USER MOD reduce.3.24.130724 H: found=0, std=0, add=789, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 793 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 65 LYS NZ :NH3+ 172:sc= 1.29 (180deg=1.14) USER MOD Set 1.2: A 71 TYR OH : rot -126:sc= 1.02 USER MOD Set 2.1: A 64 TYR OH : rot -15:sc= -1.34 USER MOD Set 2.2: A 68 ASN :FLIP amide:sc= -1.66 F(o=-4.3!,f=-3) USER MOD Set 3.1: A 55 LYS NZ :NH3+ 167:sc= 1.02 (180deg=0) USER MOD Set 3.2: A 145 ASN : amide:sc= -1.51! K(o=-0.49!,f=-4.5) USER MOD Single : A 39 MET CE :methyl 173:sc= -1.12 (180deg=-1.14) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.245 X(o=-0.24,f=-0.29) USER MOD Single : A 46 LYS NZ :NH3+ 158:sc= 1.23 (180deg=1.01) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 169:sc= -0.0995 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0237 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 83 LYS NZ :NH3+ -171:sc= 1.24 (180deg=1.16) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot -38:sc= 0.0585 USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 GLN : amide:sc= -0.338 X(o=-0.34,f=0) USER MOD Single : A 92 LYS NZ :NH3+ 171:sc=-0.00977 (180deg=-0.104) USER MOD Single : A 93 ASN : amide:sc= -0.0401 K(o=-0.04,f=-2.1!) USER MOD Single : A 95 ASN : amide:sc= -0.289 K(o=-0.29,f=-9.2!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= -2.77! USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 167:sc= -0.0102 (180deg=-0.161) USER MOD Single : A 110 ASN :FLIP amide:sc= -2.67! C(o=-4.9!,f=-2.7!) USER MOD Single : A 112 TYR OH : rot 67:sc= 0.611 USER MOD Single : A 113 GLN : amide:sc= -1.54 K(o=-1.5,f=-7.6!) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 TYR OH : rot -119:sc= 1.27 USER MOD Single : A 127 SER OG : rot -131:sc= 0.00075 USER MOD Single : A 133 LYS NZ :NH3+ 158:sc= 1.06 (180deg=0.407) USER MOD Single : A 137 SER OG : rot 25:sc= 1.3 USER MOD Single : A 139 ASN : amide:sc= -1.83! C(o=-1.8!,f=-5!) USER MOD Single : A 148 ASN :FLIP amide:sc=-0.00134 F(o=-0.65,f=-0.0013) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 39 3.053 5.675 -0.639 1.00 14.14 N ATOM 2 CA MET A 39 4.221 4.863 -1.006 1.00 13.34 C ATOM 3 C MET A 39 3.738 3.480 -1.398 1.00 3.04 C ATOM 4 O MET A 39 3.346 2.708 -0.535 1.00 34.44 O ATOM 5 CB MET A 39 5.208 4.675 0.183 1.00 11.55 C ATOM 6 CG MET A 39 5.543 5.903 1.010 1.00 12.01 C ATOM 7 SD MET A 39 4.161 6.457 2.031 1.00 23.32 S ATOM 8 CE MET A 39 4.888 7.896 2.788 1.00 12.03 C ATOM 0 HA MET A 39 4.736 5.378 -1.817 1.00 13.34 H new ATOM 0 HB2 MET A 39 4.791 3.921 0.851 1.00 11.55 H new ATOM 0 HB3 MET A 39 6.140 4.270 -0.213 1.00 11.55 H new ATOM 0 HG2 MET A 39 6.397 5.682 1.651 1.00 12.01 H new ATOM 0 HG3 MET A 39 5.845 6.712 0.345 1.00 12.01 H new ATOM 0 