USER MOD reduce.3.24.130724 H: found=0, std=0, add=1091, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1081 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 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 57 THR OG1 : rot 69:sc= 0.96 USER MOD Set 2.1: A 28 HIS : no HD1:sc= -1.98 X(o=-4.2,f=-4.2) USER MOD Set 2.2: A 29 ASN : amide:sc= -2.23! C(o=-4.2!,f=-7.7!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.119 X(o=-0.12,f=-0.0085) USER MOD Single : A 4 HIS : no HD1:sc= -0.0107 X(o=-0.011,f=-0.45) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 6 HIS : no HD1:sc= -0.0894 X(o=-0.089,f=-0.19) USER MOD Single : A 7 HIS : no HD1:sc= -0.0982 K(o=-0.098,f=-0.69) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc=-0.00375 X(o=-0.0037,f=-0.23) USER MOD Single : A 16 THR OG1 : rot 180:sc=-0.00412 USER MOD Single : A 17 GLN : amide:sc= -0.894 X(o=-0.89,f=-0.86) USER MOD Single : A 21 SER OG : rot -52:sc= 0.119 USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 CYS SG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -20:sc= -0.639 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 MET CE :methyl -170:sc= -5.31! (180deg=-6.18!) USER MOD Single : A 70 GLN : amide:sc= -0.751 K(o=-0.75,f=-0.23) USER MOD Single : A 71 MET CE :methyl 157:sc= -1.46 (180deg=-2.72!) USER MOD Single : A 74 SER OG : rot 131:sc= 0.312 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 180:sc= -0.713 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl -157:sc= 0 (180deg=-0.733) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= -0.0104 X(o=-0.01,f=-0.01) USER MOD Single : A 112 MET CE :methyl -151:sc= -0.313 (180deg=-1.33!) USER MOD Single : A 113 ASN : amide:sc= 0.0706 K(o=0.071,f=-5.9!) USER MOD Single : A 119 THR OG1 : rot 24:sc= -0.884! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 CYS SG : rot 180:sc= -3.17! USER MOD Single : A 131 THR OG1 : rot 2:sc= -0.305 USER MOD Single : A 133 GLN : amide:sc= 0.0917 X(o=0.092,f=-0.37) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 21.149 -6.572 -3.481 1.00 14.11 N ATOM 2 CA MET A 1 21.508 -5.383 -4.246 1.00 0.41 C ATOM 3 C MET A 1 20.568 -5.197 -5.434 1.00 11.33 C ATOM 4 O MET A 1 20.981 -5.303 -6.587 1.00 23.14 O ATOM 5 CB MET A 1 22.954 -5.484 -4.737 1.00 35.24 C ATOM 6 CG MET A 1 23.499 -4.178 -5.293 1.00 50.10 C ATOM 7 SD MET A 1 23.696 -2.912 -4.024 1.00 13.43 S ATOM 8 CE MET A 1 25.479 -2.755 -3.977 1.00 25.01 C ATOM 0 H1 MET A 1 21.802 -6.678 -2.678 1.00 14.11 H new ATOM 0 H2 MET A 1 20.176 -6.476 -3.126 1.00 14.11 H new ATOM 0 H3 MET A 1 21.213 -7.411 -4.093 1.00 14.11 H new ATOM 0 HA MET A 1 21.414 -4.517 -3.591 1.00 0.41 H new ATOM 0 HB2 MET A 1 23.587 -5.811 -3.912 1.00 35.24 H new ATOM 0 HB3 MET A 1 23.014 -6.251 -5.509 1.00 35.24 H new ATOM 0 HG2 MET A 1 24.462 -4.364 -5.768 1.00 50.10 H new ATOM 0 HG3 MET A 1 22.827 -3.809 -6.068 1.00 50.10 H new ATOM 0 HE1 MET A 1 25.759 -2.006 -3.236 1.00 25.01 H new ATOM 0 HE2 MET A 1 25.922 -3.714 -3.708 1.00 25.01 H new ATOM 0 HE3 MET A 1 25.843 -2.449 -4.958 1.00 25.01 H new ATOM 18 N ALA A 2 19.302 -4.917 -5.141 1.00 20.14 N ATOM 19 CA ALA A 2 18.304 -4.714 -6.184 1.00 64.33 C ATOM 20 C ALA A 2 17.836 -3.263 -6.220 1.00 53.03 C ATOM 21 O ALA A 2 17.541 -2.670 -5.182 1.00 34.44 O ATOM 22 CB ALA A 2 17.122 -5.647 -5.972 1.00 34.41 C ATOM 0 H ALA A 2 18.944 -4.826 -4.190 1.00 20.14 H new ATOM 0 HA ALA A 2 18.766 -4.944 -7.144 1.00 64.33 H new ATOM 0 HB1 ALA A 2 16.385 -5.484 -6.758 1.00 34.41 H new ATOM 0 HB2 ALA A 2 17.465 -6.681 -6.004 1.00 34.41 H new ATOM 0 HB3 ALA A 2 16.668 -5.445 -5.002 1.00 34.41 H new ATOM 28 N HIS A 3 17.770 -2.697 -7.421 1.00 75.03 N ATOM 29 CA HIS A 3 17.337 -1.314 -7.592 1.00 70.12 C ATOM 30 C HIS A 3 15.954 -1.254 -8.233 1.00 41.14 C ATOM 31 O HIS A 3 15.737 -1.792 -9.319 1.00 75.13 O ATOM 32 CB HIS A 3 18.344 -0.545 -8.449 1.00 30.14 C ATOM 33 CG HIS A 3 18.282 0.939 -8.257 1.00 53.05 C ATOM 34 ND1 HIS A 3 18.542 1.839 -9.268 1.00 13.12 N ATOM 35 CD2 HIS A 3 17.987 1.679 -7.163 1.00 72.25 C ATOM 36 CE1 HIS A 3 18.411 3.069 -8.804 1.00 34.32 C ATOM 37 NE2 HIS A 3 18.074 2.999 -7.528 1.00 32.54 N ATOM 0 H HIS A 3 18.011 -3.174 -8.290 1.00 75.03 H new ATOM 0 HA HIS A 3 17.282 -0.851 -6.607 1.00 70.12 H new ATOM 0 HB2 HIS A 3 19.350 -0.892 -8.213 1.00 30.14 H new ATOM 0 HB3 HIS A 3 18.166 -0.775 -9.499 1.00 30.14 H new ATOM 0 HD2 HIS A 3 17.731 1.301 -6.184 1.00 72.25 H new ATOM 0 HE1 HIS A 3 18.555 3.977 -9.371 1.00 34.32 H new ATOM 0 HE2 HIS A 3 17.906 3.796 -6.914 1.00 32.54 H new ATOM 45 N HIS A 4 15.021 -0.595 -7.553 1.00 53.32 N ATOM 46 CA HIS A 4 13.658 -0.463 -8.055 1.00 4.40 C ATOM 47 C HIS A 4 13.268 1.005 -8.189 1.00 44.32 C ATOM 48 O HIS A 4 13.895 1.881 -7.595 1.00 31.15 O ATOM 49 CB HIS A 4 12.678 -1.181 -7.127 1.00 51.22 C ATOM 50 CG HIS A 4 12.778 -0.744 -5.697 1.00 24.05 C ATOM 51 ND1 HIS A 4 13.749 -1.208 -4.834 1.00 3.33 N ATOM 52 CD2 HIS A 4 12.022 0.120 -4.981 1.00 1.33 C ATOM 53 CE1 HIS A 4 13.585 -0.648 -3.649 1.00 10.02 C ATOM 54 NE2 HIS A 4 12.543 0.162 -3.712 1.00 71.53 N ATOM 0 H HIS A 4 15.184 -0.144 -6.653 1.00 53.32 H new ATOM 0 HA HIS A 4 13.615 -0.923 -9.042 1.00 4.40 H new ATOM 0 HB2 HIS A 4 11.662 -1.008 -7.481 1.00 51.22 H new ATOM 0 HB3 HIS A 4 12.857 -2.255 -7.184 1.00 51.22 H new ATOM 0 HD2 HIS A 4 11.167 0.674 -5.341 1.00 1.33 H new ATOM 0 HE1 HIS A 4 14.198 -0.822 -2.777 1.00 10.02 H new ATOM 0 HE2 HIS A 4 12.184 0.727 -2.942 1.00 71.53 H new ATOM 62 N HIS A 5 12.226 1.267 -8.974 1.00 42.14 N ATOM 63 CA HIS A 5 11.753 2.629 -9.186 1.00 73.02 C ATOM 64 C HIS A 5 10.428 2.632 -9.944 1.00 23.22 C ATOM 65 O HIS A 5 10.229 1.845 -10.871 1.00 2.10 O ATOM 66 CB HIS A 5 12.795 3.441 -9.956 1.00 61.33 C ATOM 67 CG HIS A 5 12.678 4.919 -9.746 1.00 35.33 C ATOM 68 ND1 HIS A 5 12.954 5.532 -8.542 1.00 11.40 N ATOM 69 CD2 HIS A 5 12.313 5.907 -10.596 1.00 2.35 C ATOM 70 CE1 HIS A 5 12.762 6.834 -8.661 1.00 74.34 C ATOM 71 NE2 HIS A 5 12.374 7.088 -9.898 1.00 13.25 N ATOM 0 H HIS A 5 11.695 0.553 -9.473 1.00 42.14 H new ATOM 0 HA HIS A 5 11.595 3.088 -8.210 1.00 73.02 H new ATOM 0 HB2 HIS A 5 13.791 3.117 -9.654 1.00 61.33 H new ATOM 0 HB3 HIS A 5 12.698 3.225 -11.020 1.00 61.33 H new ATOM 0 HD2 HIS A 5 12.027 5.789 -11.631 1.00 2.35 H new ATOM 0 HE1 HIS A 5 12.899 7.566 -7.879 1.00 74.34 H new ATOM 0 HE2 HIS A 5 12.155 8.011 -10.273 1.00 13.25 H new ATOM 79 N HIS A 6 9.524 3.520 -9.542 1.00 62.44 N ATOM 80 CA HIS A 6 8.219 3.625 -10.183 1.00 3.21 C ATOM 81 C HIS A 6 8.201 4.763 -11.199 1.00 33.40 C ATOM 82 O HIS A 6 9.118 5.583 -11.243 1.00 1.15 O ATOM 83 CB HIS A 6 7.128 3.845 -9.134 1.00 15.32 C ATOM 84 CG HIS A 6 5.785 3.327 -9.548 1.00 11.40 C ATOM 85 ND1 HIS A 6 5.549 2.002 -9.844 1.00 41.44 N ATOM 86 CD2 HIS A 6 4.603 3.964 -9.713 1.00 53.43 C ATOM 87 CE1 HIS A 6 4.279 1.846 -10.175 1.00 73.25 C ATOM 88 NE2 HIS A 6 3.683 3.022 -10.102 1.00 21.13 N ATOM 0 H HIS A 6 9.672 4.177 -8.776 1.00 62.44 H new ATOM 0 HA HIS A 6 8.025 2.690 -10.709 1.00 3.21 H new ATOM 0 HB2 HIS A 6 7.425 3.358 -8.205 1.00 15.32 H new ATOM 0 HB3 HIS A 6 7.048 4.911 -8.924 1.00 15.32 H new ATOM 0 HD2 HIS A 6 4.418 5.018 -9.566 1.00 53.43 H new ATOM 0 HE1 HIS A 6 3.809 0.915 -10.457 1.00 73.25 H new ATOM 0 HE2 HIS A 6 2.699 3.201 -10.302 1.00 21.13 H new ATOM 96 N HIS A 7 7.152 4.807 -12.014 1.00 21.35 N ATOM 97 CA HIS A 7 7.015 5.845 -13.030 1.00 3.20 C ATOM 98 C HIS A 7 5.674 6.559 -12.900 1.00 70.01 C ATOM 99 O HIS A 7 4.683 5.968 -12.470 1.00 31.54 O ATOM 100 CB HIS A 7 7.151 5.241 -14.428 1.00 21.42 C ATOM 101 CG HIS A 7 6.202 4.113 -14.688 1.00 51.32 C ATOM 102 ND1 HIS A 7 4.858 4.302 -14.936 1.00 51.24 N ATOM 103 CD2 HIS A 7 6.407 2.777 -14.740 1.00 5.24 C ATOM 104 CE1 HIS A 7 4.278 3.131 -15.127 1.00 71.14 C ATOM 105 NE2 HIS A 7 5.197 2.188 -15.014 1.00 2.30 N ATOM 0 H HIS A 7 6.384 4.136 -11.991 1.00 21.35 H new ATOM 0 HA HIS A 7 7.811 6.574 -12.878 1.00 3.20 H new ATOM 0 HB2 HIS A 7 6.986 6.022 -15.170 1.00 21.42 H new ATOM 0 HB3 HIS A 7 8.172 4.884 -14.563 1.00 21.42 H new ATOM 0 HD2 HIS A 7 7.348 2.268 -14.593 1.00 5.24 H new ATOM 0 HE1 HIS A 7 3.231 2.971 -15.339 1.00 71.14 H new ATOM 0 HE2 HIS A 7 5.034 1.186 -15.114 1.00 2.30 H new ATOM 113 N HIS A 8 5.650 7.835 -13.273 1.00 32.25 N ATOM 114 CA HIS A 8 4.429 8.631 -13.198 1.00 13.52 C ATOM 115 C HIS A 8 4.019 9.129 -14.581 1.00 41.00 C ATOM 116 O HIS A 8 4.279 10.276 -14.939 1.00 11.01 O ATOM 117 CB HIS A 8 4.626 9.817 -12.253 1.00 11.14 C ATOM 118 CG HIS A 8 3.345 10.480 -11.850 1.00 15.44 C ATOM 119 ND1 HIS A 8 3.081 11.812 -12.086 1.00 34.22 N ATOM 120 CD2 HIS A 8 2.252 9.986 -11.224 1.00 32.33 C ATOM 121 CE1 HIS A 8 1.880 12.110 -11.621 1.00 24.33 C ATOM 122 NE2 HIS A 8 1.355 11.019 -11.094 1.00 25.30 N ATOM 0 H HIS A 8 6.461 8.340 -13.630 1.00 32.25 H new ATOM 0 HA HIS A 8 3.633 7.995 -12.810 1.00 13.52 H new ATOM 0 HB2 HIS A 8 5.146 9.476 -11.358 1.00 11.14 H new ATOM 0 HB3 HIS A 8 5.270 10.552 -12.735 1.00 11.14 H new ATOM 0 HD2 HIS A 8 2.111 8.969 -10.889 1.00 32.33 H new ATOM 0 HE1 HIS A 8 1.408 13.081 -11.665 1.00 24.33 H new ATOM 0 HE2 HIS A 8 0.434 10.954 -10.661 1.00 25.30 H new ATOM 130 N MET A 9 3.378 8.257 -15.351 1.00 15.12 N ATOM 131 CA MET A 9 2.932 8.609 -16.695 1.00 11.10 C ATOM 132 C MET A 9 1.986 7.549 -17.249 1.00 53.54 C ATOM 133 O MET A 9 2.052 6.382 -16.864 1.00 71.24 O ATOM 134 CB MET A 9 4.133 8.776 -17.627 1.00 52.23 C ATOM 135 CG MET A 9 4.861 7.473 -17.918 1.00 71.35 C ATOM 136 SD MET A 9 6.461 7.734 -18.710 1.00 35.02 S ATOM 137 CE MET A 9 6.620 6.221 -19.655 1.00 30.03 C ATOM 0 H MET A 9 3.156 7.302 -15.069 1.00 15.12 H new ATOM 0 HA MET A 9 2.394 9.555 -16.636 1.00 11.10 H new ATOM 0 HB2 MET A 9 3.795 9.212 -18.567 1.00 52.23 H new ATOM 0 HB3 MET A 9 4.833 9.482 -17.181 1.00 52.23 H new ATOM 0 HG2 MET A 9 5.006 6.926 -16.986 1.00 71.35 H new ATOM 0 HG3 MET A 9 4.239 6.849 -18.560 1.00 71.35 H new ATOM 0 HE1 MET A 9 7.563 6.231 -20.202 1.00 30.03 H new ATOM 0 HE2 MET A 9 6.602 5.366 -18.979 1.00 30.03 H new ATOM 0 HE3 MET A 9 5.792 6.143 -20.360 1.00 30.03 H new ATOM 147 N GLY A 10 1.106 7.962 -18.156 1.00 22.32 N ATOM 148 CA GLY A 10 0.159 7.035 -18.748 1.00 13.32 C ATOM 149 C GLY A 10 -1.065 7.733 -19.305 1.00 41.13 C ATOM 150 O GLY A 10 -1.729 8.496 -18.603 1.00 2.24 O ATOM 0 H GLY A 10 1.032 8.922 -18.492 1.00 22.32 H new ATOM 0 HA2 GLY A 10 0.651 6.479 -19.546 1.00 13.32 H new ATOM 0 HA3 GLY A 10 -0.151 6.308 -17.997 1.00 13.32 H new ATOM 154 N THR A 11 -1.365 7.475 -20.575 1.00 2.12 N ATOM 155 CA THR A 11 -2.515 8.087 -21.228 1.00 1.32 C ATOM 156 C THR A 11 -2.767 7.464 -22.596 1.00 12.03 C ATOM 157 O THR A 11 -1.833 7.035 -23.276 1.00 20.13 O ATOM 158 CB THR A 11 -2.325 9.606 -21.395 1.00 23.24 C ATOM 159 OG1 THR A 11 -3.542 10.205 -21.854 1.00 33.04 O ATOM 160 CG2 THR A 11 -1.203 9.906 -22.378 1.00 44.12 C ATOM 0 H THR A 11 -0.827 6.846 -21.171 1.00 2.12 H new ATOM 0 HA THR A 11 -3.376 7.905 -20.585 1.00 1.32 H new ATOM 0 HB THR A 11 -2.058 10.025 -20.425 1.00 23.24 H new ATOM 0 HG1 THR A 11 -3.413 11.171 -21.956 1.00 33.04 H new ATOM 0 HG21 THR A 11 -1.087 10.985 -22.480 1.00 44.12 H new ATOM 0 HG22 THR A 11 -0.272 9.474 -22.010 1.00 44.12 H new ATOM 0 HG23 THR A 11 -1.445 9.474 -23.349 1.00 44.12 H new ATOM 168 N LEU A 12 -4.032 7.417 -22.996 1.00 40.05 N ATOM 169 CA LEU A 12 -4.407 6.846 -24.286 1.00 42.05 C ATOM 170 C LEU A 12 -5.671 7.506 -24.827 1.00 71.42 C ATOM 171 O LEU A 12 -6.273 8.351 -24.166 1.00 14.42 O ATOM 172 CB LEU A 12 -4.621 5.338 -24.155 1.00 25.43 C ATOM 173 CG LEU A 12 -3.383 4.464 -24.357 1.00 41.34 C ATOM 174 CD1 LEU A 12 -3.718 2.999 -24.121 1.00 10.32 C ATOM 175 CD2 LEU A 12 -2.812 4.663 -25.753 1.00 65.42 C ATOM 0 H LEU A 12 -4.816 7.767 -22.446 1.00 40.05 H new ATOM 0 HA LEU A 12 -3.594 7.032 -24.988 1.00 42.05 H new ATOM 0 HB2 LEU A 12 -5.028 5.134 -23.164 1.00 25.43 H new ATOM 0 HB3 LEU A 12 -5.377 5.034 -24.879 1.00 25.43 H new ATOM 0 HG LEU A 12 -2.628 4.764 -23.630 1.00 41.34 H new ATOM 0 HD11 LEU A 12 -2.824 2.393 -24.269 1.00 10.32 H new ATOM 0 HD12 LEU A 12 -4.080 2.868 -23.101 1.00 10.32 H new ATOM 0 HD13 LEU A 12 -4.490 2.685 -24.823 1.00 10.32 H new ATOM 0 HD21 LEU A 12 -1.931 4.033 -25.879 1.00 65.42 H new ATOM 0 HD22 LEU A 12 -3.562 4.391 -26.495 1.00 65.42 H new ATOM 0 HD23 LEU A 12 -2.533 5.708 -25.886 1.00 65.42 H new ATOM 187 N GLU A 13 -6.068 7.113 -26.033 1.00 64.32 N ATOM 188 CA GLU A 13 -7.262 7.666 -26.662 1.00 63.24 C ATOM 189 C GLU A 13 -7.913 6.642 -27.587 1.00 42.35 C ATOM 190 O GLU A 13 -7.443 5.510 -27.707 1.00 51.25 O ATOM 191 CB GLU A 13 -6.911 8.930 -27.449 1.00 71.44 C ATOM 192 CG GLU A 13 -6.528 10.108 -26.568 1.00 70.34 C ATOM 193 CD GLU A 13 -7.650 10.534 -25.642 1.00 62.42 C ATOM 194 OE1 GLU A 13 -8.797 10.658 -26.119 1.00 40.24 O ATOM 195 OE2 GLU A 13 -7.381 10.744 -24.441 1.00 75.13 O ATOM 0 H GLU A 13 -5.581 6.414 -26.594 1.00 64.32 H new ATOM 0 HA GLU A 13 -7.971 7.922 -25.875 1.00 63.24 H new ATOM 0 HB2 GLU A 13 -6.085 8.709 -28.125 1.00 71.44 H new ATOM 0 HB3 GLU A 13 -7.763 9.211 -28.067 1.00 71.44 H new ATOM 0 HG2 GLU A 13 -5.653 9.843 -25.974 1.00 70.34 H new ATOM 0 HG3 GLU A 13 -6.243 10.950 -27.198 1.00 70.34 H new ATOM 202 N ALA A 14 -8.998 7.048 -28.240 1.00 24.20 N ATOM 203 CA ALA A 14 -9.713 6.168 -29.155 1.00 54.42 C ATOM 204 C ALA A 14 -10.716 6.950 -29.996 1.00 34.34 C ATOM 205 O ALA A 14 -11.537 7.697 -29.463 1.00 71.34 O ATOM 206 CB ALA A 14 -10.416 5.063 -28.382 1.00 13.24 C ATOM 0 H ALA A 14 -9.400 7.981 -28.152 1.00 24.20 H new ATOM 0 HA ALA A 14 -8.986 5.717 -29.830 1.00 54.42 H new ATOM 0 HB1 ALA A 14 -10.946 4.413 -29.078 1.00 13.24 H new ATOM 0 HB2 ALA A 14 -9.679 4.480 -27.830 1.00 13.24 H new ATOM 0 HB3 ALA A 14 -11.127 5.504 -27.683 1.00 13.24 H new ATOM 212 N GLN A 15 -10.644 6.773 -31.311 1.00 3.41 N ATOM 213 CA GLN A 15 -11.546 7.464 -32.224 1.00 11.45 C ATOM 214 C GLN A 15 -11.634 6.732 -33.560 1.00 21.34 C ATOM 215 O GLN A 15 -10.649 6.630 -34.291 1.00 54.22 O ATOM 216 CB GLN A 15 -11.077 8.902 -32.448 1.00 42.22 C ATOM 217 CG GLN A 15 -12.190 9.847 -32.871 1.00 5.13 C ATOM 218 CD GLN A 15 -13.057 10.285 -31.707 1.00 61.50 C ATOM 219 OE1 GLN A 15 -12.552 10.714 -30.670 1.00 61.20 O ATOM 220 NE2 GLN A 15 -14.370 10.179 -31.874 1.00 11.31 N ATOM 0 H GLN A 15 -9.971 6.157 -31.768 1.00 3.41 H new ATOM 0 HA GLN A 15 -12.538 7.479 -31.772 1.00 11.45 H new ATOM 0 HB2 GLN A 15 -10.625 9.275 -31.529 1.00 42.22 H new ATOM 0 HB3 GLN A 15 -10.298 8.907 -33.211 1.00 42.22 H new ATOM 0 HG2 GLN A 15 -11.754 10.726 -33.346 1.00 5.13 H new ATOM 0 HG3 GLN A 15 -12.813 9.357 -33.619 1.00 5.13 H new ATOM 0 HE21 GLN A 15 -14.745 9.818 -32.751 1.00 11.31 H new ATOM 0 HE22 GLN A 15 -15.004 10.459 -31.125 1.00 11.31 H new ATOM 229 N THR A 16 -12.822 6.223 -33.873 1.00 1.24 N ATOM 230 CA THR A 16 -13.039 5.499 -35.119 1.00 24.45 C ATOM 231 C THR A 16 -14.405 5.821 -35.711 1.00 0.20 C ATOM 232 O THR A 16 -15.383 5.991 -34.983 1.00 52.30 O ATOM 233 CB THR A 16 -12.929 3.976 -34.910 1.00 11.05 C ATOM 234 OG1 THR A 16 -11.880 3.684 -33.981 1.00 40.14 O ATOM 235 CG2 THR A 16 -12.656 3.268 -36.229 1.00 23.52 C ATOM 0 H THR A 16 -13.649 6.299 -33.280 1.00 1.24 H new ATOM 0 HA THR A 16 -12.261 5.821 -35.811 1.00 24.45 H new ATOM 0 HB THR A 16 -13.878 3.616 -34.511 1.00 11.05 H new ATOM 0 HG1 THR A 16 -11.817 2.714 -33.852 1.00 40.14 H new ATOM 0 HG21 THR A 16 -12.582 2.194 -36.057 1.00 23.52 H new ATOM 0 HG22 THR A 16 -13.470 3.469 -36.925 1.00 23.52 H new ATOM 0 HG23 THR A 16 -11.720 3.633 -36.651 1.00 23.52 H new ATOM 243 N GLN A 17 -14.466 5.904 -37.036 1.00 0.33 N ATOM 244 CA GLN A 17 -15.715 6.206 -37.727 1.00 33.44 C ATOM 245 C GLN A 17 -15.554 6.057 -39.235 1.00 74.40 C ATOM 246 O GLN A 17 -14.809 6.806 -39.867 1.00 5.23 O ATOM 247 CB GLN A 17 -16.178 7.624 -37.389 1.00 55.45 C ATOM 248 CG GLN A 17 -17.688 7.796 -37.427 1.00 54.10 C ATOM 249 CD GLN A 17 -18.306 7.247 -38.698 1.00 42.14 C ATOM 