USER MOD reduce.3.24.130724 H: found=0, std=0, add=1060, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1053 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 68 THR OG1 : rot 150:sc= -0.993 USER MOD Set 1.2: A 110 HIS : no HD1:sc= -1.05 X(o=-2,f=-2.2) USER MOD Single : A 1 MET CE :methyl 145:sc= -0.143 (180deg=-1.89!) USER MOD Single : A 1 MET N :NH3+ -151:sc= -3.97! (180deg=-5.47!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 CYS SG : rot -120:sc= -0.0169 USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 HIS : no HD1:sc= -2.81 K(o=-2.8,f=-4.9!) USER MOD Single : A 8 GLN : amide:sc= -0.196 X(o=-0.2,f=-0.2) USER MOD Single : A 11 MET CE :methyl 160:sc= -2.05 (180deg=-4.04) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 176:sc= -0.38 (180deg=-0.459) USER MOD Single : A 20 TYR OH : rot 180:sc= -0.815 USER MOD Single : A 21 THR OG1 : rot 65:sc= 1.3 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 160:sc= 0.794 USER MOD Single : A 30 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00705) USER MOD Single : A 33 HIS : no HD1:sc= -0.975 X(o=-0.98,f=-0.87) USER MOD Single : A 36 TYR OH : rot 167:sc= -2.61! USER MOD Single : A 37 CYS SG : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HE2:sc= -2.6 K(o=-2.6,f=-4.9!) USER MOD Single : A 40 CYS SG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0.0101 USER MOD Single : A 45 MET CE :methyl 158:sc= -0.0122 (180deg=-0.469) USER MOD Single : A 46 ASN : amide:sc= -1.07 K(o=-1.1,f=-1.7) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl 173:sc= -1.61 (180deg=-1.74) USER MOD Single : A 56 GLN :FLIP amide:sc= -0.162 F(o=-0.94,f=-0.16) USER MOD Single : A 58 LYS NZ :NH3+ -139:sc= -0.0766 (180deg=-0.411) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= 0.423 K(o=0.42,f=-0.41) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -168:sc= 0.156 (180deg=0.114) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.0829 USER MOD Single : A 85 GLN : amide:sc= -0.158 K(o=-0.16,f=-0.78) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -64:sc= 1.25 USER MOD Single : A 97 ASN : amide:sc= -0.13 X(o=-0.13,f=-0.34) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 166:sc= 0.745 (180deg=0.633) USER MOD Single : A 106 ASN : amide:sc= -1.71 K(o=-1.7,f=-2.9) USER MOD Single : A 108 GLN :FLIP amide:sc= -0.343 F(o=-2.1,f=-0.34) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.72 USER MOD Single : A 115 LYS NZ :NH3+ -155:sc= -2.56 (180deg=-3.51!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= -0.0151 X(o=-0.015,f=0) USER MOD Single : A 128 ASN :FLIP amide:sc= -3.08! F(o=-4.3,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.566 10.936 4.091 1.00 60.43 N ATOM 2 CA MET A 1 -12.352 10.622 2.683 1.00 5.34 C ATOM 3 C MET A 1 -13.635 10.106 2.040 1.00 1.32 C ATOM 4 O MET A 1 -14.091 10.635 1.027 1.00 71.03 O ATOM 5 CB MET A 1 -11.240 9.581 2.534 1.00 21.11 C ATOM 6 CG MET A 1 -9.941 9.979 3.216 1.00 2.51 C ATOM 7 SD MET A 1 -8.594 10.239 2.048 1.00 33.32 S ATOM 8 CE MET A 1 -7.172 10.046 3.121 1.00 2.12 C ATOM 0 H1 MET A 1 -11.917 11.696 4.380 1.00 60.43 H new ATOM 0 H2 MET A 1 -13.548 11.248 4.232 1.00 60.43 H new ATOM 0 H3 MET A 1 -12.386 10.089 4.667 1.00 60.43 H new ATOM 0 HA MET A 1 -12.054 11.538 2.174 1.00 5.34 H new ATOM 0 HB2 MET A 1 -11.583 8.633 2.948 1.00 21.11 H new ATOM 0 HB3 MET A 1 -11.048 9.415 1.474 1.00 21.11 H new ATOM 0 HG2 MET A 1 -10.101 10.892 3.789 1.00 2.51 H new ATOM 0 HG3 MET A 1 -9.656 9.203 3.926 1.00 2.51 H new ATOM 0 HE1 MET A 1 -6.361 9.571 2.569 1.00 2.12 H new ATOM 0 HE2 MET A 1 -6.846 11.025 3.473 1.00 2.12 H new ATOM 0 HE3 MET A 1 -7.442 9.425 3.975 1.00 2.12 H new ATOM 18 N LYS A 2 -14.215 9.068 2.635 1.00 3.35 N ATOM 19 CA LYS A 2 -15.447 8.480 2.122 1.00 74.43 C ATOM 20 C LYS A 2 -15.964 7.395 3.061 1.00 22.04 C ATOM 21 O LYS A 2 -15.477 7.247 4.182 1.00 61.45 O ATOM 22 CB LYS A 2 -15.214 7.896 0.727 1.00 43.23 C ATOM 23 CG LYS A 2 -14.344 6.651 0.726 1.00 75.44 C ATOM 24 CD LYS A 2 -13.029 6.891 0.004 1.00 34.51 C ATOM 25 CE LYS A 2 -11.860 6.272 0.755 1.00 63.13 C ATOM 26 NZ LYS A 2 -11.477 4.948 0.192 1.00 72.41 N ATOM 0 H LYS A 2 -13.851 8.617 3.474 1.00 3.35 H new ATOM 0 HA LYS A 2 -16.198 9.267 2.058 1.00 74.43 H new ATOM 0 HB2 LYS A 2 -16.177 7.656 0.277 1.00 43.23 H new ATOM 0 HB3 LYS A 2 -14.749 8.655 0.098 1.00 43.23 H new ATOM 0 HG2 LYS A 2 -14.146 6.344 1.753 1.00 75.44 H new ATOM 0 HG3 LYS A 2 -14.880 5.832 0.246 1.00 75.44 H new ATOM 0 HD2 LYS A 2 -13.082 6.470 -1.000 1.00 34.51 H new ATOM 0 HD3 LYS A 2 -12.864 7.963 -0.108 1.00 34.51 H new ATOM 0 HE2 LYS A 2 -11.004 6.946 0.713 1.00 63.13 H new ATOM 0 HE3 LYS A 2 -12.124 6.157 1.806 1.00 63.13 H new ATOM 0 HZ1 LYS A 2 -10.677 4.560 0.731 1.00 72.41 H new ATOM 0 HZ2 LYS A 2 -12.286 4.297 0.255 1.00 72.41 H new ATOM 0 HZ3 LYS A 2 -11.200 5.061 -0.804 1.00 72.41 H new ATOM 40 N CYS A 3 -16.951 6.638 2.594 1.00 43.34 N ATOM 41 CA CYS A 3 -17.533 5.564 3.392 1.00 23.33 C ATOM 42 C CYS A 3 -18.681 4.894 2.645 1.00 33.44 C ATOM 43 O CYS A 3 -19.819 4.849 3.115 1.00 21.30 O ATOM 44 CB CYS A 3 -18.031 6.110 4.732 1.00 31.54 C ATOM 45 SG CYS A 3 -18.899 7.691 4.610 1.00 31.24 S ATOM 0 H CYS A 3 -17.365 6.748 1.668 1.00 43.34 H new ATOM 0 HA CYS A 3 -16.759 4.819 3.576 1.00 23.33 H new ATOM 0 HB2 CYS A 3 -18.697 5.376 5.186 1.00 31.54 H new ATOM 0 HB3 CYS A 3 -17.180 6.226 5.403 1.00 31.54 H new ATOM 0 HG CYS A 3 -18.280 8.582 5.326 1.00 31.24 H new ATOM 51 N PRO A 4 -18.379 4.359 1.452 1.00 71.42 N ATOM 52 CA PRO A 4 -19.372 3.680 0.614 1.00 33.24 C ATOM 53 C PRO A 4 -19.819 2.349 1.208 1.00 2.20 C ATOM 54 O PRO A 4 -20.624 1.632 0.613 1.00 45.24 O ATOM 55 CB PRO A 4 -18.628 3.456 -0.705 1.00 62.21 C ATOM 56 CG PRO A 4 -17.188 3.427 -0.327 1.00 30.35 C ATOM 57 CD PRO A 4 -17.044 4.375 0.831 1.00 22.14 C ATOM 0 HA PRO A 4 -20.286 4.264 0.509 1.00 33.24 H new ATOM 0 HB2 PRO A 4 -18.932 2.522 -1.177 1.00 62.21 H new ATOM 0 HB3 PRO A 4 -18.834 4.255 -1.417 1.00 62.21 H new ATOM 0 HG2 PRO A 4 -16.878 2.420 -0.048 1.00 30.35 H new ATOM 0 HG3 PRO A 4 -16.559 3.734 -1.163 1.00 30.35 H new ATOM 0 HD2 PRO A 4 -16.273 4.045 1.527 1.00 22.14 H new ATOM 0 HD3 PRO A 4 -16.767 5.376 0.499 1.00 22.14 H new ATOM 65 N VAL A 5 -19.292 2.024 2.384 1.00 71.21 N ATOM 66 CA VAL A 5 -19.639 0.779 3.059 1.00 62.42 C ATOM 67 C VAL A 5 -20.798 0.982 4.027 1.00 73.21 C ATOM 68 O VAL A 5 -21.660 0.114 4.170 1.00 51.04 O ATOM 69 CB VAL A 5 -18.435 0.205 3.830 1.00 22.40 C ATOM 70 CG1 VAL A 5 -17.343 -0.234 2.866 1.00 53.15 C ATOM 71 CG2 VAL A 5 -17.903 1.226 4.823 1.00 44.24 C ATOM 0 H VAL A 5 -18.623 2.605 2.889 1.00 71.21 H new ATOM 0 HA VAL A 5 -19.937 0.072 2.285 1.00 62.42 H new ATOM 0 HB VAL A 5 -18.767 -0.671 4.388 1.00 22.40 H new ATOM 0 HG11 VAL A 5 -16.501 -0.637 3.429 1.00 53.15 H new ATOM 0 HG12 VAL A 5 -17.734 -1.002 2.199 1.00 53.15 H new ATOM 0 HG13 VAL A 5 -17.011 0.622 2.279 1.00 53.15 H new ATOM 0 HG21 VAL A 5 -17.053 0.804 5.359 1.00 44.24 H new ATOM 0 HG22 VAL A 5 -17.587 2.122 4.289 1.00 44.24 H new ATOM 0 HG23 VAL A 5 -18.688 1.485 5.534 1.00 44.24 H new ATOM 81 N CYS A 6 -20.813 2.133 4.689 1.00 22.52 N ATOM 82 CA CYS A 6 -21.868 2.452 5.646 1.00 2.12 C ATOM 83 C CYS A 6 -22.500 3.803 5.328 1.00 24.23 C ATOM 84 O CYS A 6 -23.695 4.008 5.544 1.00 61.32 O ATOM 85 CB CYS A 6 -21.309 2.459 7.069 1.00 5.25 C ATOM 86 SG CYS A 6 -22.450 1.810 8.313 1.00 13.52 S ATOM 0 H CYS A 6 -20.107 2.861 4.581 1.00 22.52 H new ATOM 0 HA CYS A 6 -22.638 1.684 5.570 1.00 2.12 H new ATOM 0 HB2 CYS A 6 -20.392 1.871 7.091 1.00 5.25 H new ATOM 0 HB3 CYS A 6 -21.039 3.480 7.337 1.00 5.25 H new ATOM 0 HG CYS A 6 -21.887 1.855 9.484 1.00 13.52 H new ATOM 92 N HIS A 7 -21.690 4.724 4.815 1.00 12.24 N ATOM 93 CA HIS A 7 -22.170 6.057 4.467 1.00 1.12 C ATOM 94 C HIS A 7 -22.585 6.827 5.717 1.00 5.22 C ATOM 95 O HIS A 7 -23.727 7.269 5.834 1.00 4.43 O ATOM 96 CB HIS A 7 -23.349 5.961 3.499 1.00 62.23 C ATOM 97 CG HIS A 7 -23.059 5.139 2.281 1.00 45.33 C ATOM 98 ND1 HIS A 7 -23.031 5.665 1.006 1.00 12.02 N ATOM 99 CD2 HIS A 7 -22.780 3.821 2.149 1.00 72.33 C ATOM 100 CE1 HIS A 7 -22.750 4.707 0.142 1.00 31.13 C ATOM 101 NE2 HIS A 7 -22.592 3.577 0.810 1.00 54.32 N ATOM 0 H HIS A 7 -20.698 4.572 4.631 1.00 12.24 H new ATOM 0 HA HIS A 7 -21.355 6.595 3.983 1.00 1.12 H new ATOM 0 HB2 HIS A 7 -24.204 5.532 4.022 1.00 62.23 H new ATOM 0 HB3 HIS A 7 -23.637 6.966 3.189 1.00 62.23 H new ATOM 0 HD2 HIS A 7 -22.717 3.096 2.947 1.00 72.33 H new ATOM 0 HE1 HIS A 7 -22.664 4.826 -0.928 1.00 31.13 H new ATOM 0 HE2 HIS A 7 -22.367 2.671 0.398 1.00 54.32 H new ATOM 109 N GLN A 8 -21.649 6.983 6.649 1.00 75.22 N ATOM 110 CA GLN A 8 -21.918 7.698 7.890 1.00 53.34 C ATOM 111 C GLN A 8 -20.974 8.885 8.050 1.00 33.24 C ATOM 112 O GLN A 8 -21.366 10.034 7.851 1.00 24.34 O ATOM 113 CB GLN A 8 -21.780 6.756 9.086 1.00 5.15 C ATOM 114 CG GLN A 8 -22.907 5.742 9.197 1.00 63.42 C ATOM 115 CD GLN A 8 -24.272 6.395 9.297 1.00 62.34 C ATOM 116 OE1 GLN A 8 -24.509 7.233 10.166 1.00 35.22 O ATOM 117 NE2 GLN A 8 -25.178 6.014 8.404 1.00 61.52 N ATOM 0 H GLN A 8 -20.698 6.623 6.567 1.00 75.22 H new ATOM 0 HA GLN A 8 -22.940 8.074 7.849 1.00 53.34 H new ATOM 0 HB2 GLN A 8 -20.831 6.225 9.012 1.00 5.15 H new ATOM 0 HB3 GLN A 8 -21.743 7.347 10.001 1.00 5.15 H new ATOM 0 HG2 GLN A 8 -22.886 5.084 8.328 1.00 63.42 H new ATOM 0 HG3 GLN A 8 -22.743 5.116 10.074 1.00 63.42 H new ATOM 0 HE21 GLN A 8 -24.938 5.316 7.700 1.00 61.52 H new ATOM 0 HE22 GLN A 8 -26.114 6.420 8.422 1.00 61.52 H new ATOM 126 N GLY A 9 -19.727 8.598 8.413 1.00 22.45 N ATOM 127 CA GLY A 9 -18.747 9.653 8.594 1.00 5.51 C ATOM 128 C GLY A 9 -17.841 9.815 7.390 1.00 52.11 C ATOM 129 O GLY A 9 -18.295 10.192 6.310 1.00 22.42 O ATOM 0 H GLY A 9 -19.379 7.655 8.585 1.00 22.45 H new ATOM 0 HA2 GLY A 9 -19.262 10.594 8.786 1.00 5.51 H new ATOM 0 HA3 GLY A 9 -18.142 9.435 9.474 1.00 5.51 H new ATOM 133 N GLU A 10 -16.555 9.533 7.576 1.00 40.24 N ATOM 134 CA GLU A 10 -15.583 9.653 6.496 1.00 24.34 C ATOM 135 C GLU A 10 -14.215 9.138 6.936 1.00 70.42 C ATOM 136 O GLU A 10 -13.451 9.853 7.586 1.00 12.00 O ATOM 137 CB GLU A 10 -15.471 11.109 6.040 1.00 14.44 C ATOM 138 CG GLU A 10 -15.348 12.098 7.188 1.00 70.31 C ATOM 139 CD GLU A 10 -15.415 13.540 6.724 1.00 4.40 C ATOM 140 OE1 GLU A 10 -14.422 14.024 6.142 1.00 30.31 O ATOM 141 OE2 GLU A 10 -16.463 14.185 6.943 1.00 62.43 O ATOM 0 H GLU A 10 -16.163 9.220 8.464 1.00 40.24 H new ATOM 0 HA GLU A 10 -15.929 9.045 5.660 1.00 24.34 H new ATOM 0 HB2 GLU A 10 -14.603 11.211 5.389 1.00 14.44 H new ATOM 0 HB3 GLU A 10 -16.348 11.363 5.445 1.00 14.44 H new ATOM 0 HG2 GLU A 10 -16.145 11.914 7.908 1.00 70.31 H new ATOM 0 HG3 GLU A 10 -14.405 11.931 7.708 1.00 70.31 H new ATOM 148 N MET A 11 -13.913 7.896 6.577 1.00 22.43 N ATOM 149 CA MET A 11 -12.637 7.285 6.933 1.00 12.22 C ATOM 150 C MET A 11 -11.473 8.086 6.358 1.00 73.13 C ATOM 151 O MET A 11 -11.228 8.064 5.153 1.00 70.24 O ATOM 152 CB MET A 11 -12.579 5.842 6.428 1.00 13.21 C ATOM 153 CG MET A 11 -13.069 5.679 4.998 1.00 31.10 C ATOM 154 SD MET A 11 -12.396 4.211 4.197 1.00 11.41 S ATOM 155 CE MET A 11 -12.403 3.048 5.560 1.00 75.52 C ATOM 0 H MET A 11 -14.534 7.292 6.039 1.00 22.43 H new ATOM 0 HA MET A 11 -12.553 7.284 8.020 1.00 12.22 H new ATOM 0 HB2 MET A 11 -11.552 5.483 6.495 1.00 13.21 H new ATOM 0 HB3 MET A 11 -13.180 5.212 7.084 1.00 13.21 H new ATOM 0 HG2 MET A 11 -14.158 5.623 4.995 1.00 31.10 H new ATOM 0 HG3 MET A 11 -12.794 6.562 4.421 1.00 31.10 H new ATOM 0 HE1 MET A 11 -12.362 2.031 5.171 1.00 75.52 H new ATOM 0 HE2 MET A 11 -11.537 3.228 6.197 1.00 75.52 H new ATOM 0 HE3 MET A 11 -13.315 3.176 6.143 1.00 75.52 H new ATOM 165 N VAL A 12 -10.759 8.791 7.229 1.00 4.43 N ATOM 166 CA VAL A 12 -9.619 9.598 6.809 1.00 44.02 C ATOM 167 C VAL A 12 -8.539 9.626 7.884 1.00 54.05 C ATOM 168 O VAL A 12 -8.810 9.942 9.043 1.00 64.13 O ATOM 169 CB VAL A 12 -10.044 11.043 6.484 1.00 12.31 C ATOM 170 CG1 VAL A 12 -10.759 11.668 7.671 1.00 11.34 C ATOM 171 CG2 VAL A 12 -8.835 11.874 6.080 1.00 30.22 C ATOM 0 H VAL A 12 -10.950 8.820 8.231 1.00 4.43 H new ATOM 0 HA VAL A 12 -9.217 9.134 5.908 1.00 44.02 H new ATOM 0 HB VAL A 12 -10.738 11.020 5.644 1.00 12.31 H new ATOM 0 HG11 VAL A 12 -11.052 12.688 7.423 1.00 11.34 H new ATOM 0 HG12 VAL A 12 -11.647 11.083 7.910 1.00 11.34 H new ATOM 0 HG13 VAL A 12 -10.091 11.681 8.532 1.00 11.34 H new ATOM 0 HG21 VAL A 12 -9.152 12.892 5.854 1.00 30.22 H new ATOM 0 HG22 VAL A 12 -8.116 11.892 6.899 1.00 30.22 H new ATOM 0 HG23 VAL A 12 -8.370 11.434 5.198 1.00 30.22 H new ATOM 181 N SER A 13 -7.313 9.295 7.493 1.00 14.13 N ATOM 182 CA SER A 13 -6.191 9.279 8.423 1.00 73.31 C ATOM 183 C SER A 13 -6.143 10.568 9.239 1.00 23.34 C ATOM 184 O SER A 13 -6.310 11.662 8.701 1.00 73.12 O ATOM 185 CB SER A 13 -4.874 9.093 7.666 1.00 41.00 C ATOM 186 OG SER A 13 -4.356 10.338 7.230 1.00 44.13 O ATOM 0 H SER A 13 -7.071 9.034 6.537 1.00 14.13 H new ATOM 0 HA SER A 13 -6.330 8.441 9.106 1.00 73.31 H new ATOM 0 HB2 SER A 13 -4.147 8.599 8.311 1.00 41.00 H new ATOM 0 HB3 SER A 13 -5.034 8.441 6.807 1.00 41.00 H new ATOM 0 HG SER A 13 -3.514 10.192 6.751 1.00 44.13 H new ATOM 192 N GLY A 14 -5.915 10.430 10.541 1.00 24.45 N ATOM 193 CA GLY A 14 -5.850 11.589 11.410 1.00 42.21 C ATOM 194 C GLY A 14 -5.717 11.212 12.872 1.00 62.21 C ATOM 195 O GLY A 14 -6.688 11.269 13.626 1.00 74.04 O ATOM 0 H GLY A 14 -5.774 9.535 11.010 1.00 24.45 H new ATOM 0 HA2 GLY A 14 -5.002 12.210 11.120 1.00 42.21 H new ATOM 0 HA3 GLY A 14 -6.748 12.192 11.274 1.00 42.21 H new ATOM 199 N ILE A 15 -4.511 10.823 13.274 1.00 11.31 N ATOM 200 CA ILE A 15 -4.254 10.434 14.655 1.00 74.44 C ATOM 201 C ILE A 15 -5.107 11.247 15.622 1.00 23.42 C ATOM 202 O ILE A 15 -5.315 12.445 15.428 1.00 55.14 O ATOM 203 CB ILE A 15 -2.769 10.610 15.023 1.00 74.41 C ATOM 204 CG1 ILE A 15 -2.123 11.672 14.131 1.00 62.23 C ATOM 205 CG2 ILE A 15 -2.032 9.285 14.898 1.00 13.42 C ATOM 206 CD1 ILE A 15 -2.793 13.025 14.221 1.00 12.43 C ATOM 0 H ILE A 15 -3.697 10.769 12.662 1.00 11.31 H new ATOM 0 HA ILE A 15 -4.517 9.380 14.740 1.00 74.44 H new ATOM 0 HB ILE A 15 -2.703 10.943 16.059 1.00 74.41 H new ATOM 0 HG12 ILE A 15 -1.073 11.776 14.406 1.00 62.23 H new ATOM 0 HG13 ILE A 15 -2.149 11.331 13.096 1.00 62.23 H new ATOM 0 HG21 ILE A 15 -0.984 9.426 15.161 1.00 13.42 H new ATOM 0 HG22 ILE A 15 -2.480 8.554 15.571 1.00 13.42 H new ATOM 0 HG23 ILE A 15 -2.103 8.924 13.872 1.00 13.42 H new ATOM 0 HD11 ILE A 15 -2.283 13.728 13.563 1.00 12.43 H new ATOM 0 HD12 ILE A 15 -3.836 12.935 13.918 1.00 12.43 H new ATOM 0 HD13 ILE A 15 -2.744 13.388 15.248 1.00 12.43 H new ATOM 218 N LYS A 16 -5.597 10.590 16.668 1.00 32.12 N ATOM 219 CA LYS A 16 -6.424 11.251 17.670 1.00 73.34 C ATOM 220 C LYS A 16 -6.350 10.520 19.006 1.00 21.23 C ATOM 221 O LYS A 16 -5.504 9.647 19.201 1.00 25.30 O ATOM 222 CB LYS A 16 -7.877 11.321 17.195 1.00 53.42 C ATOM 223 CG LYS A 16 -8.545 9.963 17.077 1.00 12.45 C ATOM 224 CD LYS A 16 -8.657 9.520 15.629 1.00 3.02 C ATOM 225 CE LYS A 16 -9.985 9.942 15.017 1.00 52.12 C ATOM 226 NZ LYS A 16 -10.263 11.387 15.240 1.00 63.23 N ATOM 0 H LYS A 16 -5.435 9.598 16.844 1.00 32.12 H new ATOM 0 HA LYS A 16 -6.043 12.263 17.809 1.00 73.34 H new ATOM 0 HB2 LYS A 16 -8.448 11.938 17.889 1.00 53.42 H new ATOM 0 HB3 LYS A 16 -7.910 11.818 16.225 1.00 53.42 H new ATOM 0 HG2 LYS A 16 -7.974 9.225 17.641 1.00 12.45 H new ATOM 0 HG3 LYS A 16 -9.539 10.005 17.523 1.00 12.45 H new ATOM 0 HD2 LYS A 16 -7.837 9.948 15.052 1.00 3.02 H new ATOM 0 HD3 LYS A 16 -8.556 8.436 15.570 1.00 3.02 H new ATOM 0 HE2 LYS A 16 -9.974 9.735 13.947 1.00 52.12 H new ATOM 0 HE3 LYS A 16 -10.789 9.346 15.449 1.00 52.12 H new ATOM 0 HZ1 LYS A 16 -11.142 11.651 14.751 1.00 63.23 H new ATOM 0 HZ2 LYS A 16 -10.366 11.567 16.259 1.00 63.23 H new ATOM 0 HZ3 LYS A 16 -9.475 11.954 14.866 1.00 63.23 H new ATOM 240 N ASP A 17 -7.242 10.879 19.923 1.00 43.33 N ATOM 241 CA ASP A 17 -7.279 10.255 21.239 1.00 75.12 C ATOM 242 C ASP A 17 -8.256 9.084 21.259 1.00 13.40 C ATOM 243 O ASP A 17 -9.461 9.265 21.075 1.00 2.53 O ATOM 244 CB ASP A 17 -7.672 11.281 22.303 1.00 2.30 C ATOM 245 CG ASP A 17 -8.873 12.111 21.891 1.00 51.55 C ATOM 246 OD1 ASP A 17 -8.677 13.150 21.227 1.00 32.43 O ATOM 247 OD2 ASP A 17 -10.008 11.719 22.232 1.00 3.04 O ATOM 0 H ASP A 17 -7.949 11.600 19.778 1.00 43.33 H new ATOM 0 HA ASP A 17 -6.282 9.876 21.461 1.00 75.12 H new ATOM 0 HB2 ASP A 17 -7.894 10.765 23.237 1.00 2.30 H new ATOM 0 HB3 ASP A 17 -6.827 11.941 22.497 1.00 2.30 H new ATOM 252 N ILE A 18 -7.731 7.885 21.482 1.00 43.31 N ATOM 253 CA ILE A 18 -8.557 6.684 21.524 1.00 44.12 C ATOM 254 C ILE A 18 -8.690 6.160 22.950 1.00 34.41 C ATOM 255 O ILE A 18 -7.881 5.363 23.423 1.00 21.11 O ATOM 256 CB ILE A 18 -7.978 5.571 20.632 1.00 61.55 C ATOM 257 CG1 ILE A 18 -8.048 5.979 19.160 1.00 71.03 C ATOM 258 CG2 ILE A 18 -8.726 4.266 20.863 1.00 61.10 C ATOM 259 CD1 ILE A 18 -9.414 5.777 18.541 1.00 44.14 C ATOM 0 H ILE A 18 -6.737 7.718 21.637 1.00 43.31 H new ATOM 0 HA ILE A 18 -9.541 6.964 21.148 1.00 44.12 H new ATOM 0 HB ILE A 18 -6.932 5.419 20.897 1.00 61.55 H new ATOM 0 HG12 ILE A 18 -7.768 7.029 19.069 1.00 71.03 H new ATOM 0 HG13 ILE A 18 -7.314 5.403 18.596 1.00 71.03 H new ATOM 0 HG21 ILE A 18 -8.306 3.488 20.226 1.00 61.10 H new ATOM 0 HG22 ILE A 18 -8.629 3.971 21.908 1.00 61.10 H new ATOM 0 HG23 ILE A 18 -9.780 4.403 20.621 1.00 61.10 H new ATOM 0 HD11 ILE A 18 -9.390 6.087 17.496 1.00 44.14 H new ATOM 0 HD12 ILE A 18 -9.688 4.724 18.600 1.00 44.14 H new ATOM 0 HD13 ILE A 18 -10.150 6.374 19.080 1.00 44.14 H new ATOM 271 N PRO A 19 -9.738 6.617 23.653 1.00 61.10 N ATOM 272 CA PRO A 19 -10.005 6.205 25.034 1.00 42.45 C ATOM 273 C PRO A 19 -10.450 4.749 25.130 1.00 30.41 C ATOM 274 O PRO A 19 -11.593 4.418 24.815 1.00 11.21 O ATOM 275 CB PRO A 19 -11.136 7.140 25.470 1.00 41.42 C ATOM 276 CG PRO A 19 -11.818 7.527 24.203 1.00 22.11 C ATOM 277 CD PRO A 19 -10.744 7.569 23.152 1.00 3.24 C ATOM 0 HA PRO A 19 -9.114 6.271 25.658 1.00 42.45 H new ATOM 0 HB2 PRO A 19 -11.823 6.639 26.152 1.00 41.42 H new ATOM 0 HB3 PRO A 19 -10.748 8.014 25.993 1.00 41.42 H new ATOM 0 HG2 PRO A 19 -12.593 6.807 23.941 1.00 22.11 H new ATOM 0 HG3 PRO A 19 -12.305 8.497 24.302 1.00 22.11 H new ATOM 0 HD2 PRO A 19 -11.126 7.273 22.175 1.00 3.24 H new ATOM 0 HD3 PRO A 19 -10.329 8.571 23.041 1.00 3.24 H new ATOM 285 N TYR A 20 -9.540 3.886 25.565 1.00 2.01 N ATOM 286 CA TYR A 20 -9.838 2.465 25.700 1.00 52.44 C ATOM 287 C TYR A 20 -10.835 2.222 26.830 1.00 43.32 C ATOM 288 O TYR A 20 -11.671 1.321 26.754 1.00 11.13 O ATOM 289 CB TYR A 20 -8.554 1.674 25.960 1.00 11.34 C ATOM 290 CG TYR A 20 -8.783 0.371 26.691 1.00 43.13 C ATOM 291 CD1 TYR A 20 -9.246 -0.753 26.017 1.00 63.05 C ATOM 292 CD2 TYR A 20 -8.537 0.263 28.053 1.00 3.22 C ATOM 293 CE1 TYR A 20 -9.457 -1.947 26.680 1.00 63.41 C ATOM 294 CE2 TYR A 20 -8.743 -0.926 28.725 1.00 32.41 C ATOM 295 CZ TYR A 20 -9.204 -2.028 28.035 1.00 62.41 C ATOM 296 OH TYR A 20 -9.412 -3.215 28.700 1.00 52.34 O ATOM 0 H TYR A 20 -8.590 4.145 25.830 1.00 2.01 H new ATOM 0 HA TYR A 20 -10.284 2.124 24.766 1.00 52.44 H new ATOM 0 HB2 TYR A 20 -8.066 1.466 25.008 1.00 11.34 H new ATOM 0 HB3 TYR A 20 -7.868 2.291 26.541 1.00 11.34 H new ATOM 0 HD1 TYR A 20 -9.444 -0.692 24.957 1.00 63.05 H new ATOM 0 HD2 TYR A 20 -8.178 1.124 28.597 1.00 3.22 H new ATOM 0 HE1 TYR A 20 -9.817 -2.811 26.142 1.00 63.41 H new ATOM 0 HE2 TYR A 20 -8.544 -0.993 29.784 1.00 32.41 H new ATOM 0 HH TYR A 20 -9.185 -3.104 29.647 1.00 52.34 H new ATOM 306 N THR A 21 -10.740 3.034 27.879 1.00 31.31 N ATOM 307 CA THR A 21 -11.632 2.908 29.025 1.00 30.23 C ATOM 308 C THR A 21 -12.285 4.244 29.361 1.00 3.24 C ATOM 309 O THR A 21 -11.687 5.304 29.175 1.00 61.12 O ATOM 310 CB THR A 21 -10.881 2.391 30.266 1.00 13.14 C ATOM 311 OG1 THR A 21 -10.478 1.032 30.063 1.00 13.12 O ATOM 312 CG2 THR A 21 -11.756 2.486 31.506 1.00 42.20 C ATOM 0 H THR A 21 -10.055 3.785 27.958 1.00 31.31 H new ATOM 0 HA THR A 21 -12.403 2.188 28.749 1.00 30.23 H new ATOM 0 HB THR A 21 -9.998 3.013 30.415 1.00 13.14 H new ATOM 0 HG1 THR A 21 -9.831 0.989 29.328 1.00 13.12 H new ATOM 0 HG21 THR A 21 -11.204 2.115 32.370 1.00 42.20 H new ATOM 0 HG22 THR A 21 -12.037 3.526 31.674 1.00 42.20 H new ATOM 0 HG23 THR A 21 -12.654 1.885 31.364 1.00 42.20 H new ATOM 320 N PHE A 22 -13.517 4.187 29.856 1.00 2.12 N ATOM 321 CA PHE A 22 -14.253 5.392 30.218 1.00 12.21 C ATOM 322 C PHE A 22 -15.066 5.172 31.491 1.00 64.04 C ATOM 323 O PHE A 22 -16.249 5.505 31.550 1.00 42.24 O ATOM 324 CB PHE A 22 -15.179 5.812 29.075 1.00 53.51 C ATOM 325 CG PHE A 22 -15.977 4.676 28.501 1.00 13.14 C ATOM 326 CD1 PHE A 22 -15.446 3.873 27.505 1.00 73.40 C ATOM 327 CD2 PHE A 22 -17.258 4.413 28.957 1.00 1.01 C ATOM 328 CE1 PHE A 22 -16.177 2.827 26.975 1.00 50.43 C ATOM 329 CE2 PHE A 22 -17.994 3.367 28.432 1.00 4.03 C ATOM 330 CZ PHE A 22 -17.453 2.575 27.439 1.00 22.50 C ATOM 0 H PHE A 22 -14.027 3.318 30.016 1.00 2.12 H new ATOM 0 HA PHE A 22 -13.530 6.187 30.402 1.00 12.21 H new ATOM 0 HB2 PHE A 22 -15.863 6.580 29.436 1.00 53.51 H new ATOM 0 HB3 PHE A 22 -14.583 6.263 28.282 1.00 53.51 H new ATOM 0 HD1 PHE A 22 -14.449 4.067 27.138 1.00 73.40 H new ATOM 0 HD2 PHE A 22 -17.687 5.032 29.731 1.00 1.01 H new ATOM 0 HE1 PHE A 22 -15.751 2.208 26.199 1.00 50.43 H new ATOM 0 HE2 PHE A 22 -18.991 3.170 28.798 1.00 4.03 H new ATOM 0 HZ PHE A 22 -18.027 1.759 27.025 1.00 22.50 H new ATOM 340 N ARG A 23 -14.421 4.607 32.507 1.00 40.11 N ATOM 341 CA ARG A 23 -15.084 4.341 33.778 1.00 50.31 C ATOM 342 C ARG A 23 -14.211 4.782 34.949 1.00 23.44 C ATOM 343 O ARG A 23 -14.533 5.740 35.651 1.00 71.45 O ATOM 344 CB ARG A 23 -15.411 2.851 33.905 1.00 35.01 C ATOM 345 CG ARG A 23 -15.914 2.227 32.613 1.00 42.41 C ATOM 346 CD ARG A 23 -15.543 0.755 32.525 1.00 54.43 C ATOM 347 NE ARG A 23 -16.718 -0.097 32.357 1.00 32.22 N ATOM 348 CZ ARG A 23 -17.461 -0.114 31.256 1.00 12.30 C ATOM 349 NH1 ARG A 23 -17.155 0.671 30.232 1.00 20.32 N ATOM 350 NH2 ARG A 23 -18.515 -0.917 31.179 1.00 51.43 N ATOM 0 H ARG A 23 -13.441 4.325 32.475 1.00 40.11 H new ATOM 0 HA ARG A 23 -16.011 4.913 33.802 1.00 50.31 H new ATOM 0 HB2 ARG A 23 -14.518 2.318 34.233 1.00 35.01 H new ATOM 0 HB3 ARG A 23 -16.165 2.718 34.681 1.00 35.01 H new ATOM 0 HG2 ARG A 23 -16.997 2.335 32.553 1.00 42.41 H new ATOM 0 HG3 ARG A 23 -15.493 2.761 31.761 1.00 42.41 H new ATOM 0 HD2 ARG A 23 -14.862 0.602 31.688 1.00 54.43 H new ATOM 0 HD3 ARG A 23 -15.008 0.461 33.428 1.00 54.43 H new ATOM 0 HE ARG A 23 -16.982 -0.712 33.127 1.00 32.22 H new ATOM 0 HH11 ARG A 23 -16.347 1.291 30.288 1.00 20.32 H new ATOM 0 HH12 ARG A 23 -17.728 0.655 29.388 1.00 20.32 H new ATOM 0 HH21 ARG A 23 -18.754 -1.521 31.965 1.00 51.43 H new ATOM 0 HH22 ARG A 23 -19.086 -0.930 30.334 1.00 51.43 H new ATOM 364 N GLY A 24 -13.103 4.075 35.154 1.00 12.53 N ATOM 365 CA GLY A 24 -12.202 4.408 36.242 1.00 64.21 C ATOM 366 C GLY A 24 -10.754 4.466 35.796 1.00 55.11 C ATOM 367 O GLY A 24 -10.014 5.370 36.185 1.00 61.35 O ATOM 0 H GLY A 24 -12.814 3.278 34.586 1.00 12.53 H new ATOM 0 HA2 GLY A 24 -12.488 5.371 36.665 1.00 64.21 H new ATOM 0 HA3 GLY A 24 -12.306 3.668 37.035 1.00 64.21 H new ATOM 371 N ARG A 25 -10.348 3.498 34.981 1.00 74.32 N ATOM 372 CA ARG A 25 -8.978 3.441 34.486 1.00 25.35 C ATOM 373 C ARG A 25 -8.898 3.946 33.048 1.00 63.35 C ATOM 374 O ARG A 25 -8.183 3.382 32.220 1.00 71.20 O ATOM 375 CB ARG A 25 -8.443 2.009 34.566 1.00 12.43 C ATOM 376 CG ARG A 25 -9.152 1.042 33.632 1.00 15.33 C ATOM 377 CD ARG A 25 -10.302 0.334 34.330 1.00 1.30 C ATOM 378 NE ARG A 25 -10.191 -1.119 34.232 1.00 73.30 N ATOM 379 CZ ARG A 25 -10.553 -1.812 33.158 1.00 52.41 C ATOM 380 NH1 ARG A 25 -11.046 -1.189 32.097 1.00 12.12 N ATOM 381 NH2 ARG A 25 -10.421 -3.133 33.145 1.00 0.21 N ATOM 0 H ARG A 25 -10.948 2.743 34.650 1.00 74.32 H new ATOM 0 HA ARG A 25 -8.364 4.086 35.114 1.00 25.35 H new ATOM 0 HB2 ARG A 25 -7.379 2.014 34.331 1.00 12.43 H new ATOM 0 HB3 ARG A 25 -8.541 1.650 35.590 1.00 12.43 H new ATOM 0 HG2 ARG A 25 -9.530 1.583 32.765 1.00 15.33 H new ATOM 0 HG3 ARG A 25 -8.440 0.304 33.262 1.00 15.33 H new ATOM 0 HD2 ARG A 25 -10.323 0.626 35.380 1.00 1.30 H new ATOM 0 HD3 ARG A 25 -11.246 0.656 33.890 1.00 1.30 H new ATOM 0 HE ARG A 25 -9.815 -1.629 35.031 1.00 73.30 H new ATOM 0 HH11 ARG A 25 -11.148 -0.174 32.103 1.00 12.12 H new ATOM 0 HH12 ARG A 25 -11.323 -1.724 31.274 1.00 12.12 H new ATOM 0 HH21 ARG A 25 -10.042 -3.616 33.960 1.00 0.21 H new ATOM 0 HH22 ARG A 25 -10.699 -3.665 32.320 1.00 0.21 H new ATOM 395 N LYS A 26 -9.638 5.011 32.758 1.00 21.42 N ATOM 396 CA LYS A 26 -9.652 5.592 31.422 1.00 43.14 C ATOM 397 C LYS A 26 -8.232 5.826 30.915 1.00 43.24 C ATOM 398 O LYS A 26 -7.496 6.651 31.457 1.00 31.25 O ATOM 399 CB LYS A 26 -10.427 6.912 31.425 1.00 73.32 C ATOM 400 CG LYS A 26 -10.341 7.671 30.113 1.00 22.50 C ATOM 401 CD LYS A 26 -11.639 8.398 29.803 1.00 23.31 C ATOM 402 CE LYS A 26 -11.518 9.244 28.545 1.00 34.31 C ATOM 403 NZ LYS A 26 -11.663 10.697 28.838 1.00 53.14 N ATOM 0 H LYS A 26 -10.236 5.489 33.432 1.00 21.42 H new ATOM 0 HA LYS A 26 -10.147 4.888 30.753 1.00 43.14 H new ATOM 0 HB2 LYS A 26 -11.474 6.708 31.649 1.00 73.32 H new ATOM 0 HB3 LYS A 26 -10.047 7.545 32.227 1.00 73.32 H new ATOM 0 HG2 LYS A 26 -9.523 8.390 30.160 1.00 22.50 H new ATOM 0 HG3 LYS A 26 -10.110 6.977 29.305 1.00 22.50 H new ATOM 0 HD2 LYS A 26 -12.443 7.672 29.679 1.00 23.31 H new ATOM 0 HD3 LYS A 26 -11.911 9.034 30.645 1.00 23.31 H new ATOM 0 HE2 LYS A 26 -10.550 9.063 28.077 1.00 34.31 H new ATOM 0 HE3 LYS A 26 -12.281 8.940 27.828 1.00 34.31 H new ATOM 0 HZ1 LYS A 26 -11.574 11.240 27.955 1.00 53.14 H new ATOM 0 HZ2 LYS A 26 -12.596 10.874 29.261 1.00 53.14 H new ATOM 0 HZ3 LYS A 26 -10.920 10.993 29.502 1.00 53.14 H new ATOM 417 N THR A 27 -7.853 5.094 29.872 1.00 73.42 N ATOM 418 CA THR A 27 -6.522 5.222 29.293 1.00 63.02 C ATOM 419 C THR A 27 -6.588 5.287 27.771 1.00 55.04 C ATOM 420 O THR A 27 -6.623 4.258 27.097 1.00 63.21 O ATOM 421 CB THR A 27 -5.614 4.048 29.706 1.00 62.33 C ATOM 422 OG1 THR A 27 -4.398 4.079 28.950 1.00 51.03 O ATOM 423 CG2 THR A 27 -6.318 2.717 29.487 1.00 30.31 C ATOM 0 H THR A 27 -8.449 4.407 29.411 1.00 73.42 H new ATOM 0 HA THR A 27 -6.099 6.151 29.676 1.00 63.02 H new ATOM 0 HB THR A 27 -5.385 4.151 30.767 1.00 62.33 H new ATOM 0 HG1 THR A 27 -3.709 3.562 29.417 1.00 51.03 H new ATOM 0 HG21 THR A 27 -5.658 1.903 29.786 1.00 30.31 H new ATOM 0 HG22 THR A 27 -7.228 2.684 30.086 1.00 30.31 H new ATOM 0 HG23 THR A 27 -6.573 2.609 28.433 1.00 30.31 H new ATOM 431 N VAL A 28 -6.605 6.504 27.236 1.00 64.23 N ATOM 432 CA VAL A 28 -6.666 6.704 25.793 1.00 43.33 C ATOM 433 C VAL A 28 -5.283 6.580 25.162 1.00 11.02 C ATOM 434 O VAL A 28 -4.289 7.045 25.722 1.00 70.13 O ATOM 435 CB VAL A 28 -7.256 8.082 25.441 1.00 73.31 C ATOM 436 CG1 VAL A 28 -8.185 8.563 26.546 1.00 72.32 C ATOM 437 CG2 VAL A 28 -6.145 9.090 25.192 1.00 33.52 C ATOM 0 H VAL A 28 -6.577 7.366 27.780 1.00 64.23 H new ATOM 0 HA VAL A 28 -7.316 5.926 25.393 1.00 43.33 H new ATOM 0 HB VAL A 28 -7.839 7.985 24.525 1.00 73.31 H new ATOM 0 HG11 VAL A 28 -8.593 9.538 26.280 1.00 72.32 H new ATOM 0 HG12 VAL A 28 -9.001 7.851 26.671 1.00 72.32 H new ATOM 0 HG13 VAL A 28 -7.628 8.645 27.479 1.00 72.32 H new ATOM 0 HG21 VAL A 28 -6.581 10.058 24.945 1.00 33.52 H new ATOM 0 HG22 VAL A 28 -5.533 9.186 26.089 1.00 33.52 H new ATOM 0 HG23 VAL A 28 -5.524 8.749 24.364 1.00 33.52 H new ATOM 447 N LEU A 29 -5.226 5.949 23.994 1.00 13.11 N ATOM 448 CA LEU A 29 -3.965 5.765 23.286 1.00 1.40 C ATOM 449 C LEU A 29 -3.650 6.972 22.409 1.00 44.03 C ATOM 450 O LEU A 29 -3.578 6.863 21.185 1.00 33.53 O ATOM 451 CB LEU A 29 -4.019 4.499 22.429 1.00 43.31 C ATOM 452 CG LEU A 29 -4.635 3.266 23.091 1.00 33.35 C ATOM 453 CD1 LEU A 29 -4.308 3.238 24.577 1.00 43.42 C ATOM 454 CD2 LEU A 29 -6.141 3.240 22.874 1.00 62.31 C ATOM 0 H LEU A 29 -6.038 5.557 23.518 1.00 13.11 H new ATOM 0 HA LEU A 29 -3.173 5.662 24.028 1.00 1.40 H new ATOM 0 HB2 LEU A 29 -4.584 4.721 21.524 1.00 43.31 H new ATOM 0 HB3 LEU A 29 -3.004 4.251 22.118 1.00 43.31 H new ATOM 0 HG LEU A 29 -4.206 2.377 22.629 1.00 33.35 H new ATOM 0 HD11 LEU A 29 -4.755 2.354 25.031 1.00 43.42 H new ATOM 0 HD12 LEU A 29 -3.227 3.208 24.711 1.00 43.42 H new ATOM 0 HD13 LEU A 29 -4.708 4.132 25.055 1.00 43.42 H new ATOM 0 HD21 LEU A 29 -6.562 2.356 23.352 1.00 62.31 H new ATOM 0 HD22 LEU A 29 -6.587 4.135 23.309 1.00 62.31 H new ATOM 0 HD23 LEU A 29 -6.354 3.211 21.805 1.00 62.31 H new ATOM 466 N LYS A 30 -3.461 8.124 23.044 1.00 2.35 N ATOM 467 CA LYS A 30 -3.151 9.354 22.323 1.00 35.13 C ATOM 468 C LYS A 30 -2.149 9.089 21.202 1.00 61.11 C ATOM 469 O LYS A 30 -0.961 8.897 21.452 1.00 71.22 O ATOM 470 CB LYS A 30 -2.591 10.404 23.284 1.00 3.14 C ATOM 471 CG LYS A 30 -3.465 10.640 24.504 1.00 20.41 C ATOM 472 CD LYS A 30 -2.986 11.835 25.310 1.00 41.14 C ATOM 473 CE LYS A 30 -3.699 11.925 26.652 1.00 63.25 C ATOM 474 NZ LYS A 30 -3.166 10.937 27.630 1.00 23.21 N ATOM 0 H LYS A 30 -3.517 8.232 24.057 1.00 2.35 H new ATOM 0 HA LYS A 30 -4.074 9.730 21.881 1.00 35.13 H new ATOM 0 HB2 LYS A 30 -1.600 10.092 23.613 1.00 3.14 H new ATOM 0 HB3 LYS A 30 -2.467 11.345 22.748 1.00 3.14 H new ATOM 0 HG2 LYS A 30 -4.496 10.802 24.188 1.00 20.41 H new ATOM 0 HG3 LYS A 30 -3.461 9.750 25.133 1.00 20.41 H new ATOM 0 HD2 LYS A 30 -1.911 11.758 25.472 1.00 41.14 H new ATOM 0 HD3 LYS A 30 -3.158 12.750 24.743 1.00 41.14 H new ATOM 0 HE2 LYS A 30 -3.588 12.932 27.055 1.00 63.25 H new ATOM 0 HE3 LYS A 30 -4.766 11.755 26.509 1.00 63.25 H new ATOM 0 HZ1 LYS A 30 -3.642 11.064 28.546 1.00 23.21 H new ATOM 0 HZ2 LYS A 30 -3.340 9.973 27.280 1.00 23.21 H new ATOM 0 HZ3 LYS A 30 -2.143 11.083 27.748 1.00 23.21 H new ATOM 488 N GLY A 31 -2.639 9.083 19.966 1.00 72.21 N ATOM 489 CA GLY A 31 -1.774 8.844 18.827 1.00 31.14 C ATOM 490 C GLY A 31 -2.118 7.562 18.096 1.00 44.11 C ATOM 491 O GLY A 31 -1.305 6.639 18.027 1.00 41.30 O ATOM 0 H GLY A 31 -3.620 9.239 19.734 1.00 72.21 H new ATOM 0 HA2 GLY A 31 -1.848 9.684 18.136 1.00 31.14 H new ATOM 0 HA3 GLY A 31 -0.738 8.799 19.164 1.00 31.14 H new ATOM 495 N ILE A 32 -3.329 7.502 17.550 1.00 41.34 N ATOM 496 CA ILE A 32 -3.780 6.323 16.821 1.00 61.50 C ATOM 497 C ILE A 32 -4.082 6.659 15.364 1.00 51.20 C ATOM 498 O ILE A 32 -5.190 7.079 15.030 1.00 55.41 O ATOM 499 CB ILE A 32 -5.037 5.709 17.465 1.00 51.41 C ATOM 500 CG1 ILE A 32 -4.786 5.415 18.946 1.00 33.55 C ATOM 501 CG2 ILE A 32 -5.445 4.442 16.729 1.00 13.22 C ATOM 502 CD1 ILE A 32 -3.471 4.713 19.208 1.00 