HE1 MET A 39 4.128 8.431 3.357 1.00 12.03 H new ATOM 0 HE2 MET A 39 5.692 7.588 3.457 1.00 12.03 H new ATOM 0 HE3 MET A 39 5.290 8.550 2.014 1.00 12.03 H new ATOM 20 N SER A 40 3.743 3.157 -2.668 1.00 1.22 N ATOM 21 CA SER A 40 3.304 1.847 -3.076 1.00 51.05 C ATOM 22 C SER A 40 4.459 1.075 -3.698 1.00 25.10 C ATOM 23 O SER A 40 4.737 1.199 -4.896 1.00 22.22 O ATOM 24 CB SER A 40 2.092 1.914 -4.025 1.00 21.12 C ATOM 25 OG SER A 40 1.596 0.610 -4.339 1.00 52.24 O ATOM 0 H SER A 40 4.041 3.772 -3.425 1.00 1.22 H new ATOM 0 HA SER A 40 2.972 1.312 -2.186 1.00 51.05 H new ATOM 0 HB2 SER A 40 1.300 2.504 -3.563 1.00 21.12 H new ATOM 0 HB3 SER A 40 2.377 2.427 -4.944 1.00 21.12 H new ATOM 0 HG SER A 40 0.827 0.689 -4.941 1.00 52.24 H new ATOM 31 N ARG A 41 5.180 0.379 -2.845 1.00 20.20 N ATOM 32 CA ARG A 41 6.278 -0.515 -3.183 1.00 73.42 C ATOM 33 C ARG A 41 6.387 -1.512 -2.042 1.00 20.42 C ATOM 34 O ARG A 41 5.825 -1.247 -0.973 1.00 43.11 O ATOM 35 CB ARG A 41 7.635 0.237 -3.348 1.00 14.23 C ATOM 36 CG ARG A 41 7.815 1.018 -4.644 1.00 71.12 C ATOM 37 CD ARG A 41 7.695 0.101 -5.853 1.00 73.01 C ATOM 38 NE ARG A 41 7.965 0.797 -7.110 1.00 33.22 N ATOM 39 CZ ARG A 41 7.582 0.376 -8.322 1.00 22.13 C ATOM 40 NH1 ARG A 41 6.787 -0.679 -8.437 1.00 32.43 N ATOM 41 NH2 ARG A 41 7.979 1.030 -9.415 1.00 24.50 N ATOM 0 H ARG A 41 5.010 0.421 -1.840 1.00 20.20 H new ATOM 0 HA ARG A 41 6.074 -0.995 -4.140 1.00 73.42 H new ATOM 0 HB2 ARG A 41 7.748 0.928 -2.513 1.00 14.23 H new ATOM 0 HB3 ARG A 41 8.442 -0.491 -3.271 1.00 14.23 H new ATOM 0 HG2 ARG A 41 7.065 1.807 -4.705 1.00 71.12 H new ATOM 0 HG3 ARG A 41 8.790 1.505 -4.647 1.00 71.12 H new ATOM 0 HD2 ARG A 41 8.391 -0.731 -5.745 1.00 73.01 H new ATOM 0 HD3 ARG A 41 6.692 -0.324 -5.885 1.00 73.01 H new ATOM 0 HE ARG A 41 8.486 1.672 -7.060 1.00 33.22 H new ATOM 0 HH11 ARG A 41 6.467 -1.170 -7.602 1.00 32.43 H new ATOM 0 HH12 ARG A 41 6.495 -1.000 -9.360 1.00 32.43 H new ATOM 0 HH21 ARG A 41 8.576 1.853 -9.329 1.00 24.50 H new ATOM 0 HH22 ARG A 41 7.686 0.707 -10.337 1.00 24.50 H new ATOM 55 N PRO A 42 7.050 -2.671 -2.236 1.00 3.25 N ATOM 56 CA PRO A 42 7.301 -3.633 -1.144 1.00 60.02 C ATOM 57 C PRO A 42 7.940 -2.935 0.065 1.00 2.30 C ATOM 58 O PRO A 42 8.855 -2.105 -0.102 1.00 25.14 O ATOM 59 CB PRO A 42 8.286 -4.608 -1.767 1.00 54.30 C ATOM 60 CG PRO A 42 7.966 -4.584 -3.223 1.00 40.23 C ATOM 61 CD PRO A 42 7.560 -3.173 -3.532 1.00 41.35 C ATOM 0 HA PRO A 42 6.391 -4.106 -0.776 1.00 60.02 H new ATOM 0 HB2 PRO A 42 9.316 -4.304 -1.582 1.00 54.30 H new ATOM 0 HB3 PRO A 42 8.170 -5.609 -1.352 1.00 54.30 H new ATOM 0 HG2 PRO A 42 8.830 -4.881 -3.818 1.00 40.23 H new ATOM 0 HG3 PRO A 42 7.162 -5.282 -3.458 1.00 40.23 H new ATOM 0 HD2 PRO A 42 8.403 -2.581 -3.888 1.00 41.35 H new ATOM 0 HD3 PRO A 42 6.794 -3.136 -4.307 1.00 41.35 H new ATOM 69 N ASP A 43 7.408 -3.219 1.263 1.00 21.21 N ATOM 70 CA ASP A 43 7.811 -2.579 2.554 1.00 3.21 C ATOM 71 C ASP A 43 7.274 -1.160 2.668 1.00 42.35 C ATOM 72 O ASP A 43 6.811 -0.740 3.713 1.00 12.44 O ATOM 73 CB ASP A 43 9.331 -2.621 2.863 1.00 1.43 C ATOM 74 CG ASP A 43 9.833 -3.983 3.294 1.00 14.12 C ATOM 75 OD1 ASP A 43 9.480 -4.443 4.417 1.00 64.25 O ATOM 76 OD2 ASP A 43 10.606 -4.623 2.537 1.00 30.25 O ATOM 0 H ASP A 43 6.669 -3.913 1.379 1.00 21.21 H new ATOM 0 HA ASP A 43 7.346 -3.200 3.320 1.00 3.21 H new ATOM 0 HB2 ASP A 43 9.881 -2.306 1.976 1.00 1.43 H new ATOM 0 HB3 ASP A 43 9.552 -1.898 3.648 1.00 1.43 H new ATOM 81 N GLN A 44 7.260 -0.458 1.562 1.00 21.11 N ATOM 82 CA GLN A 44 6.743 0.898 1.496 1.00 0.04 C ATOM 83 C GLN A 44 5.233 0.888 1.693 1.00 11.23 C ATOM 84 O GLN A 44 4.641 1.865 2.167 1.00 25.54 O ATOM 85 CB GLN A 44 7.114 1.522 0.164 1.00 54.53 C ATOM 86 CG GLN A 44 8.615 1.614 -0.073 1.00 34.40 C ATOM 87 CD GLN A 44 9.306 2.521 0.918 1.00 3.42 C ATOM 88 OE1 GLN A 44 9.754 2.095 1.977 1.00 42.21 O ATOM 89 NE2 GLN A 44 9.414 3.766 0.575 1.00 13.22 N ATOM 0 H GLN A 44 7.609 -0.810 0.671 1.00 21.11 H new ATOM 0 HA GLN A 44 7.186 1.496 2.292 1.00 0.04 H new ATOM 0 HB2 GLN A 44 6.664 0.938 -0.639 1.00 54.53 H new ATOM 0 HB3 GLN A 44 6.685 2.522 0.110 1.00 54.53 H new ATOM 0 HG2 GLN A 44 9.050 0.617 -0.012 1.00 34.40 H new ATOM 0 HG3 GLN A 44 8.798 1.980 -1.083 1.00 34.40 H new ATOM 0 HE21 GLN A 44 9.029 4.085 -0.314 1.00 13.22 H new ATOM 0 HE22 GLN A 44 9.884 4.427 1.194 1.00 13.22 H new ATOM 98 N ALA A 45 4.625 -0.248 1.370 1.00 63.22 N ATOM 99 CA ALA A 45 3.211 -0.481 1.587 1.00 22.31 C ATOM 100 C ALA A 45 2.909 -0.554 3.092 1.00 33.11 C ATOM 101 O ALA A 45 1.766 -0.431 3.521 1.00 40.54 O ATOM 102 CB ALA A 45 2.776 -1.763 0.895 1.00 31.31 C ATOM 0 H ALA A 45 5.110 -1.039 0.946 1.00 63.22 H new ATOM 0 HA ALA A 45 2.650 0.350 1.161 1.00 22.31 H new ATOM 0 HB1 ALA A 45 1.712 -1.926 1.066 1.00 31.31 H new ATOM 0 HB2 ALA A 45 2.963 -1.680 -0.176 1.00 31.31 H new ATOM 0 HB3 ALA A 45 3.341 -2.604 1.298 1.00 31.31 H new ATOM 108 N LYS A 46 3.944 -0.748 3.893 1.00 74.32 N ATOM 109 CA LYS A 46 3.787 -0.765 5.328 1.00 43.40 C ATOM 110 C LYS A 46 3.932 0.659 5.843 1.00 42.43 C ATOM 111 O LYS A 46 3.334 1.033 6.831 1.00 42.11 O ATOM 112 CB LYS A 46 4.893 -1.624 5.945 1.00 4.40 C ATOM 113 CG LYS A 46 4.919 -3.066 5.475 1.00 54.20 C ATOM 114 CD LYS A 46 6.196 -3.751 5.929 1.00 5.23 C ATOM 115 CE LYS A 46 6.238 -5.196 5.489 1.00 11.34 C ATOM 116 NZ LYS A 46 7.559 -5.818 5.761 1.00 62.42 N ATOM 0 H LYS A 46 4.900 -0.895 3.569 1.00 74.32 H new ATOM 0 HA LYS A 46 2.811 -1.172 5.594 1.00 43.40 H new