USER MOD reduce.3.24.130724 H: found=0, std=0, add=1200, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1200 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 103 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 107 THR OG1 : rot 73:sc= 0.501 USER MOD Set 2.1: A 4 HIS : no HE2:sc= -0.487 K(o=-2.5,f=-4.5!) USER MOD Set 2.2: A 102 THR OG1 : rot -100:sc= -1.99! USER MOD Set 3.1: A 1 MET CE :methyl 159:sc= -0.203 (180deg=-0.722) USER MOD Set 3.2: A 100 SER OG : rot -119:sc= 0.00269 USER MOD Set 4.1: A 54 ASN : amide:sc= 1.73 K(o=3.6,f=-6.4!) USER MOD Set 4.2: A 115 TYR OH : rot -169:sc= 1.9 USER MOD Set 5.1: A 5 HIS : no HD1:sc= 0 X(o=-0.27,f=-0.27) USER MOD Set 5.2: A 6 HIS : no HD1:sc= -0.265 X(o=-0.27,f=-0.27) USER MOD Single : A 1 MET N :NH3+ 166:sc= -0.223 (180deg=-0.394) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.0018) USER MOD Single : A 7 HIS : no HD1:sc= -0.0314 X(o=-0.031,f=-0.034) USER MOD Single : A 8 HIS :FLIP no HD1:sc= -1.42 F(o=-2.2,f=-1.4) USER MOD Single : A 9 SER OG : rot 1:sc= 0.353 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 MET CE :methyl -158:sc= -0.142 (180deg=-0.629) USER MOD Single : A 14 HIS : no HE2:sc= -0.266 K(o=-0.27,f=-1.3) USER MOD Single : A 18 THR OG1 : rot 52:sc= 0.601 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN :FLIP amide:sc= -0.0801 F(o=-1.1,f=-0.08) USER MOD Single : A 24 LYS NZ :NH3+ 171:sc= 0.156 (180deg=-0.529) USER MOD Single : A 25 GLN : amide:sc= 0.773 K(o=0.77,f=-0.036) USER MOD Single : A 27 TYR OH : rot 180:sc=-0.00254 USER MOD Single : A 34 LYS NZ :NH3+ -177:sc= 1.15 (180deg=1.04) USER MOD Single : A 36 LYS NZ :NH3+ -169:sc= -0.0162 (180deg=-0.143) USER MOD Single : A 44 SER OG : rot 78:sc= 0.0375 USER MOD Single : A 46 MET CE :methyl 174:sc= -0.822 (180deg=-0.933) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -173:sc=-0.000666 (180deg=-0.0882) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl 158:sc= -0.0986 (180deg=-0.648) USER MOD Single : A 61 LYS NZ :NH3+ -131:sc= 1.89 (180deg=-2.11!) USER MOD Single : A 62 GLN : amide:sc= 0.278 X(o=0.28,f=0) USER MOD Single : A 68 MET CE :methyl -165:sc= -0.0834 (180deg=-0.472) USER MOD Single : A 70 TYR OH : rot 180:sc= -0.337 USER MOD Single : A 74 THR OG1 : rot -78:sc= 1.08 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -1.59 X(o=-1.6,f=-1.4) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 156:sc= -1.54! (180deg=-2.85!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0486 USER MOD Single : A 93 LYS NZ :NH3+ 171:sc= -0.0167 (180deg=-0.14) USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=-0.069) USER MOD Single : A 99 THR OG1 : rot -23:sc= 0.787 USER MOD Single : A 110 THR OG1 : rot 70:sc= 0.609 USER MOD Single : A 111 GLN : amide:sc= -0.0597 K(o=-0.06,f=-0.65) USER MOD Single : A 112 TYR OH : rot -169:sc= 0.612 USER MOD Single : A 113 MET CE :methyl -178:sc= -3.39 (180deg=-3.53) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 TYR OH : rot 78:sc= -0.245 USER MOD Single : A 119 TYR OH : rot 14:sc= 0.805 USER MOD Single : A 121 CYS SG : rot 96:sc= 0.769 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 94:sc= 0.607 USER MOD Single : A 128 ASN : amide:sc= 0.93 K(o=0.93,f=-0.0022) USER MOD Single : A 130 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 133 GLN : amide:sc= 0.644 K(o=0.64,f=-0.07) USER MOD Single : A 138 SER OG : rot 80:sc= 0.756 USER MOD Single : A 139 ASN : amide:sc= -2.11! C(o=-2.1!,f=-4.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 25.112 -9.520 4.693 1.00 64.23 N ATOM 2 CA MET A 1 23.905 -8.951 4.029 1.00 11.44 C ATOM 3 C MET A 1 23.973 -9.095 2.495 1.00 42.24 C ATOM 4 O MET A 1 23.032 -9.594 1.874 1.00 22.01 O ATOM 5 CB MET A 1 23.698 -7.482 4.462 1.00 23.33 C ATOM 6 CG MET A 1 24.960 -6.619 4.445 1.00 1.45 C ATOM 7 SD MET A 1 25.479 -6.143 2.785 1.00 55.21 S ATOM 8 CE MET A 1 24.106 -5.103 2.280 1.00 45.33 C ATOM 0 H1 MET A 1 25.147 -9.201 5.682 1.00 64.23 H new ATOM 0 H2 MET A 1 25.066 -10.559 4.666 1.00 64.23 H new ATOM 0 H3 MET A 1 25.966 -9.198 4.195 1.00 64.23 H new ATOM 0 HA MET A 1 23.037 -9.524 4.353 1.00 11.44 H new ATOM 0 HB2 MET A 1 22.956 -7.027 3.806 1.00 23.33 H new ATOM 0 HB3 MET A 1 23.282 -7.471 5.470 1.00 23.33 H new ATOM 0 HG2 MET A 1 24.784 -5.719 5.035 1.00 1.45 H new ATOM 0 HG3 MET A 1 25.771 -7.164 4.929 1.00 1.45 H new ATOM 0 HE1 MET A 1 24.425 -4.448 1.469 1.00 45.33 H new ATOM 0 HE2 MET A 1 23.282 -5.729 1.938 1.00 45.33 H new ATOM 0 HE3 MET A 1 23.777 -4.499 3.126 1.00 45.33 H new ATOM 20 N GLY A 2 25.087 -8.684 1.892 1.00 34.11 N ATOM 21 CA GLY A 2 25.264 -8.828 0.449 1.00 55.33 C ATOM 22 C GLY A 2 24.672 -7.669 -0.352 1.00 75.25 C ATOM 23 O GLY A 2 23.563 -7.211 -0.074 1.00 30.41 O ATOM 0 H GLY A 2 25.874 -8.252 2.376 1.00 34.11 H new ATOM 0 HA2 GLY A 2 26.328 -8.908 0.227 1.00 55.33 H new ATOM 0 HA3 GLY A 2 24.800 -9.759 0.124 1.00 55.33 H new ATOM 27 N HIS A 3 25.415 -7.191 -1.349 1.00 22.43 N ATOM 28 CA HIS A 3 24.947 -6.100 -2.214 1.00 31.14 C ATOM 29 C HIS A 3 24.038 -6.631 -3.332 1.00 25.25 C ATOM 30 O HIS A 3 24.203 -7.762 -3.792 1.00 64.11 O ATOM 31 CB HIS A 3 26.145 -5.365 -2.830 1.00 31.44 C ATOM 32 CG HIS A 3 27.112 -4.831 -1.814 1.00 43.31 C ATOM 33 ND1 HIS A 3 28.352 -5.388 -1.593 1.00 43.34 N ATOM 34 CD2 HIS A 3 27.017 -3.785 -0.960 1.00 71.45 C ATOM 35 CE1 HIS A 3 28.975 -4.711 -0.651 1.00 41.54 C ATOM 36 NE2 HIS A 3 28.190 -3.732 -0.247 1.00 55.33 N ATOM 0 H HIS A 3 26.345 -7.540 -1.581 1.00 22.43 H new ATOM 0 HA HIS A 3 24.371 -5.408 -1.600 1.00 31.14 H new ATOM 0 HB2 HIS A 3 26.673 -6.045 -3.499 1.00 31.44 H new ATOM 0 HB3 HIS A 3 25.779 -4.539 -3.440 1.00 31.44 H new ATOM 0 HD2 HIS A 3 26.175 -3.116 -0.858 1.00 71.45 H new ATOM 0 HE1 HIS A 3 29.964 -4.922 -0.272 1.00 41.54 H new ATOM 0 HE2 HIS A 3 28.416 -3.048 0.475 1.00 55.33 H new ATOM 45 N HIS A 4 23.080 -5.814 -3.771 1.00 23.43 N ATOM 46 CA HIS A 4 22.187 -6.209 -4.868 1.00 53.53 C ATOM 47 C HIS A 4 22.964 -6.386 -6.187 1.00 31.12 C ATOM 48 O HIS A 4 23.224 -5.426 -6.914 1.00 72.15 O ATOM 49 CB HIS A 4 21.035 -5.203 -5.037 1.00 70.21 C ATOM 50 CG HIS A 4 21.455 -3.764 -5.159 1.00 62.14 C ATOM 51 ND1 HIS A 4 21.518 -2.908 -4.081 1.00 10.41 N ATOM 52 CD2 HIS A 4 21.807 -3.023 -6.238 1.00 32.20 C ATOM 53 CE1 HIS A 4 21.887 -1.710 -4.488 1.00 53.14 C ATOM 54 NE2 HIS A 4 22.069 -1.751 -5.790 1.00 51.14 N ATOM 0 H HIS A 4 22.901 -4.884 -3.391 1.00 23.43 H new ATOM 0 HA HIS A 4 21.753 -7.174 -4.607 1.00 53.53 H new ATOM 0 HB2 HIS A 4 20.464 -5.475 -5.925 1.00 70.21 H new ATOM 0 HB3 HIS A 4 20.363 -5.298 -4.184 1.00 70.21 H new ATOM 0 HD1 HIS A 4 21.311 -3.163 -3.115 1.00 10.41 H new ATOM 0 HD2 HIS A 4 21.870 -3.368 -7.259 1.00 32.20 H new ATOM 0 HE1 HIS A 4 22.018 -0.842 -3.859 1.00 53.14 H new ATOM 63 N HIS A 5 23.358 -7.624 -6.470 1.00 73.34 N ATOM 64 CA HIS A 5 24.115 -7.935 -7.682 1.00 32.40 C ATOM 65 C HIS A 5 23.182 -7.952 -8.907 1.00 33.30 C ATOM 66 O HIS A 5 23.215 -7.045 -9.742 1.00 44.41 O ATOM 67 CB HIS A 5 24.835 -9.288 -7.518 1.00 44.51 C ATOM 68 CG HIS A 5 26.241 -9.301 -8.044 1.00 43.12 C ATOM 69 ND1 HIS A 5 26.606 -9.895 -9.235 1.00 74.41 N ATOM 70 CD2 HIS A 5 27.385 -8.795 -7.521 1.00 73.15 C ATOM 71 CE1 HIS A 5 27.903 -9.752 -9.418 1.00 12.40 C ATOM 72 NE2 HIS A 5 28.397 -9.090 -8.397 1.00 11.14 N ATOM 0 H HIS A 5 23.166 -8.431 -5.876 1.00 73.34 H new ATOM 0 HA HIS A 5 24.866 -7.161 -7.842 1.00 32.40 H new ATOM 0 HB2 HIS A 5 24.851 -9.553 -6.461 1.00 44.51 H new ATOM 0 HB3 HIS A 5 24.259 -10.058 -8.031 1.00 44.51 H new ATOM 0 HD2 HIS A 5 27.481 -8.259 -6.588 1.00 73.15 H new ATOM 0 HE1 HIS A 5 28.465 -10.118 -10.265 1.00 12.40 H new ATOM 0 HE2 HIS A 5 29.377 -8.836 -8.275 1.00 11.14 H new ATOM 81 N HIS A 6 22.341 -8.985 -8.997 1.00 51.13 N ATOM 82 CA HIS A 6 21.352 -9.101 -10.082 1.00 23.31 C ATOM 83 C HIS A 6 20.093 -9.846 -9.608 1.00 2.54 C ATOM 84 O HIS A 6 20.149 -11.025 -9.257 1.00 14.32 O ATOM 85 CB HIS A 6 21.955 -9.816 -11.300 1.00 54.41 C ATOM 86 CG HIS A 6 23.031 -9.033 -11.991 1.00 20.41 C ATOM 87 ND1 HIS A 6 22.768 -7.963 -12.820 1.00 1.14 N ATOM 88 CD2 HIS A 6 24.381 -9.152 -11.957 1.00 64.11 C ATOM 89 CE1 HIS A 6 23.903 -7.459 -13.262 1.00 5.21 C ATOM 90 NE2 HIS A 6 24.893 -8.160 -12.755 1.00 43.05 N ATOM 0 H HIS A 6 22.322 -9.758 -8.331 1.00 51.13 H new ATOM 0 HA HIS A 6 21.067 -8.090 -10.374 1.00 23.31 H new ATOM 0 HB2 HIS A 6 22.364 -10.774 -10.981 1.00 54.41 H new ATOM 0 HB3 HIS A 6 21.160 -10.031 -12.014 1.00 54.41 H new ATOM 0 HD2 HIS A 6 24.947 -9.889 -11.406 1.00 64.11 H new ATOM 0 HE1 HIS A 6 24.003 -6.614 -13.927 1.00 5.21 H new ATOM 0 HE2 HIS A 6 25.884 -7.993 -12.927 1.00 43.05 H new ATOM 99 N HIS A 7 18.961 -9.151 -9.618 1.00 13.00 N ATOM 100 CA HIS A 7 17.692 -9.702 -9.126 1.00 24.52 C ATOM 101 C HIS A 7 17.119 -10.784 -10.066 1.00 3.24 C ATOM 102 O HIS A 7 17.269 -11.977 -9.812 1.00 63.22 O ATOM 103 CB HIS A 7 16.675 -8.559 -8.934 1.00 34.41 C ATOM 104 CG HIS A 7 15.282 -9.006 -8.580 1.00 70.41 C ATOM 105 ND1 HIS A 7 14.205 -8.834 -9.423 1.00 54.30 N ATOM 106 CD2 HIS A 7 14.786 -9.598 -7.465 1.00 15.52 C ATOM 107 CE1 HIS A 7 13.114 -9.297 -8.849 1.00 21.12 C ATOM 108 NE2 HIS A 7 13.436 -9.769 -7.661 1.00 60.41 N ATOM 0 H HIS A 7 18.891 -8.194 -9.964 1.00 13.00 H new ATOM 0 HA HIS A 7 17.886 -10.187 -8.169 1.00 24.52 H new ATOM 0 HB2 HIS A 7 17.039 -7.896 -8.149 1.00 34.41 H new ATOM 0 HB3 HIS A 7 16.631 -7.973 -9.852 1.00 34.41 H new ATOM 0 HD2 HIS A 7 15.347 -9.882 -6.587 1.00 15.52 H new ATOM 0 HE1 HIS A 7 12.123 -9.291 -9.279 1.00 21.12 H new ATOM 0 HE2 HIS A 7 12.789 -10.192 -6.996 1.00 60.41 H new ATOM 117 N HIS A 8 16.490 -10.339 -11.158 1.00 53.22 N ATOM 118 CA HIS A 8 15.731 -11.195 -12.095 1.00 13.22 C ATOM 119 C HIS A 8 14.884 -12.296 -11.401 1.00 74.42 C ATOM 120 O HIS A 8 13.668 -12.145 -11.270 1.00 3.54 O ATOM 121 CB HIS A 8 16.635 -11.765 -13.218 1.00 64.10 C ATOM 122 CG HIS A 8 17.710 -12.727 -12.798 1.00 62.22 C ATOM 123 ND1 HIS A 8 17.740 -14.082 -12.814 1.00 44.13 N flip ATOM 124 CD2 HIS A 8 18.945 -12.331 -12.334 1.00 40.13 C flip ATOM 125 CE1 HIS A 8 18.978 -14.471 -12.367 1.00 3.30 C flip ATOM 126 NE2 HIS A 8 19.683 -13.394 -12.084 1.00 72.13 N flip ATOM 0 H HIS A 8 16.490 -9.355 -11.427 1.00 53.22 H new ATOM 0 HA HIS A 8 15.002 -10.536 -12.566 1.00 13.22 H new ATOM 0 HB2 HIS A 8 15.997 -12.265 -13.947 1.00 64.10 H new ATOM 0 HB3 HIS A 8 17.109 -10.928 -13.730 1.00 64.10 H new ATOM 0 HD2 HIS A 8 19.260 -11.307 -12.196 1.00 40.13 H new ATOM 0 HE1 HIS A 8 19.318 -15.491 -12.264 1.00 3.30 H new ATOM 0 HE2 HIS A 8 20.640 -13.385 -11.731 1.00 72.13 H new ATOM 135 N SER A 9 15.513 -13.374 -10.926 1.00 74.52 N ATOM 136 CA SER A 9 14.774 -14.519 -10.361 1.00 2.24 C ATOM 137 C SER A 9 15.664 -15.402 -9.474 1.00 53.40 C ATOM 138 O SER A 9 16.894 -15.343 -9.538 1.00 31.15 O ATOM 139 CB SER A 9 14.174 -15.394 -11.475 1.00 23.25 C ATOM 140 OG SER A 9 13.209 -14.692 -12.241 1.00 55.31 O ATOM 0 H SER A 9 16.527 -13.483 -10.919 1.00 74.52 H new ATOM 0 HA SER A 9 13.977 -14.095 -9.750 1.00 2.24 H new ATOM 0 HB2 SER A 9 14.972 -15.744 -12.130 1.00 23.25 H new ATOM 0 HB3 SER A 9 13.713 -16.278 -11.033 1.00 23.25 H new ATOM 0 HG SER A 9 13.137 -13.772 -11.912 1.00 55.31 H new ATOM 146 N HIS A 10 15.016 -16.222 -8.651 1.00 33.03 N ATOM 147 CA HIS A 10 15.689 -17.209 -7.791 1.00 52.51 C ATOM 148 C HIS A 10 14.851 -18.495 -7.714 1.00 33.24 C ATOM 149 O HIS A 10 13.960 -18.710 -8.537 1.00 52.31 O ATOM 150 CB HIS A 10 15.907 -16.640 -6.377 1.00 35.05 C ATOM 151 CG HIS A 10 17.179 -15.858 -6.217 1.00 11.12 C ATOM 152 ND1 HIS A 10 18.293 -16.371 -5.592 1.00 54.44 N ATOM 153 CD2 HIS A 10 17.510 -14.598 -6.586 1.00 41.52 C ATOM 154 CE1 HIS A 10 19.250 -15.468 -5.581 1.00 40.31 C ATOM 155 NE2 HIS A 10 18.803 -14.382 -6.177 1.00 71.22 N ATOM 0 H HIS A 10 14.000 -16.225 -8.557 1.00 33.03 H new ATOM 0 HA HIS A 10 16.662 -17.439 -8.225 1.00 52.51 H new ATOM 0 HB2 HIS A 10 15.064 -15.997 -6.122 1.00 35.05 H new ATOM 0 HB3 HIS A 10 15.908 -17.463 -5.662 1.00 35.05 H new ATOM 0 HD2 HIS A 10 16.876 -13.894 -7.105 1.00 41.52 H new ATOM 0 HE1 HIS A 10 20.234 -15.596 -5.156 1.00 40.31 H new ATOM 0 HE2 HIS A 10 19.331 -13.520 -6.313 1.00 71.22 H new ATOM 164 N MET A 11 15.148 -19.360 -6.744 1.00 42.32 N ATOM 165 CA MET A 11 14.305 -20.533 -6.485 1.00 61.12 C ATOM 166 C MET A 11 12.861 -20.096 -6.161 1.00 11.32 C ATOM 167 O MET A 11 12.657 -19.104 -5.458 1.00 45.21 O ATOM 168 CB MET A 11 14.888 -21.372 -5.336 1.00 75.15 C ATOM 169 CG MET A 11 15.136 -20.582 -4.057 1.00 62.22 C ATOM 170 SD MET A 11 15.701 -21.619 -2.696 1.00 53.41 S ATOM 171 CE MET A 11 14.257 -22.647 -2.429 1.00 11.21 C ATOM 0 H MET A 11 15.957 -19.275 -6.129 1.00 42.32 H new ATOM 0 HA MET A 11 14.285 -21.150 -7.383 1.00 61.12 H new ATOM 0 HB2 MET A 11 14.206 -22.194 -5.117 1.00 75.15 H new ATOM 0 HB3 MET A 11 15.827 -21.817 -5.664 1.00 75.15 H new ATOM 0 HG2 MET A 11 15.879 -19.808 -4.251 1.00 62.22 H new ATOM 0 HG3 MET A 11 14.217 -20.075 -3.764 1.00 62.22 H new ATOM 0 HE1 MET A 11 14.280 -23.051 -1.417 1.00 11.21 H new ATOM 0 HE2 MET A 11 13.355 -22.049 -2.560 1.00 11.21 H new ATOM 0 HE3 MET A 11 14.256 -23.467 -3.147 1.00 11.21 H new ATOM 181 N PRO A 12 11.849 -20.835 -6.665 1.00 32.51 N ATOM 182 CA PRO A 12 10.424 -20.446 -6.551 1.00 62.01 C ATOM 183 C PRO A 12 10.000 -19.941 -5.155 1.00 64.24 C ATOM 184 O PRO A 12 9.976 -20.699 -4.182 1.00 51.02 O ATOM 185 CB PRO A 12 9.691 -21.748 -6.894 1.00 41.55 C ATOM 186 CG PRO A 12 10.604 -22.445 -7.845 1.00 74.33 C ATOM 187 CD PRO A 12 12.005 -22.118 -7.389 1.00 61.41 C ATOM 0 HA PRO A 12 10.199 -19.601 -7.201 1.00 62.01 H new ATOM 0 HB2 PRO A 12 9.510 -22.349 -6.003 1.00 41.55 H new ATOM 0 HB3 PRO A 12 8.720 -21.550 -7.348 1.00 41.55 H new ATOM 0 HG2 PRO A 12 10.431 -23.521 -7.835 1.00 74.33 H new ATOM 0 HG3 PRO A 12 10.437 -22.105 -8.867 1.00 74.33 H new ATOM 0 HD2 PRO A 12 12.407 -22.897 -6.741 1.00 61.41 H new ATOM 0 HD3 PRO A 12 12.688 -22.021 -8.233 1.00 61.41 H new ATOM 195 N ASP A 13 9.678 -18.648 -5.067 1.00 12.41 N ATOM 196 CA ASP A 13 9.126 -18.060 -3.839 1.00 51.51 C ATOM 197 C ASP A 13 7.734 -18.635 -3.530 1.00 74.30 C ATOM 198 O ASP A 13 7.105 -19.258 -4.385 1.00 23.54 O ATOM 199 CB ASP A 13 9.048 -16.539 -3.983 1.00 42.11 C ATOM 200 CG ASP A 13 10.421 -15.910 -4.111 1.00 50.33 C ATOM 201 OD1 ASP A 13 11.019 -15.565 -3.069 1.00 13.11 O ATOM 202 OD2 ASP A 13 10.932 -15.802 -5.241 1.00 21.24 O ATOM 0 H ASP A 13 9.790 -17.984 -5.833 1.00 12.41 H new ATOM 0 HA ASP A 13 9.787 -18.310 -3.009 1.00 51.51 H new ATOM 0 HB2 ASP A 13 8.451 -16.288 -4.860 1.00 42.11 H new ATOM 0 HB3 ASP A 13 8.536 -16.119 -3.118 1.00 42.11 H new ATOM 207 N HIS A 14 7.236 -18.396 -2.321 1.00 32.34 N ATOM 208 CA HIS A 14 5.974 -19.006 -1.875 1.00 71.50 C ATOM 209 C HIS A 14 4.732 -18.333 -2.506 1.00 75.21 C ATOM 210 O HIS A 14 3.621 -18.472 -1.997 1.00 52.20 O ATOM 211 CB HIS A 14 5.885 -18.956 -0.343 1.00 41.03 C ATOM 212 CG HIS A 14 5.017 -20.032 0.239 1.00 22.23 C ATOM 213 ND1 HIS A 14 3.645 -19.934 0.341 1.00 21.04 N ATOM 214 CD2 HIS A 14 5.339 -21.247 0.741 1.00 12.22 C ATOM 215 CE1 HIS A 14 3.167 -21.038 0.879 1.00 14.04 C ATOM 216 NE2 HIS A 14 4.170 -21.850 1.130 1.00 42.35 N ATOM 0 H HIS A 14 7.679 -17.789 -1.631 1.00 32.34 H new ATOM 0 HA HIS A 14 5.977 -20.043 -2.212 1.00 71.50 H new ATOM 0 HB2 HIS A 14 6.888 -19.043 0.075 1.00 41.03 H new ATOM 0 HB3 HIS A 14 5.497 -17.983 -0.041 1.00 41.03 H new ATOM 0 HD1 HIS A 14 3.087 -19.132 0.046 1.00 21.04 H new ATOM 0 HD2 HIS A 14 6.332 -21.664 0.821 1.00 12.22 H new ATOM 0 HE1 HIS A 14 2.126 -21.242 1.080 1.00 14.04 H new ATOM 225 N GLY A 15 4.924 -17.620 -3.620 1.00 51.31 N ATOM 226 CA GLY A 15 3.807 -16.973 -4.312 1.00 30.31 C ATOM 227 C GLY A 15 3.670 -17.411 -5.770 1.00 13.25 C ATOM 228 O GLY A 15 2.847 -16.875 -6.515 1.00 15.22 O ATOM 0 H GLY A 15 5.834 -17.477 -4.058 1.00 51.31 H new ATOM 0 HA2 GLY A 15 2.881 -17.197 -3.783 1.00 30.31 H new ATOM 0 HA3 GLY A 15 3.942 -15.892 -4.275 1.00 30.31 H new ATOM 232 N ASP A 16 4.484 -18.382 -6.181 1.00 4.44 N ATOM 233 CA ASP A 16 4.418 -18.933 -7.541 1.00 20.30 C ATOM 234 C ASP A 16 3.881 -20.375 -7.527 1.00 30.31 C ATOM 235 O ASP A 16 4.080 -21.142 -8.473 1.00 11.51 O ATOM 236 CB ASP A 16 5.802 -18.879 -8.200 1.00 5.11 C ATOM 237 CG ASP A 16 6.285 -17.451 -8.397 1.00 62.33 C ATOM 238 OD1 ASP A 16 5.689 -16.730 -9.226 1.00 14.30 O ATOM 239 OD2 ASP A 16 7.262 -17.044 -7.733 1.00 5.12 O ATOM 0 H ASP A 16 5.200 -18.807 -5.592 1.00 4.44 H new ATOM 0 HA ASP A 16 3.727 -18.325 -8.125 1.00 20.30 H new ATOM 0 HB2 ASP A 16 6.518 -19.422 -7.583 1.00 5.11 H new ATOM 0 HB3 ASP A 16 5.764 -19.385 -9.165 1.00 5.11 H new ATOM 244 N TRP A 17 3.181 -20.726 -6.449 1.00 44.24 N ATOM 245 CA TRP A 17 2.615 -22.070 -6.282 1.00 14.10 C ATOM 246 C TRP A 17 1.092 -22.051 -6.476 1.00 43.40 C ATOM 247 O TRP A 17 0.350 -21.549 -5.627 1.00 31.03 O ATOM 248 CB TRP A 17 2.968 -22.617 -4.891 1.00 51.13 C ATOM 249 CG TRP A 17 4.445 -22.632 -4.626 1.00 51.20 C ATOM 250 CD1 TRP A 17 5.208 -21.585 -4.202 1.00 4.22 C ATOM 251 CD2 TRP A 17 5.338 -23.740 -4.780 1.00 33.11 C ATOM 252 NE1 TRP A 17 6.519 -21.972 -4.083 1.00 32.42 N ATOM 253 CE2 TRP A 17 6.626 -23.291 -4.432 1.00 33.52 C ATOM 254 CE3 TRP A 17 5.173 -25.067 -5.182 1.00 31.34 C ATOM 255 CZ2 TRP A 17 7.740 -24.124 -4.470 1.00 71.42 C ATOM 256 CZ3 TRP A 17 6.280 -25.892 -5.218 1.00 45.31 C ATOM 257 CH2 TRP A 17 7.549 -25.418 -4.866 1.00 40.43 C ATOM 0 H TRP A 17 2.990 -20.095 -5.671 1.00 44.24 H new ATOM 0 HA TRP A 17 3.045 -22.723 -7.042 1.00 14.10 H new ATOM 0 HB2 TRP A 17 2.474 -22.011 -4.132 1.00 51.13 H new ATOM 0 HB3 TRP A 17 2.577 -23.630 -4.794 1.00 51.13 H new ATOM 0 HD1 TRP A 17 4.835 -20.594 -3.990 1.00 4.22 H new ATOM 0 HE1 TRP A 17 7.289 -21.374 -3.783 1.00 32.42 H new ATOM 0 HE3 TRP A 17 4.199 -25.441 -5.459 1.00 31.34 H new ATOM 0 HZ2 TRP A 17 8.720 -23.761 -4.197 1.00 71.42 H new ATOM 0 HZ3 TRP A 17 6.164 -26.921 -5.523 1.00 45.31 H new ATOM 0 HH2 TRP A 17 8.395 -26.089 -4.908 1.00 40.43 H new ATOM 268 N THR A 18 0.629 -22.595 -7.598 1.00 31.51 N ATOM 269 CA THR A 18 -0.799 -22.576 -7.936 1.00 3.02 C ATOM 270 C THR A 18 -1.587 -23.622 -7.133 1.00 72.24 C ATOM 271 O THR A 18 -1.676 -24.787 -7.523 1.00 60.31 O ATOM 272 CB THR A 18 -1.025 -22.817 -9.447 1.00 50.50 C ATOM 273 OG1 THR A 18 -0.422 -24.059 -9.845 1.00 43.24 O ATOM 274 CG2 THR A 18 -0.444 -21.670 -10.274 1.00 21.42 C ATOM 0 H THR A 18 1.219 -23.055 -8.291 1.00 31.51 H new ATOM 0 HA THR A 18 -1.166 -21.583 -7.674 1.00 3.02 H new ATOM 0 HB THR A 18 -2.099 -22.864 -9.627 1.00 50.50 H new ATOM 0 HG1 THR A 18 -0.727 -24.776 -9.251 1.00 43.24 H new ATOM 0 HG21 THR A 18 -0.615 -21.862 -11.333 1.00 21.42 H new ATOM 0 HG22 THR A 18 -0.929 -20.736 -9.992 1.00 21.42 H new ATOM 0 HG23 THR A 18 0.627 -21.593 -10.088 1.00 21.42 H new ATOM 282 N TYR A 19 -2.138 -23.201 -5.996 1.00 43.44 N ATOM 283 CA TYR A 19 -2.963 -24.080 -5.155 1.00 73.54 C ATOM 284 C TYR A 19 -4.256 -23.364 -4.726 1.00 43.43 C ATOM 285 O TYR A 19 -4.270 -22.151 -4.533 1.00 61.01 O ATOM 286 CB TYR A 19 -2.165 -24.541 -3.925 1.00 53.52 C ATOM 287 CG TYR A 19 -2.887 -25.567 -3.067 1.00 4.15 C ATOM 288 CD1 TYR A 19 -3.028 -26.887 -3.489 1.00 23.10 C ATOM 289 CD2 TYR A 19 -3.422 -25.216 -1.835 1.00 45.31 C ATOM 290 CE1 TYR A 19 -3.682 -27.821 -2.706 1.00 61.24 C ATOM 291 CE2 TYR A 19 -4.075 -26.143 -1.047 1.00 22.11 C ATOM 292 CZ TYR A 19 -4.204 -27.443 -1.485 1.00 5.34 C ATOM 293 OH TYR A 19 -4.853 -28.367 -0.698 1.00 33.22 O ATOM 0 H TYR A 19 -2.030 -22.255 -5.631 1.00 43.44 H new ATOM 0 HA TYR A 19 -3.240 -24.958 -5.738 1.00 73.54 H new ATOM 0 HB2 TYR A 19 -1.217 -24.964 -4.258 1.00 53.52 H new ATOM 0 HB3 TYR A 19 -1.929 -23.672 -3.312 1.00 53.52 H new ATOM 0 HD1 TYR A 19 -2.620 -27.186 -4.443 1.00 23.10 H new ATOM 0 HD2 TYR A 19 -3.326 -24.198 -1.486 1.00 45.31 H new ATOM 0 HE1 TYR A 19 -3.784 -28.840 -3.048 1.00 61.24 H new ATOM 0 HE2 TYR A 19 -4.483 -25.850 -0.091 1.00 22.11 H new ATOM 0 HH TYR A 19 -5.158 -27.937 0.128 1.00 33.22 H new ATOM 303 N GLU A 20 -5.332 -24.129 -4.555 1.00 34.23 N ATOM 304 CA GLU A 20 -6.674 -23.568 -4.300 1.00 22.32 C ATOM 305 C GLU A 20 -6.882 -23.097 -2.842 1.00 70.10 C ATOM 306 O GLU A 20 -8.008 -23.093 -2.342 1.00 53.24 O ATOM 307 CB GLU A 20 -7.729 -24.625 -4.658 1.00 71.20 C ATOM 308 CG GLU A 20 -7.543 -25.951 -3.920 1.00 54.10 C ATOM 309 CD GLU A 20 -8.603 -26.978 -4.278 1.00 60.11 C ATOM 310 OE1 GLU A 20 -8.422 -27.705 -5.281 1.00 1.33 O ATOM 311 OE2 GLU A 20 -9.624 -27.060 -3.566 1.00 61.13 O ATOM 0 H GLU A 20 -5.308 -25.148 -4.587 1.00 34.23 H new ATOM 0 HA GLU A 20 -6.775 -22.680 -4.924 1.00 22.32 H new ATOM 0 HB2 GLU A 20 -8.719 -24.229 -4.432 1.00 71.20 H new ATOM 0 HB3 GLU A 20 -7.697 -24.809 -5.732 1.00 71.20 H new ATOM 0 HG2 GLU A 20 -6.558 -26.356 -4.153 1.00 54.10 H new ATOM 0 HG3 GLU A 20 -7.567 -25.770 -2.845 1.00 54.10 H new ATOM 318 N GLU A 21 -5.815 -22.661 -2.178 1.00 62.43 N ATOM 319 CA GLU A 21 -5.905 -22.223 -0.776 1.00 3.20 C ATOM 320 C GLU A 21 -6.122 -20.706 -0.661 1.00 53.23 C ATOM 321 O GLU A 21 -5.319 -19.916 -1.163 1.00 52.11 O ATOM 322 CB GLU A 21 -4.626 -22.609 -0.009 1.00 5.43 C ATOM 323 CG GLU A 21 -4.634 -22.210 1.469 1.00 0.13 C ATOM 324 CD GLU A 21 -3.332 -22.551 2.183 1.00 41.25 C ATOM 325 OE1 GLU A 21 -3.044 -23.753 2.366 1.00 43.14 O ATOM 326 OE2 GLU A 21 -2.594 -21.621 2.582 1.00 40.32 O ATOM 0 H GLU A 21 -4.880 -22.599 -2.580 1.00 62.43 H new ATOM 0 HA GLU A 21 -6.767 -22.727 -0.339 1.00 3.20 H new ATOM 0 HB2 GLU A 21 -4.484 -23.687 -0.082 1.00 5.43 H new ATOM 0 HB3 GLU A 21 -3.770 -22.141 -0.495 1.00 5.43 H new ATOM 0 HG2 GLU A 21 -4.817 -21.138 1.550 1.00 0.13 H new ATOM 0 HG3 GLU A 21 -5.460 -22.713 1.971 1.00 0.13 H new ATOM 333 N GLN A 22 -7.215 -20.301 -0.010 1.00 14.01 N ATOM 334 CA GLN A 22 -7.384 -18.901 0.394 1.00 44.22 C ATOM 335 C GLN A 22 -6.206 -18.486 1.282 1.00 33.33 C ATOM 336 O GLN A 22 -5.955 -19.116 2.308 1.00 0.03 O ATOM 337 CB GLN A 22 -8.715 -18.702 1.142 1.00 63.20 C ATOM 338 CG GLN A 22 -9.934 -18.606 0.227 1.00 62.23 C ATOM 339 CD GLN A 22 -9.971 -17.315 -0.585 1.00 64.41 C ATOM 340 OE1 GLN A 22 -9.490 -16.226 -0.010 1.00 55.41 O flip ATOM 341 NE2 GLN A 22 -10.458 -17.288 -1.713 1.00 21.00 N flip ATOM 0 H GLN A 22 -7.989 -20.914 0.247 1.00 14.01 H new ATOM 0 HA GLN A 22 -7.406 -18.275 -0.498 1.00 44.22 H new ATOM 0 HB2 GLN A 22 -8.858 -19.531 1.835 1.00 63.20 H new ATOM 0 HB3 GLN A 22 -8.651 -17.794 1.741 1.00 63.20 H new ATOM 0 HG2 GLN A 22 -9.938 -19.457 -0.454 1.00 62.23 H new ATOM 0 HG3 GLN A 22 -10.840 -18.676 0.829 1.00 62.23 H new ATOM 0 HE21 GLN A 22 -10.822 -18.144 -2.132 1.00 21.00 H new ATOM 0 HE22 GLN A 22 -10.498 -16.410 -2.230 1.00 21.00 H new ATOM 350 N PHE A 23 -5.484 -17.443 0.875 1.00 61.42 N ATOM 351 CA PHE A 23 -4.240 -17.046 1.550 1.00 50.01 C ATOM 352 C PHE A 23 -4.468 -16.738 3.044 1.00 21.13 C ATOM 353 O PHE A 23 -4.589 -15.582 3.453 1.00 21.02 O ATOM 354 CB PHE A 23 -3.607 -15.844 0.835 1.00 61.22 C ATOM 355 CG PHE A 23 -2.108 -15.787 0.969 1.00 32.40 C ATOM 356 CD1 PHE A 23 -1.514 -15.232 2.093 1.00 54.11 C ATOM 357 CD2 PHE A 23 -1.292 -16.290 -0.035 1.00 10.10 C ATOM 358 CE1 PHE A 23 -0.143 -15.182 2.212 1.00 64.32 C ATOM 359 CE2 PHE A 23 0.083 -16.241 0.081 1.00 2.33 C ATOM 360 CZ PHE A 23 0.658 -15.686 1.204 1.00 12.42 C ATOM 0 H PHE A 23 -5.736 -16.854 0.081 1.00 61.42 H new ATOM 0 HA PHE A 23 -3.551 -17.889 1.498 1.00 50.01 H new ATOM 0 HB2 PHE A 23 -3.868 -15.881 -0.223 1.00 61.22 H new ATOM 0 HB3 PHE A 23 -4.035 -14.926 1.237 1.00 61.22 H new ATOM 0 HD1 PHE A 23 -2.134 -14.835 2.883 1.00 54.11 H new ATOM 0 HD2 PHE A 23 -1.738 -16.725 -0.917 1.00 10.10 H new ATOM 0 HE1 PHE A 23 0.307 -14.749 3.093 1.00 64.32 H new ATOM 0 HE2 PHE A 23 0.707 -16.637 -0.707 1.00 2.33 H new ATOM 0 HZ PHE A 23 1.733 -15.645 1.296 1.00 12.42 H new ATOM 370 N LYS A 24 -4.536 -17.800 3.841 1.00 5.34 N ATOM 371 CA LYS A 24 -4.833 -17.708 5.271 1.00 75.21 C ATOM 372 C LYS A 24 -3.661 -17.115 6.073 1.00 72.22 C ATOM 373 O LYS A 24 -3.857 -16.570 7.164 1.00 33.04 O ATOM 374 CB LYS A 24 -5.213 -19.104 5.786 1.00 52.22 C ATOM 375 CG LYS A 24 -5.586 -19.159 7.262 1.00 4.24 C ATOM 376 CD LYS A 24 -6.276 -20.473 7.624 1.00 21.54 C ATOM 377 CE LYS A 24 -5.484 -21.703 7.177 1.00 60.13 C ATOM 378 NZ LYS A 24 -4.123 -21.765 7.780 1.00 0.02 N ATOM 0 H LYS A 24 -4.386 -18.754 3.514 1.00 5.34 H new ATOM 0 HA LYS A 24 -5.670 -17.024 5.412 1.00 75.21 H new ATOM 0 HB2 LYS A 24 -6.053 -19.477 5.199 1.00 52.22 H new ATOM 0 HB3 LYS A 24 -4.377 -19.781 5.611 1.00 52.22 H new ATOM 0 HG2 LYS A 24 -4.688 -19.041 7.868 1.00 4.24 H new ATOM 0 HG3 LYS A 24 -6.245 -18.324 7.502 1.00 4.24 H new ATOM 0 HD2 LYS A 24 -6.424 -20.515 8.703 1.00 21.54 H new ATOM 0 HD3 LYS A 24 -7.265 -20.497 7.165 1.00 21.54 H new ATOM 0 HE2 LYS A 24 -6.037 -22.603 7.446 1.00 60.13 H new ATOM 0 HE3 LYS A 24 -5.395 -21.697 6.091 1.00 60.13 H new ATOM 0 HZ1 LYS A 24 -3.691 -22.687 7.567 1.00 0.02 H new ATOM 0 HZ2 LYS A 24 -3.533 -21.006 7.384 1.00 0.02 H new ATOM 0 HZ3 LYS A 24 -4.194 -21.646 8.811 1.00 0.02 H new ATOM 392 N GLN A 25 -2.448 -17.197 5.519 1.00 2.14 N ATOM 393 CA GLN A 25 -1.248 -16.676 6.192 1.00 2.41 C ATOM 394 C GLN A 25 -1.427 -15.215 6.648 1.00 21.55 C ATOM 395 O GLN A 25 -0.997 -14.849 7.742 1.00 24.31 O ATOM 396 CB GLN A 25 -0.022 -16.794 5.273 1.00 61.43 C ATOM 397 CG GLN A 25 1.279 -16.268 5.883 1.00 12.00 C ATOM 398 CD GLN A 25 1.663 -16.979 7.174 1.00 51.44 C ATOM 399 OE1 GLN A 25 2.347 -17.995 7.157 1.00 10.23 O ATOM 400 NE2 GLN A 25 1.236 -16.448 8.302 1.00 71.04 N ATOM 0 H GLN A 25 -2.268 -17.618 4.608 1.00 2.14 H new ATOM 0 HA GLN A 25 -1.091 -17.283 7.084 1.00 2.41 H new ATOM 0 HB2 GLN A 25 0.115 -17.841 5.003 1.00 61.43 H new ATOM 0 HB3 GLN A 25 -0.222 -16.250 4.350 1.00 61.43 H new ATOM 0 HG2 GLN A 25 2.085 -16.382 5.159 1.00 12.00 H new ATOM 0 HG3 GLN A 25 1.176 -15.201 6.080 1.00 12.00 H new ATOM 0 HE21 GLN A 25 0.668 -15.601 8.284 1.00 71.04 H new ATOM 0 HE22 GLN A 25 1.474 -16.884 9.193 1.00 71.04 H new ATOM 409 N LEU A 26 -2.074 -14.391 5.818 1.00 15.41 N ATOM 410 CA LEU A 26 -2.330 -12.986 6.173 1.00 60.51 C ATOM 411 C LEU A 26 -3.087 -12.873 7.506 1.00 25.24 C ATOM 412 O LEU A 26 -2.787 -12.012 8.338 1.00 41.41 O ATOM 413 CB LEU A 26 -3.130 -12.276 5.072 1.00 65.35 C ATOM 414 CG LEU A 26 -2.390 -12.032 3.749 1.00 73.03 C ATOM 415 CD1 LEU A 26 -3.270 -11.221 2.800 1.00 12.12 C ATOM 416 CD2 LEU A 26 -1.058 -11.323 3.992 1.00 4.33 C ATOM 0 H LEU A 26 -2.429 -14.667 4.902 1.00 15.41 H new ATOM 0 HA LEU A 26 -1.359 -12.502 6.279 1.00 60.51 H new ATOM 0 HB2 LEU A 26 -4.022 -12.866 4.862 1.00 65.35 H new ATOM 0 HB3 LEU A 26 -3.467 -11.314 5.459 1.00 65.35 H new ATOM 0 HG LEU A 26 -2.175 -12.996 3.288 1.00 73.03 H new ATOM 0 HD11 LEU A 26 -2.737 -11.053 1.864 1.00 12.12 H new ATOM 0 HD12 LEU A 26 -4.191 -11.769 2.600 1.00 12.12 H new ATOM 0 HD13 LEU A 26 -3.511 -10.262 3.258 1.00 12.12 H new ATOM 0 HD21 LEU A 26 -0.553 -11.161 3.040 1.00 4.33 H new ATOM 0 HD22 LEU A 26 -1.240 -10.362 4.474 1.00 4.33 H new ATOM 0 HD23 LEU A 26 -0.430 -11.939 4.636 1.00 4.33 H new ATOM 428 N TYR A 27 -4.071 -13.743 7.698 1.00 71.34 N ATOM 429 CA TYR A 27 -4.854 -13.767 8.934 1.00 31.41 C ATOM 430 C TYR A 27 -4.024 -14.354 10.088 1.00 72.23 C ATOM 431 O TYR A 27 -4.113 -13.903 11.233 1.00 51.55 O ATOM 432 CB TYR A 27 -6.136 -14.588 8.722 1.00 51.34 C ATOM 433 CG TYR A 27 -6.971 -14.118 7.539 1.00 61.40 C ATOM 434 CD1 TYR A 27 -7.944 -13.137 7.692 1.00 41.14 C ATOM 435 CD2 TYR A 27 -6.784 -14.657 6.267 1.00 3.34 C ATOM 436 CE1 TYR A 27 -8.705 -12.707 6.621 1.00 2.34 C ATOM 437 CE2 TYR A 27 -7.540 -14.231 5.192 1.00 43.35 C ATOM 438 CZ TYR A 27 -8.498 -13.257 5.373 1.00 22.12 C ATOM 439 OH TYR A 27 -9.257 -12.835 4.302 1.00 42.30 O ATOM 0 H TYR A 27 -4.349 -14.445 7.012 1.00 71.34 H new ATOM 0 HA TYR A 27 -5.127 -12.745 9.198 1.00 31.41 H new ATOM 0 HB2 TYR A 27 -5.867 -15.634 8.574 1.00 51.34 H new ATOM 0 HB3 TYR A 27 -6.742 -14.540 9.626 1.00 51.34 H new ATOM 0 HD1 TYR A 27 -8.109 -12.702 8.667 1.00 41.14 H new ATOM 0 HD2 TYR A 27 -6.035 -15.421 6.119 1.00 3.34 H new ATOM 0 HE1 TYR A 27 -9.457 -11.945 6.761 1.00 2.34 H new ATOM 0 HE2 TYR A 27 -7.381 -14.660 4.214 1.00 43.35 H new ATOM 0 HH TYR A 27 -8.984 -13.321 3.496 1.00 42.30 H new ATOM 449 N GLU A 28 -3.191 -15.340 9.760 1.00 4.12 N ATOM 450 CA GLU A 28 -2.349 -16.027 10.749 1.00 70.25 C ATOM 451 C GLU A 28 -1.101 -15.201 11.124 1.00 62.23 C ATOM 452 O GLU A 28 -0.286 -15.635 11.942 1.00 20.53 O ATOM 453 CB GLU A 28 -1.933 -17.403 10.204 1.00 42.02 C ATOM 454 CG GLU A 28 -3.120 -18.303 9.867 1.00 71.43 C ATOM 455 CD GLU A 28 -2.717 -19.627 9.232 1.00 74.12 C ATOM 456 OE1 GLU A 28 -2.375 -19.639 8.030 1.00 63.43 O ATOM 457 OE2 GLU A 28 -2.783 -20.669 9.918 1.00 62.53 O ATOM 0 H GLU A 28 -3.078 -15.687 8.808 1.00 4.12 H new ATOM 0 HA GLU A 28 -2.936 -16.152 11.659 1.00 70.25 H new ATOM 0 HB2 GLU A 28 -1.326 -17.263 9.309 1.00 42.02 H new ATOM 0 HB3 GLU A 28 -1.304 -17.903 10.941 1.00 42.02 H new ATOM 0 HG2 GLU A 28 -3.684 -18.503 10.778 1.00 71.43 H new ATOM 0 HG3 GLU A 28 -3.787 -17.772 9.188 1.00 71.43 H new ATOM 464 N LEU A 29 -0.949 -14.020 10.524 1.00 11.20 N ATOM 465 CA LEU A 29 0.155 -13.111 10.871 1.00 32.12 C ATOM 466 C LEU A 29 0.044 -12.605 12.321 1.00 63.10 C ATOM 467 O LEU A 29 1.020 -12.614 13.074 1.00 31.45 O ATOM 468 CB LEU A 29 0.182 -11.894 9.928 1.00 63.41 C ATOM 469 CG LEU A 29 0.442 -12.193 8.443 1.00 1.12 C ATOM 470 CD1 LEU A 29 0.309 -10.923 7.605 1.00 45.54 C ATOM 471 CD2 LEU A 29 1.817 -12.826 8.236 1.00 31.10 C ATOM 0 H LEU A 29 -1.572 -13.667 9.797 1.00 11.20 H new ATOM 0 HA LEU A 29 1.076 -13.684 10.764 1.00 32.12 H new ATOM 0 HB2 LEU A 29 -0.773 -11.375 10.011 1.00 63.41 H new ATOM 0 HB3 LEU A 29 0.951 -11.206 10.279 1.00 63.41 H new ATOM 0 HG LEU A 29 -0.311 -12.909 8.113 1.00 1.12 H new ATOM 0 HD11 LEU A 29 0.497 -11.157 6.557 1.00 45.54 H new ATOM 0 HD12 LEU A 29 -0.698 -10.520 7.712 1.00 45.54 H new ATOM 0 HD13 LEU A 29 1.033 -10.184 7.947 1.00 45.54 H new ATOM 0 HD21 LEU A 29 1.970 -13.025 7.175 1.00 31.10 H new ATOM 0 HD22 LEU A 29 2.589 -12.144 8.592 1.00 31.10 H new ATOM 0 HD23 LEU A 29 1.874 -13.761 8.793 1.00 31.10 H new ATOM 483 N ASP A 30 -1.151 -12.150 12.702 1.00 52.11 N ATOM 484 CA ASP A 30 -1.340 -11.486 13.998 1.00 34.24 C ATOM 485 C ASP A 30 -2.323 -12.242 14.917 1.00 24.54 C ATOM 486 O ASP A 30 -2.094 -12.358 16.122 1.00 63.32 O ATOM 487 CB ASP A 30 -1.856 -10.064 13.745 1.00 75.30 C ATOM 488 CG ASP A 30 -1.378 -9.064 14.783 1.00 31.32 C ATOM 489 OD1 ASP A 30 -1.806 -9.156 15.946 1.00 51.54 O ATOM 490 OD2 ASP A 30 -0.576 -8.174 14.431 1.00 40.14 O ATOM 0 H ASP A 30 -1.998 -12.227 12.138 1.00 52.11 H new ATOM 0 HA ASP A 30 -0.379 -11.469 14.512 1.00 34.24 H new ATOM 0 HB2 ASP A 30 -1.532 -9.737 12.757 1.00 75.30 H new ATOM 0 HB3 ASP A 30 -2.946 -10.076 13.735 1.00 75.30 H new ATOM 495 N GLY A 31 -3.407 -12.769 14.344 1.00 45.23 N ATOM 496 CA GLY A 31 -4.462 -13.383 15.152 1.00 42.22 C ATOM 497 C GLY A 31 -5.324 -12.353 15.891 1.00 72.44 C ATOM 498 O GLY A 31 -6.104 -12.701 16.780 1.00 31.13 O ATOM 0 H GLY A 31 -3.576 -12.783 13.338 1.00 45.23 H new ATOM 0 HA2 GLY A 31 -5.100 -13.988 14.508 1.00 42.22 H new ATOM 0 HA3 GLY A 31 -4.010 -14.059 15.878 1.00 42.22 H new ATOM 502 N ASP A 32 -5.179 -11.080 15.518 1.00 4.03 N ATOM 503 CA ASP A 32 -5.901 -9.972 16.157 1.00 4.21 C ATOM 504 C ASP A 32 -7.199 -9.628 15.395 1.00 73.44 C ATOM 505 O ASP A 32 -7.238 -9.712 14.165 1.00 14.23 O ATOM 506 CB ASP A 32 -4.978 -8.744 16.216 1.00 21.23 C ATOM 507 CG ASP A 32 -5.624 -7.534 16.867 1.00 63.11 C ATOM 508 OD1 ASP A 32 -5.597 -7.430 18.111 1.00 31.15 O ATOM 509 OD2 ASP A 32 -6.165 -6.679 16.138 1.00 12.52 O ATOM 0 H ASP A 32 -4.558 -10.785 14.764 1.00 4.03 H new ATOM 0 HA ASP A 32 -6.185 -10.275 17.165 1.00 4.21 H new ATOM 0 HB2 ASP A 32 -4.074 -9.004 16.767 1.00 21.23 H new ATOM 0 HB3 ASP A 32 -4.670 -8.481 15.204 1.00 21.23 H new ATOM 514 N PRO A 33 -8.284 -9.245 16.113 1.00 72.43 N ATOM 515 CA PRO A 33 -9.552 -8.812 15.496 1.00 1.11 C ATOM 516 C PRO A 33 -9.355 -7.835 14.314 1.00 15.44 C ATOM 517 O PRO A 33 -9.916 -8.034 13.234 1.00 74.32 O ATOM 518 CB PRO A 33 -10.312 -8.127 16.659 1.00 55.02 C ATOM 519 CG PRO A 33 -9.355 -8.103 17.816 1.00 15.32 C ATOM 520 CD PRO A 33 -8.385 -9.225 17.579 1.00 44.22 C ATOM 0 HA PRO A 33 -10.088 -9.655 15.059 1.00 1.11 H new ATOM 0 HB2 PRO A 33 -10.619 -7.118 16.385 1.00 55.02 H new ATOM 0 HB3 PRO A 33 -11.218 -8.678 16.912 1.00 55.02 H new ATOM 0 HG2 PRO A 33 -8.837 -7.146 17.873 1.00 15.32 H new ATOM 0 HG3 PRO A 33 -9.882 -8.237 18.761 1.00 15.32 H new ATOM 0 HD2 PRO A 33 -7.421 -9.036 18.051 1.00 44.22 H new ATOM 0 HD3 PRO A 33 -8.753 -10.172 17.975 1.00 44.22 H new ATOM 528 N LYS A 34 -8.530 -6.805 14.509 1.00 42.45 N ATOM 529 CA LYS A 34 -8.291 -5.790 13.471 1.00 52.31 C ATOM 530 C LYS A 34 -7.667 -6.406 12.208 1.00 64.40 C ATOM 531 O LYS A 34 -7.893 -5.934 11.092 1.00 11.13 O ATOM 532 CB LYS A 34 -7.372 -4.691 14.006 1.00 45.02 C ATOM 533 CG LYS A 34 -7.923 -4.001 15.244 1.00 74.01 C ATOM 534 CD LYS A 34 -7.080 -2.803 15.645 1.00 63.32 C ATOM 535 CE LYS A 34 -5.639 -3.186 15.981 1.00 40.51 C ATOM 536 NZ LYS A 34 -5.568 -4.169 17.096 1.00 3.24 N ATOM 0 H LYS A 34 -8.014 -6.648 15.375 1.00 42.45 H new ATOM 0 HA LYS A 34 -9.258 -5.364 13.203 1.00 52.31 H new ATOM 0 HB2 LYS A 34 -6.399 -5.122 14.241 1.00 45.02 H new ATOM 0 HB3 LYS A 34 -7.211 -3.948 13.225 1.00 45.02 H new ATOM 0 HG2 LYS A 34 -8.947 -3.678 15.055 1.00 74.01 H new ATOM 0 HG3 LYS A 34 -7.961 -4.712 16.070 1.00 74.01 H new ATOM 0 HD2 LYS A 34 -7.079 -2.076 14.833 1.00 63.32 H new ATOM 0 HD3 LYS A 34 -7.534 -2.316 16.508 1.00 63.32 H new ATOM 0 HE2 LYS A 34 -5.160 -3.606 15.097 1.00 40.51 H new ATOM 0 HE3 LYS A 34 -5.080 -2.290 16.251 1.00 40.51 H new ATOM 0 HZ1 LYS A 34 -4.572 -4.363 17.325 1.00 3.24 H new ATOM 0 HZ2 LYS A 34 -6.047 -3.780 17.933 1.00 3.24 H new ATOM 0 HZ3 LYS A 34 -6.035 -5.053 16.810 1.00 3.24 H new ATOM 550 N ARG A 35 -6.892 -7.473 12.398 1.00 23.14 N ATOM 551 CA ARG A 35 -6.183 -8.133 11.299 1.00 53.34 C ATOM 552 C ARG A 35 -7.158 -8.756 10.282 1.00 24.40 C ATOM 553 O ARG A 35 -7.126 -8.421 9.097 1.00 31.11 O ATOM 554 CB ARG A 35 -5.232 -9.206 11.857 1.00 44.32 C ATOM 555 CG ARG A 35 -4.372 -9.905 10.804 1.00 43.02 C ATOM 556 CD ARG A 35 -3.427 -8.937 10.091 1.00 3.14 C ATOM 557 NE ARG A 35 -2.533 -8.243 11.023 1.00 51.50 N ATOM 558 CZ ARG A 35 -1.247 -8.095 10.841 1.00 22.34 C ATOM 559 NH1 ARG A 35 -0.656 -8.607 9.806 1.00 41.35 N ATOM 560 NH2 ARG A 35 -0.552 -7.439 11.705 1.00 63.54 N ATOM 0 H ARG A 35 -6.738 -7.903 13.310 1.00 23.14 H new ATOM 0 HA ARG A 35 -5.603 -7.375 10.772 1.00 53.34 H new ATOM 0 HB2 ARG A 35 -4.576 -8.743 12.594 1.00 44.32 H new ATOM 0 HB3 ARG A 35 -5.822 -9.957 12.382 1.00 44.32 H new ATOM 0 HG2 ARG A 35 -3.789 -10.694 11.279 1.00 43.02 H new ATOM 0 HG3 ARG A 35 -5.019 -10.385 10.070 1.00 43.02 H new ATOM 0 HD2 ARG A 35 -2.832 -9.486 9.361 1.00 3.14 H new ATOM 0 HD3 ARG A 35 -4.012 -8.203 9.538 1.00 3.14 H new ATOM 0 HE ARG A 35 -2.942 -7.849 11.870 1.00 51.50 H new ATOM 0 HH11 ARG A 35 -1.196 -9.134 9.119 1.00 41.35 H new ATOM 0 HH12 ARG A 35 0.348 -8.482 9.679 1.00 41.35 H new ATOM 0 HH21 ARG A 35 -1.006 -7.038 12.526 1.00 63.54 H new ATOM 0 HH22 ARG A 35 0.452 -7.320 11.568 1.00 63.54 H new ATOM 574 N LYS A 36 -8.029 -9.660 10.746 1.00 52.42 N ATOM 575 CA LYS A 36 -8.966 -10.343 9.841 1.00 2.34 C ATOM 576 C LYS A 36 -10.029 -9.379 9.283 1.00 21.21 C ATOM 577 O LYS A 36 -10.417 -9.487 8.117 1.00 51.42 O ATOM 578 CB LYS A 36 -9.655 -11.555 10.510 1.00 34.25 C ATOM 579 CG LYS A 36 -10.603 -11.218 11.664 1.00 2.52 C ATOM 580 CD LYS A 36 -9.893 -11.200 13.016 1.00 23.04 C ATOM 581 CE LYS A 36 -9.328 -12.568 13.384 1.00 70.31 C ATOM 582 NZ LYS A 36 -10.392 -13.600 13.513 1.00 43.34 N ATOM 0 H LYS A 36 -8.106 -9.934 11.726 1.00 52.42 H new ATOM 0 HA LYS A 36 -8.363 -10.714 9.012 1.00 2.34 H new ATOM 0 HB2 LYS A 36 -10.215 -12.098 9.749 1.00 34.25 H new ATOM 0 HB3 LYS A 36 -8.884 -12.230 10.881 1.00 34.25 H new ATOM 0 HG2 LYS A 36 -11.059 -10.245 11.483 1.00 2.52 H new ATOM 0 HG3 LYS A 36 -11.412 -11.948 11.691 1.00 2.52 H new ATOM 0 HD2 LYS A 36 -9.085 -10.469 12.991 1.00 23.04 H new ATOM 0 HD3 LYS A 36 -10.592 -10.877 13.788 1.00 23.04 H new ATOM 0 HE2 LYS A 36 -8.612 -12.880 12.624 1.00 70.31 H new ATOM 0 HE3 LYS A 36 -8.782 -12.493 14.324 1.00 70.31 H new ATOM 0 HZ1 LYS A 36 -9.992 -14.459 13.941 1.00 43.34 H new ATOM 0 HZ2 LYS A 36 -11.157 -13.236 14.116 1.00 43.34 H new ATOM 0 HZ3 LYS A 36 -10.771 -13.827 12.572 1.00 43.34 H new ATOM 596 N GLU A 37 -10.486 -8.435 10.112 1.00 22.44 N ATOM 597 CA GLU A 37 -11.492 -7.450 9.689 1.00 15.44 C ATOM 598 C GLU A 37 -11.015 -6.634 8.479 1.00 13.52 C ATOM 599 O GLU A 37 -11.666 -6.626 7.434 1.00 30.24 O ATOM 600 CB GLU A 37 -11.845 -6.501 10.844 1.00 34.40 C ATOM 601 CG GLU A 37 -12.637 -7.162 11.969 1.00 4.20 C ATOM 602 CD GLU A 37 -13.029 -6.185 13.066 1.00 0.22 C ATOM 603 OE1 GLU A 37 -13.812 -5.253 12.782 1.00 42.30 O ATOM 604 OE2 GLU A 37 -12.575 -6.352 14.217 1.00 4.24 O ATOM 0 H GLU A 37 -10.177 -8.331 11.079 1.00 22.44 H new ATOM 0 HA GLU A 37 -12.382 -8.007 9.396 1.00 15.44 H new ATOM 0 HB2 GLU A 37 -10.924 -6.088 11.256 1.00 34.40 H new ATOM 0 HB3 GLU A 37 -12.422 -5.664 10.450 1.00 34.40 H new ATOM 0 HG2 GLU A 37 -13.537 -7.617 11.555 1.00 4.20 H new ATOM 0 HG3 GLU A 37 -12.043 -7.967 12.401 1.00 4.20 H new ATOM 611 N PHE A 38 -9.880 -5.947 8.629 1.00 73.00 N ATOM 612 CA PHE A 38 -9.328 -5.128 7.545 1.00 13.30 C ATOM 613 C PHE A 38 -9.120 -5.945 6.261 1.00 10.45 C ATOM 614 O PHE A 38 -9.558 -5.543 5.186 1.00 35.05 O ATOM 615 CB PHE A 38 -7.997 -4.488 7.971 1.00 52.32 C ATOM 616 CG PHE A 38 -7.303 -3.742 6.853 1.00 51.10 C ATOM 617 CD1 PHE A 38 -7.683 -2.449 6.523 1.00 22.05 C ATOM 618 CD2 PHE A 38 -6.287 -4.344 6.121 1.00 44.51 C ATOM 619 CE1 PHE A 38 -7.061 -1.773 5.491 1.00 2.15 C ATOM 620 CE2 PHE A 38 -5.667 -3.673 5.086 1.00 65.44 C ATOM 621 CZ PHE A 38 -6.053 -2.386 4.771 1.00 13.34 C ATOM 0 H PHE A 38 -9.327 -5.941 9.486 1.00 73.00 H new ATOM 0 HA PHE A 38 -10.055 -4.344 7.335 1.00 13.30 H new ATOM 0 HB2 PHE A 38 -8.181 -3.801 8.797 1.00 52.32 H new ATOM 0 HB3 PHE A 38 -7.332 -5.266 8.346 1.00 52.32 H new ATOM 0 HD1 PHE A 38 -8.473 -1.966 7.079 1.00 22.05 H new ATOM 0 HD2 PHE A 38 -5.978 -5.350 6.365 1.00 44.51 H new ATOM 0 HE1 PHE A 38 -7.363 -0.765 5.247 1.00 2.15 H new ATOM 0 HE2 PHE A 38 -4.881 -4.155 4.524 1.00 65.44 H new ATOM 0 HZ PHE A 38 -5.568 -1.859 3.963 1.00 13.34 H new ATOM 631 N LEU A 39 -8.446 -7.090 6.383 1.00 13.42 N ATOM 632 CA LEU A 39 -8.135 -7.934 5.223 1.00 0.50 C ATOM 633 C LEU A 39 -9.400 -8.355 4.459 1.00 54.02 C ATOM 634 O LEU A 39 -9.494 -8.164 3.246 1.00 44.21 O ATOM 635 CB LEU A 39 -7.357 -9.177 5.675 1.00 42.01 C ATOM 636 CG LEU A 39 -5.968 -8.897 6.267 1.00 40.51 C ATOM 637 CD1 LEU A 39 -5.352 -10.177 6.815 1.00 35.20 C ATOM 638 CD2 LEU A 39 -5.053 -8.258 5.222 1.00 61.51 C ATOM 0 H LEU A 39 -8.104 -7.456 7.272 1.00 13.42 H new ATOM 0 HA LEU A 39 -7.523 -7.344 4.542 1.00 0.50 H new ATOM 0 HB2 LEU A 39 -7.951 -9.708 6.419 1.00 42.01 H new ATOM 0 HB3 LEU A 39 -7.243 -9.845 4.822 1.00 42.01 H new ATOM 0 HG LEU A 39 -6.083 -8.193 7.092 1.00 40.51 H new ATOM 0 HD11 LEU A 39 -4.368 -9.959 7.230 1.00 35.20 H new ATOM 0 HD12 LEU A 39 -5.994 -10.584 7.597 1.00 35.20 H new ATOM 0 HD13 LEU A 39 -5.253 -10.906 6.011 1.00 35.20 H new ATOM 0 HD21 LEU A 39 -4.074 -8.068 5.663 1.00 61.51 H new ATOM 0 HD22 LEU A 39 -4.944 -8.933 4.373 1.00 61.51 H new ATOM 0 HD23 LEU A 39 -5.488 -7.317 4.884 1.00 61.51 H new ATOM 650 N ASP A 40 -10.369 -8.916 5.173 1.00 14.45 N ATOM 651 CA ASP A 40 -11.608 -9.392 4.550 1.00 21.15 C ATOM 652 C ASP A 40 -12.425 -8.227 3.958 1.00 10.40 C ATOM 653 O ASP A 40 -12.907 -8.304 2.823 1.00 24.43 O ATOM 654 CB ASP A 40 -12.441 -10.161 5.576 1.00 31.13 C ATOM 655 CG ASP A 40 -13.672 -10.799 4.961 1.00 60.35 C ATOM 656 OD1 ASP A 40 -13.520 -11.790 4.217 1.00 40.15 O ATOM 657 OD2 ASP A 40 -14.797 -10.319 5.218 1.00 53.32 O ATOM 0 H ASP A 40 -10.325 -9.054 6.183 1.00 14.45 H new ATOM 0 HA ASP A 40 -11.343 -10.058 3.729 1.00 21.15 H new ATOM 0 HB2 ASP A 40 -11.825 -10.935 6.034 1.00 31.13 H new ATOM 0 HB3 ASP A 40 -12.746 -9.483 6.373 1.00 31.13 H new ATOM 662 N ASP A 41 -12.568 -7.150 4.730 1.00 63.15 N ATOM 663 CA ASP A 41 -13.293 -5.956 4.277 1.00 35.45 C ATOM 664 C ASP A 41 -12.627 -5.352 3.027 1.00 24.21 C ATOM 665 O ASP A 41 -13.301 -4.874 2.109 1.00 31.43 O ATOM 666 CB ASP A 41 -13.343 -4.926 5.413 1.00 1.54 C ATOM 667 CG ASP A 41 -14.279 -3.770 5.114 1.00 63.12 C ATOM 668 OD1 ASP A 41 -15.511 -3.960 5.227 1.00 71.33 O ATOM 669 OD2 ASP A 41 -13.795 -2.672 4.767 1.00 63.23 O ATOM 0 H ASP A 41 -12.191 -7.077 5.675 1.00 63.15 H new ATOM 0 HA ASP A 41 -14.310 -6.241 4.007 1.00 35.45 H new ATOM 0 HB2 ASP A 41 -13.663 -5.419 6.331 1.00 1.54 H new ATOM 0 HB3 ASP A 41 -12.340 -4.539 5.592 1.00 1.54 H new ATOM 674 N LEU A 42 -11.297 -5.388 3.009 1.00 64.54 N ATOM 675 CA LEU A 42 -10.507 -4.937 1.860 1.00 45.43 C ATOM 676 C LEU A 42 -10.789 -5.787 0.612 1.00 34.40 C ATOM 677 O LEU A 42 -11.151 -5.258 -0.439 1.00 43.15 O ATOM 678 CB LEU A 42 -9.012 -5.010 2.201 1.00 23.03 C ATOM 679 CG LEU A 42 -8.051 -4.677 1.048 1.00 14.12 C ATOM 680 CD1 LEU A 42 -8.135 -3.197 0.674 1.00 1.14 C ATOM 681 CD2 LEU A 42 -6.624 -5.073 1.416 1.00 21.32 C ATOM 0 H LEU A 42 -10.734 -5.730 3.788 1.00 64.54 H new ATOM 0 HA LEU A 42 -10.792 -3.908 1.641 1.00 45.43 H new ATOM 0 HB2 LEU A 42 -8.812 -4.326 3.026 1.00 23.03 H new ATOM 0 HB3 LEU A 42 -8.788 -6.015 2.558 1.00 23.03 H new ATOM 0 HG LEU A 42 -8.350 -5.254 0.173 1.00 14.12 H new ATOM 0 HD11 LEU A 42 -7.445 -2.989 -0.144 1.00 1.14 H new ATOM 0 HD12 LEU A 42 -9.151 -2.958 0.361 1.00 1.14 H new ATOM 0 HD13 LEU A 42 -7.868 -2.588 1.538 1.00 1.14 H new ATOM 0 HD21 LEU A 42 -5.955 -4.831 0.590 1.00 21.32 H new ATOM 0 HD22 LEU A 42 -6.313 -4.527 2.307 1.00 21.32 H new ATOM 0 HD23 LEU A 42 -6.583 -6.144 1.614 1.00 21.32 H new ATOM 693 N PHE A 43 -10.627 -7.107 0.741 1.00 4.30 N ATOM 694 CA PHE A 43 -10.816 -8.030 -0.389 1.00 45.21 C ATOM 695 C PHE A 43 -12.200 -7.866 -1.033 1.00 53.01 C ATOM 696 O PHE A 43 -12.323 -7.819 -2.258 1.00 32.10 O ATOM 697 CB PHE A 43 -10.611 -9.483 0.061 1.00 20.14 C ATOM 698 CG PHE A 43 -9.240 -9.760 0.637 1.00 71.32 C ATOM 699 CD1 PHE A 43 -8.132 -9.030 0.222 1.00 23.31 C ATOM 700 CD2 PHE A 43 -9.058 -10.755 1.588 1.00 34.21 C ATOM 701 CE1 PHE A 43 -6.877 -9.285 0.746 1.00 74.42 C ATOM 702 CE2 PHE A 43 -7.807 -11.012 2.113 1.00 2.12 C ATOM 703 CZ PHE A 43 -6.716 -10.276 1.693 1.00 20.12 C ATOM 0 H PHE A 43 -10.366 -7.563 1.615 1.00 4.30 H new ATOM 0 HA PHE A 43 -10.067 -7.781 -1.141 1.00 45.21 H new ATOM 0 HB2 PHE A 43 -11.365 -9.731 0.808 1.00 20.14 H new ATOM 0 HB3 PHE A 43 -10.777 -10.143 -0.790 1.00 20.14 H new ATOM 0 HD1 PHE A 43 -8.252 -8.254 -0.519 1.00 23.31 H new ATOM 0 HD2 PHE A 43 -9.906 -11.335 1.921 1.00 34.21 H new ATOM 0 HE1 PHE A 43 -6.025 -8.710 0.415 1.00 74.42 H new ATOM 0 HE2 PHE A 43 -7.681 -11.789 2.853 1.00 2.12 H new ATOM 0 HZ PHE A 43 -5.738 -10.476 2.105 1.00 20.12 H new ATOM 713 N SER A 44 -13.239 -7.775 -0.205 1.00 63.14 N ATOM 714 CA SER A 44 -14.596 -7.522 -0.704 1.00 75.35 C ATOM 715 C SER A 44 -14.676 -6.165 -1.422 1.00 4.33 C ATOM 716 O SER A 44 -15.205 -6.067 -2.529 1.00 62.20 O ATOM 717 CB SER A 44 -15.612 -7.562 0.447 1.00 11.31 C ATOM 718 OG SER A 44 -15.602 -8.822 1.102 1.00 64.35 O ATOM 0 H SER A 44 -13.172 -7.871 0.808 1.00 63.14 H new ATOM 0 HA SER A 44 -14.838 -8.308 -1.419 1.00 75.35 H new ATOM 0 HB2 SER A 44 -15.382 -6.775 1.165 1.00 11.31 H new ATOM 0 HB3 SER A 44 -16.611 -7.359 0.060 1.00 11.31 H new ATOM 0 HG SER A 44 -14.826 -8.874 1.699 1.00 64.35 H new ATOM 724 N PHE A 45 -14.123 -5.127 -0.793 1.00 43.35 N ATOM 725 CA PHE A 45 -14.157 -3.761 -1.341 1.00 11.03 C ATOM 726 C PHE A 45 -13.490 -3.676 -2.727 1.00 13.04 C ATOM 727 O PHE A 45 -14.084 -3.183 -3.689 1.00 25.35 O ATOM 728 CB PHE A 45 -13.465 -2.795 -0.363 1.00 65.44 C ATOM 729 CG PHE A 45 -13.409 -1.365 -0.844 1.00 20.13 C ATOM 730 CD1 PHE A 45 -14.530 -0.553 -0.781 1.00 60.34 C ATOM 731 CD2 PHE A 45 -12.230 -0.835 -1.356 1.00 24.45 C ATOM 732 CE1 PHE A 45 -14.477 0.757 -1.218 1.00 2.41 C ATOM 733 CE2 PHE A 45 -12.175 0.473 -1.794 1.00 4.32 C ATOM 734 CZ PHE A 45 -13.299 1.269 -1.725 1.00 75.35 C ATOM 0 H PHE A 45 -13.642 -5.203 0.103 1.00 43.35 H new ATOM 0 HA PHE A 45 -15.202 -3.478 -1.466 1.00 11.03 H new ATOM 0 HB2 PHE A 45 -13.989 -2.825 0.592 1.00 65.44 H new ATOM 0 HB3 PHE A 45 -12.449 -3.146 -0.181 1.00 65.44 H new ATOM 0 HD1 PHE A 45 -15.455 -0.948 -0.386 1.00 60.34 H new ATOM 0 HD2 PHE A 45 -11.347 -1.454 -1.412 1.00 24.45 H new ATOM 0 HE1 PHE A 45 -15.357 1.380 -1.163 1.00 2.41 H new ATOM 0 HE2 PHE A 45 -11.253 0.872 -2.190 1.00 4.32 H new ATOM 0 HZ PHE A 45 -13.258 2.292 -2.067 1.00 75.35 H new ATOM 744 N MET A 46 -12.255 -4.164 -2.822 1.00 64.34 N ATOM 745 CA MET A 46 -11.491 -4.108 -4.076 1.00 44.15 C ATOM 746 C MET A 46 -12.141 -4.973 -5.174 1.00 74.32 C ATOM 747 O MET A 46 -12.068 -4.651 -6.362 1.00 51.40 O ATOM 748 CB MET A 46 -10.036 -4.537 -3.824 1.00 2.23 C ATOM 749 CG MET A 46 -9.882 -5.984 -3.366 1.00 51.15 C ATOM 750 SD MET A 46 -8.227 -6.358 -2.743 1.00 2.20 S ATOM 751 CE MET A 46 -7.200 -5.911 -4.141 1.00 61.13 C ATOM 0 H MET A 46 -11.758 -4.604 -2.048 1.00 64.34 H new ATOM 0 HA MET A 46 -11.496 -3.078 -4.434 1.00 44.15 H new ATOM 0 HB2 MET A 46 -9.463 -4.395 -4.740 1.00 2.23 H new ATOM 0 HB3 MET A 46 -9.601 -3.881 -3.070 1.00 2.23 H new ATOM 0 HG2 MET A 46 -10.613 -6.191 -2.585 1.00 51.15 H new ATOM 0 HG3 MET A 46 -10.109 -6.649 -4.199 1.00 51.15 H new ATOM 0 HE1 MET A 46 -6.150 -5.989 -3.861 1.00 61.13 H new ATOM 0 HE2 MET A 46 -7.405 -6.585 -4.973 1.00 61.13 H new ATOM 0 HE3 MET A 46 -7.420 -4.886 -4.441 1.00 61.13 H new ATOM 761 N GLN A 47 -12.797 -6.057 -4.766 1.00 51.34 N ATOM 762 CA GLN A 47 -13.508 -6.941 -5.701 1.00 61.13 C ATOM 763 C GLN A 47 -14.738 -6.245 -6.318 1.00 34.03 C ATOM 764 O GLN A 47 -15.012 -6.390 -7.512 1.00 22.21 O ATOM 765 CB GLN A 47 -13.921 -8.230 -4.974 1.00 54.04 C ATOM 766 CG GLN A 47 -14.788 -9.169 -5.804 1.00 2.04 C ATOM 767 CD GLN A 47 -15.071 -10.482 -5.091 1.00 43.40 C ATOM 768 OE1 GLN A 47 -16.037 -10.605 -4.349 1.00 22.14 O ATOM 769 NE2 GLN A 47 -14.233 -11.478 -5.311 1.00 52.02 N ATOM 0 H GLN A 47 -12.854 -6.349 -3.790 1.00 51.34 H new ATOM 0 HA GLN A 47 -12.834 -7.188 -6.521 1.00 61.13 H new ATOM 0 HB2 GLN A 47 -13.022 -8.763 -4.665 1.00 54.04 H new ATOM 0 HB3 GLN A 47 -14.461 -7.964 -4.066 1.00 54.04 H new ATOM 0 HG2 GLN A 47 -15.731 -8.676 -6.038 1.00 2.04 H new ATOM 0 HG3 GLN A 47 -14.291 -9.374 -6.752 1.00 2.04 H new ATOM 0 HE21 GLN A 47 -13.437 -11.346 -5.934 1.00 52.02 H new ATOM 0 HE22 GLN A 47 -14.382 -12.379 -4.858 1.00 52.02 H new ATOM 778 N LYS A 48 -15.466 -5.483 -5.502 1.00 45.13 N ATOM 779 CA LYS A 48 -16.657 -4.748 -5.966 1.00 4.03 C ATOM 780 C LYS A 48 -16.333 -3.804 -7.137 1.00 1.35 C ATOM 781 O LYS A 48 -17.114 -3.681 -8.085 1.00 70.10 O ATOM 782 CB LYS A 48 -17.265 -3.946 -4.807 1.00 30.41 C ATOM 783 CG LYS A 48 -17.737 -4.818 -3.650 1.00 72.43 C ATOM 784 CD LYS A 48 -18.188 -3.992 -2.449 1.00 5.44 C ATOM 785 CE LYS A 48 -18.538 -4.880 -1.260 1.00 1.33 C ATOM 786 NZ LYS A 48 -19.661 -5.807 -1.561 1.00 71.34 N ATOM 0 H LYS A 48 -15.256 -5.354 -4.512 1.00 45.13 H new ATOM 0 HA LYS A 48 -17.376 -5.485 -6.323 1.00 4.03 H new ATOM 0 HB2 LYS A 48 -16.525 -3.236 -4.439 1.00 30.41 H new ATOM 0 HB3 LYS A 48 -18.107 -3.364 -5.180 1.00 30.41 H new ATOM 0 HG2 LYS A 48 -18.561 -5.448 -3.985 1.00 72.43 H new ATOM 0 HG3 LYS A 48 -16.929 -5.484 -3.347 1.00 72.43 H new ATOM 0 HD2 LYS A 48 -17.397 -3.298 -2.166 1.00 5.44 H new ATOM 0 HD3 LYS A 48 -19.055 -3.392 -2.724 1.00 5.44 H new ATOM 0 HE2 LYS A 48 -17.660 -5.458 -0.970 1.00 1.33 H new ATOM 0 HE3 LYS A 48 -18.804 -4.255 -0.408 1.00 1.33 H new ATOM 0 HZ1 LYS A 48 -19.942 -6.305 -0.693 1.00 71.34 H new ATOM 0 HZ2 LYS A 48 -20.470 -5.265 -1.926 1.00 71.34 H new ATOM 0 HZ3 LYS A 48 -19.358 -6.500 -2.275 1.00 71.34 H new ATOM 800 N ARG A 49 -15.178 -3.148 -7.070 1.00 63.44 N ATOM 801 CA ARG A 49 -14.755 -2.210 -8.121 1.00 73.52 C ATOM 802 C ARG A 49 -13.922 -2.902 -9.216 1.00 42.03 C ATOM 803 O ARG A 49 -13.274 -2.238 -10.025 1.00 54.24 O ATOM 804 CB ARG A 49 -13.974 -1.041 -7.508 1.00 41.42 C ATOM 805 CG ARG A 49 -12.806 -1.459 -6.618 1.00 11.11 C ATOM 806 CD ARG A 49 -12.018 -0.251 -6.119 1.00 12.34 C ATOM 807 NE ARG A 49 -12.867 0.725 -5.434 1.00 25.23 N ATOM 808 CZ ARG A 49 -13.057 1.954 -5.847 1.00 13.43 C ATOM 809 NH1 ARG A 49 -12.492 2.379 -6.931 1.00 64.22 N ATOM 810 NH2 ARG A 49 -13.829 2.749 -5.182 1.00 73.24 N ATOM 0 H ARG A 49 -14.514 -3.244 -6.302 1.00 63.44 H new ATOM 0 HA ARG A 49 -15.657 -1.826 -8.598 1.00 73.52 H new ATOM 0 HB2 ARG A 49 -13.594 -0.412 -8.313 1.00 41.42 H new ATOM 0 HB3 ARG A 49 -14.660 -0.429 -6.922 1.00 41.42 H new ATOM 0 HG2 ARG A 49 -13.182 -2.026 -5.766 1.00 11.11 H new ATOM 0 HG3 ARG A 49 -12.143 -2.122 -7.174 1.00 11.11 H new ATOM 0 HD2 ARG A 49 -11.235 -0.587 -5.440 1.00 12.34 H new ATOM 0 HD3 ARG A 49 -11.523 0.230 -6.963 1.00 12.34 H new ATOM 0 HE ARG A 49 -13.341 0.430 -4.581 1.00 25.23 H new ATOM 0 HH11 ARG A 49 -11.893 1.756 -7.472 1.00 64.22 H new ATOM 0 HH12 ARG A 49 -12.646 3.337 -7.244 1.00 64.22 H new ATOM 0 HH21 ARG A 49 -14.291 2.420 -4.334 1.00 73.24 H new ATOM 0 HH22 ARG A 49 -13.976 3.705 -5.505 1.00 73.24 H new ATOM 824 N GLY A 50 -13.949 -4.233 -9.240 1.00 30.34 N ATOM 825 CA GLY A 50 -13.297 -4.985 -10.310 1.00 44.15 C ATOM 826 C GLY A 50 -11.771 -4.995 -10.231 1.00 63.22 C ATOM 827 O GLY A 50 -11.091 -4.732 -11.222 1.00 62.12 O ATOM 0 H GLY A 50 -14.411 -4.809 -8.537 1.00 30.34 H new ATOM 0 HA2 GLY A 50 -13.657 -6.014 -10.287 1.00 44.15 H new ATOM 0 HA3 GLY A 50 -13.597 -4.564 -11.269 1.00 44.15 H new ATOM 831 N THR A 51 -11.231 -5.290 -9.050 1.00 32.51 N ATOM 832 CA THR A 51 -9.777 -5.462 -8.882 1.00 31.25 C ATOM 833 C THR A 51 -9.448 -6.215 -7.579 1.00 71.10 C ATOM 834 O THR A 51 -8.993 -5.628 -6.598 1.00 55.31 O ATOM 835 CB THR A 51 -9.017 -4.107 -8.930 1.00 32.34 C ATOM 836 OG1 THR A 51 -7.615 -4.312 -8.689 1.00 74.43 O ATOM 837 CG2 THR A 51 -9.574 -3.105 -7.918 1.00 72.22 C ATOM 0 H THR A 51 -11.771 -5.416 -8.194 1.00 32.51 H new ATOM 0 HA THR A 51 -9.435 -6.063 -9.725 1.00 31.25 H new ATOM 0 HB THR A 51 -9.159 -3.691 -9.927 1.00 32.34 H new ATOM 0 HG1 THR A 51 -7.148 -3.451 -8.723 1.00 74.43 H new ATOM 0 HG21 THR A 51 -9.015 -2.172 -7.984 1.00 72.22 H new ATOM 0 HG22 THR A 51 -10.625 -2.915 -8.135 1.00 72.22 H new ATOM 0 HG23 THR A 51 -9.480 -3.514 -6.912 1.00 72.22 H new ATOM 845 N PRO A 52 -9.702 -7.539 -7.551 1.00 34.50 N ATOM 846 CA PRO A 52 -9.485 -8.376 -6.361 1.00 74.01 C ATOM 847 C PRO A 52 -8.055 -8.938 -6.250 1.00 5.14 C ATOM 848 O PRO A 52 -7.150 -8.530 -6.980 1.00 64.32 O ATOM 849 CB PRO A 52 -10.492 -9.503 -6.588 1.00 72.23 C ATOM 850 CG PRO A 52 -10.504 -9.692 -8.072 1.00 42.03 C ATOM 851 CD PRO A 52 -10.239 -8.331 -8.679 1.00 3.22 C ATOM 0 HA PRO A 52 -9.613 -7.818 -5.434 1.00 74.01 H new ATOM 0 HB2 PRO A 52 -10.191 -10.415 -6.073 1.00 72.23 H new ATOM 0 HB3 PRO A 52 -11.480 -9.236 -6.213 1.00 72.23 H new ATOM 0 HG2 PRO A 52 -9.742 -10.409 -8.378 1.00 42.03 H new ATOM 0 HG3 PRO A 52 -11.464 -10.086 -8.406 1.00 42.03 H new ATOM 0 HD2 PRO A 52 -9.525 -8.392 -9.501 1.00 3.22 H new ATOM 0 HD3 PRO A 52 -11.150 -7.888 -9.081 1.00 3.22 H new ATOM 859 N VAL A 53 -7.857 -9.880 -5.327 1.00 41.00 N ATOM 860 CA VAL A 53 -6.546 -10.499 -5.127 1.00 61.42 C ATOM 861 C VAL A 53 -6.459 -11.871 -5.815 1.00 12.31 C ATOM 862 O VAL A 53 -7.134 -12.824 -5.420 1.00 54.13 O ATOM 863 CB VAL A 53 -6.221 -10.668 -3.619 1.00 15.01 C ATOM 864 CG1 VAL A 53 -4.836 -11.289 -3.421 1.00 20.42 C ATOM 865 CG2 VAL A 53 -6.321 -9.329 -2.893 1.00 44.15 C ATOM 0 H VAL A 53 -8.587 -10.231 -4.707 1.00 41.00 H new ATOM 0 HA VAL A 53 -5.815 -9.827 -5.577 1.00 61.42 H new ATOM 0 HB VAL A 53 -6.958 -11.347 -3.190 1.00 15.01 H new ATOM 0 HG11 VAL A 53 -4.634 -11.396 -2.355 1.00 20.42 H new ATOM 0 HG12 VAL A 53 -4.806 -12.269 -3.896 1.00 20.42 H new ATOM 0 HG13 VAL A 53 -4.081 -10.644 -3.870 1.00 20.42 H new ATOM 0 HG21 VAL A 53 -6.089 -9.469 -1.837 1.00 44.15 H new ATOM 0 HG22 VAL A 53 -5.613 -8.625 -3.329 1.00 44.15 H new ATOM 0 HG23 VAL A 53 -7.332 -8.935 -2.993 1.00 44.15 H new ATOM 875 N ASN A 54 -5.635 -11.957 -6.855 1.00 11.34 N ATOM 876 CA ASN A 54 -5.378 -13.227 -7.546 1.00 54.51 C ATOM 877 C ASN A 54 -4.277 -14.035 -6.831 1.00 22.14 C ATOM 878 O ASN A 54 -4.513 -15.158 -6.385 1.00 61.43 O ATOM 879 CB ASN A 54 -5.013 -12.977 -9.020 1.00 64.33 C ATOM 880 CG ASN A 54 -4.213 -11.703 -9.235 1.00 74.54 C ATOM 881 OD1 ASN A 54 -3.527 -11.222 -8.340 1.00 21.03 O ATOM 882 ND2 ASN A 54 -4.290 -11.146 -10.426 1.00 20.01 N ATOM 0 H ASN A 54 -5.129 -11.161 -7.243 1.00 11.34 H new ATOM 0 HA ASN A 54 -6.292 -13.820 -7.518 1.00 54.51 H new ATOM 0 HB2 ASN A 54 -4.439 -13.825 -9.394 1.00 64.33 H new ATOM 0 HB3 ASN A 54 -5.928 -12.927 -9.610 1.00 64.33 H new ATOM 0 HD21 ASN A 54 -3.770 -10.291 -10.624 1.00 20.01 H new ATOM 0 HD22 ASN A 54 -4.869 -11.570 -11.151 1.00 20.01 H new ATOM 889 N ARG A 55 -3.078 -13.464 -6.731 1.00 3.20 N ATOM 890 CA ARG A 55 -2.008 -14.047 -5.913 1.00 13.21 C ATOM 891 C ARG A 55 -1.103 -12.943 -5.351 1.00 71.23 C ATOM 892 O ARG A 55 -0.854 -11.934 -6.014 1.00 64.42 O ATOM 893 CB ARG A 55 -1.184 -15.096 -6.694 1.00 61.23 C ATOM 894 CG ARG A 55 -0.179 -14.548 -7.713 1.00 24.53 C ATOM 895 CD ARG A 55 -0.842 -13.858 -8.905 1.00 4.21 C ATOM 896 NE ARG A 55 -0.852 -12.399 -8.770 1.00 62.00 N ATOM 897 CZ ARG A 55 -0.838 -11.572 -9.781 1.00 42.44 C ATOM 898 NH1 ARG A 55 -0.814 -12.018 -10.998 1.00 52.40 N ATOM 899 NH2 ARG A 55 -0.845 -10.297 -9.573 1.00 61.33 N ATOM 0 H ARG A 55 -2.820 -12.598 -7.205 1.00 3.20 H new ATOM 0 HA ARG A 55 -2.479 -14.571 -5.081 1.00 13.21 H new ATOM 0 HB2 ARG A 55 -0.642 -15.710 -5.975 1.00 61.23 H new ATOM 0 HB3 ARG A 55 -1.877 -15.755 -7.217 1.00 61.23 H new ATOM 0 HG2 ARG A 55 0.484 -13.840 -7.215 1.00 24.53 H new ATOM 0 HG3 ARG A 55 0.443 -15.366 -8.076 1.00 24.53 H new ATOM 0 HD2 ARG A 55 -0.316 -14.132 -9.819 1.00 4.21 H new ATOM 0 HD3 ARG A 55 -1.866 -14.218 -9.007 1.00 4.21 H new ATOM 0 HE ARG A 55 -0.871 -12.005 -7.829 1.00 62.00 H new ATOM 0 HH11 ARG A 55 -0.806 -13.023 -11.173 1.00 52.40 H new ATOM 0 HH12 ARG A 55 -0.803 -11.364 -11.781 1.00 52.40 H new ATOM 0 HH21 ARG A 55 -0.861 -9.936 -8.619 1.00 61.33 H new ATOM 0 HH22 ARG A 55 -0.834 -9.651 -10.363 1.00 61.33 H new ATOM 913 N ILE A 56 -0.620 -13.132 -4.130 1.00 74.30 N ATOM 914 CA ILE A 56 0.122 -12.085 -3.421 1.00 11.33 C ATOM 915 C ILE A 56 1.627 -12.116 -3.749 1.00 24.33 C ATOM 916 O ILE A 56 2.260 -13.173 -3.699 1.00 32.24 O ATOM 917 CB ILE A 56 -0.083 -12.217 -1.890 1.00 74.34 C ATOM 918 CG1 ILE A 56 -1.585 -12.218 -1.565 1.00 4.13 C ATOM 919 CG2 ILE A 56 0.630 -11.089 -1.137 1.00 53.41 C ATOM 920 CD1 ILE A 56 -1.895 -12.377 -0.095 1.00 4.43 C ATOM 0 H ILE A 56 -0.726 -14.000 -3.605 1.00 74.30 H new ATOM 0 HA ILE A 56 -0.273 -11.128 -3.761 1.00 11.33 H new ATOM 0 HB ILE A 56 0.354 -13.161 -1.563 1.00 74.34 H new ATOM 0 HG12 ILE A 56 -2.024 -11.285 -1.920 1.00 4.13 H new ATOM 0 HG13 ILE A 56 -2.065 -13.026 -2.117 1.00 4.13 H new ATOM 0 HG21 ILE A 56 0.468 -11.208 -0.066 1.00 53.41 H new ATOM 0 HG22 ILE A 56 1.698 -11.128 -1.349 1.00 53.41 H new ATOM 0 HG23 ILE A 56 0.231 -10.127 -1.460 1.00 53.41 H new ATOM 0 HD11 ILE A 56 -2.975 -12.368 0.052 1.00 4.43 H new ATOM 0 HD12 ILE A 56 -1.488 -13.323 0.262 1.00 4.43 H new ATOM 0 HD13 ILE A 56 -1.446 -11.555 0.463 1.00 4.43 H new ATOM 932 N PRO A 57 2.216 -10.949 -4.093 1.00 53.33 N ATOM 933 CA PRO A 57 3.658 -10.837 -4.388 1.00 11.23 C ATOM 934 C PRO A 57 4.551 -11.205 -3.188 1.00 65.04 C ATOM 935 O PRO A 57 4.219 -10.925 -2.032 1.00 21.04 O ATOM 936 CB PRO A 57 3.836 -9.354 -4.756 1.00 14.12 C ATOM 937 CG PRO A 57 2.661 -8.666 -4.143 1.00 61.33 C ATOM 938 CD PRO A 57 1.531 -9.649 -4.229 1.00 60.40 C ATOM 0 HA PRO A 57 3.958 -11.528 -5.176 1.00 11.23 H new ATOM 0 HB2 PRO A 57 4.774 -8.959 -4.365 1.00 14.12 H new ATOM 0 HB3 PRO A 57 3.857 -9.214 -5.837 1.00 14.12 H new ATOM 0 HG2 PRO A 57 2.864 -8.391 -3.108 1.00 61.33 H new ATOM 0 HG3 PRO A 57 2.422 -7.746 -4.677 1.00 61.33 H new ATOM 0 HD2 PRO A 57 0.798 -9.493 -3.437 1.00 60.40 H new ATOM 0 HD3 PRO A 57 0.998 -9.570 -5.176 1.00 60.40 H new ATOM 946 N ILE A 58 5.690 -11.832 -3.475 1.00 43.33 N ATOM 947 CA ILE A 58 6.630 -12.265 -2.433 1.00 24.30 C ATOM 948 C ILE A 58 7.917 -11.421 -2.452 1.00 22.54 C ATOM 949 O ILE A 58 8.398 -11.024 -3.515 1.00 14.51 O ATOM 950 CB ILE A 58 7.003 -13.760 -2.613 1.00 53.24 C ATOM 951 CG1 ILE A 58 5.738 -14.635 -2.607 1.00 12.44 C ATOM 952 CG2 ILE A 58 7.978 -14.220 -1.529 1.00 21.02 C ATOM 953 CD1 ILE A 58 4.953 -14.583 -1.312 1.00 2.42 C ATOM 0 H ILE A 58 5.989 -12.054 -4.425 1.00 43.33 H new ATOM 0 HA ILE A 58 6.130 -12.127 -1.474 1.00 24.30 H new ATOM 0 HB ILE A 58 7.498 -13.869 -3.578 1.00 53.24 H new ATOM 0 HG12 ILE A 58 5.089 -14.322 -3.425 1.00 12.44 H new ATOM 0 HG13 ILE A 58 6.024 -15.668 -2.805 1.00 12.44 H new ATOM 0 HG21 ILE A 58 8.221 -15.272 -1.681 1.00 21.02 H new ATOM 0 HG22 ILE A 58 8.890 -13.625 -1.583 1.00 21.02 H new ATOM 0 HG23 ILE A 58 7.519 -14.092 -0.549 1.00 21.02 H new ATOM 0 HD11 ILE A 58 4.077 -15.227 -1.391 1.00 2.42 H new ATOM 0 HD12 ILE A 58 5.583 -14.926 -0.491 1.00 2.42 H new ATOM 0 HD13 ILE A 58 4.634 -13.558 -1.121 1.00 2.42 H new ATOM 965 N MET A 59 8.466 -11.151 -1.270 1.00 22.22 N ATOM 966 CA MET A 59 9.731 -10.423 -1.145 1.00 75.42 C ATOM 967 C MET A 59 10.643 -11.115 -0.120 1.00 0.02 C ATOM 968 O MET A 59 10.239 -11.339 1.020 1.00 73.53 O ATOM 969 CB MET A 59 9.476 -8.969 -0.719 1.00 74.42 C ATOM 970 CG MET A 59 10.724 -8.095 -0.753 1.00 1.13 C ATOM 971 SD MET A 59 11.341 -7.838 -2.426 1.00 62.52 S ATOM 972 CE MET A 59 9.988 -6.914 -3.153 1.00 30.30 C ATOM 0 H MET A 59 8.053 -11.426 -0.379 1.00 22.22 H new ATOM 0 HA MET A 59 10.224 -10.422 -2.117 1.00 75.42 H new ATOM 0 HB2 MET A 59 8.721 -8.535 -1.374 1.00 74.42 H new ATOM 0 HB3 MET A 59 9.065 -8.962 0.291 1.00 74.42 H new ATOM 0 HG2 MET A 59 10.500 -7.129 -0.300 1.00 1.13 H new ATOM 0 HG3 MET A 59 11.504 -8.558 -0.149 1.00 1.13 H new ATOM 0 HE1 MET A 59 10.351 -6.355 -4.015 1.00 30.30 H new ATOM 0 HE2 MET A 59 9.206 -7.604 -3.471 1.00 30.30 H new ATOM 0 HE3 MET A 59 9.583 -6.221 -2.415 1.00 30.30 H new ATOM 982 N ALA A 60 11.863 -11.463 -0.532 1.00 21.21 N ATOM 983 CA ALA A 60 12.821 -12.145 0.353 1.00 72.44 C ATOM 984 C ALA A 60 12.248 -13.472 0.903 1.00 4.22 C ATOM 985 O ALA A 60 12.477 -13.828 2.063 1.00 12.53 O ATOM 986 CB ALA A 60 13.229 -11.218 1.496 1.00 23.44 C ATOM 0 H ALA A 60 12.215 -11.286 -1.473 1.00 21.21 H new ATOM 0 HA ALA A 60 13.704 -12.394 -0.236 1.00 72.44 H new ATOM 0 HB1 ALA A 60 13.938 -11.731 2.145 1.00 23.44 H new ATOM 0 HB2 ALA A 60 13.694 -10.321 1.088 1.00 23.44 H new ATOM 0 HB3 ALA A 60 12.346 -10.939 2.071 1.00 23.44 H new ATOM 992 N LYS A 61 11.498 -14.186 0.055 1.00 24.10 N ATOM 993 CA LYS A 61 10.894 -15.489 0.402 1.00 14.10 C ATOM 994 C LYS A 61 9.759 -15.395 1.444 1.00 2.34 C ATOM 995 O LYS A 61 9.206 -16.422 1.849 1.00 43.35 O ATOM 996 CB LYS A 61 11.961 -16.500 0.860 1.00 24.21 C ATOM 997 CG LYS A 61 12.751 -17.119 -0.290 1.00 21.25 C ATOM 998 CD LYS A 61 11.884 -18.087 -1.096 1.00 73.30 C ATOM 999 CE LYS A 61 12.613 -18.647 -2.309 1.00 75.31 C ATOM 1000 NZ LYS A 61 12.960 -17.586 -3.295 1.00 51.25 N ATOM 0 H LYS A 61 11.289 -13.880 -0.895 1.00 24.10 H new ATOM 0 HA LYS A 61 10.436 -15.847 -0.520 1.00 14.10 H new ATOM 0 HB2 LYS A 61 12.654 -16.002 1.539 1.00 24.21 H new ATOM 0 HB3 LYS A 61 11.476 -17.295 1.426 1.00 24.21 H new ATOM 0 HG2 LYS A 61 13.125 -16.331 -0.944 1.00 21.25 H new ATOM 0 HG3 LYS A 61 13.620 -17.646 0.104 1.00 21.25 H new ATOM 0 HD2 LYS A 61 11.569 -18.909 -0.454 1.00 73.30 H new ATOM 0 HD3 LYS A 61 10.980 -17.574 -1.424 1.00 73.30 H new ATOM 0 HE2 LYS A 61 13.523 -19.150 -1.983 1.00 75.31 H new ATOM 0 HE3 LYS A 61 11.988 -19.399 -2.791 1.00 75.31 H new ATOM 0 HZ1 LYS A 61 12.664 -17.886 -4.246 1.00 51.25 H new ATOM 0 HZ2 LYS A 61 12.471 -16.704 -3.042 1.00 51.25 H new ATOM 0 HZ3 LYS A 61 13.988 -17.427 -3.286 1.00 51.25 H new ATOM 1014 N GLN A 62 9.398 -14.183 1.867 1.00 2.22 N ATOM 1015 CA GLN A 62 8.224 -13.995 2.735 1.00 21.44 C ATOM 1016 C GLN A 62 7.100 -13.282 1.972 1.00 71.50 C ATOM 1017 O GLN A 62 7.351 -12.585 0.986 1.00 74.15 O ATOM 1018 CB GLN A 62 8.570 -13.186 3.999 1.00 55.23 C ATOM 1019 CG GLN A 62 8.884 -11.714 3.739 1.00 44.52 C ATOM 1020 CD GLN A 62 8.696 -10.846 4.975 1.00 43.04 C ATOM 1021 OE1 GLN A 62 9.611 -10.665 5.769 1.00 63.31 O ATOM 1022 NE2 GLN A 62 7.507 -10.300 5.142 1.00 31.25 N ATOM 0 H GLN A 62 9.892 -13.323 1.629 1.00 2.22 H new ATOM 0 HA GLN A 62 7.891 -14.987 3.041 1.00 21.44 H new ATOM 0 HB2 GLN A 62 7.735 -13.249 4.696 1.00 55.23 H new ATOM 0 HB3 GLN A 62 9.428 -13.647 4.487 1.00 55.23 H new ATOM 0 HG2 GLN A 62 9.912 -11.622 3.389 1.00 44.52 H new ATOM 0 HG3 GLN A 62 8.241 -11.345 2.940 1.00 44.52 H new ATOM 0 HE21 GLN A 62 6.767 -10.471 4.461 1.00 31.25 H new ATOM 0 HE22 GLN A 62 7.328 -9.706 5.952 1.00 31.25 H new ATOM 1031 N VAL A 63 5.866 -13.454 2.430 1.00 74.52 N ATOM 1032 CA VAL A 63 4.722 -12.783 1.813 1.00 21.15 C ATOM 1033 C VAL A 63 4.766 -11.269 2.059 1.00 3.31 C ATOM 1034 O VAL A 63 5.198 -10.812 3.122 1.00 12.14 O ATOM 1035 CB VAL A 63 3.376 -13.346 2.342 1.00 32.34 C ATOM 1036 CG1 VAL A 63 3.258 -13.172 3.855 1.00 12.52 C ATOM 1037 CG2 VAL A 63 2.195 -12.689 1.629 1.00 64.23 C ATOM 0 H VAL A 63 5.629 -14.050 3.224 1.00 74.52 H new ATOM 0 HA VAL A 63 4.788 -12.975 0.742 1.00 21.15 H new ATOM 0 HB VAL A 63 3.356 -14.414 2.126 1.00 32.34 H new ATOM 0 HG11 VAL A 63 2.304 -13.576 4.194 1.00 12.52 H new ATOM 0 HG12 VAL A 63 4.073 -13.703 4.347 1.00 12.52 H new ATOM 0 HG13 VAL A 63 3.312 -12.112 4.105 1.00 12.52 H new ATOM 0 HG21 VAL A 63 1.262 -13.099 2.016 1.00 64.23 H new ATOM 0 HG22 VAL A 63 2.218 -11.613 1.803 1.00 64.23 H new ATOM 0 HG23 VAL A 63 2.261 -12.885 0.559 1.00 64.23 H new ATOM 1047 N LEU A 64 4.347 -10.490 1.067 1.00 61.13 N ATOM 1048 CA LEU A 64 4.183 -9.054 1.259 1.00 51.54 C ATOM 1049 C LEU A 64 2.980 -8.792 2.175 1.00 63.23 C ATOM 1050 O LEU A 64 1.831 -8.781 1.727 1.00 63.53 O ATOM 1051 CB LEU A 64 4.007 -8.343 -0.092 1.00 44.14 C ATOM 1052 CG LEU A 64 3.888 -6.810 -0.020 1.00 42.03 C ATOM 1053 CD1 LEU A 64 5.105 -6.206 0.678 1.00 43.31 C ATOM 1054 CD2 LEU A 64 3.717 -6.216 -1.418 1.00 64.24 C ATOM 0 H LEU A 64 4.117 -10.825 0.131 1.00 61.13 H new ATOM 0 HA LEU A 64 5.080 -8.653 1.731 1.00 51.54 H new ATOM 0 HB2 LEU A 64 4.854 -8.595 -0.729 1.00 44.14 H new ATOM 0 HB3 LEU A 64 3.114 -8.737 -0.578 1.00 44.14 H new ATOM 0 HG LEU A 64 3.002 -6.564 0.566 1.00 42.03 H new ATOM 0 HD11 LEU A 64 5.001 -5.122 0.718 1.00 43.31 H new ATOM 0 HD12 LEU A 64 5.177 -6.601 1.691 1.00 43.31 H new ATOM 0 HD13 LEU A 64 6.007 -6.463 0.123 1.00 43.31 H new ATOM 0 HD21 LEU A 64 3.635 -5.132 -1.345 1.00 64.24 H new ATOM 0 HD22 LEU A 64 4.581 -6.474 -2.031 1.00 64.24 H new ATOM 0 HD23 LEU A 64 2.814 -6.618 -1.876 1.00 64.24 H new ATOM 1066 N ASP A 65 3.251 -8.627 3.468 1.00 24.22 N ATOM 1067 CA ASP A 65 2.199 -8.425 4.466 1.00 13.43 C ATOM 1068 C ASP A 65 1.309 -7.221 4.112 1.00 11.23 C ATOM 1069 O ASP A 65 1.598 -6.091 4.502 1.00 43.33 O ATOM 1070 CB ASP A 65 2.822 -8.225 5.851 1.00 70.45 C ATOM 1071 CG ASP A 65 3.824 -9.311 6.202 1.00 53.01 C ATOM 1072 OD1 ASP A 65 3.404 -10.391 6.657 1.00 51.24 O ATOM 1073 OD2 ASP A 65 5.040 -9.078 6.035 1.00 60.31 O ATOM 0 H ASP A 65 4.196 -8.629 3.852 1.00 24.22 H new ATOM 0 HA ASP A 65 1.571 -9.316 4.475 1.00 13.43 H new ATOM 0 HB2 ASP A 65 3.316 -7.254 5.886 1.00 70.45 H new ATOM 0 HB3 ASP A 65 2.032 -8.208 6.602 1.00 70.45 H new ATOM 1078 N LEU A 66 0.231 -7.477 3.370 1.00 41.55 N ATOM 1079 CA LEU A 66 -0.671 -6.412 2.900 1.00 25.44 C ATOM 1080 C LEU A 66 -1.137 -5.499 4.048 1.00 74.02 C ATOM 1081 O LEU A 66 -1.085 -4.272 3.939 1.00 34.52 O ATOM 1082 CB LEU A 66 -1.887 -7.020 2.183 1.00 1.31 C ATOM 1083 CG LEU A 66 -1.564 -7.839 0.920 1.00 52.21 C ATOM 1084 CD1 LEU A 66 -2.843 -8.379 0.281 1.00 1.52 C ATOM 1085 CD2 LEU A 66 -0.772 -6.999 -0.084 1.00 64.23 C ATOM 0 H LEU A 66 -0.044 -8.415 3.078 1.00 41.55 H new ATOM 0 HA LEU A 66 -0.107 -5.797 2.199 1.00 25.44 H new ATOM 0 HB2 LEU A 66 -2.419 -7.661 2.886 1.00 1.31 H new ATOM 0 HB3 LEU A 66 -2.567 -6.214 1.909 1.00 1.31 H new ATOM 0 HG LEU A 66 -0.947 -8.687 1.216 1.00 52.21 H new ATOM 0 HD11 LEU A 66 -2.590 -8.954 -0.610 1.00 1.52 H new ATOM 0 HD12 LEU A 66 -3.362 -9.021 0.992 1.00 1.52 H new ATOM 0 HD13 LEU A 66 -3.490 -7.547 0.004 1.00 1.52 H new ATOM 0 HD21 LEU A 66 -0.555 -7.598 -0.968 1.00 64.23 H new ATOM 0 HD22 LEU A 66 -1.359 -6.127 -0.372 1.00 64.23 H new ATOM 0 HD23 LEU A 66 0.163 -6.673 0.372 1.00 64.23 H new ATOM 1097 N PHE A 67 -1.578 -6.105 5.149 1.00 33.54 N ATOM 1098 CA PHE A 67 -2.033 -5.345 6.319 1.00 0.35 C ATOM 1099 C PHE A 67 -0.926 -4.411 6.839 1.00 74.30 C ATOM 1100 O PHE A 67 -1.147 -3.218 7.037 1.00 35.12 O ATOM 1101 CB PHE A 67 -2.469 -6.312 7.433 1.00 2.34 C ATOM 1102 CG PHE A 67 -3.081 -5.632 8.637 1.00 62.20 C ATOM 1103 CD1 PHE A 67 -2.283 -5.139 9.661 1.00 72.45 C ATOM 1104 CD2 PHE A 67 -4.457 -5.491 8.745 1.00 2.44 C ATOM 1105 CE1 PHE A 67 -2.843 -4.520 10.762 1.00 12.22 C ATOM 1106 CE2 PHE A 67 -5.020 -4.871 9.844 1.00 64.41 C ATOM 1107 CZ PHE A 67 -4.214 -4.385 10.852 1.00 61.33 C ATOM 0 H PHE A 67 -1.631 -7.118 5.258 1.00 33.54 H new ATOM 0 HA PHE A 67 -2.882 -4.731 6.018 1.00 0.35 H new ATOM 0 HB2 PHE A 67 -3.190 -7.020 7.023 1.00 2.34 H new ATOM 0 HB3 PHE A 67 -1.604 -6.890 7.757 1.00 2.34 H new ATOM 0 HD1 PHE A 67 -1.210 -5.241 9.596 1.00 72.45 H new ATOM 0 HD2 PHE A 67 -5.096 -5.870 7.961 1.00 2.44 H new ATOM 0 HE1 PHE A 67 -2.209 -4.142 11.551 1.00 12.22 H new ATOM 0 HE2 PHE A 67 -6.093 -4.767 9.914 1.00 64.41 H new ATOM 0 HZ PHE A 67 -4.655 -3.900 11.710 1.00 61.33 H new ATOM 1117 N MET A 68 0.270 -4.963 7.035 1.00 15.43 N ATOM 1118 CA MET A 68 1.396 -4.196 7.581 1.00 30.22 C ATOM 1119 C MET A 68 1.838 -3.091 6.606 1.00 55.21 C ATOM 1120 O MET A 68 2.095 -1.956 7.008 1.00 32.15 O ATOM 1121 CB MET A 68 2.576 -5.130 7.881 1.00 12.14 C ATOM 1122 CG MET A 68 2.213 -6.326 8.751 1.00 11.51 C ATOM 1123 SD MET A 68 1.521 -5.857 10.349 1.00 62.30 S ATOM 1124 CE MET A 68 2.876 -4.911 11.045 1.00 14.45 C ATOM 0 H MET A 68 0.488 -5.937 6.825 1.00 15.43 H new ATOM 0 HA MET A 68 1.066 -3.724 8.506 1.00 30.22 H new ATOM 0 HB2 MET A 68 2.989 -5.491 6.939 1.00 12.14 H new ATOM 0 HB3 MET A 68 3.362 -4.559 8.376 1.00 12.14 H new ATOM 0 HG2 MET A 68 1.494 -6.949 8.219 1.00 11.51 H new ATOM 0 HG3 MET A 68 3.103 -6.934 8.912 1.00 11.51 H new ATOM 0 HE1 MET A 68 2.716 -4.780 12.115 1.00 14.45 H new ATOM 0 HE2 MET A 68 3.813 -5.443 10.880 1.00 14.45 H new ATOM 0 HE3 MET A 68 2.923 -3.935 10.563 1.00 14.45 H new ATOM 1134 N LEU A 69 1.917 -3.438 5.323 1.00 62.22 N ATOM 1135 CA LEU A 69 2.286 -2.488 4.270 1.00 24.40 C ATOM 1136 C LEU A 69 1.374 -1.250 4.299 1.00 73.32 C ATOM 1137 O LEU A 69 1.846 -0.112 4.326 1.00 0.45 O ATOM 1138 CB LEU A 69 2.195 -3.182 2.900 1.00 4.40 C ATOM 1139 CG LEU A 69 2.680 -2.355 1.697 1.00 71.44 C ATOM 1140 CD1 LEU A 69 4.162 -2.020 1.836 1.00 44.41 C ATOM 1141 CD2 LEU A 69 2.416 -3.102 0.390 1.00 20.11 C ATOM 0 H LEU A 69 1.728 -4.381 4.983 1.00 62.22 H new ATOM 0 HA LEU A 69 3.309 -2.155 4.443 1.00 24.40 H new ATOM 0 HB2 LEU A 69 2.776 -4.103 2.941 1.00 4.40 H new ATOM 0 HB3 LEU A 69 1.157 -3.467 2.726 1.00 4.40 H new ATOM 0 HG LEU A 69 2.120 -1.420 1.676 1.00 71.44 H new ATOM 0 HD11 LEU A 69 4.485 -1.435 0.975 1.00 44.41 H new ATOM 0 HD12 LEU A 69 4.321 -1.443 2.747 1.00 44.41 H new ATOM 0 HD13 LEU A 69 4.740 -2.943 1.885 1.00 44.41 H new ATOM 0 HD21 LEU A 69 2.766 -2.501 -0.450 1.00 20.11 H new ATOM 0 HD22 LEU A 69 2.947 -4.054 0.401 1.00 20.11 H new ATOM 0 HD23 LEU A 69 1.347 -3.284 0.285 1.00 20.11 H new ATOM 1153 N TYR A 70 0.063 -1.493 4.311 1.00 41.41 N ATOM 1154 CA TYR A 70 -0.934 -0.419 4.370 1.00 41.43 C ATOM 1155 C TYR A 70 -0.739 0.457 5.623 1.00 54.20 C ATOM 1156 O TYR A 70 -0.807 1.684 5.553 1.00 54.43 O ATOM 1157 CB TYR A 70 -2.344 -1.026 4.357 1.00 31.23 C ATOM 1158 CG TYR A 70 -3.468 -0.009 4.258 1.00 54.34 C ATOM 1159 CD1 TYR A 70 -3.869 0.493 3.022 1.00 5.20 C ATOM 1160 CD2 TYR A 70 -4.139 0.439 5.394 1.00 13.42 C ATOM 1161 CE1 TYR A 70 -4.902 1.407 2.922 1.00 75.10 C ATOM 1162 CE2 TYR A 70 -5.170 1.355 5.301 1.00 5.51 C ATOM 1163 CZ TYR A 70 -5.548 1.836 4.063 1.00 12.10 C ATOM 1164 OH TYR A 70 -6.579 2.745 3.966 1.00 62.41 O ATOM 0 H TYR A 70 -0.337 -2.431 4.280 1.00 41.41 H new ATOM 0 HA TYR A 70 -0.806 0.220 3.496 1.00 41.43 H new ATOM 0 HB2 TYR A 70 -2.421 -1.716 3.517 1.00 31.23 H new ATOM 0 HB3 TYR A 70 -2.481 -1.613 5.265 1.00 31.23 H new ATOM 0 HD1 TYR A 70 -3.364 0.163 2.126 1.00 5.20 H new ATOM 0 HD2 TYR A 70 -3.848 0.064 6.364 1.00 13.42 H new ATOM 0 HE1 TYR A 70 -5.202 1.783 1.955 1.00 75.10 H new ATOM 0 HE2 TYR A 70 -5.678 1.693 6.192 1.00 5.51 H new ATOM 0 HH TYR A 70 -6.927 2.942 4.861 1.00 62.41 H new ATOM 1174 N VAL A 71 -0.492 -0.185 6.765 1.00 21.30 N ATOM 1175 CA VAL A 71 -0.256 0.526 8.031 1.00 54.34 C ATOM 1176 C VAL A 71 0.921 1.516 7.926 1.00 4.04 C ATOM 1177 O VAL A 71 0.773 2.702 8.231 1.00 41.50 O ATOM 1178 CB VAL A 71 0.004 -0.477 9.190 1.00 61.24 C ATOM 1179 