250 OE1 GLN A 17 -19.003 6.233 -38.676 1.00 52.12 O ATOM 251 NE2 GLN A 17 -18.052 7.917 -39.817 1.00 64.32 N ATOM 0 H GLN A 17 -13.665 5.766 -37.653 1.00 0.33 H new ATOM 0 HA GLN A 17 -16.469 5.494 -37.390 1.00 33.44 H new ATOM 0 HB2 GLN A 17 -15.815 7.889 -36.396 1.00 55.45 H new ATOM 0 HB3 GLN A 17 -15.723 8.323 -38.091 1.00 55.45 H new ATOM 0 HG2 GLN A 17 -18.129 7.293 -36.566 1.00 54.10 H new ATOM 0 HG3 GLN A 17 -17.932 8.855 -37.337 1.00 54.10 H new ATOM 0 HE21 GLN A 17 -17.469 8.753 -39.789 1.00 64.32 H new ATOM 0 HE22 GLN A 17 -18.440 7.595 -40.704 1.00 64.32 H new ATOM 260 N GLY A 18 -16.256 5.084 -39.808 1.00 32.41 N ATOM 261 CA GLY A 18 -16.175 4.854 -41.239 1.00 72.22 C ATOM 262 C GLY A 18 -16.737 3.505 -41.642 1.00 75.22 C ATOM 263 O GLY A 18 -17.353 2.802 -40.842 1.00 22.24 O ATOM 0 H GLY A 18 -16.879 4.451 -39.307 1.00 32.41 H new ATOM 0 HA2 GLY A 18 -16.718 5.641 -41.762 1.00 72.22 H new ATOM 0 HA3 GLY A 18 -15.134 4.920 -41.556 1.00 72.22 H new ATOM 267 N PRO A 19 -16.525 3.127 -42.911 1.00 31.15 N ATOM 268 CA PRO A 19 -17.007 1.851 -43.448 1.00 51.55 C ATOM 269 C PRO A 19 -16.259 0.657 -42.864 1.00 53.44 C ATOM 270 O PRO A 19 -15.029 0.614 -42.877 1.00 74.23 O ATOM 271 CB PRO A 19 -16.732 1.971 -44.949 1.00 22.14 C ATOM 272 CG PRO A 19 -15.608 2.944 -45.052 1.00 41.32 C ATOM 273 CD PRO A 19 -15.797 3.916 -43.919 1.00 74.42 C ATOM 0 HA PRO A 19 -18.055 1.677 -43.205 1.00 51.55 H new ATOM 0 HB2 PRO A 19 -16.462 1.007 -45.380 1.00 22.14 H new ATOM 0 HB3 PRO A 19 -17.612 2.325 -45.486 1.00 22.14 H new ATOM 0 HG2 PRO A 19 -14.646 2.438 -44.976 1.00 41.32 H new ATOM 0 HG3 PRO A 19 -15.623 3.457 -46.013 1.00 41.32 H new ATOM 0 HD2 PRO A 19 -14.843 4.276 -43.535 1.00 74.42 H new ATOM 0 HD3 PRO A 19 -16.366 4.792 -44.231 1.00 74.42 H new ATOM 281 N GLY A 20 -17.010 -0.313 -42.351 1.00 22.01 N ATOM 282 CA GLY A 20 -16.401 -1.495 -41.769 1.00 51.04 C ATOM 283 C GLY A 20 -16.139 -2.578 -42.798 1.00 11.34 C ATOM 284 O GLY A 20 -17.008 -2.895 -43.610 1.00 0.44 O ATOM 0 H GLY A 20 -18.030 -0.301 -42.328 1.00 22.01 H new ATOM 0 HA2 GLY A 20 -15.462 -1.218 -41.290 1.00 51.04 H new ATOM 0 HA3 GLY A 20 -17.052 -1.889 -40.989 1.00 51.04 H new ATOM 288 N SER A 21 -14.937 -3.146 -42.764 1.00 35.52 N ATOM 289 CA SER A 21 -14.562 -4.196 -43.704 1.00 1.33 C ATOM 290 C SER A 21 -14.157 -5.466 -42.964 1.00 5.04 C ATOM 291 O SER A 21 -13.364 -6.263 -43.466 1.00 1.33 O ATOM 292 CB SER A 21 -13.413 -3.723 -44.597 1.00 40.35 C ATOM 293 OG SER A 21 -13.321 -4.512 -45.770 1.00 64.30 O ATOM 0 H SER A 21 -14.207 -2.897 -42.096 1.00 35.52 H new ATOM 0 HA SER A 21 -15.428 -4.420 -44.327 1.00 1.33 H new ATOM 0 HB2 SER A 21 -13.566 -2.678 -44.869 1.00 40.35 H new ATOM 0 HB3 SER A 21 -12.474 -3.775 -44.045 1.00 40.35 H new ATOM 0 HG SER A 21 -13.292 -5.460 -45.525 1.00 64.30 H new ATOM 299 N MET A 22 -14.708 -5.650 -41.769 1.00 32.51 N ATOM 300 CA MET A 22 -14.406 -6.825 -40.961 1.00 32.53 C ATOM 301 C MET A 22 -14.594 -8.104 -41.769 1.00 61.40 C ATOM 302 O MET A 22 -15.720 -8.545 -41.999 1.00 71.10 O ATOM 303 CB MET A 22 -15.298 -6.857 -39.717 1.00 11.01 C ATOM 304 CG MET A 22 -16.778 -6.705 -40.027 1.00 3.03 C ATOM 305 SD MET A 22 -17.757 -6.325 -38.562 1.00 50.43 S ATOM 306 CE MET A 22 -19.136 -7.448 -38.776 1.00 34.11 C ATOM 0 H MET A 22 -15.366 -5.000 -41.339 1.00 32.51 H new ATOM 0 HA MET A 22 -13.363 -6.764 -40.650 1.00 32.53 H new ATOM 0 HB2 MET A 22 -15.140 -7.798 -39.191 1.00 11.01 H new ATOM 0 HB3 MET A 22 -14.993 -6.059 -39.040 1.00 11.01 H new ATOM 0 HG2 MET A 22 -16.912 -5.913 -40.764 1.00 3.03 H new ATOM 0 HG3 MET A 22 -17.148 -7.626 -40.478 1.00 3.03 H new ATOM 0 HE1 MET A 22 -19.832 -7.332 -37.945 1.00 34.11 H new ATOM 0 HE2 MET A 22 -19.647 -7.223 -39.712 1.00 34.11 H new ATOM 0 HE3 MET A 22 -18.769 -8.474 -38.801 1.00 34.11 H new ATOM 316 N ASP A 23 -13.484 -8.696 -42.199 1.00 41.12 N ATOM 317 CA ASP A 23 -13.527 -9.926 -42.981 1.00 13.44 C ATOM 318 C ASP A 23 -12.438 -10.895 -42.530 1.00 2.34 C ATOM 319 O ASP A 23 -11.589 -11.304 -43.322 1.00 34.23 O ATOM 320 CB ASP A 23 -13.364 -9.614 -44.470 1.00 31.54 C ATOM 321 CG ASP A 23 -14.692 -9.359 -45.156 1.00 71.31 C ATOM 322 OD1 ASP A 23 -15.730 -9.367 -44.461 1.00 42.34 O ATOM 323 OD2 ASP A 23 -14.691 -9.150 -46.386 1.00 72.52 O ATOM 0 H ASP A 23 -12.544 -8.344 -42.019 1.00 41.12 H new ATOM 0 HA ASP A 23 -14.497 -10.397 -42.820 1.00 13.44 H new ATOM 0 HB2 ASP A 23 -12.724 -8.740 -44.587 1.00 31.54 H new ATOM 0 HB3 ASP A 23 -12.859 -10.447 -44.960 1.00 31.54 H new ATOM 328 N VAL A 24 -12.469 -11.258 -41.251 1.00 11.21 N ATOM 329 CA VAL A 24 -11.486 -12.179 -40.694 1.00 43.11 C ATOM 330 C VAL A 24 -12.165 -13.340 -39.975 1.00 32.54 C ATOM 331 O VAL A 24 -13.087 -13.141 -39.184 1.00 74.33 O ATOM 332 CB VAL A 24 -10.541 -11.464 -39.710 1.00 74.11 C ATOM 333 CG1 VAL A 24 -9.619 -12.465 -39.032 1.00 35.51 C ATOM 334 CG2 VAL A 24 -9.739 -10.390 -40.429 1.00 14.24 C ATOM 0 H VAL A 24 -13.164 -10.928 -40.582 1.00 11.21 H new ATOM 0 HA VAL A 24 -10.904 -12.564 -41.531 1.00 43.11 H new ATOM 0 HB VAL A 24 -11.143 -10.982 -38.940 1.00 74.11 H new ATOM 0 HG11 VAL A 24 -8.959 -11.941 -38.341 1.00 35.51 H new ATOM 0 HG12 VAL A 24 -10.215 -13.194 -38.483 1.00 35.51 H new ATOM 0 HG13 VAL A 24 -9.022 -12.978 -39.786 1.00 35.51 H new ATOM 0 HG21 VAL A 24 -9.076 -9.894 -39.719 1.00 14.24 H new ATOM 0 HG22 VAL A 24 -9.146 -10.848 -41.221 1.00 14.24 H new ATOM 0 HG23 VAL A 24 -10.419 -9.657 -40.863 1.00 14.24 H new ATOM 344 N THR A 25 -11.704 -14.555 -40.257 1.00 71.22 N ATOM 345 CA THR A 25 -12.266 -15.748 -39.639 1.00 41.34 C ATOM 346 C THR A 25 -11.220 -16.481 -38.806 1.00 33.33 C ATOM 347 O THR A 25 -10.066 -16.608 -39.214 1.00 52.31 O ATOM 348 CB THR A 25 -12.834 -16.714 -40.695 1.00 44.12 C ATOM 349 OG1 THR A 25 -13.328 -15.976 -41.819 1.00 52.13 O ATOM 350 CG2 THR A 25 -13.950 -17.563 -40.109 1.00 44.05 C ATOM 0 H THR A 25 -10.942 -14.738 -40.910 1.00 71.22 H new ATOM 0 HA THR A 25 -13.076 -15.415 -38.990 1.00 41.34 H new ATOM 0 HB THR A 25 -12.030 -17.375 -41.020 1.00 44.12 H new ATOM 0 HG1 THR A 25 -13.686 -16.598 -42.487 1.00 52.13 H new ATOM 0 HG21 THR A 25 -14.335 -18.237 -40.874 1.00 44.05 H new ATOM 0 HG22 THR A 25 -13.563 -18.146 -39.273 1.00 44.05 H new ATOM 0 HG23 THR A 25 -14.754 -16.916 -39.758 1.00 44.05 H new ATOM 358 N ILE A 26 -11.632 -16.962 -37.637 1.00 1.50 N ATOM 359 CA ILE A 26 -10.730 -17.684 -36.749 1.00 42.15 C ATOM 360 C ILE A 26 -11.195 -19.122 -36.543 1.00 13.41 C ATOM 361 O ILE A 26 -12.394 -19.403 -36.541 1.00 62.53 O ATOM 362 CB ILE A 26 -10.617 -16.992 -35.378 1.00 42.13 C ATOM 363 CG1 ILE A 26 -10.702 -15.473 -35.540 1.00 25.04 C ATOM 364 CG2 ILE A 26 -9.316 -17.384 -34.692 1.00 35.33 C ATOM 365 CD1 ILE A 26 -9.705 -14.914 -36.530 1.00 5.04 C ATOM 0 H ILE A 26 -12.584 -16.865 -37.284 1.00 1.50 H new ATOM 0 HA ILE A 26 -9.751 -17.686 -37.228 1.00 42.15 H new ATOM 0 HB ILE A 26 -11.448 -17.319 -34.753 1.00 42.13 H new ATOM 0 HG12 ILE A 26 -11.709 -15.206 -35.861 1.00 25.04 H new ATOM 0 HG13 ILE A 26 -10.541 -15.003 -34.570 1.00 25.04 H new ATOM 0 HG21 ILE A 26 -9.251 -16.887 -33.724 1.00 35.33 H new ATOM 0 HG22 ILE A 26 -9.292 -18.464 -34.547 1.00 35.33 H new ATOM 0 HG23 ILE A 26 -8.472 -17.082 -35.312 1.00 35.33 H new ATOM 0 HD11 ILE A 26 -9.823 -13.832 -36.594 1.00 5.04 H new ATOM 0 HD12 ILE A 26 -8.693 -15.150 -36.200 1.00 5.04 H new ATOM 0 HD13 ILE A 26 -9.879 -15.356 -37.511 1.00 5.04 H new ATOM 377 N TYR A 27 -10.240 -20.028 -36.368 1.00 33.21 N ATOM 378 CA TYR A 27 -10.551 -21.437 -36.162 1.00 73.01 C ATOM 379 C TYR A 27 -9.939 -21.945 -34.861 1.00 63.14 C ATOM 380 O TYR A 27 -8.728 -22.150 -34.769 1.00 21.02 O ATOM 381 CB TYR A 27 -10.042 -22.271 -37.339 1.00 33.12 C ATOM 382 CG TYR A 27 -10.617 -21.852 -38.672 1.00 71.33 C ATOM 383 CD1 TYR A 27 -11.989 -21.715 -38.846 1.00 45.51 C ATOM 384 CD2 TYR A 27 -9.791 -21.593 -39.758 1.00 75.24 C ATOM 385 CE1 TYR A 27 -12.520 -21.334 -40.063 1.00 2.41 C ATOM 386 CE2 TYR A 27 -10.313 -21.210 -40.978 1.00 60.01 C ATOM 387 CZ TYR A 27 -11.678 -21.081 -41.126 1.00 51.23 C ATOM 388 OH TYR A 27 -12.201 -20.701 -42.340 1.00 52.15 O ATOM 0 H TYR A 27 -9.243 -19.812 -36.365 1.00 33.21 H new ATOM 0 HA TYR A 27 -11.634 -21.538 -36.096 1.00 73.01 H new ATOM 0 HB2 TYR A 27 -8.955 -22.197 -37.382 1.00 33.12 H new ATOM 0 HB3 TYR A 27 -10.284 -23.319 -37.162 1.00 33.12 H new ATOM 0 HD1 TYR A 27 -12.651 -21.910 -38.016 1.00 45.51 H new ATOM 0 HD2 TYR A 27 -8.721 -21.693 -39.647 1.00 75.24 H new ATOM 0 HE1 TYR A 27 -13.589 -21.235 -40.182 1.00 2.41 H new ATOM 0 HE2 TYR A 27 -9.656 -21.013 -41.812 1.00 60.01 H new ATOM 0 HH TYR A 27 -11.473 -20.561 -42.981 1.00 52.15 H new ATOM 398 N HIS A 28 -10.785 -22.149 -33.856 1.00 5.11 N ATOM 399 CA HIS A 28 -10.328 -22.634 -32.558 1.00 51.12 C ATOM 400 C HIS A 28 -11.510 -22.897 -31.630 1.00 11.40 C ATOM 401 O HIS A 28 -12.624 -22.440 -31.883 1.00 60.31 O ATOM 402 CB HIS A 28 -9.376 -21.624 -31.917 1.00 62.31 C ATOM 403 CG HIS A 28 -8.499 -22.216 -30.858 1.00 43.43 C ATOM 404 ND1 HIS A 28 -8.162 -21.548 -29.700 1.00 21.51 N ATOM 405 CD2 HIS A 28 -7.890 -23.423 -30.786 1.00 32.31 C ATOM 406 CE1 HIS A 28 -7.382 -22.317 -28.962 1.00 70.53 C ATOM 407 NE2 HIS A 28 -7.201 -23.461 -29.597 1.00 23.21 N ATOM 0 H HIS A 28 -11.790 -21.986 -33.915 1.00 5.11 H new ATOM 0 HA HIS A 28 -9.796 -23.572 -32.716 1.00 51.12 H new ATOM 0 HB2 HIS A 28 -8.749 -21.185 -32.693 1.00 62.31 H new ATOM 0 HB3 HIS A 28 -9.960 -20.813 -31.482 1.00 62.31 H new ATOM 0 HD2 HIS A 28 -7.937 -24.209 -31.525 1.00 32.31 H new ATOM 0 HE1 HIS A 28 -6.963 -22.055 -28.002 1.00 70.53 H new ATOM 0 HE2 HIS A 28 -6.641 -24.245 -29.260 1.00 23.21 H new ATOM 415 N ASN A 29 -11.259 -23.638 -30.555 1.00 72.24 N ATOM 416 CA ASN A 29 -12.303 -23.963 -29.590 1.00 24.13 C ATOM 417 C ASN A 29 -12.498 -22.823 -28.595 1.00 54.33 C ATOM 418 O ASN A 29 -11.604 -22.009 -28.363 1.00 13.14 O ATOM 419 CB ASN A 29 -11.953 -25.251 -28.842 1.00 51.11 C ATOM 420 CG ASN A 29 -10.519 -25.263 -28.351 1.00 15.25 C ATOM 421 OD1 ASN A 29 -9.872 -24.219 -28.264 1.00 22.15 O ATOM 422 ND2 ASN A 29 -10.015 -26.448 -28.025 1.00 22.13 N ATOM 0 H ASN A 29 -10.342 -24.024 -30.331 1.00 72.24 H new ATOM 0 HA ASN A 29 -13.235 -24.109 -30.137 1.00 24.13 H new ATOM 0 HB2 ASN A 29 -12.626 -25.369 -27.993 1.00 51.11 H new ATOM 0 HB3 ASN A 29 -12.116 -26.105 -29.499 1.00 51.11 H new ATOM 0 HD21 ASN A 29 -9.055 -26.518 -27.687 1.00 22.13 H new ATOM 0 HD22 ASN A 29 -10.588 -27.287 -28.113 1.00 22.13 H new ATOM 429 N PRO A 30 -13.696 -22.760 -27.994 1.00 41.20 N ATOM 430 CA PRO A 30 -14.037 -21.725 -27.014 1.00 72.03 C ATOM 431 C PRO A 30 -13.277 -21.895 -25.703 1.00 23.43 C ATOM 432 O PRO A 30 -13.836 -22.352 -24.706 1.00 2.11 O ATOM 433 CB PRO A 30 -15.538 -21.925 -26.793 1.00 14.01 C ATOM 434 CG PRO A 30 -15.782 -23.356 -27.129 1.00 2.35 C ATOM 435 CD PRO A 30 -14.809 -23.696 -28.224 1.00 33.42 C ATOM 0 HA PRO A 30 -13.774 -20.728 -27.367 1.00 72.03 H new ATOM 0 HB2 PRO A 30 -15.819 -21.707 -25.763 1.00 14.01 H new ATOM 0 HB3 PRO A 30 -16.124 -21.263 -27.431 1.00 14.01 H new ATOM 0 HG2 PRO A 30 -15.628 -23.993 -26.258 1.00 2.35 H new ATOM 0 HG3 PRO A 30 -16.810 -23.510 -27.458 1.00 2.35 H new ATOM 0 HD2 PRO A 30 -14.481 -24.734 -28.162 1.00 33.42 H new ATOM 0 HD3 PRO A 30 -15.251 -23.560 -29.211 1.00 33.42 H new ATOM 443 N VAL A 31 -12.001 -21.525 -25.711 1.00 70.34 N ATOM 444 CA VAL A 31 -11.165 -21.636 -24.521 1.00 75.32 C ATOM 445 C VAL A 31 -10.913 -20.267 -23.897 1.00 61.23 C ATOM 446 O VAL A 31 -10.417 -19.354 -24.559 1.00 30.14 O ATOM 447 CB VAL A 31 -9.813 -22.298 -24.844 1.00 65.20 C ATOM 448 CG1 VAL A 31 -8.936 -22.356 -23.603 1.00 11.34 C ATOM 449 CG2 VAL A 31 -10.026 -23.689 -25.421 1.00 52.00 C ATOM 0 H VAL A 31 -11.523 -21.146 -26.528 1.00 70.34 H new ATOM 0 HA VAL A 31 -11.706 -22.262 -23.811 1.00 75.32 H new ATOM 0 HB VAL A 31 -9.302 -21.693 -25.593 1.00 65.20 H new ATOM 0 HG11 VAL A 31 -7.985 -22.827 -23.851 1.00 11.34 H new ATOM 0 HG12 VAL A 31 -8.756 -21.345 -23.237 1.00 11.34 H new ATOM 0 HG13 VAL A 31 -9.438 -22.937 -22.830 1.00 11.34 H new ATOM 0 HG21 VAL A 31 -9.060 -24.142 -25.644 1.00 52.00 H new ATOM 0 HG22 VAL A 31 -10.558 -24.306 -24.697 1.00 52.00 H new ATOM 0 HG23 VAL A 31 -10.613 -23.617 -26.337 1.00 52.00 H new ATOM 459 N CYS A 32 -11.255 -20.132 -22.622 1.00 63.23 N ATOM 460 CA CYS A 32 -11.065 -18.874 -21.908 1.00 71.23 C ATOM 461 C CYS A 32 -9.617 -18.405 -22.009 1.00 44.13 C ATOM 462 O CYS A 32 -8.715 -19.197 -22.276 1.00 2.11 O ATOM 463 CB CYS A 32 -11.462 -19.032 -20.439 1.00 24.13 C ATOM 464 SG CYS A 32 -10.419 -20.181 -19.512 1.00 1.02 S ATOM 0 H CYS A 32 -11.666 -20.878 -22.060 1.00 63.23 H new ATOM 0 HA CYS A 32 -11.704 -18.122 -22.370 1.00 71.23 H new ATOM 0 HB2 CYS A 32 -11.425 -18.055 -19.957 1.00 24.13 H new ATOM 0 HB3 CYS A 32 -12.496 -19.374 -20.388 1.00 24.13 H new ATOM 0 HG CYS A 32 -10.832 -20.245 -18.281 1.00 1.02 H new ATOM 470 N GLY A 33 -9.404 -17.111 -21.792 1.00 3.35 N ATOM 471 CA GLY A 33 -8.064 -16.558 -21.865 1.00 3.21 C ATOM 472 C GLY A 33 -7.593 -16.364 -23.292 1.00 54.32 C ATOM 473 O GLY A 33 -7.263 -15.250 -23.700 1.00 34.43 O ATOM 0 H GLY A 33 -10.135 -16.436 -21.567 1.00 3.35 H new ATOM 0 HA2 GLY A 33 -8.041 -15.600 -21.345 1.00 3.21 H new ATOM 0 HA3 GLY A 33 -7.372 -17.220 -21.344 1.00 3.21 H new ATOM 477 N THR A 34 -7.559 -17.452 -24.055 1.00 72.14 N ATOM 478 CA THR A 34 -7.122 -17.398 -25.445 1.00 31.14 C ATOM 479 C THR A 34 -8.139 -16.665 -26.313 1.00 13.25 C ATOM 480 O THR A 34 -7.822 -15.654 -26.938 1.00 20.52 O ATOM 481 CB THR A 34 -6.897 -18.809 -26.019 1.00 63.23 C ATOM 482 OG1 THR A 34 -5.836 -19.461 -25.312 1.00 41.31 O ATOM 483 CG2 THR A 34 -6.560 -18.743 -27.501 1.00 22.40 C ATOM 0 H THR A 34 -7.829 -18.382 -23.734 1.00 72.14 H new ATOM 0 HA THR A 34 -6.178 -16.854 -25.458 1.00 31.14 H new ATOM 0 HB THR A 34 -7.818 -19.378 -25.897 1.00 63.23 H new ATOM 0 HG1 THR A 34 -5.285 -18.790 -24.858 1.00 41.31 H new ATOM 0 HG21 THR A 34 -6.405 -19.752 -27.884 1.00 22.40 H new ATOM 0 HG22 THR A 34 -7.382 -18.272 -28.040 1.00 22.40 H new ATOM 0 HG23 THR A 34 -5.651 -18.158 -27.642 1.00 22.40 H new ATOM 491 N SER A 35 -9.364 -17.182 -26.346 1.00 4.35 N ATOM 492 CA SER A 35 -10.427 -16.577 -27.140 1.00 61.20 C ATOM 493 C SER A 35 -10.705 -15.149 -26.679 1.00 74.41 C ATOM 494 O SER A 35 -10.970 -14.265 -27.493 1.00 4.45 O ATOM 495 CB SER A 35 -11.704 -17.414 -27.041 1.00 34.55 C ATOM 496 OG SER A 35 -12.684 -16.959 -27.957 1.00 11.42 O ATOM 0 H SER A 35 -9.644 -18.018 -25.832 1.00 4.35 H new ATOM 0 HA SER A 35 -10.099 -16.547 -28.179 1.00 61.20 H new ATOM 0 HB2 SER A 35 -11.473 -18.460 -27.241 1.00 34.55 H new ATOM 0 HB3 SER A 35 -12.098 -17.363 -26.026 1.00 34.55 H new ATOM 0 HG SER A 35 -13.490 -17.511 -27.875 1.00 11.42 H new ATOM 502 N ARG A 36 -10.640 -14.933 -25.370 1.00 34.54 N ATOM 503 CA ARG A 36 -10.885 -13.614 -24.800 1.00 11.34 C ATOM 504 C ARG A 36 -9.778 -12.639 -25.190 1.00 64.21 C ATOM 505 O ARG A 36 -10.047 -11.522 -25.634 1.00 2.23 O ATOM 506 CB ARG A 36 -10.986 -13.704 -23.277 1.00 35.03 C ATOM 507 CG ARG A 36 -12.386 -14.022 -22.777 1.00 64.05 C ATOM 508 CD ARG A 36 -12.585 -13.558 -21.343 1.00 23.32 C ATOM 509 NE ARG A 36 -13.850 -14.029 -20.784 1.00 2.11 N ATOM 510 CZ ARG A 36 -15.020 -13.447 -21.023 1.00 51.14 C ATOM 511 NH1 ARG A 36 -15.084 -12.377 -21.805 1.00 71.13 N ATOM 512 NH2 ARG A 36 -16.127 -13.933 -20.479 1.00 31.30 N ATOM 0 H ARG A 36 -10.420 -15.655 -24.684 1.00 34.54 H new ATOM 0 HA ARG A 36 -11.829 -13.243 -25.199 1.00 11.34 H new ATOM 0 HB2 ARG A 36 -10.299 -14.472 -22.921 1.00 35.03 H new ATOM 0 HB3 ARG A 36 -10.660 -12.758 -22.843 1.00 35.03 H new ATOM 0 HG2 ARG A 36 -13.122 -13.541 -23.422 1.00 64.05 H new ATOM 0 HG3 ARG A 36 -12.561 -15.096 -22.840 1.00 64.05 H new ATOM 0 HD2 ARG A 36 -11.761 -13.919 -20.728 1.00 23.32 H new ATOM 0 HD3 ARG A 36 -12.556 -12.469 -21.307 1.00 