1.00 1.33 H new ATOM 0 HA HIS A 94 12.722 -8.440 4.572 1.00 64.33 H new ATOM 0 HB2 HIS A 94 14.655 -7.162 5.126 1.00 21.52 H new ATOM 0 HB3 HIS A 94 13.848 -6.354 6.456 1.00 21.52 H new ATOM 0 HD1 HIS A 94 15.853 -9.348 5.606 1.00 45.43 H new ATOM 0 HD2 HIS A 94 13.469 -8.035 8.792 1.00 24.23 H new ATOM 0 HE1 HIS A 94 16.392 -10.858 7.579 1.00 11.21 H new ATOM 1451 N GLN A 95 11.032 -7.310 7.160 1.00 5.23 N ATOM 1452 CA GLN A 95 10.119 -7.693 8.229 1.00 22.22 C ATOM 1453 C GLN A 95 8.964 -8.527 7.685 1.00 53.50 C ATOM 1454 O GLN A 95 8.668 -9.606 8.198 1.00 61.23 O ATOM 1455 CB GLN A 95 9.576 -6.448 8.929 1.00 1.35 C ATOM 1456 CG GLN A 95 8.890 -6.747 10.251 1.00 1.10 C ATOM 1457 CD GLN A 95 7.387 -6.562 10.185 1.00 4.30 C ATOM 1458 OE1 GLN A 95 6.624 -7.423 10.621 1.00 73.41 O ATOM 1459 NE2 GLN A 95 6.953 -5.433 9.637 1.00 1.05 N ATOM 0 H GLN A 95 11.150 -6.303 7.048 1.00 5.23 H new ATOM 0 HA GLN A 95 10.672 -8.297 8.948 1.00 22.22 H new ATOM 0 HB2 GLN A 95 10.397 -5.752 9.104 1.00 1.35 H new ATOM 0 HB3 GLN A 95 8.869 -5.948 8.267 1.00 1.35 H new ATOM 0 HG2 GLN A 95 9.113 -7.772 10.548 1.00 1.10 H new ATOM 0 HG3 GLN A 95 9.299 -6.095 11.023 1.00 1.10 H new ATOM 0 HE21 GLN A 95 7.621 -4.746 9.288 1.00 1.05 H new ATOM 0 HE22 GLN A 95 5.952 -5.253 9.565 1.00 1.05 H new ATOM 1468 N TYR A 96 8.314 -8.017 6.645 1.00 54.35 N ATOM 1469 CA TYR A 96 7.190 -8.712 6.031 1.00 4.15 C ATOM 1470 C TYR A 96 7.612 -10.083 5.513 1.00 33.51 C ATOM 1471 O TYR A 96 6.820 -11.027 5.510 1.00 25.41 O ATOM 1472 CB TYR A 96 6.613 -7.878 4.886 1.00 52.24 C ATOM 1473 CG TYR A 96 5.798 -6.691 5.350 1.00 14.13 C ATOM 1474 CD1 TYR A 96 4.567 -6.868 5.967 1.00 51.00 C ATOM 1475 CD2 TYR A 96 6.261 -5.393 5.168 1.00 4.12 C ATOM 1476 CE1 TYR A 96 3.819 -5.786 6.391 1.00 3.42 C ATOM 1477 CE2 TYR A 96 5.518 -4.307 5.589 1.00 43.42 C ATOM 1478 CZ TYR A 96 4.299 -4.508 6.199 1.00 44.24 C ATOM 1479 OH TYR A 96 3.557 -3.428 6.620 1.00 42.32 O ATOM 0 H TYR A 96 8.547 -7.124 6.210 1.00 54.35 H new ATOM 0 HA TYR A 96 6.423 -8.853 6.793 1.00 4.15 H new ATOM 0 HB2 TYR A 96 7.431 -7.523 4.259 1.00 52.24 H new ATOM 0 HB3 TYR A 96 5.987 -8.516 4.263 1.00 52.24 H new ATOM 0 HD1 TYR A 96 4.188 -7.868 6.118 1.00 51.00 H new ATOM 0 HD2 TYR A 96 7.216 -5.231 4.690 1.00 4.12 H new ATOM 0 HE1 TYR A 96 2.864 -5.941 6.870 1.00 3.42 H new ATOM 0 HE2 TYR A 96 5.891 -3.304 5.441 1.00 43.42 H new ATOM 0 HH TYR A 96 4.037 -2.600 6.411 1.00 42.32 H new ATOM 1489 N ARG A 97 8.862 -10.186 5.074 1.00 73.33 N ATOM 1490 CA ARG A 97 9.387 -11.442 4.552 1.00 2.35 C ATOM 1491 C ARG A 97 9.322 -12.541 5.607 1.00 73.31 C ATOM 1492 O ARG A 97 8.914 -13.667 5.320 1.00 72.34 O ATOM 1493 CB ARG A 97 10.830 -11.257 4.080 1.00 21.33 C ATOM 1494 CG ARG A 97 11.430 -12.509 3.459 1.00 23.22 C ATOM 1495 CD ARG A 97 12.662 -12.974 4.218 1.00 53.23 C ATOM 1496 NE ARG A 97 12.322 -13.870 5.320 1.00 54.23 N ATOM 1497 CZ ARG A 97 13.208 -14.339 6.196 1.00 60.34 C ATOM 1498 NH1 ARG A 97 14.488 -14.001 6.101 1.00 22.53 N ATOM 1499 NH2 ARG A 97 12.813 -15.145 7.171 1.00 14.11 N ATOM 0 H ARG A 97 9.530 -9.415 5.069 1.00 73.33 H new ATOM 0 HA ARG A 97 8.769 -11.741 3.705 1.00 2.35 H new ATOM 0 HB2 ARG A 97 10.865 -10.447 3.351 1.00 21.33 H new ATOM 0 HB3 ARG A 97 11.444 -10.951 4.927 1.00 21.33 H new ATOM 0 HG2 ARG A 97 10.685 -13.305 3.451 1.00 23.22 H new ATOM 0 HG3 ARG A 97 11.695 -12.310 2.421 1.00 23.22 H new ATOM 0 HD2 ARG A 97 13.339 -13.484 3.532 1.00 53.23 H new ATOM 0 HD3 ARG A 97 13.196 -12.107 4.607 1.00 53.23 H new ATOM 0 HE ARG A 97 11.348 -14.153 5.425 1.00 54.23 H new ATOM 0 HH11 ARG A 97 14.797 -13.379 5.354 1.00 22.53 H new ATOM 0 HH12 ARG A 97 15.163 -14.363 6.775 1.00 22.53 H new ATOM 0 HH21 ARG A 97 11.830 -15.406 7.250 1.00 14.11 H new ATOM 0 HH22 ARG A 97 13.492 -15.504 7.842 1.00 14.11 H new ATOM 1513 N GLU A 98 9.726 -12.208 6.828 1.00 42.12 N ATOM 1514 CA GLU A 98 9.714 -13.167 7.928 1.00 65.34 C ATOM 1515 C GLU A 98 8.316 -13.737 8.141 1.00 4.10 C ATOM 1516 O GLU A 98 8.157 -14.909 8.488 1.00 33.23 O ATOM 1517 CB GLU A 98 10.210 -12.506 9.215 1.00 40.32 C ATOM 1518 CG GLU A 98 11.723 -12.383 9.292 1.00 21.34 C ATOM 1519 CD GLU A 98 12.363 -13.544 10.027 1.00 11.31 C ATOM 1520 OE1 GLU A 98 11.806 -14.660 9.973 1.00 23.54 O ATOM 1521 OE2 GLU A 98 13.421 -13.337 10.658 1.00 62.42 O ATOM 0 H GLU A 98 10.066 -11.281 7.082 1.00 42.12 H new ATOM 0 HA GLU A 98 10.384 -13.987 7.667 1.00 65.34 H new ATOM 0 HB2 GLU A 98 9.768 -11.513 9.297 1.00 40.32 H new ATOM 0 HB3 GLU A 98 9.857 -13.083 10.069 1.00 40.32 H new ATOM 0 HG2 GLU A 98 12.132 -12.326 8.283 1.00 21.34 H new ATOM 0 HG3 GLU A 98 11.984 -11.451 9.794 1.00 21.34 H new ATOM 1528 N GLN A 99 7.302 -12.903 7.930 1.00 24.23 N ATOM 1529 CA GLN A 99 5.918 -13.326 8.099 1.00 2.14 C ATOM 1530 C GLN A 99 5.499 -14.269 6.974 1.00 15.20 C ATOM 1531 O GLN A 99 4.743 -15.216 7.193 1.00 51.04 O ATOM 1532 CB GLN A 99 4.991 -12.109 8.130 1.00 63.41 C ATOM 1533 CG GLN A 99 4.940 -11.416 9.482 1.00 63.30 C ATOM 1534 CD GLN A 99 4.021 -10.210 9.485 1.00 53.41 C ATOM 1535 OE1 GLN A 99 4.475 -9.068 9.424 1.00 14.10 O ATOM 1536 NE2 GLN A 99 2.718 -10.460 9.557 1.00 43.15 N ATOM 0 H GLN A 99 7.414 -11.931 7.642 1.00 24.23 H new ATOM 0 HA GLN A 99 5.839 -13.859 9.047 1.00 2.14 H new ATOM 0 HB2 GLN A 99 5.320 -11.393 7.377 1.00 63.41 H new ATOM 0 HB3 GLN A 99 3.984 -12.423 7.854 1.00 63.41 H new ATOM 0 HG2 GLN A 99 4.604 -12.126 10.238 1.00 63.30 H new ATOM 0 HG3 GLN A 99 5.945 -11.103 9.764 1.00 63.30 H new ATOM 0 HE21 GLN A 99 2.385 -11.423 9.606 1.00 43.15 H new ATOM 0 HE22 GLN A 99 2.050 -9.689 9.563 1.00 43.15 H new ATOM 1545 N ILE A 100 5.996 -14.001 5.771 1.00 71.40 N ATOM 1546 CA ILE A 100 5.676 -14.823 4.609 1.00 21.25 C ATOM 1547 C ILE A 100 6.093 -16.275 4.830 1.00 63.30 C ATOM 1548 O ILE A 100 5.329 -17.199 4.546 1.00 73.54 O ATOM 1549 CB ILE A 100 6.362 -14.281 3.336 1.00 12.51 C ATOM 1550 CG1 ILE A 100 5.789 -12.910 2.972 1.00 51.52 C ATOM 1551 CG2 ILE A 100 6.195 -15.256 2.176 1.00 31.24 C ATOM 1552 CD1 ILE A 100 6.499 -12.244 1.815 1.00 61.31 C ATOM 0 H ILE A 100 6.623 -13.220 5.575 1.00 71.40 H new ATOM 0 HA ILE A 100 4.595 -14.781 4.474 1.00 21.25 H new ATOM 0 HB ILE A 100 7.428 -14.173 3.536 1.00 12.51 H new ATOM 0 HG12 ILE A 100 4.733 -13.021 2.724 1.00 51.52 H new ATOM 0 HG13 ILE A 100 5.845 -12.259 3.845 1.00 51.52 H new ATOM 0 HG21 ILE A 100 6.686 -14.854 1.290 1.00 31.24 H new ATOM 0 HG22 ILE A 100 6.645 -16.213 2.438 1.00 31.24 H new ATOM 0 HG23 ILE A 100 5.134 -15.398 1.970 1.00 31.24 H new ATOM 0 HD11 ILE A 100 6.039 -11.277 1.614 1.00 61.31 H new ATOM 0 HD12 ILE A 100 7.550 -12.100 2.067 1.00 61.31 H new ATOM 0 HD13 ILE A 100 6.421 -12.874 0.929 1.00 61.31 H new ATOM 1564 N LYS A 101 7.307 -16.470 5.334 1.00 65.50 N ATOM 1565 CA LYS A 101 7.823 -17.812 5.587 1.00 12.44 C ATOM 1566 C LYS A 101 6.838 -18.627 6.423 1.00 51.45 C ATOM 1567 O LYS A 101 6.579 -19.795 6.133 1.00 33.02 O ATOM 1568 CB LYS A 101 9.174 -17.744 6.306 1.00 10.44 C ATOM 1569 CG LYS A 101 10.187 -16.816 5.648 1.00 34.14 C ATOM 1570 CD LYS A 101 10.395 -17.153 4.179 1.00 11.35 C ATOM 1571 CE LYS A 101 10.013 -15.992 3.273 1.00 23.22 C ATOM 1572 NZ LYS A 101 11.124 -15.616 2.355 1.00 13.13 N ATOM 0 H LYS A 101 7.952 -15.717 5.575 1.00 65.50 H new ATOM 0 HA LYS A 101 7.956 -18.304 4.623 1.00 12.44 H new ATOM 0 HB2 LYS A 101 9.010 -17.415 7.332 1.00 10.44 H new ATOM 0 HB3 LYS A 101 9.597 -18.747 6.356 1.00 10.44 H new ATOM 0 HG2 LYS A 101 9.847 -15.784 5.739 1.00 34.14 H new ATOM 0 HG3 LYS A 101 11.139 -16.886 6.175 1.00 34.14 H new ATOM 0 HD2 LYS A 101 11.439 -17.417 4.011 1.00 11.35 H new ATOM 0 HD3 LYS A 101 9.799 -18.028 3.919 1.00 11.35 H new ATOM 0 HE2 LYS A 101 9.134 -16.262 2.688 1.00 23.22 H new ATOM 0 HE3 LYS A 101 9.738 -15.131 3.882 1.00 23.22 H new ATOM 0 HZ1 LYS A 101 10.939 -14.675 1.954 1.00 13.13 H new ATOM 0 HZ2 LYS A 101 12.020 -15.597 2.883 1.00 13.13 H new ATOM 0 HZ3 LYS A 101 11.190 -16.313 1.586 1.00 13.13 H new ATOM 1586 N ARG A 102 6.297 -18.001 7.465 1.00 3.32 N ATOM 1587 CA ARG A 102 5.346 -18.661 8.350 1.00 30.35 C ATOM 1588 C ARG A 102 4.025 -18.940 7.640 1.00 1.32 C ATOM 1589 O ARG A 102 3.423 -19.999 7.822 1.00 45.03 O ATOM 1590 CB ARG A 102 5.100 -17.803 9.588 1.00 22.22 C ATOM 1591 CG ARG A 102 5.071 -18.606 10.874 1.00 61.34 C ATOM 1592 CD ARG A 102 4.702 -17.738 12.063 1.00 63.23 C ATOM 1593 NE ARG A 102 4.251 -18.533 13.202 1.00 24.44 N ATOM 1594 CZ ARG A 102 3.967 -18.021 14.397 1.00 13.14 C ATOM 1595 NH1 ARG A 102 4.082 -16.717 14.613 1.00 42.42 N ATOM 1596 NH2 ARG A 102 3.563 -18.815 15.380 1.00 21.12 N ATOM 0 H ARG A 102 6.503 -17.034 7.716 1.00 3.32 H new ATOM 0 HA ARG A 102 5.776 -19.616 8.650 1.00 30.35 H new ATOM 0 HB2 ARG A 102 5.880 -17.045 9.658 1.00 22.22 H new ATOM 0 HB3 ARG A 102 4.153 -17.276 9.475 1.00 22.22 H new ATOM 0 HG2 ARG A 102 4.353 -19.420 10.780 1.00 61.34 H new ATOM 0 HG3 ARG A 102 6.047 -19.060 11.043 1.00 61.34 H new ATOM 0 HD2 ARG A 102 5.565 -17.140 12.357 1.00 63.23 H new ATOM 0 HD3 ARG A 102 3.915 -17.041 11.773 1.00 63.23 H new ATOM 0 HE ARG A 102 4.148 -19.540 13.074 1.00 24.44 H new ATOM 0 HH11 ARG A 102 4.390 -16.101 13.861 1.00 42.42 H new ATOM 0 HH12 ARG A 102 3.863 -16.331 15.531 1.00 42.42 H new ATOM 0 HH21 ARG A 102 3.470 -19.818 15.220 1.00 21.12 H new ATOM 0 HH22 ARG A 102 3.345 -18.422 16.296 1.00 21.12 H new ATOM 1610 N VAL A 103 3.574 -17.983 6.835 1.00 21.34 N ATOM 1611 CA VAL A 103 2.320 -18.123 6.105 1.00 43.12 C ATOM 1612 C VAL A 103 2.264 -19.444 5.341 1.00 11.32 C ATOM 1613 O VAL A 103 1.286 -20.186 5.437 1.00 13.30 O ATOM 1614 CB VAL A 103 2.121 -16.954 5.120 1.00 31.11 C ATOM 1615 CG1 VAL A 103 0.801 -17.088 4.375 1.00 13.02 C ATOM 1616 CG2 VAL A 103 2.193 -15.623 5.855 1.00 40.23 C ATOM 0 H VAL A 103 4.060 -17.101 6.672 1.00 21.34 H new ATOM 0 HA VAL A 103 1.518 -18.111 6.843 1.00 43.12 H new ATOM 0 HB VAL A 103 2.925 -16.987 4.385 1.00 31.11 H new ATOM 0 HG11 VAL A 103 0.685 -16.251 3.687 1.00 13.02 H new ATOM 0 HG12 VAL A 103 0.793 -18.023 3.814 1.00 13.02 H new ATOM 0 HG13 VAL A 103 -0.022 -17.087 5.090 1.00 13.02 H new ATOM 0 HG21 VAL A 103 2.051 -14.808 5.146 1.00 40.23 H new ATOM 0 HG22 VAL A 103 1.412 -15.584 6.614 1.00 40.23 H new ATOM 0 HG23 VAL A 103 3.168 -15.523 6.332 1.00 40.23 H new ATOM 1626 N LYS A 104 3.315 -19.734 4.584 1.00 51.04 N ATOM 1627 CA LYS A 104 3.378 -20.970 3.807 1.00 61.41 C ATOM 1628 C LYS A 104 4.341 -21.976 4.436 1.00 43.15 C ATOM 1629 O LYS A 104 4.620 -23.024 3.852 1.00 33.34 O ATOM 1630 CB LYS A 104 3.792 -20.683 2.357 1.00 52.54 C ATOM 1631 CG LYS A 104 4.660 -19.444 2.190 1.00 2.34 C ATOM 1632 CD LYS A 104 3.818 -18.179 2.117 1.00 41.22 C ATOM 1633 CE LYS A 104 3.310 -17.928 0.705 1.00 33.54 C ATOM 1634 NZ LYS A 104 4.367 -17.354 -0.175 1.00 24.33 N ATOM 0 H LYS A 104 4.134 -19.133 4.490 1.00 51.04 H new ATOM 0 HA LYS A 104 2.379 -21.407 3.808 1.00 61.41 H new ATOM 0 HB2 LYS A 104 4.332 -21.546 1.967 1.00 52.54 H new ATOM 0 HB3 LYS A 104 2.894 -20.568 1.750 1.00 52.54 H new ATOM 0 HG2 LYS A 104 5.356 -19.371 3.025 1.00 2.34 H new ATOM 0 HG3 LYS A 104 5.258 -19.537 1.284 1.00 2.34 H new ATOM 0 HD2 LYS A 104 2.972 -18.264 2.799 1.00 41.22 H new ATOM 0 HD3 LYS A 104 4.411 -17.326 2.448 1.00 41.22 H new ATOM 0 HE2 LYS A 104 2.951 -18.864 0.277 1.00 33.54 H new ATOM 0 HE3 LYS A 104 2.459 -17.247 0.741 1.00 33.54 H new ATOM 0 HZ1 LYS A 104 4.065 -16.419 -0.515 1.00 24.33 H new ATOM 0 HZ2 LYS A 104 5.252 -17.258 0.363 1.00 24.33 H new ATOM 0 HZ3 LYS A 104 4.522 -17.984 -0.988 1.00 24.33 H new ATOM 1648 N ASP A 105 4.843 -21.658 5.628 1.00 34.20 N ATOM 1649 CA ASP A 105 5.770 -22.541 6.333 1.00 20.02 C ATOM 1650 C ASP A 105 6.876 -23.041 5.403 1.00 45.25 C ATOM 1651 O ASP A 105 6.983 -24.238 5.137 1.00 13.50 O ATOM 1652 CB ASP A 105 5.015 -23.728 6.932 1.00 24.15 C ATOM 1653 CG ASP A 105 5.886 -24.565 7.848 1.00 73.23 C ATOM 1654 OD1 ASP A 105 6.450 -24.000 8.810 1.00 52.13 O ATOM 1655 OD2 ASP A 105 6.003 -25.784 7.605 1.00 33.21 O ATOM 0 H ASP A 105 4.623 -20.795 6.126 1.00 34.20 H new ATOM 0 HA ASP A 105 6.235 -21.968 7.135 1.00 20.02 H new ATOM 0 HB2 ASP A 105 4.153 -23.362 7.489 1.00 24.15 H new ATOM 0 HB3 ASP A 105 4.632 -24.355 6.127 1.00 24.15 H new ATOM 1660 N SER A 106 7.694 -22.114 4.914 1.00 2.30 N ATOM 1661 CA SER A 106 8.790 -22.462 4.016 1.00 14.12 C ATOM 1662 C SER A 106 9.603 -21.227 3.649 1.00 34.24 C ATOM 1663 O SER A 106 9.064 -20.126 3.530 1.00 33.32 O ATOM 1664 CB SER A 106 8.248 -23.130 2.749 1.00 34.43 C ATOM 1665 OG SER A 106 8.861 -24.391 2.535 1.00 4.22 O ATOM 0 H SER A 106 7.619 -21.119 5.124 1.00 2.30 H new ATOM 0 HA SER A 106 9.444 -23.163 4.534 1.00 14.12 H new ATOM 0 HB2 SER A 106 7.169 -23.256 2.834 1.00 34.43 H new ATOM 0 HB3 SER A 106 8.427 -22.485 1.889 1.00 34.43 H new ATOM 0 HG SER A 106 8.497 -24.798 1.721 1.00 4.22 H new ATOM 1671 N ASP A 107 10.905 -21.419 3.472 1.00 54.11 N ATOM 1672 CA ASP A 107 11.800 -20.325 3.121 1.00 10.34 C ATOM 1673 C ASP A 107 11.676 -19.973 1.641 1.00 50.43 C ATOM 1674 O ASP A 107 11.482 -18.812 1.283 1.00 62.23 O ATOM 1675 CB ASP A 107 13.244 -20.702 3.451 1.00 3.23 C ATOM 1676 CG ASP A 107 14.181 -19.511 3.396 1.00 62.43 C ATOM 1677 OD1 ASP A 107 13.685 -18.364 3.388 1.00 22.43 O ATOM 1678 OD2 ASP A 107 15.412 -19.724 3.363 1.00 42.42 O ATOM 0 H ASP A 107 11.364 -22.325 3.566 1.00 54.11 H new ATOM 0 HA ASP A 107 11.516 -19.450 3.706 1.00 10.34 H new ATOM 0 HB2 ASP A 107 13.282 -21.145 4.446 1.00 3.23 H new ATOM 0 HB3 ASP A 107 13.587 -21.463 2.750 1.00 3.23 H new ATOM 1683 N ASP A 108 11.792 -20.984 0.786 1.00 42.12 N ATOM 1684 CA ASP A 108 11.695 -20.781 -0.655 1.00 45.21 C ATOM 1685 C ASP A 108 10.241 -20.617 -1.088 1.00 32.55 C ATOM 1686 O ASP A 108 9.623 -21.556 -1.588 1.00 24.31 O ATOM 1687 CB ASP A 108 12.331 -21.958 -1.399 1.00 42.42 C ATOM 1688 CG ASP A 108 12.320 -21.770 -2.904 1.00 34.25 C ATOM 1689 OD1 ASP A 108 12.074 -20.633 -3.358 1.00 74.41 O ATOM 1690 OD2 ASP A 108 12.556 -22.760 -3.627 1.00 33.43 O ATOM 0 H ASP A 108 11.953 -21.952 1.066 1.00 42.12 H new ATOM 0 HA ASP A 108 12.233 -19.866 -0.904 1.00 45.21 H new ATOM 0 HB2 ASP A 108 13.359 -22.085 -1.060 1.00 42.42 H new ATOM 0 HB3 ASP A 108 11.797 -22.874 -1.147 1.00 42.42 H new ATOM 1695 N VAL A 109 9.702 -19.417 -0.893 1.00 74.23 N ATOM 1696 CA VAL A 109 8.322 -19.132 -1.266 1.00 13.41 C ATOM 1697 C VAL A 109 8.262 -18.234 -2.502 1.00 13.35 C ATOM 1698 O VAL A 109 9.154 -17.417 -2.729 1.00 72.15 O ATOM 1699 CB VAL A 109 7.549 -18.461 -0.108 1.00 34.33 C ATOM 1700 CG1 VAL A 109 7.706 -19.263 1.174 1.00 4.40 C ATOM 1701 CG2 VAL A 109 8.015 -17.025 0.097 1.00 74.34 C ATOM 0 H VAL A 109 10.199 -18.628 -0.480 1.00 74.23 H new ATOM 0 HA VAL A 109 7.851 -20.088 -1.494 1.00 13.41 H new ATOM 0 HB VAL A 109 6.492 -18.439 -0.374 1.00 34.33 H new ATOM 0 HG11 VAL A 109 7.155 -18.775 1.978 1.00 4.40 H new ATOM 0 HG12 VAL A 109 7.314 -20.269 1.024 1.00 4.40 H new ATOM 0 HG13 VAL A 109 8.761 -19.320 1.440 1.00 4.40 H new ATOM 0 HG21 VAL A 109 7.456 -16.575 0.917 1.00 74.34 H new ATOM 0 HG22 VAL A 109 9.078 -17.018 0.336 1.00 74.34 H new ATOM 0 HG23 VAL A 109 7.844 -16.453 -0.815 1.00 74.34 H new ATOM 1711 N PRO A 110 7.204 -18.373 -3.317 1.00 10.15 N ATOM 1712 CA PRO A 110 7.032 -17.569 -4.531 1.00 73.21 C ATOM 1713 C PRO A 110 6.755 -16.103 -4.215 1.00 54.52 C ATOM 1714 O PRO A 110 5.678 -15.755 -3.733 1.00 24.50 O ATOM 1715 CB PRO A 110 5.823 -18.209 -5.217 1.00 52.41 C ATOM 1716 CG PRO A 110 5.064 -18.864 -4.116 1.00 70.54 C ATOM 1717 CD PRO A 110 6.092 -19.322 -3.119 1.00 53.54 C ATOM 0 HA PRO A 110 7.930 -17.563 -5.148 1.00 73.21 H new ATOM 0 HB2 PRO A 110 5.215 -17.461 -5.726 1.00 52.41 H new ATOM 0 HB3 PRO A 110 6.133 -18.934 -5.970 1.00 52.41 H new ATOM 0 HG2 PRO A 110 4.361 -18.168 -3.659 1.00 70.54 H new ATOM 0 HG3 PRO A 110 4.482 -19.706 -4.491 1.00 70.54 H new ATOM 0 HD2 PRO A 110 5.708 -19.285 -2.100 1.00 53.54 H new ATOM 0 HD3 PRO A 110 6.403 -20.350 -3.305 1.00 53.54 H new ATOM 1725 N MET A 111 7.736 -15.249 -4.489 1.00 31.33 N ATOM 1726 CA MET A 111 7.598 -13.820 -4.229 1.00 21.25 C ATOM 1727 C MET A 111 8.545 -13.011 -5.108 1.00 51.13 C ATOM 1728 O MET A 111 9.379 -13.570 -5.822 1.00 65.14 O ATOM 1729 CB MET A 111 7.877 -13.519 -2.757 1.00 42.51 C ATOM 1730 CG MET A 111 9.264 -13.942 -2.305 1.00 61.54 C ATOM 1731 SD MET A 111 9.836 -13.024 -0.865 1.00 72.22 S ATOM 1732 CE MET A 111 8.921 -13.847 0.434 1.00 54.55 C ATOM 0 H MET A 111 8.634 -15.521 -4.890 1.00 31.33 H new ATOM 0 HA MET A 111 6.574 -13.533 -4.467 1.00 21.25 H new ATOM 0 HB2 MET A 111 7.757 -12.449 -2.584 1.00 42.51 H new ATOM 0 HB3 MET A 111 7.133 -14.026 -2.143 1.00 42.51 H new ATOM 0 HG2 MET A 111 9.257 -15.007 -2.073 1.00 61.54 H new ATOM 0 HG3 MET A 111 9.968 -13.799 -3.125 1.00 61.54 H new ATOM 0 HE1 MET A 111 8.995 -13.268 1.354 1.00 54.55 H new ATOM 0 HE2 MET A 111 7.874 -13.933 0.143 1.00 54.55 H new ATOM 0 HE3 MET A 