CG1 VAL A 71 0.432 0.242 10.467 1.00 33.12 C ATOM 1180 CG2 VAL A 71 -1.239 -1.326 9.452 1.00 43.12 C ATOM 0 H VAL A 71 -0.449 -1.201 6.844 1.00 21.30 H new ATOM 0 HA VAL A 71 -1.160 1.096 8.246 1.00 54.34 H new ATOM 0 HB VAL A 71 0.821 -1.131 8.884 1.00 61.24 H new ATOM 0 HG11 VAL A 71 0.605 -0.490 11.256 1.00 33.12 H new ATOM 0 HG12 VAL A 71 1.350 0.799 10.281 1.00 33.12 H new ATOM 0 HG13 VAL A 71 -0.354 0.931 10.777 1.00 33.12 H new ATOM 0 HG21 VAL A 71 -1.039 -2.022 10.266 1.00 43.12 H new ATOM 0 HG22 VAL A 71 -2.071 -0.678 9.725 1.00 43.12 H new ATOM 0 HG23 VAL A 71 -1.495 -1.884 8.552 1.00 43.12 H new ATOM 1190 N LEU A 72 2.079 1.026 7.477 1.00 11.45 N ATOM 1191 CA LEU A 72 3.294 1.855 7.376 1.00 71.23 C ATOM 1192 C LEU A 72 3.150 2.993 6.348 1.00 73.11 C ATOM 1193 O LEU A 72 3.619 4.110 6.574 1.00 71.01 O ATOM 1194 CB LEU A 72 4.514 0.984 7.024 1.00 64.40 C ATOM 1195 CG LEU A 72 5.178 0.251 8.205 1.00 24.42 C ATOM 1196 CD1 LEU A 72 5.689 1.251 9.241 1.00 33.10 C ATOM 1197 CD2 LEU A 72 4.218 -0.749 8.848 1.00 60.13 C ATOM 0 H LEU A 72 2.206 0.060 7.176 1.00 11.45 H new ATOM 0 HA LEU A 72 3.442 2.315 8.353 1.00 71.23 H new ATOM 0 HB2 LEU A 72 4.206 0.242 6.287 1.00 64.40 H new ATOM 0 HB3 LEU A 72 5.262 1.616 6.546 1.00 64.40 H new ATOM 0 HG LEU A 72 6.029 -0.308 7.815 1.00 24.42 H new ATOM 0 HD11 LEU A 72 6.154 0.713 10.067 1.00 33.10 H new ATOM 0 HD12 LEU A 72 6.423 1.911 8.778 1.00 33.10 H new ATOM 0 HD13 LEU A 72 4.855 1.843 9.618 1.00 33.10 H new ATOM 0 HD21 LEU A 72 4.716 -1.250 9.678 1.00 60.13 H new ATOM 0 HD22 LEU A 72 3.338 -0.223 9.217 1.00 60.13 H new ATOM 0 HD23 LEU A 72 3.914 -1.489 8.108 1.00 60.13 H new ATOM 1209 N VAL A 73 2.510 2.714 5.216 1.00 1.33 N ATOM 1210 CA VAL A 73 2.337 3.727 4.166 1.00 22.42 C ATOM 1211 C VAL A 73 1.349 4.832 4.590 1.00 20.11 C ATOM 1212 O VAL A 73 1.623 6.026 4.421 1.00 51.45 O ATOM 1213 CB VAL A 73 1.866 3.085 2.837 1.00 21.50 C ATOM 1214 CG1 VAL A 73 1.622 4.151 1.767 1.00 35.13 C ATOM 1215 CG2 VAL A 73 2.882 2.053 2.349 1.00 30.14 C ATOM 0 H VAL A 73 2.104 1.804 4.998 1.00 1.33 H new ATOM 0 HA VAL A 73 3.314 4.184 4.010 1.00 22.42 H new ATOM 0 HB VAL A 73 0.921 2.576 3.025 1.00 21.50 H new ATOM 0 HG11 VAL A 73 1.292 3.672 0.845 1.00 35.13 H new ATOM 0 HG12 VAL A 73 0.853 4.843 2.111 1.00 35.13 H new ATOM 0 HG13 VAL A 73 2.546 4.698 1.581 1.00 35.13 H new ATOM 0 HG21 VAL A 73 2.534 1.613 1.415 1.00 30.14 H new ATOM 0 HG22 VAL A 73 3.844 2.539 2.185 1.00 30.14 H new ATOM 0 HG23 VAL A 73 2.994 1.270 3.099 1.00 30.14 H new ATOM 1225 N THR A 74 0.207 4.435 5.153 1.00 31.24 N ATOM 1226 CA THR A 74 -0.833 5.395 5.561 1.00 32.55 C ATOM 1227 C THR A 74 -0.371 6.311 6.701 1.00 4.21 C ATOM 1228 O THR A 74 -0.692 7.499 6.713 1.00 30.13 O ATOM 1229 CB THR A 74 -2.140 4.690 5.991 1.00 54.31 C ATOM 1230 OG1 THR A 74 -1.875 3.762 7.054 1.00 24.22 O ATOM 1231 CG2 THR A 74 -2.783 3.971 4.809 1.00 53.14 C ATOM 0 H THR A 74 -0.026 3.459 5.339 1.00 31.24 H new ATOM 0 HA THR A 74 -1.025 6.002 4.676 1.00 32.55 H new ATOM 0 HB THR A 74 -2.837 5.448 6.349 1.00 54.31 H new ATOM 0 HG1 THR A 74 -1.483 2.944 6.684 1.00 24.22 H new ATOM 0 HG21 THR A 74 -3.701 3.482 5.136 1.00 53.14 H new ATOM 0 HG22 THR A 74 -3.015 4.693 4.026 1.00 53.14 H new ATOM 0 HG23 THR A 74 -2.093 3.223 4.419 1.00 53.14 H new ATOM 1239 N GLU A 75 0.378 5.770 7.663 1.00 12.12 N ATOM 1240 CA GLU A 75 0.896 6.589 8.771 1.00 73.40 C ATOM 1241 C GLU A 75 1.922 7.624 8.277 1.00 64.13 C ATOM 1242 O GLU A 75 2.167 8.634 8.940 1.00 73.14 O ATOM 1243 CB GLU A 75 1.518 5.714 9.871 1.00 64.31 C ATOM 1244 CG GLU A 75 2.724 4.895 9.425 1.00 24.03 C ATOM 1245 CD GLU A 75 3.364 4.125 10.572 1.00 5.22 C ATOM 1246 OE1 GLU A 75 2.759 3.134 11.044 1.00 11.32 O ATOM 1247 OE2 GLU A 75 4.460 4.523 11.023 1.00 54.20 O ATOM 0 H GLU A 75 0.639 4.785 7.703 1.00 12.12 H new ATOM 0 HA GLU A 75 0.046 7.124 9.194 1.00 73.40 H new ATOM 0 HB2 GLU A 75 1.817 6.355 10.701 1.00 64.31 H new ATOM 0 HB3 GLU A 75 0.755 5.035 10.252 1.00 64.31 H new ATOM 0 HG2 GLU A 75 2.416 4.194 8.649 1.00 24.03 H new ATOM 0 HG3 GLU A 75 3.465 5.559 8.979 1.00 24.03 H new ATOM 1254 N LYS A 76 2.517 7.366 7.115 1.00 11.34 N ATOM 1255 CA LYS A 76 3.437 8.322 6.491 1.00 61.32 C ATOM 1256 C LYS A 76 2.692 9.346 5.619 1.00 44.41 C ATOM 1257 O LYS A 76 3.272 10.347 5.200 1.00 22.24 O ATOM 1258 CB LYS A 76 4.500 7.585 5.663 1.00 1.32 C ATOM 1259 CG LYS A 76 5.555 6.882 6.515 1.00 50.23 C ATOM 1260 CD LYS A 76 6.304 7.877 7.404 1.00 73.21 C ATOM 1261 CE LYS A 76 7.400 7.213 8.230 1.00 73.21 C ATOM 1262 NZ LYS A 76 8.134 8.207 9.061 1.00 52.30 N ATOM 0 H LYS A 76 2.381 6.505 6.585 1.00 11.34 H new ATOM 0 HA LYS A 76 3.931 8.871 7.293 1.00 61.32 H new ATOM 0 HB2 LYS A 76 4.008 6.849 5.027 1.00 1.32 H new ATOM 0 HB3 LYS A 76 4.994 8.298 5.002 1.00 1.32 H new ATOM 0 HG2 LYS A 76 5.078 6.124 7.136 1.00 50.23 H new ATOM 0 HG3 LYS A 76 6.263 6.365 5.868 1.00 50.23 H new ATOM 0 HD2 LYS A 76 6.744 8.656 6.781 1.00 73.21 H new ATOM 0 HD3 LYS A 76 5.596 8.366 8.073 1.00 73.21 H new ATOM 0 HE2 LYS A 76 6.961 6.452 8.875 1.00 73.21 H new ATOM 0 HE3 LYS A 76 8.099 6.704 7.567 1.00 73.21 H new ATOM 0 HZ1 LYS A 76 8.872 7.723 9.610 1.00 52.30 H new ATOM 0 HZ2 LYS A 76 8.573 8.919 8.443 1.00 52.30 H new ATOM 0 HZ3 LYS A 76 7.470 8.674 9.711 1.00 52.30 H new ATOM 1276 N GLY A 77 1.409 9.092 5.345 1.00 65.11 N ATOM 1277 CA GLY A 77 0.597 10.052 4.591 1.00 34.50 C ATOM 1278 C GLY A 77 -0.084 9.469 3.351 1.00 30.23 C ATOM 1279 O GLY A 77 -0.870 10.157 2.694 1.00 64.35 O ATOM 0 H GLY A 77 0.917 8.245 5.628 1.00 65.11 H new ATOM 0 HA2 GLY A 77 -0.167 10.460 5.252 1.00 34.50 H new ATOM 0 HA3 GLY A 77 1.231 10.884 4.285 1.00 34.50 H new ATOM 1283 N GLY A 78 0.216 8.215 3.018 1.00 13.24 N ATOM 1284 CA GLY A 78 -0.394 7.581 1.846 1.00 14.24 C ATOM 1285 C GLY A 78 0.607 7.290 0.729 1.00 64.55 C ATOM 1286 O GLY A 78 1.751 7.750 0.776 1.00 12.44 O ATOM 0 H GLY A 78 0.868 7.623 3.533 1.00 13.24 H new ATOM 0 HA2 GLY A 78 -0.869 6.649 2.151 1.00 14.24 H new ATOM 0 HA3 GLY A 78 -1.182 8.228 1.460 1.00 14.24 H new ATOM 1290 N LEU A 79 0.174 6.532 -0.281 1.00 11.40 N ATOM 1291 CA LEU A 79 1.055 6.105 -1.385 1.00 31.34 C ATOM 1292 C LEU A 79 1.847 7.267 -2.004 1.00 71.02 C ATOM 1293 O LEU A 79 3.080 7.265 -1.996 1.00 61.53 O ATOM 1294 CB LEU A 79 0.239 5.405 -2.481 1.00 72.14 C ATOM 1295 CG LEU A 79 1.034 4.988 -3.736 1.00 52.00 C ATOM 1296 CD1 LEU A 79 2.219 4.097 -3.372 1.00 34.31 C ATOM 1297 CD2 LEU A 79 0.121 4.284 -4.736 1.00 72.02 C ATOM 0 H LEU A 79 -0.786 6.197 -0.362 1.00 11.40 H new ATOM 0 HA LEU A 79 1.776 5.412 -0.952 1.00 31.34 H new ATOM 0 HB2 LEU A 79 -0.224 4.516 -2.053 1.00 72.14 H new ATOM 0 HB3 LEU A 79 -0.569 6.069 -2.788 1.00 72.14 H new ATOM 0 HG LEU A 79 1.428 5.893 -4.199 1.00 52.00 H new ATOM 0 HD11 LEU A 79 2.758 3.821 -4.278 1.00 34.31 H new ATOM 0 HD12 LEU A 79 2.888 4.637 -2.702 1.00 34.31 H new ATOM 0 HD13 LEU A 79 1.858 3.196 -2.876 1.00 34.31 H new ATOM 0 HD21 LEU A 79 0.698 3.997 -5.615 1.00 72.02 H new ATOM 0 HD22 LEU A 79 -0.306 3.393 -4.275 1.00 72.02 H new ATOM 0 HD23 LEU A 79 -0.682 4.959 -5.033 1.00 72.02 H new ATOM 1309 N VAL A 80 1.134 8.250 -2.550 1.00 43.21 N ATOM 1310 CA VAL A 80 1.769 9.370 -3.252 1.00 64.31 C ATOM 1311 C VAL A 80 2.736 10.140 -2.341 1.00 21.42 C ATOM 1312 O VAL A 80 3.833 10.502 -2.760 1.00 71.32 O ATOM 1313 CB VAL A 80 0.706 10.331 -3.832 1.00 74.40 C ATOM 1314 CG1 VAL A 80 1.354 11.518 -4.536 1.00 62.43 C ATOM 1315 CG2 VAL A 80 -0.221 9.582 -4.783 1.00 31.25 C ATOM 0 H VAL A 80 0.115 8.296 -2.521 1.00 43.21 H new ATOM 0 HA VAL A 80 2.347 8.947 -4.073 1.00 64.31 H new ATOM 0 HB VAL A 80 0.117 10.721 -3.002 1.00 74.40 H new ATOM 0 HG11 VAL A 80 0.579 12.174 -4.932 1.00 62.43 H new ATOM 0 HG12 VAL A 80 1.969 12.071 -3.826 1.00 62.43 H new ATOM 0 HG13 VAL A 80 1.978 11.159 -5.354 1.00 62.43 H new ATOM 0 HG21 VAL A 80 -0.965 10.271 -5.184 1.00 31.25 H new ATOM 0 HG22 VAL A 80 0.362 9.160 -5.602 1.00 31.25 H new ATOM 0 HG23 VAL A 80 -0.724 8.779 -4.244 1.00 31.25 H new ATOM 1325 N GLU A 81 2.334 10.371 -1.092 1.00 71.10 N ATOM 1326 CA GLU A 81 3.214 11.009 -0.104 1.00 72.21 C ATOM 1327 C GLU A 81 4.534 10.230 0.041 1.00 13.43 C ATOM 1328 O GLU A 81 5.621 10.799 -0.070 1.00 22.12 O ATOM 1329 CB GLU A 81 2.508 11.101 1.256 1.00 23.13 C ATOM 1330 CG GLU A 81 3.369 11.693 2.371 1.00 73.21 C ATOM 1331 CD GLU A 81 3.654 13.176 2.193 1.00 54.10 C ATOM 1332 OE1 GLU A 81 4.656 13.531 1.537 1.00 53.52 O ATOM 1333 OE2 GLU A 81 2.883 14.002 2.724 1.00 51.04 O ATOM 0 H GLU A 81 1.409 10.128 -0.738 1.00 71.10 H new ATOM 0 HA GLU A 81 3.444 12.015 -0.455 1.00 72.21 H new ATOM 0 HB2 GLU A 81 1.609 11.708 1.146 1.00 23.13 H new ATOM 0 HB3 GLU A 81 2.185 10.103 1.553 1.00 23.13 H new ATOM 0 HG2 GLU A 81 2.868 11.539 3.327 1.00 73.21 H new ATOM 0 HG3 GLU A 81 4.314 11.152 2.416 1.00 73.21 H new ATOM 1340 N VAL A 82 4.429 8.919 0.265 1.00 64.34 N ATOM 1341 CA VAL A 82 5.606 8.049 0.390 1.00 13.44 C ATOM 1342 C VAL A 82 6.498 8.124 -0.863 1.00 41.23 C ATOM 1343 O VAL A 82 7.730 8.148 -0.768 1.00 71.44 O ATOM 1344 CB VAL A 82 5.182 6.578 0.650 1.00 3.11 C ATOM 1345 CG1 VAL A 82 6.385 5.635 0.654 1.00 3.12 C ATOM 1346 CG2 VAL A 82 4.414 6.474 1.966 1.00 44.54 C ATOM 0 H VAL A 82 3.538 8.432 0.364 1.00 64.34 H new ATOM 0 HA VAL A 82 6.183 8.406 1.243 1.00 13.44 H new ATOM 0 HB VAL A 82 4.529 6.271 -0.167 1.00 3.11 H new ATOM 0 HG11 VAL A 82 6.047 4.615 0.839 1.00 3.12 H new ATOM 0 HG12 VAL A 82 6.887 5.681 -0.313 1.00 3.12 H new ATOM 0 HG13 VAL A 82 7.080 5.935 1.438 1.00 3.12 H new ATOM 0 HG21 VAL A 82 4.123 5.438 2.136 1.00 44.54 H new ATOM 0 HG22 VAL A 82 5.049 6.812 2.785 1.00 44.54 H new ATOM 0 HG23 VAL A 82 3.522 7.098 1.917 1.00 44.54 H new ATOM 1356 N ILE A 83 5.866 8.175 -2.035 1.00 40.35 N ATOM 1357 CA ILE A 83 6.586 8.341 -3.304 1.00 42.43 C ATOM 1358 C ILE A 83 7.300 9.703 -3.361 1.00 64.04 C ATOM 1359 O ILE A 83 8.447 9.802 -3.804 1.00 31.22 O ATOM 1360 CB ILE A 83 5.621 8.215 -4.512 1.00 2.33 C ATOM 1361 CG1 ILE A 83 4.931 6.842 -4.508 1.00 72.34 C ATOM 1362 CG2 ILE A 83 6.365 8.437 -5.827 1.00 62.34 C ATOM 1363 CD1 ILE A 83 3.919 6.660 -5.622 1.00 53.52 C ATOM 0 H ILE A 83 4.853 8.104 -2.135 1.00 40.35 H new ATOM 0 HA ILE A 83 7.331 7.547 -3.360 1.00 42.43 H new ATOM 0 HB ILE A 83 4.857 8.987 -4.420 1.00 2.33 H new ATOM 0 HG12 ILE A 83 5.690 6.064 -4.590 1.00 72.34 H new ATOM 0 HG13 ILE A 83 4.431 6.700 -3.550 1.00 72.34 H new ATOM 0 HG21 ILE A 83 5.668 8.344 -6.660 1.00 62.34 H new ATOM 0 HG22 ILE A 83 6.805 9.434 -5.832 1.00 62.34 H new ATOM 0 HG23 ILE A 83 7.154 7.692 -5.929 1.00 62.34 H new ATOM 0 HD11 ILE A 83 3.475 5.667 -5.552 1.00 53.52 H new ATOM 0 HD12 ILE A 83 3.137 7.414 -5.530 1.00 53.52 H new ATOM 0 HD13 ILE A 83 4.416 6.768 -6.586 1.00 53.52 H new ATOM 1375 N ASN A 84 6.616 10.743 -2.888 1.00 62.12 N ATOM 1376 CA ASN A 84 7.167 12.103 -2.870 1.00 71.13 C ATOM 1377 C ASN A 84 8.292 12.255 -1.830 1.00 20.14 C ATOM 1378 O ASN A 84 9.147 13.136 -1.955 1.00 73.04 O ATOM 1379 CB ASN A 84 6.052 13.120 -2.594 1.00 20.34 C ATOM 1380 CG ASN A 84 5.029 13.184 -3.715 1.00 53.01 C ATOM 1381 OD1 ASN A 84 5.350 12.983 -4.881 1.00 33.31 O ATOM 1382 ND2 ASN A 84 3.790 13.468 -3.375 1.00 1.31 N ATOM 0 H ASN A 84 5.672 10.672 -2.509 1.00 62.12 H new ATOM 0 HA ASN A 84 7.600 12.295 -3.852 1.00 71.13 H new ATOM 0 HB2 ASN A 84 5.549 12.859 -1.663 1.00 20.34 H new ATOM 0 HB3 ASN A 84 6.492 14.107 -2.452 1.00 20.34 H new ATOM 0 HD21 ASN A 84 3.065 13.526 -4.090 1.00 1.31 H new ATOM 0 HD22 ASN A 84 3.554 13.630 -2.396 1.00 1.31 H new ATOM 1389 N LYS A 85 8.281 11.414 -0.795 1.00 51.23 N ATOM 1390 CA LYS A 85 9.357 11.414 0.210 1.00 63.20 C ATOM 1391 C LYS A 85 10.500 10.470 -0.196 1.00 31.12 C ATOM 1392 O LYS A 85 11.606 10.553 0.345 1.00 31.24 O ATOM 1393 CB LYS A 85 8.817 10.970 1.582 1.00 14.32 C ATOM 1394 CG LYS A 85 7.588 11.726 2.102 1.00 42.43 C ATOM 1395 CD LYS A 85 7.899 13.136 2.618 1.00 44.42 C ATOM 1396 CE LYS A 85 8.201 14.115 1.493 1.00 61.22 C ATOM 1397 NZ LYS A 85 8.127 15.527 1.946 1.00 43.33 N ATOM 0 H LYS A 85 7.546 10.727 -0.627 1.00 51.23 H new ATOM 0 HA LYS A 85 9.738 12.433 0.273 1.00 63.20 H new ATOM 0 HB2 LYS A 85 8.569 9.910 1.526 1.00 14.32 H new ATOM 0 HB3 LYS A 85 9.617 11.072 2.315 1.00 14.32 H new ATOM 0 HG2 LYS A 85 6.852 11.797 1.302 1.00 42.43 H new ATOM 0 HG3 LYS A 85 7.131 11.148 2.905 1.00 42.43 H new ATOM 0 HD2 LYS A 85 7.051 13.503 3.197 1.00 44.42 H new ATOM 0 HD3 LYS A 85 8.752 13.092 3.295 1.00 44.42 H new ATOM 0 HE2 LYS A 85 9.196 13.914 1.096 1.00 61.22 H new ATOM 0 HE3 LYS A 85 7.494 13.959 0.678 1.00 61.22 H new ATOM 0 HZ1 LYS A 85 8.340 16.159 1.148 1.00 43.33 H new ATOM 0 HZ2 LYS A 85 7.171 15.728 2.302 1.00 43.33 H new ATOM 0 HZ3 LYS A 85 8.819 15.684 2.706 1.00 43.33 H new ATOM 1411 N LYS A 86 10.220 9.563 -1.141 1.00 12.21 N ATOM 1412 CA LYS A 86 11.193 8.545 -1.576 1.00 50.32 C ATOM 1413 C LYS A 86 11.645 7.661 -0.395 1.00 25.34 C ATOM 1414 O LYS A 86 12.611 6.905 -0.506 1.00 24.33 O ATOM 1415 CB LYS A 86 12.418 9.222 -2.221 1.00 21.15 C ATOM 1416 CG LYS A 86 12.075 10.213 -3.334 1.00 50.13 C ATOM 1417 CD LYS A 86 11.544 9.534 -4.598 1.00 72.14 C ATOM 1418 CE LYS A 86 12.664 8.989 -5.483 1.00 72.23 C ATOM 1419 NZ LYS A 86 13.428 7.889 -4.839 1.00 64.41 N ATOM 0 H LYS A 86 9.323 9.511 -1.623 1.00 12.21 H new ATOM 0 HA LYS A 86 10.703 7.907 -2.311 1.00 50.32 H new ATOM 0 HB2 LYS A 86 12.980 9.744 -1.446 1.00 21.15 H new ATOM 0 HB3 LYS A 86 13.073 8.451 -2.626 1.00 21.15 H new ATOM 0 HG2 LYS A 86 11.330 10.919 -2.967 1.00 50.13 H new ATOM 0 HG3 LYS A 86 12.965 10.791 -3.585 1.00 50.13 H new ATOM 0 HD2 LYS A 86 10.878 8.718 -4.316 1.00 72.14 H new ATOM 0 HD3 LYS A 86 10.950 10.248 -5.168 1.00 72.14 H new ATOM 0 HE2 LYS A 86 12.237 8.628 -6.419 1.00 72.23 H new ATOM 0 HE3 LYS A 86 13.347 9.800 -5.736 1.00 72.23 H new ATOM 0 HZ1 LYS A 86 13.872 7.299 -5.572 1.00 64.41 H new ATOM 0 HZ2 LYS A 86 14.165 8.291 -4.225 1.00 64.41 H new ATOM 0 HZ3 LYS A 86 12.783 7.306 -4.269 1.00 64.41 H new ATOM 1433 N LEU A 87 10.909 7.719 0.719 1.00 14.31 N ATOM 1434 CA LEU A 87 11.360 7.125 1.987 1.00 32.22 C ATOM 1435 C LEU A 87 10.979 5.629 2.108 1.00 71.01 C ATOM 1436 O LEU A 87 10.905 5.082 3.208 1.00 44.04 O ATOM 1437 CB LEU A 87 10.805 7.956 3.176 1.00 3.51 C ATOM 1438 CG LEU A 87 9.473 7.492 3.809 1.00 74.04 C ATOM 1439 CD1 LEU A 87 9.144 8.334 5.039 1.00 73.32 C ATOM 1440 CD2 LEU A 87 8.324 7.552 2.809 1.00 73.12 C ATOM 0 H LEU A 87 9.996 8.171 0.771 1.00 14.31 H new ATOM 0 HA LEU A 87 12.449 7.158 2.009 1.00 32.22 H new ATOM 0 HB2 LEU A 87 11.563 7.971 3.959 1.00 3.51 H new ATOM 0 HB3 LEU A 87 10.677 8.984 2.837 1.00 3.51 H new ATOM 0 HG LEU A 87 9.599 6.452 4.112 1.00 74.04 H new ATOM 0 HD11 LEU A 87 8.203 7.994 5.472 1.00 73.32 H new ATOM 0 HD12 LEU A 87 9.941 8.230 5.775 1.00 73.32 H new ATOM 0 HD13 LEU A 87 9.052 9.381 4.749 1.00 73.32 H new ATOM 0 HD21 LEU A 87 7.405 7.218 3.291 1.00 73.12 H new ATOM 0 HD22 LEU A 87 8.199 8.577 2.459 1.00 73.12 H new ATOM 0 HD23 LEU A 87 8.545 6.904 1.961 1.00 73.12 H new ATOM 1452 N TRP A 88 10.799 4.959 0.965 1.00 54.20 N ATOM 1453 CA TRP A 88 10.415 3.531 0.934 1.00 3.25 C ATOM 1454 C TRP A 88 11.359 2.640 1.767 1.00 24.44 C ATOM 1455 O TRP A 88 10.987 1.534 2.161 1.00 11.33 O ATOM 1456 CB TRP A 88 10.360 3.022 -0.514 1.00 25.11 C ATOM 1457 CG TRP A 88 9.179 3.531 -1.287 1.00 62.14 C ATOM 1458 CD1 TRP A 88 9.132 4.628 -2.101 1.00 53.04 C ATOM 1459 CD2 TRP A 88 7.866 2.960 -1.306 1.00 51.42 C ATOM 1460 NE1 TRP A 88 7.871 4.766 -2.633 1.00 1.23 N ATOM 1461 CE2 TRP A 88 7.075 3.758 -2.154 1.00 1.15 C ATOM 1462 CE3 TRP A 88 7.283 1.849 -0.689 1.00 72.33 C ATOM 1463 CZ2 TRP A 88 5.732 3.482 -2.395 1.00 25.21 C ATOM 1464 CZ3 TRP A 88 5.950 1.577 -0.929 1.00 41.05 C ATOM 1465 CH2 TRP A 88 5.187 2.390 -1.776 1.00 34.54 C ATOM 0 H TRP A 88 10.912 5.379 0.042 1.00 54.20 H new ATOM 0 HA TRP A 88 9.425 3.464 1.386 1.00 3.25 H new ATOM 0 HB2 TRP A 88 11.275 3.317 -1.029 1.00 25.11 H new ATOM 0 HB3 TRP A 88 10.336 1.932 -0.506 1.00 25.11 H new ATOM 0 HD1 TRP A 88 9.963 5.289 -2.298 1.00 53.04 H new ATOM 0 HE1 TRP A 88 7.576 5.499 -3.279 1.00 1.23 H new ATOM 0 HE3 TRP A 88 7.864 1.215 -0.036 1.00 72.33 H new ATOM 0 HZ2 TRP A 88 5.141 4.108 -3.047 1.00 25.21 H new ATOM 0 HZ3 TRP A 88 5.489 0.723 -0.455 1.00 41.05 H new ATOM 0 HH2 TRP A 88 4.147 2.150 -1.944 1.00 34.54 H new ATOM 1476 N ARG A 89 12.575 3.126 2.026 1.00 24.31 N ATOM 1477 CA ARG A 89 13.527 2.433 2.911 1.00 74.34 C ATOM 1478 C ARG A 89 12.898 2.110 4.282 1.00 41.41 C ATOM 1479 O ARG A 89 13.181 1.073 4.887 1.00 12.34 O ATOM 1480 CB ARG A 89 14.782 3.301 3.104 1.00 61.24 C ATOM 1481 CG ARG A 89 14.477 4.735 3.534 1.00 62.23 C ATOM 1482 CD ARG A 89 15.745 5.549 3.768 1.00 34.23 C ATOM 1483 NE ARG A 89 15.450 6.965 3.992 1.00 41.30 N ATOM 1484 CZ ARG A 89 15.293 7.510 5.172 1.00 64.42 C ATOM 1485 NH1 ARG A 89 15.366 6.796 6.248 1.00 61.53 N ATOM 1486 NH2 ARG A 89 15.058 8.776 5.268 1.00 40.43 N ATOM 0 H ARG A 89 12.929 4.000 1.636 1.00 24.31 H new ATOM 0 HA ARG A 89 13.799 1.489 2.438 1.00 74.34 H new ATOM 0 HB2 ARG A 89 15.423 2.835 3.852 1.00 61.24 H new ATOM 0 HB3 ARG A 89 15.345 3.323 2.171 1.00 61.24 H new ATOM 0 HG2 ARG A 89 13.872 5.221 2.769 1.00 62.23 H new ATOM 0 HG3 ARG A 89 13.883 4.720 4.448 1.00 62.23 H new ATOM 0 HD2 ARG A 89 16.280 5.149 4.629 1.00 34.23 H new ATOM 0 HD3 ARG A 89 16.406 