ATOM 0 HB2 LYS A 46 5.856 -1.166 5.720 1.00 4.40 H new ATOM 0 HB3 LYS A 46 4.780 -1.612 7.029 1.00 4.40 H new ATOM 0 HG2 LYS A 46 4.054 -3.599 5.869 1.00 54.20 H new ATOM 0 HG3 LYS A 46 4.847 -3.102 4.388 1.00 54.20 H new ATOM 0 HD2 LYS A 46 7.058 -3.221 5.523 1.00 5.23 H new ATOM 0 HD3 LYS A 46 6.272 -3.698 7.015 1.00 5.23 H new ATOM 0 HE2 LYS A 46 5.459 -5.756 6.007 1.00 11.34 H new ATOM 0 HE3 LYS A 46 6.020 -5.258 4.423 1.00 11.34 H new ATOM 0 HZ1 LYS A 46 7.454 -6.852 5.805 1.00 62.42 H new ATOM 0 HZ2 LYS A 46 8.223 -5.569 5.000 1.00 62.42 H new ATOM 0 HZ3 LYS A 46 7.927 -5.469 6.669 1.00 62.42 H new ATOM 130 N VAL A 47 4.655 1.468 5.090 1.00 5.33 N ATOM 131 CA VAL A 47 4.903 2.855 5.454 1.00 12.25 C ATOM 132 C VAL A 47 3.667 3.694 5.194 1.00 64.03 C ATOM 133 O VAL A 47 3.258 4.508 6.019 1.00 24.14 O ATOM 134 CB VAL A 47 6.100 3.434 4.658 1.00 63.42 C ATOM 135 CG1 VAL A 47 6.419 4.862 5.083 1.00 71.13 C ATOM 136 CG2 VAL A 47 7.311 2.551 4.829 1.00 1.21 C ATOM 0 H VAL A 47 5.087 1.185 4.210 1.00 5.33 H new ATOM 0 HA VAL A 47 5.145 2.885 6.516 1.00 12.25 H new ATOM 0 HB VAL A 47 5.821 3.459 3.605 1.00 63.42 H new ATOM 0 HG11 VAL A 47 7.264 5.234 4.503 1.00 71.13 H new ATOM 0 HG12 VAL A 47 5.550 5.497 4.907 1.00 71.13 H new ATOM 0 HG13 VAL A 47 6.672 4.878 6.143 1.00 71.13 H new ATOM 0 HG21 VAL A 47 8.147 2.966 4.266 1.00 1.21 H new ATOM 0 HG22 VAL A 47 7.576 2.497 5.885 1.00 1.21 H new ATOM 0 HG23 VAL A 47 7.087 1.550 4.460 1.00 1.21 H new ATOM 146 N THR A 48 3.056 3.455 4.055 1.00 74.10 N ATOM 147 CA THR A 48 1.906 4.211 3.622 1.00 34.14 C ATOM 148 C THR A 48 0.694 3.987 4.555 1.00 63.43 C ATOM 149 O THR A 48 -0.132 4.885 4.745 1.00 22.40 O ATOM 150 CB THR A 48 1.562 3.895 2.130 1.00 61.45 C ATOM 151 OG1 THR A 48 0.529 4.755 1.644 1.00 2.24 O ATOM 152 CG2 THR A 48 1.130 2.453 1.950 1.00 22.43 C ATOM 0 H THR A 48 3.345 2.727 3.401 1.00 74.10 H new ATOM 0 HA THR A 48 2.158 5.270 3.684 1.00 34.14 H new ATOM 0 HB THR A 48 2.473 4.065 1.557 1.00 61.45 H new ATOM 0 HG1 THR A 48 0.335 4.537 0.709 1.00 2.24 H new ATOM 0 HG21 THR A 48 0.899 2.271 0.900 1.00 22.43 H new ATOM 0 HG22 THR A 48 1.936 1.790 2.265 1.00 22.43 H new ATOM 0 HG23 THR A 48 0.244 2.260 2.555 1.00 22.43 H new ATOM 160 N VAL A 49 0.619 2.815 5.175 1.00 34.33 N ATOM 161 CA VAL A 49 -0.471 2.542 6.079 1.00 73.13 C ATOM 162 C VAL A 49 -0.155 3.100 7.454 1.00 71.11 C ATOM 163 O VAL A 49 -1.028 3.629 8.135 1.00 10.24 O ATOM 164 CB VAL A 49 -0.840 1.032 6.155 1.00 53.04 C ATOM 165 CG1 VAL A 49 -1.176 0.495 4.777 1.00 4.24 C ATOM 166 CG2 VAL A 49 0.246 0.192 6.826 1.00 14.00 C ATOM 0 H VAL A 49 1.292 2.056 5.066 1.00 34.33 H new ATOM 0 HA VAL A 49 -1.353 3.043 5.681 1.00 73.13 H new ATOM 0 HB VAL A 49 -1.725 0.951 6.786 1.00 