111 9.336 -14.842 0.597 1.00 54.55 H new ATOM 1742 N VAL A 112 8.411 -11.690 -5.051 1.00 54.01 N ATOM 1743 CA VAL A 112 9.254 -10.800 -5.839 1.00 53.53 C ATOM 1744 C VAL A 112 9.500 -9.486 -5.105 1.00 10.11 C ATOM 1745 O VAL A 112 8.720 -9.093 -4.237 1.00 62.21 O ATOM 1746 CB VAL A 112 8.622 -10.495 -7.209 1.00 73.33 C ATOM 1747 CG1 VAL A 112 9.638 -9.834 -8.129 1.00 5.03 C ATOM 1748 CG2 VAL A 112 8.068 -11.765 -7.837 1.00 5.53 C ATOM 0 H VAL A 112 7.725 -11.212 -4.466 1.00 54.01 H new ATOM 0 HA VAL A 112 10.203 -11.315 -5.990 1.00 53.53 H new ATOM 0 HB VAL A 112 7.794 -9.801 -7.061 1.00 73.33 H new ATOM 0 HG11 VAL A 112 9.174 -9.625 -9.093 1.00 5.03 H new ATOM 0 HG12 VAL A 112 9.981 -8.901 -7.682 1.00 5.03 H new ATOM 0 HG13 VAL A 112 10.488 -10.502 -8.272 1.00 5.03 H new ATOM 0 HG21 VAL A 112 7.625 -11.529 -8.805 1.00 5.53 H new ATOM 0 HG22 VAL A 112 8.875 -12.486 -7.973 1.00 5.53 H new ATOM 0 HG23 VAL A 112 7.307 -12.192 -7.184 1.00 5.53 H new ATOM 1758 N LEU A 113 10.587 -8.810 -5.461 1.00 42.43 N ATOM 1759 CA LEU A 113 10.937 -7.541 -4.838 1.00 4.54 C ATOM 1760 C LEU A 113 11.026 -6.431 -5.882 1.00 10.12 C ATOM 1761 O LEU A 113 12.008 -6.335 -6.619 1.00 51.51 O ATOM 1762 CB LEU A 113 12.266 -7.664 -4.090 1.00 54.24 C ATOM 1763 CG LEU A 113 12.793 -6.366 -3.473 1.00 22.15 C ATOM 1764 CD1 LEU A 113 11.659 -5.578 -2.836 1.00 24.32 C ATOM 1765 CD2 LEU A 113 13.877 -6.666 -2.450 1.00 40.25 C ATOM 0 H LEU A 113 11.241 -9.121 -6.179 1.00 42.43 H new ATOM 0 HA LEU A 113 10.152 -7.284 -4.126 1.00 4.54 H new ATOM 0 HB2 LEU A 113 12.150 -8.403 -3.297 1.00 54.24 H new ATOM 0 HB3 LEU A 113 13.017 -8.050 -4.779 1.00 54.24 H new ATOM 0 HG LEU A 113 13.228 -5.758 -4.267 1.00 22.15 H new ATOM 0 HD11 LEU A 113 12.053 -4.659 -2.403 1.00 24.32 H new ATOM 0 HD12 LEU A 113 10.916 -5.332 -3.595 1.00 24.32 H new ATOM 0 HD13 LEU A 113 11.194 -6.178 -2.053 1.00 24.32 H new ATOM 0 HD21 LEU A 113 14.241 -5.732 -2.021 1.00 40.25 H new ATOM 0 HD22 LEU A 113 13.467 -7.293 -1.659 1.00 40.25 H new ATOM 0 HD23 LEU A 113 14.702 -7.188 -2.936 1.00 40.25 H new ATOM 1777 N VAL A 114 9.995 -5.594 -5.938 1.00 32.32 N ATOM 1778 CA VAL A 114 9.957 -4.491 -6.891 1.00 21.51 C ATOM 1779 C VAL A 114 10.417 -3.190 -6.244 1.00 51.55 C ATOM 1780 O VAL A 114 10.286 -3.005 -5.035 1.00 4.23 O ATOM 1781 CB VAL A 114 8.542 -4.290 -7.465 1.00 4.34 C ATOM 1782 CG1 VAL A 114 8.569 -3.298 -8.617 1.00 12.15 C ATOM 1783 CG2 VAL A 114 7.954 -5.620 -7.910 1.00 51.21 C ATOM 0 H VAL A 114 9.175 -5.659 -5.335 1.00 32.32 H new ATOM 0 HA VAL A 114 10.636 -4.753 -7.702 1.00 21.51 H new ATOM 0 HB VAL A 114 7.905 -3.882 -6.680 1.00 4.34 H new ATOM 0 HG11 VAL A 114 7.560 -3.169 -9.010 1.00 12.15 H new ATOM 0 HG12 VAL A 114 8.946 -2.339 -8.262 1.00 12.15 H new ATOM 0 HG13 VAL A 114 9.220 -3.674 -9.406 1.00 12.15 H new ATOM 0 HG21 VAL A 114 6.954 -5.459 -8.313 1.00 51.21 H new ATOM 0 HG22 VAL A 114 8.589 -6.059 -8.679 1.00 51.21 H new ATOM 0 HG23 VAL A 114 7.897 -6.296 -7.057 1.00 51.21 H new ATOM 1793 N GLY A 115 10.955 -2.291 -7.061 1.00 32.45 N ATOM 1794 CA GLY A 115 11.427 -1.015 -6.554 1.00 63.22 C ATOM 1795 C GLY A 115 10.726 0.161 -7.205 1.00 13.11 C ATOM 1796 O GLY A 115 11.171 0.666 -8.236 1.00 1.05 O ATOM 0 H GLY A 115 11.073 -2.423 -8.066 1.00 32.45 H new ATOM 0 HA2 GLY A 115 11.271 -0.976 -5.476 1.00 63.22 H new ATOM 0 HA3 GLY A 115 12.501 -0.934 -6.724 1.00 63.22 H new ATOM 1800 N ASN A 116 9.625 0.598 -6.602 1.00 51.54 N ATOM 1801 CA ASN A 116 8.858 1.722 -7.128 1.00 64.43 C ATOM 1802 C ASN A 116 9.637 3.025 -6.984 1.00 5.34 C ATOM 1803 O ASN A 116 10.705 3.057 -6.373 1.00 54.14 O ATOM 1804 CB ASN A 116 7.517 1.834 -6.401 1.00 63.31 C ATOM 1805 CG ASN A 116 6.438 2.458 -7.265 1.00 14.44 C ATOM 1806 OD1 ASN A 116 6.696 2.874 -8.394 1.00 73.31 O ATOM 1807 ND2 ASN A 116 5.223 2.526 -6.737 1.00 4.22 N ATOM 0 H ASN A 116 9.244 0.191 -5.748 1.00 51.54 H new ATOM 0 HA ASN A 116 8.676 1.543 -8.188 1.00 64.43 H new ATOM 0 HB2 ASN A 116 7.195 0.842 -6.084 1.00 63.31 H new ATOM 0 HB3 ASN A 116 7.646 2.431 -5.498 1.00 63.31 H new ATOM 0 HD21 ASN A 116 4.457 2.936 -7.271 1.00 4.22 H new ATOM 0 HD22 ASN A 116 5.055 2.168 -5.797 1.00 4.22 H new ATOM 1814 N LYS A 117 9.093 4.098 -7.549 1.00 54.12 N ATOM 1815 CA LYS A 117 9.735 5.406 -7.482 1.00 63.24 C ATOM 1816 C LYS A 117 11.092 5.383 -8.179 1.00 22.32 C ATOM 1817 O LYS A 117 12.136 5.464 -7.532 1.00 74.30 O ATOM 1818 CB LYS A 117 9.902 5.842 -6.025 1.00 63.15 C ATOM 1819 CG LYS A 117 8.675 5.581 -5.167 1.00 51.14 C ATOM 1820 CD LYS A 117 8.397 6.738 -4.220 1.00 15.32 C ATOM 1821 CE LYS A 117 7.278 6.405 -3.247 1.00 1.12 C ATOM 1822 NZ LYS A 117 7.165 7.415 -2.160 1.00 4.14 N ATOM 0 H LYS A 117 8.209 4.088 -8.058 1.00 54.12 H new ATOM 0 HA LYS A 117 9.096 6.123 -7.997 1.00 63.24 H new ATOM 0 HB2 LYS A 117 10.755 5.318 -5.593 1.00 63.15 H new ATOM 0 HB3 LYS A 117 10.134 6.907 -5.997 1.00 63.15 H new ATOM 0 HG2 LYS A 117 7.809 5.420 -5.809 1.00 51.14 H new ATOM 0 HG3 LYS A 117 8.820 4.666 -4.592 1.00 51.14 H new ATOM 0 HD2 LYS A 117 9.303 6.981 -3.665 1.00 15.32 H new ATOM 0 HD3 LYS A 117 8.129 7.624 -4.795 1.00 15.32 H new ATOM 0 HE2 LYS A 117 6.333 6.347 -3.787 1.00 1.12 H new ATOM 0 HE3 LYS A 117 7.457 5.422 -2.811 1.00 1.12 H new ATOM 0 HZ1 LYS A 117 6.390 7.150 -1.519 1.00 4.14 H new ATOM 0 HZ2 LYS A 117 8.057 7.453 -1.627 1.00 4.14 H new ATOM 0 HZ3 LYS A 117 6.968 8.349 -2.573 1.00 4.14 H new ATOM 1836 N CYS A 118 11.070 5.269 -9.503 1.00 52.55 N ATOM 1837 CA CYS A 118 12.299 5.234 -10.287 1.00 12.11 C ATOM 1838 C CYS A 118 12.477 6.520 -11.089 1.00 22.42 C ATOM 1839 O CYS A 118 13.598 6.897 -11.434 1.00 50.24 O ATOM 1840 CB CYS A 118 12.289 4.031 -11.232 1.00 52.31 C ATOM 1841 SG CYS A 118 13.912 3.612 -11.909 1.00 3.32 S ATOM 0 H CYS A 118 10.215 5.199 -10.055 1.00 52.55 H new ATOM 0 HA CYS A 118 13.136 5.142 -9.595 1.00 12.11 H new ATOM 0 HB2 CYS A 118 11.896 3.166 -10.698 1.00 52.31 H new ATOM 0 HB3 CYS A 118 11.605 4.235 -12.056 1.00 52.31 H new ATOM 0 HG CYS A 118 13.802 2.582 -12.694 1.00 3.32 H new ATOM 1847 N ASP A 119 11.367 7.192 -11.384 1.00 42.45 N ATOM 1848 CA ASP A 119 11.404 8.437 -12.147 1.00 75.24 C ATOM 1849 C ASP A 119 12.358 9.441 -11.508 1.00 13.31 C ATOM 1850 O ASP A 119 13.394 9.779 -12.081 1.00 43.50 O ATOM 1851 CB ASP A 119 10.002 9.039 -12.248 1.00 24.44 C ATOM 1852 CG ASP A 119 9.965 10.274 -13.126 1.00 64.22 C ATOM 1853 OD1 ASP A 119 10.854 10.413 -13.993 1.00 24.11 O ATOM 1854 OD2 ASP A 119 9.047 11.103 -12.948 1.00 64.32 O ATOM 0 H ASP A 119 10.431 6.896 -11.107 1.00 42.45 H new ATOM 0 HA ASP A 119 11.767 8.208 -13.149 1.00 75.24 H new ATOM 0 HB2 ASP A 119 9.317 8.292 -12.648 1.00 24.44 H new ATOM 0 HB3 ASP A 119 9.647 9.295 -11.250 1.00 24.44 H new ATOM 1859 N LEU A 120 12.001 9.916 -10.318 1.00 64.52 N ATOM 1860 CA LEU A 120 12.826 10.884 -9.599 1.00 14.51 C ATOM 1861 C LEU A 120 14.280 10.425 -9.524 1.00 32.13 C ATOM 1862 O LEU A 120 14.611 9.313 -9.934 1.00 20.31 O ATOM 1863 CB LEU A 120 12.278 11.122 -8.183 1.00 22.13 C ATOM 1864 CG LEU A 120 11.843 9.871 -7.400 1.00 61.53 C ATOM 1865 CD1 LEU A 120 10.380 9.546 -7.672 1.00 73.55 C ATOM 1866 CD2 LEU A 120 12.729 8.676 -7.728 1.00 62.22 C ATOM 0 H LEU A 120 11.146 9.647 -9.831 1.00 64.52 H new ATOM 0 HA LEU A 120 12.790 11.822 -10.154 1.00 14.51 H new ATOM 0 HB2 LEU A 120 13.042 11.640 -7.603 1.00 22.13 H new ATOM 0 HB3 LEU A 120 11.423 11.794 -8.256 1.00 22.13 H new ATOM 0 HG LEU A 120 11.956 10.088 -6.338 1.00 61.53 H new ATOM 0 HD11 LEU A 120 10.094 8.658 -7.108 1.00 73.55 H new ATOM 0 HD12 LEU A 120 9.757 10.387 -7.366 1.00 73.55 H new ATOM 0 HD13 LEU A 120 10.240 9.360 -8.737 1.00 73.55 H new ATOM 0 HD21 LEU A 120 12.395 7.809 -7.159 1.00 62.22 H new ATOM 0 HD22 LEU A 120 12.665 8.457 -8.794 1.00 62.22 H new ATOM 0 HD23 LEU A 120 13.762 8.906 -7.467 1.00 62.22 H new ATOM 1878 N ALA A 121 15.143 11.292 -9.002 1.00 65.12 N ATOM 1879 CA ALA A 121 16.561 10.976 -8.877 1.00 44.41 C ATOM 1880 C ALA A 121 17.034 11.126 -7.435 1.00 24.12 C ATOM 1881 O ALA A 121 18.127 11.633 -7.180 1.00 30.35 O ATOM 1882 CB ALA A 121 17.380 11.867 -9.800 1.00 55.32 C ATOM 0 H ALA A 121 14.885 12.217 -8.659 1.00 65.12 H new ATOM 0 HA ALA A 121 16.704 9.936 -9.170 1.00 44.41 H new ATOM 0 HB1 ALA A 121 18.437 11.622 -9.698 1.00 55.32 H new ATOM 0 HB2 ALA A 121 17.068 11.706 -10.832 1.00 55.32 H new ATOM 0 HB3 ALA A 121 17.222 12.912 -9.532 1.00 55.32 H new ATOM 1888 N ALA A 122 16.206 10.681 -6.496 1.00 