5.447 2.907 1.00 34.23 H new ATOM 0 HE ARG A 89 15.361 7.568 3.174 1.00 41.30 H new ATOM 0 HH11 ARG A 89 15.548 5.794 6.184 1.00 61.53 H new ATOM 0 HH12 ARG A 89 15.242 7.235 7.160 1.00 61.53 H new ATOM 0 HH21 ARG A 89 14.995 9.348 4.426 1.00 40.43 H new ATOM 0 HH22 ARG A 89 14.935 9.204 6.186 1.00 40.43 H new ATOM 1500 N GLU A 90 12.043 3.011 4.758 1.00 62.11 N ATOM 1501 CA GLU A 90 11.329 2.822 6.023 1.00 32.52 C ATOM 1502 C GLU A 90 10.242 1.748 5.881 1.00 62.35 C ATOM 1503 O GLU A 90 10.012 0.949 6.790 1.00 64.35 O ATOM 1504 CB GLU A 90 10.694 4.152 6.460 1.00 74.41 C ATOM 1505 CG GLU A 90 11.675 5.321 6.495 1.00 72.43 C ATOM 1506 CD GLU A 90 12.800 5.129 7.504 1.00 65.42 C ATOM 1507 OE1 GLU A 90 13.815 4.489 7.163 1.00 54.12 O ATOM 1508 OE2 GLU A 90 12.675 5.631 8.640 1.00 1.21 O ATOM 0 H GLU A 90 11.825 3.887 4.284 1.00 62.11 H new ATOM 0 HA GLU A 90 12.042 2.491 6.778 1.00 32.52 H new ATOM 0 HB2 GLU A 90 9.878 4.395 5.780 1.00 74.41 H new ATOM 0 HB3 GLU A 90 10.257 4.027 7.451 1.00 74.41 H new ATOM 0 HG2 GLU A 90 12.105 5.456 5.502 1.00 72.43 H new ATOM 0 HG3 GLU A 90 11.132 6.235 6.735 1.00 72.43 H new ATOM 1515 N ILE A 91 9.589 1.736 4.721 1.00 43.04 N ATOM 1516 CA ILE A 91 8.504 0.790 4.442 1.00 0.04 C ATOM 1517 C ILE A 91 9.025 -0.657 4.387 1.00 72.42 C ATOM 1518 O ILE A 91 8.454 -1.557 5.005 1.00 31.32 O ATOM 1519 CB ILE A 91 7.793 1.136 3.107 1.00 42.30 C ATOM 1520 CG1 ILE A 91 7.318 2.603 3.112 1.00 71.13 C ATOM 1521 CG2 ILE A 91 6.620 0.190 2.857 1.00 13.22 C ATOM 1522 CD1 ILE A 91 6.355 2.942 4.235 1.00 15.41 C ATOM 0 H ILE A 91 9.792 2.375 3.952 1.00 43.04 H new ATOM 0 HA ILE A 91 7.787 0.873 5.258 1.00 0.04 H new ATOM 0 HB ILE A 91 8.509 1.010 2.295 1.00 42.30 H new ATOM 0 HG12 ILE A 91 8.189 3.255 3.186 1.00 71.13 H new ATOM 0 HG13 ILE A 91 6.837 2.821 2.158 1.00 71.13 H new ATOM 0 HG21 ILE A 91 6.136 0.451 1.916 1.00 13.22 H new ATOM 0 HG22 ILE A 91 6.985 -0.836 2.805 1.00 13.22 H new ATOM 0 HG23 ILE A 91 5.901 0.279 3.671 1.00 13.22 H new ATOM 0 HD11 ILE A 91 6.070 3.992 4.166 1.00 15.41 H new ATOM 0 HD12 ILE A 91 5.465 2.319 4.152 1.00 15.41 H new ATOM 0 HD13 ILE A 91 6.837 2.759 5.195 1.00 15.41 H new ATOM 1534 N THR A 92 10.116 -0.871 3.650 1.00 10.43 N ATOM 1535 CA THR A 92 10.759 -2.193 3.582 1.00 60.34 C ATOM 1536 C THR A 92 11.174 -2.676 4.972 1.00 2.03 C ATOM 1537 O THR A 92 10.818 -3.777 5.396 1.00 2.41 O ATOM 1538 CB THR A 92 12.020 -2.189 2.682 1.00 50.20 C ATOM 1539 OG1 THR A 92 12.902 -1.127 3.073 1.00 33.14 O ATOM 1540 CG2 THR A 92 11.660 -2.048 1.209 1.00 62.25 C ATOM 0 H THR A 92 10.575 -0.151 3.092 1.00 10.43 H new ATOM 0 HA THR A 92 10.015 -2.864 3.153 1.00 60.34 H new ATOM 0 HB THR A 92 12.523 -3.147 2.813 1.00 50.20 H new ATOM 0 HG1 THR A 92 13.697 -1.134 2.499 1.00 33.14 H new ATOM 0 HG21 THR A 92 12.571 -2.049 0.610 1.00 62.25 H new ATOM 0 HG22 THR A 92 11.026 -2.882 0.908 1.00 62.25 H new ATOM 0 HG23 THR A 92 11.125 -1.111 1.053 1.00 62.25 H new ATOM 1548 N LYS A 93 11.927 -1.841 5.680 1.00 15.10 N ATOM 1549 CA LYS A 93 12.421 -2.186 7.013 1.00 32.22 C ATOM 1550 C LYS A 93 11.260 -2.480 7.983 1.00 30.22 C ATOM 1551 O LYS A 93 11.360 -3.366 8.834 1.00 40.41 O ATOM 1552 CB LYS A 93 13.303 -1.055 7.556 1.00 52.51 C ATOM 1553 CG LYS A 93 14.093 -1.430 8.808 1.00 41.02 C ATOM 1554 CD LYS A 93 14.982 -2.652 8.569 1.00 52.14 C ATOM 1555 CE LYS A 93 15.857 -2.967 9.775 1.00 51.41 C ATOM 1556 NZ LYS A 93 15.053 -3.153 11.015 1.00 14.04 N ATOM 0 H LYS A 93 12.211 -0.917 5.354 1.00 15.10 H new ATOM 0 HA LYS A 93 13.019 -3.093 6.929 1.00 32.22 H new ATOM 0 HB2 LYS A 93 14.001 -0.747 6.777 1.00 52.51 H new ATOM 0 HB3 LYS A 93 12.674 -0.193 7.780 1.00 52.51 H new ATOM 0 HG2 LYS A 93 14.710 -0.586 9.116 1.00 41.02 H new ATOM 0 HG3 LYS A 93 13.403 -1.636 9.626 1.00 41.02 H new ATOM 0 HD2 LYS A 93 14.357 -3.515 8.339 1.00 52.14 H new ATOM 0 HD3 LYS A 93 15.614 -2.475 7.699 1.00 52.14 H new ATOM 0 HE2 LYS A 93 16.434 -3.871 9.578 1.00 51.41 H new ATOM 0 HE3 LYS A 93 16.572 -2.158 9.925 1.00 51.41 H new ATOM 0 HZ1 LYS A 93 15.665 -3.513 11.775 1.00 14.04 H new ATOM 0 HZ2 LYS A 93 14.643 -2.241 11.303 1.00 14.04 H new ATOM 0 HZ3 LYS A 93 14.288 -3.834 10.834 1.00 14.04 H new ATOM 1570 N GLY A 94 10.154 -1.747 7.831 1.00 3.21 N ATOM 1571 CA GLY A 94 8.967 -1.982 8.653 1.00 45.52 C ATOM 1572 C GLY A 94 8.366 -3.374 8.459 1.00 24.31 C ATOM 1573 O GLY A 94 7.675 -3.892 9.340 1.00 54.32 O ATOM 0 H GLY A 94 10.057 -0.992 7.152 1.00 3.21 H new ATOM 0 HA2 GLY A 94 9.228 -1.849 9.703 1.00 45.52 H new ATOM 0 HA3 GLY A 94 8.213 -1.231 8.414 1.00 45.52 H new ATOM 1577 N LEU A 95 8.629 -3.979 7.300 1.00 23.24 N ATOM 1578 CA LEU A 95 8.160 -5.337 6.992 1.00 10.15 C ATOM 1579 C LEU A 95 9.292 -6.362 7.187 1.00 74.53 C ATOM 1580 O LEU A 95 9.188 -7.511 6.755 1.00 71.52 O ATOM 1581 CB LEU A 95 7.649 -5.396 5.546 1.00 2.30 C ATOM 1582 CG LEU A 95 6.616 -4.321 5.166 1.00 0.50 C ATOM 1583 CD1 LEU A 95 6.157 -4.501 3.723 1.00 34.44 C ATOM 1584 CD2 LEU A 95 5.428 -4.349 6.121 1.00 15.20 C ATOM 0 H LEU A 95 9.170 -3.547 6.550 1.00 23.24 H new ATOM 0 HA LEU A 95 7.347 -5.585 7.675 1.00 10.15 H new ATOM 0 HB2 LEU A 95 8.502 -5.309 4.873 1.00 2.30 H new ATOM 0 HB3 LEU A 95 7.207 -6.377 5.375 1.00 2.30 H new ATOM 0 HG LEU A 95 7.094 -3.345 5.251 1.00 0.50 H new ATOM 0 HD11 LEU A 95 5.427 -3.731 3.475 1.00 34.44 H new ATOM 0 HD12 LEU A 95 7.014 -4.417 3.055 1.00 34.44 H new ATOM 0 HD13 LEU A 95 5.701 -5.484 3.606 1.00 34.44 H new ATOM 0 HD21 LEU A 95 4.711 -3.580 5.832 1.00 15.20 H new ATOM 0 HD22 LEU A 95 4.949 -5.327 6.077 1.00 15.20 H new ATOM 0 HD23 LEU A 95 5.774 -4.160 7.137 1.00 15.20 H new ATOM 1596 N ASN A 96 10.369 -5.923 7.845 1.00 71.13 N ATOM 1597 CA ASN A 96 11.562 -6.752 8.082 1.00 55.44 C ATOM 1598 C ASN A 96 12.262 -7.109 6.754 1.00 71.13 C ATOM 1599 O ASN A 96 13.031 -8.071 6.673 1.00 63.02 O ATOM 1600 CB ASN A 96 11.191 -8.025 8.866 1.00 40.21 C ATOM 1601 CG ASN A 96 12.361 -8.587 9.661 1.00 3.23 C ATOM 1602 OD1 ASN A 96 13.147 -9.393 9.167 1.00 61.42 O ATOM 1603 ND2 ASN A 96 12.486 -8.165 10.905 1.00 21.32 N ATOM 0 H ASN A 96 10.442 -4.981 8.230 1.00 71.13 H new ATOM 0 HA ASN A 96 12.263 -6.172 8.683 1.00 55.44 H new ATOM 0 HB2 ASN A 96 10.369 -7.801 9.546 1.00 40.21 H new ATOM 0 HB3 ASN A 96 10.832 -8.783 8.170 1.00 40.21 H new ATOM 0 HD21 ASN A 96 13.251 -8.508 11.485 1.00 21.32 H new ATOM 0 HD22 ASN A 96 11.817 -7.496 11.286 1.00 21.32 H new ATOM 1610 N LEU A 97 12.007 -6.315 5.716 1.00 0.00 N ATOM 1611 CA LEU A 97 12.620 -6.530 4.400 1.00 11.31 C ATOM 1612 C LEU A 97 13.987 -5.833 4.304 1.00 44.52 C ATOM 1613 O LEU A 97 14.176 -4.736 4.835 1.00 25.52 O ATOM 1614 CB LEU A 97 11.696 -6.015 3.284 1.00 62.12 C ATOM 1615 CG LEU A 97 10.279 -6.609 3.280 1.00 35.20 C ATOM 1616 CD1 LEU A 97 9.440 -6.015 2.150 1.00 51.14 C ATOM 1617 CD2 LEU A 97 10.332 -8.131 3.174 1.00 34.24 C ATOM 0 H LEU A 97 11.378 -5.513 5.758 1.00 0.00 H new ATOM 0 HA LEU A 97 12.769 -7.603 4.276 1.00 11.31 H new ATOM 0 HB2 LEU A 97 11.618 -4.931 3.371 1.00 62.12 H new ATOM 0 HB3 LEU A 97 12.163 -6.225 2.322 1.00 62.12 H new ATOM 0 HG LEU A 97 9.801 -6.349 4.225 1.00 35.20 H new ATOM 0 HD11 LEU A 97 8.442 -6.452 2.169 1.00 51.14 H new ATOM 0 HD12 LEU A 97 9.366 -4.935 2.281 1.00 51.14 H new ATOM 0 HD13 LEU A 97 9.913 -6.233 1.192 1.00 51.14 H new ATOM 0 HD21 LEU A 97 9.318 -8.531 3.173 1.00 34.24 H new ATOM 0 HD22 LEU A 97 10.835 -8.414 2.249 1.00 34.24 H new ATOM 0 HD23 LEU A 97 10.881 -8.536 4.024 1.00 34.24 H new ATOM 1629 N PRO A 98 14.960 -6.458 3.617 1.00 75.53 N ATOM 1630 CA PRO A 98 16.292 -5.872 3.436 1.00 70.14 C ATOM 1631 C PRO A 98 16.307 -4.757 2.375 1.00 20.53 C ATOM 1632 O PRO A 98 16.025 -4.996 1.200 1.00 74.30 O ATOM 1633 CB PRO A 98 17.137 -7.071 2.990 1.00 4.22 C ATOM 1634 CG PRO A 98 16.176 -7.976 2.293 1.00 22.10 C ATOM 1635 CD PRO A 98 14.837 -7.776 2.962 1.00 44.10 C ATOM 0 HA PRO A 98 16.659 -5.389 4.341 1.00 70.14 H new ATOM 0 HB2 PRO A 98 17.943 -6.761 2.324 1.00 4.22 H new ATOM 0 HB3 PRO A 98 17.601 -7.567 3.843 1.00 4.22 H new ATOM 0 HG2 PRO A 98 16.119 -7.737 1.231 1.00 22.10 H new ATOM 0 HG3 PRO A 98 16.496 -9.015 2.369 1.00 22.10 H new ATOM 0 HD2 PRO A 98 14.023 -7.788 2.237 1.00 44.10 H new ATOM 0 HD3 PRO A 98 14.631 -8.564 3.686 1.00 44.10 H new ATOM 1643 N THR A 99 16.653 -3.536 2.795 1.00 15.24 N ATOM 1644 CA THR A 99 16.696 -2.377 1.882 1.00 0.04 C ATOM 1645 C THR A 99 17.785 -2.526 0.805 1.00 52.33 C ATOM 1646 O THR A 99 17.884 -1.703 -0.105 1.00 33.11 O ATOM 1647 CB THR A 99 16.914 -1.043 2.652 1.00 23.50 C ATOM 1648 OG1 THR A 99 17.063 0.063 1.738 1.00 33.32 O ATOM 1649 CG2 THR A 99 18.133 -1.118 3.568 1.00 43.25 C ATOM 0 H THR A 99 16.908 -3.319 3.759 1.00 15.24 H new ATOM 0 HA THR A 99 15.723 -2.348 1.391 1.00 0.04 H new ATOM 0 HB THR A 99 16.029 -0.880 3.267 1.00 23.50 H new ATOM 0 HG1 THR A 99 17.354 -0.272 0.864 1.00 33.32 H new ATOM 0 HG21 THR A 99 18.255 -0.169 4.090 1.00 43.25 H new ATOM 0 HG22 THR A 99 17.992 -1.917 4.296 1.00 43.25 H new ATOM 0 HG23 THR A 99 19.023 -1.322 2.973 1.00 43.25 H new ATOM 1657 N SER A 100 18.593 -3.579 0.917 1.00 30.33 N ATOM 1658 CA SER A 100 19.640 -3.880 -0.073 1.00 52.13 C ATOM 1659 C SER A 100 19.052 -4.322 -1.427 1.00 61.23 C ATOM 1660 O SER A 100 19.715 -4.212 -2.460 1.00 14.14 O ATOM 1661 CB SER A 100 20.578 -4.977 0.461 1.00 25.31 C ATOM 1662 OG SER A 100 21.606 -5.281 -0.472 1.00 31.33 O ATOM 0 H SER A 100 18.546 -4.246 1.687 1.00 30.33 H new ATOM 0 HA SER A 100 20.200 -2.959 -0.236 1.00 52.13 H new ATOM 0 HB2 SER A 100 21.023 -4.651 1.401 1.00 25.31 H new ATOM 0 HB3 SER A 100 20.002 -5.877 0.676 1.00 25.31 H new ATOM 0 HG SER A 100 21.539 -6.222 -0.738 1.00 31.33 H new ATOM 1668 N ILE A 101 17.809 -4.821 -1.414 1.00 35.10 N ATOM 1669 CA ILE A 101 17.129 -5.277 -2.643 1.00 71.34 C ATOM 1670 C ILE A 101 17.085 -4.162 -3.712 1.00 23.24 C ATOM 1671 O ILE A 101 16.714 -3.025 -3.420 1.00 72.22 O ATOM 1672 CB ILE A 101 15.681 -5.752 -2.339 1.00 32.24 C ATOM 1673 CG1 ILE A 101 15.679 -6.929 -1.339 1.00 54.31 C ATOM 1674 CG2 ILE A 101 14.954 -6.143 -3.628 1.00 32.55 C ATOM 1675 CD1 ILE A 101 14.302 -7.270 -0.805 1.00 21.44 C ATOM 0 H ILE A 101 17.250 -4.921 -0.567 1.00 35.10 H new ATOM 0 HA ILE A 101 17.707 -6.115 -3.032 1.00 71.34 H new ATOM 0 HB ILE A 101 15.148 -4.918 -1.882 1.00 32.24 H new ATOM 0 HG12 ILE A 101 16.099 -7.809 -1.826 1.00 54.31 H new ATOM 0 HG13 ILE A 101 16.334 -6.685 -0.502 1.00 54.31 H new ATOM 0 HG21 ILE A 101 13.943 -6.472 -3.390 1.00 32.55 H new ATOM 0 HG22 ILE A 101 14.908 -5.282 -4.295 1.00 32.55 H new ATOM 0 HG23 ILE A 101 15.493 -6.954 -4.118 1.00 32.55 H new ATOM 0 HD11 ILE A 101 14.378 -8.105 -0.109 1.00 21.44 H new ATOM 0 HD12 ILE A 101 13.887 -6.404 -0.289 1.00 21.44 H new ATOM 0 HD13 ILE A 101 13.649 -7.546 -1.633 1.00 21.44 H new ATOM 1687 N THR A 102 17.447 -4.513 -4.952 1.00 72.41 N ATOM 1688 CA THR A 102 17.582 -3.536 -6.054 1.00 63.14 C ATOM 1689 C THR A 102 16.352 -2.622 -6.216 1.00 60.42 C ATOM 1690 O THR A 102 16.395 -1.431 -5.889 1.00 21.03 O ATOM 1691 CB THR A 102 17.841 -4.247 -7.411 1.00 60.34 C ATOM 1692 OG1 THR A 102 18.914 -5.193 -7.289 1.00 73.22 O ATOM 1693 CG2 THR A 102 18.180 -3.236 -8.506 1.00 14.33 C ATOM 0 H THR A 102 17.655 -5.474 -5.225 1.00 72.41 H new ATOM 0 HA THR A 102 18.435 -2.916 -5.779 1.00 63.14 H new ATOM 0 HB THR A 102 16.926 -4.772 -7.687 1.00 60.34 H new ATOM 0 HG1 THR A 102 19.739 -4.800 -7.643 1.00 73.22 H new ATOM 0 HG21 THR A 102 18.356 -3.762 -9.444 1.00 14.33 H new ATOM 0 HG22 THR A 102 17.349 -2.541 -8.630 1.00 14.33 H new ATOM 0 HG23 THR A 102 19.077 -2.683 -8.226 1.00 14.33 H new ATOM 1701 N SER A 103 15.256 -3.176 -6.731 1.00 73.23 N ATOM 1702 CA SER A 103 14.061 -2.381 -7.054 1.00 60.54 C ATOM 1703 C SER A 103 12.956 -2.530 -6.000 1.00 12.51 C ATOM 1704 O SER A 103 11.775 -2.383 -6.316 1.00 44.22 O ATOM 1705 CB SER A 103 13.514 -2.796 -8.426 1.00 24.21 C ATOM 1706 OG SER A 103 13.118 -4.160 -8.430 1.00 54.51 O ATOM 0 H SER A 103 15.166 -4.171 -6.935 1.00 73.23 H new ATOM 0 HA SER A 103 14.366 -1.335 -7.068 1.00 60.54 H new ATOM 0 HB2 SER A 103 12.663 -2.167 -8.687 1.00 24.21 H new ATOM 0 HB3 SER A 103 14.276 -2.634 -9.188 1.00 24.21 H new ATOM 0 HG SER A 103 12.772 -4.398 -9.316 1.00 54.51 H new ATOM 1712 N ALA A 104 13.338 -2.783 -4.748 1.00 74.40 N ATOM 1713 CA ALA A 104 12.363 -2.948 -3.653 1.00 1.40 C ATOM 1714 C ALA A 104 11.353 -1.790 -3.598 1.00 45.21 C ATOM 1715 O ALA A 104 10.142 -2.007 -3.632 1.00 63.15 O ATOM 1716 CB ALA A 104 13.088 -3.069 -2.319 1.00 0.54 C ATOM 0 H ALA A 104 14.312 -2.879 -4.460 1.00 74.40 H new ATOM 0 HA ALA A 104 11.804 -3.863 -3.850 1.00 1.40 H new ATOM 0 HB1 ALA A 104 12.359 -3.190 -1.518 1.00 0.54 H new ATOM 0 HB2 ALA A 104 13.749 -3.935 -2.342 1.00 0.54 H new ATOM 0 HB3 ALA A 104 13.676 -2.168 -2.141 1.00 0.54 H new ATOM 1722 N ALA A 105 11.868 -0.563 -3.527 1.00 30.15 N ATOM 1723 CA ALA A 105 11.029 0.643 -3.470 1.00 42.30 C ATOM 1724 C ALA A 105 10.022 0.709 -4.631 1.00 31.42 C ATOM 1725 O ALA A 105 8.859 1.065 -4.442 1.00 32.24 O ATOM 1726 CB ALA A 105 11.911 1.889 -3.470 1.00 25.21 C ATOM 0 H ALA A 105 12.870 -0.373 -3.507 1.00 30.15 H new ATOM 0 HA ALA A 105 10.454 0.598 -2.545 1.00 42.30 H new ATOM 0 HB1 ALA A 105 11.283 2.779 -3.428 1.00 25.21 H new ATOM 0 HB2 ALA A 105 12.570 1.868 -2.602 1.00 25.21 H new ATOM 0 HB3 ALA A 105 12.510 1.911 -4.380 1.00 25.21 H new ATOM 1732 N PHE A 106 10.476 0.359 -5.833 1.00 43.13 N ATOM 1733 CA PHE A 106 9.627 0.413 -7.027 1.00 22.03 C ATOM 1734 C PHE A 106 8.623 -0.755 -7.063 1.00 71.33 C ATOM 1735 O PHE A 106 7.467 -0.585 -7.464 1.00 73.03 O ATOM 1736 CB PHE A 106 10.504 0.401 -8.287 1.00 10.12 C ATOM 1737 CG PHE A 106 9.722 0.504 -9.575 1.00 23.03 C ATOM 1738 CD1 PHE A 106 9.081 1.688 -9.919 1.00 50.24 C ATOM 1739 CD2 PHE A 106 9.623 -0.579 -10.439 1.00 24.40 C ATOM 1740 CE1 PHE A 106 8.360 1.787 -11.094 1.00 53.33 C ATOM 1741 CE2 PHE A 106 8.902 -0.484 -11.616 1.00 44.33 C ATOM 1742 CZ PHE A 106 8.271 0.700 -11.942 1.00 1.44 C ATOM 0 H PHE A 106 11.427 0.035 -6.008 1.00 43.13 H new ATOM 0 HA PHE A 106 9.052 1.338 -6.993 1.00 22.03 H new ATOM 0 HB2 PHE A 106 11.210 1.229 -8.235 1.00 10.12 H new ATOM 0 HB3 PHE A 106 11.091 -0.518 -8.301 1.00 10.12 H new ATOM 0 HD1 PHE A 106 9.147 2.541 -9.260 1.00 50.24 H new ATOM 0 HD2 PHE A 106 10.115 -1.507 -10.189 1.00 24.40 H new ATOM 0 HE1 PHE A 106 7.867 2.713 -11.349 1.00 53.33 H new ATOM 0 HE2 PHE A 106 8.833 -1.334 -12.278 1.00 44.33 H new ATOM 0 HZ PHE A 106 7.708 0.776 -12.860 1.00 1.44 H new ATOM 1752 N THR A 107 9.069 -1.937 -6.635 1.00 21.12 N ATOM 1753 CA THR A 107 8.214 -3.135 -6.614 1.00 41.34 C ATOM 1754 C THR A 107 7.058 -2.967 -5.617 1.00 43.32 C ATOM 1755 O THR A 107 5.900 -3.226 -5.949 1.00 14.41 O ATOM 1756 CB THR A 107 9.017 -4.415 -6.257 1.00 31.11 C ATOM 1757 OG1 THR A 107 10.071 -4.623 -7.212 1.00 52.35 O ATOM 1758 CG2 THR A 107 8.114 -5.647 -6.226 1.00 11.23 C ATOM 0 H THR A 107 10.018 -2.095 -6.297 1.00 21.12 H new ATOM 0 HA THR A 107 7.812 -3.250 -7.621 1.00 41.34 H new ATOM 0 HB THR A 107 9.443 -4.271 -5.264 1.00 31.11 H new ATOM 0 HG1 THR A 107 10.778 -3.959 -7.069 1.00 52.35 H new ATOM 0 HG21 THR A 107 8.707 -6.526 -5.973 1.00 11.23 H new ATOM 0 HG22 THR A 107 7.334 -5.508 -5.478 1.00 11.23 H new ATOM 0 HG23 THR A 107 7.656 -5.787 -7.205 1.00 11.23 H new ATOM 1766 N LEU A 108 7.375 -2.522 -4.397 1.00 44.03 N ATOM 1767 CA LEU A 108 6.346 -2.229 -3.392 1.00 62.12 C ATOM 1768 C LEU A 108 5.397 -1.139 -3.897 1.00 74.41 C ATOM 1769 O LEU A 108 4.181 -1.247 -3.770 1.00 63.23 O ATOM 1770 CB LEU A 108 6.988 -1.773 -2.074 1.00 63.34 C ATOM 1771 CG LEU A 108 7.943 -2.779 -1.413 1.00 42.35 C ATOM 1772 CD1 LEU A 108 8.495 -2.217 -0.106 1.00 53.44 C ATOM 1773 CD2 LEU A 108 7.247 -4.116 -1.176 1.00 33.33 C ATOM 0 H LEU A 108 8.331 -2.357 -4.082 1.00 44.03 H new ATOM 0 HA LEU A 108 5.781 -3.144 -3.215 1.00 62.12 H new ATOM 0 HB2 LEU A 108 7.535 -0.849 -2.259 1.00 63.34 H new ATOM 0 HB3 LEU A 108 6.193 -1.537 -1.367 1.00 63.34 H new ATOM 0 HG LEU A 108 8.779 -2.950 -2.092 1.00 42.35 H new ATOM 0 HD11 LEU A 108 9.169 -2.944 0.347 1.00 53.44 H new ATOM 0 HD12 LEU A 108 9.039 -1.294 -0.308 1.00 53.44 H new ATOM 0 HD13 LEU A 108 7.672 -2.011 0.578 1.00 53.44 H new ATOM 0 HD21 LEU A 108 7.944 -4.811 -0.707 1.00 33.33 H new ATOM 0 HD22 LEU A 108 6.387 -3.968 -0.522 1.00 33.33 H new ATOM 0 HD23 LEU A 108 6.912 -4.526 -2.129 1.00 33.33 H new ATOM 1785 N ARG A 109 5.977 -0.090 -4.479 1.00 64.45 N ATOM 1786 CA ARG A 109 5.208 1.021 -5.050 1.00 71.21 C ATOM 1787 C ARG A 109 4.199 0.529 -6.101 1.00 45.30 C ATOM 1788 O ARG A 109 3.087 1.047 -6.203 1.00 62.44 O ATOM 1789 CB ARG A 109 6.178 2.038 -5.671 1.00 34.42 C ATOM 1790 CG ARG A 109 5.530 3.318 -6.190 1.00 61.22 C ATOM 1791 CD ARG A 109 6.583 4.255 -6.773 1.00 53.22 C ATOM 1792 NE ARG A 109 7.713 4.430 -5.857 1.00 42.14 N ATOM 1793 CZ ARG A 109 8.922 4.757 -6.229 1.00 71.13 C ATOM 1794 NH1 ARG A 109 9.200 4.968 -7.476 1.00 0.20 N ATOM 1795 NH2 ARG A 109 9.858 4.874 -5.346 1.00 75.45 N ATOM 0 H ARG A 109 6.987 0.016 -4.569 1.00 64.45 H new ATOM 0 HA ARG A 109 4.637 1.496 -4.252 1.00 71.21 H new ATOM 0 HB2 ARG A 109 6.926 2.305 -4.925 1.00 34.42 H new ATOM 0 HB3 ARG A 109 6.706 1.557 -6.494 1.00 34.42 H new ATOM 0 HG2 ARG A 109 4.790 3.074 -6.953 1.00 61.22 H new ATOM 0 HG3 ARG A 109 4.999 3.818 -5.380 1.00 61.22 H new ATOM 0 HD2 ARG A 109 6.941 