53.04 H new ATOM 0 HG11 VAL A 49 -1.431 -0.562 4.851 1.00 4.24 H new ATOM 0 HG12 VAL A 49 -2.024 1.045 4.369 1.00 4.24 H new ATOM 0 HG13 VAL A 49 -0.315 0.615 4.120 1.00 4.24 H new ATOM 0 HG21 VAL A 49 -0.065 -0.852 6.851 1.00 14.00 H new ATOM 0 HG22 VAL A 49 1.175 0.280 6.262 1.00 14.00 H new ATOM 0 HG23 VAL A 49 0.404 0.548 7.844 1.00 14.00 H new ATOM 176 N ALA A 50 1.121 3.052 7.809 1.00 34.22 N ATOM 177 CA ALA A 50 1.608 3.539 9.080 1.00 21.15 C ATOM 178 C ALA A 50 1.310 5.016 9.230 1.00 44.14 C ATOM 179 O ALA A 50 0.908 5.478 10.295 1.00 31.43 O ATOM 180 CB ALA A 50 3.089 3.306 9.170 1.00 1.12 C ATOM 0 H ALA A 50 1.852 2.668 7.211 1.00 34.22 H new ATOM 0 HA ALA A 50 1.104 3.000 9.882 1.00 21.15 H new ATOM 0 HB1 ALA A 50 3.457 3.673 10.128 1.00 1.12 H new ATOM 0 HB2 ALA A 50 3.295 2.239 9.086 1.00 1.12 H new ATOM 0 HB3 ALA A 50 3.591 3.837 8.361 1.00 1.12 H new ATOM 186 N LYS A 51 1.434 5.748 8.119 1.00 20.21 N ATOM 187 CA LYS A 51 1.195 7.184 8.109 1.00 0.43 C ATOM 188 C LYS A 51 -0.276 7.483 8.412 1.00 24.11 C ATOM 189 O LYS A 51 -0.614 8.522 8.985 1.00 61.31 O ATOM 190 CB LYS A 51 1.524 7.766 6.726 1.00 62.23 C ATOM 191 CG LYS A 51 2.962 7.598 6.255 1.00 13.14 C ATOM 192 CD LYS A 51 3.938 8.530 6.959 1.00 14.40 C ATOM 193 CE LYS A 51 5.346 8.308 6.424 1.00 74.51 C ATOM 194 NZ LYS A 51 6.289 9.363 6.831 1.00 33.34 N ATOM 0 H LYS A 51 1.700 5.362 7.213 1.00 20.21 H new ATOM 0 HA LYS A 51 1.832 7.635 8.870 1.00 0.43 H new ATOM 0 HB2 LYS A 51 0.866 7.301 5.992 1.00 62.23 H new ATOM 0 HB3 LYS A 51 1.288 8.830 6.736 1.00 62.23 H new ATOM 0 HG2 LYS A 51 3.273 6.566 6.419 1.00 13.14 H new ATOM 0 HG3 LYS A 51 3.009 7.778 5.181 1.00 13.14 H new ATOM 0 HD2 LYS A 51 3.640 9.567 6.804 1.00 14.40 H new ATOM 0 HD3 LYS A 51 3.916 8.349 8.034 1.00 14.40 H new ATOM 0 HE2 LYS A 51 5.714 7.344 6.775 1.00 74.51 H new ATOM 0 HE3 LYS A 51 5.312 8.259 5.336 1.00 74.51 H new ATOM 0 HZ1 LYS A 51 7.230 9.158 6.438 1.00 33.34 H new ATOM 0 HZ2 LYS A 51 5.957 10.282 6.474 1.00 33.34 H new ATOM 0 HZ3 LYS A 51 6.347 9.395 7.869 1.00 33.34 H new ATOM 208 N GLY A 52 -1.134 6.547 8.107 1.00 72.21 N ATOM 209 CA GLY A 52 -2.535 6.757 8.317 1.00 42.52 C ATOM 210 C GLY A 52 -2.951 6.315 9.677 1.00 64.02 C ATOM 211 O GLY A 52 -3.884 6.857 10.268 1.00 20.42 O ATOM 0 H GLY A 52 -0.887 5.638 7.715 1.00 72.21 H new ATOM 0 HA2 GLY A 52 -2.770 7.814 8.188 1.00 42.52 H new ATOM 0 HA3 GLY A 52 -3.104 6.210 7.565 1.00 42.52 H new ATOM 215 N ASP A 53 -2.248 5.360 10.198 1.00 40.22 N ATOM 216 CA ASP A 53 -2.574 4.812 11.484 1.00 44.23 C ATOM 217 C ASP A 53 -2.024 5.646 12.609 1.00 60.53 C ATOM 218 O ASP A 53 -2.616 5.723 13.682 1.00 43.34 O ATOM 219 CB ASP A 53 -2.268 3.326 11.563 1.00 13.54 C ATOM 220 CG ASP A 53 -3.297 2.487 