23.32 H new ATOM 0 HE ARG A 36 -13.834 -14.849 -20.178 1.00 2.11 H new ATOM 0 HH11 ARG A 36 -14.234 -12.000 -22.224 1.00 71.13 H new ATOM 0 HH12 ARG A 36 -15.983 -11.932 -21.987 1.00 71.13 H new ATOM 0 HH21 ARG A 36 -16.081 -14.755 -19.876 1.00 31.30 H new ATOM 0 HH22 ARG A 36 -17.025 -13.485 -20.663 1.00 31.30 H new ATOM 526 N LYS A 37 -8.532 -13.069 -25.023 1.00 34.40 N ATOM 527 CA LYS A 37 -7.383 -12.236 -25.357 1.00 75.21 C ATOM 528 C LYS A 37 -7.410 -11.838 -26.830 1.00 44.13 C ATOM 529 O LYS A 37 -7.373 -10.654 -27.165 1.00 33.44 O ATOM 530 CB LYS A 37 -6.082 -12.975 -25.041 1.00 42.51 C ATOM 531 CG LYS A 37 -4.835 -12.135 -25.264 1.00 50.41 C ATOM 532 CD LYS A 37 -4.827 -10.904 -24.375 1.00 21.42 C ATOM 533 CE LYS A 37 -3.550 -10.097 -24.553 1.00 31.44 C ATOM 534 NZ LYS A 37 -3.510 -8.915 -23.648 1.00 33.53 N ATOM 0 H LYS A 37 -8.292 -13.991 -24.658 1.00 34.40 H new ATOM 0 HA LYS A 37 -7.434 -11.330 -24.753 1.00 75.21 H new ATOM 0 HB2 LYS A 37 -6.105 -13.307 -24.003 1.00 42.51 H new ATOM 0 HB3 LYS A 37 -6.023 -13.870 -25.661 1.00 42.51 H new ATOM 0 HG2 LYS A 37 -3.949 -12.737 -25.062 1.00 50.41 H new ATOM 0 HG3 LYS A 37 -4.782 -11.831 -26.309 1.00 50.41 H new ATOM 0 HD2 LYS A 37 -5.689 -10.279 -24.609 1.00 21.42 H new ATOM 0 HD3 LYS A 37 -4.926 -11.206 -23.332 1.00 21.42 H new ATOM 0 HE2 LYS A 37 -2.688 -10.734 -24.357 1.00 31.44 H new ATOM 0 HE3 LYS A 37 -3.472 -9.765 -25.588 1.00 31.44 H new ATOM 0 HZ1 LYS A 37 -2.624 -8.391 -23.800 1.00 33.53 H new ATOM 0 HZ2 LYS A 37 -4.319 -8.294 -23.852 1.00 33.53 H new ATOM 0 HZ3 LYS A 37 -3.559 -9.233 -22.659 1.00 33.53 H new ATOM 548 N VAL A 38 -7.477 -12.835 -27.707 1.00 61.40 N ATOM 549 CA VAL A 38 -7.511 -12.591 -29.143 1.00 34.04 C ATOM 550 C VAL A 38 -8.685 -11.693 -29.519 1.00 42.50 C ATOM 551 O VAL A 38 -8.509 -10.662 -30.169 1.00 5.35 O ATOM 552 CB VAL A 38 -7.612 -13.908 -29.935 1.00 4.13 C ATOM 553 CG1 VAL A 38 -7.548 -13.637 -31.430 1.00 1.35 C ATOM 554 CG2 VAL A 38 -6.512 -14.869 -29.511 1.00 24.40 C ATOM 0 H VAL A 38 -7.509 -13.821 -27.447 1.00 61.40 H new ATOM 0 HA VAL A 38 -6.577 -12.092 -29.402 1.00 34.04 H new ATOM 0 HB VAL A 38 -8.573 -14.372 -29.715 1.00 4.13 H new ATOM 0 HG11 VAL A 38 -7.621 -14.579 -31.974 1.00 1.35 H new ATOM 0 HG12 VAL A 38 -8.374 -12.987 -31.718 1.00 1.35 H new ATOM 0 HG13 VAL A 38 -6.603 -13.151 -31.671 1.00 1.35 H new ATOM 0 HG21 VAL A 38 -6.598 -15.794 -30.080 1.00 24.40 H new ATOM 0 HG22 VAL A 38 -5.539 -14.415 -29.701 1.00 24.40 H new ATOM 0 HG23 VAL A 38 -6.609 -15.087 -28.447 1.00 24.40 H new ATOM 564 N LEU A 39 -9.882 -12.091 -29.106 1.00 43.05 N ATOM 565 CA LEU A 39 -11.088 -11.322 -29.398 1.00 74.42 C ATOM 566 C LEU A 39 -10.962 -9.894 -28.879 1.00 73.52 C ATOM 567 O LEU A 39 -11.412 -8.947 -29.522 1.00 45.40 O ATOM 568 CB LEU A 39 -12.310 -11.998 -28.776 1.00 5.31 C ATOM 569 CG LEU A 39 -12.817 -13.255 -29.485 1.00 32.44 C ATOM 570 CD1 LEU A 39 -13.989 -13.860 -28.728 1.00 51.43 C ATOM 571 CD2 LEU A 39 -13.214 -12.935 -30.919 1.00 14.44 C ATOM 0 H LEU A 39 -10.045 -12.942 -28.568 1.00 43.05 H new ATOM 0 HA LEU A 39 -11.213 -11.285 -30.480 1.00 74.42 H new ATOM 0 HB2 LEU A 39 -12.070 -12.259 -27.745 1.00 5.31 H new ATOM 0 HB3 LEU A 39 -13.123 -11.272 -28.741 1.00 5.31 H new ATOM 0 HG LEU A 39 -12.009 -13.987 -29.507 1.00 32.44 H new ATOM 0 HD11 LEU A 39 -14.336 -14.753 -29.248 1.00 51.43 H new ATOM 0 HD12 LEU A 39 -13.672 -14.127 -27.720 1.00 51.43 H new ATOM 0 HD13 LEU A 39 -14.800 -13.134 -28.673 1.00 51.43 H new ATOM 0 HD21 LEU A 39 -13.572 -13.841 -31.408 1.00 14.44 H new ATOM 0 HD22 LEU A 39 -14.005 -12.185 -30.919 1.00 14.44 H new ATOM 0 HD23 LEU A 39 -12.349 -12.549 -31.459 1.00 14.44 H new ATOM 583 N GLY A 40 -10.345 -9.747 -27.710 1.00 54.33 N ATOM 584 CA GLY A 40 -10.169 -8.431 -27.124 1.00 4.42 C ATOM 585 C GLY A 40 -9.295 -7.531 -27.974 1.00 73.20 C ATOM 586 O GLY A 40 -9.629 -6.369 -28.206 1.00 43.31 O ATOM 0 H GLY A 40 -9.964 -10.516 -27.159 1.00 54.33 H new ATOM 0 HA2 GLY A 40 -11.144 -7.963 -26.989 1.00 4.42 H new ATOM 0 HA3 GLY A 40 -9.725 -8.534 -26.134 1.00 4.42 H new ATOM 590 N MET A 41 -8.171 -8.066 -28.438 1.00 24.11 N ATOM 591 CA MET A 41 -7.246 -7.302 -29.268 1.00 23.24 C ATOM 592 C MET A 41 -7.907 -6.887 -30.578 1.00 42.54 C ATOM 593 O MET A 41 -7.851 -5.720 -30.969 1.00 53.20 O ATOM 594 CB MET A 41 -5.988 -8.124 -29.555 1.00 74.11 C ATOM 595 CG MET A 41 -4.965 -8.083 -28.430 1.00 50.10 C ATOM 596 SD MET A 41 -3.925 -6.611 -28.490 1.00 52.31 S ATOM 597 CE MET A 41 -4.188 -5.945 -26.849 1.00 35.33 C ATOM 0 H MET A 41 -7.878 -9.026 -28.254 1.00 24.11 H new ATOM 0 HA MET A 41 -6.966 -6.401 -28.722 1.00 23.24 H new ATOM 0 HB2 MET A 41 -6.274 -9.160 -29.737 1.00 74.11 H new ATOM 0 HB3 MET A 41 -5.524 -7.756 -30.470 1.00 74.11 H new ATOM 0 HG2 MET A 41 -5.483 -8.118 -27.472 1.00 50.10 H new ATOM 0 HG3 MET A 41 -4.335 -8.971 -28.485 1.00 50.10 H new ATOM 0 HE1 MET A 41 -3.609 -5.029 -26.731 1.00 35.33 H new ATOM 0 HE2 MET A 41 -5.247 -5.726 -26.711 1.00 35.33 H new ATOM 0 HE3 MET A 41 -3.869 -6.674 -26.105 1.00 35.33 H new ATOM 607 N ILE A 42 -8.530 -7.847 -31.252 1.00 53.12 N ATOM 608 CA ILE A 42 -9.201 -7.579 -32.518 1.00 55.04 C ATOM 609 C ILE A 42 -10.381 -6.632 -32.325 1.00 70.03 C ATOM 610 O ILE A 42 -10.447 -5.572 -32.950 1.00 14.11 O ATOM 611 CB ILE A 42 -9.704 -8.879 -33.174 1.00 43.53 C ATOM 612 CG1 ILE A 42 -8.567 -9.897 -33.276 1.00 40.43 C ATOM 613 CG2 ILE A 42 -10.285 -8.586 -34.550 1.00 20.34 C ATOM 614 CD1 ILE A 42 -9.026 -11.274 -33.702 1.00 33.24 C ATOM 0 H ILE A 42 -8.584 -8.817 -30.943 1.00 53.12 H new ATOM 0 HA ILE A 42 -8.465 -7.111 -33.172 1.00 55.04 H new ATOM 0 HB ILE A 42 -10.491 -9.303 -32.551 1.00 43.53 H new ATOM 0 HG12 ILE A 42 -7.827 -9.533 -33.989 1.00 40.43 H new ATOM 0 HG13 ILE A 42 -8.069 -9.972 -32.309 1.00 40.43 H new ATOM 0 HG21 ILE A 42 -10.636 -9.514 -35.002 1.00 20.34 H new ATOM 0 HG22 ILE A 42 -11.119 -7.891 -34.452 1.00 20.34 H new ATOM 0 HG23 ILE A 42 -9.516 -8.143 -35.183 1.00 20.34 H new ATOM 0 HD11 ILE A 42 -8.168 -11.944 -33.753 1.00 33.24 H new ATOM 0 HD12 ILE A 42 -9.744 -11.659 -32.977 1.00 33.24 H new ATOM 0 HD13 ILE A 42 -9.498 -11.213 -34.683 1.00 33.24 H new ATOM 626 N ARG A 43 -11.307 -7.018 -31.454 1.00 55.31 N ATOM 627 CA ARG A 43 -12.484 -6.202 -31.179 1.00 32.30 C ATOM 628 C ARG A 43 -12.084 -4.772 -30.829 1.00 11.24 C ATOM 629 O ARG A 43 -12.723 -3.814 -31.264 1.00 22.42 O ATOM 630 CB ARG A 43 -13.296 -6.811 -30.035 1.00 33.32 C ATOM 631 CG ARG A 43 -14.022 -8.091 -30.416 1.00 24.31 C ATOM 632 CD ARG A 43 -14.478 -8.860 -29.187 1.00 30.00 C ATOM 633 NE ARG A 43 -15.373 -9.961 -29.531 1.00 2.12 N ATOM 634 CZ ARG A 43 -16.188 -10.546 -28.661 1.00 73.44 C ATOM 635 NH1 ARG A 43 -16.219 -10.138 -27.400 1.00 4.01 N ATOM 636 NH2 ARG A 43 -16.973 -11.543 -29.050 1.00 13.43 N ATOM 0 H ARG A 43 -11.265 -7.890 -30.927 1.00 55.31 H new ATOM 0 HA ARG A 43 -13.098 -6.179 -32.079 1.00 32.30 H new ATOM 0 HB2 ARG A 43 -12.630 -7.017 -29.198 1.00 33.32 H new ATOM 0 HB3 ARG A 43 -14.026 -6.079 -29.689 1.00 33.32 H new ATOM 0 HG2 ARG A 43 -14.885 -7.850 -31.037 1.00 24.31 H new ATOM 0 HG3 ARG A 43 -13.364 -8.719 -31.016 1.00 24.31 H new ATOM 0 HD2 ARG A 43 -13.607 -9.252 -28.661 1.00 30.00 H new ATOM 0 HD3 ARG A 43 -14.986 -8.181 -28.502 1.00 30.00 H new ATOM 0 HE ARG A 43 -15.372 -10.300 -30.493 1.00 2.12 H new ATOM 0 HH11 ARG A 43 -15.616 -9.373 -27.096 1.00 4.01 H new ATOM 0 HH12 ARG A 43 -16.846 -10.589 -26.733 1.00 4.01 H new ATOM 0 HH21 ARG A 43 -16.951 -11.861 -30.019 1.00 13.43 H new ATOM 0 HH22 ARG A 43 -17.598 -11.991 -28.380 1.00 13.43 H new ATOM 650 N GLU A 44 -11.023 -4.636 -30.039 1.00 31.55 N ATOM 651 CA GLU A 44 -10.540 -3.323 -29.629 1.00 52.13 C ATOM 652 C GLU A 44 -9.795 -2.636 -30.772 1.00 3.31 C ATOM 653 O GLU A 44 -9.750 -1.409 -30.847 1.00 34.54 O ATOM 654 CB GLU A 44 -9.621 -3.450 -28.412 1.00 70.52 C ATOM 655 CG GLU A 44 -10.358 -3.781 -27.125 1.00 33.42 C ATOM 656 CD GLU A 44 -9.419 -4.138 -25.989 1.00 3.24 C ATOM 657 OE1 GLU A 44 -8.209 -3.857 -26.111 1.00 50.33 O ATOM 658 OE2 GLU A 44 -9.893 -4.697 -24.979 1.00 72.10 O ATOM 0 H GLU A 44 -10.482 -5.419 -29.671 1.00 31.55 H new ATOM 0 HA GLU A 44 -11.404 -2.714 -29.362 1.00 52.13 H new ATOM 0 HB2 GLU A 44 -8.880 -4.225 -28.606 1.00 70.52 H new ATOM 0 HB3 GLU A 44 -9.077 -2.515 -28.279 1.00 70.52 H new ATOM 0 HG2 GLU A 44 -10.969 -2.928 -26.831 1.00 33.42 H new ATOM 0 HG3 GLU A 44 -11.038 -4.614 -27.304 1.00 33.42 H new ATOM 665 N ALA A 45 -9.214 -3.438 -31.657 1.00 24.42 N ATOM 666 CA ALA A 45 -8.473 -2.909 -32.796 1.00 73.43 C ATOM 667 C ALA A 45 -9.413 -2.271 -33.813 1.00 53.23 C ATOM 668 O ALA A 45 -9.020 -1.379 -34.563 1.00 64.43 O ATOM 669 CB ALA A 45 -7.654 -4.011 -33.451 1.00 43.53 C ATOM 0 H ALA A 45 -9.242 -4.456 -31.608 1.00 24.42 H new ATOM 0 HA ALA A 45 -7.796 -2.137 -32.431 1.00 73.43 H new ATOM 0 HB1 ALA A 45 -7.106 -3.602 -34.300 1.00 43.53 H new ATOM 0 HB2 ALA A 45 -6.949 -4.420 -32.727 1.00 43.53 H new ATOM 0 HB3 ALA A 45 -8.319 -4.802 -33.796 1.00 43.53 H new ATOM 675 N GLY A 46 -10.660 -2.736 -33.834 1.00 12.01 N ATOM 676 CA GLY A 46 -11.636 -2.199 -34.764 1.00 21.14 C ATOM 677 C GLY A 46 -12.086 -3.223 -35.787 1.00 1.15 C ATOM 678 O GLY A 46 -12.311 -2.889 -36.951 1.00 2.52 O ATOM 0 H GLY A 46 -11.010 -3.474 -33.224 1.00 12.01 H new ATOM 0 HA2 GLY A 46 -12.502 -1.839 -34.209 1.00 21.14 H new ATOM 0 HA3 GLY A 46 -11.208 -1.339 -35.279 1.00 21.14 H new ATOM 682 N ILE A 47 -12.216 -4.472 -35.353 1.00 42.45 N ATOM 683 CA ILE A 47 -12.642 -5.548 -36.241 1.00 44.03 C ATOM 684 C ILE A 47 -13.447 -6.599 -35.484 1.00 1.24 C ATOM 685 O ILE A 47 -13.163 -6.895 -34.324 1.00 42.24 O ATOM 686 CB ILE A 47 -11.437 -6.229 -36.917 1.00 25.04 C ATOM 687 CG1 ILE A 47 -10.632 -5.208 -37.725 1.00 44.42 C ATOM 688 CG2 ILE A 47 -11.905 -7.368 -37.810 1.00 51.50 C ATOM 689 CD1 ILE A 47 -9.467 -5.814 -38.475 1.00 34.44 C ATOM 0 H ILE A 47 -12.033 -4.764 -34.393 1.00 42.45 H new ATOM 0 HA ILE A 47 -13.271 -5.095 -37.008 1.00 44.03 H new ATOM 0 HB ILE A 47 -10.791 -6.642 -36.142 1.00 25.04 H new ATOM 0 HG12 ILE A 47 -11.295 -4.716 -38.436 1.00 44.42 H new ATOM 0 HG13 ILE A 47 -10.258 -4.437 -37.051 1.00 44.42 H new ATOM 0 HG21 ILE A 47 -11.042 -7.839 -38.281 1.00 51.50 H new ATOM 0 HG22 ILE A 47 -12.439 -8.105 -37.210 1.00 51.50 H new ATOM 0 HG23 ILE A 47 -12.570 -6.977 -38.580 1.00 51.50 H new ATOM 0 HD11 ILE A 47 -8.942 -5.033 -39.025 1.00 34.44 H new ATOM 0 HD12 ILE A 47 -8.783 -6.282 -37.767 1.00 34.44 H new ATOM 0 HD13 ILE A 47 -9.835 -6.565 -39.174 1.00 34.44 H new ATOM 701 N GLU A 48 -14.451 -7.159 -36.150 1.00 45.15 N ATOM 702 CA GLU A 48 -15.297 -8.179 -35.540 1.00 44.15 C ATOM 703 C GLU A 48 -15.296 -9.457 -36.373 1.00 4.42 C ATOM 704 O GLU A 48 -16.201 -9.709 -37.169 1.00 3.11 O ATOM 705 CB GLU A 48 -16.727 -7.660 -35.384 1.00 71.10 C ATOM 706 CG GLU A 48 -17.472 -8.269 -34.208 1.00 65.15 C ATOM 707 CD GLU A 48 -18.619 -7.401 -33.730 1.00 52.12 C ATOM 708 OE1 GLU A 48 -18.849 -6.334 -34.336 1.00 33.44 O ATOM 709 OE2 GLU A 48 -19.288 -7.789 -32.749 1.00 31.22 O ATOM 0 H GLU A 48 -14.699 -6.924 -37.111 1.00 45.15 H new ATOM 0 HA GLU A 48 -14.892 -8.409 -34.555 1.00 44.15 H new ATOM 0 HB2 GLU A 48 -16.700 -6.577 -35.264 1.00 71.10 H new ATOM 0 HB3 GLU A 48 -17.281 -7.866 -36.300 1.00 71.10 H new ATOM 0 HG2 GLU A 48 -17.857 -9.248 -34.494 1.00 65.15 H new ATOM 0 HG3 GLU A 48 -16.775 -8.429 -33.385 1.00 65.15 H new ATOM 716 N PRO A 49 -14.256 -10.283 -36.188 1.00 13.42 N ATOM 717 CA PRO A 49 -14.111 -11.549 -36.913 1.00 11.24 C ATOM 718 C PRO A 49 -15.140 -12.588 -36.478 1.00 15.21 C ATOM 719 O PRO A 49 -15.866 -12.385 -35.504 1.00 22.32 O ATOM 720 CB PRO A 49 -12.698 -12.009 -36.546 1.00 2.24 C ATOM 721 CG PRO A 49 -12.420 -11.365 -35.231 1.00 73.33 C ATOM 722 CD PRO A 49 -13.141 -10.046 -35.255 1.00 12.21 C ATOM 0 HA PRO A 49 -14.268 -11.425 -37.984 1.00 11.24 H new ATOM 0 HB2 PRO A 49 -12.641 -13.095 -36.475 1.00 2.24 H new ATOM 0 HB3 PRO A 49 -11.973 -11.700 -37.299 1.00 2.24 H new ATOM 0 HG2 PRO A 49 -12.773 -11.988 -34.409 1.00 73.33 H new ATOM 0 HG3 PRO A 49 -11.349 -11.222 -35.085 1.00 73.33 H new ATOM 0 HD2 PRO A 49 -13.499 -9.766 -34.264 1.00 12.21 H new ATOM 0 HD3 PRO A 49 -12.493 -9.240 -35.600 1.00 12.21 H new ATOM 730 N HIS A 50 -15.195 -13.699 -37.204 1.00 33.30 N ATOM 731 CA HIS A 50 -16.135 -14.770 -36.891 1.00 52.14 C ATOM 732 C HIS A 50 -15.399 -16.008 -36.388 1.00 44.23 C ATOM 733 O HIS A 50 -14.397 -16.427 -36.969 1.00 42.45 O ATOM 734 CB HIS A 50 -16.967 -15.123 -38.124 1.00 74.33 C ATOM 735 CG HIS A 50 -18.185 -14.267 -38.289 1.00 32.12 C ATOM 736 ND1 HIS A 50 -19.285 -14.356 -37.464 1.00 73.23 N ATOM 737 CD2 HIS A 50 -18.471 -13.300 -39.192 1.00 40.44 C ATOM 738 CE1 HIS A 50 -20.197 -13.482 -37.852 1.00 72.41 C ATOM 739 NE2 HIS A 50 -19.727 -12.828 -38.899 1.00 51.50 N ATOM 0 H HIS A 50 -14.601 -13.882 -38.013 1.00 33.30 H new ATOM 0 HA HIS A 50 -16.800 -14.418 -36.102 1.00 52.14 H new ATOM 0 HB2 HIS A 50 -16.343 -15.028 -39.013 1.00 74.33 H new ATOM 0 HB3 HIS A 50 -17.273 -16.167 -38.059 1.00 74.33 H new ATOM 0 HD2 HIS A 50 -17.831 -12.962 -39.994 1.00 40.44 H new ATOM 0 HE1 HIS A 50 -21.162 -13.329 -37.392 1.00 72.41 H new ATOM 0 HE2 HIS A 50 -20.217 -12.092 -39.407 1.00 51.50 H new ATOM 747 N VAL A 51 -15.902 -16.590 -35.304 1.00 45.03 N ATOM 748 CA VAL A 51 -15.292 -17.780 -34.722 1.00 60.51 C ATOM 749 C VAL A 51 -15.974 -19.048 -35.225 1.00 24.25 C ATOM 750 O VAL A 51 -17.182 -19.222 -35.059 1.00 44.02 O ATOM 751 CB VAL A 51 -15.358 -17.750 -33.184 1.00 23.12 C ATOM 752 CG1 VAL A 51 -14.450 -16.662 -32.632 1.00 11.41 C ATOM 753 CG2 VAL A 51 -16.791 -17.548 -32.716 1.00 23.24 C ATOM 0 H VAL A 51 -16.730 -16.257 -34.811 1.00 45.03 H new ATOM 0 HA VAL A 51 -14.247 -17.785 -35.033 1.00 60.51 H new ATOM 0 HB VAL A 51 -15.008 -18.710 -32.804 1.00 23.12 H new ATOM 0 HG11 VAL A 51 -14.510 -16.656 -31.544 1.00 11.41 H new ATOM 0 HG12 VAL A 51 -13.422 -16.856 -32.938 1.00 11.41 H new ATOM 0 HG13 VAL A 51 -14.767 -15.693 -33.018 1.00 11.41 H new ATOM 0 HG21 VAL A 51 -16.819 -17.529 -31.627 1.00 23.24 H new ATOM 0 HG22 VAL A 51 -17.171 -16.603 -33.105 1.00 23.24 H new ATOM 0 HG23 VAL A 51 -17.412 -18.366 -33.081 1.00 23.24 H new ATOM 763 N ILE A 52 -15.193 -19.930 -35.838 1.00 22.12 N ATOM 764 CA ILE A 52 -15.721 -21.183 -36.363 1.00 23.12 C ATOM 765 C ILE A 52 -14.963 -22.379 -35.798 1.00 53.23 C ATOM 766 O ILE A 52 -13.787 -22.580 -36.100 1.00 14.41 O ATOM 767 CB ILE A 52 -15.650 -21.224 -37.901 1.00 11.34 C ATOM 768 CG1 ILE A 52 -16.437 -20.057 -38.501 1.00 33.30 C ATOM 769 CG2 ILE A 52 -16.180 -22.552 -38.420 1.00 74.34 C ATOM 770 CD1 ILE A 52 -16.331 -19.967 -40.007 1.00 0.43 C ATOM 0 H ILE A 52 -14.192 -19.800 -35.984 1.00 22.12 H new ATOM 0 HA ILE A 52 -16.765 -21.239 -36.054 1.00 23.12 H new ATOM 0 HB ILE A 52 -14.608 -21.128 -38.205 1.00 11.34 H new ATOM 0 HG12 ILE A 52 -17.487 -20.157 -38.224 1.00 33.30 H new ATOM 0 HG13 ILE A 52 -16.079 -19.125 -38.063 1.00 33.30 H new ATOM 0 HG21 ILE A 52 -16.123 -22.566 -39.508 1.00 74.34 H new ATOM 0 HG22 ILE A 52 -15.580 -23.367 -38.015 1.00 74.34 H new ATOM 0 HG23 ILE A 52 -17.217 -22.676 -38.109 1.00 74.34 H new ATOM 0 HD11 ILE A 52 -16.913 -19.117 -40.363 1.00 0.43 H new ATOM 0 HD12 ILE A 52 -15.287 -19.836 -40.291 1.00 0.43 H new ATOM 0 HD13 ILE A 52 -16.716 -20.883 -40.454 1.00 0.43 H new ATOM 782 N GLU A 53 -15.646 -23.172 -34.977 1.00 61.15 N ATOM 783 CA GLU A 53 -15.036 -24.349 -34.372 1.00 33.13 C ATOM 784 C GLU A 53 -15.419 -25.615 -35.134 1.00 73.11 C ATOM 785 O GLU A 53 -16.591 -25.989 -35.187 1.00 42.20 O ATOM 786 CB GLU A 53 -15.462 -24.475 -32.906 1.00 62.20 C ATOM 787 CG GLU A 53 -14.920 -25.718 -32.220 1.00 62.32 C ATOM 788 CD GLU A 53 -15.385 -25.839 -30.782 1.00 12.50 C ATOM 789 OE1 GLU A 53 -16.440 -25.258 -30.449 1.00 74.35 O ATOM 790 OE2 GLU A 53 -14.696 -26.513 -29.989 1.00 11.20 O ATOM 0 H GLU A 