42.03 N ATOM 1889 CA ALA A 122 16.541 10.764 -5.079 1.00 70.12 C ATOM 1890 C ALA A 122 16.532 9.383 -4.432 1.00 72.42 C ATOM 1891 O ALA A 122 15.758 9.120 -3.512 1.00 25.12 O ATOM 1892 CB ALA A 122 15.571 11.693 -4.362 1.00 11.22 C ATOM 0 H ALA A 122 15.298 10.259 -6.691 1.00 42.03 H new ATOM 0 HA ALA A 122 17.548 11.171 -4.991 1.00 70.12 H new ATOM 0 HB1 ALA A 122 15.832 11.746 -3.305 1.00 11.22 H new ATOM 0 HB2 ALA A 122 15.630 12.689 -4.801 1.00 11.22 H new ATOM 0 HB3 ALA A 122 14.556 11.310 -4.466 1.00 11.22 H new ATOM 1898 N ARG A 123 17.398 8.500 -4.924 1.00 41.22 N ATOM 1899 CA ARG A 123 17.489 7.143 -4.399 1.00 55.13 C ATOM 1900 C ARG A 123 18.369 7.092 -3.154 1.00 21.45 C ATOM 1901 O ARG A 123 19.595 7.044 -3.250 1.00 41.33 O ATOM 1902 CB ARG A 123 18.043 6.198 -5.467 1.00 4.42 C ATOM 1903 CG ARG A 123 19.338 6.685 -6.095 1.00 32.11 C ATOM 1904 CD ARG A 123 20.309 5.540 -6.333 1.00 30.30 C ATOM 1905 NE ARG A 123 20.232 5.033 -7.700 1.00 24.01 N ATOM 1906 CZ ARG A 123 20.791 5.637 -8.747 1.00 51.14 C ATOM 1907 NH1 ARG A 123 21.465 6.768 -8.586 1.00 21.04 N ATOM 1908 NH2 ARG A 123 20.674 5.108 -9.957 1.00 72.01 N ATOM 0 H ARG A 123 18.046 8.701 -5.685 1.00 41.22 H new ATOM 0 HA ARG A 123 16.485 6.823 -4.122 1.00 55.13 H new ATOM 0 HB2 ARG A 123 18.211 5.218 -5.021 1.00 4.42 H new ATOM 0 HB3 ARG A 123 17.295 6.069 -6.249 1.00 4.42 H new ATOM 0 HG2 ARG A 123 19.120 7.181 -7.041 1.00 32.11 H new ATOM 0 HG3 ARG A 123 19.802 7.427 -5.445 1.00 32.11 H new ATOM 0 HD2 ARG A 123 21.325 5.878 -6.128 1.00 30.30 H new ATOM 0 HD3 ARG A 123 20.095 4.732 -5.634 1.00 30.30 H new ATOM 0 HE ARG A 123 19.720 4.166 -7.863 1.00 24.01 H new ATOM 0 HH11 ARG A 123 21.557 7.179 -7.657 1.00 21.04 H new ATOM 0 HH12 ARG A 123 21.891 7.227 -9.391 1.00 21.04 H new ATOM 0 HH21 ARG A 123 20.156 4.239 -10.086 1.00 72.01 H new ATOM 0 HH22 ARG A 123 21.102 5.570 -10.759 1.00 72.01 H new ATOM 1922 N THR A 124 17.735 7.094 -1.986 1.00 53.05 N ATOM 1923 CA THR A 124 18.463 7.041 -0.725 1.00 2.21 C ATOM 1924 C THR A 124 19.108 5.672 -0.533 1.00 5.12 C ATOM 1925 O THR A 124 20.135 5.546 0.133 1.00 44.54 O ATOM 1926 CB THR A 124 17.524 7.345 0.444 1.00 3.00 C ATOM 1927 OG1 THR A 124 16.466 6.406 0.496 1.00 71.22 O ATOM 1928 CG2 THR A 124 16.908 8.726 0.374 1.00 23.54 C ATOM 0 H THR A 124 16.720 7.132 -1.887 1.00 53.05 H new ATOM 0 HA THR A 124 19.249 7.795 -0.753 1.00 2.21 H new ATOM 0 HB THR A 124 18.147 7.287 1.336 1.00 3.00 H new ATOM 0 HG1 THR A 124 16.476 5.950 1.363 1.00 71.22 H new ATOM 0 HG21 THR A 124 16.253 8.876 1.232 1.00 23.54 H new ATOM 0 HG22 THR A 124 17.697 9.477 0.384 1.00 23.54 H new ATOM 0 HG23 THR A 124 16.329 8.820 -0.545 1.00 23.54 H new ATOM 1936 N VAL A 125 18.497 4.648 -1.123 1.00 71.23 N ATOM 1937 CA VAL A 125 19.005 3.290 -1.023 1.00 23.33 C ATOM 1938 C VAL A 125 19.661 2.858 -2.332 1.00 44.20 C ATOM 1939 O VAL A 125 18.985 2.667 -3.343 1.00 12.23 O ATOM 1940 CB VAL A 125 17.875 2.304 -0.668 1.00 0.14 C ATOM 1941 CG1 VAL A 125 18.393 0.878 -0.641 1.00 73.25 C ATOM 1942 CG2 VAL A 125 17.243 2.674 0.665 1.00 63.44 C ATOM 0 H VAL A 125 17.645 4.738 -1.677 1.00 71.23 H new ATOM 0 HA VAL A 125 19.751 3.277 -0.228 1.00 23.33 H new ATOM 0 HB VAL A 125 17.108 2.370 -1.440 1.00 0.14 H new ATOM 0 HG11 VAL A 125 17.578 0.200 -0.388 1.00 73.25 H new ATOM 0 HG12 VAL A 125 18.792 0.617 -1.621 1.00 73.25 H new ATOM 0 HG13 VAL A 125 19.182 0.792 0.106 1.00 73.25 H new ATOM 0 HG21 VAL A 125 16.447 1.967 0.899 1.00 63.44 H new ATOM 0 HG22 VAL A 125 18.000 2.641 1.448 1.00 63.44 H new ATOM 0 HG23 VAL A 125 16.828 3.680 0.604 1.00 63.44 H new ATOM 1952 N GLU A 126 20.980 2.705 -2.305 1.00 40.43 N ATOM 1953 CA GLU A 126 21.726 2.296 -3.490 1.00 63.00 C ATOM 1954 C GLU A 126 21.237 0.946 -4.004 1.00 31.22 C ATOM 1955 O GLU A 126 20.599 0.186 -3.275 1.00 63.43 O ATOM 1956 CB GLU A 126 23.223 2.223 -3.176 1.00 41.05 C ATOM 1957 CG GLU A 126 23.534 1.529 -1.860 1.00 52.21 C ATOM 1958 CD GLU A 126 24.990 1.118 -1.748 1.00 1.00 C ATOM 1959 OE1 GLU A 126 25.815 1.632 -2.531 1.00 13.21 O ATOM 1960 OE2 GLU A 126 25.304 0.282 -0.874 1.00 34.15 O ATOM 0 H GLU A 126 21.555 2.858 -1.476 1.00 40.43 H new ATOM 0 HA GLU A 126 21.560 3.042 -4.267 1.00 63.00 H new ATOM 0 HB2 GLU A 126 23.730 1.696 -3.984 1.00 41.05 H new ATOM 0 HB3 GLU A 126 23.630 3.234 -3.150 1.00 41.05 H new ATOM 0 HG2 GLU A 126 23.284 2.195 -1.034 1.00 52.21 H new ATOM 0 HG3 GLU A 126 22.902 0.646 -1.761 1.00 52.21 H new ATOM 1967 N SER A 127 21.540 0.654 -5.264 1.00 52.51 N ATOM 1968 CA SER A 127 21.131 -0.604 -5.877 1.00 31.42 C ATOM 1969 C SER A 127 21.843 -1.782 -5.220 1.00 73.43 C ATOM 1970 O SER A 127 21.283 -2.873 -5.106 1.00 50.41 O ATOM 1971 CB SER A 127 21.429 -0.585 -7.377 1.00 72.14 C ATOM 1972 OG SER A 127 22.819 -0.462 -7.621 1.00 72.24 O ATOM 0 H SER A 127 22.068 1.272 -5.881 1.00 52.51 H new ATOM 0 HA SER A 127 20.057 -0.721 -5.729 1.00 31.42 H new ATOM 0 HB2 SER A 127 21.056 -1.500 -7.836 1.00 72.14 H new ATOM 0 HB3 SER A 127 20.900 0.245 -7.845 1.00 72.14 H new ATOM 0 HG SER A 127 22.982 -0.454 -8.587 1.00 72.24 H new ATOM 1978 N ARG A 128 23.079 -1.554 -4.788 1.00 24.00 N ATOM 1979 CA ARG A 128 23.868 -2.595 -4.139 1.00 10.35 C ATOM 1980 C ARG A 128 23.147 -3.130 -2.904 1.00 15.11 C ATOM 1981 O ARG A 128 23.072 -4.340 -2.692 1.00 2.41 O ATOM 1982 CB ARG A 128 25.245 -2.049 -3.750 1.00 24.55 C ATOM 1983 CG ARG A 128 26.085 -3.023 -2.938 1.00 20.45 C ATOM 1984 CD ARG A 128 26.260 -4.349 -3.662 1.00 4.53 C ATOM 1985 NE ARG A 128 27.413 -5.095 -3.163 1.00 24.34 N ATOM 1986 CZ ARG A 128 27.703 -6.342 -3.527 1.00 72.13 C ATOM 1987 NH1 ARG A 128 26.927 -6.986 -4.391 1.00 54.22 N ATOM 1988 NH2 ARG A 128 28.772 -6.947 -3.028 1.00 61.21 N ATOM 0 H ARG A 128 23.556 -0.657 -4.876 1.00 24.00 H new ATOM 0 HA ARG A 128 23.998 -3.416 -4.844 1.00 10.35 H new ATOM 0 HB2 ARG A 128 25.789 -1.783 -4.656 1.00 24.55 H new ATOM 0 HB3 ARG A 128 25.113 -1.132 -3.176 1.00 24.55 H new ATOM 0 HG2 ARG A 128 27.063 -2.584 -2.740 1.00 20.45 H new ATOM 0 HG3 ARG A 128 25.611 -3.195 -1.972 1.00 20.45 H new ATOM 0 HD2 ARG A 128 25.359 -4.950 -3.541 1.00 4.53 H new ATOM 0 HD3 ARG A 128 26.380 -4.166 -4.730 1.00 4.53 H new ATOM 0 HE ARG A 128 28.032 -4.633 -2.497 1.00 24.34 H new ATOM 0 HH11 ARG A 128 26.104 -6.525 -4.779 1.00 54.22 H new ATOM 0 HH12 ARG A 128 27.154 -7.942 -4.666 1.00 54.22 H new ATOM 0 HH21 ARG A 128 29.372 -6.457 -2.365 1.00 61.21 H new ATOM 0 HH22 ARG A 128 28.994 -7.903 -3.307 1.00 61.21 H new ATOM 2002 N GLN A 129 22.619 -2.219 -2.094 1.00 11.53 N ATOM 2003 CA GLN A 129 21.904 -2.598 -0.882 1.00 45.34 C ATOM 2004 C GLN A 129 20.624 -3.353 -1.222 1.00 52.02 C ATOM 2005 O GLN A 129 20.292 -4.352 -0.584 1.00 45.41 O ATOM 2006 CB GLN A 129 21.574 -1.357 -0.050 1.00 2.41 C ATOM 2007 CG GLN A 129 21.506 -1.627 1.444 1.00 3.43 C ATOM 2008 CD GLN A 129 21.278 -0.365 2.254 1.00 34.32 C ATOM 2009 OE1 GLN A 129 20.241 -0.208 2.898 1.00 64.33 O ATOM 2010 NE2 GLN A 129 22.249 0.540 2.226 1.00 51.20 N ATOM 0 H GLN A 129 22.673 -1.213 -2.255 1.00 11.53 H new ATOM 0 HA GLN A 129 22.549 -3.255 -0.299 1.00 45.34 H new ATOM 0 HB2 GLN A 129 22.328 -0.592 -0.239 1.00 2.41 H new ATOM 0 HB3 GLN A 129 20.618 -0.951 -0.381 1.00 2.41 H new ATOM 0 HG2 GLN A 129 20.701 -2.334 1.646 1.00 3.43 H new ATOM 0 HG3 GLN A 129 22.434 -2.099 1.767 1.00 3.43 H new ATOM 0 HE21 GLN A 129 23.092 0.367 1.678 1.00 51.20 H new ATOM 0 HE22 GLN A 129 22.152 1.408 2.753 1.00 51.20 H new ATOM 2019 N ALA A 130 19.910 -2.869 -2.233 1.00 51.23 N ATOM 2020 CA ALA A 130 18.666 -3.498 -2.660 1.00 43.12 C ATOM 2021 C ALA A 130 18.928 -4.875 -3.260 1.00 11.42 C ATOM 2022 O ALA A 130 18.240 -5.844 -2.939 1.00 32.20 O ATOM 2023 CB ALA A 130 17.944 -2.611 -3.663 1.00 10.12 C ATOM 0 H ALA A 130 20.172 -2.043 -2.772 1.00 51.23 H new ATOM 0 HA ALA A 130 18.031 -3.627 -1.783 1.00 43.12 H new ATOM 0 HB1 ALA A 130 17.017 -3.093 -3.973 1.00 10.12 H new ATOM 0 HB2 ALA A 130 17.717 -1.650 -3.201 1.00 10.12 H new ATOM 0 HB3 ALA A 130 18.580 -2.454 -4.534 1.00 10.12 H new ATOM 2029 N GLN A 131 19.927 -4.954 -4.133 1.00 43.43 N ATOM 2030 CA GLN A 131 20.280 -6.214 -4.777 1.00 0.02 C ATOM 2031 C GLN A 131 20.833 -7.207 -3.761 1.00 73.23 C ATOM 2032 O GLN A 131 20.585 -8.410 -3.854 1.00 43.15 O ATOM 2033 CB GLN A 131 21.307 -5.973 -5.886 1.00 10.13 C ATOM 2034 CG GLN A 131 20.684 -5.777 -7.258 1.00 61.13 C ATOM 2035 CD GLN A 131 21.110 -6.843 -8.251 1.00 34.32 C ATOM 2036 OE1 GLN A 131 22.045 -6.647 -9.025 1.00 71.45 O ATOM 2037 NE2 GLN A 131 20.421 -7.979 -8.230 1.00 25.14 N ATOM 0 H GLN A 131 20.506 -4.161 -4.411 1.00 43.43 H new ATOM 0 HA GLN A 131 19.376 -6.637 -5.215 1.00 0.02 H new ATOM 0 HB2 GLN A 131 21.900 -5.093 -5.636 1.00 10.13 H new ATOM 0 HB3 GLN A 131 21.993 -6.819 -5.925 1.00 10.13 H new ATOM 0 HG2 GLN A 131 19.598 -5.786 -7.164 1.00 61.13 H new ATOM 0 HG3 GLN A 131 20.962 -4.796 -7.642 1.00 61.13 H new ATOM 0 HE21 GLN A 131 19.652 -8.097 -7.570 1.00 25.14 H new ATOM 0 HE22 GLN A 131 20.661 -8.733 -8.874 1.00 25.14 H new ATOM 2046 N ASP A 132 21.582 -6.697 -2.789 1.00 23.43 N ATOM 2047 CA ASP A 132 22.169 -7.539 -1.753 1.00 53.15 C ATOM 2048 C ASP A 132 21.084 -8.279 -0.978 1.00 64.42 C ATOM 2049 O ASP A 132 21.261 -9.435 -0.591 1.00 62.11 O ATOM 2050 CB ASP A 132 23.008 -6.693 -0.794 1.00 22.01 C ATOM 2051 CG ASP A 132 23.850 -7.540 0.140 1.00 22.34 C ATOM 2052 OD1 ASP A 132 23.478 -8.708 0.381 1.00 54.23 O ATOM 2053 OD2 ASP A 132 24.882 -7.035 0.630 1.00 50.11 O ATOM 0 H ASP A 132 21.797 -5.704 -2.697 1.00 23.43 H new ATOM 0 HA ASP A 132 22.813 -8.274 -2.237 1.00 53.15 H new ATOM 0 HB2 ASP A 132 23.659 -6.035 -1.369 1.00 22.01 H new ATOM 0 HB3 ASP A 132 22.349 -6.054 -0.206 1.00 22.01 H new ATOM 2058 N LEU A 133 19.959 -7.606 -0.759 1.00 53.31 N ATOM 2059 CA LEU A 133 18.843 -8.201 -0.035 1.00 61.41 C ATOM 2060 C LEU A 133 18.087 -9.186 -0.921 1.00 60.43 C ATOM 2061 O LEU A 133 17.847 -10.330 -0.533 1.00 34.14 O ATOM 2062 CB LEU A 133 17.891 -7.110 0.462 1.00 74.42 C ATOM 2063 CG LEU A 133 16.616 -7.619 1.136 1.00 14.54 C ATOM 2064 CD1 LEU A 133 16.924 -8.154 2.526 1.00 43.30 C ATOM 2065 CD2 LEU A 133 15.573 -6.514 1.205 1.00 0.12 C ATOM 0 H LEU A 133 19.797 -6.649 -1.073 1.00 53.31 H new ATOM 0 HA LEU A 133 19.243 -8.742 0.822 1.00 61.41 H new ATOM 0 HB2 LEU A 133 18.427 -6.475 1.167 1.00 74.42 H new ATOM 0 HB3 LEU A 133 17.611 -6.482 -0.383 1.00 74.42 H new ATOM 0 HG LEU A 133 16.212 -8.435 0.538 1.00 14.54 H new ATOM 0 HD11 LEU A 133 16.005 -8.512 2.990 1.00 43.30 H new ATOM 0 HD12 LEU A 133 17.636 -8.976 2.450 1.00 43.30 H new ATOM 0 HD13 LEU A 133 17.352 -7.358 3.135 1.00 43.30 H new ATOM 0 HD21 LEU A 133 14.672 -6.893 1.687 1.00 0.12 H new ATOM 0 HD22 LEU A 133 15.968 -5.677 1.781 1.00 0.12 H new ATOM 0 HD23 LEU A 133 15.331 -6.179 0.196 1.00 0.12 H new ATOM 2077 N ALA A 134 17.714 -8.734 -2.113 1.00 50.42 N ATOM 2078 CA ALA A 134 16.985 -9.572 -3.057 1.00 52.43 C ATOM 2079 C ALA A 134 17.807 -10.794 -3.454 1.00 60.45 C ATOM 2080 O ALA A 134 17.287 -11.907 -3.531 1.00 1.42 O ATOM 2081 CB ALA A 134 16.604 -8.767 -4.291 1.00 34.04 C ATOM 0 H ALA A 134 17.905 -7.790 -2.449 1.00 50.42 H new ATOM 0 HA ALA A 134 16.075 -9.921 -2.568 1.00 52.43 H new ATOM 0 HB1 ALA A 134 16.060 -9.405 -4.988 1.00 34.04 H new ATOM 0 HB2 ALA A 134 15.972 -7.929 -3.998 1.00 34.04 H new ATOM 0 HB3 ALA A 134 17.506 -8.390 -4.773 1.00 34.04 H new ATOM 2087 N ARG A 135 19.094 -10.578 -3.708 1.00 63.12 N ATOM 2088 CA ARG A 135 19.990 -11.661 -4.098 1.00 20.25 C ATOM 2089 C ARG A 135 20.101 -12.709 -2.995 1.00 53.42 C ATOM 2090 O ARG A 135 20.357 -13.882 -3.264 1.00 5.51 O ATOM 2091 CB ARG A 135 21.376 -11.106 -4.432 1.00 62.02 C ATOM 2092 CG ARG A 135 22.372 -12.171 -4.862 1.00 12.21 C ATOM 2093 CD ARG A 135 23.477 -11.584 -5.725 1.00 22.42 C ATOM 2094 NE ARG A 135 24.782 -12.160 -5.408 1.00 15.55 N ATOM 2095 CZ ARG A 135 25.468 -11.879 -4.302 1.00 41.24 C ATOM 2096 NH1 ARG A 135 24.978 -11.028 -3.408 1.00 74.52 N ATOM 2097 NH2 ARG A 135 26.645 -12.449 -4.089 1.00 12.52 N ATOM 0 H ARG A 135 19.540 -9.662 -3.651 1.00 63.12 H new ATOM 0 HA ARG A 135 19.572 -12.141 -4.983 1.00 20.25 H new ATOM 0 HB2 ARG A 135 21.280 -10.368 -5.228 1.00 62.02 H new ATOM 0 HB3 ARG A 135 21.769 -10.584 -3.559 1.00 62.02 H new ATOM 0 HG2 ARG A 135 22.808 -12.640 -3.980 1.00 12.21 H new ATOM 0 HG3 ARG A 135 21.853 -12.954 -5.416 1.00 12.21 H new ATOM 0 HD2 ARG A 135 23.248 -11.760 -6.776 1.00 22.42 H new ATOM 0 HD3 ARG A 135 23.513 -10.504 -5.583 1.00 22.42 H new ATOM 0 HE ARG A 135 25.192 -12.816 -6.073 1.00 15.55 H new ATOM 0 HH11 ARG A 135 24.072 -10.586 -3.567 1.00 74.52 H new ATOM 0 HH12 ARG A 135 25.507 -10.816 -2.562 1.00 74.52 H new ATOM 0 HH21 ARG A 135 27.026 -13.103 -4.772 1.00 12.52 H new ATOM 0 HH22 ARG A 135 27.170 -12.233 -3.242 1.00 12.52 H new ATOM 2111 N SER A 136 19.906 -12.279 -1.752 1.00 44.33 N ATOM 2112 CA SER A 136 19.983 -13.183 -0.611 1.00 44.43 C ATOM 2113 C SER A 136 18.740 -14.063 -0.533 1.00 34.12 C ATOM 2114 O SER A 136 18.799 -15.200 -0.064 1.00 23.15 O ATOM 2115 CB SER A 136 20.146 -12.389 0.686 1.00 73.15 C ATOM 2116 OG SER A 136 21.181 -12.928 1.489 1.00 34.40 O ATOM 0 H SER A 136 19.694 -11.311 -1.510 1.00 44.33 H new ATOM 0 HA SER A 136 20.853 -13.826 -0.744 1.00 44.43 H new ATOM 0 HB2 SER A 136 20.368 -11.348 0.453 1.00 73.15 H new ATOM 0 HB3 SER A 136 19.208 -12.398 1.242 1.00 73.15 H new ATOM 0 HG SER A 136 21.265 -12.401 2.311 1.00 34.40 H new ATOM 2122 N TYR A 137 17.616 -13.528 -0.996 1.00 33.01 N ATOM 2123 CA TYR A 137 16.356 -14.261 -0.982 1.00 70.42 C ATOM 2124 C TYR A 137 16.214 -15.146 -2.220 1.00 73.31 C ATOM 2125 O TYR A 137 15.307 -15.974 -2.299 1.00 21.15 O ATOM 2126 CB TYR A 137 15.180 -13.286 -0.898 1.00 25.11 C ATOM 2127 CG TYR A 137 15.151 -12.476 0.379 1.00 53.32 C ATOM 2128 CD1 TYR A 137 15.476 -13.054 1.600 1.00 62.32 C ATOM 2129 CD2 TYR A 137 14.800 -11.132 0.362 1.00 53.23 C ATOM 2130 CE1 TYR A 137 15.450 -12.316 2.767 1.00 33.14 C ATOM 2131 CE2 TYR A 137 14.771 -10.387 1.526 1.00 50.44 C ATOM 2132 CZ TYR A 137 15.098 -10.983 2.725 1.00 44.53 C ATOM 2133 OH TYR A 137 15.071 -10.245 3.886 1.00 52.22 O ATOM 0 H TYR A 137 17.552 -12.588 -1.386 1.00 33.01 H new ATOM 0 HA TYR A 137 16.353 -14.906 -0.103 1.00 70.42 H new ATOM 0 HB2 TYR A 137 15.222 -12.605 -1.748 1.00 25.11 H new ATOM 0 HB3 TYR A 137 14.249 -13.846 -0.984 1.00 25.11 H new ATOM 0 HD1 TYR A 137 15.753 -14.097 1.637 1.00 62.32 H new ATOM 0 HD2 TYR A 137 14.546 -10.661 -0.576 1.00 53.23 H new ATOM 0 HE1 TYR A 137 15.704 -12.781 3.708 1.00 33.14 H new ATOM 0 HE2 TYR A 137 14.494 -9.344 1.496 1.00 50.44 H new ATOM 0 HH TYR A 137 15.038 -10.849 4.657 1.00 52.22 H new ATOM 2143 N GLY A 138 17.112 -14.967 -3.186 1.00 42.21 N ATOM 2144 CA GLY A 138 17.059 -15.759 -4.401 1.00 60.35 C ATOM 2145 C GLY A 138 15.910 -15.355 -5.303 1.00 50.31 C ATOM 2146 O GLY A 138 15.439 -16.151 -6.115 1.00 35.12 O ATOM 0 H GLY A 138 17.873 -14.289 -3.148 1.00 42.21 H new ATOM 0 HA2 GLY A 138 17.998 -15.651 -4.943 1.00 60.35 H new ATOM 0 HA3 GLY A 138 16.960 -16.813 -4.141 1.00 60.35 H new ATOM 2150 N ILE A 139 15.457 -14.114 -5.159 1.00 1.32 N ATOM 2151 CA ILE A 139 14.354 -13.603 -5.965 1.00 54.01 C ATOM 2152 C ILE A 139 14.813 -12.489 -6.899 1.00 45.14 C ATOM 2153 O ILE A 139 15.827 -11.836 -6.650 1.00 10.04 O ATOM 2154 CB ILE A 139 13.213 -13.079 -5.088 1.00 50.30 C ATOM 2155 CG1 ILE A 139 13.765 -12.261 -3.929 1.00 24.50 C ATOM 2156 CG2 ILE A 139 12.374 -14.237 -4.573 1.00 35.23 C ATOM 2157 CD1 ILE A 139 12.687 -11.686 -3.052 1.00 41.41 C ATOM 0 H ILE A 139 15.837 -13.443 -4.491 1.00 1.32 H new ATOM 0 HA ILE A 139 13.992 -14.441 -6.560 1.00 54.01 H new ATOM 0 HB ILE A 139 12.577 -12.431 -5.691 1.00 50.30 H new ATOM 0 HG12 ILE A 139 14.419 -12.890 -3.326 1.00 24.50 H new ATOM 0 HG13 ILE A 139 14.377 -11.450 -4.323 1.00 24.50 H new ATOM 0 HG21 ILE A 139 11.566 -13.852 -3.951 1.00 35.23 H new ATOM 0 HG22 ILE A 139 11.953 -14.785 -5.416 1.00 35.23 H new ATOM 0 HG23 ILE A 139 13.000 -14.905 -3.982 1.00 35.23 H new ATOM 0 HD11 ILE A 139 13.142 -11.114 -2.244 1.00 41.41 H new ATOM 0 HD12 ILE A 139 12.047 -11.032 -3.644 1.00 41.41 H new ATOM 0 HD13 ILE A 139 12.090 -12.495 -2.632 1.00 41.41 H new ATOM 2169 N PRO A 140 14.067 -12.253 -7.990 1.00 14.25 N ATOM 2170 CA PRO A 140 14.399 -11.209 -8.962 1.00 33.24 C ATOM 2171 C PRO A 140 14.117 -9.812 -8.423 1.00 42.11 C ATOM 2172 O PRO A 140 13.189 -9.613 -7.638 1.00 14.43 O ATOM 2173 CB PRO A 140 13.482 -11.523 -10.144 1.00 73.01 C ATOM 2174 CG PRO A 140 12.309 -12.209 -9.537 1.00 64.44 C ATOM 2175 CD PRO A 140 12.839 -12.986 -8.361 1.00 43.34 C ATOM 0 HA PRO A 140 15.459 -11.208 -9.218 1.00 33.24 H new ATOM 0 HB2 PRO A 140 13.183 -10.614 -10.666 1.00 73.01 H new ATOM 0 HB3 PRO A 140 13.980 -12.161 -10.874 1.00 73.01 H new ATOM 0 HG2 PRO A 140 11.557 -11.487 -9.219 1.00 64.44 H new ATOM 0 HG3 PRO A 140 11.830 -12.872 -10.258 1.00 64.44 