10.788 1.00 22.35 C ATOM 221 OD1 ASP A 53 -3.786 2.927 9.704 1.00 4.35 O ATOM 222 OD2 ASP A 53 -3.628 1.361 11.218 1.00 0.31 O ATOM 0 H ASP A 53 -1.435 4.937 9.750 1.00 40.22 H new ATOM 0 HA ASP A 53 -3.655 4.869 11.615 1.00 44.23 H new ATOM 0 HB2 ASP A 53 -1.272 3.139 11.163 1.00 13.54 H new ATOM 0 HB3 ASP A 53 -2.256 3.013 12.607 1.00 13.54 H new ATOM 227 N ILE A 54 -0.935 6.354 12.345 1.00 31.10 N ATOM 228 CA ILE A 54 -0.452 7.345 13.300 1.00 71.21 C ATOM 229 C ILE A 54 -1.389 8.555 13.303 1.00 33.31 C ATOM 230 O ILE A 54 -1.585 9.203 14.334 1.00 42.35 O ATOM 231 CB ILE A 54 1.003 7.794 13.033 1.00 63.12 C ATOM 232 CG1 ILE A 54 1.153 8.332 11.601 1.00 52.50 C ATOM 233 CG2 ILE A 54 1.964 6.659 13.326 1.00 71.32 C ATOM 234 CD1 ILE A 54 2.556 8.703 11.197 1.00 0.31 C ATOM 0 H ILE A 54 -0.378 6.265 11.495 1.00 31.10 H new ATOM 0 HA ILE A 54 -0.449 6.868 14.280 1.00 71.21 H new ATOM 0 HB ILE A 54 1.252 8.614 13.706 1.00 63.12 H new ATOM 0 HG12 ILE A 54 0.779 7.579 10.907 1.00 52.50 H new ATOM 0 HG13 ILE A 54 0.517 9.210 11.492 1.00 52.50 H new ATOM 0 HG21 ILE A 54 2.985 6.988 13.134 1.00 71.32 H new ATOM 0 HG22 ILE A 54 1.869 6.362 14.370 1.00 71.32 H new ATOM 0 HG23 ILE A 54 1.730 5.809 12.685 1.00 71.32 H new ATOM 0 HD11 ILE A 54 2.554 9.071 10.171 1.00 0.31 H new ATOM 0 HD12 ILE A 54 2.932 9.482 11.861 1.00 0.31 H new ATOM 0 HD13 ILE A 54 3.199 7.825 11.267 1.00 0.31 H new ATOM 246 N LYS A 55 -2.012 8.832 12.144 1.00 14.23 N ATOM 247 CA LYS A 55 -3.005 9.900 12.056 1.00 20.13 C ATOM 248 C LYS A 55 -4.286 9.504 12.775 1.00 4.01 C ATOM 249 O LYS A 55 -5.049 10.362 13.225 1.00 20.32 O ATOM 250 CB LYS A 55 -3.292 10.300 10.606 1.00 4.34 C ATOM 251 CG LYS A 55 -2.120 10.983 9.909 1.00 30.30 C ATOM 252 CD LYS A 55 -1.659 12.195 10.687 1.00 24.41 C ATOM 253 CE LYS A 55 -0.485 12.889 10.029 1.00 20.45 C ATOM 254 NZ LYS A 55 -0.069 14.081 10.798 1.00 20.22 N ATOM 0 H LYS A 55 -1.844 8.334 11.270 1.00 14.23 H new ATOM 0 HA LYS A 55 -2.586 10.775 12.552 1.00 20.13 H new ATOM 0 HB2 LYS A 55 -3.568 9.409 10.042 1.00 4.34 H new ATOM 0 HB3 LYS A 55 -4.153 10.969 10.588 1.00 4.34 H new ATOM 0 HG2 LYS A 55 -1.295 10.279 9.803 1.00 30.30 H new ATOM 0 HG3 LYS A 55 -2.415 11.282 8.903 1.00 30.30 H new ATOM 0 HD2 LYS A 55 -2.486 12.898 10.783 1.00 24.41 H new ATOM 0 HD3 LYS A 55 -1.380 11.891 11.696 1.00 24.41 H new ATOM 0 HE2 LYS A 55 0.352 12.195 9.948 1.00 20.45 H new ATOM 0 HE3 LYS A 55 -0.755 13.183 9.015 1.00 20.45 H new ATOM 0 HZ1 LYS A 55 0.858 14.407 10.458 1.00 20.22 H new ATOM 0 HZ2 LYS A 55 -0.771 14.838 10.671 1.00 20.22 H new ATOM 0 HZ3 LYS A 55 -0.001 13.837 11.807 1.00 20.22 H new ATOM 268 N ALA A 56 -4.496 8.206 12.894 1.00 22.24 N ATOM 269 CA ALA A 56 -5.626 7.661 13.614 1.00 74.23 C