44.04 C ATOM 0 H ILE A 32 -4.014 8.256 17.599 1.00 41.34 H new ATOM 0 HA ILE A 32 -2.968 5.597 16.863 1.00 61.50 H new ATOM 0 HB ILE A 32 -5.853 6.427 17.390 1.00 51.41 H new ATOM 0 HG12 ILE A 32 -4.806 6.352 19.503 1.00 33.55 H new ATOM 0 HG13 ILE A 32 -5.600 4.799 19.329 1.00 33.55 H new ATOM 0 HG21 ILE A 32 -6.335 4.020 17.196 1.00 13.22 H new ATOM 0 HG22 ILE A 32 -5.660 4.680 15.687 1.00 13.22 H new ATOM 0 HG23 ILE A 32 -4.633 3.717 16.775 1.00 13.22 H new ATOM 0 HD11 ILE A 32 -3.360 4.536 20.278 1.00 44.04 H new ATOM 0 HD12 ILE A 32 -3.456 3.760 18.679 1.00 44.04 H new ATOM 0 HD13 ILE A 32 -2.649 5.336 18.856 1.00 44.04 H new ATOM 514 N HIS A 33 -3.089 6.472 14.501 1.00 21.31 N ATOM 515 CA HIS A 33 -3.248 6.752 13.079 1.00 41.35 C ATOM 516 C HIS A 33 -4.084 5.670 12.401 1.00 44.10 C ATOM 517 O HIS A 33 -4.107 4.522 12.845 1.00 61.35 O ATOM 518 CB HIS A 33 -1.882 6.856 12.401 1.00 5.35 C ATOM 519 CG HIS A 33 -1.755 8.035 11.486 1.00 0.30 C ATOM 520 ND1 HIS A 33 -0.540 8.543 11.075 1.00 33.31 N ATOM 521 CD2 HIS A 33 -2.700 8.806 10.900 1.00 31.24 C ATOM 522 CE1 HIS A 33 -0.744 9.575 10.279 1.00 30.21 C ATOM 523 NE2 HIS A 33 -2.047 9.756 10.154 1.00 1.41 N ATOM 0 H HIS A 33 -2.165 6.127 14.762 1.00 21.31 H new ATOM 0 HA HIS A 33 -3.768 7.705 12.979 1.00 41.35 H new ATOM 0 HB2 HIS A 33 -1.109 6.916 13.167 1.00 5.35 H new ATOM 0 HB3 HIS A 33 -1.697 5.944 11.833 1.00 5.35 H new ATOM 0 HD2 HIS A 33 -3.770 8.695 11.000 1.00 31.24 H new ATOM 0 HE1 HIS A 33 0.024 10.171 9.809 1.00 30.21 H new ATOM 0 HE2 HIS A 33 -2.494 10.482 9.595 1.00 1.41 H new ATOM 531 N GLY A 34 -4.769 6.045 11.325 1.00 2.15 N ATOM 532 CA GLY A 34 -5.597 5.094 10.605 1.00 52.54 C ATOM 533 C GLY A 34 -6.518 5.767 9.608 1.00 1.24 C ATOM 534 O GLY A 34 -6.067 6.280 8.583 1.00 24.33 O ATOM 0 H GLY A 34 -4.766 6.989 10.939 1.00 2.15 H new ATOM 0 HA2 GLY A 34 -4.957 4.383 10.082 1.00 52.54 H new ATOM 0 HA3 GLY A 34 -6.193 4.523 11.317 1.00 52.54 H new ATOM 538 N LEU A 35 -7.813 5.766 9.906 1.00 71.40 N ATOM 539 CA LEU A 35 -8.801 6.379 9.026 1.00 65.11 C ATOM 540 C LEU A 35 -10.060 6.756 9.801 1.00 20.50 C ATOM 541 O LEU A 35 -11.019 5.986 9.859 1.00 71.20 O ATOM 542 CB LEU A 35 -9.158 5.427 7.883 1.00 12.11 C ATOM 543 CG LEU A 35 -8.090 5.246 6.804 1.00 35.34 C ATOM 544 CD1 LEU A 35 -8.572 4.278 5.734 1.00 55.23 C ATOM 545 CD2 LEU A 35 -7.724 6.587 6.184 1.00 3.10 C ATOM 0 H LEU A 35 -8.203 5.347 10.750 1.00 71.40 H new ATOM 0 HA LEU A 35 -8.366 7.288 8.610 1.00 65.11 H new ATOM 0 HB2 LEU A 35 -9.386 4.450 8.308 1.00 12.11 H new ATOM 0 HB3 LEU A 35 -10.070 5.788 7.407 1.00 12.11 H new ATOM 0 HG LEU A 35 -7.198 4.828 7.270 1.00 35.34 H new ATOM 0 HD11 LEU A 35 -7.799 4.161 4.974 1.00 55.23 H new ATOM 0 HD12 LEU A 35 -8.784 3.310 6.188 1.00 55.23 H new ATOM 0 HD13 LEU A 35 -9.479 4.668 5.272 1.00 55.23 H new ATOM 0 HD21 LEU A 35 -6.963 6.438 5.418 1.00 3.10 H new ATOM 0 HD22 LEU A 35 -8.610 7.033 5.733 1.00 3.10 H new ATOM 0 HD23 LEU A 35 -7.337 7.251 6.956 1.00 3.10 H new ATOM 557 N TYR A 36 -10.051 7.946 10.392 1.00 22.33 N ATOM 558 CA TYR A 36 -11.191 8.425 11.164 1.00 32.35 C ATOM 559 C TYR A 36 -11.139 9.940 11.329 1.00 40.42 C ATOM 560 O TYR A 36 -10.082 10.555 11.185 1.00 31.45 O ATOM 561 CB TYR A 36 -11.225 7.751 12.537 1.00 23.13 C ATOM 562 CG TYR A 36 -9.962 6.989 12.868 1.00 4.35 C ATOM 563 CD1 TYR A 36 -8.739 7.641 12.968 1.00 20.32 C ATOM 564 CD2 TYR A 36 -9.990 5.616 13.080 1.00 55.33 C ATOM 565 CE1 TYR A 36 -7.582 6.949 13.270 1.00 34.01 C ATOM 566 CE2 TYR A 36 -8.839 4.916 13.384 1.00 74.14 C ATOM 567 CZ TYR A 36 -7.637 5.586 13.476 1.00 52.55 C ATOM 568 OH TYR A 36 -6.488 4.893 13.778 1.00 34.52 O ATOM 0 H TYR A 36 -9.266 8.597 10.351 1.00 22.33 H new ATOM 0 HA TYR A 36 -12.099 8.168 10.619 1.00 32.35 H new ATOM 0 HB2 TYR A 36 -11.392 8.510 13.301 1.00 23.13 H new ATOM 0 HB3 TYR A 36 -12.073 7.067 12.576 1.00 23.13 H new ATOM 0 HD1 TYR A 36 -8.692 8.708 12.807 1.00 20.32 H new ATOM 0 HD2 TYR A 36 -10.929 5.087 13.006 1.00 55.33 H new ATOM 0 HE1 TYR A 36 -6.640 7.472 13.344 1.00 34.01 H new ATOM 0 HE2 TYR A 36 -8.880 3.849 13.549 1.00 74.14 H new ATOM 0 HH TYR A 36 -6.721 3.995 14.095 1.00 34.52 H new ATOM 578 N CYS A 37 -12.287 10.534 11.634 1.00 44.21 N ATOM 579 CA CYS A 37 -12.374 11.979 11.821 1.00 41.34 C ATOM 580 C CYS A 37 -13.668 12.359 12.533 1.00 73.40 C ATOM 581 O CYS A 37 -13.662 13.152 13.474 1.00 63.34 O ATOM 582 CB CYS A 37 -12.292 12.694 10.471 1.00 10.50 C ATOM 583 SG CYS A 37 -12.585 14.476 10.560 1.00 50.45 S ATOM 0 H CYS A 37 -13.170 10.039 11.757 1.00 44.21 H new ATOM 0 HA CYS A 37 -11.534 12.291 12.442 1.00 41.34 H new ATOM 0 HB2 CYS A 37 -11.306 12.520 10.039 1.00 10.50 H new ATOM 0 HB3 CYS A 37 -13.020 12.250 9.792 1.00 10.50 H new ATOM 0 HG CYS A 37 -12.492 14.991 9.370 1.00 50.45 H new ATOM 589 N VAL A 38 -14.779 11.787 12.077 1.00 51.21 N ATOM 590 CA VAL A 38 -16.081 12.066 12.669 1.00 35.21 C ATOM 591 C VAL A 38 -16.724 10.792 13.207 1.00 23.54 C ATOM 592 O VAL A 38 -17.223 10.764 14.332 1.00 53.44 O ATOM 593 CB VAL A 38 -17.034 12.718 11.650 1.00 1.32 C ATOM 594 CG1 VAL A 38 -16.677 14.182 11.446 1.00 24.02 C ATOM 595 CG2 VAL A 38 -16.999 11.962 10.330 1.00 44.33 C ATOM 0 H VAL A 38 -14.802 11.128 11.299 1.00 51.21 H new ATOM 0 HA VAL A 38 -15.912 12.760 13.492 1.00 35.21 H new ATOM 0 HB VAL A 38 -18.049 12.669 12.044 1.00 1.32 H new ATOM 0 HG11 VAL A 38 -17.361 14.626 10.723 1.00 24.02 H new ATOM 0 HG12 VAL A 38 -16.758 14.712 12.395 1.00 24.02 H new ATOM 0 HG13 VAL A 38 -15.655 14.259 11.074 1.00 24.02 H new ATOM 0 HG21 VAL A 38 -17.678 12.436 9.621 1.00 44.33 H new ATOM 0 HG22 VAL A 38 -15.986 11.978 9.928 1.00 44.33 H new ATOM 0 HG23 VAL A 38 -17.308 10.930 10.494 1.00 44.33 H new ATOM 605 N HIS A 39 -16.706 9.739 12.397 1.00 71.53 N ATOM 606 CA HIS A 39 -17.287 8.461 12.791 1.00 22.14 C ATOM 607 C HIS A 39 -16.263 7.605 13.531 1.00 4.11 C ATOM 608 O HIS A 39 -15.081 7.947 13.590 1.00 22.13 O ATOM 609 CB HIS A 39 -17.805 7.711 11.564 1.00 50.11 C ATOM 610 CG HIS A 39 -16.725 7.320 10.601 1.00 45.35 C ATOM 611 ND1 HIS A 39 -15.402 7.664 10.775 1.00 11.13 N ATOM 612 CD2 HIS A 39 -16.780 6.609 9.452 1.00 35.14 C ATOM 613 CE1 HIS A 39 -14.689 7.183 9.772 1.00 50.41 C ATOM 614 NE2 HIS A 39 -15.501 6.538 8.955 1.00 62.33 N ATOM 0 H HIS A 39 -16.295 9.745 11.463 1.00 71.53 H new ATOM 0 HA HIS A 39 -18.122 8.661 13.463 1.00 22.14 H new ATOM 0 HB2 HIS A 39 -18.331 6.814 11.892 1.00 50.11 H new ATOM 0 HB3 HIS A 39 -18.533 8.336 11.047 1.00 50.11 H new ATOM 0 HD1 HIS A 39 -15.031 8.205 11.556 1.00 11.13 H new ATOM 0 HD2 HIS A 39 -17.665 6.177 9.008 1.00 35.14 H new ATOM 0 HE1 HIS A 39 -13.623 7.298 9.643 1.00 50.41 H new ATOM 622 N CYS A 40 -16.724 6.493 14.093 1.00 74.13 N ATOM 623 CA CYS A 40 -15.849 5.589 14.830 1.00 13.42 C ATOM 624 C CYS A 40 -16.160 4.135 14.491 1.00 1.34 C ATOM 625 O CYS A 40 -15.662 3.216 15.141 1.00 33.12 O ATOM 626 CB CYS A 40 -15.995 5.817 16.335 1.00 24.25 C ATOM 627 SG CYS A 40 -14.587 6.658 17.095 1.00 43.44 S ATOM 0 H CYS A 40 -17.699 6.196 14.052 1.00 74.13 H new ATOM 0 HA CYS A 40 -14.821 5.800 14.537 1.00 13.42 H new ATOM 0 HB2 CYS A 40 -16.896 6.403 16.517 1.00 24.25 H new ATOM 0 HB3 CYS A 40 -16.137 4.854 16.825 1.00 24.25 H new ATOM 0 HG CYS A 40 -14.806 6.807 18.368 1.00 43.44 H new ATOM 633 N GLU A 41 -16.988 3.934 13.471 1.00 13.33 N ATOM 634 CA GLU A 41 -17.367 2.591 13.049 1.00 54.20 C ATOM 635 C GLU A 41 -16.544 2.147 11.843 1.00 41.35 C ATOM 636 O GLU A 41 -15.790 1.177 11.917 1.00 5.33 O ATOM 637 CB GLU A 41 -18.858 2.541 12.708 1.00 45.52 C ATOM 638 CG GLU A 41 -19.761 2.939 13.864 1.00 3.22 C ATOM 639 CD GLU A 41 -20.008 1.797 14.830 1.00 14.41 C ATOM 640 OE1 GLU A 41 -20.808 0.899 14.493 1.00 43.24 O ATOM 641 OE2 GLU A 41 -19.404 1.801 15.923 1.00 11.32 O ATOM 0 H GLU A 41 -17.409 4.684 12.922 1.00 13.33 H new ATOM 0 HA GLU A 41 -17.167 1.909 13.875 1.00 54.20 H new ATOM 0 HB2 GLU A 41 -19.051 3.202 11.863 1.00 45.52 H new ATOM 0 HB3 GLU A 41 -19.115 1.531 12.388 1.00 45.52 H new ATOM 0 HG2 GLU A 41 -19.311 3.774 14.401 1.00 3.22 H new ATOM 0 HG3 GLU A 41 -20.715 3.290 13.471 1.00 3.22 H new ATOM 648 N GLU A 42 -16.694 2.865 10.735 1.00 65.02 N ATOM 649 CA GLU A 42 -15.966 2.543 9.513 1.00 10.03 C ATOM 650 C GLU A 42 -14.515 3.008 9.606 1.00 2.12 C ATOM 651 O GLU A 42 -14.069 3.846 8.822 1.00 61.34 O ATOM 652 CB GLU A 42 -16.643 3.191 8.303 1.00 23.25 C ATOM 653 CG GLU A 42 -16.007 2.814 6.976 1.00 31.20 C ATOM 654 CD GLU A 42 -15.635 1.346 6.903 1.00 43.02 C ATOM 655 OE1 GLU A 42 -16.443 0.507 7.353 1.00 50.24 O ATOM 656 OE2 GLU A 42 -14.537 1.036 6.396 1.00 63.54 O ATOM 0 H GLU A 42 -17.312 3.673 10.658 1.00 65.02 H new ATOM 0 HA GLU A 42 -15.976 1.460 9.389 1.00 10.03 H new ATOM 0 HB2 GLU A 42 -17.694 2.903 8.288 1.00 23.25 H new ATOM 0 HB3 GLU A 42 -16.611 4.275 8.417 1.00 23.25 H new ATOM 0 HG2 GLU A 42 -16.697 3.051 6.166 1.00 31.20 H new ATOM 0 HG3 GLU A 42 -15.114 3.419 6.820 1.00 31.20 H new ATOM 663 N SER A 43 -13.785 2.458 10.571 1.00 34.12 N ATOM 664 CA SER A 43 -12.386 2.819 10.771 1.00 71.31 C ATOM 665 C SER A 43 -11.462 1.777 10.147 1.00 42.31 C ATOM 666 O SER A 43 -11.861 0.635 9.917 1.00 74.12 O ATOM 667 CB SER A 43 -12.082 2.958 12.264 1.00 61.50 C ATOM 668 OG SER A 43 -12.634 1.881 13.000 1.00 24.42 O ATOM 0 H SER A 43 -14.139 1.761 11.226 1.00 34.12 H new ATOM 0 HA SER A 43 -12.209 3.776 10.281 1.00 71.31 H new ATOM 0 HB2 SER A 43 -11.003 2.992 12.417 1.00 61.50 H new ATOM 0 HB3 SER A 43 -12.486 3.900 12.634 1.00 61.50 H new ATOM 0 HG SER A 43 -12.424 1.993 13.951 1.00 24.42 H new ATOM 674 N ILE A 44 -10.225 2.179 9.875 1.00 31.12 N ATOM 675 CA ILE A 44 -9.244 1.282 9.280 1.00 74.12 C ATOM 676 C ILE A 44 -7.861 1.499 9.885 1.00 51.11 C ATOM 677 O ILE A 44 -7.451 2.633 10.131 1.00 21.11 O ATOM 678 CB ILE A 44 -9.160 1.472 7.754 1.00 0.13 C ATOM 679 CG1 ILE A 44 -10.417 0.919 7.079 1.00 2.44 C ATOM 680 CG2 ILE A 44 -7.915 0.795 7.203 1.00 73.44 C ATOM 681 CD1 ILE A 44 -10.586 -0.574 7.247 1.00 54.21 C ATOM 0 H ILE A 44 -9.879 3.121 10.058 1.00 31.12 H new ATOM 0 HA ILE A 44 -9.576 0.266 9.494 1.00 74.12 H new ATOM 0 HB ILE A 44 -9.094 2.539 7.539 1.00 0.13 H new ATOM 0 HG12 ILE A 44 -11.292 1.424 7.489 1.00 2.44 H new ATOM 0 HG13 ILE A 44 -10.382 1.155 6.015 1.00 2.44 H new ATOM 0 HG21 ILE A 44 -7.870 0.938 6.123 1.00 73.44 H new ATOM 0 HG22 ILE A 44 -7.029 1.232 7.664 1.00 73.44 H new ATOM 0 HG23 ILE A 44 -7.952 -0.271 7.426 1.00 73.44 H new ATOM 0 HD11 ILE A 44 -11.497 -0.896 6.743 1.00 54.21 H new ATOM 0 HD12 ILE A 44 -9.729 -1.088 6.811 1.00 54.21 H new ATOM 0 HD13 ILE A 44 -10.653 -0.815 8.308 1.00 54.21 H new ATOM 693 N MET A 45 -7.145 0.405 10.120 1.00 2.22 N ATOM 694 CA MET A 45 -5.806 0.476 10.693 1.00 64.43 C ATOM 695 C MET A 45 -4.915 -0.627 10.132 1.00 64.33 C ATOM 696 O MET A 45 -5.307 -1.792 10.088 1.00 4.42 O ATOM 697 CB MET A 45 -5.875 0.366 12.218 1.00 22.41 C ATOM 698 CG MET A 45 -6.340 1.643 12.898 1.00 40.12 C ATOM 699 SD MET A 45 -6.116 1.599 14.686 1.00 73.23 S ATOM 700 CE MET A 45 -7.817 1.684 15.244 1.00 13.21 C ATOM 0 H MET A 45 -7.469 -0.542 9.923 1.00 2.22 H new ATOM 0 HA MET A 45 -5.373 1.440 10.424 1.00 64.43 H new ATOM 0 HB2 MET A 45 -6.552 -0.446 12.485 1.00 22.41 H new ATOM 0 HB3 MET A 45 -4.890 0.099 12.600 1.00 22.41 H new ATOM 0 HG2 MET A 45 -5.790 2.490 12.488 1.00 40.12 H new ATOM 0 HG3 MET A 45 -7.393 1.808 12.672 1.00 40.12 H new ATOM 0 HE1 MET A 45 -7.888 1.285 16.256 1.00 13.21 H new ATOM 0 HE2 MET A 45 -8.150 2.722 15.239 1.00 13.21 H new ATOM 0 HE3 MET A 45 -8.449 1.097 14.577 1.00 13.21 H new ATOM 710 N ASN A 46 -3.714 -0.251 9.703 1.00 24.34 N ATOM 711 CA ASN A 46 -2.768 -1.210 9.143 1.00 43.34 C ATOM 712 C ASN A 46 -1.979 -1.905 10.250 1.00 33.43 C ATOM 713 O ASN A 46 -2.299 -1.775 11.431 1.00 11.24 O ATOM 714 CB ASN A 46 -1.808 -0.507 8.181 1.00 64.13 C ATOM 715 CG ASN A 46 -2.536 0.269 7.101 1.00 32.23 C ATOM 716 OD1 ASN A 46 -3.684 -0.032 6.773 1.00 1.30 O ATOM 717 ND2 ASN A 46 -1.871 1.273 6.544 1.00 63.34 N ATOM 0 H ASN A 46 -3.373 0.710 9.732 1.00 24.34 H new ATOM 0 HA ASN A 46 -3.333 -1.964 8.596 1.00 43.34 H new ATOM 0 HB2 ASN A 46 -1.167 0.172 8.743 1.00 64.13 H new ATOM 0 HB3 ASN A 46 -1.157 -1.247 7.716 1.00 64.13 H new ATOM 0 HD21 ASN A 46 -2.310 1.832 5.812 1.00 63.34 H new ATOM 0 HD22 ASN A 46 -0.921 1.486 6.848 1.00 63.34 H new ATOM 724 N LYS A 47 -0.946 -2.642 9.858 1.00 0.51 N ATOM 725 CA LYS A 47 -0.109 -3.357 10.814 1.00 53.33 C ATOM 726 C LYS A 47 0.447 -2.405 11.868 1.00 43.32 C ATOM 727 O LYS A 47 0.221 -2.588 13.063 1.00 44.03 O ATOM 728 CB LYS A 47 1.041 -4.062 10.091 1.00 2.20 C ATOM 729 CG LYS A 47 0.659 -5.414 9.514 1.00 2.10 C ATOM 730 CD LYS A 47 0.029 -5.275 8.138 1.00 44.41 C ATOM 731 CE LYS A 47 -1.490 -5.304 8.214 1.00 10.43 C ATOM 732 NZ LYS A 47 -2.063 -6.438 7.440 1.00 33.54 N ATOM 0 H LYS A 47 -0.668 -2.760 8.884 1.00 0.51 H new ATOM 0 HA LYS A 47 -0.727 -4.103 11.313 1.00 53.33 H new ATOM 0 HB2 LYS A 47 1.400 -3.421 9.286 1.00 2.20 H new ATOM 0 HB3 LYS A 47 1.870 -4.194 10.787 1.00 2.20 H new ATOM 0 HG2 LYS A 47 1.545 -6.046 9.448 1.00 2.10 H new ATOM 0 HG3 LYS A 47 -0.039 -5.913 10.186 1.00 2.10 H new ATOM 0 HD2 LYS A 47 0.354 -4.340 7.681 1.00 44.41 H new ATOM 0 HD3 LYS A 47 0.377 -6.082 7.494 1.00 44.41 H new ATOM 0 HE2 LYS A 47 -1.800 -5.383 9.256 1.00 10.43 H new ATOM 0 HE3 LYS A 47 -1.891 -4.365 7.832 1.00 10.43 H new ATOM 0 HZ1 LYS A 47 -3.100 -6.422 7.517 1.00 33.54 H new ATOM 0 HZ2 LYS A 47 -1.789 -6.350 6.441 1.00 33.54 H new ATOM 0 HZ3 LYS A 47 -1.701 -7.336 7.820 1.00 33.54 H new ATOM 746 N GLU A 48 1.175 -1.388 11.415 1.00 74.32 N ATOM 747 CA GLU A 48 1.763 -0.408 12.321 1.00 2.54 C ATOM 748 C GLU A 48 0.698 0.199 13.231 1.00 21.15 C ATOM 749 O GLU A 48 0.816 0.158 14.455 1.00 62.33 O ATOM 750 CB GLU A 48 2.461 0.698 11.528 1.00 12.25 C ATOM 751 CG GLU A 48 3.948 0.811 11.821 1.00 61.32 C ATOM 752 CD GLU A 48 4.722 1.439 10.678 1.00 10.54 C ATOM 753 OE1 GLU A 48 5.133 0.696 9.762 1.00 53.23 O ATOM 754 OE2 GLU A 48 4.916 2.672 10.700 1.00 72.34 O ATOM 0 H GLU A 48 1.371 -1.222 10.428 1.00 74.32 H new ATOM 0 HA GLU A 48 2.498 -0.920 12.941 1.00 2.54 H new ATOM 0 HB2 GLU A 48 2.322 0.513 10.463 1.00 12.25 H new ATOM 0 HB3 GLU A 48 1.982 1.651 11.751 1.00 12.25 H new ATOM 0 HG2 GLU A 48 4.093 1.406 12.723 1.00 61.32 H new ATOM 0 HG3 GLU A 48 4.351 -0.181 12.026 1.00 61.32 H new ATOM 761 N GLU A 49 -0.341 0.763 12.623 1.00 70.33 N ATOM 762 CA GLU A 49 -1.426 1.379 13.377 1.00 50.20 C ATOM 763 C GLU A 49 -1.963 0.422 14.437 1.00 55.14 C ATOM 764 O GLU A 49 -1.949 0.728 15.629 1.00 22.32 O ATOM 765 CB GLU A 49 -2.556 1.802 12.436 1.00 2.30 C ATOM 766 CG GLU A 49 -2.140 2.853 11.420 1.00 23.44 C ATOM 767 CD GLU A 49 -1.605 2.244 10.138 1.00 34.30 C ATOM 768 OE1 GLU A 49 -0.418 1.855 10.115 1.00 4.24 O ATOM 769 OE2 GLU A 49 -2.373 2.158 9.158 1.00 22.13 O ATOM 0 H GLU A 49 -0.454 0.806 11.610 1.00 70.33 H new ATOM 0 HA GLU A 49 -1.030 2.263 13.877 1.00 50.20 H new ATOM 0 HB2 GLU A 49 -2.925 0.923 11.907 1.00 2.30 H new ATOM 0 HB3 GLU A 49 -3.385 2.189 13.028 1.00 2.30 H new ATOM 0 HG2 GLU A 49 -2.995 3.487 11.187 1.00 23.44 H new ATOM 0 HG3 GLU A 49 -1.377 3.496 11.859 1.00 23.44 H new ATOM 776 N SER A 50 -2.438 -0.737 13.993 1.00 33.32 N ATOM 777 CA SER A 50 -2.986 -1.737 14.902 1.00 42.43 C ATOM 