53 -16.620 -23.020 -34.717 1.00 61.15 H new ATOM 0 HA GLU A 53 -13.954 -24.230 -34.421 1.00 33.13 H new ATOM 0 HB2 GLU A 53 -15.125 -23.593 -32.361 1.00 62.20 H new ATOM 0 HB3 GLU A 53 -16.551 -24.486 -32.852 1.00 62.20 H new ATOM 0 HG2 GLU A 53 -15.235 -26.602 -32.775 1.00 62.32 H new ATOM 0 HG3 GLU A 53 -13.830 -25.697 -32.245 1.00 62.32 H new ATOM 797 N TYR A 54 -14.424 -26.267 -35.723 1.00 12.53 N ATOM 798 CA TYR A 54 -14.656 -27.488 -36.485 1.00 40.23 C ATOM 799 C TYR A 54 -13.571 -28.522 -36.202 1.00 23.25 C ATOM 800 O TYR A 54 -12.766 -28.358 -35.285 1.00 74.21 O ATOM 801 CB TYR A 54 -14.701 -27.178 -37.983 1.00 12.45 C ATOM 802 CG TYR A 54 -13.338 -26.943 -38.594 1.00 20.54 C ATOM 803 CD1 TYR A 54 -12.531 -25.900 -38.158 1.00 53.14 C ATOM 804 CD2 TYR A 54 -12.858 -27.763 -39.607 1.00 62.15 C ATOM 805 CE1 TYR A 54 -11.284 -25.680 -38.713 1.00 32.24 C ATOM 806 CE2 TYR A 54 -11.613 -27.552 -40.168 1.00 55.00 C ATOM 807 CZ TYR A 54 -10.831 -26.510 -39.719 1.00 23.01 C ATOM 808 OH TYR A 54 -9.590 -26.295 -40.274 1.00 21.11 O ATOM 0 H TYR A 54 -13.449 -25.971 -35.688 1.00 12.53 H new ATOM 0 HA TYR A 54 -15.616 -27.901 -36.176 1.00 40.23 H new ATOM 0 HB2 TYR A 54 -15.185 -28.005 -38.502 1.00 12.45 H new ATOM 0 HB3 TYR A 54 -15.319 -26.295 -38.144 1.00 12.45 H new ATOM 0 HD1 TYR A 54 -12.884 -25.249 -37.372 1.00 53.14 H new ATOM 0 HD2 TYR A 54 -13.469 -28.580 -39.962 1.00 62.15 H new ATOM 0 HE1 TYR A 54 -10.669 -24.865 -38.362 1.00 32.24 H new ATOM 0 HE2 TYR A 54 -11.255 -28.200 -40.954 1.00 55.00 H new ATOM 0 HH TYR A 54 -9.421 -26.966 -40.968 1.00 21.11 H new ATOM 818 N MET A 55 -13.557 -29.588 -36.995 1.00 24.23 N ATOM 819 CA MET A 55 -12.570 -30.649 -36.831 1.00 70.23 C ATOM 820 C MET A 55 -11.157 -30.076 -36.781 1.00 32.25 C ATOM 821 O MET A 55 -10.657 -29.546 -37.773 1.00 4.33 O ATOM 822 CB MET A 55 -12.682 -31.661 -37.973 1.00 30.21 C ATOM 823 CG MET A 55 -12.814 -31.017 -39.344 1.00 73.32 C ATOM 824 SD MET A 55 -12.708 -32.216 -40.687 1.00 51.23 S ATOM 825 CE MET A 55 -11.965 -31.215 -41.974 1.00 63.31 C ATOM 0 H MET A 55 -14.217 -29.740 -37.757 1.00 24.23 H new ATOM 0 HA MET A 55 -12.772 -31.154 -35.886 1.00 70.23 H new ATOM 0 HB2 MET A 55 -11.802 -32.304 -37.966 1.00 30.21 H new ATOM 0 HB3 MET A 55 -13.546 -32.302 -37.797 1.00 30.21 H new ATOM 0 HG2 MET A 55 -13.768 -30.493 -39.405 1.00 73.32 H new ATOM 0 HG3 MET A 55 -12.031 -30.269 -39.467 1.00 73.32 H new ATOM 0 HE1 MET A 55 -11.834 -31.817 -42.873 1.00 63.31 H new ATOM 0 HE2 MET A 55 -12.614 -30.368 -42.196 1.00 63.31 H new ATOM 0 HE3 MET A 55 -10.995 -30.851 -41.637 1.00 63.31 H new ATOM 835 N LYS A 56 -10.520 -30.185 -35.621 1.00 73.51 N ATOM 836 CA LYS A 56 -9.165 -29.678 -35.441 1.00 30.44 C ATOM 837 C LYS A 56 -8.238 -30.207 -36.531 1.00 41.50 C ATOM 838 O LYS A 56 -7.345 -29.499 -36.999 1.00 2.12 O ATOM 839 CB LYS A 56 -8.628 -30.074 -34.064 1.00 45.11 C ATOM 840 CG LYS A 56 -8.515 -31.576 -33.865 1.00 53.43 C ATOM 841 CD LYS A 56 -8.903 -31.981 -32.453 1.00 35.32 C ATOM 842 CE LYS A 56 -7.709 -31.937 -31.512 1.00 75.11 C ATOM 843 NZ LYS A 56 -6.942 -33.215 -31.529 1.00 63.15 N ATOM 0 H LYS A 56 -10.921 -30.620 -34.790 1.00 73.51 H new ATOM 0 HA LYS A 56 -9.198 -28.591 -35.512 1.00 30.44 H new ATOM 0 HB2 LYS A 56 -7.646 -29.622 -33.922 1.00 45.11 H new ATOM 0 HB3 LYS A 56 -9.282 -29.662 -33.296 1.00 45.11 H new ATOM 0 HG2 LYS A 56 -9.157 -32.088 -34.581 1.00 53.43 H new ATOM 0 HG3 LYS A 56 -7.493 -31.895 -34.068 1.00 53.43 H new ATOM 0 HD2 LYS A 56 -9.683 -31.315 -32.084 1.00 35.32 H new ATOM 0 HD3 LYS A 56 -9.322 -32.987 -32.464 1.00 35.32 H new ATOM 0 HE2 LYS A 56 -7.052 -31.115 -31.797 1.00 75.11 H new ATOM 0 HE3 LYS A 56 -8.053 -31.733 -30.498 1.00 75.11 H new ATOM 0 HZ1 LYS A 56 -6.136 -33.145 -30.875 1.00 63.15 H new ATOM 0 HZ2 LYS A 56 -7.562 -33.996 -31.233 1.00 63.15 H new ATOM 0 HZ3 LYS A 56 -6.592 -33.397 -32.491 1.00 63.15 H new ATOM 857 N THR A 57 -8.455 -31.455 -36.933 1.00 13.51 N ATOM 858 CA THR A 57 -7.640 -32.077 -37.969 1.00 34.53 C ATOM 859 C THR A 57 -6.168 -32.099 -37.571 1.00 21.13 C ATOM 860 O THR A 57 -5.351 -31.330 -38.077 1.00 25.31 O ATOM 861 CB THR A 57 -7.784 -31.343 -39.315 1.00 21.51 C ATOM 862 OG1 THR A 57 -9.144 -30.938 -39.508 1.00 43.40 O ATOM 863 CG2 THR A 57 -7.348 -32.235 -40.467 1.00 25.41 C ATOM 0 H THR A 57 -9.189 -32.055 -36.557 1.00 13.51 H new ATOM 0 HA THR A 57 -8.000 -33.100 -38.081 1.00 34.53 H new ATOM 0 HB THR A 57 -7.142 -30.463 -39.295 1.00 21.51 H new ATOM 0 HG1 THR A 57 -9.369 -30.232 -38.867 1.00 43.40 H new ATOM 0 HG21 THR A 57 -7.459 -31.695 -41.407 1.00 25.41 H new ATOM 0 HG22 THR A 57 -6.304 -32.519 -40.332 1.00 25.41 H new ATOM 0 HG23 THR A 57 -7.968 -33.131 -40.488 1.00 25.41 H new ATOM 871 N PRO A 58 -5.820 -33.000 -36.640 1.00 43.24 N ATOM 872 CA PRO A 58 -4.444 -33.145 -36.155 1.00 24.54 C ATOM 873 C PRO A 58 -3.514 -33.730 -37.212 1.00 65.13 C ATOM 874 O PRO A 58 -3.634 -34.899 -37.581 1.00 34.13 O ATOM 875 CB PRO A 58 -4.585 -34.108 -34.973 1.00 65.24 C ATOM 876 CG PRO A 58 -5.819 -34.889 -35.266 1.00 71.32 C ATOM 877 CD PRO A 58 -6.740 -33.949 -35.993 1.00 43.21 C ATOM 0 HA PRO A 58 -4.002 -32.185 -35.890 1.00 24.54 H new ATOM 0 HB2 PRO A 58 -3.715 -34.759 -34.887 1.00 65.24 H new ATOM 0 HB3 PRO A 58 -4.673 -33.568 -34.030 1.00 65.24 H new ATOM 0 HG2 PRO A 58 -5.592 -35.763 -35.876 1.00 71.32 H new ATOM 0 HG3 PRO A 58 -6.278 -35.253 -34.347 1.00 71.32 H new ATOM 0 HD2 PRO A 58 -7.355 -34.474 -36.724 1.00 43.21 H new ATOM 0 HD3 PRO A 58 -7.421 -33.444 -35.308 1.00 43.21 H new ATOM 885 N LEU A 59 -2.587 -32.912 -37.696 1.00 14.11 N ATOM 886 CA LEU A 59 -1.635 -33.348 -38.711 1.00 65.44 C ATOM 887 C LEU A 59 -0.340 -33.837 -38.070 1.00 31.20 C ATOM 888 O LEU A 59 0.016 -33.447 -36.958 1.00 24.13 O ATOM 889 CB LEU A 59 -1.336 -32.206 -39.684 1.00 44.34 C ATOM 890 CG LEU A 59 -2.469 -31.203 -39.910 1.00 52.30 C ATOM 891 CD1 LEU A 59 -1.983 -30.028 -40.744 1.00 65.23 C ATOM 892 CD2 LEU A 59 -3.654 -31.881 -40.581 1.00 53.13 C ATOM 0 H LEU A 59 -2.474 -31.942 -37.402 1.00 14.11 H new ATOM 0 HA LEU A 59 -2.083 -34.177 -39.260 1.00 65.44 H new ATOM 0 HB2 LEU A 59 -0.464 -31.663 -39.319 1.00 44.34 H new ATOM 0 HB3 LEU A 59 -1.062 -32.638 -40.647 1.00 44.34 H new ATOM 0 HG LEU A 59 -2.793 -30.825 -38.940 1.00 52.30 H new ATOM 0 HD11 LEU A 59 -2.802 -29.325 -40.894 1.00 65.23 H new ATOM 0 HD12 LEU A 59 -1.166 -29.527 -40.225 1.00 65.23 H new ATOM 0 HD13 LEU A 59 -1.632 -30.389 -41.711 1.00 65.23 H new ATOM 0 HD21 LEU A 59 -4.451 -31.153 -40.734 1.00 53.13 H new ATOM 0 HD22 LEU A 59 -3.344 -32.287 -41.544 1.00 53.13 H new ATOM 0 HD23 LEU A 59 -4.018 -32.689 -39.947 1.00 53.13 H new ATOM 904 N PRO A 60 0.384 -34.708 -38.788 1.00 30.25 N ATOM 905 CA PRO A 60 1.653 -35.266 -38.309 1.00 21.42 C ATOM 906 C PRO A 60 2.765 -34.225 -38.269 1.00 22.42 C ATOM 907 O PRO A 60 2.610 -33.116 -38.783 1.00 33.21 O ATOM 908 CB PRO A 60 1.973 -36.352 -39.340 1.00 61.21 C ATOM 909 CG PRO A 60 1.269 -35.918 -40.579 1.00 52.43 C ATOM 910 CD PRO A 60 0.020 -35.216 -40.121 1.00 12.11 C ATOM 0 HA PRO A 60 1.576 -35.638 -37.287 1.00 21.42 H new ATOM 0 HB2 PRO A 60 3.047 -36.437 -39.504 1.00 61.21 H new ATOM 0 HB3 PRO A 60 1.623 -37.329 -39.007 1.00 61.21 H new ATOM 0 HG2 PRO A 60 1.896 -35.252 -41.171 1.00 52.43 H new ATOM 0 HG3 PRO A 60 1.027 -36.773 -41.210 1.00 52.43 H new ATOM 0 HD2 PRO A 60 -0.258 -34.407 -40.797 1.00 12.11 H new ATOM 0 HD3 PRO A 60 -0.829 -35.897 -40.073 1.00 12.11 H new ATOM 918 N ARG A 61 3.887 -34.588 -37.655 1.00 0.41 N ATOM 919 CA ARG A 61 5.026 -33.684 -37.547 1.00 34.14 C ATOM 920 C ARG A 61 5.400 -33.116 -38.913 1.00 74.21 C ATOM 921 O ARG A 61 5.580 -31.907 -39.065 1.00 61.25 O ATOM 922 CB ARG A 61 6.226 -34.412 -36.939 1.00 53.11 C ATOM 923 CG ARG A 61 6.548 -35.730 -37.622 1.00 10.33 C ATOM 924 CD ARG A 61 7.595 -36.517 -36.849 1.00 41.05 C ATOM 925 NE ARG A 61 7.553 -37.942 -37.165 1.00 43.43 N ATOM 926 CZ ARG A 61 8.211 -38.868 -36.475 1.00 61.31 C ATOM 927 NH1 ARG A 61 8.956 -38.519 -35.436 1.00 45.12 N ATOM 928 NH2 ARG A 61 8.122 -40.144 -36.823 1.00 22.22 N ATOM 0 H ARG A 61 4.031 -35.502 -37.225 1.00 0.41 H new ATOM 0 HA ARG A 61 4.742 -32.858 -36.895 1.00 34.14 H new ATOM 0 HB2 ARG A 61 7.099 -33.762 -36.992 1.00 53.11 H new ATOM 0 HB3 ARG A 61 6.031 -34.598 -35.883 1.00 53.11 H new ATOM 0 HG2 ARG A 61 5.639 -36.325 -37.714 1.00 10.33 H new ATOM 0 HG3 ARG A 61 6.908 -35.539 -38.633 1.00 10.33 H new ATOM 0 HD2 ARG A 61 8.586 -36.124 -37.078 1.00 41.05 H new ATOM 0 HD3 ARG A 61 7.436 -36.378 -35.780 1.00 41.05 H new ATOM 0 HE ARG A 61 6.988 -38.243 -37.959 1.00 43.43 H new ATOM 0 HH11 ARG A 61 9.025 -37.538 -35.165 1.00 45.12 H new ATOM 0 HH12 ARG A 61 9.460 -39.231 -34.908 1.00 45.12 H new ATOM 0 HH21 ARG A 61 7.548 -40.416 -37.621 1.00 22.22 H new ATOM 0 HH22 ARG A 61 8.627 -40.854 -36.293 1.00 22.22 H new ATOM 942 N ASP A 62 5.517 -33.995 -39.901 1.00 20.25 N ATOM 943 CA ASP A 62 5.869 -33.582 -41.255 1.00 21.54 C ATOM 944 C ASP A 62 4.956 -32.457 -41.735 1.00 32.34 C ATOM 945 O ASP A 62 5.410 -31.503 -42.368 1.00 61.04 O ATOM 946 CB ASP A 62 5.781 -34.769 -42.214 1.00 41.05 C ATOM 947 CG ASP A 62 6.356 -34.455 -43.581 1.00 10.43 C ATOM 948 OD1 ASP A 62 5.605 -33.943 -44.438 1.00 4.40 O ATOM 949 OD2 ASP A 62 7.558 -34.718 -43.793 1.00 14.21 O ATOM 0 H ASP A 62 5.373 -34.999 -39.790 1.00 20.25 H new ATOM 0 HA ASP A 62 6.895 -33.213 -41.239 1.00 21.54 H new ATOM 0 HB2 ASP A 62 6.314 -35.618 -41.786 1.00 41.05 H new ATOM 0 HB3 ASP A 62 4.738 -35.068 -42.322 1.00 41.05 H new ATOM 954 N MET A 63 3.668 -32.575 -41.429 1.00 53.24 N ATOM 955 CA MET A 63 2.693 -31.568 -41.829 1.00 13.24 C ATOM 956 C MET A 63 2.900 -30.271 -41.054 1.00 65.25 C ATOM 957 O MET A 63 2.778 -29.178 -41.609 1.00 3.03 O ATOM 958 CB MET A 63 1.271 -32.087 -41.605 1.00 42.01 C ATOM 959 CG MET A 63 0.725 -32.888 -42.777 1.00 11.42 C ATOM 960 SD MET A 63 0.439 -31.873 -44.240 1.00 42.14 S ATOM 961 CE MET A 63 -0.822 -30.756 -43.634 1.00 0.01 C ATOM 0 H MET A 63 3.276 -33.358 -40.906 1.00 53.24 H new ATOM 0 HA MET A 63 2.835 -31.363 -42.890 1.00 13.24 H new ATOM 0 HB2 MET A 63 1.257 -32.711 -40.711 1.00 42.01 H new ATOM 0 HB3 MET A 63 0.610 -31.241 -41.414 1.00 42.01 H new ATOM 0 HG2 MET A 63 1.425 -33.686 -43.024 1.00 11.42 H new ATOM 0 HG3 MET A 63 -0.210 -33.365 -42.482 1.00 11.42 H new ATOM 0 HE1 MET A 63 -1.232 -30.184 -44.466 1.00 0.01 H new ATOM 0 HE2 MET A 63 -1.619 -31.329 -43.161 1.00 0.01 H new ATOM 0 HE3 MET A 63 -0.384 -30.074 -42.905 1.00 0.01 H new ATOM 971 N LEU A 64 3.215 -30.399 -39.770 1.00 14.34 N ATOM 972 CA LEU A 64 3.441 -29.236 -38.918 1.00 1.43 C ATOM 973 C LEU A 64 4.665 -28.453 -39.378 1.00 75.42 C ATOM 974 O LEU A 64 4.628 -27.226 -39.481 1.00 34.12 O ATOM 975 CB LEU A 64 3.617 -29.673 -37.462 1.00 63.25 C ATOM 976 CG LEU A 64 3.655 -28.550 -36.426 1.00 62.31 C ATOM 977 CD1 LEU A 64 2.449 -27.637 -36.582 1.00 71.11 C ATOM 978 CD2 LEU A 64 3.710 -29.126 -35.017 1.00 54.15 C ATOM 0 H LEU A 64 3.320 -31.296 -39.296 1.00 14.34 H new ATOM 0 HA LEU A 64 2.569 -28.586 -38.993 1.00 1.43 H new ATOM 0 HB2 LEU A 64 2.802 -30.350 -37.205 1.00 63.25 H new ATOM 0 HB3 LEU A 64 4.542 -30.244 -37.384 1.00 63.25 H new ATOM 0 HG LEU A 64 4.556 -27.959 -36.593 1.00 62.31 H new ATOM 0 HD11 LEU A 64 2.494 -26.844 -35.836 1.00 71.11 H new ATOM 0 HD12 LEU A 64 2.452 -27.197 -37.579 1.00 71.11 H new ATOM 0 HD13 LEU A 64 1.535 -28.214 -36.443 1.00 71.11 H new ATOM 0 HD21 LEU A 64 3.737 -28.312 -34.292 1.00 54.15 H new ATOM 0 HD22 LEU A 64 2.827 -29.741 -34.840 1.00 54.15 H new ATOM 0 HD23 LEU A 64 4.606 -29.738 -34.909 1.00 54.15 H new ATOM 990 N VAL A 65 5.749 -29.169 -39.658 1.00 60.43 N ATOM 991 CA VAL A 65 6.984 -28.541 -40.112 1.00 33.20 C ATOM 992 C VAL A 65 6.823 -27.959 -41.512 1.00 30.12 C ATOM 993 O VAL A 65 7.380 -26.908 -41.824 1.00 14.41 O ATOM 994 CB VAL A 65 8.154 -29.543 -40.115 1.00 1.30 C ATOM 995 CG1 VAL A 65 7.855 -30.710 -41.044 1.00 40.51 C ATOM 996 CG2 VAL A 65 9.447 -28.849 -40.517 1.00 63.40 C ATOM 0 H VAL A 65 5.797 -30.185 -39.578 1.00 60.43 H new ATOM 0 HA VAL A 65 7.206 -27.736 -39.411 1.00 33.20 H new ATOM 0 HB VAL A 65 8.277 -29.936 -39.106 1.00 1.30 H new ATOM 0 HG11 VAL A 65 8.693 -31.407 -41.033 1.00 40.51 H new ATOM 0 HG12 VAL A 65 6.953 -31.221 -40.708 1.00 40.51 H new ATOM 0 HG13 VAL A 65 7.705 -30.339 -42.058 1.00 40.51 H new ATOM 0 HG21 VAL A 65 10.264 -29.571 -40.514 1.00 63.40 H new ATOM 0 HG22 VAL A 65 9.338 -28.428 -41.517 1.00 63.40 H new ATOM 0 HG23 VAL A 65 9.667 -28.050 -39.809 1.00 63.40 H new ATOM 1006 N GLU A 66 6.058 -28.651 -42.350 1.00 3.23 N ATOM 1007 CA GLU A 66 5.823 -28.202 -43.717 1.00 12.04 C ATOM 1008 C GLU A 66 5.001 -26.917 -43.734 1.00 55.20 C ATOM 1009 O GLU A 66 5.222 -26.035 -44.565 1.00 0.24 O ATOM 1010 CB GLU A 66 5.107 -29.291 -44.519 1.00 35.21 C ATOM 1011 CG GLU A 66 4.635 -28.827 -45.887 1.00 2.33 C ATOM 1012 CD GLU A 66 4.648 -29.939 -46.917 1.00 0.21 C ATOM 1013 OE1 GLU A 66 5.689 -30.122 -47.581 1.00 20.23 O ATOM 1014 OE2 GLU A 66 3.615 -30.629 -47.057 1.00 75.45 O ATOM 0 H GLU A 66 5.591 -29.524 -42.106 1.00 3.23 H new ATOM 0 HA GLU A 66 6.790 -27.999 -44.177 1.00 12.04 H new ATOM 0 HB2 GLU A 66 5.779 -30.140 -44.644 1.00 35.21 H new ATOM 0 HB3 GLU A 66 4.249 -29.646 -43.949 1.00 35.21 H new ATOM 0 HG2 GLU A 66 3.624 -28.427 -45.802 1.00 2.33 H new ATOM 0 HG3 GLU A 66 5.272 -28.012 -46.230 1.00 2.33 H new ATOM 1021 N LEU A 67 4.049 -26.819 -42.812 1.00 61.43 N ATOM 1022 CA LEU A 67 3.191 -25.643 -42.720 1.00 23.04 C ATOM 1023 C LEU A 67 3.929 -24.480 -42.065 1.00 23.53 C ATOM 1024 O LEU A 67 3.786 -23.327 -42.476 1.00 22.05 O ATOM 1025 CB LEU A 67 1.925 -25.970 -41.927 1.00 45.14 C ATOM 1026 CG LEU A 67 0.720 -26.433 -42.746 1.00 11.34 C ATOM 1027 CD1 LEU A 67 -0.394 -26.916 -41.830 1.00 35.45 C ATOM 1028 CD2 LEU A 67 0.224 -25.310 -43.645 1.00 5.32 C ATOM 0 H LEU A 67 3.852 -27.540 -42.118 1.00 61.43 H new ATOM 0 HA LEU A 67 2.912 -25.349 -43.732 1.00 23.04 H new ATOM 0 HB2 LEU A 67 2.166 -26.747 -41.201 1.00 45.14 H new ATOM 0 HB3 LEU A 67 1.636 -25.084 -41.362 1.00 45.14 H new ATOM 0 HG LEU A 67 1.031 -27.266 -43.376 1.00 11.34 H new ATOM 0 HD11 LEU A 67 -1.243 -27.242 -42.431 1.00 35.45 H new ATOM 0 HD12 LEU A 67 -0.034 -27.750 -41.228 1.00 35.45 H new ATOM 0 HD13 LEU A 67 -0.704 -26.103 -41.174 1.00 35.45 H new ATOM 0 HD21 LEU A 67 -0.634 -25.657 -44.221 1.00 5.32 H new ATOM 0 HD22 LEU A 67 -0.070 -24.457 -43.033 1.00 5.32 H new ATOM 0 HD23 LEU A 67 1.021 -25.010 -44.326 1.00 5.32 H new ATOM 1040 N LEU A 68 4.721 -24.788 -41.044 1.00 41.32 N ATOM 1041 CA LEU A 68 5.485 -23.770 -40.332 1.00 53.11 C ATOM 1042 C LEU A 68 6.650 -23.271 -41.181 1.00 31.03 C ATOM 1043 O LEU A 68 7.006 -22.093 -41.132 1.00 11.12 O ATOM 1044 CB LEU A 68 6.006 -24.328 -39.007 1.00 0.12 C ATOM 1045 CG LEU A 68 7.477 -24.745 -38.987 1.00 5.35 C ATOM 1046 CD1 LEU A 68 8.374 -23.531 -38.801 1.00 44.43 C ATOM 1047 CD2 LEU A 68 7.727 -25.767 -37.888 1.00 42.54 C ATOM 0 H LEU A 68 4.851 -25.736 -40.690 1.00 41.32 H new ATOM 0 HA LEU A 68 4.822 -22.929 -40.128 1.00 53.11 H new ATOM 0 HB2 LEU A 68 5.852 -23.576 -38.233 1.00 0.12 H new ATOM 0 HB3 LEU A 68 5.400 -25.193 -38.737 1.00 0.12 H new ATOM 0 HG LEU A 68 7.717 -25.205 -39.946 1.00 5.35 H new ATOM 0 HD11 LEU A 68 9.417 -23.848 -38.789 1.00 44.43 H new ATOM 0 HD12 LEU A 68 8.216 -22.833 -39.623 1.00 44.43 H new ATOM 0 HD13 LEU A 68 8.133 -23.042 -37.857 1.00 44.43 H new ATOM 0 HD21 LEU A 68 8.779 -26.052 -37.889 1.00 42.54 H new ATOM 0 HD22 LEU A 68 7.469 -25.333 -36.922 1.00 42.54 H new ATOM 0 HD23 LEU A 68 7.112 -26.649 -38.065 1.00 42.54 H new ATOM 1059 N ARG A 69 7.238 -24.173 -41.959 1.00 12.34 N ATOM 1060 CA ARG A 69 8.363 -23.825 -42.818 1.00 34.44 C ATOM 1061 C ARG A 69 7.890 -23.044 -44.041 1.00 1.42 C ATOM 1062 O ARG A 69 8.543 -22.095 -44.474 1.00 11.31 O ATOM 1063 CB ARG A 69 9.104 -25.087 -43.262 1.00 