ATOM 270 C ALA A 56 -5.447 7.905 15.098 1.00 14.22 C ATOM 271 O ALA A 56 -6.396 8.248 15.810 1.00 11.11 O ATOM 272 CB ALA A 56 -5.739 6.176 13.345 1.00 41.40 C ATOM 0 H ALA A 56 -3.882 7.498 12.491 1.00 22.24 H new ATOM 0 HA ALA A 56 -6.539 8.152 13.277 1.00 74.23 H new ATOM 0 HB1 ALA A 56 -6.592 5.771 13.890 1.00 41.40 H new ATOM 0 HB2 ALA A 56 -5.879 6.009 12.277 1.00 41.40 H new ATOM 0 HB3 ALA A 56 -4.828 5.676 13.674 1.00 41.40 H new ATOM 278 N ILE A 57 -4.222 7.743 15.553 1.00 42.33 N ATOM 279 CA ILE A 57 -3.871 7.963 16.942 1.00 75.31 C ATOM 280 C ILE A 57 -3.964 9.442 17.264 1.00 10.24 C ATOM 281 O ILE A 57 -4.359 9.811 18.337 1.00 33.54 O ATOM 282 CB ILE A 57 -2.455 7.444 17.251 1.00 0.04 C ATOM 283 CG1 ILE A 57 -2.384 5.969 16.901 1.00 2.52 C ATOM 284 CG2 ILE A 57 -2.138 7.643 18.733 1.00 12.12 C ATOM 285 CD1 ILE A 57 -1.000 5.393 16.898 1.00 21.10 C ATOM 0 H ILE A 57 -3.438 7.454 14.968 1.00 42.33 H new ATOM 0 HA ILE A 57 -4.574 7.408 17.564 1.00 75.31 H new ATOM 0 HB ILE A 57 -1.725 7.998 16.661 1.00 0.04 H new ATOM 0 HG12 ILE A 57 -2.994 5.411 17.612 1.00 2.52 H new ATOM 0 HG13 ILE A 57 -2.827 5.821 15.916 1.00 2.52 H new ATOM 0 HG21 ILE A 57 -1.134 7.273 18.943 1.00 12.12 H new ATOM 0 HG22 ILE A 57 -2.192 8.704 18.977 1.00 12.12 H new ATOM 0 HG23 ILE A 57 -2.861 7.094 19.337 1.00 12.12 H new ATOM 0 HD11 ILE A 57 -1.047 4.336 16.638 1.00 21.10 H new ATOM 0 HD12 ILE A 57 -0.388 5.920 16.166 1.00 21.10 H new ATOM 0 HD13 ILE A 57 -0.558 5.504 17.888 1.00 21.10 H new ATOM 297 N ALA A 58 -3.640 10.285 16.298 1.00 30.45 N ATOM 298 CA ALA A 58 -3.751 11.735 16.471 1.00 14.11 C ATOM 299 C ALA A 58 -5.185 12.132 16.802 1.00 11.02 C ATOM 300 O ALA A 58 -5.426 13.047 17.602 1.00 45.50 O ATOM 301 CB ALA A 58 -3.298 12.453 15.221 1.00 62.05 C ATOM 0 H ALA A 58 -3.297 9.996 15.382 1.00 30.45 H new ATOM 0 HA ALA A 58 -3.107 12.025 17.301 1.00 14.11 H new ATOM 0 HB1 ALA A 58 -3.387 13.529 15.367 1.00 62.05 H new ATOM 0 HB2 ALA A 58 -2.258 12.200 15.013 1.00 62.05 H new ATOM 0 HB3 ALA A 58 -3.921 12.148 14.380 1.00 62.05 H new ATOM 307 N ALA A 59 -6.119 11.402 16.235 1.00 54.33 N ATOM 308 CA ALA A 59 -7.514 11.660 16.430 1.00 2.54 C ATOM 309 C ALA A 59 -7.985 11.036 17.733 1.00 73.04 C ATOM 310 O ALA A 59 -8.796 11.612 18.439 1.00 13.24 O ATOM 311 CB ALA A 59 -8.322 11.126 15.256 1.00 3.21 C ATOM 0 H ALA A 59 -5.923 10.610 15.623 1.00 54.33 H new ATOM 0 HA ALA A 59 -7.667 12.738 16.487 1.00 2.54 H new ATOM 0 HB1 ALA A 59 -9.380 11.330 15.420 1.00 3.21 H new ATOM 0 HB2 ALA A 59 -7.996 11.615 14.338 1.00 3.21 H new ATOM 0 HB3 ALA A 59 -8.169 10.050 15.169 1.00 3.21 H new ATOM 317 N ALA A 60 -7.448 9.875 18.068 1.00 4.44 N ATOM 318 CA ALA A 60 -7.863 9.180 19.279 1.00 74.53 C ATOM 319 C ALA