H new ATOM 0 HD2 PRO A 140 12.122 -13.010 -7.540 1.00 43.34 H new ATOM 0 HD3 PRO A 140 13.054 -14.021 -8.627 1.00 43.34 H new ATOM 2183 N TYR A 141 14.924 -8.846 -8.847 1.00 63.10 N ATOM 2184 CA TYR A 141 14.761 -7.465 -8.406 1.00 42.32 C ATOM 2185 C TYR A 141 14.425 -6.557 -9.586 1.00 10.11 C ATOM 2186 O TYR A 141 15.298 -6.193 -10.372 1.00 3.20 O ATOM 2187 CB TYR A 141 16.036 -6.981 -7.707 1.00 34.35 C ATOM 2188 CG TYR A 141 16.049 -5.497 -7.409 1.00 63.50 C ATOM 2189 CD1 TYR A 141 14.954 -4.876 -6.822 1.00 33.33 C ATOM 2190 CD2 TYR A 141 17.158 -4.719 -7.716 1.00 30.44 C ATOM 2191 CE1 TYR A 141 14.964 -3.522 -6.549 1.00 21.25 C ATOM 2192 CE2 TYR A 141 17.176 -3.364 -7.445 1.00 31.42 C ATOM 2193 CZ TYR A 141 16.077 -2.770 -6.862 1.00 3.34 C ATOM 2194 OH TYR A 141 16.090 -1.421 -6.592 1.00 51.42 O ATOM 0 H TYR A 141 15.698 -8.993 -9.495 1.00 63.10 H new ATOM 0 HA TYR A 141 13.933 -7.424 -7.698 1.00 42.32 H new ATOM 0 HB2 TYR A 141 16.157 -7.530 -6.773 1.00 34.35 H new ATOM 0 HB3 TYR A 141 16.895 -7.223 -8.332 1.00 34.35 H new ATOM 0 HD1 TYR A 141 14.081 -5.461 -6.575 1.00 33.33 H new ATOM 0 HD2 TYR A 141 18.020 -5.181 -8.174 1.00 30.44 H new ATOM 0 HE1 TYR A 141 14.104 -3.054 -6.093 1.00 21.25 H new ATOM 0 HE2 TYR A 141 18.047 -2.773 -7.689 1.00 31.42 H new ATOM 0 HH TYR A 141 16.948 -1.039 -6.873 1.00 51.42 H new ATOM 2204 N ILE A 142 13.150 -6.198 -9.703 1.00 10.34 N ATOM 2205 CA ILE A 142 12.694 -5.335 -10.784 1.00 53.42 C ATOM 2206 C ILE A 142 12.430 -3.920 -10.285 1.00 14.33 C ATOM 2207 O ILE A 142 12.070 -3.718 -9.124 1.00 55.12 O ATOM 2208 CB ILE A 142 11.409 -5.885 -11.434 1.00 2.11 C ATOM 2209 CG1 ILE A 142 11.580 -7.364 -11.785 1.00 73.21 C ATOM 2210 CG2 ILE A 142 11.055 -5.076 -12.673 1.00 44.51 C ATOM 2211 CD1 ILE A 142 10.852 -8.297 -10.842 1.00 73.41 C ATOM 0 H ILE A 142 12.414 -6.493 -9.061 1.00 10.34 H new ATOM 0 HA ILE A 142 13.490 -5.311 -11.528 1.00 53.42 H new ATOM 0 HB ILE A 142 10.591 -5.795 -10.720 1.00 2.11 H new ATOM 0 HG12 ILE A 142 11.220 -7.532 -12.800 1.00 73.21 H new ATOM 0 HG13 ILE A 142 12.642 -7.610 -11.779 1.00 73.21 H new ATOM 0 HG21 ILE A 142 10.146 -5.476 -13.121 1.00 44.51 H new ATOM 0 HG22 ILE A 142 10.894 -4.035 -12.394 1.00 44.51 H new ATOM 0 HG23 ILE A 142 11.871 -5.137 -13.393 1.00 44.51 H new ATOM 0 HD11 ILE A 142 11.018 -9.329 -11.151 1.00 73.41 H new ATOM 0 HD12 ILE A 142 11.229 -8.157 -9.829 1.00 73.41 H new ATOM 0 HD13 ILE A 142 9.784 -8.078 -10.866 1.00 73.41 H new ATOM 2223 N GLU A 143 12.609 -2.942 -11.166 1.00 62.35 N ATOM 2224 CA GLU A 143 12.387 -1.544 -10.816 1.00 55.22 C ATOM 2225 C GLU A 143 11.297 -0.932 -11.689 1.00 15.32 C ATOM 2226 O GLU A 143 11.331 -1.049 -12.914 1.00 64.13 O ATOM 2227 CB GLU A 143 13.684 -0.747 -10.964 1.00 61.23 C ATOM 2228 CG GLU A 143 14.748 -1.122 -9.946 1.00 32.12 C ATOM 2229 CD GLU A 143 16.142 -1.143 -10.541 1.00 12.42 C ATOM 2230 OE1 GLU A 143 16.711 -0.051 -10.759 1.00 74.21 O ATOM 2231 OE2 GLU A 143 16.666 -2.249 -10.790 1.00 24.34 O ATOM 0 H GLU A 143 12.908 -3.092 -12.130 1.00 62.35 H new ATOM 0 HA GLU A 143 12.061 -1.503 -9.777 1.00 55.22 H new ATOM 0 HB2 GLU A 143 14.082 -0.900 -11.967 1.00 61.23 H new ATOM 0 HB3 GLU A 143 13.461 0.316 -10.869 1.00 61.23 H new ATOM 0 HG2 GLU A 143 14.721 -0.412 -9.119 1.00 32.12 H new ATOM 0 HG3 GLU A 143 14.519 -2.104 -9.531 1.00 32.12 H new ATOM 2238 N THR A 144 10.329 -0.283 -11.051 1.00 42.22 N ATOM 2239 CA THR A 144 9.229 0.345 -11.773 1.00 12.30 C ATOM 2240 C THR A 144 8.951 1.746 -11.240 1.00 21.15 C ATOM 2241 O THR A 144 9.639 2.227 -10.340 1.00 24.10 O ATOM 2242 CB THR A 144 7.967 -0.513 -11.667 1.00 32.13 C ATOM 2243 OG1 THR A 144 7.419 -0.437 -10.363 1.00 63.11 O ATOM 2244 CG2 THR A 144 8.207 -1.973 -11.980 1.00 70.54 C ATOM 0 H THR A 144 10.284 -0.178 -10.037 1.00 42.22 H new ATOM 0 HA THR A 144 9.519 0.428 -12.820 1.00 12.30 H new ATOM 0 HB THR A 144 7.279 -0.109 -12.410 1.00 32.13 H new ATOM 0 HG1 THR A 144 6.711 -1.108 -10.266 1.00 63.11 H new ATOM 0 HG21 THR A 144 7.271 -2.524 -11.886 1.00 70.54 H new ATOM 0 HG22 THR A 144 8.584 -2.070 -12.998 1.00 70.54 H new ATOM 0 HG23 THR A 144 8.939 -2.379 -11.282 1.00 70.54 H new ATOM 2252 N SER A 145 7.936 2.393 -11.802 1.00 41.25 N ATOM 2253 CA SER A 145 7.559 3.739 -11.389 1.00 70.42 C ATOM 2254 C SER A 145 6.075 3.981 -11.636 1.00 61.11 C ATOM 2255 O SER A 145 5.611 3.930 -12.775 1.00 53.21 O ATOM 2256 CB SER A 145 8.391 4.779 -12.140 1.00 25.02 C ATOM 2257 OG SER A 145 8.278 4.607 -13.542 1.00 61.24 O ATOM 0 H SER A 145 7.358 2.005 -12.547 1.00 41.25 H new ATOM 0 HA SER A 145 7.754 3.835 -10.321 1.00 70.42 H new ATOM 0 HB2 SER A 145 8.060 5.781 -11.866 1.00 25.02 H new ATOM 0 HB3 SER A 145 9.437 4.696 -11.843 1.00 25.02 H new ATOM 0 HG SER A 145 8.190 5.483 -13.973 1.00 61.24 H new ATOM 2263 N ALA A 146 5.334 4.241 -10.566 1.00 51.20 N ATOM 2264 CA ALA A 146 3.902 4.488 -10.671 1.00 1.41 C ATOM 2265 C ALA A 146 3.618 5.874 -11.239 1.00 21.05 C ATOM 2266 O ALA A 146 2.557 6.113 -11.815 1.00 12.32 O ATOM 2267 CB ALA A 146 3.239 4.325 -9.312 1.00 63.24 C ATOM 0 H ALA A 146 5.701 4.286 -9.616 1.00 51.20 H new ATOM 0 HA ALA A 146 3.483 3.754 -11.359 1.00 1.41 H new ATOM 0 HB1 ALA A 146 2.169 4.512 -9.404 1.00 63.24 H new ATOM 0 HB2 ALA A 146 3.400 3.310 -8.948 1.00 63.24 H new ATOM 0 HB3 ALA A 146 3.672 5.036 -8.608 1.00 63.24 H new ATOM 2273 N LYS A 147 4.571 6.787 -11.074 1.00 61.13 N ATOM 2274 CA LYS A 147 4.418 8.149 -11.572 1.00 24.40 C ATOM 2275 C LYS A 147 4.619 8.204 -13.085 1.00 13.22 C ATOM 2276 O LYS A 147 3.777 8.730 -13.812 1.00 41.45 O ATOM 2277 CB LYS A 147 5.414 9.083 -10.879 1.00 55.25 C ATOM 2278 CG LYS A 147 5.011 10.549 -10.930 1.00 70.31 C ATOM 2279 CD LYS A 147 3.971 10.879 -9.873 1.00 2.33 C ATOM 2280 CE LYS A 147 3.981 12.358 -9.521 1.00 14.14 C ATOM 2281 NZ LYS A 147 4.047 12.579 -8.048 1.00 53.53 N ATOM 0 H LYS A 147 5.456 6.608 -10.600 1.00 61.13 H new ATOM 0 HA LYS A 147 3.404 8.478 -11.347 1.00 24.40 H new ATOM 0 HB2 LYS A 147 5.519 8.780 -9.837 1.00 55.25 H new ATOM 0 HB3 LYS A 147 6.393 8.967 -11.345 1.00 55.25 H new ATOM 0 HG2 LYS A 147 5.891 11.175 -10.783 1.00 70.31 H new ATOM 0 HG3 LYS A 147 4.614 10.784 -11.918 1.00 70.31 H new ATOM 0 HD2 LYS A 147 2.982 10.597 -10.234 1.00 2.33 H new ATOM 0 HD3 LYS A 147 4.163 10.290 -8.976 1.00 2.33 H new ATOM 0 HE2 LYS A 147 4.835 12.839 -9.999 1.00 14.14 H new ATOM 0 HE3 LYS A 147 3.084 12.832 -9.919 1.00 14.14 H new ATOM 0 HZ1 LYS A 147 4.052 13.600 -7.850 1.00 53.53 H new ATOM 0 HZ2 LYS A 147 3.220 12.142 -7.594 1.00 53.53 H new ATOM 0 HZ3 LYS A 147 4.916 12.149 -7.671 1.00 53.53 H new ATOM 2295 N THR A 148 5.739 7.660 -13.551 1.00 5.41 N ATOM 2296 CA THR A 148 6.049 7.655 -14.977 1.00 34.32 C ATOM 2297 C THR A 148 5.516 6.395 -15.662 1.00 25.43 C ATOM 2298 O THR A 148 5.421 6.343 -16.888 1.00 42.30 O ATOM 2299 CB THR A 148 7.559 7.760 -15.193 1.00 51.14 C ATOM 2300 OG1 THR A 148 8.262 7.048 -14.191 1.00 41.22 O ATOM 2301 CG2 THR A 148 8.068 9.185 -15.187 1.00 42.35 C ATOM 0 H THR A 148 6.446 7.218 -12.963 1.00 5.41 H new ATOM 0 HA THR A 148 5.558 8.520 -15.424 1.00 34.32 H new ATOM 0 HB THR A 148 7.738 7.332 -16.179 1.00 51.14 H new ATOM 0 HG1 THR A 148 9.210 6.991 -14.434 1.00 41.22 H new ATOM 0 HG21 THR A 148 9.146 9.187 -15.345 1.00 42.35 H new ATOM 0 HG22 THR A 148 7.583 9.748 -15.985 1.00 42.35 H new ATOM 0 HG23 THR A 148 7.842 9.648 -14.227 1.00 42.35 H new ATOM 2309 N ARG A 149 5.175 5.382 -14.871 1.00 30.31 N ATOM 2310 CA ARG A 149 4.659 4.128 -15.417 1.00 61.41 C ATOM 2311 C ARG A 149 5.720 3.434 -16.263 1.00 55.05 C ATOM 2312 O ARG A 149 5.607 3.364 -17.488 1.00 51.13 O ATOM 2313 CB ARG A 149 3.405 4.385 -16.257 1.00 1.12 C ATOM 2314 CG ARG A 149 2.503 3.167 -16.391 1.00 54.05 C ATOM 2315 CD ARG A 149 2.654 2.506 -17.752 1.00 35.43 C ATOM 2316 NE ARG A 149 1.854 1.286 -17.859 1.00 12.33 N ATOM 2317 CZ ARG A 149 1.581 0.677 -19.010 1.00 45.24 C ATOM 2318 NH1 ARG A 149 2.039 1.168 -20.155 1.00 42.52 N ATOM 2319 NH2 ARG A 149 0.846 -0.428 -19.017 1.00 34.04 N ATOM 0 H ARG A 149 5.246 5.403 -13.854 1.00 30.31 H new ATOM 0 HA ARG A 149 4.396 3.477 -14.583 1.00 61.41 H new ATOM 0 HB2 ARG A 149 2.837 5.200 -15.808 1.00 1.12 H new ATOM 0 HB3 ARG A 149 3.705 4.716 -17.251 1.00 1.12 H new ATOM 0 HG2 ARG A 149 2.743 2.448 -15.608 1.00 54.05 H new ATOM 0 HG3 ARG A 149 1.465 3.464 -16.243 1.00 54.05 H new ATOM 0 HD2 ARG A 149 2.353 3.207 -18.531 1.00 35.43 H new ATOM 0 HD3 ARG A 149 3.703 2.268 -17.925 1.00 35.43 H new ATOM 0 HE ARG A 149 1.484 0.878 -17.001 1.00 12.33 H new ATOM 0 HH11 ARG A 149 2.604 2.017 -20.156 1.00 42.52 H new ATOM 0 HH12 ARG A 149 1.826 0.696 -21.034 1.00 42.52 H new ATOM 0 HH21 ARG A 149 0.491 -0.810 -18.140 1.00 34.04 H new ATOM 0 HH22 ARG A 149 0.636 -0.895 -19.899 1.00 34.04 H new ATOM 2333 N GLN A 150 6.755 2.923 -15.604 1.00 20.23 N ATOM 2334 CA GLN A 150 7.839 2.237 -16.296 1.00 43.22 C ATOM 2335 C GLN A 150 8.002 0.810 -15.781 1.00 53.41 C ATOM 2336 O GLN A 150 8.181 0.588 -14.584 1.00 2.53 O ATOM 2337 CB GLN A 150 9.149 3.007 -16.119 1.00 43.42 C ATOM 2338 CG GLN A 150 10.341 2.347 -16.795 1.00 31.41 C ATOM 2339 CD GLN A 150 10.989 3.237 -17.836 1.00 2.21 C ATOM 2340 OE1 GLN A 150 10.828 3.026 -19.038 1.00 22.41 O ATOM 2341 NE2 GLN A 150 11.730 4.238 -17.378 1.00 74.50 N ATOM 0 H GLN A 150 6.865 2.971 -14.591 1.00 20.23 H new ATOM 0 HA GLN A 150 7.588 2.193 -17.356 1.00 43.22 H new ATOM 0 HB2 GLN A 150 9.026 4.013 -16.520 1.00 43.42 H new ATOM 0 HB3 GLN A 150 9.358 3.111 -15.054 1.00 43.42 H new ATOM 0 HG2 GLN A 150 11.080 2.081 -16.040 1.00 31.41 H new ATOM 0 HG3 GLN A 150 10.018 1.419 -17.267 1.00 31.41 H new ATOM 0 HE21 GLN A 150 11.836 4.376 -16.373 1.00 74.50 H new ATOM 0 HE22 GLN A 150 12.194 4.870 -18.031 1.00 74.50 H new ATOM 2350 N GLY A 151 7.940 -0.154 -16.694 1.00 23.54 N ATOM 2351 CA GLY A 151 8.085 -1.549 -16.319 1.00 63.33 C ATOM 2352 C GLY A 151 7.155 -1.957 -15.192 1.00 72.31 C ATOM 2353 O GLY A 151 7.446 -2.893 -14.448 1.00 22.23 O ATOM 0 H GLY A 151 7.791 0.007 -17.690 1.00 23.54 H new ATOM 0 HA2 GLY A 151 7.890 -2.176 -17.189 1.00 63.33 H new ATOM 0 HA3 GLY A 151 9.116 -1.734 -16.017 1.00 63.33 H new ATOM 2357 N VAL A 152 6.035 -1.254 -15.067 1.00 40.31 N ATOM 2358 CA VAL A 152 5.060 -1.550 -14.023 1.00 30.14 C ATOM 2359 C VAL A 152 4.553 -2.983 -14.131 1.00 31.53 C ATOM 2360 O VAL A 152 4.621 -3.752 -13.172 1.00 12.11 O ATOM 2361 CB VAL A 152 3.860 -0.588 -14.090 1.00 22.31 C ATOM 2362 CG1 VAL A 152 2.944 -0.787 -12.892 1.00 60.04 C ATOM 2363 CG2 VAL A 152 4.338 0.855 -14.172 1.00 42.21 C ATOM 0 H VAL A 152 5.779 -0.476 -15.675 1.00 40.31 H new ATOM 0 HA VAL A 152 5.570 -1.421 -13.069 1.00 30.14 H new ATOM 0 HB VAL A 152 3.290 -0.811 -14.992 1.00 22.31 H new ATOM 0 HG11 VAL A 152 2.102 -0.097 -12.959 1.00 60.04 H new ATOM 0 HG12 VAL A 152 2.573 -1.812 -12.884 1.00 60.04 H new ATOM 0 HG13 VAL A 152 3.499 -0.594 -11.974 1.00 60.04 H new ATOM 0 HG21 VAL A 152 3.477 1.521 -14.219 1.00 42.21 H new ATOM 0 HG22 VAL A 152 4.933 1.092 -13.290 1.00 42.21 H new ATOM 0 HG23 VAL A 152 4.947 0.986 -15.066 1.00 42.21 H new ATOM 2373 N GLU A 153 4.043 -3.335 -15.306 1.00 51.41 N ATOM 2374 CA GLU A 153 3.521 -4.677 -15.542 1.00 2.15 C ATOM 2375 C GLU A 153 4.632 -5.721 -15.461 1.00 64.34 C ATOM 2376 O GLU A 153 4.383 -6.880 -15.130 1.00 31.44 O ATOM 2377 CB GLU A 153 2.840 -4.748 -16.910 1.00 12.13 C ATOM 2378 CG GLU A 153 1.928 -3.567 -17.199 1.00 41.34 C ATOM 2379 CD GLU A 153 1.040 -3.799 -18.406 1.00 52.23 C ATOM 2380 OE1 GLU A 153 1.550 -4.297 -19.431 1.00 63.05 O ATOM 2381 OE2 GLU A 153 -0.166 -3.484 -18.326 1.00 14.55 O ATOM 0 H GLU A 153 3.980 -2.710 -16.110 1.00 51.41 H new ATOM 0 HA GLU A 153 2.788 -4.894 -14.765 1.00 2.15 H new ATOM 0 HB2 GLU A 153 3.605 -4.803 -17.685 1.00 12.13 H new ATOM 0 HB3 GLU A 153 2.259 -5.668 -16.970 1.00 12.13 H new ATOM 0 HG2 GLU A 153 1.305 -3.371 -16.326 1.00 41.34 H new ATOM 0 HG3 GLU A 153 2.534 -2.676 -17.364 1.00 41.34 H new ATOM 2388 N ASP A 154 5.858 -5.304 -15.767 1.00 70.02 N ATOM 2389 CA ASP A 154 7.005 -6.206 -15.729 1.00 13.01 C ATOM 2390 C ASP A 154 7.170 -6.825 -14.345 1.00 43.14 C ATOM 2391 O ASP A 154 7.173 -8.046 -14.197 1.00 22.05 O ATOM 2392 CB ASP A 154 8.282 -5.460 -16.120 1.00 1.32 C ATOM 2393 CG ASP A 154 8.221 -4.905 -17.530 1.00 1.25 C ATOM 2394 OD1 ASP A 154 7.304 -5.295 -18.285 1.00 1.42 O ATOM 2395 OD2 ASP A 154 9.090 -4.079 -17.881 1.00 10.55 O ATOM 0 H ASP A 154 6.082 -4.348 -16.044 1.00 70.02 H new ATOM 0 HA ASP A 154 6.825 -7.007 -16.446 1.00 13.01 H new ATOM 0 HB2 ASP A 154 8.451 -4.643 -15.418 1.00 1.32 H new ATOM 0 HB3 ASP A 154 9.134 -6.135 -16.035 1.00 1.32 H new ATOM 2400 N ALA A 155 7.312 -5.974 -13.332 1.00 54.34 N ATOM 2401 CA ALA A 155 7.481 -6.437 -11.958 1.00 71.24 C ATOM 2402 C ALA A 155 6.392 -7.433 -11.569 1.00 22.32 C ATOM 2403 O ALA A 155 6.655 -8.414 -10.874 1.00 63.11 O ATOM 2404 CB ALA A 155 7.483 -5.253 -11.001 1.00 73.44 C ATOM 0 H ALA A 155 7.313 -4.959 -13.437 1.00 54.34 H new ATOM 0 HA ALA A 155 8.441 -6.950 -11.891 1.00 71.24 H new ATOM 0 HB1 ALA A 155 7.610 -5.611 -9.979 1.00 73.44 H new ATOM 0 HB2 ALA A 155 8.303 -4.582 -11.255 1.00 73.44 H new ATOM 0 HB3 ALA A 155 6.537 -4.717 -11.083 1.00 73.44 H new ATOM 2410 N PHE A 156 5.170 -7.174 -12.022 1.00 43.34 N ATOM 2411 CA PHE A 156 4.043 -8.048 -11.721 1.00 40.35 C ATOM 2412 C PHE A 156 4.170 -9.374 -12.464 1.00 41.25 C ATOM 2413 O PHE A 156 4.040 -10.446 -11.871 1.00 34.24 O ATOM 2414 CB PHE A 156 2.727 -7.364 -12.093 1.00 64.12 C ATOM 2415 CG PHE A 156 2.278 -6.342 -11.088 1.00 63.10 C ATOM 2416 CD1 PHE A 156 1.782 -6.735 -9.856 1.00 4.24 C ATOM 2417 CD2 PHE A 156 2.355 -4.989 -11.375 1.00 22.32 C ATOM 2418 CE1 PHE A 156 1.368 -5.798 -8.929 1.00 53.02 C ATOM 2419 CE2 PHE A 156 1.943 -4.047 -10.452 1.00 52.02 C ATOM 2420 CZ PHE A 156 1.449 -4.451 -9.227 1.00 65.22 C ATOM 0 H PHE A 156 4.935 -6.366 -12.599 1.00 43.34 H new ATOM 0 HA PHE A 156 4.048 -8.251 -10.650 1.00 40.35 H new ATOM 0 HB2 PHE A 156 2.839 -6.882 -13.064 1.00 64.12 H new ATOM 0 HB3 PHE A 156 1.951 -8.122 -12.201 1.00 64.12 H new ATOM 0 HD1 PHE A 156 1.718 -7.786 -9.617 1.00 4.24 H new ATOM 0 HD2 PHE A 156 2.741 -4.667 -12.331 1.00 22.32 H new ATOM 0 HE1 PHE A 156 0.982 -6.118 -7.973 1.00 53.02 H new ATOM 0 HE2 PHE A 156 2.007 -2.995 -10.688 1.00 52.02 H new ATOM 0 HZ PHE A 156 1.127 -3.716 -8.504 1.00 65.22 H new ATOM 2430 N TYR A 157 4.427 -9.296 -13.766 1.00 51.23 N ATOM 2431 CA TYR A 157 4.573 -10.489 -14.592 1.00 1.23 C ATOM 2432 C TYR A 157 5.681 -11.391 -14.054 1.00 30.43 C ATOM 2433 O TYR A 157 5.628 -12.611 -14.203 1.00 72.44 O ATOM 2434 CB TYR A 157 4.875 -10.099 -16.039 1.00 64.12 C ATOM 2435 CG TYR A 157 3.702 -9.469 -16.756 1.00 43.52 C ATOM 2436 CD1 TYR A 157 2.421 -9.992 -16.626 1.00 10.51 C ATOM 2437 CD2 TYR A 157 3.876 -8.350 -17.562 1.00 43.41 C ATOM 2438 CE1 TYR A 157 1.347 -9.419 -17.279 1.00 61.51 C ATOM 2439 CE2 TYR A 157 2.805 -7.772 -18.217 1.00 5.21 C ATOM 2440 CZ TYR A 157 1.543 -8.309 -18.073 1.00 75.51 C ATOM 2441 OH TYR A 157 0.476 -7.736 -18.725 1.00 3.03 O ATOM 0 H TYR A 157 4.539 -8.418 -14.272 1.00 51.23 H new ATOM 0 HA TYR A 157 3.633 -11.040 -14.560 1.00 1.23 H new ATOM 0 HB2 TYR A 157 5.713 -9.403 -16.051 1.00 64.12 H new ATOM 0 HB3 TYR A 157 5.190 -10.987 -16.587 1.00 64.12 H new ATOM 0 HD1 TYR A 157 2.263 -10.861 -16.004 1.00 10.51 H new ATOM 0 HD2 TYR A 157 4.862 -7.926 -17.678 1.00 43.41 H new ATOM 0 HE1 TYR A 157 0.358 -9.839 -17.168 1.00 61.51 H new ATOM 0 HE2 TYR A 157 2.956 -6.903 -18.840 1.00 5.21 H new ATOM 0 HH TYR A 157 0.785 -6.962 -19.241 1.00 3.03 H new ATOM 2451 N THR A 158 6.682 -10.780 -13.428 1.00 1.02 N ATOM 2452 CA THR A 158 7.801 -11.522 -12.868 1.00 21.55 C ATOM 2453 C THR A 158 7.322 -12.508 -11.806 1.00 23.23 C ATOM 2454 O THR A 158 7.842 -13.618 -11.696 1.00 52.42 O ATOM 2455 CB THR A 158 8.815 -10.554 -12.264 1.00 53.31 C ATOM 2456 OG1 THR A 158 9.202 -9.576 -13.214 1.00 73.42 O ATOM 2457 CG2 THR A 158 10.068 -11.234 -11.771 1.00 45.31 C ATOM 0 H THR A 158 6.739 -9.770 -13.297 1.00 1.02 H new ATOM 0 HA THR A 158 8.276 -12.087 -13.670 1.00 21.55 H new ATOM 0 HB THR A 158 8.309 -10.099 -11.413 1.00 53.31 H new ATOM 0 HG1 THR A 158 8.423 -9.036 -13.464 1.00 73.42 H new ATOM 0 HG21 THR A 158 10.746 -10.489 -11.354 1.00 45.31 H new ATOM 0 HG22 THR A 158 9.809 -11.960 -11.001 1.00 45.31 H new ATOM 0 HG23 THR A 158 10.556 -11.744 -12.601 1.00 45.31 H new ATOM 2465 N LEU A 159 6.327 -12.093 -11.027 1.00 34.41 N ATOM 2466 CA LEU A 159 5.778 -12.940 -9.975 1.00 13.03 C ATOM 2467 C LEU A 159 5.148 -14.198 -10.565 1.00 21.32 C ATOM 2468 O LEU A 159 5.339 -15.300 -10.050 1.00 33.14 O ATOM 2469 CB LEU A 159 4.739 -12.167 -9.158 1.00 33.13 C ATOM 2470 CG LEU A 159 4.006 -12.989 -8.096 1.00 23.54 C ATOM 2471 CD1 LEU A 159 4.998 -13.625 -7.134 1.00 15.12 C ATOM 2472 CD2 LEU A 159 3.011 -12.119 -7.342 1.00 11.12 C ATOM 0 H LEU A 159 5.886 -11.177 -11.105 1.00 34.41 H new ATOM 0 HA LEU A 159 6.595 -13.239 -9.318 1.00 13.03 H new ATOM 0 HB2 LEU A 159 5.235 -11.329 -8.668 1.00 33.13 H new ATOM 0 HB3 LEU A 159 4.002 -11.746 -9.842 1.00 33.13 H new ATOM 0 HG LEU A 159 3.456 -13.786 -8.596 1.00 23.54 H new ATOM 0 HD11 LEU A 159 4.458 -14.206 -6.386 1.00 15.12 H new ATOM 0 HD12 LEU A 159 5.671 -14.281 -7.686 1.00 15.12 H new ATOM 0 HD13 LEU A 159 5.577 -12.845 -6.640 1.00 15.12 H new ATOM 0 HD21 LEU A 159 2.499 -12.720 -6.591 1.00 11.12 H new ATOM 0 HD22 LEU A 159 3.540 -11.301 -6.853 1.00 11.12 H new ATOM 0 HD23 LEU A 159 2.280 -11.712 -8.041 1.00 11.12 H new ATOM 2484 N VAL A 160 4.395 -14.025 -11.648 1.00 5.30 N ATOM 2485 CA VAL A 160 3.736 -15.147 -12.310 1.00 24.41 C ATOM 2486 C VAL A 160 4.736 -16.246 -12.656 1.00 35.10 C ATOM 2487 O VAL A 160 4.444 -17.433 -12.515 1.00 34.42 O ATOM 2488 CB VAL A 160 3.018 -14.698 -13.596 1.00 33.33 C ATOM 2489 CG1 VAL A 160 2.192 -15.837 -14.176 1.00 61.50 C ATOM 2490 CG2 VAL A 160 2.147 -13.479 -13.329 1.00 72.13 C ATOM 0 H VAL A 160 4.226 -13.119 -12.086 1.00 5.30 H new ATOM 0 HA VAL A 160 2.998 -15.538 -11.609 1.00 24.41 H new ATOM 0 HB VAL A 160 3.774 -14.419 -14.330 1.00 33.33 H new ATOM 0 HG11 VAL A 160 1.693 -15.499 -15.084 1.00 61.50 H new ATOM 0 HG12 VAL A 160 2.846 -16.677 -14.412 1.00 61.50 H new ATOM 0 HG13 VAL A 160 1.445 -16.152 -13.447 1.00 61.50 H new ATOM 0 HG21 VAL A 160 1.649 -13.179 -14.251 1.00 72.13 H new ATOM 0 HG22 VAL A 160 1.398 -13.725 -12.576 1.00 72.13 H new ATOM 0 HG23 VAL A 160 2.769 -12.659 -12.969 1.00 72.13 H new ATOM 2500 N ARG A 161 5.919 -15.840 -13.107 1.00 53.30 N ATOM 2501 CA ARG A 161 6.964 -16.788 -13.470 1.00 1.13 C ATOM 2502 C ARG A 161 7.523 -17.478 -12.230 1.00 2.51 C ATOM 2503 O ARG A 161 7.947 -18.633 -12.287 1.00 62.43 O ATOM 2504 CB ARG A 161 8.091 -16.076 -14.222 1.00 61.55 C ATOM 2505 CG ARG A 161 7.606 -15.233 -15.391 1.00 62.13 C ATOM 2506 CD ARG A 161 8.578 -15.286 -16.560 1.00 62.11 C ATOM 2507 NE ARG A 161 8.034 -16.034 -17.691 1.00 75.20 N ATOM 2508 CZ ARG A 161 7.158 -15.532 -18.560 1.00 41.55 C ATOM 2509 NH1 ARG A 161 6.723 -14.285 -18.430 1.00 61.23 N ATOM 2510 NH2 ARG A 161 6.717 -16.279 -19.562 1.00 73.33 N ATOM 0 H ARG A 161 6.177 -14.861 -13.229 1.00 53.30 H new ATOM 0 HA ARG A 161 6.525 -17.544 -14.121 1.00 1.13 H new ATOM 0 HB2 ARG A 161 8.634 -15.438 -13.525 1.00 61.55 H new ATOM 0 HB3 ARG A 161 8.797 -16.820 -14.590 1.00 61.55 H new ATOM 0 HG2 ARG A 161 6.627 -15.587 -15.714 1.00 62.13 H new ATOM 0 HG3 ARG A 161 7.480 -14.200 -15.068 1.00 62.13 H new ATOM 0 HD2 ARG A 161 8.818 -14.271 -16.878 1.00 62.11 H new ATOM 0 HD3 ARG A 161 9.511 -15.747 -16.235 1.00 62.11 H new ATOM 0 HE ARG A 161 8.343 -16.997 -17.823 1.00 75.20 H new ATOM 0 HH11 ARG A 161 7.059 -13.705 -17.661 1.00 61.23 H new ATOM 0 HH12 ARG A 161 6.052 -13.907 -19.099 1.00 61.23 H new ATOM 0 HH21 ARG A 161 7.048 -17.238 -19.668 1.00 73.33 H new ATOM 0 HH22 ARG A 161 6.046 -15.895 -20.228 1.00 73.33 H new ATOM 2524 N GLU A 162 7.521 -16.761 -11.111 1.00 31.24 N ATOM 2525 CA GLU A 162 8.027 -17.302 -9.855 1.00 4.22 C ATOM 2526 C GLU A 162 7.051 -18.321 -9.272 1.00 73.21 C ATOM 2527 O GLU A 162 7.447 -19.418 -8.878 1.00 55.31 O ATOM 2528 CB GLU A 162 8.271 -16.173 -8.850 1.00 30.44 C ATOM 2529 CG GLU A 162 9.742 -15.902 -8.586 1.00 41.05 C ATOM 2530 CD GLU A 162 10.527 -15.649 -9.859 1.00 74.33 C ATOM 2531 OE1 GLU A 162 10.319 -14.587 -10.483 1.00 2.41 O ATOM 2532 OE2 GLU A 162 11.349 -16.512 -10.232 1.00 13.40 O ATOM 0 H GLU A 162 7.174 -15.804 -11.048 1.00 31.24 H new ATOM 0 HA GLU A 162 8.972 -17.806 -10.057 1.00 4.22 H new ATOM 0 HB2 GLU A 162 7.803 -15.261 -9.220 1.00 30.44 H new ATOM 0 HB3 GLU A 162 7.782 -16.423 -7.909 1.00 30.44 H new ATOM 0 HG2 GLU A 162 9.836 -15.038 -7.928 1.00 41.05 H new ATOM 0 HG3 GLU A 162 10.175 -16.752 -8.059 1.00 41.05 H new ATOM 2539 N ILE A 163 5.776 -17.951 -9.219 1.00 2.01 N ATOM 2540 CA ILE A 163 4.748 -18.825 -8.689 1.00 34.15 C ATOM 2541 C ILE A 163 4.649 -20.116 -9.496 1.00 14.14 C ATOM 2542 O ILE A 163 4.758 -21.212 -8.946 1.00 74.44 O ATOM 2543 CB ILE A 163 3.393 -18.113 -8.695 1.00 11.14 C ATOM 2544 CG1 ILE A 163 3.483 -16.815 -7.908 1.00 22.43 C ATOM 2545 CG2 ILE A 163 2.312 -19.000 -8.111 1.00 33.32 C ATOM 2546 CD1 ILE A 163 2.216 -16.018 -7.972 1.00 45.54 C ATOM 0 H ILE A 163 5.433 -17.045 -9.540 1.00 2.01 H new ATOM 0 HA ILE A 163 5.023 -19.078 -7.665 1.00 34.15 H new ATOM 0 HB ILE A 163 3.130 -17.889 -9.729 1.00 11.14 H new ATOM 0 HG12 ILE A 163 3.715 -17.040 -6.867 1.00 22.43 H new ATOM 0 HG13 ILE A 163 4.306 -16.215 -8.296 1.00 22.43 H new ATOM 0 HG21 ILE A 163 1.359 -18.471 -8.127 1.00 33.32 H new ATOM 0 HG22 ILE A 163 2.230 -19.912 -8.703 1.00 33.32 H new ATOM 0 HG23 ILE A 163 2.568 -19.256 -7.083 1.00 33.32 H new ATOM 0 HD11 ILE A 163 2.333 -15.101 -7.394 1.00 45.54 H new ATOM 0 HD12 ILE A 163 1.996 -15.767 -9.010 1.00 45.54 H new ATOM 0 HD13 ILE A 163 1.396 -16.605 -7.559 1.00 45.54 H new ATOM 2558 N ARG A 164 4.443 -19.977 -10.802 1.00 41.33 N ATOM 2559 CA ARG A 164 4.331 -21.131 -11.687 1.00 71.01 C ATOM 2560 C ARG A 164 5.569 -22.014 -11.587 1.00 62.32 C ATOM 2561 O ARG A 164 5.471 -23.242 -11.585 1.00 30.23 O ATOM 2562 CB ARG A 164 4.133 -20.673 -13.133 1.00 74.32 C ATOM 2563 CG ARG A 164 2.694 -20.308 -13.462 1.00 15.10 C ATOM 2564 CD ARG A 164 2.372 -20.565 -14.925 1.00 2.43 C ATOM 2565 NE ARG A 164 1.212 -21.437 -15.084 1.00 43.51 N ATOM 2566 CZ ARG A 164 1.260 -22.764 -14.975 1.00 53.13 C ATOM 2567 NH1 ARG A 164 2.408 -23.374 -14.708 1.00 15.41 N ATOM 2568 NH2 ARG A 164 0.156 -23.482 -15.134 1.00 53.53 N ATOM 0 H ARG A 164 4.350 -19.076 -11.271 1.00 41.33 H new ATOM 0 HA ARG A 164 3.464 -21.714 -11.376 1.00 71.01 H new ATOM 0 HB2 ARG A 164 4.771 -19.810 -13.323 1.00 74.32 H new ATOM 0 HB3 ARG A 164 4.461 -21.466 -13.805 1.00 74.32 H new ATOM 0 HG2 ARG A 164 2.018 -20.887 -12.833 1.00 15.10 H new ATOM 0 HG3 ARG A 164 2.523 -19.257 -13.230 1.00 15.10 H new ATOM 0 HD2 ARG A 164 2.184 -19.616 -15.427 1.00 2.43 H new ATOM 0 HD3 ARG A 164 3.236 -21.018 -15.412 1.00 2.43 H new ATOM 0 HE ARG A 164 0.312 -21.005 -15.291 1.00 43.51 H new ATOM 0 HH11 ARG A 164 3.260 -22.827 -14.585 1.00 15.41 H new ATOM 0 HH12 ARG A 164 2.438 -24.390 -14.626 1.00 15.41 H new ATOM 0 HH21 ARG A 164 -0.729 -23.018 -15.340 1.00 53.53 H new ATOM 0 HH22 ARG A 164 0.192 -24.498 -15.051 1.00 53.53 H new ATOM 2582 N GLN A 165 6.734 -21.382 -11.500 1.00 2.34 N ATOM 2583 CA GLN A 165 7.993 -22.110 -11.396 1.00 53.55 C ATOM 2584 C GLN A 165 8.061 -22.903 -10.095 1.00 54.30 C ATOM 2585 O GLN A 165 8.821 -23.865 -9.983 1.00 42.32 O ATOM 2586 CB GLN A 165 9.174 -21.142 -11.482 1.00 44.11 C ATOM 2587 CG GLN A 165 9.585 -20.813 -12.908 1.00 44.23 C ATOM 2588 CD GLN A 165 10.729 -19.818 -12.971 1.00 14.35 C ATOM 2589 OE1 GLN A 165 10.627 -18.779 -13.623 1.00 24.23 O ATOM 2590 NE2 GLN A 165 11.825 -20.132 -12.290 1.00 74.50 N ATOM 0 H GLN A 165 6.833 -20.367 -11.499 1.00 2.34 H new ATOM 0 HA GLN A 165 8.047 -22.812 -12.228 1.00 53.55 H new ATOM 0 HB2 GLN A 165 8.915 -20.218 -10.965 1.00 44.11 H new ATOM 0 HB3 GLN A 165 10.026 -21.573 -10.957 1.00 44.11 H new ATOM 0 HG2 GLN A 165 9.878 -21.730 -13.419 1.00 44.23 H new ATOM 0 HG3 GLN A 165 8.727 -20.409 -13.445 1.00 44.23 H new ATOM 0 HE21 GLN A 165 11.866 -21.004 -11.763 1.00 74.50 H new ATOM 0 HE22 GLN A 165 12.626 -19.501 -12.294 1.00 74.50 H new ATOM 2599 N HIS A 166 7.261 -22.497 -9.111 1.00 33.20 N ATOM 2600 CA HIS A 166 7.236 -23.174 -7.819 1.00 25.30 C ATOM 2601 C HIS A 166 5.846 -23.731 -7.525 1.00 43.20 C ATOM 2602 O HIS A 166 5.643 -24.254 -6.409 1.00 37.29 O ATOM 2603 CB HIS A 166 7.659 -22.215 -6.707 1.00 21.52 C ATOM 2604 CG HIS A 166 8.451 -22.872 -5.620 1.00 61.31 C ATOM 2605 ND1 HIS A 166 9.422 -23.821 -5.865 1.00 3.10 N ATOM 2606 CD2 HIS A 166 8.415 -22.712 -4.275 1.00 32.10 C ATOM 2607 CE1 HIS A 166 9.946 -24.219 -4.719 1.00 11.23 C ATOM 2608 NE2 HIS A 166 9.353 -23.560 -3.740 1.00 63.34 N ATOM 2609 OXT HIS A 166 4.973 -23.639 -8.413 1.00 20.13 O ATOM 0 H HIS A 166 6.623 -21.704 -9.185 1.00 33.20 H new ATOM 0 HA HIS A 166 7.941 -24.004 -7.859 1.00 25.30 H new ATOM 0 HB2 HIS A 166 8.251 -21.408 -7.140 1.00 21.52 H new ATOM 0 HB3 HIS A 166 6.769 -21.760 -6.273 1.00 21.52 H new ATOM 0 HD2 HIS A 166 7.769 -22.043 -3.726 1.00 32.10 H new ATOM 0 HE1 HIS A 166 10.726 -24.957 -4.603 1.00 11.23 H new ATOM 0 HE2 HIS A 166 9.559 -23.664 -2.746 1.00 63.34 H new