21.44 C ATOM 1064 CG ARG A 69 8.379 -25.871 -44.343 1.00 10.44 C ATOM 1065 CD ARG A 69 9.142 -27.130 -44.725 1.00 55.20 C ATOM 1066 NE ARG A 69 10.338 -26.828 -45.507 1.00 2.33 N ATOM 1067 CZ ARG A 69 11.240 -27.741 -45.852 1.00 64.35 C ATOM 1068 NH1 ARG A 69 11.082 -29.005 -45.486 1.00 40.04 N ATOM 1069 NH2 ARG A 69 12.303 -27.389 -46.564 1.00 32.44 N ATOM 0 H ARG A 69 6.954 -25.151 -42.012 1.00 12.34 H new ATOM 0 HA ARG A 69 9.044 -23.195 -42.245 1.00 34.44 H new ATOM 0 HB2 ARG A 69 10.092 -24.808 -43.628 1.00 21.44 H new ATOM 0 HB3 ARG A 69 9.255 -25.732 -42.397 1.00 21.44 H new ATOM 0 HG2 ARG A 69 7.383 -26.140 -43.992 1.00 10.44 H new ATOM 0 HG3 ARG A 69 8.248 -25.242 -45.224 1.00 10.44 H new ATOM 0 HD2 ARG A 69 9.426 -27.670 -43.822 1.00 55.20 H new ATOM 0 HD3 ARG A 69 8.490 -27.789 -45.299 1.00 55.20 H new ATOM 0 HE ARG A 69 10.489 -25.864 -45.804 1.00 2.33 H new ATOM 0 HH11 ARG A 69 10.266 -29.279 -44.938 1.00 40.04 H new ATOM 0 HH12 ARG A 69 11.776 -29.704 -45.752 1.00 40.04 H new ATOM 0 HH21 ARG A 69 12.428 -26.417 -46.847 1.00 32.44 H new ATOM 0 HH22 ARG A 69 12.995 -28.090 -46.828 1.00 32.44 H new ATOM 1083 N GLN A 70 6.751 -23.451 -44.594 1.00 34.24 N ATOM 1084 CA GLN A 70 6.192 -22.790 -45.767 1.00 51.24 C ATOM 1085 C GLN A 70 5.491 -21.492 -45.379 1.00 30.33 C ATOM 1086 O GLN A 70 5.390 -20.567 -46.182 1.00 64.14 O ATOM 1087 CB GLN A 70 5.210 -23.720 -46.483 1.00 63.42 C ATOM 1088 CG GLN A 70 3.849 -23.801 -45.810 1.00 13.44 C ATOM 1089 CD GLN A 70 2.938 -24.823 -46.460 1.00 31.34 C ATOM 1090 OE1 GLN A 70 1.785 -24.529 -46.780 1.00 73.41 O ATOM 1091 NE2 GLN A 70 3.450 -26.032 -46.659 1.00 22.35 N ATOM 0 H GLN A 70 6.198 -24.235 -44.248 1.00 34.24 H new ATOM 0 HA GLN A 70 7.013 -22.550 -46.443 1.00 51.24 H new ATOM 0 HB2 GLN A 70 5.079 -23.376 -47.509 1.00 63.42 H new ATOM 0 HB3 GLN A 70 5.641 -24.720 -46.534 1.00 63.42 H new ATOM 0 HG2 GLN A 70 3.982 -24.055 -44.758 1.00 13.44 H new ATOM 0 HG3 GLN A 70 3.372 -22.821 -45.843 1.00 13.44 H new ATOM 0 HE21 GLN A 70 4.410 -26.232 -46.378 1.00 22.35 H new ATOM 0 HE22 GLN A 70 2.883 -26.761 -47.093 1.00 22.35 H new ATOM 1100 N MET A 71 5.009 -21.433 -44.141 1.00 42.23 N ATOM 1101 CA MET A 71 4.318 -20.248 -43.647 1.00 13.45 C ATOM 1102 C MET A 71 5.202 -19.012 -43.771 1.00 23.25 C ATOM 1103 O MET A 71 4.860 -18.060 -44.471 1.00 33.35 O ATOM 1104 CB MET A 71 3.900 -20.446 -42.189 1.00 24.40 C ATOM 1105 CG MET A 71 2.425 -20.774 -42.018 1.00 30.35 C ATOM 1106 SD MET A 71 2.062 -21.534 -40.425 1.00 45.05 S ATOM 1107 CE MET A 71 0.764 -22.680 -40.885 1.00 51.25 C ATOM 0 H MET A 71 5.084 -22.191 -43.463 1.00 42.23 H new ATOM 0 HA MET A 71 3.426 -20.098 -44.256 1.00 13.45 H new ATOM 0 HB2 MET A 71 4.495 -21.250 -41.755 1.00 24.40 H new ATOM 0 HB3 MET A 71 4.130 -19.540 -41.628 1.00 24.40 H new ATOM 0 HG2 MET A 71 1.839 -19.861 -42.122 1.00 30.35 H new ATOM 0 HG3 MET A 71 2.111 -21.446 -42.817 1.00 30.35 H new ATOM 0 HE1 MET A 71 0.714 -23.486 -40.153 1.00 51.25 H new ATOM 0 HE2 MET A 71 -0.191 -22.155 -40.914 1.00 51.25 H new ATOM 0 HE3 MET A 71 0.979 -23.097 -41.869 1.00 51.25 H new ATOM 1117 N ALA A 72 6.341 -19.034 -43.086 1.00 35.32 N ATOM 1118 CA ALA A 72 7.276 -17.916 -43.121 1.00 55.31 C ATOM 1119 C ALA A 72 8.685 -18.388 -43.464 1.00 33.21 C ATOM 1120 O ALA A 72 9.197 -18.109 -44.548 1.00 11.53 O ATOM 1121 CB ALA A 72 7.272 -17.182 -41.789 1.00 23.55 C ATOM 0 H ALA A 72 6.638 -19.814 -42.500 1.00 35.32 H new ATOM 0 HA ALA A 72 6.952 -17.229 -43.902 1.00 55.31 H new ATOM 0 HB1 ALA A 72 7.975 -16.350 -41.830 1.00 23.55 H new ATOM 0 HB2 ALA A 72 6.271 -16.802 -41.586 1.00 23.55 H new ATOM 0 HB3 ALA A 72 7.568 -17.868 -40.995 1.00 23.55 H new ATOM 1127 N ILE A 73 9.307 -19.102 -42.531 1.00 64.14 N ATOM 1128 CA ILE A 73 10.656 -19.612 -42.735 1.00 43.01 C ATOM 1129 C ILE A 73 10.853 -20.946 -42.020 1.00 25.34 C ATOM 1130 O ILE A 73 9.974 -21.409 -41.295 1.00 0.23 O ATOM 1131 CB ILE A 73 11.718 -18.614 -42.236 1.00 11.52 C ATOM 1132 CG1 ILE A 73 11.936 -18.778 -40.730 1.00 44.51 C ATOM 1133 CG2 ILE A 73 11.299 -17.189 -42.565 1.00 21.24 C ATOM 1134 CD1 ILE A 73 10.661 -18.677 -39.921 1.00 61.14 C ATOM 0 H ILE A 73 8.898 -19.340 -41.627 1.00 64.14 H new ATOM 0 HA ILE A 73 10.780 -19.755 -43.808 1.00 43.01 H new ATOM 0 HB ILE A 73 12.660 -18.822 -42.744 1.00 11.52 H new ATOM 0 HG12 ILE A 73 12.401 -19.746 -40.541 1.00 44.51 H new ATOM 0 HG13 ILE A 73 12.636 -18.016 -40.387 1.00 44.51 H new ATOM 0 HG21 ILE A 73 12.059 -16.494 -42.207 1.00 21.24 H new ATOM 0 HG22 ILE A 73 11.190 -17.082 -43.644 1.00 21.24 H new ATOM 0 HG23 ILE A 73 10.348 -16.968 -42.080 1.00 21.24 H new ATOM 0 HD11 ILE A 73 10.891 -18.803 -38.863 1.00 61.14 H new ATOM 0 HD12 ILE A 73 10.206 -17.699 -40.080 1.00 61.14 H new ATOM 0 HD13 ILE A 73 9.967 -19.456 -40.237 1.00 61.14 H new ATOM 1146 N SER A 74 12.015 -21.557 -42.231 1.00 32.21 N ATOM 1147 CA SER A 74 12.327 -22.839 -41.609 1.00 73.54 C ATOM 1148 C SER A 74 12.033 -22.802 -40.113 1.00 72.24 C ATOM 1149 O SER A 74 11.906 -21.739 -39.505 1.00 34.20 O ATOM 1150 CB SER A 74 13.797 -23.198 -41.843 1.00 63.22 C ATOM 1151 OG SER A 74 14.581 -22.905 -40.699 1.00 41.24 O ATOM 0 H SER A 74 12.755 -21.186 -42.827 1.00 32.21 H new ATOM 0 HA SER A 74 11.696 -23.601 -42.067 1.00 73.54 H new ATOM 0 HB2 SER A 74 13.882 -24.257 -42.085 1.00 63.22 H new ATOM 0 HB3 SER A 74 14.178 -22.644 -42.701 1.00 63.22 H new ATOM 0 HG SER A 74 15.137 -23.680 -40.476 1.00 41.24 H new ATOM 1157 N PRO A 75 11.921 -23.992 -39.503 1.00 41.51 N ATOM 1158 CA PRO A 75 11.641 -24.124 -38.071 1.00 72.44 C ATOM 1159 C PRO A 75 12.817 -23.682 -37.206 1.00 60.14 C ATOM 1160 O PRO A 75 12.671 -23.480 -36.000 1.00 52.42 O ATOM 1161 CB PRO A 75 11.382 -25.623 -37.896 1.00 14.45 C ATOM 1162 CG PRO A 75 12.124 -26.267 -39.017 1.00 50.42 C ATOM 1163 CD PRO A 75 12.061 -25.300 -40.166 1.00 61.11 C ATOM 0 HA PRO A 75 10.807 -23.494 -37.760 1.00 72.44 H new ATOM 0 HB2 PRO A 75 11.740 -25.977 -36.929 1.00 14.45 H new ATOM 0 HB3 PRO A 75 10.317 -25.849 -37.944 1.00 14.45 H new ATOM 0 HG2 PRO A 75 13.157 -26.471 -38.735 1.00 50.42 H new ATOM 0 HG3 PRO A 75 11.673 -27.222 -39.286 1.00 50.42 H new ATOM 0 HD2 PRO A 75 12.961 -25.345 -40.779 1.00 61.11 H new ATOM 0 HD3 PRO A 75 11.217 -25.510 -40.823 1.00 61.11 H new ATOM 1171 N ARG A 76 13.981 -23.534 -37.830 1.00 4.13 N ATOM 1172 CA ARG A 76 15.181 -23.116 -37.117 1.00 63.45 C ATOM 1173 C ARG A 76 15.092 -21.648 -36.713 1.00 44.41 C ATOM 1174 O ARG A 76 15.634 -21.241 -35.687 1.00 62.30 O ATOM 1175 CB ARG A 76 16.421 -23.342 -37.986 1.00 54.44 C ATOM 1176 CG ARG A 76 17.687 -23.601 -37.186 1.00 23.32 C ATOM 1177 CD ARG A 76 18.808 -24.123 -38.070 1.00 44.15 C ATOM 1178 NE ARG A 76 19.202 -23.151 -39.085 1.00 24.42 N ATOM 1179 CZ ARG A 76 20.301 -23.263 -39.823 1.00 13.40 C ATOM 1180 NH1 ARG A 76 21.111 -24.300 -39.659 1.00 60.15 N ATOM 1181 NH2 ARG A 76 20.592 -22.336 -40.727 1.00 3.25 N ATOM 0 H ARG A 76 14.118 -23.697 -38.827 1.00 4.13 H new ATOM 0 HA ARG A 76 15.263 -23.719 -36.213 1.00 63.45 H new ATOM 0 HB2 ARG A 76 16.240 -24.189 -38.648 1.00 54.44 H new ATOM 0 HB3 ARG A 76 16.574 -22.468 -38.620 1.00 54.44 H new ATOM 0 HG2 ARG A 76 18.006 -22.679 -36.699 1.00 23.32 H new ATOM 0 HG3 ARG A 76 17.478 -24.323 -36.397 1.00 23.32 H new ATOM 0 HD2 ARG A 76 19.671 -24.372 -37.452 1.00 44.15 H new ATOM 0 HD3 ARG A 76 18.487 -25.045 -38.556 1.00 44.15 H new ATOM 0 HE ARG A 76 18.600 -22.341 -39.236 1.00 24.42 H new ATOM 0 HH11 ARG A 76 20.891 -25.014 -38.965 1.00 60.15 H new ATOM 0 HH12 ARG A 76 21.954 -24.383 -40.227 1.00 60.15 H new ATOM 0 HH21 ARG A 76 19.972 -21.537 -40.856 1.00 3.25 H new ATOM 0 HH22 ARG A 76 21.436 -22.423 -41.293 1.00 3.25 H new ATOM 1195 N ALA A 77 14.402 -20.856 -37.530 1.00 33.33 N ATOM 1196 CA ALA A 77 14.240 -19.433 -37.257 1.00 0.30 C ATOM 1197 C ALA A 77 12.781 -19.090 -36.983 1.00 42.12 C ATOM 1198 O ALA A 77 12.342 -17.963 -37.218 1.00 44.41 O ATOM 1199 CB ALA A 77 14.768 -18.609 -38.423 1.00 24.14 C ATOM 0 H ALA A 77 13.947 -21.176 -38.385 1.00 33.33 H new ATOM 0 HA ALA A 77 14.817 -19.191 -36.364 1.00 0.30 H new ATOM 0 HB1 ALA A 77 14.641 -17.548 -38.206 1.00 24.14 H new ATOM 0 HB2 ALA A 77 15.826 -18.825 -38.571 1.00 24.14 H new ATOM 0 HB3 ALA A 77 14.216 -18.863 -39.328 1.00 24.14 H new ATOM 1205 N LEU A 78 12.031 -20.068 -36.484 1.00 45.55 N ATOM 1206 CA LEU A 78 10.619 -19.869 -36.178 1.00 52.13 C ATOM 1207 C LEU A 78 10.414 -19.635 -34.685 1.00 71.23 C ATOM 1208 O LEU A 78 9.668 -18.740 -34.283 1.00 74.40 O ATOM 1209 CB LEU A 78 9.803 -21.081 -36.633 1.00 62.51 C ATOM 1210 CG LEU A 78 8.292 -20.992 -36.417 1.00 13.22 C ATOM 1211 CD1 LEU A 78 7.934 -21.370 -34.988 1.00 31.23 C ATOM 1212 CD2 LEU A 78 7.788 -19.593 -36.744 1.00 4.23 C ATOM 0 H LEU A 78 12.378 -21.006 -36.283 1.00 45.55 H new ATOM 0 HA LEU A 78 10.276 -18.985 -36.716 1.00 52.13 H new ATOM 0 HB2 LEU A 78 9.989 -21.241 -37.695 1.00 62.51 H new ATOM 0 HB3 LEU A 78 10.174 -21.961 -36.108 1.00 62.51 H new ATOM 0 HG LEU A 78 7.805 -21.698 -37.090 1.00 13.22 H new ATOM 0 HD11 LEU A 78 6.855 -21.301 -34.853 1.00 31.23 H new ATOM 0 HD12 LEU A 78 8.260 -22.391 -34.789 1.00 31.23 H new ATOM 0 HD13 LEU A 78 8.431 -20.689 -34.296 1.00 31.23 H new ATOM 0 HD21 LEU A 78 6.711 -19.548 -36.585 1.00 4.23 H new ATOM 0 HD22 LEU A 78 8.281 -18.868 -36.097 1.00 4.23 H new ATOM 0 HD23 LEU A 78 8.011 -19.360 -37.785 1.00 4.23 H new ATOM 1224 N LEU A 79 11.080 -20.442 -33.867 1.00 31.22 N ATOM 1225 CA LEU A 79 10.973 -20.322 -32.418 1.00 1.32 C ATOM 1226 C LEU A 79 11.323 -18.910 -31.961 1.00 4.10 C ATOM 1227 O LEU A 79 12.492 -18.524 -31.944 1.00 33.52 O ATOM 1228 CB LEU A 79 11.892 -21.335 -31.732 1.00 2.15 C ATOM 1229 CG LEU A 79 11.317 -22.738 -31.536 1.00 5.12 C ATOM 1230 CD1 LEU A 79 10.175 -22.712 -30.534 1.00 31.44 C ATOM 1231 CD2 LEU A 79 10.850 -23.313 -32.866 1.00 42.04 C ATOM 0 H LEU A 79 11.700 -21.187 -34.183 1.00 31.22 H new ATOM 0 HA LEU A 79 9.940 -20.530 -32.137 1.00 1.32 H new ATOM 0 HB2 LEU A 79 12.808 -21.418 -32.316 1.00 2.15 H new ATOM 0 HB3 LEU A 79 12.171 -20.939 -30.756 1.00 2.15 H new ATOM 0 HG LEU A 79 12.104 -23.381 -31.141 1.00 5.12 H new ATOM 0 HD11 LEU A 79 9.779 -23.720 -30.408 1.00 31.44 H new ATOM 0 HD12 LEU A 79 10.540 -22.343 -29.576 1.00 31.44 H new ATOM 0 HD13 LEU A 79 9.386 -22.055 -30.899 1.00 31.44 H new ATOM 0 HD21 LEU A 79 10.444 -24.312 -32.708 1.00 42.04 H new ATOM 0 HD22 LEU A 79 10.078 -22.670 -33.289 1.00 42.04 H new ATOM 0 HD23 LEU A 79 11.693 -23.369 -33.554 1.00 42.04 H new ATOM 1243 N ARG A 80 10.303 -18.143 -31.589 1.00 4.41 N ATOM 1244 CA ARG A 80 10.504 -16.774 -31.132 1.00 73.20 C ATOM 1245 C ARG A 80 11.379 -16.741 -29.882 1.00 73.41 C ATOM 1246 O ARG A 80 11.760 -17.784 -29.353 1.00 21.14 O ATOM 1247 CB ARG A 80 9.157 -16.108 -30.843 1.00 75.33 C ATOM 1248 CG ARG A 80 8.297 -15.912 -32.081 1.00 23.13 C ATOM 1249 CD ARG A 80 8.606 -14.592 -32.771 1.00 50.12 C ATOM 1250 NE ARG A 80 9.781 -14.687 -33.632 1.00 52.34 N ATOM 1251 CZ ARG A 80 10.466 -13.631 -34.061 1.00 23.00 C ATOM 1252 NH1 ARG A 80 10.092 -12.408 -33.711 1.00 23.00 N ATOM 1253 NH2 ARG A 80 11.524 -13.799 -34.842 1.00 53.03 N ATOM 0 H ARG A 80 9.329 -18.447 -31.595 1.00 4.41 H new ATOM 0 HA ARG A 80 11.012 -16.223 -31.924 1.00 73.20 H new ATOM 0 HB2 ARG A 80 8.609 -16.714 -30.122 1.00 75.33 H new ATOM 0 HB3 ARG A 80 9.333 -15.139 -30.376 1.00 75.33 H new ATOM 0 HG2 ARG A 80 8.465 -16.735 -32.776 1.00 23.13 H new ATOM 0 HG3 ARG A 80 7.244 -15.940 -31.802 1.00 23.13 H new ATOM 0 HD2 ARG A 80 7.746 -14.283 -33.365 1.00 50.12 H new ATOM 0 HD3 ARG A 80 8.769 -13.819 -32.019 1.00 50.12 H new ATOM 0 HE ARG A 80 10.094 -15.614 -33.920 1.00 52.34 H new ATOM 0 HH11 ARG A 80 9.277 -12.276 -33.112 1.00 23.00 H new ATOM 0 HH12 ARG A 80 10.619 -11.599 -34.041 1.00 23.00 H new ATOM 0 HH21 ARG A 80 11.813 -14.739 -35.114 1.00 53.03 H new ATOM 0 HH22 ARG A 80 12.049 -12.989 -35.171 1.00 53.03 H new ATOM 1267 N ALA A 81 11.692 -15.536 -29.417 1.00 74.21 N ATOM 1268 CA ALA A 81 12.519 -15.367 -28.229 1.00 72.12 C ATOM 1269 C ALA A 81 11.742 -15.717 -26.964 1.00 43.20 C ATOM 1270 O ALA A 81 12.267 -16.370 -26.061 1.00 21.14 O ATOM 1271 CB ALA A 81 13.045 -13.941 -28.150 1.00 14.14 C ATOM 0 H ALA A 81 11.385 -14.663 -29.845 1.00 74.21 H new ATOM 0 HA ALA A 81 13.364 -16.051 -28.305 1.00 72.12 H new ATOM 0 HB1 ALA A 81 13.661 -13.829 -27.258 1.00 14.14 H new ATOM 0 HB2 ALA A 81 13.645 -13.725 -29.034 1.00 14.14 H new ATOM 0 HB3 ALA A 81 12.207 -13.246 -28.101 1.00 14.14 H new ATOM 1277 N LYS A 82 10.489 -15.279 -26.904 1.00 4.44 N ATOM 1278 CA LYS A 82 9.639 -15.546 -25.751 1.00 41.24 C ATOM 1279 C LYS A 82 9.719 -17.014 -25.344 1.00 35.22 C ATOM 1280 O LYS A 82 9.531 -17.355 -24.177 1.00 60.00 O ATOM 1281 CB LYS A 82 8.189 -15.171 -26.063 1.00 55.13 C ATOM 1282 CG LYS A 82 7.498 -14.422 -24.936 1.00 72.33 C ATOM 1283 CD LYS A 82 8.019 -13.000 -24.810 1.00 14.54 C ATOM 1284 CE LYS A 82 8.976 -12.859 -23.636 1.00 63.15 C ATOM 1285 NZ LYS A 82 8.773 -11.576 -22.906 1.00 3.12 N ATOM 0 H LYS A 82 10.040 -14.737 -27.642 1.00 4.44 H new ATOM 0 HA LYS A 82 9.995 -14.937 -24.920 1.00 41.24 H new ATOM 0 HB2 LYS A 82 8.167 -14.557 -26.963 1.00 55.13 H new ATOM 0 HB3 LYS A 82 7.627 -16.079 -26.283 1.00 55.13 H new ATOM 0 HG2 LYS A 82 6.423 -14.402 -25.116 1.00 72.33 H new ATOM 0 HG3 LYS A 82 7.654 -14.952 -23.996 1.00 72.33 H new ATOM 0 HD2 LYS A 82 8.527 -12.715 -25.731 1.00 14.54 H new ATOM 0 HD3 LYS A 82 7.181 -12.314 -24.682 1.00 14.54 H new ATOM 0 HE2 LYS A 82 8.834 -13.694 -22.950 1.00 63.15 H new ATOM 0 HE3 LYS A 82 10.003 -12.913 -23.996 1.00 63.15 H new ATOM 0 HZ1 LYS A 82 9.444 -11.518 -22.113 1.00 3.12 H new ATOM 0 HZ2 LYS A 82 8.933 -10.779 -23.554 1.00 3.12 H new ATOM 0 HZ3 LYS A 82 7.800 -11.535 -22.540 1.00 3.12 H new ATOM 1299 N GLU A 83 10.001 -17.878 -26.315 1.00 43.34 N ATOM 1300 CA GLU A 83 10.106 -19.309 -26.055 1.00 33.33 C ATOM 1301 C GLU A 83 11.450 -19.649 -25.421 1.00 51.25 C ATOM 1302 O GLU A 83 12.192 -20.492 -25.926 1.00 43.20 O ATOM 1303 CB GLU A 83 9.927 -20.099 -27.354 1.00 62.23 C ATOM 1304 CG GLU A 83 8.639 -19.775 -28.092 1.00 61.32 C ATOM 1305 CD GLU A 83 7.406 -20.000 -27.238 1.00 63.44 C ATOM 1306 OE1 GLU A 83 7.477 -20.814 -26.295 1.00 54.12 O ATOM 1307 OE2 GLU A 83 6.370 -19.359 -27.514 1.00 43.32 O ATOM 0 H GLU A 83 10.160 -17.612 -27.287 1.00 43.34 H new ATOM 0 HA GLU A 83 9.315 -19.586 -25.358 1.00 33.33 H new ATOM 0 HB2 GLU A 83 10.773 -19.897 -28.011 1.00 62.23 H new ATOM 0 HB3 GLU A 83 9.947 -21.165 -27.127 1.00 62.23 H new ATOM 0 HG2 GLU A 83 8.664 -18.736 -28.421 1.00 61.32 H new ATOM 0 HG3 GLU A 83 8.573 -20.391 -28.988 1.00 61.32 H new ATOM 1314 N ALA A 84 11.758 -18.987 -24.310 1.00 31.34 N ATOM 1315 CA ALA A 84 13.013 -19.220 -23.605 1.00 60.02 C ATOM 1316 C ALA A 84 13.433 -20.683 -23.701 1.00 72.43 C ATOM 1317 O ALA A 84 14.611 -20.989 -23.890 1.00 43.23 O ATOM 1318 CB ALA A 84 12.885 -18.800 -22.148 1.00 73.01 C ATOM 0 H ALA A 84 11.156 -18.285 -23.879 1.00 31.34 H new ATOM 0 HA ALA A 84 13.786 -18.616 -24.080 1.00 60.02 H new ATOM 0 HB1 ALA A 84 13.829 -18.979 -21.633 1.00 73.01 H new ATOM 0 HB2 ALA A 84 12.639 -17.739 -22.095 1.00 73.01 H new ATOM 0 HB3 ALA A 84 12.095 -19.380 -21.670 1.00 73.01 H new ATOM 1324 N ARG A 85 12.464 -21.582 -23.569 1.00 55.23 N ATOM 1325 CA ARG A 85 12.735 -23.013 -23.639 1.00 54.12 C ATOM 1326 C ARG A 85 13.550 -23.352 -24.884 1.00 74.41 C ATOM 1327 O ARG A 85 14.542 -24.076 -24.810 1.00 32.30 O ATOM 1328 CB ARG A 85 11.424 -23.802 -23.645 1.00 33.42 C ATOM 1329 CG ARG A 85 10.690 -23.773 -22.313 1.00 35.25 C ATOM 1330 CD ARG A 85 11.448 -24.544 -21.243 1.00 71.11 C ATOM 1331 NE ARG A 85 10.590 -24.903 -20.118 1.00 53.20 N ATOM 1332 CZ ARG A 85 11.014 -25.586 -19.059 1.00 72.23 C ATOM 1333 NH1 ARG A 85 12.277 -25.980 -18.983 1.00 14.51 N ATOM 1334 NH2 ARG A 85 10.172 -25.874 -18.075 1.00 53.41 N ATOM 0 