3.856 -7.722 1.00 53.22 H new ATOM 0 HD3 ARG A 109 6.132 5.224 -6.985 1.00 53.22 H new ATOM 0 HE ARG A 109 7.544 4.287 -4.861 1.00 42.14 H new ATOM 0 HH11 ARG A 109 8.470 4.880 -8.183 1.00 0.20 H new ATOM 0 HH12 ARG A 109 10.149 5.223 -7.751 1.00 0.20 H new ATOM 0 HH21 ARG A 109 9.652 4.711 -4.360 1.00 75.45 H new ATOM 0 HH22 ARG A 109 10.802 5.129 -5.635 1.00 75.45 H new ATOM 1809 N THR A 110 4.596 -0.479 -6.874 1.00 42.31 N ATOM 1810 CA THR A 110 3.722 -1.073 -7.892 1.00 5.52 C ATOM 1811 C THR A 110 2.622 -1.936 -7.254 1.00 1.22 C ATOM 1812 O THR A 110 1.433 -1.717 -7.486 1.00 63.21 O ATOM 1813 CB THR A 110 4.525 -1.949 -8.887 1.00 73.41 C ATOM 1814 OG1 THR A 110 5.508 -1.156 -9.574 1.00 55.11 O ATOM 1815 CG2 THR A 110 3.605 -2.611 -9.908 1.00 54.02 C ATOM 0 H THR A 110 5.521 -0.906 -6.817 1.00 42.31 H new ATOM 0 HA THR A 110 3.264 -0.242 -8.429 1.00 5.52 H new ATOM 0 HB THR A 110 5.024 -2.728 -8.311 1.00 73.41 H new ATOM 0 HG1 THR A 110 6.212 -0.892 -8.946 1.00 55.11 H new ATOM 0 HG21 THR A 110 4.198 -3.219 -10.592 1.00 54.02 H new ATOM 0 HG22 THR A 110 2.884 -3.245 -9.391 1.00 54.02 H new ATOM 0 HG23 THR A 110 3.075 -1.843 -10.471 1.00 54.02 H new ATOM 1823 N GLN A 111 3.030 -2.912 -6.443 1.00 42.20 N ATOM 1824 CA GLN A 111 2.090 -3.866 -5.837 1.00 45.41 C ATOM 1825 C GLN A 111 1.074 -3.165 -4.922 1.00 62.21 C ATOM 1826 O GLN A 111 -0.124 -3.459 -4.969 1.00 42.22 O ATOM 1827 CB GLN A 111 2.859 -4.941 -5.057 1.00 14.42 C ATOM 1828 CG GLN A 111 3.876 -5.702 -5.907 1.00 23.13 C ATOM 1829 CD GLN A 111 3.256 -6.375 -7.124 1.00 72.15 C ATOM 1830 OE1 GLN A 111 2.094 -6.770 -7.115 1.00 70.24 O ATOM 1831 NE2 GLN A 111 4.027 -6.511 -8.183 1.00 63.34 N ATOM 0 H GLN A 111 4.005 -3.066 -6.188 1.00 42.20 H new ATOM 0 HA GLN A 111 1.530 -4.339 -6.644 1.00 45.41 H new ATOM 0 HB2 GLN A 111 3.376 -4.471 -4.220 1.00 14.42 H new ATOM 0 HB3 GLN A 111 2.148 -5.650 -4.634 1.00 14.42 H new ATOM 0 HG2 GLN A 111 4.652 -5.012 -6.237 1.00 23.13 H new ATOM 0 HG3 GLN A 111 4.362 -6.458 -5.290 1.00 23.13 H new ATOM 0 HE21 GLN A 111 4.989 -6.173 -8.160 1.00 63.34 H new ATOM 0 HE22 GLN A 111 3.662 -6.955 -9.026 1.00 63.34 H new ATOM 1840 N TYR A 112 1.557 -2.237 -4.095 1.00 74.13 N ATOM 1841 CA TYR A 112 0.685 -1.435 -3.230 1.00 52.54 C ATOM 1842 C TYR A 112 -0.380 -0.715 -4.070 1.00 70.43 C ATOM 1843 O TYR A 112 -1.572 -0.863 -3.837 1.00 72.14 O ATOM 1844 CB TYR A 112 1.525 -0.418 -2.434 1.00 14.12 C ATOM 1845 CG TYR A 112 0.737 0.400 -1.421 1.00 61.24 C ATOM 1846 CD1 TYR A 112 0.461 -0.104 -0.157 1.00 43.32 C ATOM 1847 CD2 TYR A 112 0.279 1.676 -1.729 1.00 3.51 C ATOM 1848 CE1 TYR A 112 -0.247 0.636 0.770 1.00 31.51 C ATOM 1849 CE2 TYR A 112 -0.427 2.423 -0.804 1.00 34.14 C ATOM 1850 CZ TYR A 112 -0.689 1.898 0.441 1.00 44.30 C ATOM 1851 OH TYR A 112 -1.391 2.642 1.365 1.00 51.12 O ATOM 0 H TYR A 112 2.550 -2.020 -4.005 1.00 74.13 H new ATOM 0 HA TYR A 112 0.179 -2.096 -2.526 1.00 52.54 H new ATOM 0 HB2 TYR A 112 2.319 -0.952 -1.912 1.00 14.12 H new ATOM 0 HB3 TYR A 112 2.007 0.263 -3.135 1.00 14.12 H new ATOM 0 HD1 TYR A 112 0.806 -1.093 0.106 1.00 43.32 H new ATOM 0 HD2 TYR A 112 0.478 2.090 -2.706 1.00 3.51 H new ATOM 0 HE1 TYR A 112 -0.453 0.227 1.748 1.00 31.51 H new ATOM 0 HE2 TYR A 112 -0.772 3.415 -1.058 1.00 34.14 H new ATOM 0 HH TYR A 112 -1.778 3.428 0.926 1.00 51.12 H new ATOM 1861 N MET A 113 0.073 0.022 -5.080 1.00 51.44 N ATOM 1862 CA MET A 113 -0.821 0.759 -5.983 1.00 43.44 C ATOM 1863 C MET A 113 -1.925 -0.141 -6.570 1.00 43.24 C ATOM 1864 O MET A 113 -3.073 0.281 -6.720 1.00 53.43 O ATOM 1865 CB MET A 113 0.004 1.365 -7.121 1.00 2.22 C ATOM 1866 CG MET A 113 -0.779 2.275 -8.056 1.00 14.44 C ATOM 1867 SD MET A 113 0.219 2.842 -9.446 1.00 44.21 S ATOM 1868 CE MET A 113 1.662 3.472 -8.588 1.00 25.22 C ATOM 0 H MET A 113 1.063 0.128 -5.299 1.00 51.44 H new ATOM 0 HA MET A 113 -1.310 1.542 -5.404 1.00 43.44 H new ATOM 0 HB2 MET A 113 0.830 1.932 -6.691 1.00 2.22 H new ATOM 0 HB3 MET A 113 0.442 0.556 -7.705 1.00 2.22 H new ATOM 0 HG2 MET A 113 -1.653 1.742 -8.431 1.00 14.44 H new ATOM 0 HG3 MET A 113 -1.146 3.137 -7.499 1.00 14.44 H new ATOM 0 HE1 MET A 113 2.361 3.892 -9.311 1.00 25.22 H new ATOM 0 HE2 MET A 113 1.358 4.247 -7.885 1.00 25.22 H new ATOM 0 HE3 MET A 113 2.146 2.660 -8.046 1.00 25.22 H new ATOM 1878 N LYS A 114 -1.564 -1.377 -6.902 1.00 11.52 N ATOM 1879 CA LYS A 114 -2.500 -2.330 -7.509 1.00 21.02 C ATOM 1880 C LYS A 114 -3.548 -2.839 -6.502 1.00 65.11 C ATOM 1881 O LYS A 114 -4.750 -2.796 -6.771 1.00 72.10 O ATOM 1882 CB LYS A 114 -1.719 -3.515 -8.099 1.00 11.24 C ATOM 1883 CG LYS A 114 -0.766 -3.119 -9.225 1.00 12.15 C ATOM 1884 CD LYS A 114 0.154 -4.268 -9.643 1.00 73.20 C ATOM 1885 CE LYS A 114 -0.621 -5.472 -10.166 1.00 42.22 C ATOM 1886 NZ LYS A 114 0.286 -6.505 -10.735 1.00 40.11 N ATOM 0 H LYS A 114 -0.624 -1.748 -6.761 1.00 11.52 H new ATOM 0 HA LYS A 114 -3.038 -1.807 -8.300 1.00 21.02 H new ATOM 0 HB2 LYS A 114 -1.149 -3.996 -7.304 1.00 11.24 H new ATOM 0 HB3 LYS A 114 -2.426 -4.254 -8.476 1.00 11.24 H new ATOM 0 HG2 LYS A 114 -1.345 -2.789 -10.088 1.00 12.15 H new ATOM 0 HG3 LYS A 114 -0.161 -2.271 -8.904 1.00 12.15 H new ATOM 0 HD2 LYS A 114 0.840 -3.918 -10.414 1.00 73.20 H new ATOM 0 HD3 LYS A 114 0.761 -4.572 -8.790 1.00 73.20 H new ATOM 0 HE2 LYS A 114 -1.206 -5.908 -9.356 1.00 42.22 H new ATOM 0 HE3 LYS A 114 -1.327 -5.147 -10.930 1.00 42.22 H new ATOM 0 HZ1 LYS A 114 -0.277 -7.309 -11.081 1.00 40.11 H new ATOM 0 HZ2 LYS A 114 0.826 -6.096 -11.524 1.00 40.11 H new ATOM 0 HZ3 LYS A 114 0.943 -6.834 -9.999 1.00 40.11 H new ATOM 1900 N TYR A 115 -3.092 -3.310 -5.344 1.00 72.14 N ATOM 1901 CA TYR A 115 -3.990 -3.920 -4.350 1.00 73.32 C ATOM 1902 C TYR A 115 -4.416 -2.918 -3.259 1.00 51.11 C ATOM 1903 O TYR A 115 -5.605 -2.753 -2.977 1.00 43.22 O ATOM 1904 CB TYR A 115 -3.301 -5.133 -3.702 1.00 34.14 C ATOM 1905 CG TYR A 115 -2.926 -6.230 -4.689 1.00 45.20 C ATOM 1906 CD1 TYR A 115 -1.723 -6.188 -5.391 1.00 64.20 C ATOM 1907 CD2 TYR A 115 -3.778 -7.306 -4.920 1.00 54.40 C ATOM 1908 CE1 TYR A 115 -1.384 -7.182 -6.290 1.00 24.13 C ATOM 1909 CE2 TYR A 115 -3.445 -8.303 -5.818 1.00 3.34 C ATOM 1910 CZ TYR A 115 -2.247 -8.238 -6.498 1.00 32.21 C ATOM 1911 OH TYR A 115 -1.915 -9.230 -7.395 1.00 2.33 O ATOM 0 H TYR A 115 -2.111 -3.284 -5.066 1.00 72.14 H new ATOM 0 HA TYR A 115 -4.892 -4.238 -4.873 1.00 73.32 H new ATOM 0 HB2 TYR A 115 -2.400 -4.796 -3.189 1.00 34.14 H new ATOM 0 HB3 TYR A 115 -3.962 -5.551 -2.943 1.00 34.14 H new ATOM 0 HD1 TYR A 115 -1.043 -5.364 -5.230 1.00 64.20 H new ATOM 0 HD2 TYR A 115 -4.716 -7.363 -4.388 1.00 54.40 H new ATOM 0 HE1 TYR A 115 -0.448 -7.132 -6.827 1.00 24.13 H new ATOM 0 HE2 TYR A 115 -4.120 -9.129 -5.986 1.00 3.34 H new ATOM 0 HH TYR A 115 -2.697 -9.798 -7.559 1.00 2.33 H new ATOM 1921 N LEU A 116 -3.441 -2.242 -2.660 1.00 40.24 N ATOM 1922 CA LEU A 116 -3.692 -1.323 -1.541 1.00 54.12 C ATOM 1923 C LEU A 116 -3.651 0.148 -1.983 1.00 61.03 C ATOM 1924 O LEU A 116 -2.603 0.784 -1.947 1.00 13.23 O ATOM 1925 CB LEU A 116 -2.646 -1.548 -0.441 1.00 31.24 C ATOM 1926 CG LEU A 116 -2.639 -2.942 0.203 1.00 64.22 C ATOM 1927 CD1 LEU A 116 -1.387 -3.136 1.053 1.00 52.31 C ATOM 1928 CD2 LEU A 116 -3.894 -3.150 1.044 1.00 1.12 C ATOM 0 H LEU A 116 -2.460 -2.310 -2.929 1.00 40.24 H new ATOM 0 HA LEU A 116 -4.692 -1.534 -1.163 1.00 54.12 H new ATOM 0 HB2 LEU A 116 -1.658 -1.358 -0.861 1.00 31.24 H new ATOM 0 HB3 LEU A 116 -2.806 -0.808 0.343 1.00 31.24 H new ATOM 0 HG LEU A 116 -2.631 -3.686 -0.593 1.00 64.22 H new ATOM 0 HD11 LEU A 116 -1.401 -4.130 1.500 1.00 52.31 H new ATOM 0 HD12 LEU A 116 -0.502 -3.033 0.425 1.00 52.31 H new ATOM 0 HD13 LEU A 116 -1.362 -2.384 1.841 1.00 52.31 H new ATOM 0 HD21 LEU A 116 -3.871 -4.143 1.492 1.00 1.12 H new ATOM 0 HD22 LEU A 116 -3.933 -2.397 1.831 1.00 1.12 H new ATOM 0 HD23 LEU A 116 -4.776 -3.058 0.410 1.00 1.12 H new ATOM 1940 N TYR A 117 -4.788 0.686 -2.403 1.00 10.15 N ATOM 1941 CA TYR A 117 -4.862 2.106 -2.776 1.00 4.20 C ATOM 1942 C TYR A 117 -6.298 2.658 -2.707 1.00 23.22 C ATOM 1943 O TYR A 117 -6.546 3.626 -1.986 1.00 23.12 O ATOM 1944 CB TYR A 117 -4.261 2.358 -4.170 1.00 52.04 C ATOM 1945 CG TYR A 117 -4.263 3.828 -4.547 1.00 54.34 C ATOM 1946 CD1 TYR A 117 -3.247 4.672 -4.114 1.00 53.23 C ATOM 1947 CD2 TYR A 117 -5.290 4.376 -5.312 1.00 1.44 C ATOM 1948 CE1 TYR A 117 -3.251 6.015 -4.431 1.00 65.32 C ATOM 1949 CE2 TYR A 117 -5.302 5.722 -5.628 1.00 14.41 C ATOM 1950 CZ TYR A 117 -4.279 6.534 -5.185 1.00 60.11 C ATOM 1951 OH TYR A 117 -4.288 7.873 -5.490 1.00 4.04 O ATOM 0 H TYR A 117 -5.666 0.175 -2.496 1.00 10.15 H new ATOM 0 HA TYR A 117 -4.266 2.644 -2.039 1.00 4.20 H new ATOM 0 HB2 TYR A 117 -3.238 1.981 -4.195 1.00 52.04 H new ATOM 0 HB3 TYR A 117 -4.826 1.795 -4.913 1.00 52.04 H new ATOM 0 HD1 TYR A 117 -2.440 4.270 -3.519 1.00 53.23 H new ATOM 0 HD2 TYR A 117 -6.089 3.740 -5.664 1.00 1.44 H new ATOM 0 HE1 TYR A 117 -2.452 6.656 -4.089 1.00 65.32 H new ATOM 0 HE2 TYR A 117 -6.107 6.135 -6.218 1.00 14.41 H new ATOM 0 HH TYR A 117 -3.659 8.046 -6.221 1.00 4.04 H new ATOM 1961 N PRO A 118 -7.280 2.074 -3.442 1.00 35.33 N ATOM 1962 CA PRO A 118 -8.667 2.576 -3.416 1.00 62.34 C ATOM 1963 C PRO A 118 -9.215 2.710 -1.985 1.00 72.13 C ATOM 1964 O PRO A 118 -10.116 3.506 -1.724 1.00 22.23 O ATOM 1965 CB PRO A 118 -9.457 1.519 -4.219 1.00 71.42 C ATOM 1966 CG PRO A 118 -8.540 0.345 -4.340 1.00 4.52 C ATOM 1967 CD PRO A 118 -7.150 0.914 -4.344 1.00 42.03 C ATOM 0 HA PRO A 118 -8.745 3.579 -3.836 1.00 62.34 H new ATOM 0 HB2 PRO A 118 -10.380 1.246 -3.707 1.00 71.42 H new ATOM 0 HB3 PRO A 118 -9.738 1.901 -5.201 1.00 71.42 H new ATOM 0 HG2 PRO A 118 -8.678 -0.347 -3.509 1.00 4.52 H new ATOM 0 HG3 PRO A 118 -8.737 -0.213 -5.255 1.00 4.52 H new ATOM 0 HD2 PRO A 118 -6.416 0.196 -3.979 1.00 42.03 H new ATOM 0 HD3 PRO A 118 -6.835 1.211 -5.345 1.00 42.03 H new ATOM 1975 N TYR A 119 -8.639 1.949 -1.054 1.00 63.10 N ATOM 1976 CA TYR A 119 -9.075 1.974 0.342 1.00 3.13 C ATOM 1977 C TYR A 119 -8.622 3.269 1.053 1.00 11.32 C ATOM 1978 O TYR A 119 -9.414 3.906 1.749 1.00 61.11 O ATOM 1979 CB TYR A 119 -8.551 0.732 1.081 1.00 70.52 C ATOM 1980 CG TYR A 119 -9.399 0.331 2.279 1.00 61.41 C ATOM 1981 CD1 TYR A 119 -10.596 -0.355 2.097 1.00 21.43 C ATOM 1982 CD2 TYR A 119 -9.010 0.636 3.580 1.00 33.14 C ATOM 1983 CE1 TYR A 119 -11.379 -0.723 3.174 1.00 51.11 C ATOM 1984 CE2 TYR A 119 -9.792 0.270 4.661 1.00 24.34 C ATOM 1985 CZ TYR A 119 -10.974 -0.409 4.453 1.00 14.35 C ATOM 1986 OH TYR A 119 -11.760 -0.771 5.526 1.00 44.31 O ATOM 0 H TYR A 119 -7.869 1.307 -1.242 1.00 63.10 H new ATOM 0 HA TYR A 119 -10.165 1.959 0.358 1.00 3.13 H new ATOM 0 HB2 TYR A 119 -8.506 -0.104 0.383 1.00 70.52 H new ATOM 0 HB3 TYR A 119 -7.531 0.922 1.416 1.00 70.52 H new ATOM 0 HD1 TYR A 119 -10.918 -0.604 1.097 1.00 21.43 H new ATOM 0 HD2 TYR A 119 -8.084 1.166 3.748 1.00 33.14 H new ATOM 0 HE1 TYR A 119 -12.305 -1.255 3.014 1.00 51.11 H new ATOM 0 HE2 TYR A 119 -9.478 0.515 5.665 1.00 24.34 H new ATOM 0 HH TYR A 119 -12.433 -1.420 5.234 1.00 44.31 H new ATOM 1996 N GLU A 120 -7.358 3.676 0.858 1.00 22.30 N ATOM 1997 CA GLU A 120 -6.844 4.901 1.501 1.00 0.23 C ATOM 1998 C GLU A 120 -7.528 6.152 0.933 1.00 73.41 C ATOM 1999 O GLU A 120 -7.777 7.120 1.653 1.00 24.44 O ATOM 2000 CB GLU A 120 -5.313 5.036 1.349 1.00 10.54 C ATOM 2001 CG GLU A 120 -4.835 5.342 -0.072 1.00 60.12 C ATOM 2002 CD GLU A 120 -3.389 5.832 -0.120 1.00 31.55 C ATOM 2003 OE1 GLU A 120 -2.469 4.994 -0.048 1.00 61.41 O ATOM 2004 OE2 GLU A 120 -3.174 7.062 -0.223 1.00 13.30 O ATOM 0 H GLU A 120 -6.682 3.187 0.272 1.00 22.30 H new ATOM 0 HA GLU A 120 -7.076 4.816 2.563 1.00 0.23 H new ATOM 0 HB2 GLU A 120 -4.964 5.827 2.013 1.00 10.54 H new ATOM 0 HB3 GLU A 120 -4.845 4.110 1.683 1.00 10.54 H new ATOM 0 HG2 GLU A 120 -4.930 4.444 -0.683 1.00 60.12 H new ATOM 0 HG3 GLU A 120 -5.484 6.098 -0.514 1.00 60.12 H new ATOM 2011 N CYS A 121 -7.835 6.130 -0.364 1.00 4.13 N ATOM 2012 CA CYS A 121 -8.482 7.271 -1.025 1.00 33.55 C ATOM 2013 C CYS A 121 -9.980 7.346 -0.687 1.00 30.30 C ATOM 2014 O CYS A 121 -10.541 8.435 -0.562 1.00 72.14 O ATOM 2015 CB CYS A 121 -8.287 7.196 -2.546 1.00 34.23 C ATOM 2016 SG CYS A 121 -8.791 8.691 -3.433 1.00 41.34 S ATOM 0 H CYS A 121 -7.648 5.338 -0.979 1.00 4.13 H new ATOM 0 HA CYS A 121 -8.007 8.178 -0.650 1.00 33.55 H new ATOM 0 HB2 CYS A 121 -7.236 6.999 -2.757 1.00 34.23 H new ATOM 0 HB3 CYS A 121 -8.854 6.349 -2.932 1.00 34.23 H new ATOM 0 HG CYS A 121 -7.754 9.450 -3.628 1.00 41.34 H new ATOM 2022 N GLU A 122 -10.618 6.189 -0.523 1.00 23.31 N ATOM 2023 CA GLU A 122 -12.050 6.138 -0.205 1.00 12.12 C ATOM 2024 C GLU A 122 -12.313 6.445 1.282 1.00 23.04 C ATOM 2025 O GLU A 122 -13.119 7.316 1.617 1.00 40.41 O ATOM 2026 CB GLU A 122 -12.621 4.751 -0.552 1.00 15.43 C ATOM 2027 CG GLU A 122 -14.148 4.674 -0.529 1.00 23.32 C ATOM 2028 CD GLU A 122 -14.794 5.353 -1.733 1.00 44.44 C ATOM 2029 OE1 GLU A 122 -14.832 6.598 -1.774 1.00 2.42 O ATOM 2030 OE2 GLU A 122 -15.266 4.633 -2.646 1.00 60.33 O ATOM 0 H GLU A 122 -10.171 5.276 -0.604 1.00 23.31 H new ATOM 0 HA GLU A 122 -12.547 6.901 -0.804 1.00 12.12 H new ATOM 0 HB2 GLU A 122 -12.270 4.464 -1.543 1.00 15.43 H new ATOM 0 HB3 GLU A 122 -12.222 4.020 0.152 1.00 15.43 H new ATOM 0 HG2 GLU A 122 -14.454 3.628 -0.500 1.00 23.32 H new ATOM 0 HG3 GLU A 122 -14.517 5.139 0.385 1.00 23.32 H new ATOM 2037 N LYS A 123 -11.619 5.729 2.167 1.00 43.24 N ATOM 2038 CA LYS A 123 -11.841 5.853 3.615 1.00 20.31 C ATOM 2039 C LYS A 123 -11.206 7.124 4.203 1.00 72.41 C ATOM 2040 O LYS A 123 -11.768 7.745 5.106 1.00 23.11 O ATOM 2041 CB LYS A 123 -11.274 4.623 4.340 1.00 60.02 C ATOM 2042 CG LYS A 123 -11.840 3.294 3.845 1.00 44.43 C ATOM 2043 CD LYS A 123 -13.346 3.189 4.070 1.00 40.12 C ATOM 2044 CE LYS A 123 -13.888 1.847 3.594 1.00 45.32 C ATOM 2045 NZ LYS A 123 -15.348 1.712 3.835 1.00 2.40 N ATOM 0 H LYS A 123 -10.897 5.056 1.910 1.00 43.24 H new ATOM 0 HA LYS A 123 -12.918 5.920 3.766 1.00 20.31 H new ATOM 0 HB2 LYS A 123 -10.191 4.611 4.221 1.00 60.02 H new ATOM 0 HB3 LYS A 123 -11.477 4.718 5.407 1.00 60.02 H new ATOM 0 HG2 LYS A 123 -11.625 3.183 2.782 1.00 44.43 H new ATOM 0 HG3 LYS A 123 -11.339 2.474 4.359 1.00 44.43 H new ATOM 0 HD2 LYS A 123 -13.567 3.317 5.130 1.00 40.12 H new ATOM 0 HD3 LYS A 123 -13.852 3.996 3.540 1.00 40.12 H new ATOM 0 HE2 LYS A 123 -13.686 1.733 2.529 1.00 45.32 H new ATOM 0 HE3 LYS A 123 -13.361 1.042 4.107 1.00 45.32 H new ATOM 0 HZ1 LYS A 123 -15.672 0.784 3.495 1.00 2.40 H new ATOM 0 HZ2 LYS A 123 -15.541 1.794 4.854 1.00 2.40 H new ATOM 0 HZ3 LYS A 123 -15.855 2.463 3.325 1.00 2.40 H new ATOM 2059 N ARG A 124 -10.036 7.508 3.693 1.00 20.10 N ATOM 2060 CA ARG A 124 -9.295 8.656 4.239 1.00 12.31 C ATOM 2061 C ARG A 124 -9.190 9.820 3.238 1.00 24.44 C ATOM 2062 O ARG A 124 -9.261 10.987 3.622 1.00 21.22 O ATOM 2063 CB ARG A 124 -7.883 8.217 4.650 1.00 34.42 C ATOM 2064 CG ARG A 124 -7.842 7.102 5.691 1.00 61.23 C ATOM 2065 CD ARG A 124 -8.456 7.532 7.018 1.00 4.03 C ATOM 2066 NE ARG A 124 -8.284 6.515 8.055 1.00 73.22 N ATOM 2067 CZ ARG A 124 -8.879 6.535 9.218 1.00 15.35 C ATOM 2068 NH1 ARG A 124 -9.787 7.418 9.483 1.00 51.23 N ATOM 2069 NH2 ARG A 124 -8.581 5.646 10.109 1.00 44.05 N ATOM 0 H ARG A 124 -9.579 7.047 2.907 1.00 20.10 H new ATOM 0 HA ARG A 124 -9.852 9.012 5.106 1.00 12.31 H new ATOM 0 HB2 ARG A 124 -7.347 7.886 3.761 1.00 34.42 H new ATOM 0 HB3 ARG A 124 -7.348 9.082 5.042 1.00 34.42 H new ATOM 0 HG2 ARG A 124 -8.376 6.232 5.310 1.00 61.23 H new ATOM 0 HG3 ARG A 124 -6.808 6.796 5.853 1.00 61.23 H new ATOM 0 HD2 ARG A 124 -7.997 8.465 7.345 1.00 4.03 H new ATOM 0 HD3 ARG A 124 -9.518 7.732 6.878 1.00 4.03 H new ATOM 0 HE ARG A 124 -7.656 5.736 7.856 1.00 73.22 H new ATOM 0 HH11 ARG A 124 -10.046 8.110 8.780 1.00 51.23 H new ATOM 0 HH12 ARG A 124 -10.244 7.422 10.395 1.00 51.23 H new ATOM 0 HH21 ARG A 124 -7.883 4.931 9.903 1.00 44.05 H new ATOM 0 HH22 ARG A 124 -9.044 5.660 11.018 1.00 44.05 H new ATOM 2083 N GLY A 125 -9.013 9.499 1.960 1.00 35.51 N ATOM 2084 CA GLY A 125 -8.804 10.534 0.947 1.00 32.34 C ATOM 2085 C GLY A 125 -7.370 11.057 0.930 1.00 15.55 C ATOM 2086 O GLY A 125 -7.130 12.229 0.640 1.00 45.43 O ATOM 0 H GLY A 125 -9.010 8.544 1.602 1.00 35.51 H new ATOM 0 HA2 GLY A 125 -9.052 10.131 -0.035 1.00 32.34 H new ATOM 0 HA3 GLY A 125 -9.487 11.363 1.133 1.00 32.34 H new ATOM 2090 N LEU A 126 -6.417 10.175 1.230 1.00 71.33 N ATOM 2091 CA LEU A 126 -5.003 10.559 1.353 1.00 14.22 C ATOM 2092 C LEU A 126 -4.389 10.969 0.000 1.00 72.13 C ATOM 2093 O LEU A 126 -3.847 12.067 -0.137 1.00 31.42 O ATOM 2094 CB LEU A 126 -4.196 9.403 1.968 1.00 20.22 C ATOM 2095 CG LEU A 126 -4.702 8.906 3.334 1.00 50.42 C ATOM 2096 CD1 LEU A 126 -3.865 7.733 3.832 1.00 73.23 C ATOM 2097 CD2 LEU A 126 -4.709 10.038 4.362 1.00 3.41 C ATOM 0 H LEU A 126 -6.596 9.184 1.394 1.00 71.33 H new ATOM 0 HA LEU A 126 -4.958 11.429 2.008 1.00 14.22 H new ATOM 0 HB2 LEU A 126 -4.201 8.566 1.270 1.00 20.22 H new ATOM 0 HB3 LEU A 126 -3.159 9.722 2.076 1.00 20.22 H new ATOM 0 HG LEU A 126 -5.728 8.561 3.203 1.00 50.42 H new ATOM 0 HD11 LEU A 126 -4.243 7.401 4.799 1.00 73.23 H new ATOM 0 HD12 LEU A 126 -3.926 6.913 3.117 1.00 73.23 H new ATOM 0 HD13 LEU A 126 -2.826 8.046 3.937 1.00 73.23 H new ATOM 0 HD21 LEU A 126 -5.071 9.659 5.318 1.00 3.41 H new ATOM 0 HD22 LEU A 126 -3.697 10.425 4.484 1.00 3.41 H new ATOM 0 HD23 LEU A 126 -5.364 10.838 4.018 1.00 3.41 H new ATOM 2109 N SER A 127 -4.473 10.085 -0.996 1.00 52.10 N ATOM 2110 CA SER A 127 -3.867 10.350 -2.313 1.00 73.50 C ATOM 2111 C SER A 127 -4.892 10.284 -3.457 1.00 71.34 C ATOM 2112 O SER A 127 -5.850 9.509 -3.410 1.00 62.41 O ATOM 2113 CB SER A 127 -2.744 9.342 -2.593 1.00 1.12 C ATOM 2114 OG SER A 127 -1.817 9.272 -1.518 1.00 44.40 O ATOM 0 H SER A 127 -4.949 9.186 -0.923 1.00 52.10 H new ATOM 0 HA SER A 127 -3.468 11.364 -2.275 1.00 73.50 H new ATOM 0 HB2 SER A 127 -3.175 8.356 -2.766 1.00 1.12 H new ATOM 0 HB3 SER A 127 -2.221 9.625 -3.506 1.00 1.12 H new ATOM 0 HG SER A 127 -2.072 8.544 -0.913 1.00 44.40 H new ATOM 2120 N ASN A 128 -4.676 11.100 -4.493 1.00 61.44 N ATOM 2121 CA ASN A 128 -5.507 11.065 -5.708 1.00 62.43 C ATOM 2122 C ASN A 128 -4.723 10.444 -6.877 1.00 24.40 C ATOM 2123 O ASN A 128 -3.514 10.644 -6.993 1.00 21.53 O ATOM 2124 CB ASN A 128 -5.958 12.477 -6.107 1.00 22.22 C ATOM 2125 CG ASN A 128 -6.521 13.267 -4.942 1.00 5.20 C ATOM 2126 OD1 ASN A 128 -7.704 13.190 -4.634 1.00 2.54 O ATOM 2127 ND2 ASN A 128 -5.674 14.044 -4.298 1.00 3.15 N ATOM 0 H ASN A 128 -3.931 11.796 -4.518 1.00 61.44 H new ATOM 0 HA ASN A 128 -6.385 10.457 -5.489 1.00 62.43 H new ATOM 0 HB2 ASN A 128 -5.111 13.017 -6.531 1.00 22.22 H new ATOM 0 HB3 ASN A 128 -6.714 12.404 -6.889 1.00 22.22 H new ATOM 0 HD21 ASN A 128 -5.996 14.609 -3.512 1.00 3.15 H new ATOM 0 HD22 ASN A 128 -4.696 14.081 -4.585 1.00 3.15 H new ATOM 2134 N PRO A 129 -5.400 9.702 -7.776 1.00 71.33 N ATOM 2135 CA PRO A 129 -4.741 9.073 -8.940 1.00 0.22 C ATOM 2136 C PRO A 129 -4.020 10.098 -9.840 1.00 12.42 C ATOM 2137 O PRO A 129 -3.072 9.761 -10.551 1.00 2.02 O ATOM 2138 CB PRO A 129 -5.904 8.400 -9.696 1.00 34.23 C ATOM 2139 CG PRO A 129 -7.143 9.053 -9.172 1.00 62.13 C ATOM 2140 CD PRO A 129 -6.845 9.414 -7.742 1.00 2.01 C ATOM 0 HA PRO A 129 -3.960 8.377 -8.635 1.00 0.22 H new ATOM 0 HB2 PRO A 129 -5.809 8.543 -10.772 1.00 34.23 H new ATOM 0 HB3 PRO A 129 -5.920 7.325 -9.517 1.00 34.23 H new ATOM 0 HG2 PRO A 129 -7.394 9.939 -9.755 1.00 62.13 H new ATOM 0 HG3 PRO A 129 -7.997 8.378 -9.235 1.00 62.13 H new ATOM 0 HD2 PRO A 129 -7.423 10.278 -7.414 1.00 2.01 H new ATOM 0 HD3 PRO A 129 -7.079 8.596 -7.060 1.00 2.01 H new ATOM 2148 N ASN A 130 -4.470 11.354 -9.790 1.00 62.40 N ATOM 2149 CA ASN A 130 -3.858 12.433 -10.577 1.00 53.21 C ATOM 2150 C ASN A 130 -2.462 12.790 -10.039 1.00 12.51 C ATOM 2151 O ASN A 130 -1.463 12.675 -10.753 1.00 73.41 O ATOM 2152 CB ASN A 130 -4.762 13.670 -10.565 1.00 15.31 C ATOM 2153 CG ASN A 130 -6.158 13.374 -11.077 1.00 1.21 C ATOM 2154 OD1 ASN A 130 -6.364 12.489 -11.901 1.00 20.21 O ATOM 2155 ND2 ASN A 130 -7.130 14.116 -10.599 1.00 40.51 N ATOM 0 H ASN A 130 -5.257 11.651 -9.213 1.00 62.40 H new ATOM 0 HA ASN A 130 -3.744 12.083 -11.603 1.00 53.21 H new ATOM 0 HB2 ASN A 130 -4.826 14.059 -9.549 1.00 15.31 H new ATOM 0 HB3 ASN A 130 -4.312 14.451 -11.178 1.00 15.31 H new ATOM 0 HD21 ASN A 130 -8.089 13.964 -10.912 1.00 40.51 H new ATOM 0 HD22 ASN A 130 -6.926 14.844 -9.915 1.00 40.51 H new ATOM 2162 N GLU A 131 -2.398 13.217 -8.772 1.00 12.13 N ATOM 2163 CA GLU A 131 -1.116 13.526 -8.116 1.00 32.34 C ATOM 2164 C GLU A 131 -0.167 12.312 -8.159 1.00 54.13 C ATOM 2165 O GLU A 131 1.053 12.465 -8.241 1.00 12.34 O ATOM 2166 CB GLU A 131 -1.347 13.982 -6.660 1.00 10.02 C ATOM 2167 CG GLU A 131 -1.992 12.931 -5.763 1.00 10.52 C ATOM 2168 CD GLU A 131 -2.148 13.400 -4.324 1.00 25.24 C ATOM 2169 OE1 GLU A 131 -2.915 14.351 -4.088 1.00 30.33 O ATOM 2170 OE2 GLU A 131 -1.521 12.811 -3.420 1.00 2.32 O ATOM 0 H GLU A 131 -3.216 13.357 -8.179 1.00 12.13 H new ATOM 0 HA GLU A 131 -0.645 14.343 -8.663 1.00 32.34 H new ATOM 0 HB2 GLU A 131 -0.390 14.273 -6.227 1.00 10.02 H new ATOM 0 HB3 GLU A 131 -1.977 14.872 -6.667 1.00 10.02 H new ATOM 0 HG2 GLU A 131 -2.972 12.670 -6.163 1.00 10.52 H new ATOM 0 HG3 GLU A 131 -1.388 12.024 -5.781 1.00 10.52 H new ATOM 2177 N LEU A 132 -0.749 11.112 -8.100 1.00 73.10 N ATOM 2178 CA LEU A 132 0.008 9.854 -8.181 1.00 5.32 C ATOM 2179 C LEU A 132 0.933 9.801 -9.411 1.00 50.13 C ATOM 2180 O LEU A 132 2.131 9.538 -9.284 1.00 23.10 O ATOM 2181 CB LEU A 132 -0.971 8.668 -8.206 1.00 52.32 C ATOM 2182 CG LEU A 132 -0.332 7.270 -8.291 1.00 61.01 C ATOM 2183 CD1 LEU A 132 0.591 7.015 -7.100 1.00 62.32 C ATOM 2184 CD2 LEU A 132 -1.411 6.193 -8.377 1.00 30.14 C ATOM 0 H LEU A 132 -1.755 10.982 -7.995 1.00 73.10 H new ATOM 0 HA LEU A 132 0.647 9.796 -7.300 1.00 5.32 H new ATOM 0 HB2 LEU A 132 -1.586 8.711 -7.307 1.00 52.32 H new ATOM 0 HB3 LEU A 132 -1.641 8.793 -9.057 1.00 52.32 H new ATOM 0 HG LEU A 132 0.271 7.228 -9.198 1.00 61.01 H new ATOM 0 HD11 LEU A 132 1.029 6.020 -7.185 1.00 62.32 H new ATOM 0 HD12 LEU A 132 1.385 7.761 -7.089 1.00 62.32 H new ATOM 0 HD13 LEU A 132 0.018 7.081 -6.175 1.00 62.32 H new ATOM 0 HD21 LEU A 132 -0.941 5.211 -8.436 1.00 30.14 H new ATOM 0 HD22 LEU A 132 -2.043 6.240 -7.490 1.00 30.14 H new ATOM 0 HD23 LEU A 132 -2.020 6.358 -9.266 1.00 30.14 H new ATOM 2196 N GLN A 133 0.381 10.054 -10.596 1.00 22.54 N ATOM 2197 CA GLN A 133 1.163 9.991 -11.837 1.00 4.05 C ATOM 2198 C GLN A 133 2.343 10.979 -11.819 1.00 75.51 C ATOM 2199 O GLN A 133 3.457 10.636 -12.228 1.00 43.01 O ATOM 2200 CB GLN A 133 0.263 10.256 -13.052 1.00 54.51 C ATOM 2201 CG GLN A 133 0.989 10.183 -14.395 1.00 11.24 C ATOM 2202 CD GLN A 133 1.687 8.847 -14.631 1.00 24.32 C ATOM 2203 OE1 GLN A 133 1.101 7.907 -15.156 1.00 14.03 O ATOM 2204 NE2 GLN A 133 2.949 8.752 -14.259 1.00 53.11 N ATOM 0 H GLN A 133 -0.599 10.304 -10.727 1.00 22.54 H new ATOM 0 HA GLN A 133 1.576 8.985 -11.914 1.00 4.05 H new ATOM 0 HB2 GLN A 133 -0.552 9.532 -13.052 1.00 54.51 H new ATOM 0 HB3 GLN A 133 -0.188 11.243 -12.948 1.00 54.51 H new ATOM 0 HG2 GLN A 133 0.272 10.358 -15.198 1.00 11.24 H new ATOM 0 HG3 GLN A 133 1.726 10.984 -14.446 1.00 11.24 H new ATOM 0 HE21 GLN A 133 3.414 9.549 -13.824 1.00 53.11 H new ATOM 0 HE22 GLN A 133 3.460 7.882 -14.406 1.00 53.11 H new ATOM 2213 N ALA A 134 2.092 12.198 -11.341 1.00 60.21 N ATOM 2214 CA ALA A 134 3.143 13.216 -11.217 1.00 44.24 C ATOM 2215 C ALA A 134 4.266 12.743 -10.278 1.00 11.03 C ATOM 2216 O ALA A 134 5.454 12.916 -10.566 1.00 23.23 O ATOM 2217 CB ALA A 134 2.550 14.531 -10.718 1.00 22.43 C ATOM 0 H ALA A 134 1.170 12.507 -11.032 1.00 60.21 H new ATOM 0 HA ALA A 134 3.576 13.377 -12.204 1.00 44.24 H new ATOM 0 HB1 ALA A 134 3.340 15.277 -10.631 1.00 22.43 H new ATOM 0 HB2 ALA A 134 1.797 14.881 -11.424 1.00 22.43 H new ATOM 0 HB3 ALA A 134 2.089 14.375 -9.743 1.00 22.43 H new ATOM 2223 N ALA A 135 3.871 12.138 -9.159 1.00 53.35 N ATOM 2224 CA ALA A 135 4.820 11.555 -8.203 1.00 51.02 C ATOM 2225 C ALA A 135 5.724 10.510 -8.876 1.00 53.12 C ATOM 2226 O ALA A 135 6.955 10.577 -8.800 1.00 52.23 O ATOM 2227 CB ALA A 135 4.058 10.912 -7.048 1.00 13.03 C ATOM 0 H ALA A 135 2.893 12.037 -8.888 1.00 53.35 H new ATOM 0 HA ALA A 135 5.455 12.356 -7.825 1.00 51.02 H new ATOM 0 HB1 ALA A 135 4.766 10.480 -6.341 1.00 13.03 H new ATOM 0 HB2 ALA A 135 3.456 11.668 -6.544 1.00 13.03 H new ATOM 0 HB3 ALA A 135 3.407 10.128 -7.434 1.00 13.03 H new ATOM 2233 N ILE A 136 5.090 9.553 -9.546 1.00 24.54 N ATOM 2234 CA ILE A 136 5.795 8.456 -10.217 1.00 2.44 C ATOM 2235 C ILE A 136 6.759 8.967 -11.296 1.00 3.12 C ATOM 2236 O ILE A 136 7.914 8.542 -11.360 1.00 13.44 O ATOM 2237 CB ILE A 136 4.784 7.480 -10.856 1.00 31.32 C ATOM 2238 CG1 ILE A 136 3.813 6.965 -9.785 1.00 1.22 C ATOM 2239 CG2 ILE A 136 5.502 6.315 -11.544 1.00 61.31 C ATOM 2240 CD1 ILE A 136 2.598 6.269 -10.347 1.00 55.44 C ATOM 0 H ILE A 136 4.075 9.512 -9.642 1.00 24.54 H new ATOM 0 HA ILE A 136 6.380 7.939 -9.457 1.00 2.44 H new ATOM 0 HB ILE A 136 4.218 8.014 -11.619 1.00 31.32 H new ATOM 0 HG12 ILE A 136 4.344 6.275 -9.128 1.00 1.22 H new ATOM 0 HG13 ILE A 136 3.487 7.804 -9.170 1.00 1.22 H new ATOM 0 HG21 ILE A 136 4.766 5.643 -11.985 1.00 61.31 H new ATOM 0 HG22 ILE A 136 6.155 6.701 -12.326 1.00 61.31 H new ATOM 0 HG23 ILE A 136 6.097 5.770 -10.811 1.00 61.31 H new ATOM 0 HD11 ILE A 136 1.960 5.934 -9.529 1.00 55.44 H new ATOM 0 HD12 ILE A 136 2.043 6.961 -10.980 1.00 55.44 H new ATOM 0 HD13 ILE A 136 2.912 5.409 -10.938 1.00 55.44 H new ATOM 2252 N ASP A 137 6.284 9.884 -12.136 1.00 64.43 N ATOM 2253 CA ASP A 137 7.112 10.454 -13.200 1.00 14.00 C ATOM 2254 C ASP A 137 8.326 11.183 -12.598 1.00 41.11 C ATOM 2255 O ASP A 137 9.450 11.069 -13.095 1.00 2.14 O ATOM 2256 CB ASP A 137 6.279 11.407 -14.064 1.00 72.10 C ATOM 2257 CG ASP A 137 6.932 11.695 -15.405 1.00 31.55 C ATOM 2258 OD1 ASP A 137 7.768 12.615 -15.486 1.00 3.44 O ATOM 2259 OD2 ASP A 137 6.613 10.993 -16.385 1.00 41.32 O ATOM 0 H ASP A 137 5.332 10.249 -12.102 1.00 64.43 H new ATOM 0 HA ASP A 137 7.478 9.646 -13.834 1.00 14.00 H new ATOM 0 HB2 ASP A 137 5.292 10.974 -14.229 1.00 72.10 H new ATOM 0 HB3 ASP A 137 6.130 12.344 -13.527 1.00 72.10 H new ATOM 2264 N SER A 138 8.088 11.909 -11.505 1.00 0.22 N ATOM 2265 CA SER A 138 9.166 12.575 -10.760 1.00 3.23 C ATOM 2266 C SER A 138 10.206 11.566 -10.250 1.00 52.22 C ATOM 2267 O SER A 138 11.398 11.871 -10.176 1.00 51.23 O ATOM 2268 CB SER A 138 8.596 13.365 -9.573 1.00 24.21 C ATOM 2269 OG SER A 138 7.800 14.459 -10.004 1.00 53.41 O ATOM 0 H SER A 138 7.158 12.053 -11.112 1.00 0.22 H new ATOM 0 HA SER A 138 9.659 13.261 -11.449 1.00 3.23 H new ATOM 0 HB2 SER A 138 7.996 12.702 -8.949 1.00 24.21 H new ATOM 0 HB3 SER A 138 9.414 13.732 -8.954 1.00 24.21 H new ATOM 0 HG SER A 138 6.910 14.136 -10.258 1.00 53.41 H new ATOM 2275 N ASN A 139 9.747 10.369 -9.877 1.00 3.20 N ATOM 2276 CA ASN A 139 10.656 9.290 -9.459 1.00 23.41 C ATOM 2277 C ASN A 139 11.392 8.685 -10.665 1.00 41.33 C ATOM 2278 O ASN A 139 12.550 8.276 -10.559 1.00 54.13 O ATOM 2279 CB ASN A 139 9.895 8.186 -8.712 1.00 15.02 C ATOM 2280 CG ASN A 139 9.493 8.579 -7.299 1.00 74.11 C ATOM 2281 OD1 ASN A 139 9.476 7.747 -6.400 1.00 32.23 O ATOM 2282 ND2 ASN A 139 9.155 9.835 -7.085 1.00 44.23 N ATOM 0 H ASN A 139 8.758 10.120 -9.855 1.00 3.20 H new ATOM 0 HA ASN A 139 11.391 9.730 -8.785 1.00 23.41 H new ATOM 0 HB2 ASN A 139 9.000 7.926 -9.277 1.00 15.02 H new ATOM 0 HB3 ASN A 139 10.517 7.292 -8.669 1.00 15.02 H new ATOM 0 HD21 ASN A 139 8.870 10.135 -6.153 1.00 44.23 H new ATOM 0 HD22 ASN A 139 9.178 10.507 -7.852 1.00 44.23 H new ATOM 2289 N ARG A 140 10.711 8.633 -11.810 1.00 64.40 N ATOM 2290 CA ARG A 140 11.300 8.097 -13.045 1.00 11.35 C ATOM 2291 C ARG A 140 12.489 8.945 -13.523 1.00 54.21 C ATOM 2292 O ARG A 140 13.517 8.409 -13.946 1.00 42.34 O ATOM 2293 CB ARG A 140 10.237 8.014 -14.155 1.00 64.03 C ATOM 2294 CG ARG A 140 9.146 6.977 -13.895 1.00 31.22 C ATOM 2295 CD ARG A 140 8.110 6.940 -15.017 1.00 43.11 C ATOM 2296 NE ARG A 140 7.133 5.870 -14.816 1.00 63.44 N ATOM 2297 CZ ARG A 140 5.934 5.849 -15.335 1.00 42.54 C ATOM 2298 NH1 ARG A 140 5.522 6.807 -16.103 1.00 1.15 N ATOM 2299 NH2 ARG A 140 5.152 4.849 -15.091 1.00 35.31 N ATOM 0 H ARG A 140 9.749 8.955 -11.912 1.00 64.40 H new ATOM 0 HA ARG A 140 11.669 7.096 -12.822 1.00 11.35 H new ATOM 0 HB2 ARG A 140 9.773 8.993 -14.273 1.00 64.03 H new ATOM 0 HB3 ARG A 140 10.730 7.779 -15.099 1.00 64.03 H new ATOM 0 HG2 ARG A 140 9.600 5.992 -13.789 1.00 31.22 H new ATOM 0 HG3 ARG A 140 8.650 7.202 -12.951 1.00 31.22 H new ATOM 0 HD2 ARG A 140 7.594 7.899 -15.068 1.00 43.11 H new ATOM 0 HD3 ARG A 140 8.614 6.798 -15.973 1.00 43.11 H new ATOM 0 HE ARG A 140 7.408 5.083 -14.228 1.00 63.44 H new ATOM 0 HH11 ARG A 140 6.137 7.594 -16.311 1.00 1.15 H new ATOM 0 HH12 ARG A 140 4.583 6.775 -16.500 1.00 1.15 H new ATOM 0 HH21 ARG A 140 5.472 4.084 -14.497 1.00 35.31 H new ATOM 0 HH22 ARG A 140 4.215 4.825 -15.492 1.00 35.31 H new ATOM 2313 N ARG A 141 12.349 10.269 -13.443 1.00 71.02 N ATOM 2314 CA ARG A 141 13.405 11.181 -13.902 1.00 31.34 C ATOM 2315 C ARG A 141 14.683 11.048 -13.047 1.00 71.35 C ATOM 2316 O ARG A 141 15.766 11.463 -13.464 1.00 70.34 O ATOM 2317 CB ARG A 141 12.905 12.635 -13.903 1.00 13.43 C ATOM 2318 CG ARG A 141 13.789 13.580 -14.719 1.00 34.44 C ATOM 2319 CD ARG A 141 13.196 14.983 -14.823 1.00 14.44 C ATOM 2320 NE ARG A 141 13.922 15.811 -15.790 1.00 3.22 N ATOM 2321 CZ ARG A 141 13.879 17.116 -15.822 1.00 31.12 C ATOM 2322 NH1 ARG A 141 13.247 17.779 -14.909 1.00 71.22 N ATOM 2323 NH2 ARG A 141 14.496 17.763 -16.756 1.00 64.53 N ATOM 0 H ARG A 141 11.522 10.734 -13.068 1.00 71.02 H new ATOM 0 HA ARG A 141 13.660 10.899 -14.924 1.00 31.34 H new ATOM 0 HB2 ARG A 141 11.891 12.663 -14.302 1.00 13.43 H new ATOM 0 HB3 ARG A 141 12.853 12.994 -12.875 1.00 13.43 H new ATOM 0 HG2 ARG A 141 14.776 13.638 -14.260 1.00 34.44 H new ATOM 0 HG3 ARG A 141 13.927 13.171 -15.720 1.00 34.44 H new ATOM 0 HD2 ARG A 141 12.149 14.914 -15.118 1.00 14.44 H new ATOM 0 HD3 ARG A 141 13.221 15.461 -13.844 1.00 14.44 H new ATOM 0 HE ARG A 141 14.499 15.337 -16.484 1.00 3.22 H new ATOM 0 HH11 ARG A 141 12.775 17.283 -14.153 1.00 71.22 H new ATOM 0 HH12 ARG A 141 13.221 18.798 -14.945 1.00 71.22 H new ATOM 0 HH21 ARG A 141 15.018 17.254 -17.470 1.00 64.53 H new ATOM 0 HH22 ARG A 141 14.461 18.782 -16.779 1.00 64.53 H new ATOM 2337 N GLU A 142 14.551 10.471 -11.851 1.00 73.43 N ATOM 2338 CA GLU A 142 15.715 10.176 -11.008 1.00 62.25 C ATOM 2339 C GLU A 142 16.382 8.857 -11.431 1.00 55.14 C ATOM 2340 O GLU A 142 16.095 7.789 -10.884 1.00 71.23 O ATOM 2341 CB GLU A 142 15.329 10.123 -9.520 1.00 55.23 C ATOM 2342 CG GLU A 142 14.961 11.479 -8.924 1.00 23.43 C ATOM 2343 CD GLU A 142 14.754 11.425 -7.418 1.00 21.33 C ATOM 2344 OE1 GLU A 142 15.677 10.976 -6.704 1.00 12.22 O ATOM 2345 OE2 GLU A 142 13.679 11.842 -6.941 1.00 21.11 O ATOM 0 H GLU A 142 13.656 10.199 -11.445 1.00 73.43 H new ATOM 0 HA GLU A 142 16.431 10.986 -11.146 1.00 62.25 H new ATOM 0 HB2 GLU A 142 14.485 9.443 -9.398 1.00 55.23 H new ATOM 0 HB3 GLU A 142 16.161 9.703 -8.954 1.00 55.23 H new ATOM 0 HG2 GLU A 142 15.749 12.197 -9.152 1.00 23.43 H new ATOM 0 HG3 GLU A 142 14.050 11.844 -9.398 1.00 23.43 H new ATOM 2352 N GLY A 143 17.262 8.947 -12.423 1.00 14.12 N ATOM 2353 CA GLY A 143 17.962 7.775 -12.932 1.00 45.33 C ATOM 2354 C GLY A 143 19.142 8.148 -13.827 1.00 54.21 C ATOM 2355 O GLY A 143 20.285 7.777 -13.551 1.00 43.34 O ATOM 0 H GLY A 143 17.507 9.820 -12.890 1.00 14.12 H new ATOM 0 HA2 GLY A 143 18.319 7.176 -12.095 1.00 45.33 H new ATOM 0 HA3 GLY A 143 17.265 7.154 -13.494 1.00 45.33 H new ATOM 2359 N ARG A 144 18.863 8.890 -14.898 1.00 55.53 N ATOM 2360 CA ARG A 144 19.909 9.355 -15.819 1.00 14.51 C ATOM 2361 C ARG A 144 19.941 10.892 -15.878 1.00 54.45 C ATOM 2362 O ARG A 144 19.138 11.561 -15.231 1.00 11.13 O ATOM 2363 CB ARG A 144 19.672 8.781 -17.224 1.00 50.22 C ATOM 2364 CG ARG A 144 18.445 9.357 -17.928 1.00 3.14 C ATOM 2365 CD ARG A 144 18.234 8.737 -19.306 1.00 64.42 C ATOM 2366 NE ARG A 144 19.479 8.665 -20.074 1.00 13.23 N ATOM 2367 CZ ARG A 144 19.965 9.636 -20.799 1.00 74.34 C ATOM 2368 NH1 ARG A 144 19.364 10.781 -20.868 1.00 44.04 N ATOM 2369 NH2 ARG A 144 21.064 9.453 -21.452 1.00 51.42 N ATOM 0 H ARG A 144 17.920 9.185 -15.153 1.00 55.53 H new ATOM 0 HA ARG A 144 20.872 9.003 -15.448 1.00 14.51 H new ATOM 0 HB2 ARG A 144 20.553 8.971 -17.837 1.00 50.22 H new ATOM 0 HB3 ARG A 144 19.562 7.699 -17.150 1.00 50.22 H new ATOM 0 HG2 ARG A 144 17.561 9.186 -17.314 1.00 3.14 H new ATOM 0 HG3 ARG A 144 18.558 10.436 -18.029 1.00 3.14 H new ATOM 0 HD2 ARG A 144 17.820 7.735 -19.193 1.00 64.42 H new ATOM 0 HD3 ARG A 144 17.501 9.324 -19.859 1.00 64.42 H new ATOM 0 HE ARG A 144 20.005 7.792 -20.040 1.00 13.23 H new ATOM 0 HH11 ARG A 144 18.498 10.934 -20.351 1.00 44.04 H new ATOM 0 HH12 ARG A 144 19.757 11.530 -21.439 1.00 44.04 H new ATOM 0 HH21 ARG A 144 21.545 8.555 -21.399 1.00 51.42 H new ATOM 0 HH22 ARG A 144 21.451 10.206 -22.021 1.00 51.42 H new ATOM 2383 N ARG A 145 20.873 11.446 -16.651 1.00 44.01 N ATOM 2384 CA ARG A 145 20.987 12.908 -16.799 1.00 33.41 C ATOM 2385 C ARG A 145 20.123 13.427 -17.971 1.00 40.33 C ATOM 2386 O ARG A 145 18.918 13.689 -17.760 1.00 38.68 O ATOM 2387 CB ARG A 145 22.460 13.307 -17.001 1.00 14.30 C ATOM 2388 CG ARG A 145 23.380 12.878 -15.860 1.00 22.44 C ATOM 2389 CD ARG A 145 24.827 13.300 -16.108 1.00 21.42 C ATOM 2390 NE ARG A 145 24.971 14.753 -16.215 1.00 33.22 N ATOM 2391 CZ ARG A 145 26.117 15.380 -16.274 1.00 32.32 C ATOM 2392 NH1 ARG A 145 27.235 14.725 -16.269 1.00 34.02 N ATOM 2393 NH2 ARG A 145 26.141 16.672 -16.358 1.00 33.13 N ATOM 2394 OXT ARG A 145 20.653 13.572 -19.097 1.00 38.68 O ATOM 0 H ARG A 145 21.560 10.914 -17.185 1.00 44.01 H new ATOM 0 HA ARG A 145 20.615 13.369 -15.884 1.00 33.41 H new ATOM 0 HB2 ARG A 145 22.821 12.867 -17.931 1.00 14.30 H new ATOM 0 HB3 ARG A 145 22.520 14.389 -17.116 1.00 14.30 H new ATOM 0 HG2 ARG A 145 23.029 13.316 -14.926 1.00 22.44 H new ATOM 0 HG3 ARG A 145 23.332 11.795 -15.742 1.00 22.44 H new ATOM 0 HD2 ARG A 145 25.454 12.934 -15.295 1.00 21.42 H new ATOM 0 HD3 ARG A 145 25.187 12.833 -17.024 1.00 21.42 H new ATOM 0 HE ARG A 145 24.120 15.314 -16.246 1.00 33.22 H new ATOM 0 HH11 ARG A 145 27.229 13.706 -16.219 1.00 34.02 H new ATOM 0 HH12 ARG A 145 28.121 15.228 -16.316 1.00 34.02 H new ATOM 0 HH21 ARG A 145 25.267 17.198 -16.378 1.00 33.13 H new ATOM 0 HH22 ARG A 145 27.034 17.164 -16.404 1.00 33.13 H new TER 2408 ARG A 145