778 C SER A 50 -1.972 -2.102 15.982 1.00 44.52 C ATOM 779 O SER A 50 -2.330 -2.307 17.141 1.00 52.33 O ATOM 780 CB SER A 50 -3.396 -2.992 14.127 1.00 53.24 C ATOM 781 OG SER A 50 -4.163 -3.863 14.938 1.00 71.31 O ATOM 0 H SER A 50 -2.454 -1.007 13.009 1.00 33.32 H new ATOM 0 HA SER A 50 -3.867 -1.311 15.383 1.00 42.43 H new ATOM 0 HB2 SER A 50 -3.972 -2.708 13.247 1.00 53.24 H new ATOM 0 HB3 SER A 50 -2.506 -3.511 13.771 1.00 53.24 H new ATOM 0 HG SER A 50 -4.414 -4.656 14.420 1.00 71.31 H new ATOM 787 N ASP A 51 -0.704 -2.181 15.593 1.00 72.14 N ATOM 788 CA ASP A 51 0.364 -2.520 16.527 1.00 14.13 C ATOM 789 C ASP A 51 0.423 -1.514 17.671 1.00 1.11 C ATOM 790 O ASP A 51 0.532 -1.891 18.837 1.00 21.41 O ATOM 791 CB ASP A 51 1.709 -2.566 15.801 1.00 1.24 C ATOM 792 CG ASP A 51 2.119 -3.978 15.432 1.00 33.22 C ATOM 793 OD1 ASP A 51 2.173 -4.836 16.338 1.00 62.43 O ATOM 794 OD2 ASP A 51 2.388 -4.226 14.238 1.00 61.02 O ATOM 0 H ASP A 51 -0.390 -2.015 14.637 1.00 72.14 H new ATOM 0 HA ASP A 51 0.151 -3.505 16.943 1.00 14.13 H new ATOM 0 HB2 ASP A 51 1.652 -1.959 14.897 1.00 1.24 H new ATOM 0 HB3 ASP A 51 2.476 -2.122 16.435 1.00 1.24 H new ATOM 799 N ALA A 52 0.353 -0.231 17.330 1.00 63.45 N ATOM 800 CA ALA A 52 0.397 0.829 18.329 1.00 35.41 C ATOM 801 C ALA A 52 -0.826 0.779 19.239 1.00 62.23 C ATOM 802 O ALA A 52 -0.702 0.655 20.457 1.00 12.32 O ATOM 803 CB ALA A 52 0.499 2.188 17.652 1.00 24.20 C ATOM 0 H ALA A 52 0.266 0.099 16.369 1.00 63.45 H new ATOM 0 HA ALA A 52 1.282 0.675 18.947 1.00 35.41 H new ATOM 0 HB1 ALA A 52 0.531 2.971 18.410 1.00 24.20 H new ATOM 0 HB2 ALA A 52 1.407 2.228 17.051 1.00 24.20 H new ATOM 0 HB3 ALA A 52 -0.368 2.340 17.010 1.00 24.20 H new ATOM 809 N PHE A 53 -2.008 0.877 18.638 1.00 23.40 N ATOM 810 CA PHE A 53 -3.254 0.845 19.395 1.00 75.25 C ATOM 811 C PHE A 53 -3.323 -0.398 20.277 1.00 54.14 C ATOM 812 O PHE A 53 -3.661 -0.316 21.457 1.00 43.41 O ATOM 813 CB PHE A 53 -4.453 0.876 18.444 1.00 21.14 C ATOM 814 CG PHE A 53 -5.739 0.442 19.087 1.00 43.55 C ATOM 815 CD1 PHE A 53 -6.115 -0.892 19.083 1.00 64.40 C ATOM 816 CD2 PHE A 53 -6.573 1.367 19.694 1.00 1.51 C ATOM 817 CE1 PHE A 53 -7.297 -1.295 19.674 1.00 64.32 C ATOM 818 CE2 PHE A 53 -7.756 0.970 20.288 1.00 75.51 C ATOM 819 CZ PHE A 53 -8.120 -0.363 20.275 1.00 44.44 C ATOM 0 H PHE A 53 -2.129 0.979 17.630 1.00 23.40 H new ATOM 0 HA PHE A 53 -3.284 1.726 20.036 1.00 75.25 H new ATOM 0 HB2 PHE A 53 -4.573 1.888 18.056 1.00 21.14 H new ATOM 0 HB3 PHE A 53 -4.247 0.230 17.591 1.00 21.14 H new ATOM 0 HD1 PHE A 53 -5.477 -1.625 18.612 1.00 64.40 H new ATOM 0 HD2 PHE A 53 -6.295 2.411 19.703 1.00 1.51 H new ATOM 0 HE1 PHE A 53 -7.577 -2.338 19.666 1.00 64.32 H new ATOM 0 HE2 PHE A 53 -8.395 1.701 20.762 1.00 75.51 H new ATOM 0 HZ PHE A 53 -9.046 -0.675 20.734 1.00 44.44 H new ATOM 829 N MET A 54 -3.000 -1.548 19.694 1.00 72.25 N ATOM 830 CA MET A 54 -3.024 -2.809 20.427 1.00 23.14 C ATOM 831 C MET A 54 -1.983 -2.810 21.541 1.00 71.31 C ATOM 832 O MET A 54 -2.291 -3.123 22.691 1.00 72.22 O ATOM 833 CB MET A 54 -2.772 -3.981 19.476 1.00 53.24 C ATOM 834 CG MET A 54 -3.937 -4.268 18.544 1.00 41.12 C ATOM 835 SD MET A 54 -4.958 -5.644 19.108 1.00 1.32 S ATOM 836 CE MET A 54 -5.486 -5.037 20.708 1.00 22.25 C ATOM 0 H MET A 54 -2.719 -1.633 18.717 1.00 72.25 H new ATOM 0 HA MET A 54 -4.011 -2.921 20.876 1.00 23.14 H new ATOM 0 HB2 MET A 54 -1.884 -3.770 18.880 1.00 53.24 H new ATOM 0 HB3 MET A 54 -2.558 -4.875 20.062 1.00 53.24 H new ATOM 0 HG2 MET A 54 -4.555 -3.375 18.456 1.00 41.12 H new ATOM 0 HG3 MET A 54 -3.554 -4.490 17.548 1.00 41.12 H new ATOM 0 HE1 MET A 54 -6.224 -5.719 21.130 1.00 22.25 H new ATOM 0 HE2 MET A 54 -4.626 -4.974 21.375 1.00 22.25 H new ATOM 0 HE3 MET A 54 -5.930 -4.048 20.594 1.00 22.25 H new ATOM 846 N ALA A 55 -0.749 -2.459 21.193 1.00 1.31 N ATOM 847 CA ALA A 55 0.336 -2.418 22.165 1.00 1.43 C ATOM 848 C ALA A 55 -0.055 -1.600 23.391 1.00 62.43 C ATOM 849 O ALA A 55 0.272 -1.965 24.521 1.00 62.54 O ATOM 850 CB ALA A 55 1.594 -1.847 21.527 1.00 4.04 C ATOM 0 H ALA A 55 -0.476 -2.199 20.245 1.00 1.31 H new ATOM 0 HA ALA A 55 0.537 -3.438 22.491 1.00 1.43 H new ATOM 0 HB1 ALA A 55 2.397 -1.822 22.264 1.00 4.04 H new ATOM 0 HB2 ALA A 55 1.892 -2.474 20.687 1.00 4.04 H new ATOM 0 HB3 ALA A 55 1.395 -0.836 21.173 1.00 4.04 H new ATOM 856 N GLN A 56 -0.756 -0.495 23.161 1.00 50.13 N ATOM 857 CA GLN A 56 -1.189 0.375 24.248 1.00 41.35 C ATOM 858 C GLN A 56 -2.308 -0.278 25.053 1.00 34.15 C ATOM 859 O GLN A 56 -2.124 -0.631 26.218 1.00 42.12 O ATOM 860 CB GLN A 56 -1.660 1.722 23.695 1.00 31.30 C ATOM 861 CG GLN A 56 -0.630 2.412 22.817 1.00 14.33 C ATOM 862 CD GLN A 56 -0.290 3.807 23.303 1.00 43.41 C ATOM 863 OE1 GLN A 56 -0.669 4.814 22.525 1.00 2.13 O flip ATOM 864 NE2 GLN A 56 0.309 3.977 24.366 1.00 45.15 N flip ATOM 0 H GLN A 56 -1.036 -0.181 22.232 1.00 50.13 H new ATOM 0 HA GLN A 56 -0.339 0.540 24.910 1.00 41.35 H new ATOM 0 HB2 GLN A 56 -2.573 1.570 23.119 1.00 31.30 H new ATOM 0 HB3 GLN A 56 -1.914 2.378 24.527 1.00 31.30 H new ATOM 0 HG2 GLN A 56 0.278 1.810 22.787 1.00 14.33 H new ATOM 0 HG3 GLN A 56 -1.008 2.469 21.796 1.00 14.33 H new ATOM 0 HE21 GLN A 56 0.581 3.173 24.932 1.00 45.15 H new ATOM 0 HE22 GLN A 56 0.533 4.921 24.680 1.00 45.15 H new ATOM 873 N VAL A 57 -3.469 -0.434 24.425 1.00 35.54 N ATOM 874 CA VAL A 57 -4.618 -1.045 25.082 1.00 63.43 C ATOM 875 C VAL A 57 -4.220 -2.325 25.808 1.00 74.13 C ATOM 876 O VAL A 57 -4.662 -2.579 26.928 1.00 4.33 O ATOM 877 CB VAL A 57 -5.736 -1.369 24.073 1.00 5.43 C ATOM 878 CG1 VAL A 57 -6.161 -0.113 23.327 1.00 11.04 C ATOM 879 CG2 VAL A 57 -5.281 -2.447 23.101 1.00 32.12 C ATOM 0 H VAL A 57 -3.639 -0.145 23.461 1.00 35.54 H new ATOM 0 HA VAL A 57 -4.990 -0.320 25.806 1.00 63.43 H new ATOM 0 HB VAL A 57 -6.598 -1.748 24.622 1.00 5.43 H new ATOM 0 HG11 VAL A 57 -6.951 -0.361 22.618 1.00 11.04 H new ATOM 0 HG12 VAL A 57 -6.530 0.626 24.039 1.00 11.04 H new ATOM 0 HG13 VAL A 57 -5.307 0.297 22.789 1.00 11.04 H new ATOM 0 HG21 VAL A 57 -6.083 -2.663 22.396 1.00 32.12 H new ATOM 0 HG22 VAL A 57 -4.403 -2.099 22.557 1.00 32.12 H new ATOM 0 HG23 VAL A 57 -5.030 -3.352 23.653 1.00 32.12 H new ATOM 889 N LYS A 58 -3.380 -3.128 25.165 1.00 72.31 N ATOM 890 CA LYS A 58 -2.919 -4.381 25.748 1.00 51.44 C ATOM 891 C LYS A 58 -2.057 -4.123 26.981 1.00 14.05 C ATOM 892 O LYS A 58 -2.290 -4.697 28.044 1.00 2.55 O ATOM 893 CB LYS A 58 -2.123 -5.186 24.718 1.00 54.33 C ATOM 894 CG LYS A 58 -2.987 -5.812 23.637 1.00 14.23 C ATOM 895 CD LYS A 58 -4.154 -6.582 24.232 1.00 13.31 C ATOM 896 CE LYS A 58 -3.694 -7.534 25.326 1.00 22.12 C ATOM 897 NZ LYS A 58 -2.594 -8.423 24.860 1.00 73.22 N ATOM 0 H LYS A 58 -3.004 -2.932 24.237 1.00 72.31 H new ATOM 0 HA LYS A 58 -3.795 -4.955 26.051 1.00 51.44 H new ATOM 0 HB2 LYS A 58 -1.386 -4.534 24.250 1.00 54.33 H new ATOM 0 HB3 LYS A 58 -1.571 -5.973 25.232 1.00 54.33 H new ATOM 0 HG2 LYS A 58 -3.364 -5.033 22.975 1.00 14.23 H new ATOM 0 HG3 LYS A 58 -2.380 -6.482 23.028 1.00 14.23 H new ATOM 0 HD2 LYS A 58 -4.883 -5.882 24.640 1.00 13.31 H new ATOM 0 HD3 LYS A 58 -4.658 -7.145 23.447 1.00 13.31 H new ATOM 0 HE2 LYS A 58 -3.356 -6.960 26.189 1.00 22.12 H new ATOM 0 HE3 LYS A 58 -4.536 -8.141 25.657 1.00 22.12 H new ATOM 0 HZ1 LYS A 58 -2.749 -9.386 25.222 1.00 73.22 H new ATOM 0 HZ2 LYS A 58 -2.580 -8.442 23.820 1.00 73.22 H new ATOM 0 HZ3 LYS A 58 -1.684 -8.063 25.212 1.00 73.22 H new ATOM 911 N ALA A 59 -1.064 -3.253 26.832 1.00 62.13 N ATOM 912 CA ALA A 59 -0.172 -2.915 27.934 1.00 54.00 C ATOM 913 C ALA A 59 -0.960 -2.539 29.183 1.00 32.31 C ATOM 914 O ALA A 59 -0.730 -3.085 30.263 1.00 72.22 O ATOM 915 CB ALA A 59 0.758 -1.780 27.532 1.00 53.22 C ATOM 0 H ALA A 59 -0.857 -2.769 25.958 1.00 62.13 H new ATOM 0 HA ALA A 59 0.427 -3.795 28.166 1.00 54.00 H new ATOM 0 HB1 ALA A 59 1.418 -1.538 28.365 1.00 53.22 H new ATOM 0 HB2 ALA A 59 1.355 -2.086 26.673 1.00 53.22 H new ATOM 0 HB3 ALA A 59 0.168 -0.902 27.270 1.00 53.22 H new ATOM 921 N PHE A 60 -1.891 -1.604 29.030 1.00 24.05 N ATOM 922 CA PHE A 60 -2.713 -1.153 30.148 1.00 72.14 C ATOM 923 C PHE A 60 -3.630 -2.271 30.634 1.00 50.24 C ATOM 924 O PHE A 60 -3.795 -2.475 31.837 1.00 11.13 O ATOM 925 CB PHE A 60 -3.546 0.063 29.738 1.00 33.31 C ATOM 926 CG PHE A 60 -3.450 1.208 30.705 1.00 64.21 C ATOM 927 CD1 PHE A 60 -2.401 2.111 30.628 1.00 64.43 C ATOM 928 CD2 PHE A 60 -4.408 1.382 31.691 1.00 31.22 C ATOM 929 CE1 PHE A 60 -2.309 3.167 31.516 1.00 31.33 C ATOM 930 CE2 PHE A 60 -4.323 2.436 32.580 1.00 23.33 C ATOM 931 CZ PHE A 60 -3.271 3.329 32.494 1.00 13.31 C ATOM 0 H PHE A 60 -2.096 -1.143 28.143 1.00 24.05 H new ATOM 0 HA PHE A 60 -2.049 -0.871 30.965 1.00 72.14 H new ATOM 0 HB2 PHE A 60 -3.221 0.401 28.754 1.00 33.31 H new ATOM 0 HB3 PHE A 60 -4.590 -0.236 29.644 1.00 33.31 H new ATOM 0 HD1 PHE A 60 -1.646 1.988 29.865 1.00 64.43 H new ATOM 0 HD2 PHE A 60 -5.230 0.686 31.765 1.00 31.22 H new ATOM 0 HE1 PHE A 60 -1.487 3.864 31.445 1.00 31.33 H new ATOM 0 HE2 PHE A 60 -5.078 2.562 33.342 1.00 23.33 H new ATOM 0 HZ PHE A 60 -3.201 4.152 33.190 1.00 13.31 H new ATOM 941 N ARG A 61 -4.226 -2.993 29.689 1.00 54.11 N ATOM 942 CA ARG A 61 -5.128 -4.088 30.020 1.00 34.10 C ATOM 943 C ARG A 61 -4.488 -5.033 31.034 1.00 54.25 C ATOM 944 O ARG A 61 -5.071 -5.328 32.076 1.00 65.23 O ATOM 945 CB ARG A 61 -5.510 -4.862 28.756 1.00 34.43 C ATOM 946 CG ARG A 61 -6.701 -4.274 28.019 1.00 54.35 C ATOM 947 CD ARG A 61 -6.707 -4.683 26.554 1.00 61.05 C ATOM 948 NE ARG A 61 -6.783 -6.133 26.391 1.00 72.02 N ATOM 949 CZ ARG A 61 -7.870 -6.848 26.665 1.00 14.31 C ATOM 950 NH1 ARG A 61 -8.964 -6.250 27.113 1.00 52.51 N ATOM 951 NH2 ARG A 61 -7.861 -8.163 26.491 1.00 41.34 N ATOM 0 H ARG A 61 -4.100 -2.838 28.689 1.00 54.11 H new ATOM 0 HA ARG A 61 -6.028 -3.662 30.464 1.00 34.10 H new ATOM 0 HB2 ARG A 61 -4.653 -4.887 28.083 1.00 34.43 H new ATOM 0 HB3 ARG A 61 -5.734 -5.894 29.026 1.00 34.43 H new ATOM 0 HG2 ARG A 61 -7.624 -4.606 28.494 1.00 54.35 H new ATOM 0 HG3 ARG A 61 -6.676 -3.187 28.094 1.00 54.35 H new ATOM 0 HD2 ARG A 61 -7.554 -4.217 26.051 1.00 61.05 H new ATOM 0 HD3 ARG A 61 -5.804 -4.311 26.070 1.00 61.05 H new ATOM 0 HE ARG A 61 -5.957 -6.624 26.048 1.00 72.02 H new ATOM 0 HH11 ARG A 61 -8.974 -5.239 27.248 1.00 52.51 H new ATOM 0 HH12 ARG A 61 -9.797 -6.801 27.323 1.00 52.51 H new ATOM 0 HH21 ARG A 61 -7.020 -8.626 26.147 1.00 41.34 H new ATOM 0 HH22 ARG A 61 -8.695 -8.711 26.701 1.00 41.34 H new ATOM 965 N ALA A 62 -3.286 -5.504 30.719 1.00 12.45 N ATOM 966 CA ALA A 62 -2.566 -6.412 31.602 1.00 62.42 C ATOM 967 C ALA A 62 -2.174 -5.719 32.902 1.00 41.34 C ATOM 968 O ALA A 62 -2.482 -6.202 33.992 1.00 75.13 O ATOM 969 CB ALA A 62 -1.331 -6.962 30.902 1.00 75.01 C ATOM 0 H ALA A 62 -2.790 -5.271 29.858 1.00 12.45 H new ATOM 0 HA ALA A 62 -3.230 -7.241 31.848 1.00 62.42 H new ATOM 0 HB1 ALA A 62 -0.803 -7.639 31.574 1.00 75.01 H new ATOM 0 HB2 ALA A 62 -1.632 -7.503 30.005 1.00 75.01 H new ATOM 0 HB3 ALA A 62 -0.673 -6.139 30.625 1.00 75.01 H new ATOM 975 N SER A 63 -1.494 -4.584 32.782 1.00 33.42 N ATOM 976 CA SER A 63 -1.056 -3.826 33.948 1.00 2.12 C ATOM 977 C SER A 63 -2.206 -3.631 34.931 1.00 22.33 C ATOM 978 O SER A 63 -2.020 -3.708 36.146 1.00 4.52 O ATOM 979 CB SER A 63 -0.499 -2.467 33.520 1.00 54.30 C ATOM 980 OG SER A 63 0.800 -2.260 34.045 1.00 54.03 O ATOM 0 H SER A 63 -1.234 -4.168 31.888 1.00 33.42 H new ATOM 0 HA SER A 63 -0.268 -4.392 34.445 1.00 2.12 H new ATOM 0 HB2 SER A 63 -0.468 -2.409 32.432 1.00 54.30 H new ATOM 0 HB3 SER A 63 -1.164 -1.674 33.862 1.00 54.30 H new ATOM 0 HG SER A 63 1.134 -1.385 33.756 1.00 54.03 H new ATOM 986 N VAL A 64 -3.397 -3.377 34.397 1.00 71.34 N ATOM 987 CA VAL A 64 -4.579 -3.171 35.226 1.00 53.43 C ATOM 988 C VAL A 64 -5.169 -4.501 35.680 1.00 11.22 C ATOM 989 O VAL A 64 -5.797 -4.585 36.735 1.00 3.11 O ATOM 990 CB VAL A 64 -5.659 -2.373 34.474 1.00 35.34 C ATOM 991 CG1 VAL A 64 -6.866 -2.134 35.368 1.00 41.12 C ATOM 992 CG2 VAL A 64 -5.092 -1.055 33.969 1.00 72.40 C ATOM 0 H VAL A 64 -3.569 -3.309 33.394 1.00 71.34 H new ATOM 0 HA VAL A 64 -4.259 -2.602 36.099 1.00 53.43 H new ATOM 0 HB VAL A 64 -5.984 -2.957 33.613 1.00 35.34 H new ATOM 0 HG11 VAL A 64 -7.619 -1.568 34.819 1.00 41.12 H new ATOM 0 HG12 VAL A 64 -7.285 -3.092 35.677 1.00 41.12 H new ATOM 0 HG13 VAL A 64 -6.560 -1.571 36.249 1.00 41.12 H new ATOM 0 HG21 VAL A 64 -5.869 -0.504 33.440 1.00 72.40 H new ATOM 0 HG22 VAL A 64 -4.739 -0.464 34.814 1.00 72.40 H new ATOM 0 HG23 VAL A 64 -4.261 -1.252 33.291 1.00 72.40 H new ATOM 1002 N ASN A 65 -4.964 -5.539 34.876 1.00 65.42 N ATOM 1003 CA ASN A 65 -5.477 -6.867 35.195 1.00 63.33 C ATOM 1004 C ASN A 65 -4.917 -7.361 36.525 1.00 34.44 C ATOM 1005 O ASN A 65 -5.473 -8.266 37.148 1.00 74.22 O ATOM 1006 CB ASN A 65 -5.123 -7.855 34.082 1.00 65.12 C ATOM 1007 CG ASN A 65 -4.409 -9.085 34.606 1.00 25.04 C ATOM 1008 OD1 ASN A 65 -5.028 -10.122 34.845 1.00 23.33 O ATOM 1009 ND2 ASN A 65 -3.098 -8.976 34.788 1.00 24.43 N ATOM 0 H ASN A 65 -4.446 -5.487 33.999 1.00 65.42 H new ATOM 0 HA ASN A 65 -6.562 -6.799 35.280 1.00 63.33 H new ATOM 0 HB2 ASN A 65 -6.034 -8.159 33.567 1.00 65.12 H new ATOM 0 HB3 ASN A 65 -4.491 -7.358 33.346 1.00 65.12 H new ATOM 0 HD21 ASN A 65 -2.564 -9.771 35.139 1.00 24.43 H new ATOM 0 HD22 ASN A 65 -2.625 -8.097 34.577 1.00 24.43 H new ATOM 1016 N ALA A 66 -3.811 -6.760 36.956 1.00 34.40 N ATOM 1017 CA ALA A 66 -3.177 -7.137 38.212 1.00 71.20 C ATOM 1018 C ALA A 66 -4.155 -7.022 39.377 1.00 64.32 C ATOM 1019 O ALA A 66 -3.983 -7.670 40.409 1.00 75.05 O ATOM 1020 CB ALA A 66 -1.950 -6.274 38.464 1.00 31.54 C ATOM 0 H ALA A 66 -3.337 -6.010 36.453 1.00 34.40 H new ATOM 0 HA ALA A 66 -2.865 -8.179 38.134 1.00 71.20 H new ATOM 0 HB1 ALA A 66 -1.486 -6.567 39.406 1.00 31.54 H new ATOM 0 HB2 ALA A 66 -1.237 -6.409 37.651 1.00 31.54 H new ATOM 0 HB3 ALA A 66 -2.246 -5.226 38.516 1.00 31.54 H new ATOM 1026 N GLU A 67 -5.180 -6.194 39.204 1.00 20.14 N ATOM 1027 CA GLU A 67 -6.184 -5.994 40.242 1.00 72.20 C ATOM 1028 C GLU A 67 -6.740 -7.330 40.725 1.00 43.13 C ATOM 1029 O GLU A 67 -6.408 -7.797 41.816 1.00 75.41 O ATOM 1030 CB GLU A 67 -7.322 -5.115 39.719 1.00 22.11 C ATOM 1031 CG GLU A 67 -6.882 -3.712 39.337 1.00 61.11 C ATOM 1032 CD GLU A 67 -7.561 -2.640 40.168 1.00 0.53 C ATOM 1033 OE1 GLU A 67 -8.800 -2.699 40.313 1.00 63.32 O ATOM 1034 OE2 GLU A 67 -6.854 -1.743 40.672 1.00 43.35 O ATOM 0 H GLU A 67 -5.337 -5.651 38.355 1.00 20.14 H new ATOM 0 HA GLU A 67 -5.705 -5.493 41.084 1.00 72.20 H new ATOM 0 HB2 GLU A 67 -7.770 -5.595 38.849 1.00 22.11 H new ATOM 0 HB3 GLU A 67 -8.098 -5.048 40.482 1.00 22.11 H new ATOM 0 HG2 GLU A 67 -5.802 -3.629 39.457 1.00 61.11 H new ATOM 0 HG3 GLU A 67 -7.100 -3.541 38.283 1.00 61.11 H new ATOM 1041 N THR A 68 -7.589 -7.942 39.906 1.00 44.20 N ATOM 1042 CA THR A 68 -8.193 -9.224 40.250 1.00 74.54 C ATOM 1043 C THR A 68 -7.803 -10.303 39.246 1.00 54.25 C ATOM 1044 O THR A 68 -6.964 -11.157 39.532 1.00 43.32 O ATOM 1045 CB THR A 68 -9.730 -9.123 40.307 1.00 12.11 C ATOM 1046 OG1 THR A 68 -10.121 -8.159 41.290 1.00 61.32 O ATOM 1047 CG2 THR A 68 -10.348 -10.473 40.638 1.00 73.14 C ATOM 0 H THR A 68 -7.874 -7.571 39.000 1.00 44.20 H new ATOM 0 HA THR A 68 -7.817 -9.496 41.236 1.00 74.54 H new ATOM 0 HB THR A 68 -10.089 -8.807 39.327 1.00 12.11 H new ATOM 0 HG1 THR A 68 -10.970 -7.747 41.025 1.00 61.32 H new ATOM 0 HG21 THR A 68 -11.433 -10.378 40.673 1.00 73.14 H new ATOM 0 HG22 THR A 68 -10.072 -11.197 39.872 1.00 73.14 H new ATOM 0 HG23 THR A 68 -9.982 -10.813 41.607 1.00 73.14 H new ATOM 1055 N VAL A 69 -8.416 -10.257 38.068 1.00 72.34 N ATOM 1056 CA VAL A 69 -8.131 -11.230 37.020 1.00 71.13 C ATOM 1057 C VAL A 69 -8.305 -10.614 35.636 1.00 51.04 C ATOM 1058 O VAL A 69 -8.507 -9.408 35.503 1.00 32.41 O ATOM 1059 CB VAL A 69 -9.043 -12.467 37.138 1.00 73.32 C ATOM 1060 CG1 VAL A 69 -8.940 -13.076 38.528 1.00 12.13 C ATOM 1061 CG2 VAL A 69 -10.483 -12.098 36.814 1.00 63.22 C ATOM 0 H VAL A 69 -9.113 -9.557 37.815 1.00 72.34 H new ATOM 0 HA VAL A 69 -7.094 -11.539 37.149 1.00 71.13 H new ATOM 0 HB VAL A 69 -8.711 -13.213 36.416 1.00 73.32 H new ATOM 0 HG11 VAL A 69 -9.591 -13.948 38.592 1.00 12.13 H new ATOM 0 HG12 VAL A 69 -7.910 -13.377 38.718 1.00 12.13 H new ATOM 0 HG13 VAL A 69 -9.246 -12.340 39.271 1.00 12.13 H new ATOM 0 HG21 VAL A 69 -11.114 -12.983 36.902 1.00 63.22 H new ATOM 0 HG22 VAL A 69 -10.829 -11.335 37.511 1.00 63.22 H new ATOM 0 HG23 VAL A 69 -10.539 -11.712 35.796 1.00 63.22 H new ATOM 1071 N ALA A 70 -8.224 -11.452 34.607 1.00 13.24 N ATOM 1072 CA ALA A 70 -8.376 -10.992 33.233 1.00 3.13 C ATOM 1073 C ALA A 70 -9.730 -11.397 32.664 1.00 32.51 C ATOM 1074 O ALA A 70 -10.389 -12.313 33.155 1.00 43.12 O ATOM 1075 CB ALA A 70 -7.252 -11.538 32.366 1.00 12.50 C ATOM 0 H ALA A 70 -8.054 -12.453 34.700 1.00 13.24 H new ATOM 0 HA ALA A 70 -8.323 -9.903 33.234 1.00 3.13 H new ATOM 0 HB1 ALA A 70 -7.379 -11.186 31.342 1.00 12.50 H new ATOM 0 HB2 ALA A 70 -6.293 -11.192 32.753 1.00 12.50 H new ATOM 0 HB3 ALA A 70 -7.277 -12.628 32.381 1.00 12.50 H new ATOM 1081 N PRO A 71 -10.160 -10.699 31.601 1.00 65.15 N ATOM 1082 CA PRO A 71 -11.441 -10.969 30.942 1.00 1.54 C ATOM 1083 C PRO A 71 -11.439 -12.297 30.192 1.00 12.21 C ATOM 1084 O PRO A 71 -12.477 -12.748 29.708 1.00 20.04 O ATOM 1085 CB PRO A 71 -11.589 -9.803 29.962 1.00 70.44 C ATOM 1086 CG PRO A 71 -10.193 -9.358 29.689 1.00 72.52 C ATOM 1087 CD PRO A 71 -9.428 -9.593 30.961 1.00 22.23 C ATOM 0 HA PRO A 71 -12.258 -11.048 31.659 1.00 1.54 H new ATOM 0 HB2 PRO A 71 -12.091 -10.117 29.047 1.00 70.44 H new ATOM 0 HB3 PRO A 71 -12.184 -8.998 30.392 1.00 70.44 H new ATOM 0 HG2 PRO A 71 -9.759 -9.921 28.863 1.00 72.52 H new ATOM 0 HG3 PRO A 71 -10.167 -8.306 29.407 1.00 72.52 H new ATOM 0 HD2 PRO A 71 -8.390 -9.860 30.762 1.00 22.23 H new ATOM 0 HD3 PRO A 71 -9.413 -8.704 31.591 1.00 22.23 H new ATOM 1095 N GLU A 72 -10.267 -12.917 30.100 1.00 71.53 N ATOM 1096 CA GLU A 72 -10.130 -14.194 29.408 1.00 24.02 C ATOM 1097 C GLU A 72 -10.159 -15.355 30.399 1.00 3.11 C ATOM 1098 O GLU A 72 -10.684 -16.428 30.099 1.00 45.23 O ATOM 1099 CB GLU A 72 -8.830 -14.228 28.603 1.00 63.23 C ATOM 1100 CG GLU A 72 -8.997 -13.789 27.158 1.00 23.41 C ATOM 1101 CD GLU A 72 -7.960 -12.765 26.736 1.00 62.14 C ATOM 1102 OE1 GLU A 72 -6.753 -13.071 26.827 1.00 65.14 O ATOM 1103 OE2 GLU A 72 -8.357 -11.659 26.313 1.00 71.11 O ATOM 0 H GLU A 72 -9.399 -12.556 30.496 1.00 71.53 H new ATOM 0 HA GLU A 72 -10.973 -14.300 28.725 1.00 24.02 H new ATOM 0 HB2 GLU A 72 -8.096 -13.584 29.087 1.00 63.23 H new ATOM 0 HB3 GLU A 72 -8.427 -15.241 28.622 1.00 63.23 H new ATOM 0 HG2 GLU A 72 -8.928 -14.660 26.507 1.00 23.41 H new ATOM 0 HG3 GLU A 72 -9.994 -13.369 27.023 1.00 23.41 H new ATOM 1110 N PHE A 73 -9.589 -15.132 31.579 1.00 42.31 N ATOM 1111 CA PHE A 73 -9.547 -16.160 32.613 1.00 33.33 C ATOM 1112 C PHE A 73 -10.954 -16.634 32.966 1.00 65.15 C ATOM 1113 O PHE A 73 -11.276 -17.813 32.820 1.00 70.42 O ATOM 1114 CB PHE A 73 -8.848 -15.624 33.864 1.00 14.40 C ATOM 1115 CG PHE A 73 -8.560 -16.683 34.889 1.00 4.03 C ATOM 1116 CD1 PHE A 73 -9.586 -17.241 35.636 1.00 3.12 C ATOM 1117 CD2 PHE A 73 -7.265 -17.122 35.106 1.00 31.45 C ATOM 1118 CE1 PHE A 73 -9.325 -18.214 36.581 1.00 71.33 C ATOM 1119 CE2 PHE A 73 -6.996 -18.097 36.049 1.00 33.41 C ATOM 1120 CZ PHE A 73 -8.028 -18.644 36.787 1.00 23.22 C ATOM 0 H PHE A 73 -9.150 -14.250 31.843 1.00 42.31 H new ATOM 0 HA PHE A 73 -8.984 -17.009 32.225 1.00 33.33 H new ATOM 0 HB2 PHE A 73 -7.912 -15.148 33.572 1.00 14.40 H new ATOM 0 HB3 PHE A 73 -9.471 -14.852 34.316 1.00 14.40 H new ATOM 0 HD1 PHE A 73 -10.602 -16.911 35.477 1.00 3.12 H new ATOM 0 HD2 PHE A 73 -6.455 -16.698 34.532 1.00 31.45 H new ATOM 0 HE1 PHE A 73 -10.133 -18.638 37.158 1.00 71.33 H new ATOM 0 HE2 PHE A 73 -5.981 -18.430 36.208 1.00 33.41 H new ATOM 0 HZ PHE A 73 -7.821 -19.406 37.524 1.00 23.22 H new ATOM 1130 N ILE A 74 -11.785 -15.708 33.430 1.00 62.10 N ATOM 1131 CA ILE A 74 -13.156 -16.032 33.804 1.00 11.01 C ATOM 1132 C ILE A 74 -13.824 -16.901 32.744 1.00 71.02 C ATOM 1133 O ILE A 74 -14.108 -18.076 32.977 1.00 44.51 O ATOM 1134 CB ILE A 74 -13.999 -14.759 34.012 1.00 5.51 C ATOM 1135 CG1 ILE A 74 -13.364 -13.576 33.277 1.00 74.21 C ATOM 1136 CG2 ILE A 74 -14.139 -14.454 35.496 1.00 21.41 C ATOM 1137 CD1 ILE A 74 -14.316 -12.422 33.056 1.00 12.51 C ATOM 0 H ILE A 74 -11.533 -14.728 33.556 1.00 62.10 H new ATOM 0 HA ILE A 74 -13.105 -16.582 34.743 1.00 11.01 H new ATOM 0 HB ILE A 74 -14.994 -14.927 33.600 1.00 5.51 H new ATOM 0 HG12 ILE A 74 -12.504 -13.223 33.847 1.00 74.21 H new ATOM 0 HG13 ILE A 74 -12.989 -13.917 32.312 1.00 74.21 H new ATOM 0 HG21 ILE A 74 -14.737 -13.552 35.627 1.00 21.41 H new ATOM 0 HG22 ILE A 74 -14.629 -15.290 35.995 1.00 21.41 H new ATOM 0 HG23 ILE A 74 -13.151 -14.301 35.931 1.00 21.41 H new ATOM 0 HD11 ILE A 74 -13.799 -11.619 32.530 1.00 12.51 H new ATOM 0 HD12 ILE A 74 -15.164 -12.759 32.460 1.00 12.51 H new ATOM 0 HD13 ILE A 74 -14.672 -12.055 34.018 1.00 12.51 H new ATOM 1149 N VAL A 75 -14.071 -16.317 31.575 1.00 13.50 N ATOM 1150 CA VAL A 75 -14.702 -17.039 30.478 1.00 55.20 C ATOM 1151 C VAL A 75 -14.033 -18.389 30.251 1.00 11.40 C ATOM 1152 O VAL A 75 -14.700 -19.389 29.982 1.00 31.02 O ATOM 1153 CB VAL A 75 -14.651 -16.228 29.169 1.00 71.12 C ATOM 1154 CG1 VAL A 75 -15.461 -14.947 29.303 1.00 53.41 C ATOM 1155 CG2 VAL A 75 -13.210 -15.919 28.790 1.00 23.31 C ATOM 0 H VAL A 75 -13.843 -15.345 31.364 1.00 13.50 H new ATOM 0 HA VAL A 75 -15.743 -17.195 30.761 1.00 55.20 H new ATOM 0 HB VAL A 75 -15.092 -16.828 28.373 1.00 71.12 H new ATOM 0 HG11 VAL A 75 -15.414 -14.387 28.369 1.00 53.41 H new ATOM 0 HG12 VAL A 75 -16.499 -15.194 29.525 1.00 53.41 H new ATOM 0 HG13 VAL A 75 -15.052 -14.340 30.111 1.00 53.41 H new ATOM 0 HG21 VAL A 75 -13.192 -15.346 27.863 1.00 23.31 H new ATOM 0 HG22 VAL A 75 -12.741 -15.339 29.585 1.00 23.31 H new ATOM 0 HG23 VAL A 75 -12.663 -16.851 28.650 1.00 23.31 H new ATOM 1165 N LYS A 76 -12.709 -18.415 30.364 1.00 13.12 N ATOM 1166 CA LYS A 76 -11.947 -19.643 30.174 1.00 14.44 C ATOM 1167 C LYS A 76 -12.372 -20.708 31.181 1.00 14.54 C ATOM 1168 O LYS A 76 -12.613 -21.858 30.817 1.00 33.14 O ATOM 1169 CB LYS A 76 -10.449 -19.364 30.312 1.00 13.53 C ATOM 1170 CG LYS A 76 -9.755 -19.100 28.987 1.00 23.41 C ATOM 1171 CD LYS A 76 -8.260 -19.354 29.080 1.00 74.41 C ATOM 1172 CE LYS A 76 -7.523 -18.147 29.642 1.00 34.25 C ATOM 1173 NZ LYS A 76 -6.125 -18.067 29.139 1.00 15.33 N ATOM 0 H LYS A 76 -12.141 -17.598 30.587 1.00 13.12 H new ATOM 0 HA LYS A 76 -12.150 -20.016 29.170 1.00 14.44 H new ATOM 0 HB2 LYS A 76 -10.307 -18.503 30.965 1.00 13.53 H new ATOM 0 HB3 LYS A 76 -9.973 -20.215 30.799 1.00 13.53 H new ATOM 0 HG2 LYS A 76 -10.186 -19.739 28.216 1.00 23.41 H new ATOM 0 HG3 LYS A 76 -9.931 -18.068 28.682 1.00 23.41 H new ATOM 0 HD2 LYS A 76 -8.076 -20.221 29.714 1.00 74.41 H new ATOM 0 HD3 LYS A 76 -7.868 -19.593 28.091 1.00 74.41 H new ATOM 0 HE2 LYS A 76 -8.059 -17.237 29.372 1.00 34.25 H new ATOM 0 HE3 LYS A 76 -7.515 -18.201 30.731 1.00 34.25 H new ATOM 0 HZ1 LYS A 76 -5.657 -17.232 29.545 1.00 15.33 H new ATOM 0 HZ2 LYS A 76 -5.606 -18.924 29.418 1.00 15.33 H new ATOM 0 HZ3 LYS A 76 -6.133 -17.989 28.102 1.00 15.33 H new ATOM 1187 N VAL A 77 -12.463 -20.316 32.447 1.00 74.50 N ATOM 1188 CA VAL A 77 -12.862 -21.235 33.505 1.00 22.40 C ATOM 1189 C VAL A 77 -14.259 -21.790 33.254 1.00 60.02 C ATOM 1190 O VAL A 77 -14.526 -22.966 33.504 1.00 55.21 O ATOM 1191 CB VAL A 77 -12.834 -20.551 34.885 1.00 12.31 C ATOM 1192 CG1 VAL A 77 -13.350 -21.495 35.961 1.00 34.34 C ATOM 1193 CG2 VAL A 77 -11.427 -20.074 35.213 1.00 51.31 C ATOM 0 H VAL A 77 -12.266 -19.367 32.765 1.00 74.50 H new ATOM 0 HA VAL A 77 -12.142 -22.054 33.499 1.00 22.40 H new ATOM 0 HB VAL A 77 -13.491 -19.682 34.854 1.00 12.31 H new ATOM 0 HG11 VAL A 77 -13.322 -20.994 36.929 1.00 34.34 H new ATOM 0 HG12 VAL A 77 -14.376 -21.783 35.731 1.00 34.34 H new ATOM 0 HG13 VAL A 77 -12.722 -22.385 35.996 1.00 34.34 H new ATOM 0 HG21 VAL A 77 -11.425 -19.593 36.191 1.00 51.31 H new ATOM 0 HG22 VAL A 77 -10.748 -20.926 35.226 1.00 51.31 H new ATOM 0 HG23 VAL A 77 -11.099 -19.360 34.457 1.00 51.31 H new ATOM 1203 N ARG A 78 -15.149 -20.936 32.758 1.00 43.20 N ATOM 1204 CA ARG A 78 -16.520 -21.341 32.473 1.00 1.30 C ATOM 1205 C ARG A 78 -16.558 -22.407 31.383 1.00 10.34 C ATOM 1206 O ARG A 78 -17.038 -23.519 31.602 1.00 23.41 O ATOM 1207 CB ARG A 78 -17.353 -20.130 32.046 1.00 40.24 C ATOM 1208 CG ARG A 78 -17.170 -18.918 32.945 1.00 54.23 C ATOM 1209 CD ARG A 78 -18.426 -18.061 32.987 1.00 54.24 C ATOM 1210 NE ARG A 78 -18.882 -17.827 34.355 1.00 2.03 N ATOM 1211 CZ ARG A 78 -18.621 -16.718 35.037 1.00 43.20 C ATOM 1212 NH1 ARG A 78 -17.909 -15.746 34.482 1.00 14.04 N ATOM 1213 NH2 ARG A 78 -19.072 -16.578 36.278 1.00 41.04 N ATOM 0 H ARG A 78 -14.945 -19.960 32.545 1.00 43.20 H new ATOM 0 HA ARG A 78 -16.944 -21.763 33.384 1.00 1.30 H new ATOM 0 HB2 ARG A 78 -17.086 -19.858 31.025 1.00 40.24 H new ATOM 0 HB3 ARG A 78 -18.407 -20.409 32.037 1.00 40.24 H new ATOM 0 HG2 ARG A 78 -16.918 -19.246 33.953 1.00 54.23 H new ATOM 0 HG3 ARG A 78 -16.332 -18.320 32.586 1.00 54.23 H new ATOM 0 HD2 ARG A 78 -18.229 -17.105 32.502 1.00 54.24 H new ATOM 0 HD3 ARG A 78 -19.218 -18.550 32.419 1.00 54.24 H new ATOM 0 HE ARG A 78 -19.431 -18.556 34.811 1.00 2.03 H new ATOM 0 HH11 ARG A 78 -17.561 -15.849 33.529 1.00 14.04 H new ATOM 0 HH12 ARG A 78 -17.710 -14.895 35.008 1.00 14.04 H new ATOM 0 HH21 ARG A 78 -19.620 -17.323 36.709 1.00 41.04 H new ATOM 0 HH22 ARG A 78 -18.871 -15.726 36.801 1.00 41.04 H new ATOM 1227 N LYS A 79 -16.047 -22.060 30.206 1.00 42.32 N ATOM 1228 CA LYS A 79 -16.019 -22.986 29.080 1.00 44.45 C ATOM 1229 C LYS A 79 -15.128 -24.185 29.384 1.00 43.44 C ATOM 1230 O LYS A 79 -15.260 -25.243 28.766 1.00 74.11 O ATOM 1231 CB LYS A 79 -15.525 -22.275 27.819 1.00 13.13 C ATOM 1232 CG LYS A 79 -14.124 -21.702 27.954 1.00 11.32 C ATOM 1233 CD LYS A 79 -13.298 -21.946 26.702 1.00 71.24 C ATOM 1234 CE LYS A 79 -12.539 -20.696 26.284 1.00 52.13 C ATOM 1235 NZ LYS A 79 -11.529 -20.988 25.229 1.00 30.23 N ATOM 0 H LYS A 79 -15.646 -21.143 30.007 1.00 42.32 H new ATOM 0 HA LYS A 79 -17.035 -23.344 28.912 1.00 44.45 H new ATOM 0 HB2 LYS A 79 -15.543 -22.977 26.985 1.00 13.13 H new ATOM 0 HB3 LYS A 79 -16.216 -21.469 27.572 1.00 13.13 H new ATOM 0 HG2 LYS A 79 -14.185 -20.631 28.147 1.00 11.32 H new ATOM 0 HG3 LYS A 79 -13.627 -22.153 28.813 1.00 11.32 H new ATOM 0 HD2 LYS A 79 -12.593 -22.758 26.882 1.00 71.24 H new ATOM 0 HD3 LYS A 79 -13.951 -22.265 25.890 1.00 71.24 H new ATOM 0 HE2 LYS A 79 -13.243 -19.949 25.916 1.00 52.13 H new ATOM 0 HE3 LYS A 79 -12.042 -20.265 27.153 1.00 52.13 H new ATOM 0 HZ1 LYS A 79 -11.033 -20.111 24.971 1.00 30.23 H new ATOM 0 HZ2 LYS A 79 -10.842 -21.681 25.588 1.00 30.23 H new ATOM 0 HZ3 LYS A 79 -12.006 -21.376 24.390 1.00 30.23 H new ATOM 1249 N LYS A 80 -14.221 -24.016 30.339 1.00 33.32 N ATOM 1250 CA LYS A 80 -13.309 -25.085 30.726 1.00 41.11 C ATOM 1251 C LYS A 80 -14.053 -26.197 31.459 1.00 12.24 C ATOM 1252 O LYS A 80 -13.977 -27.365 31.077 1.00 63.41 O ATOM 1253 CB LYS A 80 -12.192 -24.533 31.616 1.00 34.51 C ATOM 1254 CG LYS A 80 -11.343 -25.612 32.267 1.00 71.23 C ATOM 1255 CD LYS A 80 -10.011 -25.060 32.745 1.00 12.35 C ATOM 1256 CE LYS A 80 -9.084 -24.753 31.579 1.00 31.14 C ATOM 1257 NZ LYS A 80 -7.663 -25.054 31.905 1.00 22.21 N ATOM 0 H LYS A 80 -14.098 -23.148 30.860 1.00 33.32 H new ATOM 0 HA LYS A 80 -12.871 -25.501 29.819 1.00 41.11 H new ATOM 0 HB2 LYS A 80 -11.548 -23.887 31.018 1.00 34.51 H new ATOM 0 HB3 LYS A 80 -12.633 -23.911 32.395 1.00 34.51 H new ATOM 0 HG2 LYS A 80 -11.883 -26.042 33.110 1.00 71.23 H new ATOM 0 HG3 LYS A 80 -11.169 -26.419 31.555 1.00 71.23 H new ATOM 0 HD2 LYS A 80 -10.179 -24.153 33.326 1.00 12.35 H new ATOM 0 HD3 LYS A 80 -9.535 -25.781 33.410 1.00 12.35 H new ATOM 0 HE2 LYS A 80 -9.388 -25.336 30.710 1.00 31.14 H new ATOM 0 HE3 LYS A 80 -9.179 -23.702 31.307 1.00 31.14 H new ATOM 0 HZ1 LYS A 80 -7.045 -24.647 31.174 1.00 22.21 H new ATOM 0 HZ2 LYS A 80 -7.424 -24.641 32.829 1.00 22.21 H new ATOM 0 HZ3 LYS A 80 -7.526 -26.084 31.940 1.00 22.21 H new ATOM 1271 N LEU A 81 -14.772 -25.827 32.513 1.00 43.34 N ATOM 1272 CA LEU A 81 -15.532 -26.793 33.298 1.00 31.52 C ATOM 1273 C LEU A 81 -16.956 -26.926 32.768 1.00 41.12 C ATOM 1274 O LEU A 81 -17.830 -27.476 33.438 1.00 43.53 O ATOM 1275 CB LEU A 81 -15.561 -26.374 34.769 1.00 23.04 C ATOM 1276 CG LEU A 81 -14.248 -25.836 35.340 1.00 64.35 C ATOM 1277 CD1 LEU A 81 -14.482 -25.188 36.695 1.00 3.34 C ATOM 1278 CD2 LEU A 81 -13.218 -26.951 35.449 1.00 53.42 C ATOM 0 H LEU A 81 -14.845 -24.865 32.844 1.00 43.34 H new ATOM 0 HA LEU A 81 -15.040 -27.762 33.211 1.00 31.52 H new ATOM 0 HB2 LEU A 81 -16.328 -25.610 34.893 1.00 23.04 H new ATOM 0 HB3 LEU A 81 -15.868 -27.234 35.365 1.00 23.04 H new ATOM 0 HG LEU A 81 -13.861 -25.077 34.660 1.00 64.35 H new ATOM 0 HD11 LEU A 81 -13.537 -24.811 37.086 1.00 3.34 H new ATOM 0 HD12 LEU A 81 -15.185 -24.362 36.587 1.00 3.34 H new ATOM 0 HD13 LEU A 81 -14.892 -25.926 37.385 1.00 3.34 H new ATOM 0 HD21 LEU A 81 -12.290 -26.550 35.857 1.00 53.42 H new ATOM 0 HD22 LEU A 81 -13.596 -27.733 36.108 1.00 53.42 H new ATOM 0 HD23 LEU A 81 -13.029 -27.370 34.460 1.00 53.42 H new ATOM 1290 N SER A 82 -17.181 -26.421 31.558 1.00 54.04 N ATOM 1291 CA SER A 82 -18.499 -26.483 30.938 1.00 32.02 C ATOM 1292 C SER A 82 -19.561 -25.888 31.858 1.00 4.42 C ATOM 1293 O SER A 82 -20.686 -26.383 31.929 1.00 2.21 O ATOM 1294 CB SER A 82 -18.858 -27.930 30.596 1.00 44.20 C ATOM 1295 OG SER A 82 -17.869 -28.518 29.769 1.00 41.30 O ATOM 0 H SER A 82 -16.468 -25.965 30.989 1.00 54.04 H new ATOM 0 HA SER A 82 -18.469 -25.897 30.020 1.00 32.02 H new ATOM 0 HB2 SER A 82 -18.961 -28.509 31.514 1.00 44.20 H new ATOM 0 HB3 SER A 82 -19.823 -27.959 30.091 1.00 44.20 H new ATOM 0 HG SER A 82 -18.120 -29.443 29.566 1.00 41.30 H new ATOM 1301 N LEU A 83 -19.195 -24.822 32.562 1.00 31.43 N ATOM 1302 CA LEU A 83 -20.115 -24.157 33.479 1.00 52.32 C ATOM 1303 C LEU A 83 -21.072 -23.243 32.722 1.00 70.21 C ATOM 1304 O LEU A 83 -20.840 -22.038 32.610 1.00 41.32 O ATOM 1305 CB LEU A 83 -19.335 -23.351 34.519 1.00 52.31 C ATOM 1306 CG LEU A 83 -19.211 -23.984 35.905 1.00 14.21 C ATOM 1307 CD1 LEU A 83 -20.539 -23.919 36.643 1.00 64.01 C ATOM 1308 CD2 LEU A 83 -18.733 -25.424 35.792 1.00 23.20 C ATOM 0 H LEU A 83 -18.268 -24.400 32.515 1.00 31.43 H new ATOM 0 HA LEU A 83 -20.701 -24.923 33.987 1.00 