H ARG A 85 11.484 -21.345 -23.413 1.00 55.23 H new ATOM 0 HA ARG A 85 13.315 -23.291 -22.759 1.00 54.12 H new ATOM 0 HB2 ARG A 85 10.771 -23.399 -24.419 1.00 33.42 H new ATOM 0 HB3 ARG A 85 11.634 -24.838 -23.912 1.00 33.42 H new ATOM 0 HG2 ARG A 85 10.556 -22.740 -21.993 1.00 35.25 H new ATOM 0 HG3 ARG A 85 9.695 -24.201 -22.435 1.00 35.25 H new ATOM 0 HD2 ARG A 85 11.872 -25.449 -21.679 1.00 71.11 H new ATOM 0 HD3 ARG A 85 12.283 -23.942 -20.885 1.00 71.11 H new ATOM 0 HE ARG A 85 9.612 -24.614 -20.146 1.00 53.20 H new ATOM 0 HH11 ARG A 85 12.926 -25.759 -19.738 1.00 14.51 H new ATOM 0 HH12 ARG A 85 12.600 -26.504 -18.169 1.00 14.51 H new ATOM 0 HH21 ARG A 85 9.200 -25.571 -18.131 1.00 53.41 H new ATOM 0 HH22 ARG A 85 10.497 -26.398 -17.263 1.00 53.41 H new ATOM 1348 N TYR A 86 13.123 -22.824 -26.026 1.00 11.52 N ATOM 1349 CA TYR A 86 13.812 -23.072 -27.287 1.00 35.02 C ATOM 1350 C TYR A 86 15.310 -22.818 -27.149 1.00 2.42 C ATOM 1351 O TYR A 86 16.129 -23.653 -27.530 1.00 63.10 O ATOM 1352 CB TYR A 86 13.233 -22.185 -28.391 1.00 73.03 C ATOM 1353 CG TYR A 86 14.262 -21.718 -29.395 1.00 4.22 C ATOM 1354 CD1 TYR A 86 14.642 -22.526 -30.459 1.00 45.44 C ATOM 1355 CD2 TYR A 86 14.856 -20.467 -29.279 1.00 32.32 C ATOM 1356 CE1 TYR A 86 15.582 -22.104 -31.377 1.00 40.12 C ATOM 1357 CE2 TYR A 86 15.797 -20.035 -30.194 1.00 22.12 C ATOM 1358 CZ TYR A 86 16.158 -20.857 -31.241 1.00 1.03 C ATOM 1359 OH TYR A 86 17.093 -20.432 -32.155 1.00 24.30 O ATOM 0 H TYR A 86 12.303 -22.222 -26.104 1.00 11.52 H new ATOM 0 HA TYR A 86 13.662 -24.118 -27.554 1.00 35.02 H new ATOM 0 HB2 TYR A 86 12.451 -22.735 -28.914 1.00 73.03 H new ATOM 0 HB3 TYR A 86 12.761 -21.314 -27.936 1.00 73.03 H new ATOM 0 HD1 TYR A 86 14.194 -23.502 -30.570 1.00 45.44 H new ATOM 0 HD2 TYR A 86 14.577 -19.821 -28.459 1.00 32.32 H new ATOM 0 HE1 TYR A 86 15.866 -22.746 -32.198 1.00 40.12 H new ATOM 0 HE2 TYR A 86 16.247 -19.059 -30.090 1.00 22.12 H new ATOM 0 HH TYR A 86 17.399 -19.532 -31.916 1.00 24.30 H new ATOM 1369 N ALA A 87 15.659 -21.659 -26.601 1.00 33.22 N ATOM 1370 CA ALA A 87 17.058 -21.295 -26.410 1.00 2.12 C ATOM 1371 C ALA A 87 17.695 -22.128 -25.303 1.00 31.20 C ATOM 1372 O ALA A 87 18.861 -22.511 -25.396 1.00 71.41 O ATOM 1373 CB ALA A 87 17.179 -19.812 -26.093 1.00 31.43 C ATOM 0 H ALA A 87 14.993 -20.956 -26.281 1.00 33.22 H new ATOM 0 HA ALA A 87 17.592 -21.502 -27.338 1.00 2.12 H new ATOM 0 HB1 ALA A 87 18.229 -19.554 -25.953 1.00 31.43 H new ATOM 0 HB2 ALA A 87 16.769 -19.229 -26.918 1.00 31.43 H new ATOM 0 HB3 ALA A 87 16.626 -19.589 -25.181 1.00 31.43 H new ATOM 1379 N GLU A 88 16.923 -22.406 -24.258 1.00 22.54 N ATOM 1380 CA GLU A 88 17.414 -23.192 -23.133 1.00 64.14 C ATOM 1381 C GLU A 88 17.936 -24.547 -23.603 1.00 13.42 C ATOM 1382 O GLU A 88 18.932 -25.055 -23.086 1.00 13.33 O ATOM 1383 CB GLU A 88 16.305 -23.392 -22.098 1.00 34.24 C ATOM 1384 CG GLU A 88 16.121 -22.206 -21.167 1.00 31.21 C ATOM 1385 CD GLU A 88 15.423 -22.582 -19.873 1.00 22.53 C ATOM 1386 OE1 GLU A 88 15.990 -23.385 -19.104 1.00 54.51 O ATOM 1387 OE2 GLU A 88 14.309 -22.072 -19.632 1.00 15.24 O ATOM 0 H GLU A 88 15.955 -22.098 -24.167 1.00 22.54 H new ATOM 0 HA GLU A 88 18.236 -22.644 -22.672 1.00 64.14 H new ATOM 0 HB2 GLU A 88 15.366 -23.585 -22.617 1.00 34.24 H new ATOM 0 HB3 GLU A 88 16.529 -24.278 -21.504 1.00 34.24 H new ATOM 0 HG2 GLU A 88 17.095 -21.774 -20.938 1.00 31.21 H new ATOM 0 HG3 GLU A 88 15.543 -21.435 -21.677 1.00 31.21 H new ATOM 1394 N LEU A 89 17.257 -25.127 -24.585 1.00 61.52 N ATOM 1395 CA LEU A 89 17.651 -26.423 -25.127 1.00 23.11 C ATOM 1396 C LEU A 89 18.852 -26.284 -26.056 1.00 74.21 C ATOM 1397 O LEU A 89 19.462 -27.276 -26.453 1.00 3.44 O ATOM 1398 CB LEU A 89 16.480 -27.061 -25.878 1.00 53.35 C ATOM 1399 CG LEU A 89 15.377 -27.666 -25.012 1.00 10.44 C ATOM 1400 CD1 LEU A 89 14.006 -27.335 -25.584 1.00 34.15 C ATOM 1401 CD2 LEU A 89 15.557 -29.173 -24.893 1.00 1.05 C ATOM 0 H LEU A 89 16.430 -24.721 -25.023 1.00 61.52 H new ATOM 0 HA LEU A 89 17.934 -27.066 -24.294 1.00 23.11 H new ATOM 0 HB2 LEU A 89 16.034 -26.305 -26.524 1.00 53.35 H new ATOM 0 HB3 LEU A 89 16.874 -27.843 -26.528 1.00 53.35 H new ATOM 0 HG LEU A 89 15.447 -27.232 -24.015 1.00 10.44 H new ATOM 0 HD11 LEU A 89 13.233 -27.774 -24.954 1.00 34.15 H new ATOM 0 HD12 LEU A 89 13.877 -26.253 -25.616 1.00 34.15 H new ATOM 0 HD13 LEU A 89 13.925 -27.740 -26.593 1.00 34.15 H new ATOM 0 HD21 LEU A 89 14.762 -29.587 -24.272 1.00 1.05 H new ATOM 0 HD22 LEU A 89 15.515 -29.624 -25.885 1.00 1.05 H new ATOM 0 HD23 LEU A 89 16.523 -29.389 -24.437 1.00 1.05 H new ATOM 1413 N GLY A 90 19.187 -25.043 -26.399 1.00 70.10 N ATOM 1414 CA GLY A 90 20.316 -24.796 -27.277 1.00 61.22 C ATOM 1415 C GLY A 90 19.959 -24.965 -28.741 1.00 62.23 C ATOM 1416 O GLY A 90 20.835 -25.175 -29.580 1.00 15.15 O ATOM 0 H GLY A 90 18.697 -24.205 -26.085 1.00 70.10 H new ATOM 0 HA2 GLY A 90 20.687 -23.785 -27.111 1.00 61.22 H new ATOM 0 HA3 GLY A 90 21.127 -25.479 -27.023 1.00 61.22 H new ATOM 1420 N LEU A 91 18.670 -24.876 -29.047 1.00 75.55 N ATOM 1421 CA LEU A 91 18.198 -25.022 -30.421 1.00 43.42 C ATOM 1422 C LEU A 91 18.793 -23.942 -31.319 1.00 5.25 C ATOM 1423 O LEU A 91 18.799 -24.073 -32.543 1.00 0.05 O ATOM 1424 CB LEU A 91 16.671 -24.954 -30.466 1.00 14.34 C ATOM 1425 CG LEU A 91 15.933 -26.278 -30.258 1.00 65.32 C ATOM 1426 CD1 LEU A 91 16.000 -27.129 -31.518 1.00 53.23 C ATOM 1427 CD2 LEU A 91 16.515 -27.032 -29.072 1.00 0.23 C ATOM 0 H LEU A 91 17.933 -24.704 -28.364 1.00 75.55 H new ATOM 0 HA LEU A 91 18.524 -25.995 -30.789 1.00 43.42 H new ATOM 0 HB2 LEU A 91 16.336 -24.251 -29.703 1.00 14.34 H new ATOM 0 HB3 LEU A 91 16.374 -24.543 -31.431 1.00 14.34 H new ATOM 0 HG LEU A 91 14.886 -26.060 -30.046 1.00 65.32 H new ATOM 0 HD11 LEU A 91 15.470 -28.067 -31.352 1.00 53.23 H new ATOM 0 HD12 LEU A 91 15.536 -26.592 -32.345 1.00 53.23 H new ATOM 0 HD13 LEU A 91 17.042 -27.339 -31.760 1.00 53.23 H new ATOM 0 HD21 LEU A 91 15.978 -27.971 -28.939 1.00 0.23 H new ATOM 0 HD22 LEU A 91 17.569 -27.240 -29.255 1.00 0.23 H new ATOM 0 HD23 LEU A 91 16.415 -26.426 -28.171 1.00 0.23 H new ATOM 1439 N ASP A 92 19.295 -22.878 -30.702 1.00 33.44 N ATOM 1440 CA ASP A 92 19.896 -21.776 -31.445 1.00 74.05 C ATOM 1441 C ASP A 92 21.127 -22.248 -32.214 1.00 62.30 C ATOM 1442 O ASP A 92 21.538 -21.622 -33.191 1.00 70.43 O ATOM 1443 CB ASP A 92 20.277 -20.640 -30.496 1.00 1.55 C ATOM 1444 CG ASP A 92 19.395 -20.595 -29.264 1.00 64.35 C ATOM 1445 OD1 ASP A 92 19.606 -21.421 -28.352 1.00 31.33 O ATOM 1446 OD2 ASP A 92 18.494 -19.731 -29.212 1.00 24.44 O ATOM 0 H ASP A 92 19.298 -22.755 -29.689 1.00 33.44 H new ATOM 0 HA ASP A 92 19.160 -21.409 -32.161 1.00 74.05 H new ATOM 0 HB2 ASP A 92 21.317 -20.759 -30.191 1.00 1.55 H new ATOM 0 HB3 ASP A 92 20.206 -19.689 -31.025 1.00 1.55 H new ATOM 1451 N ASP A 93 21.712 -23.354 -31.765 1.00 23.44 N ATOM 1452 CA ASP A 93 22.896 -23.909 -32.410 1.00 31.11 C ATOM 1453 C ASP A 93 22.671 -24.072 -33.910 1.00 62.53 C ATOM 1454 O ASP A 93 21.756 -24.767 -34.353 1.00 33.31 O ATOM 1455 CB ASP A 93 23.257 -25.257 -31.785 1.00 41.32 C ATOM 1456 CG ASP A 93 24.024 -25.106 -30.486 1.00 24.35 C ATOM 1457 OD1 ASP A 93 23.727 -24.159 -29.729 1.00 73.12 O ATOM 1458 OD2 ASP A 93 24.920 -25.936 -30.227 1.00 71.12 O ATOM 0 H ASP A 93 21.385 -23.883 -30.957 1.00 23.44 H new ATOM 0 HA ASP A 93 23.723 -23.215 -32.259 1.00 31.11 H new ATOM 0 HB2 ASP A 93 22.345 -25.825 -31.601 1.00 41.32 H new ATOM 0 HB3 ASP A 93 23.854 -25.833 -32.491 1.00 41.32 H new ATOM 1463 N PRO A 94 23.523 -23.417 -34.711 1.00 23.53 N ATOM 1464 CA PRO A 94 23.438 -23.474 -36.173 1.00 75.32 C ATOM 1465 C PRO A 94 23.821 -24.844 -36.724 1.00 3.20 C ATOM 1466 O PRO A 94 23.290 -25.284 -37.743 1.00 31.01 O ATOM 1467 CB PRO A 94 24.445 -22.415 -36.629 1.00 55.43 C ATOM 1468 CG PRO A 94 25.422 -22.314 -35.509 1.00 21.24 C ATOM 1469 CD PRO A 94 24.637 -22.570 -34.252 1.00 11.34 C ATOM 0 HA PRO A 94 22.423 -23.298 -36.528 1.00 75.32 H new ATOM 0 HB2 PRO A 94 24.936 -22.709 -37.557 1.00 55.43 H new ATOM 0 HB3 PRO A 94 23.957 -21.459 -36.816 1.00 55.43 H new ATOM 0 HG2 PRO A 94 26.224 -23.043 -35.624 1.00 21.24 H new ATOM 0 HG3 PRO A 94 25.888 -21.329 -35.485 1.00 21.24 H new ATOM 0 HD2 PRO A 94 25.240 -23.074 -33.497 1.00 11.34 H new ATOM 0 HD3 PRO A 94 24.279 -21.642 -33.806 1.00 11.34 H new ATOM 1477 N ALA A 95 24.744 -25.513 -36.042 1.00 41.33 N ATOM 1478 CA ALA A 95 25.195 -26.835 -36.462 1.00 54.01 C ATOM 1479 C ALA A 95 24.037 -27.827 -36.492 1.00 13.13 C ATOM 1480 O ALA A 95 24.080 -28.826 -37.211 1.00 53.22 O ATOM 1481 CB ALA A 95 26.296 -27.334 -35.538 1.00 40.00 C ATOM 0 H ALA A 95 25.194 -25.162 -35.197 1.00 41.33 H new ATOM 0 HA ALA A 95 25.593 -26.752 -37.473 1.00 54.01 H new ATOM 0 HB1 ALA A 95 26.624 -28.322 -35.863 1.00 40.00 H new ATOM 0 HB2 ALA A 95 27.139 -26.643 -35.570 1.00 40.00 H new ATOM 0 HB3 ALA A 95 25.916 -27.395 -34.518 1.00 40.00 H new ATOM 1487 N LEU A 96 23.003 -27.544 -35.706 1.00 20.31 N ATOM 1488 CA LEU A 96 21.832 -28.412 -35.643 1.00 61.12 C ATOM 1489 C LEU A 96 21.190 -28.561 -37.018 1.00 1.50 C ATOM 1490 O LEU A 96 21.695 -28.038 -38.011 1.00 3.31 O ATOM 1491 CB LEU A 96 20.813 -27.854 -34.648 1.00 43.10 C ATOM 1492 CG LEU A 96 21.215 -27.909 -33.174 1.00 42.34 C ATOM 1493 CD1 LEU A 96 20.092 -27.381 -32.295 1.00 41.14 C ATOM 1494 CD2 LEU A 96 21.587 -29.329 -32.774 1.00 5.12 C ATOM 0 H LEU A 96 22.952 -26.722 -35.105 1.00 20.31 H new ATOM 0 HA LEU A 96 22.157 -29.397 -35.307 1.00 61.12 H new ATOM 0 HB2 LEU A 96 20.610 -26.816 -34.910 1.00 43.10 H new ATOM 0 HB3 LEU A 96 19.879 -28.402 -34.770 1.00 43.10 H new ATOM 0 HG LEU A 96 22.089 -27.274 -33.032 1.00 42.34 H new ATOM 0 HD11 LEU A 96 20.396 -27.428 -31.249 1.00 41.14 H new ATOM 0 HD12 LEU A 96 19.875 -26.347 -32.564 1.00 41.14 H new ATOM 0 HD13 LEU A 96 19.199 -27.989 -32.441 1.00 41.14 H new ATOM 0 HD21 LEU A 96 21.870 -29.348 -31.722 1.00 5.12 H new ATOM 0 HD22 LEU A 96 20.733 -29.987 -32.932 1.00 5.12 H new ATOM 0 HD23 LEU A 96 22.425 -29.670 -33.382 1.00 5.12 H new ATOM 1506 N SER A 97 20.069 -29.276 -37.068 1.00 3.55 N ATOM 1507 CA SER A 97 19.358 -29.495 -38.321 1.00 11.30 C ATOM 1508 C SER A 97 17.851 -29.557 -38.087 1.00 25.43 C ATOM 1509 O SER A 97 17.392 -29.634 -36.947 1.00 33.45 O ATOM 1510 CB SER A 97 19.835 -30.789 -38.984 1.00 40.53 C ATOM 1511 OG SER A 97 20.820 -30.523 -39.969 1.00 53.10 O ATOM 0 H SER A 97 19.635 -29.713 -36.255 1.00 3.55 H new ATOM 0 HA SER A 97 19.572 -28.656 -38.982 1.00 11.30 H new ATOM 0 HB2 SER A 97 20.243 -31.460 -38.228 1.00 40.53 H new ATOM 0 HB3 SER A 97 18.988 -31.301 -39.441 1.00 40.53 H new ATOM 0 HG SER A 97 21.110 -31.365 -40.377 1.00 53.10 H new ATOM 1517 N ASP A 98 17.088 -29.522 -39.173 1.00 13.22 N ATOM 1518 CA ASP A 98 15.633 -29.575 -39.089 1.00 24.54 C ATOM 1519 C ASP A 98 15.180 -30.788 -38.282 1.00 24.42 C ATOM 1520 O ASP A 98 14.118 -30.769 -37.660 1.00 12.01 O ATOM 1521 CB ASP A 98 15.020 -29.621 -40.489 1.00 14.25 C ATOM 1522 CG ASP A 98 15.622 -28.585 -41.418 1.00 64.44 C ATOM 1523 OD1 ASP A 98 15.662 -27.397 -41.036 1.00 52.31 O ATOM 1524 OD2 ASP A 98 16.054 -28.963 -42.527 1.00 12.40 O ATOM 0 H ASP A 98 17.453 -29.457 -40.123 1.00 13.22 H new ATOM 0 HA ASP A 98 15.290 -28.673 -38.581 1.00 24.54 H new ATOM 0 HB2 ASP A 98 15.165 -30.614 -40.914 1.00 14.25 H new ATOM 0 HB3 ASP A 98 13.944 -29.459 -40.417 1.00 14.25 H new ATOM 1529 N GLU A 99 15.992 -31.841 -38.297 1.00 72.54 N ATOM 1530 CA GLU A 99 15.673 -33.062 -37.568 1.00 72.45 C ATOM 1531 C GLU A 99 15.426 -32.766 -36.091 1.00 11.42 C ATOM 1532 O GLU A 99 14.326 -32.977 -35.580 1.00 32.33 O ATOM 1533 CB GLU A 99 16.806 -34.080 -37.713 1.00 75.14 C ATOM 1534 CG GLU A 99 17.074 -34.492 -39.150 1.00 32.11 C ATOM 1535 CD GLU A 99 17.888 -35.768 -39.249 1.00 1.32 C ATOM 1536 OE1 GLU A 99 17.329 -36.850 -38.972 1.00 13.34 O ATOM 1537 OE2 GLU A 99 19.083 -35.685 -39.602 1.00 32.03 O ATOM 0 H GLU A 99 16.875 -31.872 -38.806 1.00 72.54 H new ATOM 0 HA GLU A 99 14.761 -33.481 -37.994 1.00 72.45 H new ATOM 0 HB2 GLU A 99 17.718 -33.659 -37.289 1.00 75.14 H new ATOM 0 HB3 GLU A 99 16.563 -34.968 -37.129 1.00 75.14 H new ATOM 0 HG2 GLU A 99 16.125 -34.630 -39.668 1.00 32.11 H new ATOM 0 HG3 GLU A 99 17.602 -33.688 -39.662 1.00 32.11 H new ATOM 1544 N VAL A 100 16.457 -32.275 -35.412 1.00 72.43 N ATOM 1545 CA VAL A 100 16.353 -31.948 -33.994 1.00 64.24 C ATOM 1546 C VAL A 100 15.383 -30.796 -33.766 1.00 2.24 C ATOM 1547 O VAL A 100 14.635 -30.783 -32.787 1.00 62.41 O ATOM 1548 CB VAL A 100 17.725 -31.575 -33.402 1.00 14.23 C ATOM 1549 CG1 VAL A 100 18.648 -32.785 -33.387 1.00 64.32 C ATOM 1550 CG2 VAL A 100 18.349 -30.429 -34.185 1.00 4.04 C ATOM 0 H VAL A 100 17.374 -32.095 -35.820 1.00 72.43 H new ATOM 0 HA VAL A 100 15.979 -32.839 -33.490 1.00 64.24 H new ATOM 0 HB VAL A 100 17.580 -31.246 -32.373 1.00 14.23 H new ATOM 0 HG11 VAL A 100 19.612 -32.502 -32.965 1.00 64.32 H new ATOM 0 HG12 VAL A 100 18.204 -33.574 -32.780 1.00 64.32 H new ATOM 0 HG13 VAL A 100 18.790 -33.147 -34.405 1.00 64.32 H new ATOM 0 HG21 VAL A 100 19.318 -30.178 -33.753 1.00 4.04 H new ATOM 0 HG22 VAL A 100 18.482 -30.728 -35.225 1.00 4.04 H new ATOM 0 HG23 VAL A 100 17.695 -29.558 -34.139 1.00 4.04 H new ATOM 1560 N LEU A 101 15.398 -29.827 -34.676 1.00 40.00 N ATOM 1561 CA LEU A 101 14.519 -28.668 -34.574 1.00 61.42 C ATOM 1562 C LEU A 101 13.056 -29.097 -34.530 1.00 13.14 C ATOM 1563 O LEU A 101 12.310 -28.699 -33.634 1.00 0.31 O ATOM 1564 CB LEU A 101 14.749 -27.723 -35.755 1.00 1.20 C ATOM 1565 CG LEU A 101 15.565 -26.465 -35.459 1.00 65.24 C ATOM 1566 CD1 LEU A 101 14.840 -25.582 -34.455 1.00 10.42 C ATOM 1567 CD2 LEU A 101 16.949 -26.835 -34.944 1.00 33.34 C ATOM 0 H LEU A 101 16.009 -29.822 -35.492 1.00 40.00 H new ATOM 0 HA LEU A 101 14.754 -28.145 -33.647 1.00 61.42 H new ATOM 0 HB2 LEU A 101 15.251 -28.279 -36.547 1.00 1.20 H new ATOM 0 HB3 LEU A 101 13.778 -27.418 -36.145 1.00 1.20 H new ATOM 0 HG LEU A 101 15.682 -25.905 -36.387 1.00 65.24 H new ATOM 0 HD11 LEU A 101 15.436 -24.691 -34.257 1.00 10.42 H new ATOM 0 HD12 LEU A 101 13.872 -25.288 -34.861 1.00 10.42 H new ATOM 0 HD13 LEU A 101 14.691 -26.133 -33.526 1.00 10.42 H new ATOM 0 HD21 LEU A 101 17.516 -25.927 -34.739 1.00 33.34 H new ATOM 0 HD22 LEU A 101 16.853 -27.417 -34.028 1.00 33.34 H new ATOM 0 HD23 LEU A 101 17.471 -27.426 -35.696 1.00 33.34 H new ATOM 1579 N ILE A 102 12.653 -29.912 -35.498 1.00 1.20 N ATOM 1580 CA ILE A 102 11.281 -30.398 -35.567 1.00 60.32 C ATOM 1581 C ILE A 102 10.947 -31.275 -34.365 1.00 1.14 C ATOM 1582 O ILE A 102 9.959 -31.042 -33.668 1.00 72.53 O ATOM 1583 CB ILE A 102 11.031 -31.199 -36.858 1.00 14.24 C ATOM 1584 CG1 ILE A 102 11.298 -30.327 -38.086 1.00 33.21 C ATOM 1585 CG2 ILE A 102 9.608 -31.735 -36.882 1.00 21.11 C ATOM 1586 CD1 ILE A 102 11.665 -31.118 -39.321 1.00 42.42 C ATOM 0 H ILE A 102 13.258 -30.250 -36.246 1.00 1.20 H new ATOM 0 HA ILE A 102 10.635 -29.520 -35.564 1.00 60.32 H new ATOM 0 HB ILE A 102 11.718 -32.045 -36.881 1.00 14.24 H new ATOM 0 HG12 ILE A 102 10.411 -29.730 -38.297 1.00 33.21 H new ATOM 0 HG13 ILE A 102 12.104 -29.630 -37.858 1.00 33.21 H new ATOM 0 HG21 ILE A 102 9.447 -32.299 -37.801 1.00 21.11 H new ATOM 0 HG22 ILE A 102 9.451 -32.388 -36.023 1.00 21.11 H new ATOM 0 HG23 ILE A 102 8.905 -30.903 -36.839 1.00 21.11 H new ATOM 0 HD11 ILE A 102 11.840 -30.435 -40.152 1.00 42.42 H new ATOM 0 HD12 ILE A 102 12.570 -31.694 -39.128 1.00 42.42 H new ATOM 0 HD13 ILE A 102 10.850 -31.796 -39.574 1.00 42.42 H new ATOM 1598 N ASP A 103 11.779 -32.283 -34.126 1.00 55.53 N ATOM 1599 CA ASP A 103 11.574 -33.194 -33.006 1.00 30.11 C ATOM 1600 C ASP A 103 11.351 -32.421 -31.710 1.00 34.25 C ATOM 1601 O ASP A 103 10.548 -32.820 -30.867 1.00 12.34 O ATOM 1602 CB ASP A 103 12.774 -34.130 -32.856 1.00 50.13 C ATOM 1603 CG ASP A 103 12.490 -35.293 -31.927 1.00 