52.32 H new ATOM 0 HB2 LEU A 83 -18.332 -23.172 34.132 1.00 52.31 H new ATOM 0 HB3 LEU A 83 -19.813 -22.377 34.628 1.00 52.31 H new ATOM 0 HG LEU A 83 -18.473 -23.420 36.476 1.00 14.21 H new ATOM 0 HD11 LEU A 83 -20.431 -24.374 37.627 1.00 64.01 H new ATOM 0 HD12 LEU A 83 -20.842 -22.878 36.756 1.00 64.01 H new ATOM 0 HD13 LEU A 83 -21.298 -24.458 36.075 1.00 64.01 H new ATOM 0 HD21 LEU A 83 -18.650 -25.859 36.788 1.00 23.20 H new ATOM 0 HD22 LEU A 83 -19.447 -25.999 35.203 1.00 23.20 H new ATOM 0 HD23 LEU A 83 -17.759 -25.447 35.304 1.00 23.20 H new ATOM 1320 N THR A 84 -22.150 -23.822 32.203 1.00 32.40 N ATOM 1321 CA THR A 84 -23.144 -23.060 31.458 1.00 2.43 C ATOM 1322 C THR A 84 -23.510 -21.772 32.188 1.00 35.23 C ATOM 1323 O THR A 84 -23.334 -21.665 33.402 1.00 63.52 O ATOM 1324 CB THR A 84 -24.424 -23.884 31.221 1.00 53.14 C ATOM 1325 OG1 THR A 84 -25.528 -23.011 30.960 1.00 11.15 O ATOM 1326 CG2 THR A 84 -24.735 -24.758 32.427 1.00 31.43 C ATOM 0 H THR A 84 -22.357 -24.817 32.285 1.00 32.40 H new ATOM 0 HA THR A 84 -22.696 -22.814 30.495 1.00 2.43 H new ATOM 0 HB THR A 84 -24.260 -24.529 30.357 1.00 53.14 H new ATOM 0 HG1 THR A 84 -26.337 -23.543 30.809 1.00 11.15 H new ATOM 0 HG21 THR A 84 -25.643 -25.331 32.237 1.00 31.43 H new ATOM 0 HG22 THR A 84 -23.905 -25.442 32.604 1.00 31.43 H new ATOM 0 HG23 THR A 84 -24.880 -24.128 33.305 1.00 31.43 H new ATOM 1334 N GLN A 85 -24.022 -20.800 31.442 1.00 61.05 N ATOM 1335 CA GLN A 85 -24.413 -19.519 32.020 1.00 30.02 C ATOM 1336 C GLN A 85 -25.424 -19.716 33.145 1.00 51.25 C ATOM 1337 O GLN A 85 -25.565 -18.865 34.023 1.00 62.23 O ATOM 1338 CB GLN A 85 -25.004 -18.608 30.942 1.00 33.01 C ATOM 1339 CG GLN A 85 -26.247 -19.177 30.277 1.00 22.32 C ATOM 1340 CD GLN A 85 -26.253 -18.968 28.776 1.00 75.24 C ATOM 1341 OE1 GLN A 85 -25.217 -19.068 28.118 1.00 65.33 O ATOM 1342 NE2 GLN A 85 -27.425 -18.677 28.224 1.00 1.01 N ATOM 0 H GLN A 85 -24.176 -20.874 30.436 1.00 61.05 H new ATOM 0 HA GLN A 85 -23.521 -19.049 32.435 1.00 30.02 H new ATOM 0 HB2 GLN A 85 -25.250 -17.644 31.388 1.00 33.01 H new ATOM 0 HB3 GLN A 85 -24.247 -18.423 30.180 1.00 33.01 H new ATOM 0 HG2 GLN A 85 -26.313 -20.244 30.492 1.00 22.32 H new ATOM 0 HG3 GLN A 85 -27.132 -18.709 30.709 1.00 22.32 H new ATOM 0 HE21 GLN A 85 -28.259 -18.604 28.807 1.00 1.01 H new ATOM 0 HE22 GLN A 85 -27.491 -18.527 27.217 1.00 1.01 H new ATOM 1351 N LYS A 86 -26.126 -20.844 33.112 1.00 3.22 N ATOM 1352 CA LYS A 86 -27.123 -21.153 34.129 1.00 43.32 C ATOM 1353 C LYS A 86 -26.461 -21.681 35.398 1.00 33.35 C ATOM 1354 O LYS A 86 -26.760 -21.224 36.500 1.00 2.31 O ATOM 1355 CB LYS A 86 -28.122 -22.184 33.596 1.00 42.53 C ATOM 1356 CG LYS A 86 -29.433 -21.575 33.130 1.00 22.51 C ATOM 1357 CD LYS A 86 -29.389 -21.220 31.653 1.00 0.30 C ATOM 1358 CE LYS A 86 -29.892 -22.365 30.788 1.00 73.01 C ATOM 1359 NZ LYS A 86 -31.016 -21.943 29.907 1.00 61.34 N ATOM 0 H LYS A 86 -26.022 -21.559 32.392 1.00 3.22 H new ATOM 0 HA LYS A 86 -27.654 -20.233 34.373 1.00 43.32 H new ATOM 0 HB2 LYS A 86 -27.666 -22.724 32.766 1.00 42.53 H new ATOM 0 HB3 LYS A 86 -28.328 -22.916 34.377 1.00 42.53 H new ATOM 0 HG2 LYS A 86 -30.247 -22.277 33.312 1.00 22.51 H new ATOM 0 HG3 LYS A 86 -29.647 -20.680 33.714 1.00 22.51 H new ATOM 0 HD2 LYS A 86 -29.996 -20.333 31.473 1.00 0.30 H new ATOM 0 HD3 LYS A 86 -28.367 -20.970 31.368 1.00 0.30 H new ATOM 0 HE2 LYS A 86 -29.074 -22.744 30.176 1.00 73.01 H new ATOM 0 HE3 LYS A 86 -30.219 -23.186 31.426 1.00 73.01 H new ATOM 0 HZ1 LYS A 86 -31.330 -22.752 29.334 1.00 61.34 H new ATOM 0 HZ2 LYS A 86 -31.807 -21.605 30.491 1.00 61.34 H new ATOM 0 HZ3 LYS A 86 -30.697 -21.177 29.280 1.00 61.34 H new ATOM 1373 N GLU A 87 -25.559 -22.644 35.233 1.00 25.13 N ATOM 1374 CA GLU A 87 -24.855 -23.232 36.366 1.00 64.10 C ATOM 1375 C GLU A 87 -24.028 -22.179 37.099 1.00 61.34 C ATOM 1376 O GLU A 87 -24.186 -21.981 38.304 1.00 51.34 O ATOM 1377 CB GLU A 87 -23.947 -24.371 35.896 1.00 24.35 C ATOM 1378 CG GLU A 87 -23.479 -25.280 37.020 1.00 52.04 C ATOM 1379 CD GLU A 87 -22.783 -26.527 36.510 1.00 42.14 C ATOM 1380 OE1 GLU A 87 -22.232 -26.484 35.389 1.00 24.32 O ATOM 1381 OE2 GLU A 87 -22.787 -27.545 37.231 1.00 1.31 O ATOM 0 H GLU A 87 -25.299 -23.033 34.327 1.00 25.13 H new ATOM 0 HA GLU A 87 -25.599 -23.630 37.056 1.00 64.10 H new ATOM 0 HB2 GLU A 87 -24.480 -24.968 35.156 1.00 24.35 H new ATOM 0 HB3 GLU A 87 -23.076 -23.947 35.396 1.00 24.35 H new ATOM 0 HG2 GLU A 87 -22.799 -24.728 37.669 1.00 52.04 H new ATOM 0 HG3 GLU A 87 -24.336 -25.570 37.629 1.00 52.04 H new ATOM 1388 N ALA A 88 -23.150 -21.508 36.364 1.00 41.24 N ATOM 1389 CA ALA A 88 -22.300 -20.474 36.942 1.00 23.05 C ATOM 1390 C ALA A 88 -23.119 -19.491 37.772 1.00 73.15 C ATOM 1391 O ALA A 88 -22.636 -18.951 38.767 1.00 64.23 O ATOM 1392 CB ALA A 88 -21.542 -19.739 35.847 1.00 51.41 C ATOM 0 H ALA A 88 -23.008 -21.661 35.366 1.00 41.24 H new ATOM 0 HA ALA A 88 -21.581 -20.958 37.603 1.00 23.05 H new ATOM 0 HB1 ALA A 88 -20.912 -18.970 36.294 1.00 51.41 H new ATOM 0 HB2 ALA A 88 -20.919 -20.446 35.299 1.00 51.41 H new ATOM 0 HB3 ALA A 88 -22.252 -19.274 35.163 1.00 51.41 H new ATOM 1398 N SER A 89 -24.361 -19.264 37.356 1.00 61.34 N ATOM 1399 CA SER A 89 -25.246 -18.342 38.058 1.00 5.31 C ATOM 1400 C SER A 89 -25.869 -19.011 39.280 1.00 62.40 C ATOM 1401 O SER A 89 -26.086 -18.371 40.308 1.00 62.31 O ATOM 1402 CB SER A 89 -26.346 -17.842 37.120 1.00 53.23 C ATOM 1403 OG SER A 89 -27.454 -18.726 37.116 1.00 43.53 O ATOM 0 H SER A 89 -24.777 -19.706 36.536 1.00 61.34 H new ATOM 0 HA SER A 89 -24.652 -17.492 38.394 1.00 5.31 H new ATOM 0 HB2 SER A 89 -26.670 -16.849 37.431 1.00 53.23 H new ATOM 0 HB3 SER A 89 -25.950 -17.746 36.109 1.00 53.23 H new ATOM 0 HG SER A 89 -27.181 -19.592 36.747 1.00 43.53 H new ATOM 1409 N GLU A 90 -26.154 -20.304 39.157 1.00 22.40 N ATOM 1410 CA GLU A 90 -26.753 -21.062 40.251 1.00 40.30 C ATOM 1411 C GLU A 90 -25.732 -21.321 41.355 1.00 23.32 C ATOM 1412 O GLU A 90 -26.096 -21.542 42.510 1.00 30.31 O ATOM 1413 CB GLU A 90 -27.312 -22.389 39.735 1.00 43.23 C ATOM 1414 CG GLU A 90 -28.734 -22.287 39.210 1.00 62.12 C ATOM 1415 CD GLU A 90 -29.143 -23.496 38.392 1.00 63.23 C ATOM 1416 OE1 GLU A 90 -29.441 -24.548 38.997 1.00 35.12 O ATOM 1417 OE2 GLU A 90 -29.164 -23.393 37.148 1.00 54.43 O ATOM 0 H GLU A 90 -25.980 -20.848 38.312 1.00 22.40 H new ATOM 0 HA GLU A 90 -27.569 -20.470 40.666 1.00 40.30 H new ATOM 0 HB2 GLU A 90 -26.666 -22.761 38.940 1.00 43.23 H new ATOM 0 HB3 GLU A 90 -27.283 -23.124 40.540 1.00 43.23 H new ATOM 0 HG2 GLU A 90 -29.420 -22.172 40.050 1.00 62.12 H new ATOM 0 HG3 GLU A 90 -28.827 -21.390 38.597 1.00 62.12 H new ATOM 1424 N ILE A 91 -24.455 -21.294 40.991 1.00 41.24 N ATOM 1425 CA ILE A 91 -23.382 -21.527 41.950 1.00 12.34 C ATOM 1426 C ILE A 91 -22.677 -20.224 42.312 1.00 1.25 C ATOM 1427 O ILE A 91 -22.700 -19.794 43.467 1.00 44.51 O ATOM 1428 CB ILE A 91 -22.344 -22.524 41.404 1.00 14.23 C ATOM 1429 CG1 ILE A 91 -23.046 -23.725 40.764 1.00 35.20 C ATOM 1430 CG2 ILE A 91 -21.410 -22.979 42.515 1.00 61.13 C ATOM 1431 CD1 ILE A 91 -23.923 -24.494 41.727 1.00 42.41 C ATOM 0 H ILE A 91 -24.138 -21.113 40.039 1.00 41.24 H new ATOM 0 HA ILE A 91 -23.843 -21.949 42.843 1.00 12.34 H new ATOM 0 HB ILE A 91 -21.749 -22.024 40.639 1.00 14.23 H new ATOM 0 HG12 ILE A 91 -23.654 -23.378 39.929 1.00 35.20 H new ATOM 0 HG13 ILE A 91 -22.294 -24.398 40.352 1.00 35.20 H new ATOM 0 HG21 ILE A 91 -20.682 -23.684 42.113 1.00 61.13 H new ATOM 0 HG22 ILE A 91 -20.889 -22.116 42.929 1.00 61.13 H new ATOM 0 HG23 ILE A 91 -21.989 -23.464 43.301 1.00 61.13 H new ATOM 0 HD11 ILE A 91 -24.389 -25.331 41.206 1.00 42.41 H new ATOM 0 HD12 ILE A 91 -23.316 -24.871 42.550 1.00 42.41 H new ATOM 0 HD13 ILE A 91 -24.697 -23.835 42.120 1.00 42.41 H new ATOM 1443 N PHE A 92 -22.053 -19.599 41.320 1.00 75.43 N ATOM 1444 CA PHE A 92 -21.342 -18.344 41.533 1.00 13.24 C ATOM 1445 C PHE A 92 -22.321 -17.184 41.696 1.00 1.41 C ATOM 1446 O PHE A 92 -22.396 -16.565 42.757 1.00 52.15 O ATOM 1447 CB PHE A 92 -20.394 -18.065 40.365 1.00 40.32 C ATOM 1448 CG PHE A 92 -19.676 -19.288 39.871 1.00 0.11 C ATOM 1449 CD1 PHE A 92 -19.074 -20.161 40.762 1.00 53.13 C ATOM 1450 CD2 PHE A 92 -19.603 -19.564 38.515 1.00 60.21 C ATOM 1451 CE1 PHE A 92 -18.412 -21.288 40.309 1.00 52.55 C ATOM 1452 CE2 PHE A 92 -18.943 -20.689 38.057 1.00 52.21 C ATOM 1453 CZ PHE A 92 -18.347 -21.552 38.955 1.00 74.52 C ATOM 0 H PHE A 92 -22.025 -19.941 40.360 1.00 75.43 H new ATOM 0 HA PHE A 92 -20.760 -18.437 42.450 1.00 13.24 H new ATOM 0 HB2 PHE A 92 -20.962 -17.630 39.543 1.00 40.32 H new ATOM 0 HB3 PHE A 92 -19.659 -17.322 40.674 1.00 40.32 H new ATOM 0 HD1 PHE A 92 -19.122 -19.960 41.822 1.00 53.13 H new ATOM 0 HD2 PHE A 92 -20.067 -18.892 37.808 1.00 60.21 H new ATOM 0 HE1 PHE A 92 -17.946 -21.961 41.014 1.00 52.55 H new ATOM 0 HE2 PHE A 92 -18.894 -20.893 36.998 1.00 52.21 H new ATOM 0 HZ PHE A 92 -17.831 -22.432 38.599 1.00 74.52 H new ATOM 1463 N GLY A 93 -23.071 -16.897 40.636 1.00 40.11 N ATOM 1464 CA GLY A 93 -24.035 -15.814 40.682 1.00 2.52 C ATOM 1465 C GLY A 93 -23.709 -14.706 39.699 1.00 34.55 C ATOM 1466 O GLY A 93 -23.721 -13.528 40.053 1.00 44.31 O ATOM 0 H GLY A 93 -23.028 -17.395 39.747 1.00 40.11 H new ATOM 0 HA2 GLY A 93 -25.029 -16.207 40.466 1.00 2.52 H new ATOM 0 HA3 GLY A 93 -24.067 -15.403 41.691 1.00 2.52 H new ATOM 1470 N GLY A 94 -23.415 -15.085 38.459 1.00 14.50 N ATOM 1471 CA GLY A 94 -23.086 -14.104 37.441 1.00 23.21 C ATOM 1472 C GLY A 94 -24.271 -13.233 37.072 1.00 41.52 C ATOM 1473 O GLY A 94 -24.113 -12.047 36.785 1.00 13.33 O ATOM 0 H GLY A 94 -23.399 -16.054 38.141 1.00 14.50 H new ATOM 0 HA2 GLY A 94 -22.272 -13.473 37.798 1.00 23.21 H new ATOM 0 HA3 GLY A 94 -22.724 -14.617 36.550 1.00 23.21 H new ATOM 1477 N GLY A 95 -25.462 -13.823 37.077 1.00 4.14 N ATOM 1478 CA GLY A 95 -26.660 -13.079 36.736 1.00 22.33 C ATOM 1479 C GLY A 95 -27.224 -13.473 35.385 1.00 33.32 C ATOM 1480 O GLY A 95 -27.591 -14.628 35.170 1.00 71.53 O ATOM 0 H GLY A 95 -25.619 -14.803 37.311 1.00 4.14 H new ATOM 0 HA2 GLY A 95 -27.416 -13.243 37.504 1.00 22.33 H new ATOM 0 HA3 GLY A 95 -26.433 -12.013 36.734 1.00 22.33 H new ATOM 1484 N VAL A 96 -27.294 -12.510 34.471 1.00 51.33 N ATOM 1485 CA VAL A 96 -27.818 -12.763 33.134 1.00 62.22 C ATOM 1486 C VAL A 96 -26.772 -12.454 32.068 1.00 15.23 C ATOM 1487 O VAL A 96 -26.359 -13.335 31.315 1.00 21.34 O ATOM 1488 CB VAL A 96 -29.079 -11.924 32.858 1.00 30.51 C ATOM 1489 CG1 VAL A 96 -29.043 -10.627 33.651 1.00 41.11 C ATOM 1490 CG2 VAL A 96 -29.217 -11.644 31.369 1.00 34.34 C ATOM 0 H VAL A 96 -26.995 -11.548 34.632 1.00 51.33 H new ATOM 0 HA VAL A 96 -28.078 -13.821 33.090 1.00 62.22 H new ATOM 0 HB VAL A 96 -29.950 -12.494 33.180 1.00 30.51 H new ATOM 0 HG11 VAL A 96 -29.943 -10.048 33.442 1.00 41.11 H new ATOM 0 HG12 VAL A 96 -28.996 -10.853 34.716 1.00 41.11 H new ATOM 0 HG13 VAL A 96 -28.165 -10.049 33.363 1.00 41.11 H new ATOM 0 HG21 VAL A 96 -30.114 -11.050 31.192 1.00 34.34 H new ATOM 0 HG22 VAL A 96 -28.343 -11.095 31.020 1.00 34.34 H new ATOM 0 HG23 VAL A 96 -29.294 -12.587 30.827 1.00 34.34 H new ATOM 1500 N ASN A 97 -26.346 -11.196 32.011 1.00 32.04 N ATOM 1501 CA ASN A 97 -25.348 -10.771 31.036 1.00 71.14 C ATOM 1502 C ASN A 97 -23.937 -11.010 31.562 1.00 32.40 C ATOM 1503 O ASN A 97 -23.061 -10.156 31.432 1.00 63.43 O ATOM 1504 CB ASN A 97 -25.533 -9.289 30.699 1.00 13.34 C ATOM 1505 CG ASN A 97 -25.698 -8.431 31.939 1.00 5.25 C ATOM 1506 OD1 ASN A 97 -26.811 -8.045 32.297 1.00 22.32 O ATOM 1507 ND2 ASN A 97 -24.587 -8.127 32.600 1.00 33.43 N ATOM 0 H ASN A 97 -26.676 -10.454 32.628 1.00 32.04 H new ATOM 0 HA ASN A 97 -25.485 -11.364 30.132 1.00 71.14 H new ATOM 0 HB2 ASN A 97 -24.672 -8.938 30.130 1.00 13.34 H new ATOM 0 HB3 ASN A 97 -26.408 -9.171 30.060 1.00 13.34 H new ATOM 0 HD21 ASN A 97 -24.635 -7.552 33.441 1.00 33.43 H new ATOM 0 HD22 ASN A 97 -23.686 -8.469 32.267 1.00 33.43 H new ATOM 1514 N ALA A 98 -23.724 -12.180 32.158 1.00 41.14 N ATOM 1515 CA ALA A 98 -22.419 -12.535 32.701 1.00 55.14 C ATOM 1516 C ALA A 98 -21.354 -12.542 31.611 1.00 44.22 C ATOM 1517 O ALA A 98 -20.542 -11.622 31.514 1.00 5.54 O ATOM 1518 CB ALA A 98 -22.484 -13.891 33.388 1.00 14.50 C ATOM 0 H ALA A 98 -24.439 -12.897 32.277 1.00 41.14 H new ATOM 0 HA ALA A 98 -22.142 -11.780 33.437 1.00 55.14 H new ATOM 0 HB1 ALA A 98 -21.502 -14.143 33.789 1.00 14.50 H new ATOM 0 HB2 ALA A 98 -23.209 -13.853 34.201 1.00 14.50 H new ATOM 0 HB3 ALA A 98 -22.787 -14.650 32.667 1.00 14.50 H new ATOM 1524 N PHE A 99 -21.362 -13.587 30.789 1.00 71.43 N ATOM 1525 CA PHE A 99 -20.394 -13.716 29.706 1.00 73.42 C ATOM 1526 C PHE A 99 -20.182 -12.377 29.005 1.00 75.24 C ATOM 1527 O PHE A 99 -19.060 -12.024 28.643 1.00 52.03 O ATOM 1528 CB PHE A 99 -20.864 -14.765 28.695 1.00 54.41 C ATOM 1529 CG PHE A 99 -20.676 -16.178 29.168 1.00 15.32 C ATOM 1530 CD1 PHE A 99 -21.642 -16.797 29.946 1.00 23.44 C ATOM 1531 CD2 PHE A 99 -19.534 -16.889 28.834 1.00 41.11 C ATOM 1532 CE1 PHE A 99 -21.471 -18.098 30.382 1.00 55.24 C ATOM 1533 CE2 PHE A 99 -19.358 -18.189 29.267 1.00 51.12 C ATOM 1534 CZ PHE A 99 -20.328 -18.794 30.041 1.00 25.04 C ATOM 0 H PHE A 99 -22.028 -14.357 30.853 1.00 71.43 H new ATOM 0 HA PHE A 99 -19.445 -14.036 30.136 1.00 73.42 H new ATOM 0 HB2 PHE A 99 -21.919 -14.601 28.476 1.00 54.41 H new ATOM 0 HB3 PHE A 99 -20.320 -14.627 27.761 1.00 54.41 H new ATOM 0 HD1 PHE A 99 -22.538 -16.257 30.215 1.00 23.44 H new ATOM 0 HD2 PHE A 99 -18.772 -16.421 28.228 1.00 41.11 H new ATOM 0 HE1 PHE A 99 -22.230 -18.569 30.988 1.00 55.24 H new ATOM 0 HE2 PHE A 99 -18.463 -18.731 29.000 1.00 51.12 H new ATOM 0 HZ PHE A 99 -20.193 -19.811 30.380 1.00 25.04 H new ATOM 1544 N SER A 100 -21.270 -11.636 28.817 1.00 74.31 N ATOM 1545 CA SER A 100 -21.204 -10.338 28.154 1.00 73.34 C ATOM 1546 C SER A 100 -20.290 -9.385 28.917 1.00 3.45 C ATOM 1547 O SER A 100 -19.156 -9.135 28.508 1.00 42.00 O ATOM 1548 CB SER A 100 -22.605 -9.733 28.034 1.00 2.41 C ATOM 1549 OG SER A 100 -23.200 -10.068 26.793 1.00 15.54 O ATOM 0 H SER A 100 -22.206 -11.912 29.114 1.00 74.31 H new ATOM 0 HA SER A 100 -20.793 -10.487 27.156 1.00 73.34 H new ATOM 0 HB2 SER A 100 -23.231 -10.093 28.850 1.00 2.41 H new ATOM 0 HB3 SER A 100 -22.546 -8.649 28.132 1.00 2.41 H new ATOM 0 HG SER A 100 -24.095 -9.671 26.741 1.00 15.54 H new ATOM 1555 N ARG A 101 -20.791 -8.856 30.028 1.00 60.12 N ATOM 1556 CA ARG A 101 -20.021 -7.929 30.848 1.00 23.13 C ATOM 1557 C ARG A 101 -18.638 -8.495 31.156 1.00 1.31 C ATOM 1558 O ARG A 101 -17.633 -7.791 31.064 1.00 51.31 O ATOM 1559 CB ARG A 101 -20.764 -7.631 32.152 1.00 1.31 C ATOM 1560 CG ARG A 101 -21.709 -6.445 32.056 1.00 1.01 C ATOM 1561 CD ARG A 101 -22.112 -5.941 33.434 1.00 52.04 C ATOM 1562 NE ARG A 101 -22.509 -4.536 33.408 1.00 64.23 N ATOM 1563 CZ ARG A 101 -22.853 -3.849 34.493 1.00 11.31 C ATOM 1564 NH1 ARG A 101 -22.848 -4.435 35.682 1.00 33.52 N ATOM 1565 NH2 ARG A 101 -23.202 -2.574 34.388 1.00 23.10 N ATOM 0 H ARG A 101 -21.727 -9.054 30.381 1.00 60.12 H new ATOM 0 HA ARG A 101 -19.898 -7.002 30.287 1.00 23.13 H new ATOM 0 HB2 ARG A 101 -21.331 -8.514 32.447 1.00 1.31 H new ATOM 0 HB3 ARG A 101 -20.036 -7.442 32.940 1.00 1.31 H new ATOM 0 HG2 ARG A 101 -21.229 -5.640 31.499 1.00 1.01 H new ATOM 0 HG3 ARG A 101 -22.600 -6.732 31.497 1.00 1.01 H new ATOM 0 HD2 ARG A 101 -22.937 -6.544 33.814 1.00 52.04 H new ATOM 0 HD3 ARG A 101 -21.279 -6.070 34.125 1.00 52.04 H new ATOM 0 HE ARG A 101 -22.523 -4.055 32.508 1.00 64.23 H new ATOM 0 HH11 ARG A 101 -22.580 -5.415 35.766 1.00 33.52 H new ATOM 0 HH12 ARG A 101 -23.112 -3.905 36.513 1.00 33.52 H new ATOM 0 HH21 ARG A 101 -23.207 -2.120 33.475 1.00 23.10 H new ATOM 0 HH22 ARG A 101 -23.466 -2.047 35.221 1.00 23.10 H new ATOM 1579 N TYR A 102 -18.595 -9.772 31.522 1.00 4.12 N ATOM 1580 CA TYR A 102 -17.337 -10.432 31.846 1.00 31.30 C ATOM 1581 C TYR A 102 -16.348 -10.319 30.689 1.00 62.30 C ATOM 1582 O TYR A 102 -15.146 -10.158 30.899 1.00 22.44 O ATOM 1583 CB TYR A 102 -17.580 -11.904 32.181 1.00 62.25 C ATOM 1584 CG TYR A 102 -18.018 -12.135 33.610 1.00 64.35 C ATOM 1585 CD1 TYR A 102 -17.346 -11.537 34.669 1.00 41.42 C ATOM 1586 CD2 TYR A 102 -19.105 -12.952 33.902 1.00 14.34 C ATOM 1587 CE1 TYR A 102 -17.742 -11.746 35.976 1.00 62.14 C ATOM 1588 CE2 TYR A 102 -19.509 -13.165 35.205 1.00 2.53 C ATOM 1589 CZ TYR A 102 -18.824 -12.561 36.239 1.00 23.41 C ATOM 1590 OH TYR A 102 -19.223 -12.770 37.538 1.00 42.42 O ATOM 0 H TYR A 102 -19.418 -10.370 31.601 1.00 4.12 H new ATOM 0 HA TYR A 102 -16.909 -9.934 32.716 1.00 31.30 H new ATOM 0 HB2 TYR A 102 -18.340 -12.300 31.508 1.00 62.25 H new ATOM 0 HB3 TYR A 102 -16.665 -12.466 31.995 1.00 62.25 H new ATOM 0 HD1 TYR A 102 -16.499 -10.898 34.467 1.00 41.42 H new ATOM 0 HD2 TYR A 102 -19.643 -13.428 33.095 1.00 14.34 H new ATOM 0 HE1 TYR A 102 -17.208 -11.274 36.787 1.00 62.14 H new ATOM 0 HE2 TYR A 102 -20.357 -13.801 35.414 1.00 2.53 H new ATOM 0 HH TYR A 102 -20.000 -13.367 37.550 1.00 42.42 H new ATOM 1600 N GLU A 103 -16.865 -10.405 29.467 1.00 64.35 N ATOM 1601 CA GLU A 103 -16.029 -10.313 28.276 1.00 34.24 C ATOM 1602 C GLU A 103 -15.150 -9.067 28.324 1.00 60.24 C ATOM 1603 O GLU A 103 -14.053 -9.044 27.764 1.00 74.53 O ATOM 1604 CB GLU A 103 -16.898 -10.291 27.017 1.00 11.23 C ATOM 1605 CG GLU A 103 -16.114 -10.521 25.735 1.00 52.02 C ATOM 1606 CD GLU A 103 -16.983 -11.049 24.608 1.00 31.41 C ATOM 1607 OE1 GLU A 103 -18.106 -10.531 24.431 1.00 54.24 O ATOM 1608 OE2 GLU A 103 -16.538 -11.980 23.905 1.00 22.20 O ATOM 0 H GLU A 103 -17.858 -10.538 29.276 1.00 64.35 H new ATOM 0 HA GLU A 103 -15.383 -11.191 28.247 1.00 34.24 H new ATOM 0 HB2 GLU A 103 -17.669 -11.056 27.104 1.00 11.23 H new ATOM 0 HB3 GLU A 103 -17.408 -9.330 26.954 1.00 11.23 H new ATOM 0 HG2 GLU A 103 -15.650 -9.585 25.424 1.00 52.02 H new ATOM 0 HG3 GLU A 103 -15.307 -11.228 25.928 1.00 52.02 H new ATOM 1615 N LYS A 104 -15.640 -8.030 28.995 1.00 21.35 N ATOM 1616 CA LYS A 104 -14.901 -6.779 29.118 1.00 2.40 C ATOM 1617 C LYS A 104 -14.351 -6.608 30.530 1.00 31.43 C ATOM 1618 O LYS A 104 -13.390 -5.871 30.747 1.00 30.45 O ATOM 1619 CB LYS A 104 -15.803 -5.594 28.763 1.00 24.52 C ATOM 1620 CG LYS A 104 -15.861 -5.298 27.275 1.00 61.22 C ATOM 1621 CD LYS A 104 -16.937 -6.120 26.586 1.00 54.50 C ATOM 1622 CE LYS A 104 -18.328 -5.583 26.887 1.00 53.52 C ATOM 1623 NZ LYS A 104 -19.320 -6.680 27.062 1.00 14.44 N ATOM 0 H LYS A 104 -16.547 -8.031 29.462 1.00 21.35 H new ATOM 0 HA LYS A 104 -14.062 -6.811 28.423 1.00 2.40 H new ATOM 0 HB2 LYS A 104 -16.812 -5.795 29.124 1.00 24.52 H new ATOM 0 HB3 LYS A 104 -15.447 -4.707 29.288 1.00 24.52 H new ATOM 0 HG2 LYS A 104 -16.058 -4.237 27.121 1.00 61.22 H new ATOM 0 HG3 LYS A 104 -14.893 -5.511 26.822 1.00 61.22 H new ATOM 0 HD2 LYS A 104 -16.768 -6.112 25.509 1.00 54.50 H new ATOM 0 HD3 LYS A 104 -16.868 -7.158 26.912 1.00 54.50 H new ATOM 0 HE2 LYS A 104 -18.295 -4.976 27.791 1.00 53.52 H new ATOM 0 HE3 LYS A 104 -18.648 -4.930 26.076 1.00 53.52 H new ATOM 0 HZ1 LYS A 104 -20.186 -6.299 27.493 1.00 14.44 H new ATOM 0 HZ2 LYS A 104 -19.547 -7.094 26.135 1.00 14.44 H new ATOM 0 HZ3 LYS A 104 -18.920 -7.414 27.680 1.00 14.44 H new ATOM 1637 N GLY A 105 -14.966 -7.297 31.487 1.00 13.35 N ATOM 1638 CA GLY A 105 -14.521 -7.208 32.866 1.00 73.05 C ATOM 1639 C GLY A 105 -15.339 -6.222 33.676 1.00 34.25 C ATOM 1640 O GLY A 105 -14.850 -5.652 34.650 1.00 51.12 O ATOM 0 H GLY A 105 -15.763 -7.914 31.332 1.00 13.35 H new ATOM 0 HA2 GLY A 105 -14.582 -8.193 33.329 1.00 73.05 H new ATOM 0 HA3 GLY A 105 -13.473 -6.910 32.888 1.00 73.05 H new ATOM 1644 N ASN A 106 -16.589 -6.018 33.272 1.00 71.23 N ATOM 1645 CA ASN A 106 -17.475 -5.091 33.966 1.00 4.22 C ATOM 1646 C ASN A 106 -18.397 -5.837 34.926 1.00 23.54 C ATOM 1647 O ASN A 106 -19.137 -5.224 35.694 1.00 31.50 O ATOM 1648 CB ASN A 106 -18.306 -4.296 32.957 1.00 32.01 C ATOM 1649 CG ASN A 106 -17.448 -3.623 31.903 1.00 32.34 C ATOM 1650 OD1 ASN A 106 -16.547 -2.846 32.223 1.00 21.40 O ATOM 1651 ND2 ASN A 106 -17.723 -3.919 30.638 1.00 70.21 N ATOM 0 H ASN A 106 -17.011 -6.482 32.468 1.00 71.23 H new ATOM 0 HA ASN A 106 -16.860 -4.401 34.543 1.00 4.22 H new ATOM 0 HB2 ASN A 106 -19.017 -4.963 32.470 1.00 32.01 H new ATOM 0 HB3 ASN A 106 -18.888 -3.540 33.485 1.00 32.01 H new ATOM 0 HD21 ASN A 106 -17.179 -3.497 29.886 1.00 70.21 H new ATOM 0 HD22 ASN A 106 -18.479 -4.568 30.419 1.00 70.21 H new ATOM 1658 N ALA A 107 -18.347 -7.164 34.875 1.00 21.40 N ATOM 1659 CA ALA A 107 -19.175 -7.994 35.741 1.00 22.02 C ATOM 1660 C ALA A 107 -18.328 -8.716 36.784 1.00 1.32 C ATOM 1661 O ALA A 107 -18.813 -9.609 37.479 1.00 14.15 O ATOM 1662 CB ALA A 107 -19.966 -8.997 34.914 1.00 13.52 C ATOM 0 H ALA A 107 -17.741 -7.687 34.243 1.00 21.40 H new ATOM 0 HA ALA A 107 -19.873 -7.342 36.266 1.00 22.02 H new ATOM 0 HB1 ALA A 107 -20.580 -9.610 35.574 1.00 13.52 H new ATOM 0 HB2 ALA A 107 -20.608 -8.464 34.213 1.00 13.52 H new ATOM 0 HB3 ALA A 107 -19.278 -9.636 34.362 1.00 13.52 H new ATOM 1668 N GLN A 108 -17.063 -8.324 36.885 1.00 64.41 N ATOM 1669 CA GLN A 108 -16.148 -8.936 37.842 1.00 1.22 C ATOM 1670 C GLN A 108 -15.532 -7.882 38.757 1.00 61.41 C ATOM 1671 O GLN A 108 -14.313 -7.738 38.845 1.00 25.24 O ATOM 1672 CB GLN A 108 -15.045 -9.699 37.109 1.00 23.10 C ATOM 1673 CG GLN A 108 -14.076 -8.799 36.360 1.00 50.00 C ATOM 1674 CD GLN A 108 -12.626 -9.112 36.674 1.00 53.24 C ATOM 1675 OE1 GLN A 108 -12.342 -9.396 37.940 1.00 71.14 O flip ATOM 1676 NE2 GLN A 108 -11.770 -9.098 35.789 1.00 61.50 N flip ATOM 0 H GLN A 108 -16.648 -7.586 36.317 1.00 64.41 H new ATOM 0 HA GLN A 108 -16.718 -9.635 38.455 1.00 1.22 H new ATOM 0 HB2 GLN A 108 -14.488 -10.298 37.830 1.00 23.10 H new ATOM 0 HB3 GLN A 108 -15.502 -10.393 36.404 1.00 23.10 H new ATOM 0 HG2 GLN A 108 -14.243 -8.905 35.288 1.00 50.00 H new ATOM 0 HG3 GLN A 108 -14.282 -7.759 36.613 1.00 50.00 H new ATOM 0 HE21 GLN A 108 -12.033 -8.874 34.829 1.00 61.50 H new ATOM 0 HE22 GLN A 108 -10.798 -9.310 36.016 1.00 61.50 H new ATOM 1685 N PRO A 109 -16.394 -7.129 39.456 1.00 53.11 N ATOM 1686 CA PRO A 109 -15.957 -6.077 40.378 1.00 54.40 C ATOM 1687 C PRO A 109 -15.285 -6.640 41.626 1.00 54.44 C ATOM 1688 O PRO A 109 -15.435 -6.099 42.722 1.00 55.32 O ATOM 1689 CB PRO A 109 -17.262 -5.366 40.749 1.00 64.45 C ATOM 1690 CG PRO A 109 -18.322 -6.393 40.550 1.00 11.42 C ATOM 1691 CD PRO A 109 -17.861 -7.248 39.402 1.00 63.50 C ATOM 0 HA PRO A 109 -15.212 -5.423 39.925 1.00 54.40 H new ATOM 0 HB2 PRO A 109 -17.241 -5.013 41.780 1.00 64.45 H new ATOM 0 HB3 PRO A 109 -17.432 -4.494 40.117 1.00 64.45 H new ATOM 0 HG2 PRO A 109 -18.460 -6.991 41.451 1.00 11.42 H new ATOM 0 HG3 PRO A 109 -19.281 -5.926 40.328 1.00 11.42 H new ATOM 0 HD2 PRO A 109 -18.185 -8.283 39.516 1.00 63.50 H new ATOM 0 HD3 PRO A 109 -18.258 -6.893 38.451 1.00 63.50 H new ATOM 1699 N HIS A 110 -14.543 -7.729 41.452 1.00 71.04 N ATOM 1700 CA HIS A 110 -13.847 -8.364 42.564 1.00 54.14 C ATOM 1701 C HIS A 110 -14.827 -9.107 43.466 1.00 34.13 C ATOM 1702 O HIS A 110 -14.644 -9.200 44.681 1.00 40.12 O ATOM 1703 CB HIS A 110 -13.079 -7.320 43.376 1.00 70.23 C ATOM 1704 CG HIS A 110 -11.674 -7.728 43.700 1.00 70.20 C ATOM 1705 ND1 HIS A 110 -10.627 -6.834 43.766 1.00 15.41 N ATOM 1706 CD2 HIS A 110 -11.148 -8.943 43.981 1.00 41.33 C ATOM 1707 CE1 HIS A 110 -9.516 -7.482 44.070 1.00 31.20 C ATOM 1708 NE2 HIS A 110 -9.805 -8.763 44.206 1.00 74.34 N ATOM 0 H HIS A 110 -14.409 -8.189 40.552 1.00 71.04 H new ATOM 0 HA HIS A 110 -13.141 -9.085 42.153 1.00 54.14 H new ATOM 0 HB2 HIS A 110 -13.057 -6.383 42.820 1.00 70.23 H new ATOM 0 HB3 HIS A 110 -13.616 -7.127 44.305 1.00 70.23 H new ATOM 0 HD2 HIS A 110 -11.684 -9.880 44.021 1.00 41.33 H new ATOM 0 HE1 HIS A 110 -8.538 -7.039 44.187 1.00 31.20 H new ATOM 0 HE2 HIS A 110 -9.139 -9.499 44.440 1.00 74.34 H new ATOM 1716 N PRO A 111 -15.896 -9.647 42.862 1.00 24.44 N ATOM 1717 CA PRO A 111 -16.927 -10.391 43.592 1.00 31.41 C ATOM 1718 C PRO A 111 -16.418 -11.733 44.108 1.00 32.23 C ATOM 1719 O PRO A 111 -15.212 -11.970 44.164 1.00 74.13 O ATOM 1720 CB PRO A 111 -18.022 -10.602 42.543 1.00 15.14 C ATOM 1721 CG PRO A 111 -17.309 -10.550 41.236 1.00 62.43 C ATOM 1722 CD PRO A 111 -16.179 -9.574 41.418 1.00 35.24 C ATOM 0 HA PRO A 111 -17.265 -9.855 44.479 1.00 31.41 H new ATOM 0 HB2 PRO A 111 -18.524 -11.559 42.682 1.00 15.14 H new ATOM 0 HB3 PRO A 111 -18.787 -9.828 42.608 1.00 15.14 H new ATOM 0 HG2 PRO A 111 -16.933 -11.534 40.957 1.00 62.43 H new ATOM 0 HG3 PRO A 111 -17.979 -10.227 40.439 1.00 62.43 H new ATOM 0 HD2 PRO A 111 -15.309 -9.851 40.823 1.00 35.24 H new ATOM 0 HD3 PRO A 111 -16.465 -8.567 41.115 1.00 35.24 H new ATOM 1730 N SER A 112 -17.346 -12.606 44.484 1.00 21.23 N ATOM 1731 CA SER A 112 -16.991 -13.924 45.000 1.00 21.52 C ATOM 1732 C SER A 112 -16.809 -14.922 43.861 1.00 63.14 C ATOM 1733 O SER A 112 -16.012 -15.856 43.958 1.00 35.41 O ATOM 1734 CB SER A 112 -18.068 -14.425 45.965 1.00 12.20 C ATOM 1735 OG SER A 112 -17.488 -15.062 47.090 1.00 31.44 O ATOM 0 H SER A 112 -18.349 -12.426 44.441 1.00 21.23 H new ATOM 0 HA SER A 112 -16.046 -13.834 45.536 1.00 21.52 H new ATOM 0 HB2 SER A 112 -18.684 -13.588 46.294 1.00 12.20 H new ATOM 0 HB3 SER A 112 -18.728 -15.122 45.448 1.00 12.20 H new ATOM 0 HG SER A 112 -18.197 -15.372 47.692 1.00 31.44 H new ATOM 1741 N THR A 113 -17.554 -14.718 42.779 1.00 22.52 N ATOM 1742 CA THR A 113 -17.478 -15.599 41.621 1.00 22.33 C ATOM 1743 C THR A 113 -16.040 -15.744 41.135 1.00 51.05 C ATOM 1744 O THR A 113 -15.565 -16.854 40.895 1.00 13.12 O ATOM 1745 CB THR A 113 -18.350 -15.080 40.462 1.00 73.42 C ATOM 1746 OG1 THR A 113 -19.727 -15.069 40.852 1.00 62.24 O ATOM 1747 CG2 THR A 113 -18.176 -15.949 39.224 1.00 60.51 C ATOM 0 H THR A 113 -18.217 -13.949 42.681 1.00 22.52 H new ATOM 0 HA THR A 113 -17.852 -16.572 41.939 1.00 22.33 H new ATOM 0 HB THR A 113 -18.032 -14.065 40.223 1.00 73.42 H new ATOM 0 HG1 THR A 113 -20.274 -14.736 40.110 1.00 62.24 H new ATOM 0 HG21 THR A 113 -18.801 -15.564 38.418 1.00 60.51 H new ATOM 0 HG22 THR A 113 -17.132 -15.933 38.912 1.00 60.51 H new ATOM 0 HG23 THR A 113 -18.471 -16.973 39.454 1.00 60.51 H new ATOM 1755 N ILE A 114 -15.352 -14.615 40.991 1.00 21.51 N ATOM 1756 CA ILE A 114 -13.968 -14.619 40.535 1.00 62.53 C ATOM 1757 C ILE A 114 -13.100 -15.511 41.416 1.00 10.43 C ATOM 1758 O ILE A 114 -12.310 -16.314 40.920 1.00 32.25 O ATOM 1759 CB ILE A 114 -13.377 -13.196 40.523 1.00 10.22 C ATOM 1760 CG1 ILE A 114 -14.182 -12.293 39.587 1.00 13.23 C ATOM 1761 CG2 ILE A 114 -11.915 -13.235 40.102 1.00 13.31 C ATOM 1762 CD1 ILE A 114 -14.312 -12.841 38.183 1.00 1.21 C ATOM 0 H ILE A 114 -15.731 -13.688 41.183 1.00 21.51 H new ATOM 0 HA ILE A 114 -13.971 -15.012 39.518 1.00 62.53 H new ATOM 0 HB ILE A 114 -13.435 -12.785 41.531 1.00 10.22 H new ATOM 0 HG12 ILE A 114 -15.178 -12.146 40.005 1.00 13.23 H new ATOM 0 HG13 ILE A 114 -13.707 -11.313 39.543 1.00 13.23 H new ATOM 0 HG21 ILE A 114 -11.510 -12.223 40.098 1.00 13.31 H new ATOM 0 HG22 ILE A 114 -11.350 -13.849 40.804 1.00 13.31 H new ATOM 0 HG23 ILE A 114 -11.836 -13.661 39.102 1.00 13.31 H new ATOM 0 HD11 ILE A 114 -14.895 -12.149 37.575 1.00 1.21 H new ATOM 0 HD12 ILE A 114 -13.321 -12.962 37.746 1.00 1.21 H new ATOM 0 HD13 ILE A 114 -14.815 -13.808 38.215 1.00 1.21 H new ATOM 1774 N LYS A 115 -13.254 -15.366 42.729 1.00 73.22 N ATOM 1775 CA LYS A 115 -12.488 -16.160 43.682 1.00 30.40 C ATOM 1776 C LYS A 115 -12.820 -17.642 43.546 1.00 65.01 C ATOM 1777 O LYS A 115 -11.983 -18.504 43.819 1.00 41.25 O ATOM 1778 CB LYS A 115 -12.770 -15.691 45.111 1.00 13.30 C ATOM 1779 CG LYS A 115 -13.386 -16.765 45.992 1.00 4.33 C ATOM 1780 CD LYS A 115 -12.333 -17.722 46.523 1.00 3.55 C ATOM 1781 CE LYS A 115 -12.843 -19.154 46.550 1.00 63.10 C ATOM 1782 NZ LYS A 115 -11.796 -20.108 47.009 1.00 41.22 N ATOM 0 H LYS A 115 -13.903 -14.705 43.157 1.00 73.22 H new ATOM 0 HA LYS A 115 -11.429 -16.022 43.464 1.00 30.40 H new ATOM 0 HB2 LYS A 115 -11.838 -15.351 45.564 1.00 13.30 H new ATOM 0 HB3 LYS A 115 -13.440 -14.832 45.077 1.00 13.30 H new ATOM 0 HG2 LYS A 115 -13.908 -16.297 46.827 1.00 4.33 H new ATOM 0 HG3 LYS A 115 -14.130 -17.321 45.422 1.00 4.33 H new ATOM 0 HD2 LYS A 115 -11.440 -17.664 45.900 1.00 3.55 H new ATOM 0 HD3 LYS A 115 -12.040 -17.420 47.529 1.00 3.55 H new ATOM 0 HE2 LYS A 115 -13.708 -19.219 47.210 1.00 63.10 H new ATOM 0 HE3 LYS A 115 -13.181 -19.438 45.553 1.00 63.10 H new ATOM 0 HZ1 LYS A 115 -12.000 -21.055 46.631 1.00 41.22 H new ATOM 0 HZ2 LYS A 115 -10.865 -19.792 46.669 1.00 41.22 H new ATOM 0 HZ3 LYS A 115 -11.791 -20.144 48.048 1.00 41.22 H new ATOM 1796 N LEU A 116 -14.044 -17.932 43.121 1.00 31.55 N ATOM 1797 CA LEU A 116 -14.488 -19.312 42.948 1.00 15.21 C ATOM 1798 C LEU A 116 -13.969 -19.889 41.635 1.00 74.02 C ATOM 1799 O LEU A 116 -13.521 -21.035 41.581 1.00 3.40 O ATOM 1800 CB LEU A 116 -16.015 -19.386 42.983 1.00 42.10 C ATOM 1801 CG LEU A 116 -16.635 -19.795 44.319 1.00 74.04 C ATOM 1802 CD1 LEU A 116 -16.215 -18.833 45.419 1.00 2.30 C ATOM 1803 CD2 LEU A 116 -18.153 -19.850 44.208 1.00 21.31 C ATOM 0 H LEU A 116 -14.748 -17.231 42.890 1.00 31.55 H new ATOM 0 HA LEU A 116 -14.084 -19.904 43.769 1.00 15.21 H new ATOM 0 HB2 LEU A 116 -16.413 -18.410 42.704 1.00 42.10 H new ATOM 0 HB3 LEU A 116 -16.342 -20.094 42.221 1.00 42.10 H new ATOM 0 HG LEU A 116 -16.272 -20.790 44.576 1.00 74.04 H new ATOM 0 HD11 LEU A 116 -16.666 -19.140 46.363 1.00 2.30 H new ATOM 0 HD12 LEU A 116 -15.129 -18.842 45.516 1.00 2.30 H new ATOM 0 HD13 LEU A 116 -16.548 -17.826 45.168 1.00 2.30 H new ATOM 0 HD21 LEU A 116 -18.578 -20.143 45.168 1.00 21.31 H new ATOM 0 HD22 LEU A 116 -18.533 -18.868 43.927 1.00 21.31 H new ATOM 0 HD23 LEU A 116 -18.436 -20.579 43.449 1.00 21.31 H new ATOM 1815 N LEU A 117 -14.031 -19.088 40.577 1.00 52.10 N ATOM 1816 CA LEU A 117 -13.566 -19.517 39.262 1.00 40.53 C ATOM 1817 C LEU A 117 -12.078 -19.854 39.295 1.00 3.24 C ATOM 1818 O LEU A 117 -11.661 -20.915 38.831 1.00 12.31 O ATOM 1819 CB LEU A 117 -13.830 -18.426 38.224 1.00 14.40 C ATOM 1820 CG LEU A 117 -15.298 -18.167 37.883 1.00 65.23 C ATOM 1821 CD1 LEU A 117 -15.553 -16.676 37.723 1.00 52.31 C ATOM 1822 CD2 LEU A 117 -15.693 -18.916 36.619 1.00 51.25 C ATOM 0 H LEU A 117 -14.399 -18.137 40.604 1.00 52.10 H new ATOM 0 HA LEU A 117 -14.118 -20.415 38.984 1.00 40.53 H new ATOM 0 HB2 LEU A 117 -13.392 -17.495 38.584 1.00 14.40 H new ATOM 0 HB3 LEU A 117 -13.305 -18.691 37.306 1.00 14.40 H new ATOM 0 HG LEU A 117 -15.912 -18.534 38.705 1.00 65.23 H