60.43 C ATOM 1604 OD1 ASP A 103 11.987 -36.330 -32.409 1.00 11.22 O ATOM 1605 OD2 ASP A 103 12.770 -35.166 -30.716 1.00 10.20 O ATOM 0 H ASP A 103 12.601 -32.490 -34.693 1.00 55.53 H new ATOM 0 HA ASP A 103 10.683 -33.788 -33.211 1.00 30.11 H new ATOM 0 HB2 ASP A 103 13.057 -34.513 -33.837 1.00 50.13 H new ATOM 0 HB3 ASP A 103 13.626 -33.566 -32.477 1.00 50.13 H new ATOM 1610 N ALA A 104 12.068 -31.312 -31.558 1.00 2.41 N ATOM 1611 CA ALA A 104 11.948 -30.483 -30.365 1.00 53.05 C ATOM 1612 C ALA A 104 10.632 -29.712 -30.364 1.00 41.22 C ATOM 1613 O ALA A 104 9.960 -29.618 -29.338 1.00 25.21 O ATOM 1614 CB ALA A 104 13.125 -29.522 -30.270 1.00 4.34 C ATOM 0 H ALA A 104 12.738 -30.967 -32.246 1.00 2.41 H new ATOM 0 HA ALA A 104 11.957 -31.138 -29.494 1.00 53.05 H new ATOM 0 HB1 ALA A 104 13.023 -28.909 -29.375 1.00 4.34 H new ATOM 0 HB2 ALA A 104 14.054 -30.089 -30.217 1.00 4.34 H new ATOM 0 HB3 ALA A 104 13.142 -28.879 -31.150 1.00 4.34 H new ATOM 1620 N MET A 105 10.272 -29.162 -31.519 1.00 50.33 N ATOM 1621 CA MET A 105 9.036 -28.400 -31.649 1.00 41.43 C ATOM 1622 C MET A 105 7.821 -29.282 -31.373 1.00 12.21 C ATOM 1623 O MET A 105 6.935 -28.910 -30.604 1.00 52.23 O ATOM 1624 CB MET A 105 8.931 -27.792 -33.049 1.00 15.40 C ATOM 1625 CG MET A 105 8.043 -26.560 -33.111 1.00 71.42 C ATOM 1626 SD MET A 105 7.052 -26.494 -34.617 1.00 70.24 S ATOM 1627 CE MET A 105 5.887 -25.200 -34.199 1.00 30.45 C ATOM 0 H MET A 105 10.818 -29.230 -32.378 1.00 50.33 H new ATOM 0 HA MET A 105 9.055 -27.597 -30.912 1.00 41.43 H new ATOM 0 HB2 MET A 105 9.930 -27.528 -33.397 1.00 15.40 H new ATOM 0 HB3 MET A 105 8.543 -28.545 -33.735 1.00 15.40 H new ATOM 0 HG2 MET A 105 7.382 -26.549 -32.245 1.00 71.42 H new ATOM 0 HG3 MET A 105 8.663 -25.666 -33.049 1.00 71.42 H new ATOM 0 HE1 MET A 105 4.989 -25.308 -34.808 1.00 30.45 H new ATOM 0 HE2 MET A 105 5.621 -25.276 -33.145 1.00 30.45 H new ATOM 0 HE3 MET A 105 6.340 -24.227 -34.390 1.00 30.45 H new ATOM 1637 N ILE A 106 7.788 -30.450 -32.007 1.00 1.31 N ATOM 1638 CA ILE A 106 6.683 -31.383 -31.829 1.00 24.13 C ATOM 1639 C ILE A 106 6.524 -31.772 -30.362 1.00 51.23 C ATOM 1640 O ILE A 106 5.442 -32.170 -29.930 1.00 14.50 O ATOM 1641 CB ILE A 106 6.884 -32.659 -32.667 1.00 34.44 C ATOM 1642 CG1 ILE A 106 6.994 -32.307 -34.152 1.00 64.21 C ATOM 1643 CG2 ILE A 106 5.738 -33.632 -32.431 1.00 60.51 C ATOM 1644 CD1 ILE A 106 5.814 -31.517 -34.675 1.00 62.21 C ATOM 0 H ILE A 106 8.513 -30.772 -32.648 1.00 1.31 H new ATOM 0 HA ILE A 106 5.781 -30.873 -32.168 1.00 24.13 H new ATOM 0 HB ILE A 106 7.812 -33.139 -32.357 1.00 34.44 H new ATOM 0 HG12 ILE A 106 7.906 -31.733 -34.314 1.00 64.21 H new ATOM 0 HG13 ILE A 106 7.090 -33.227 -34.729 1.00 64.21 H new ATOM 0 HG21 ILE A 106 5.893 -34.529 -33.030 1.00 60.51 H new ATOM 0 HG22 ILE A 106 5.701 -33.902 -31.376 1.00 60.51 H new ATOM 0 HG23 ILE A 106 4.797 -33.163 -32.718 1.00 60.51 H new ATOM 0 HD11 ILE A 106 5.960 -31.303 -35.734 1.00 62.21 H new ATOM 0 HD12 ILE A 106 4.901 -32.098 -34.545 1.00 62.21 H new ATOM 0 HD13 ILE A 106 5.730 -30.580 -34.124 1.00 62.21 H new ATOM 1656 N SER A 107 7.607 -31.651 -29.603 1.00 2.41 N ATOM 1657 CA SER A 107 7.588 -31.992 -28.185 1.00 22.10 C ATOM 1658 C SER A 107 7.204 -30.782 -27.340 1.00 0.52 C ATOM 1659 O SER A 107 6.590 -30.919 -26.282 1.00 33.22 O ATOM 1660 CB SER A 107 8.956 -32.521 -27.747 1.00 42.33 C ATOM 1661 OG SER A 107 8.843 -33.327 -26.587 1.00 12.33 O ATOM 0 H SER A 107 8.509 -31.320 -29.945 1.00 2.41 H new ATOM 0 HA SER A 107 6.840 -32.770 -28.034 1.00 22.10 H new ATOM 0 HB2 SER A 107 9.401 -33.102 -28.555 1.00 42.33 H new ATOM 0 HB3 SER A 107 9.626 -31.685 -27.549 1.00 42.33 H new ATOM 0 HG SER A 107 9.730 -33.654 -26.328 1.00 12.33 H new ATOM 1667 N ASN A 108 7.569 -29.596 -27.816 1.00 54.44 N ATOM 1668 CA ASN A 108 7.264 -28.360 -27.106 1.00 65.22 C ATOM 1669 C ASN A 108 5.812 -27.949 -27.329 1.00 71.11 C ATOM 1670 O ASN A 108 5.153 -28.390 -28.271 1.00 42.24 O ATOM 1671 CB ASN A 108 8.200 -27.239 -27.563 1.00 23.12 C ATOM 1672 CG ASN A 108 9.425 -27.112 -26.679 1.00 65.52 C ATOM 1673 OD1 ASN A 108 10.128 -28.091 -26.429 1.00 62.34 O ATOM 1674 ND2 ASN A 108 9.686 -25.901 -26.201 1.00 11.53 N ATOM 0 H ASN A 108 8.077 -29.465 -28.691 1.00 54.44 H new ATOM 0 HA ASN A 108 7.414 -28.536 -26.041 1.00 65.22 H new ATOM 0 HB2 ASN A 108 8.514 -27.428 -28.590 1.00 23.12 H new ATOM 0 HB3 ASN A 108 7.657 -26.294 -27.564 1.00 23.12 H new ATOM 0 HD21 ASN A 108 10.497 -25.754 -25.600 1.00 11.53 H new ATOM 0 HD22 ASN A 108 9.075 -25.118 -26.435 1.00 11.53 H new ATOM 1681 N PRO A 109 5.300 -27.081 -26.443 1.00 2.14 N ATOM 1682 CA PRO A 109 3.921 -26.589 -26.523 1.00 44.03 C ATOM 1683 C PRO A 109 3.706 -25.656 -27.709 1.00 35.14 C ATOM 1684 O PRO A 109 2.571 -25.369 -28.089 1.00 53.33 O ATOM 1685 CB PRO A 109 3.738 -25.831 -25.205 1.00 74.04 C ATOM 1686 CG PRO A 109 5.114 -25.421 -24.810 1.00 40.43 C ATOM 1687 CD PRO A 109 6.027 -26.513 -25.295 1.00 31.23 C ATOM 0 HA PRO A 109 3.207 -27.400 -26.667 1.00 44.03 H new ATOM 0 HB2 PRO A 109 3.088 -24.965 -25.333 1.00 74.04 H new ATOM 0 HB3 PRO A 109 3.280 -26.464 -24.445 1.00 74.04 H new ATOM 0 HG2 PRO A 109 5.379 -24.463 -25.257 1.00 40.43 H new ATOM 0 HG3 PRO A 109 5.190 -25.300 -23.729 1.00 40.43 H new ATOM 0 HD2 PRO A 109 7.001 -26.121 -25.590 1.00 31.23 H new ATOM 0 HD3 PRO A 109 6.205 -27.261 -24.522 1.00 31.23 H new ATOM 1695 N VAL A 110 4.804 -25.184 -28.292 1.00 43.44 N ATOM 1696 CA VAL A 110 4.735 -24.284 -29.436 1.00 12.04 C ATOM 1697 C VAL A 110 4.112 -24.977 -30.644 1.00 41.25 C ATOM 1698 O VAL A 110 3.734 -24.327 -31.619 1.00 40.11 O ATOM 1699 CB VAL A 110 6.132 -23.761 -29.823 1.00 64.03 C ATOM 1700 CG1 VAL A 110 6.713 -22.912 -28.703 1.00 31.53 C ATOM 1701 CG2 VAL A 110 7.058 -24.917 -30.163 1.00 55.05 C ATOM 0 H VAL A 110 5.752 -25.410 -27.990 1.00 43.44 H new ATOM 0 HA VAL A 110 4.108 -23.443 -29.140 1.00 12.04 H new ATOM 0 HB VAL A 110 6.034 -23.133 -30.708 1.00 64.03 H new ATOM 0 HG11 VAL A 110 7.700 -22.551 -28.994 1.00 31.53 H new ATOM 0 HG12 VAL A 110 6.057 -22.062 -28.513 1.00 31.53 H new ATOM 0 HG13 VAL A 110 6.799 -23.513 -27.798 1.00 31.53 H new ATOM 0 HG21 VAL A 110 8.040 -24.529 -30.434 1.00 55.05 H new ATOM 0 HG22 VAL A 110 7.153 -25.573 -29.298 1.00 55.05 H new ATOM 0 HG23 VAL A 110 6.646 -25.479 -31.001 1.00 55.05 H new ATOM 1711 N LEU A 111 4.008 -26.299 -30.571 1.00 32.23 N ATOM 1712 CA LEU A 111 3.429 -27.081 -31.658 1.00 45.53 C ATOM 1713 C LEU A 111 1.923 -26.857 -31.749 1.00 71.23 C ATOM 1714 O LEU A 111 1.277 -27.289 -32.703 1.00 55.43 O ATOM 1715 CB LEU A 111 3.723 -28.569 -31.455 1.00 4.24 C ATOM 1716 CG LEU A 111 2.630 -29.379 -30.759 1.00 2.22 C ATOM 1717 CD1 LEU A 111 2.996 -30.855 -30.731 1.00 14.32 C ATOM 1718 CD2 LEU A 111 2.396 -28.859 -29.348 1.00 24.21 C ATOM 0 H LEU A 111 4.317 -26.852 -29.771 1.00 32.23 H new ATOM 0 HA LEU A 111 3.884 -26.751 -32.592 1.00 45.53 H new ATOM 0 HB2 LEU A 111 3.915 -29.017 -32.430 1.00 4.24 H new ATOM 0 HB3 LEU A 111 4.641 -28.662 -30.875 1.00 4.24 H new ATOM 0 HG LEU A 111 1.705 -29.265 -31.324 1.00 2.22 H new ATOM 0 HD11 LEU A 111 2.206 -31.416 -30.232 1.00 14.32 H new ATOM 0 HD12 LEU A 111 3.112 -31.221 -31.751 1.00 14.32 H new ATOM 0 HD13 LEU A 111 3.933 -30.987 -30.190 1.00 14.32 H new ATOM 0 HD21 LEU A 111 1.614 -29.448 -28.868 1.00 24.21 H new ATOM 0 HD22 LEU A 111 3.318 -28.942 -28.772 1.00 24.21 H new ATOM 0 HD23 LEU A 111 2.088 -27.814 -29.392 1.00 24.21 H new ATOM 1730 N MET A 112 1.370 -26.174 -30.750 1.00 52.44 N ATOM 1731 CA MET A 112 -0.059 -25.890 -30.720 1.00 0.00 C ATOM 1732 C MET A 112 -0.487 -25.120 -31.966 1.00 53.21 C ATOM 1733 O MET A 112 -0.362 -23.898 -32.025 1.00 22.13 O ATOM 1734 CB MET A 112 -0.415 -25.090 -29.465 1.00 23.34 C ATOM 1735 CG MET A 112 -1.543 -25.704 -28.653 1.00 5.21 C ATOM 1736 SD MET A 112 -3.045 -24.707 -28.685 1.00 25.32 S ATOM 1737 CE MET A 112 -2.428 -23.146 -28.059 1.00 20.33 C ATOM 0 H MET A 112 1.890 -25.808 -29.952 1.00 52.44 H new ATOM 0 HA MET A 112 -0.593 -26.840 -30.701 1.00 0.00 H new ATOM 0 HB2 MET A 112 0.470 -25.005 -28.835 1.00 23.34 H new ATOM 0 HB3 MET A 112 -0.697 -24.078 -29.757 1.00 23.34 H new ATOM 0 HG2 MET A 112 -1.764 -26.699 -29.040 1.00 5.21 H new ATOM 0 HG3 MET A 112 -1.216 -25.828 -27.621 1.00 5.21 H new ATOM 0 HE1 MET A 112 -3.230 -22.618 -27.544 1.00 20.33 H new ATOM 0 HE2 MET A 112 -1.610 -23.331 -27.363 1.00 20.33 H new ATOM 0 HE3 MET A 112 -2.068 -22.538 -28.889 1.00 20.33 H new ATOM 1747 N ASN A 113 -0.991 -25.844 -32.959 1.00 31.31 N ATOM 1748 CA ASN A 113 -1.437 -25.229 -34.204 1.00 34.14 C ATOM 1749 C ASN A 113 -2.960 -25.171 -34.268 1.00 2.13 C ATOM 1750 O ASN A 113 -3.532 -24.697 -35.249 1.00 70.14 O ATOM 1751 CB ASN A 113 -0.895 -26.009 -35.405 1.00 51.22 C ATOM 1752 CG ASN A 113 -1.359 -27.452 -35.414 1.00 10.53 C ATOM 1753 OD1 ASN A 113 -1.158 -28.187 -34.447 1.00 53.23 O ATOM 1754 ND2 ASN A 113 -1.984 -27.865 -36.511 1.00 42.11 N ATOM 0 H ASN A 113 -1.101 -26.858 -32.926 1.00 31.31 H new ATOM 0 HA ASN A 113 -1.051 -24.210 -34.235 1.00 34.14 H new ATOM 0 HB2 ASN A 113 -1.215 -25.522 -36.326 1.00 51.22 H new ATOM 0 HB3 ASN A 113 0.195 -25.981 -35.392 1.00 51.22 H new ATOM 0 HD21 ASN A 113 -2.319 -28.826 -36.576 1.00 42.11 H new ATOM 0 HD22 ASN A 113 -2.129 -27.221 -37.289 1.00 42.11 H new ATOM 1761 N ARG A 114 -3.610 -25.654 -33.214 1.00 1.03 N ATOM 1762 CA ARG A 114 -5.066 -25.657 -33.150 1.00 22.33 C ATOM 1763 C ARG A 114 -5.629 -24.281 -33.497 1.00 54.21 C ATOM 1764 O ARG A 114 -6.388 -24.116 -34.451 1.00 64.24 O ATOM 1765 CB ARG A 114 -5.536 -26.074 -31.755 1.00 21.14 C ATOM 1766 CG ARG A 114 -5.998 -27.521 -31.676 1.00 2.43 C ATOM 1767 CD ARG A 114 -4.823 -28.485 -31.738 1.00 31.22 C ATOM 1768 NE ARG A 114 -4.539 -28.913 -33.105 1.00 34.21 N ATOM 1769 CZ ARG A 114 -3.532 -29.717 -33.429 1.00 22.14 C ATOM 1770 NH1 ARG A 114 -2.718 -30.177 -32.490 1.00 63.24 N ATOM 1771 NH2 ARG A 114 -3.337 -30.062 -34.696 1.00 50.01 N ATOM 0 H ARG A 114 -3.151 -26.048 -32.393 1.00 1.03 H new ATOM 0 HA ARG A 114 -5.435 -26.377 -33.881 1.00 22.33 H new ATOM 0 HB2 ARG A 114 -4.722 -25.922 -31.046 1.00 21.14 H new ATOM 0 HB3 ARG A 114 -6.354 -25.423 -31.446 1.00 21.14 H new ATOM 0 HG2 ARG A 114 -6.550 -27.678 -30.749 1.00 2.43 H new ATOM 0 HG3 ARG A 114 -6.685 -27.730 -32.496 1.00 2.43 H new ATOM 0 HD2 ARG A 114 -3.939 -28.007 -31.317 1.00 31.22 H new ATOM 0 HD3 ARG A 114 -5.037 -29.358 -31.122 1.00 31.22 H new ATOM 0 HE ARG A 114 -5.147 -28.576 -33.852 1.00 34.21 H new ATOM 0 HH11 ARG A 114 -2.864 -29.914 -31.515 1.00 63.24 H new ATOM 0 HH12 ARG A 114 -1.946 -30.794 -32.742 1.00 63.24 H new ATOM 0 HH21 ARG A 114 -3.961 -29.710 -35.422 1.00 50.01 H new ATOM 0 HH22 ARG A 114 -2.564 -30.679 -34.943 1.00 50.01 H new ATOM 1785 N PRO A 115 -5.248 -23.269 -32.702 1.00 53.02 N ATOM 1786 CA PRO A 115 -5.702 -21.890 -32.906 1.00 45.11 C ATOM 1787 C PRO A 115 -5.103 -21.261 -34.159 1.00 53.52 C ATOM 1788 O PRO A 115 -3.934 -20.877 -34.176 1.00 25.25 O ATOM 1789 CB PRO A 115 -5.203 -21.165 -31.653 1.00 35.50 C ATOM 1790 CG PRO A 115 -4.033 -21.964 -31.192 1.00 43.41 C ATOM 1791 CD PRO A 115 -4.344 -23.393 -31.546 1.00 4.43 C ATOM 0 HA PRO A 115 -6.781 -21.833 -33.048 1.00 45.11 H new ATOM 0 HB2 PRO A 115 -4.917 -20.138 -31.878 1.00 35.50 H new ATOM 0 HB3 PRO A 115 -5.977 -21.120 -30.887 1.00 35.50 H new ATOM 0 HG2 PRO A 115 -3.117 -21.631 -31.679 1.00 43.41 H new ATOM 0 HG3 PRO A 115 -3.882 -21.852 -30.118 1.00 43.41 H new ATOM 0 HD2 PRO A 115 -3.442 -23.950 -31.799 1.00 4.43 H new ATOM 0 HD3 PRO A 115 -4.820 -23.918 -30.718 1.00 4.43 H new ATOM 1799 N VAL A 116 -5.913 -21.158 -35.209 1.00 24.41 N ATOM 1800 CA VAL A 116 -5.464 -20.574 -36.467 1.00 44.34 C ATOM 1801 C VAL A 116 -6.356 -19.409 -36.881 1.00 40.23 C ATOM 1802 O VAL A 116 -7.580 -19.530 -36.908 1.00 24.55 O ATOM 1803 CB VAL A 116 -5.447 -21.621 -37.596 1.00 61.33 C ATOM 1804 CG1 VAL A 116 -4.898 -21.014 -38.879 1.00 11.23 C ATOM 1805 CG2 VAL A 116 -4.632 -22.838 -37.183 1.00 25.14 C ATOM 0 H VAL A 116 -6.884 -21.472 -35.213 1.00 24.41 H new ATOM 0 HA VAL A 116 -4.450 -20.210 -36.304 1.00 44.34 H new ATOM 0 HB VAL A 116 -6.471 -21.944 -37.783 1.00 61.33 H new ATOM 0 HG11 VAL A 116 -4.894 -21.769 -39.666 1.00 11.23 H new ATOM 0 HG12 VAL A 116 -5.526 -20.177 -39.183 1.00 11.23 H new ATOM 0 HG13 VAL A 116 -3.881 -20.662 -38.709 1.00 11.23 H new ATOM 0 HG21 VAL A 116 -4.631 -23.567 -37.993 1.00 25.14 H new ATOM 0 HG22 VAL A 116 -3.608 -22.534 -36.967 1.00 25.14 H new ATOM 0 HG23 VAL A 116 -5.073 -23.286 -36.292 1.00 25.14 H new ATOM 1815 N VAL A 117 -5.733 -18.280 -37.205 1.00 30.02 N ATOM 1816 CA VAL A 117 -6.470 -17.093 -37.620 1.00 21.24 C ATOM 1817 C VAL A 117 -6.308 -16.840 -39.115 1.00 50.13 C ATOM 1818 O VAL A 117 -5.190 -16.740 -39.621 1.00 15.24 O ATOM 1819 CB VAL A 117 -6.006 -15.845 -36.846 1.00 32.30 C ATOM 1820 CG1 VAL A 117 -4.491 -15.716 -36.901 1.00 23.32 C ATOM 1821 CG2 VAL A 117 -6.675 -14.596 -37.400 1.00 61.41 C ATOM 0 H VAL A 117 -4.720 -18.163 -37.188 1.00 30.02 H new ATOM 0 HA VAL A 117 -7.521 -17.279 -37.398 1.00 21.24 H new ATOM 0 HB VAL A 117 -6.300 -15.955 -35.802 1.00 32.30 H new ATOM 0 HG11 VAL A 117 -4.181 -14.829 -36.349 1.00 23.32 H new ATOM 0 HG12 VAL A 117 -4.034 -16.599 -36.454 1.00 23.32 H new ATOM 0 HG13 VAL A 117 -4.171 -15.628 -37.939 1.00 23.32 H new ATOM 0 HG21 VAL A 117 -6.336 -13.723 -36.842 1.00 61.41 H new ATOM 0 HG22 VAL A 117 -6.412 -14.479 -38.451 1.00 61.41 H new ATOM 0 HG23 VAL A 117 -7.757 -14.690 -37.305 1.00 61.41 H new ATOM 1831 N VAL A 118 -7.431 -16.737 -39.818 1.00 13.14 N ATOM 1832 CA VAL A 118 -7.415 -16.495 -41.255 1.00 51.41 C ATOM 1833 C VAL A 118 -7.799 -15.054 -41.574 1.00 24.24 C ATOM 1834 O VAL A 118 -8.932 -14.635 -41.336 1.00 13.44 O ATOM 1835 CB VAL A 118 -8.373 -17.446 -41.996 1.00 54.32 C ATOM 1836 CG1 VAL A 118 -8.200 -17.312 -43.502 1.00 20.32 C ATOM 1837 CG2 VAL A 118 -8.147 -18.882 -41.551 1.00 23.24 C ATOM 0 H VAL A 118 -8.364 -16.818 -39.415 1.00 13.14 H new ATOM 0 HA VAL A 118 -6.396 -16.681 -41.595 1.00 51.41 H new ATOM 0 HB VAL A 118 -9.397 -17.169 -41.746 1.00 54.32 H new ATOM 0 HG11 VAL A 118 -8.885 -17.992 -44.009 1.00 20.32 H new ATOM 0 HG12 VAL A 118 -8.416 -16.287 -43.803 1.00 20.32 H new ATOM 0 HG13 VAL A 118 -7.174 -17.561 -43.774 1.00 20.32 H new ATOM 0 HG21 VAL A 118 -8.832 -19.540 -42.085 1.00 23.24 H new ATOM 0 HG22 VAL A 118 -7.120 -19.173 -41.770 1.00 23.24 H new ATOM 0 HG23 VAL A 118 -8.327 -18.963 -40.479 1.00 23.24 H new ATOM 1847 N THR A 119 -6.847 -14.299 -42.115 1.00 52.21 N ATOM 1848 CA THR A 119 -7.085 -12.905 -42.465 1.00 11.13 C ATOM 1849 C THR A 119 -7.041 -12.703 -43.977 1.00 60.11 C ATOM 1850 O THR A 119 -6.455 -13.494 -44.715 1.00 42.04 O ATOM 1851 CB THR A 119 -6.051 -11.975 -41.804 1.00 2.43 C ATOM 1852 OG1 THR A 119 -4.736 -12.522 -41.950 1.00 12.14 O ATOM 1853 CG2 THR A 119 -6.364 -11.781 -40.329 1.00 62.00 C ATOM 0 H THR A 119 -5.904 -14.630 -42.320 1.00 52.21 H new ATOM 0 HA THR A 119 -8.079 -12.651 -42.095 1.00 11.13 H new ATOM 0 HB THR A 119 -6.097 -11.005 -42.300 1.00 2.43 H new ATOM 0 HG1 THR A 119 -4.717 -13.126 -42.722 1.00 12.14 H new ATOM 0 HG21 THR A 119 -5.620 -11.121 -39.883 1.00 62.00 H new ATOM 0 HG22 THR A 119 -7.354 -11.337 -40.222 1.00 62.00 H new ATOM 0 HG23 THR A 119 -6.342 -12.746 -39.823 1.00 62.00 H new ATOM 1861 N PRO A 120 -7.674 -11.619 -44.448 1.00 32.54 N ATOM 1862 CA PRO A 120 -7.720 -11.287 -45.875 1.00 13.05 C ATOM 1863 C PRO A 120 -6.361 -10.849 -46.412 1.00 24.13 C ATOM 1864 O PRO A 120 -6.200 -10.622 -47.611 1.00 3.33 O ATOM 1865 CB PRO A 120 -8.719 -10.129 -45.938 1.00 5.22 C ATOM 1866 CG PRO A 120 -8.666 -9.508 -44.584 1.00 12.04 C ATOM 1867 CD PRO A 120 -8.393 -10.632 -43.624 1.00 22.43 C ATOM 0 HA PRO A 120 -8.003 -12.145 -46.484 1.00 13.05 H new ATOM 0 HB2 PRO A 120 -8.446 -9.413 -46.713 1.00 5.22 H new ATOM 0 HB3 PRO A 120 -9.723 -10.484 -46.171 1.00 5.22 H new ATOM 0 HG2 PRO A 120 -7.883 -8.751 -44.532 1.00 12.04 H new ATOM 0 HG3 PRO A 120 -9.606 -9.011 -44.346 1.00 12.04 H new ATOM 0 HD2 PRO A 120 -7.791 -10.300 -42.778 1.00 22.43 H new ATOM 0 HD3 PRO A 120 -9.316 -11.045 -43.216 1.00 22.43 H new ATOM 1875 N LYS A 121 -5.387 -10.730 -45.517 1.00 73.32 N ATOM 1876 CA LYS A 121 -4.041 -10.321 -45.900 1.00 44.30 C ATOM 1877 C LYS A 121 -3.063 -11.485 -45.781 1.00 52.20 C ATOM 1878 O LYS A 121 -1.877 -11.345 -46.075 1.00 42.24 O ATOM 1879 CB LYS A 121 -3.571 -9.156 -45.026 1.00 71.22 C ATOM 1880 CG LYS A 121 -4.426 -7.907 -45.166 1.00 52.53 C ATOM 1881 CD LYS A 121 -3.667 -6.662 -44.739 1.00 1.41 C ATOM 1882 CE LYS A 121 -2.871 -6.072 -45.894 1.00 12.44 C ATOM 1883 NZ LYS A 121 -2.255 -4.765 -45.532 1.00 3.22 N ATOM 0 H LYS A 121 -5.505 -10.911 -44.520 1.00 73.32 H new ATOM 0 HA LYS A 121 -4.070 -9.998 -46.941 1.00 44.30 H new ATOM 0 HB2 LYS A 121 -3.572 -9.472 -43.983 1.00 71.22 H new ATOM 0 HB3 LYS A 121 -2.541 -8.912 -45.284 1.00 71.22 H new ATOM 0 HG2 LYS A 121 -4.749 -7.800 -46.202 1.00 52.53 H new ATOM 0 HG3 LYS A 121 -5.326 -8.011 -44.560 1.00 52.53 H new ATOM 0 HD2 LYS A 121 -4.369 -5.918 -44.362 1.00 1.41 H new ATOM 0 HD3 LYS A 121 -2.992 -6.909 -43.919 1.00 1.41 H new ATOM 0 HE2 LYS A 121 -2.090 -6.772 -46.192 1.00 12.44 H new ATOM 0 HE3 LYS A 121 -3.525 -5.939 -46.756 1.00 12.44 H new ATOM 0 HZ1 LYS A 121 -1.721 -4.396 -46.345 1.00 3.22 H new ATOM 0 HZ2 LYS A 121 -3.002 -4.089 -45.272 1.00 3.22 H new ATOM 0 HZ3 LYS A 121 -1.611 -4.896 -44.726 1.00 3.22 H new ATOM 1897 N GLY A 122 -3.570 -12.636 -45.350 1.00 32.34 N ATOM 1898 CA GLY A 122 -2.727 -13.809 -45.202 1.00 41.23 C ATOM 1899 C GLY A 122 -3.219 -14.742 -44.112 1.00 20.44 C ATOM 1900 O GLY A 122 -4.278 -14.520 -43.527 1.00 44.13 O ATOM 0 H GLY A 122 -4.549 -12.777 -45.101 1.00 32.34 H new ATOM 0 HA2 GLY A 122 -2.690 -14.348 -46.149 1.00 41.23 H new ATOM 0 HA3 GLY A 122 -1.708 -13.494 -44.975 1.00 41.23 H new ATOM 1904 N VAL A 123 -2.447 -15.790 -43.841 1.00 54.54 N ATOM 1905 CA VAL A 123 -2.811 -16.761 -42.816 1.00 64.40 C ATOM 1906 C VAL A 123 -1.772 -16.796 -41.700 1.00 11.44 C ATOM 1907 O VAL A 123 -0.575 -16.651 -41.949 1.00 41.14 O ATOM 1908 CB VAL A 123 -2.959 -18.175 -43.408 1.00 61.30 C ATOM 1909 CG1 VAL A 123 -1.627 -18.669 -43.950 1.00 60.13 C ATOM 1910 CG2 VAL A 123 -3.510 -19.134 -42.365 1.00 65.32 C ATOM 0 H VAL A 123 -1.567 -15.988 -44.317 1.00 54.54 H new ATOM 0 HA VAL A 123 -3.771 -16.445 -42.407 1.00 64.40 H new ATOM 0 HB VAL A 123 -3.666 -18.131 -44.236 1.00 61.30 H new ATOM 0 HG11 VAL A 123 -1.751 -19.670 -44.364 1.00 60.13 H new ATOM 0 HG12 VAL A 123 -1.279 -17.993 -44.731 1.00 60.13 H new ATOM 0 HG13 VAL A 123 -0.894 -18.699 -43.143 1.00 60.13 H new ATOM 0 HG21 VAL A 123 -3.608 -20.128 -42.801 1.00 65.32 H new ATOM 0 HG22 VAL A 123 -2.830 -19.176 -41.514 1.00 65.32 H new ATOM 0 HG23 VAL A 123 -4.488 -18.786 -42.031 1.00 65.32 H new ATOM 1920 N ARG A 124 -2.238 -16.990 -40.471 1.00 61.33 N ATOM 1921 CA ARG A 124 -1.349 -17.044 -39.317 1.00 5.33 C ATOM 1922 C ARG A 124 -2.026 -17.744 -38.141 1.00 2.32 C ATOM 1923 O ARG A 124 -3.243 -17.935 -38.135 1.00 73.32 O ATOM 1924 CB ARG A 124 -0.925 -15.633 -38.907 1.00 72.22 C ATOM 1925 CG ARG A 124 0.247 -15.606 -37.939 1.00 14.12 C ATOM 1926 CD ARG A 124 1.432 -16.391 -38.477 1.00 45.23 C ATOM 1927 NE ARG A 124 1.675 -16.116 -39.891 1.00 25.11 N ATOM 1928 CZ ARG A 124 2.177 -14.971 -40.341 1.00 4.44 C ATOM 1929 NH1 ARG A 124 2.490 -14.001 -39.493 1.00 42.13 N ATOM 1930 NH2 ARG A 124 2.369 -14.795 -41.642 1.00 71.41 N ATOM 0 H ARG A 124 -3.226 -17.112 -40.249 1.00 61.33 H new ATOM 0 HA ARG A 124 -0.464 -17.615 -39.598 1.00 5.33 H new ATOM 0 HB2 ARG A 124 -0.660 -15.068 -39.801 1.00 72.22 H new ATOM 0 HB3 ARG A 124 -1.775 -15.126 -38.450 1.00 72.22 H new ATOM 0 HG2 ARG A 124 0.546 -14.574 -37.756 1.00 14.12 H new ATOM 0 HG3 ARG A 124 -0.062 -16.023 -36.980 1.00 14.12 H new ATOM 0 HD2 ARG A 124 2.323 -16.142 -37.901 1.00 45.23 H new ATOM 0 HD3 ARG A 124 1.252 -17.457 -38.341 1.00 45.23 H new ATOM 0 HE ARG A 124 1.447 -16.842 -40.570 1.00 25.11 H new ATOM 0 HH11 ARG A 124 2.346 -14.133 -38.492 1.00 42.13 H new ATOM 0 HH12 ARG A 124 2.875 -13.123 -39.842 1.00 42.13 H new ATOM 0 HH21 ARG A 124 2.131 -15.539 -42.298 1.00 71.41 H new ATOM 0 HH22 ARG A 124 2.754 -13.916 -41.986 1.00 71.41 H new ATOM 1944 N LEU A 125 -1.229 -18.127 -37.150 1.00 13.25 N ATOM 1945 CA LEU A 125 -1.751 -18.808 -35.969 1.00 62.43 C ATOM 1946 C LEU A 125 -2.456 -17.823 -35.041 1.00 13.44 C ATOM 1947 O LEU A 125 -1.916 -16.765 -34.717 1.00 22.25 O ATOM 1948 CB LEU A 125 -0.618 -19.511 -35.220 1.00 70.10 C ATOM 1949 CG LEU A 125 -0.306 -20.940 -35.662 1.00 61.33 C ATOM 1950 CD1 LEU A 125 -1.510 -21.842 -35.438 1.00 73.31 C ATOM 1951 CD2 LEU A 125 0.117 -20.967 -37.124 1.00 34.21 C ATOM 0 H LEU A 125 -0.220 -17.978 -37.140 1.00 13.25 H new ATOM 0 HA LEU A 125 -2.477 -19.552 -36.298 1.00 62.43 H new ATOM 0 HB2 LEU A 125 0.287 -18.913 -35.327 1.00 70.10 H new ATOM 0 HB3 LEU A 125 -0.866 -19.526 -34.159 1.00 70.10 H new ATOM 0 HG LEU A 125 0.521 -21.314 -35.058 1.00 61.33 H new ATOM 0 HD11 LEU A 125 -1.270 -22.856 -35.758 1.00 73.31 H new ATOM 0 HD12 LEU A 125 -1.768 -21.848 -34.379 1.00 73.31 H new ATOM 0 HD13 LEU A 125 -2.356 -21.470 -36.016 1.00 73.31 H new ATOM 0 HD21 LEU A 125 0.335 -21.993 -37.421 1.00 34.21 H new ATOM 0 HD22 LEU A 125 -0.689 -20.574 -37.743 1.00 34.21 H new ATOM 0 HD23 LEU A 125 1.008 -20.354 -37.256 1.00 34.21 H new ATOM 1963 N CYS A 126 -3.662 -18.181 -34.616 1.00 54.33 N ATOM 1964 CA CYS A 126 -4.442 -17.331 -33.723 1.00 44.33 C ATOM 1965 C CYS A 126 -3.732 -17.153 -32.385 1.00 42.32 C ATOM 1966 O CYS A 126 -3.977 -16.184 -31.666 1.00 12.02 O ATOM 1967 CB CYS A 126 -5.832 -17.927 -33.502 1.00 21.13 C ATOM 1968 SG CYS A 126 -6.809 -17.074 -32.241 1.00 20.32 S ATOM 0 H CYS A 126 -4.121 -19.054 -34.875 1.00 54.33 H new ATOM 0 HA CYS A 126 -4.546 -16.352 -34.192 1.00 44.33 H new ATOM 0 HB2 CYS A 126 -6.378 -17.907 -34.445 1.00 21.13 H new ATOM 0 HB3 CYS A 126 -5.726 -18.974 -33.218 1.00 21.13 H new ATOM 0 HG CYS A 126 -7.969 -17.650 -32.128 1.00 20.32 H new ATOM 1974 N ARG A 127 -2.855 -18.095 -32.057 1.00 73.23 N ATOM 1975 CA ARG A 127 -2.112 -18.043 -30.803 1.00 60.05 C ATOM 1976 C ARG A 127 -0.650 -18.422 -31.022 1.00 64.15 C ATOM 1977 O ARG A 127 -0.299 -19.118 -31.975 1.00 41.44 O ATOM 1978 CB ARG A 127 -2.744 -18.981 -29.773 1.00 74.15 C ATOM 1979 CG ARG A 127 -3.440 -18.255 -28.634 1.00 10.24 C ATOM 1980 CD ARG A 127 -3.382 -19.055 -27.343 1.00 14.41 C ATOM 1981 NE ARG A 127 -2.066 -18.982 -26.714 1.00 64.12 N ATOM 1982 CZ ARG A 127 -1.672 -17.970 -25.948 1.00 52.54 C ATOM 1983 NH1 ARG A 127 -2.490 -16.952 -25.718 1.00 24.03 N ATOM 1984 NH2 ARG A 127 -0.459 -17.977 -25.411 1.00 34.24 N ATOM 0 H ARG A 127 -2.641 -18.903 -32.641 1.00 73.23 H new ATOM 0 HA ARG A 127 -2.152 -17.021 -30.427 1.00 60.05 H new ATOM 0 HB2 ARG A 127 -3.465 -19.626 -30.276 1.00 74.15 H new ATOM 0 HB3 ARG A 127 -1.970 -19.628 -29.361 1.00 74.15 H new ATOM 0 HG2 ARG A 127 -2.972 -17.283 -28.482 1.00 10.24 H new ATOM 0 HG3 ARG A 127 -4.480 -18.070 -28.902 1.00 10.24 H new ATOM 0 HD2 ARG A 127 -4.136 -18.681 -26.651 1.00 14.41 H new ATOM 0 HD3 ARG A 127 -3.628 -20.097 -27.550 1.00 14.41 H new ATOM 0 HE ARG A 127 -1.413 -19.750 -26.871 1.00 64.12 H new ATOM 0 HH11 ARG A 127 -3.423 -16.945 -26.129 1.00 24.03 H new ATOM 0 HH12 ARG A 127 -2.186 -16.176 -25.130 1.00 24.03 H new ATOM 0 HH21 ARG A 127 0.172 -18.759 -25.586 1.00 34.24 H new ATOM 0 HH22 ARG A 127 -0.157 -17.200 -24.823 1.00 34.24 H new ATOM 1998 N PRO A 128 0.224 -17.952 -30.120 1.00 65.41 N ATOM 1999 CA PRO A 128 -0.181 -17.122 -28.983 1.00 11.44 C ATOM 2000 C PRO A 128 -0.634 -15.730 -29.412 1.00 21.34 C ATOM 2001 O PRO A 128 -0.665 -15.418 -30.603 1.00 62.33 O ATOM 2002 CB PRO A 128 1.092 -17.031 -28.137 1.00 23.43 C ATOM 2003 CG PRO A 128 2.205 -17.242 -29.105 1.00 4.32 C ATOM 2004 CD PRO A 128 1.677 -18.195 -30.142 1.00 30.21 C ATOM 0 HA PRO A 128 -1.033 -17.548 -28.453 1.00 11.44 H new ATOM 0 HB2 PRO A 128 1.173 -16.061 -27.646 1.00 23.43 H new ATOM 0 HB3 PRO A 128 1.101 -17.787 -27.352 1.00 23.43 H new ATOM 0 HG2 PRO A 128 2.510 -16.300 -29.560 1.00 4.32 H new ATOM 0 HG3 PRO A 128 3.083 -17.654 -28.607 1.00 4.32 H new ATOM 0 HD2 PRO A 128 2.103 -17.995 -31.125 1.00 30.21 H new ATOM 0 HD3 PRO A 128 1.915 -19.230 -29.895 1.00 30.21 H new ATOM 2012 N ALA A 129 -0.985 -14.899 -28.437 1.00 61.24 N ATOM 2013 CA ALA A 129 -1.435 -13.541 -28.716 1.00 70.45 C ATOM 2014 C ALA A 129 -0.371 -12.756 -29.476 1.00 50.04 C ATOM 2015 O ALA A 129 -0.668 -11.744 -30.108 1.00 35.23 O ATOM 2016 CB ALA A 129 -1.795 -12.828 -27.420 1.00 11.13 C ATOM 0 H ALA A 129 -0.966 -15.142 -27.447 1.00 61.24 H new ATOM 0 HA ALA A 129 -2.324 -13.600 -29.344 1.00 70.45 H new ATOM 0 HB1 ALA A 129 -2.129 -11.815 -27.643 1.00 11.13 H new ATOM 0 HB2 ALA A 129 -2.594 -13.371 -26.916 1.00 11.13 H new ATOM 0 HB3 ALA A 129 -0.919 -12.787 -26.772 1.00 11.13 H new ATOM 2022 N GLU A 130 0.869 -13.230 -29.408 1.00 2.40 N ATOM 2023 CA GLU A 130 1.976 -12.570 -30.090 1.00 31.43 C ATOM 2024 C GLU A 130 1.877 -12.762 -31.600 1.00 12.01 C ATOM 2025 O GLU A 130 2.160 -11.848 -32.375 1.00 13.14 O ATOM 2026 CB GLU A 130 3.313 -13.113 -29.582 1.00 24.41 C ATOM 2027 CG GLU A 130 3.641 -12.691 -28.160 1.00 33.44 C ATOM 2028 CD GLU A 130 5.061 -13.043 -27.759 1.00 43.13 C ATOM 2029 OE1 GLU A 130 5.703 -13.834 -28.481 1.00 25.21 O ATOM 2030 OE2 GLU A 130 5.530 -12.525 -26.724 1.00 34.23 O ATOM 0 H GLU A 130 1.132 -14.067 -28.888 1.00 2.40 H new ATOM 0 HA GLU A 130 1.919 -11.503 -29.873 1.00 31.43 H new ATOM 0 HB2 GLU A 130 3.297 -14.202 -29.634 1.00 24.41 H new ATOM 0 HB3 GLU A 130 4.109 -12.774 -30.245 1.00 24.41 H new ATOM 0 HG2 GLU A 130 3.496 -11.615 -28.062 1.00 33.44 H new ATOM 0 HG3 GLU A 130 2.944 -13.171 -27.473 1.00 33.44 H new ATOM 2037 N THR A 131 1.476 -13.960 -32.013 1.00 24.22 N ATOM 2038 CA THR A 131 1.341 -14.275 -33.430 1.00 72.33 C ATOM 2039 C THR A 131 0.143 -13.556 -34.042 1.00 53.43 C ATOM 2040 O THR A 131 0.250 -12.949 -35.108 1.00 62.40 O ATOM 2041 CB THR A 131 1.186 -15.790 -33.657 1.00 74.31 C ATOM 2042 OG1 THR A 131 0.274 -16.338 -32.699 1.00 53.52 O ATOM 2043 CG2 THR A 131 2.530 -16.494 -33.546 1.00 4.41 C ATOM 0 H THR A 131 1.239 -14.729 -31.386 1.00 24.22 H new ATOM 0 HA THR A 131 2.254 -13.934 -33.917 1.00 72.33 H new ATOM 0 HB THR A 131 0.794 -15.946 -34.662 1.00 74.31 H new ATOM 0 HG1 THR A 131 -0.076 -15.619 -32.132 1.00 53.52 H new ATOM 0 HG21 THR A 131 2.395 -17.563 -33.710 1.00 4.41 H new ATOM 0 HG22 THR A 131 3.213 -16.095 -34.296 1.00 4.41 H new ATOM 0 HG23 THR A 131 2.946 -16.329 -32.552 1.00 4.41 H new ATOM 2051 N VAL A 132 -0.995 -13.628 -33.360 1.00 43.15 N ATOM 2052 CA VAL A 132 -2.213 -12.982 -33.836 1.00 30.43 C ATOM 2053 C VAL A 132 -2.051 -11.467 -33.876 1.00 51.44 C ATOM 2054 O VAL A 132 -2.486 -10.812 -34.823 1.00 34.45 O ATOM 2055 CB VAL A 132 -3.420 -13.335 -32.946 1.00 55.11 C ATOM 2056 CG1 VAL A 132 -3.203 -12.831 -31.527 1.00 65.21 C ATOM 2057 CG2 VAL A 132 -4.700 -12.762 -33.535 1.00 23.54 C ATOM 0 H VAL A 132 -1.100 -14.127 -32.476 1.00 43.15 H new ATOM 0 HA VAL A 132 -2.395 -13.352 -34.845 1.00 30.43 H new ATOM 0 HB VAL A 132 -3.518 -14.420 -32.909 1.00 55.11 H new ATOM 0 HG11 VAL A 132 -4.066 -13.090 -30.913 1.00 65.21 H new ATOM 0 HG12 VAL A 132 -2.309 -13.294 -31.109 1.00 65.21 H new ATOM 0 HG13 VAL A 132 -3.079 -11.748 -31.540 1.00 65.21 H new ATOM 0 HG21 VAL A 132 -5.543 -13.020 -32.894 1.00 23.54 H new ATOM 0 HG22 VAL A 132 -4.615 -11.677 -33.603 1.00 23.54 H new ATOM 0 HG23 VAL A 132 -4.860 -13.177 -34.530 1.00 23.54 H new ATOM 2067 N GLN A 133 -1.423 -10.916 -32.842 1.00 2.32 N ATOM 2068 CA GLN A 133 -1.205 -9.477 -32.759 1.00 74.13 C ATOM 2069 C GLN A 133 -0.154 -9.027 -33.769 1.00 64.24 C ATOM 2070 O GLN A 133 -0.136 -7.870 -34.186 1.00 31.42 O ATOM 2071 CB GLN A 133 -0.772 -9.085 -31.346 1.00 32.42 C ATOM 2072 CG GLN A 133 0.692 -9.374 -31.056 1.00 21.31 C ATOM 2073 CD GLN A 133 1.100 -8.973 -29.652 1.00 43.41 C ATOM 2074 OE1 GLN A 133 2.009 -8.166 -29.464 1.00 25.13 O ATOM 2075 NE2 GLN A 133 0.427 -9.539 -28.657 1.00 30.52 N ATOM 0 H GLN A 133 -1.056 -11.445 -32.050 1.00 2.32 H new ATOM 0 HA GLN A 133 -2.146 -8.979 -32.994 1.00 74.13 H new ATOM 0 HB2 GLN A 133 -0.960 -8.021 -31.199 1.00 32.42 H new ATOM 0 HB3 GLN A 133 -1.389 -9.620 -30.624 1.00 32.42 H new ATOM 0 HG2 GLN A 133 0.883 -10.438 -31.196 1.00 21.31 H new ATOM 0 HG3 GLN A 133 1.313 -8.842 -31.777 1.00 21.31 H new ATOM 0 HE21 GLN A 133 -0.320 -10.203 -28.860 1.00 30.52 H new ATOM 0 HE22 GLN A 133 0.657 -9.309 -27.690 1.00 30.52 H new ATOM 2084 N GLU A 134 0.720 -9.950 -34.157 1.00 60.44 N ATOM 2085 CA GLU A 134 1.775 -9.648 -35.116 1.00 75.34 C ATOM 2086 C GLU A 134 1.209 -9.532 -36.529 1.00 14.43 C ATOM 2087 O GLU A 134 1.547 -8.611 -37.272 1.00 50.35 O ATOM 2088 CB GLU A 134 2.858 -10.728 -35.075 1.00 71.00 C ATOM 2089 CG GLU A 134 4.035 -10.378 -34.179 1.00 70.11 C ATOM 2090 CD GLU A 134 4.903 -9.279 -34.760 1.00 23.02 C ATOM 2091 OE1 GLU A 134 5.536 -9.514 -35.810 1.00 73.42 O ATOM 2092 OE2 GLU A 134 4.950 -8.183 -34.163 1.00 1.23 O ATOM 0 H GLU A 134 0.718 -10.913 -33.822 1.00 60.44 H new ATOM 0 HA GLU A 134 2.217 -8.691 -34.841 1.00 75.34 H new ATOM 0 HB2 GLU A 134 2.415 -11.662 -34.730 1.00 71.00 H new ATOM 0 HB3 GLU A 134 3.223 -10.903 -36.087 1.00 71.00 H new ATOM 0 HG2 GLU A 134 3.664 -10.065 -33.203 1.00 70.11 H new ATOM 0 HG3 GLU A 134 4.642 -11.269 -34.018 1.00 70.11 H new ATOM 2099 N LEU A 135 0.346 -10.475 -36.892 1.00 63.23 N ATOM 2100 CA LEU A 135 -0.268 -10.480 -38.215 1.00 52.12 C ATOM 2101 C LEU A 135 -1.304 -9.368 -38.340 1.00 40.42 C ATOM 2102 O LEU A 135 -1.419 -8.727 -39.385 1.00 13.10 O ATOM 2103 CB LEU A 135 -0.922 -11.836 -38.490 1.00 44.30 C ATOM 2104 CG LEU A 135 -1.860 -11.897 -39.696 1.00 71.45 C ATOM 2105 CD1 LEU A 135 -1.064 -11.958 -40.990 1.00 51.20 C ATOM 2106 CD2 LEU A 135 -2.794 -13.093 -39.585 1.00 40.12 C ATOM 0 H LEU A 135 0.056 -11.245 -36.289 1.00 63.23 H new ATOM 0 HA LEU A 135 0.515 -10.305 -38.952 1.00 52.12 H new ATOM 0 HB2 LEU A 135 -0.133 -12.575 -38.631 1.00 44.30 H new ATOM 0 HB3 LEU A 135 -1.483 -12.133 -37.604 1.00 44.30 H new ATOM 0 HG LEU A 135 -2.464 -10.990 -39.708 1.00 71.45 H new ATOM 0 HD11 LEU A 135 -1.749 -12.001 -41.837 1.00 51.20 H new ATOM 0 HD12 LEU A 135 -0.438 -11.070 -41.074 1.00 51.20 H new ATOM 0 HD13 LEU A 135 -0.434 -12.847 -40.988 1.00 51.20 H new ATOM 0 HD21 LEU A 135 -3.454 -13.121 -40.452 1.00 40.12 H new ATOM 0 HD22 LEU A 135 -2.207 -14.011 -39.547 1.00 40.12 H new ATOM 0 HD23 LEU A 135 -3.391 -13.006 -38.677 1.00 40.12 H new ATOM 2118 N LEU A 136 -2.056 -9.145 -37.267 1.00 41.21 N ATOM 2119 CA LEU A 136 -3.082 -8.108 -37.255 1.00 15.34 C ATOM 2120 C LEU A 136 -2.709 -6.984 -36.293 1.00 11.23 C ATOM 2121 O LEU A 136 -1.531 -6.697 -36.086 1.00 73.12 O ATOM 2122 CB LEU A 136 -4.434 -8.706 -36.860 1.00 61.43 C ATOM 2123 CG LEU A 136 -5.519 -7.705 -36.462 1.00 1.10 C ATOM 2124 CD1 LEU A 136 -6.840 -8.057 -37.128 1.00 73.42 C ATOM 2125 CD2 LEU A 136 -5.677 -7.662 -34.949 1.00 14.51 C ATOM 0 H LEU A 136 -1.974 -9.668 -36.395 1.00 41.21 H new ATOM 0 HA LEU A 136 -3.155 -7.692 -38.260 1.00 15.34 H new ATOM 0 HB2 LEU A 136 -4.804 -9.300 -37.696 1.00 61.43 H new ATOM 0 HB3 LEU A 136 -4.276 -9.391 -36.027 1.00 61.43 H new ATOM 0 HG LEU A 136 -5.216 -6.715 -36.803 1.00 1.10 H new ATOM 0 HD11 LEU A 136 -7.600 -7.334 -36.833 1.00 73.42 H new ATOM 0 HD12 LEU A 136 -6.719 -8.035 -38.211 1.00 73.42 H new ATOM 0 HD13 LEU A 136 -7.149 -9.055 -36.818 1.00 73.42 H new ATOM 0 HD21 LEU A 136 -6.453 -6.944 -34.685 1.00 14.51 H new ATOM 0 HD22 LEU A 136 -5.957 -8.650 -34.584 1.00 14.51 H new ATOM 0 HD23 LEU A 136 -4.734 -7.361 -34.493 1.00 14.51 H new TER 2137 LEU A 136