new ATOM 0 HD11 LEU A 117 -16.603 -16.510 37.481 1.00 52.31 H new ATOM 0 HD12 LEU A 117 -15.310 -16.163 38.654 1.00 52.31 H new ATOM 0 HD13 LEU A 117 -14.929 -16.284 36.920 1.00 52.31 H new ATOM 0 HD21 LEU A 117 -16.741 -18.720 36.392 1.00 51.25 H new ATOM 0 HD22 LEU A 117 -15.073 -18.580 35.788 1.00 51.25 H new ATOM 0 HD23 LEU A 117 -15.549 -19.986 36.770 1.00 51.25 H new ATOM 1834 N ARG A 118 -11.283 -18.944 39.847 1.00 34.51 N ATOM 1835 CA ARG A 118 -9.841 -19.145 39.941 1.00 13.32 C ATOM 1836 C ARG A 118 -9.521 -20.481 40.603 1.00 40.32 C ATOM 1837 O ARG A 118 -8.567 -21.161 40.224 1.00 14.22 O ATOM 1838 CB ARG A 118 -9.197 -18.005 40.732 1.00 14.52 C ATOM 1839 CG ARG A 118 -9.769 -17.833 42.129 1.00 32.23 C ATOM 1840 CD ARG A 118 -9.062 -16.720 42.887 1.00 53.14 C ATOM 1841 NE ARG A 118 -9.141 -15.443 42.184 1.00 60.54 N ATOM 1842 CZ ARG A 118 -8.414 -14.379 42.507 1.00 42.21 C ATOM 1843 NH1 ARG A 118 -7.556 -14.440 43.517 1.00 30.20 N ATOM 1844 NH2 ARG A 118 -8.543 -13.252 41.820 1.00 42.41 N ATOM 0 H ARG A 118 -11.612 -18.060 40.236 1.00 34.51 H new ATOM 0 HA ARG A 118 -9.433 -19.153 38.930 1.00 13.32 H new ATOM 0 HB2 ARG A 118 -8.125 -18.187 40.808 1.00 14.52 H new ATOM 0 HB3 ARG A 118 -9.324 -17.074 40.180 1.00 14.52 H new ATOM 0 HG2 ARG A 118 -10.834 -17.610 42.062 1.00 32.23 H new ATOM 0 HG3 ARG A 118 -9.673 -18.768 42.680 1.00 32.23 H new ATOM 0 HD2 ARG A 118 -9.506 -16.617 43.877 1.00 53.14 H new ATOM 0 HD3 ARG A 118 -8.016 -16.989 43.033 1.00 53.14 H new ATOM 0 HE ARG A 118 -9.790 -15.363 41.401 1.00 60.54 H new ATOM 0 HH11 ARG A 118 -7.453 -15.305 44.047 1.00 30.20 H new ATOM 0 HH12 ARG A 118 -6.999 -13.622 43.763 1.00 30.20 H new ATOM 0 HH21 ARG A 118 -9.201 -13.201 41.042 1.00 42.41 H new ATOM 0 HH22 ARG A 118 -7.984 -12.436 42.069 1.00 42.41 H new ATOM 1858 N VAL A 119 -10.324 -20.852 41.596 1.00 20.11 N ATOM 1859 CA VAL A 119 -10.126 -22.108 42.311 1.00 73.22 C ATOM 1860 C VAL A 119 -10.914 -23.240 41.661 1.00 25.13 C ATOM 1861 O VAL A 119 -10.718 -24.412 41.985 1.00 33.13 O ATOM 1862 CB VAL A 119 -10.548 -21.985 43.787 1.00 65.44 C ATOM 1863 CG1 VAL A 119 -9.735 -20.908 44.487 1.00 2.43 C ATOM 1864 CG2 VAL A 119 -12.037 -21.693 43.893 1.00 21.23 C ATOM 0 H VAL A 119 -11.117 -20.301 41.923 1.00 20.11 H new ATOM 0 HA VAL A 119 -9.061 -22.336 42.263 1.00 73.22 H new ATOM 0 HB VAL A 119 -10.351 -22.935 44.283 1.00 65.44 H new ATOM 0 HG11 VAL A 119 -10.047 -20.836 45.529 1.00 2.43 H new ATOM 0 HG12 VAL A 119 -8.677 -21.165 44.442 1.00 2.43 H new ATOM 0 HG13 VAL A 119 -9.897 -19.950 43.992 1.00 2.43 H new ATOM 0 HG21 VAL A 119 -12.318 -21.609 44.943 1.00 21.23 H new ATOM 0 HG22 VAL A 119 -12.262 -20.757 43.382 1.00 21.23 H new ATOM 0 HG23 VAL A 119 -12.601 -22.503 43.430 1.00 21.23 H new ATOM 1874 N LEU A 120 -11.804 -22.882 40.742 1.00 4.33 N ATOM 1875 CA LEU A 120 -12.622 -23.868 40.045 1.00 43.13 C ATOM 1876 C LEU A 120 -11.849 -24.499 38.891 1.00 54.43 C ATOM 1877 O LEU A 120 -11.940 -25.703 38.654 1.00 15.32 O ATOM 1878 CB LEU A 120 -13.904 -23.218 39.522 1.00 14.23 C ATOM 1879 CG LEU A 120 -15.210 -23.712 40.145 1.00 2.25 C ATOM 1880 CD1 LEU A 120 -15.409 -25.193 39.865 1.00 72.21 C ATOM 1881 CD2 LEU A 120 -15.220 -23.444 41.643 1.00 12.24 C ATOM 0 H LEU A 120 -11.977 -21.917 40.462 1.00 4.33 H new ATOM 0 HA LEU A 120 -12.884 -24.653 40.754 1.00 43.13 H new ATOM 0 HB2 LEU A 120 -13.833 -22.142 39.681 1.00 14.23 H new ATOM 0 HB3 LEU A 120 -13.955 -23.378 38.445 1.00 14.23 H new ATOM 0 HG LEU A 120 -16.036 -23.164 39.692 1.00 2.25 H new ATOM 0 HD11 LEU A 120 -16.344 -25.526 40.316 1.00 72.21 H new ATOM 0 HD12 LEU A 120 -15.447 -25.358 38.788 1.00 72.21 H new ATOM 0 HD13 LEU A 120 -14.579 -25.758 40.290 1.00 72.21 H new ATOM 0 HD21 LEU A 120 -16.157 -23.802 42.070 1.00 12.24 H new ATOM 0 HD22 LEU A 120 -14.385 -23.965 42.111 1.00 12.24 H new ATOM 0 HD23 LEU A 120 -15.125 -22.373 41.822 1.00 12.24 H new ATOM 1893 N ASP A 121 -11.088 -23.676 38.177 1.00 63.32 N ATOM 1894 CA ASP A 121 -10.296 -24.153 37.049 1.00 72.41 C ATOM 1895 C ASP A 121 -9.463 -25.369 37.445 1.00 23.10 C ATOM 1896 O ASP A 121 -9.175 -26.234 36.618 1.00 52.45 O ATOM 1897 CB ASP A 121 -9.384 -23.040 36.531 1.00 12.40 C ATOM 1898 CG ASP A 121 -8.227 -23.575 35.711 1.00 51.12 C ATOM 1899 OD1 ASP A 121 -7.255 -24.079 36.313 1.00 14.34 O ATOM 1900 OD2 ASP A 121 -8.292 -23.490 34.467 1.00 41.31 O ATOM 0 H ASP A 121 -11.003 -22.676 38.359 1.00 63.32 H new ATOM 0 HA ASP A 121 -10.982 -24.448 36.255 1.00 72.41 H new ATOM 0 HB2 ASP A 121 -9.968 -22.349 35.923 1.00 12.40 H new ATOM 0 HB3 ASP A 121 -8.995 -22.471 37.375 1.00 12.40 H new ATOM 1905 N LYS A 122 -9.077 -25.426 38.716 1.00 23.43 N ATOM 1906 CA LYS A 122 -8.276 -26.533 39.223 1.00 41.12 C ATOM 1907 C LYS A 122 -9.156 -27.566 39.921 1.00 73.22 C ATOM 1908 O LYS A 122 -8.756 -28.715 40.106 1.00 64.41 O ATOM 1909 CB LYS A 122 -7.210 -26.018 40.192 1.00 60.14 C ATOM 1910 CG LYS A 122 -6.186 -25.105 39.540 1.00 63.53 C ATOM 1911 CD LYS A 122 -6.422 -23.650 39.906 1.00 31.14 C ATOM 1912 CE LYS A 122 -6.169 -23.398 41.384 1.00 51.44 C ATOM 1913 NZ LYS A 122 -5.603 -22.042 41.626 1.00 2.33 N ATOM 0 H LYS A 122 -9.307 -24.718 39.413 1.00 23.43 H new ATOM 0 HA LYS A 122 -7.786 -27.011 38.375 1.00 41.12 H new ATOM 0 HB2 LYS A 122 -7.699 -25.480 41.004 1.00 60.14 H new ATOM 0 HB3 LYS A 122 -6.694 -26.869 40.638 1.00 60.14 H new ATOM 0 HG2 LYS A 122 -5.184 -25.401 39.850 1.00 63.53 H new ATOM 0 HG3 LYS A 122 -6.232 -25.221 38.457 1.00 63.53 H new ATOM 0 HD2 LYS A 122 -5.768 -23.013 39.310 1.00 31.14 H new ATOM 0 HD3 LYS A 122 -7.447 -23.373 39.659 1.00 31.14 H new ATOM 0 HE2 LYS A 122 -7.103 -23.506 41.936 1.00 51.44 H new ATOM 0 HE3 LYS A 122 -5.483 -24.152 41.769 1.00 51.44 H new ATOM 0 HZ1 LYS A 122 -5.445 -21.909 42.645 1.00 2.33 H new ATOM 0 HZ2 LYS A 122 -4.699 -21.948 41.120 1.00 2.33 H new ATOM 0 HZ3 LYS A 122 -6.269 -21.321 41.282 1.00 2.33 H new ATOM 1927 N HIS A 123 -10.358 -27.148 40.308 1.00 20.32 N ATOM 1928 CA HIS A 123 -11.296 -28.037 40.983 1.00 4.45 C ATOM 1929 C HIS A 123 -12.667 -27.990 40.316 1.00 35.01 C ATOM 1930 O HIS A 123 -13.537 -27.200 40.684 1.00 52.04 O ATOM 1931 CB HIS A 123 -11.420 -27.655 42.459 1.00 23.45 C ATOM 1932 CG HIS A 123 -10.121 -27.710 43.203 1.00 2.01 C ATOM 1933 ND1 HIS A 123 -9.783 -28.745 44.050 1.00 32.23 N ATOM 1934 CD2 HIS A 123 -9.075 -26.852 43.222 1.00 2.20 C ATOM 1935 CE1 HIS A 123 -8.586 -28.519 44.561 1.00 45.01 C ATOM 1936 NE2 HIS A 123 -8.133 -27.377 44.074 1.00 61.53 N ATOM 0 H HIS A 123 -10.704 -26.199 40.165 1.00 20.32 H new ATOM 0 HA HIS A 123 -10.911 -29.054 40.909 1.00 4.45 H new ATOM 0 HB2 HIS A 123 -11.829 -26.647 42.532 1.00 23.45 H new ATOM 0 HB3 HIS A 123 -12.134 -28.324 42.940 1.00 23.45 H new ATOM 0 HD2 HIS A 123 -8.995 -25.927 42.670 1.00 2.20 H new ATOM 0 HE1 HIS A 123 -8.066 -29.159 45.258 1.00 45.01 H new ATOM 0 HE2 HIS A 123 -7.231 -26.954 44.294 1.00 61.53 H new ATOM 1944 N PRO A 124 -12.866 -28.854 39.311 1.00 3.53 N ATOM 1945 CA PRO A 124 -14.129 -28.930 38.571 1.00 5.05 C ATOM 1946 C PRO A 124 -15.264 -29.501 39.417 1.00 63.34 C ATOM 1947 O PRO A 124 -16.383 -29.670 38.935 1.00 63.12 O ATOM 1948 CB PRO A 124 -13.804 -29.871 37.408 1.00 22.14 C ATOM 1949 CG PRO A 124 -12.676 -30.709 37.903 1.00 0.32 C ATOM 1950 CD PRO A 124 -11.874 -29.825 38.819 1.00 10.41 C ATOM 0 HA PRO A 124 -14.476 -27.946 38.256 1.00 5.05 H new ATOM 0 HB2 PRO A 124 -14.665 -30.484 37.142 1.00 22.14 H new ATOM 0 HB3 PRO A 124 -13.521 -29.314 36.515 1.00 22.14 H new ATOM 0 HG2 PRO A 124 -13.045 -31.587 38.433 1.00 0.32 H new ATOM 0 HG3 PRO A 124 -12.065 -31.070 37.075 1.00 0.32 H new ATOM 0 HD2 PRO A 124 -11.428 -30.392 39.636 1.00 10.41 H new ATOM 0 HD3 PRO A 124 -11.058 -29.333 38.290 1.00 10.41 H new ATOM 1958 N GLU A 125 -14.964 -29.795 40.678 1.00 13.12 N ATOM 1959 CA GLU A 125 -15.959 -30.348 41.590 1.00 20.23 C ATOM 1960 C GLU A 125 -16.240 -29.383 42.738 1.00 33.21 C ATOM 1961 O GLU A 125 -17.204 -29.552 43.485 1.00 24.25 O ATOM 1962 CB GLU A 125 -15.486 -31.693 42.143 1.00 74.33 C ATOM 1963 CG GLU A 125 -14.417 -31.567 43.216 1.00 12.10 C ATOM 1964 CD GLU A 125 -13.559 -32.812 43.334 1.00 24.31 C ATOM 1965 OE1 GLU A 125 -12.787 -33.091 42.393 1.00 34.54 O ATOM 1966 OE2 GLU A 125 -13.659 -33.505 44.367 1.00 74.54 O ATOM 0 H GLU A 125 -14.041 -29.660 41.091 1.00 13.12 H new ATOM 0 HA GLU A 125 -16.882 -30.499 41.031 1.00 20.23 H new ATOM 0 HB2 GLU A 125 -16.341 -32.228 42.555 1.00 74.33 H new ATOM 0 HB3 GLU A 125 -15.097 -32.297 41.323 1.00 74.33 H new ATOM 0 HG2 GLU A 125 -13.780 -30.712 42.990 1.00 12.10 H new ATOM 0 HG3 GLU A 125 -14.893 -31.366 44.176 1.00 12.10 H new ATOM 1973 N LEU A 126 -15.390 -28.370 42.873 1.00 13.14 N ATOM 1974 CA LEU A 126 -15.544 -27.378 43.931 1.00 71.22 C ATOM 1975 C LEU A 126 -16.939 -26.759 43.898 1.00 13.54 C ATOM 1976 O LEU A 126 -17.599 -26.634 44.930 1.00 11.51 O ATOM 1977 CB LEU A 126 -14.485 -26.284 43.789 1.00 55.31 C ATOM 1978 CG LEU A 126 -13.903 -25.740 45.094 1.00 51.03 C ATOM 1979 CD1 LEU A 126 -13.115 -26.820 45.818 1.00 70.55 C ATOM 1980 CD2 LEU A 126 -13.024 -24.527 44.822 1.00 30.35 C ATOM 0 H LEU A 126 -14.587 -28.215 42.263 1.00 13.14 H new ATOM 0 HA LEU A 126 -15.412 -27.881 44.889 1.00 71.22 H new ATOM 0 HB2 LEU A 126 -13.666 -26.675 43.185 1.00 55.31 H new ATOM 0 HB3 LEU A 126 -14.922 -25.453 43.235 1.00 55.31 H new ATOM 0 HG LEU A 126 -14.728 -25.429 45.735 1.00 51.03 H new ATOM 0 HD11 LEU A 126 -12.708 -26.414 46.744 1.00 70.55 H new ATOM 0 HD12 LEU A 126 -13.773 -27.659 46.047 1.00 70.55 H new ATOM 0 HD13 LEU A 126 -12.298 -27.162 45.182 1.00 70.55 H new ATOM 0 HD21 LEU A 126 -12.618 -24.153 45.762 1.00 30.35 H new ATOM 0 HD22 LEU A 126 -12.205 -24.812 44.161 1.00 30.35 H new ATOM 0 HD23 LEU A 126 -13.618 -23.746 44.347 1.00 30.35 H new ATOM 1992 N LEU A 127 -17.382 -26.377 42.706 1.00 0.44 N ATOM 1993 CA LEU A 127 -18.700 -25.773 42.537 1.00 64.00 C ATOM 1994 C LEU A 127 -19.770 -26.595 43.247 1.00 43.31 C ATOM 1995 O LEU A 127 -20.771 -26.056 43.716 1.00 23.40 O ATOM 1996 CB LEU A 127 -19.039 -25.649 41.050 1.00 60.13 C ATOM 1997 CG LEU A 127 -19.419 -26.948 40.338 1.00 20.33 C ATOM 1998 CD1 LEU A 127 -20.470 -26.683 39.271 1.00 5.55 C ATOM 1999 CD2 LEU A 127 -18.189 -27.601 39.727 1.00 25.23 C ATOM 0 H LEU A 127 -16.849 -26.474 41.842 1.00 0.44 H new ATOM 0 HA LEU A 127 -18.677 -24.778 42.982 1.00 64.00 H new ATOM 0 HB2 LEU A 127 -19.864 -24.945 40.943 1.00 60.13 H new ATOM 0 HB3 LEU A 127 -18.181 -25.215 40.537 1.00 60.13 H new ATOM 0 HG LEU A 127 -19.841 -27.633 41.073 1.00 20.33 H new ATOM 0 HD11 LEU A 127 -20.728 -27.618 38.775 1.00 5.55 H new ATOM 0 HD12 LEU A 127 -21.361 -26.260 39.735 1.00 5.55 H new ATOM 0 HD13 LEU A 127 -20.075 -25.980 38.538 1.00 5.55 H new ATOM 0 HD21 LEU A 127 -18.479 -28.524 39.225 1.00 25.23 H new ATOM 0 HD22 LEU A 127 -17.737 -26.921 39.005 1.00 25.23 H new ATOM 0 HD23 LEU A 127 -17.468 -27.827 40.513 1.00 25.23 H new ATOM 2011 N ASN A 128 -19.550 -27.904 43.325 1.00 24.14 N ATOM 2012 CA ASN A 128 -20.495 -28.801 43.981 1.00 50.40 C ATOM 2013 C ASN A 128 -20.240 -28.855 45.484 1.00 11.11 C ATOM 2014 O ASN A 128 -21.166 -29.043 46.273 1.00 51.21 O ATOM 2015 CB ASN A 128 -20.395 -30.206 43.384 1.00 30.34 C ATOM 2016 CG ASN A 128 -20.397 -30.192 41.867 1.00 60.51 C ATOM 2017 OD1 ASN A 128 -19.231 -29.965 41.275 1.00 73.41 O flip ATOM 2018 ND2 ASN A 128 -21.437 -30.383 41.236 1.00 52.11 N flip ATOM 0 H ASN A 128 -18.726 -28.367 42.942 1.00 24.14 H new ATOM 0 HA ASN A 128 -21.500 -28.414 43.815 1.00 50.40 H new ATOM 0 HB2 ASN A 128 -19.482 -30.684 43.739 1.00 30.34 H new ATOM 0 HB3 ASN A 128 -21.230 -30.809 43.740 1.00 30.34 H new ATOM 0 HD21 ASN A 128 -22.311 -30.554 41.733 1.00 52.11 H new ATOM 0 HD22 ASN A 128 -21.424 -30.371 40.216 1.00 52.11 H new ATOM 2025 N GLU A 129 -18.980 -28.687 45.872 1.00 64.15 N ATOM 2026 CA GLU A 129 -18.605 -28.718 47.280 1.00 34.41 C ATOM 2027 C GLU A 129 -18.686 -27.323 47.895 1.00 4.22 C ATOM 2028 O GLU A 129 -18.330 -27.124 49.056 1.00 41.41 O ATOM 2029 CB GLU A 129 -17.189 -29.275 47.441 1.00 64.14 C ATOM 2030 CG GLU A 129 -16.100 -28.227 47.288 1.00 70.51 C ATOM 2031 CD GLU A 129 -15.627 -27.679 48.621 1.00 11.43 C ATOM 2032 OE1 GLU A 129 -15.617 -28.445 49.608 1.00 30.30 O ATOM 2033 OE2 GLU A 129 -15.267 -26.485 48.677 1.00 71.44 O ATOM 0 H GLU A 129 -18.202 -28.528 45.231 1.00 64.15 H new ATOM 0 HA GLU A 129 -19.306 -29.369 47.802 1.00 34.41 H new ATOM 0 HB2 GLU A 129 -17.100 -29.738 48.424 1.00 64.14 H new ATOM 0 HB3 GLU A 129 -17.031 -30.061 46.703 1.00 64.14 H new ATOM 0 HG2 GLU A 129 -15.253 -28.663 46.757 1.00 70.51 H new ATOM 0 HG3 GLU A 129 -16.473 -27.407 46.674 1.00 70.51 H new ATOM 2040 N ILE A 130 -19.156 -26.362 47.107 1.00 32.13 N ATOM 2041 CA ILE A 130 -19.286 -24.987 47.574 1.00 40.54 C ATOM 2042 C ILE A 130 -20.718 -24.487 47.421 1.00 24.44 C ATOM 2043 O ILE A 130 -21.208 -23.714 48.245 1.00 43.33 O ATOM 2044 CB ILE A 130 -18.340 -24.043 46.810 1.00 75.14 C ATOM 2045 CG1 ILE A 130 -18.829 -23.847 45.373 1.00 35.03 C ATOM 2046 CG2 ILE A 130 -16.920 -24.590 46.821 1.00 62.02 C ATOM 2047 CD1 ILE A 130 -17.905 -22.998 44.529 1.00 53.15 C ATOM 0 H ILE A 130 -19.453 -26.510 46.142 1.00 32.13 H new ATOM 0 HA ILE A 130 -19.015 -24.985 48.630 1.00 40.54 H new ATOM 0 HB ILE A 130 -18.339 -23.074 47.309 1.00 75.14 H new ATOM 0 HG12 ILE A 130 -18.944 -24.823 44.901 1.00 35.03 H new ATOM 0 HG13 ILE A 130 -19.816 -23.384 45.394 1.00 35.03 H new ATOM 0 HG21 ILE A 130 -16.264 -23.911 46.277 1.00 62.02 H new ATOM 0 HG22 ILE A 130 -16.573 -24.682 47.850 1.00 62.02 H new ATOM 0 HG23 ILE A 130 -16.904 -25.570 46.344 1.00 62.02 H new ATOM 0 HD11 ILE A 130 -18.316 -22.902 43.524 1.00 53.15 H new ATOM 0 HD12 ILE A 130 -17.809 -22.009 44.977 1.00 53.15 H new ATOM 0 HD13 ILE A 130 -16.924 -23.470 44.477 1.00 53.15 H new ATOM 2059 N ARG A 131 -21.385 -24.934 46.362 1.00 54.13 N ATOM 2060 CA ARG A 131 -22.762 -24.533 46.101 1.00 11.34 C ATOM 2061 C ARG A 131 -23.695 -25.047 47.195 1.00 63.43 C ATOM 2062 O ARG A 131 -23.824 -24.433 48.254 1.00 2.33 O ATOM 2063 CB ARG A 131 -23.220 -25.056 44.738 1.00 53.10 C ATOM 2064 CG ARG A 131 -23.430 -26.560 44.703 1.00 44.22 C ATOM 2065 CD ARG A 131 -24.846 -26.915 44.277 1.00 24.34 C ATOM 2066 NE ARG A 131 -24.946 -27.134 42.837 1.00 50.40 N ATOM 2067 CZ ARG A 131 -24.398 -28.169 42.211 1.00 65.42 C ATOM 2068 NH1 ARG A 131 -23.713 -29.076 42.896 1.00 12.41 N ATOM 2069 NH2 ARG A 131 -24.533 -28.300 40.898 1.00 62.25 N ATOM 0 H ARG A 131 -20.994 -25.574 45.671 1.00 54.13 H new ATOM 0 HA ARG A 131 -22.801 -23.444 46.096 1.00 11.34 H new ATOM 0 HB2 ARG A 131 -24.151 -24.561 44.463 1.00 53.10 H new ATOM 0 HB3 ARG A 131 -22.480 -24.783 43.986 1.00 53.10 H new ATOM 0 HG2 ARG A 131 -22.717 -27.012 44.013 1.00 44.22 H new ATOM 0 HG3 ARG A 131 -23.229 -26.980 45.689 1.00 44.22 H new ATOM 0 HD2 ARG A 131 -25.168 -27.813 44.803 1.00 24.34 H new ATOM 0 HD3 ARG A 131 -25.524 -26.113 44.570 1.00 24.34 H new ATOM 0 HE ARG A 131 -25.465 -26.455 42.281 1.00 50.40 H new ATOM 0 HH11 ARG A 131 -23.606 -28.979 43.906 1.00 12.41 H new ATOM 0 HH12 ARG A 131 -23.293 -29.870 42.413 1.00 12.41 H new ATOM 0 HH21 ARG A 131 -25.058 -27.605 40.367 1.00 62.25 H new ATOM 0 HH22 ARG A 131 -24.111 -29.096 40.419 1.00 62.25 H new TER 2083 ARG A 131