A 60 -7.203 9.760 20.527 1.00 62.21 C ATOM 320 O ALA A 60 -7.794 9.764 21.596 1.00 22.04 O ATOM 321 CB ALA A 60 -7.584 7.707 19.169 1.00 21.42 C ATOM 0 H ALA A 60 -6.730 9.396 17.525 1.00 4.44 H new ATOM 0 HA ALA A 60 -8.938 9.326 19.382 1.00 74.53 H new ATOM 0 HB1 ALA A 60 -7.902 7.207 20.084 1.00 21.42 H new ATOM 0 HB2 ALA A 60 -8.132 7.295 18.322 1.00 21.42 H new ATOM 0 HB3 ALA A 60 -6.516 7.549 19.021 1.00 21.42 H new ATOM 327 N LEU A 61 -6.025 10.310 20.389 1.00 10.03 N ATOM 328 CA LEU A 61 -5.348 10.931 21.510 1.00 44.11 C ATOM 329 C LEU A 61 -6.113 12.207 21.840 1.00 4.43 C ATOM 330 O LEU A 61 -6.235 12.606 22.991 1.00 20.33 O ATOM 331 CB LEU A 61 -3.888 11.229 21.130 1.00 5.44 C ATOM 332 CG LEU A 61 -2.818 11.064 22.231 1.00 43.14 C ATOM 333 CD1 LEU A 61 -3.026 12.003 23.384 1.00 20.33 C ATOM 334 CD2 LEU A 61 -2.795 9.659 22.740 1.00 11.22 C ATOM 0 H LEU A 61 -5.508 10.343 19.510 1.00 10.03 H new ATOM 0 HA LEU A 61 -5.327 10.277 22.382 1.00 44.11 H new ATOM 0 HB2 LEU A 61 -3.618 10.579 20.298 1.00 5.44 H new ATOM 0 HB3 LEU A 61 -3.838 12.254 20.763 1.00 5.44 H new ATOM 0 HG LEU A 61 -1.862 11.308 21.768 1.00 43.14 H new ATOM 0 HD11 LEU A 61 -2.246 11.844 24.128 1.00 20.33 H new ATOM 0 HD12 LEU A 61 -2.983 13.032 23.027 1.00 20.33 H new ATOM 0 HD13 LEU A 61 -4.001 11.816 23.834 1.00 20.33 H new ATOM 0 HD21 LEU A 61 -2.034 9.565 23.515 1.00 11.22 H new ATOM 0 HD22 LEU A 61 -3.770 9.407 23.157 1.00 11.22 H new ATOM 0 HD23 LEU A 61 -2.564 8.979 21.920 1.00 11.22 H new ATOM 346 N ASP A 62 -6.707 12.776 20.799 1.00 15.44 N ATOM 347 CA ASP A 62 -7.580 13.942 20.902 1.00 71.13 C ATOM 348 C ASP A 62 -8.910 13.534 21.573 1.00 62.33 C ATOM 349 O ASP A 62 -9.627 14.351 22.131 1.00 10.33 O ATOM 350 CB ASP A 62 -7.818 14.527 19.503 1.00 33.45 C ATOM 351 CG ASP A 62 -8.760 15.718 19.451 1.00 1.45 C ATOM 352 OD1 ASP A 62 -8.336 16.855 19.731 1.00 74.04 O ATOM 353 OD2 ASP A 62 -9.919 15.541 19.027 1.00 20.21 O ATOM 0 H ASP A 62 -6.595 12.436 19.844 1.00 15.44 H new ATOM 0 HA ASP A 62 -7.110 14.709 21.518 1.00 71.13 H new ATOM 0 HB2 ASP A 62 -6.857 14.825 19.083 1.00 33.45 H new ATOM 0 HB3 ASP A 62 -8.216 13.741 18.861 1.00 33.45 H new ATOM 358 N MET A 63 -9.197 12.249 21.559 1.00 2.21 N ATOM 359 CA MET A 63 -10.387 11.728 22.206 1.00 54.21 C ATOM 360 C MET A 63 -10.111 11.570 23.691 1.00 31.53 C ATOM 361 O MET A 63 -10.946 11.909 24.507 1.00 12.30 O ATOM 362 CB MET A 63 -10.844 10.397 21.591 1.00 23.31 C ATOM 363 CG MET A 63 -11.205 10.483 20.119 1.00 50.21 C ATOM 364 SD MET A 63 -11.527 8.869 19.374 1.00 61.03 S ATOM 365 CE MET A 63 -11.772 9.344 17.661 1.00 22.54 C ATOM 0 H MET A 63 -8.620 11.541 21.104 1.00 2.21 H new ATOM 0 HA MET A 63 -11.202 12.436 22.054 1.00 54.21 H new ATOM 0 HB2 MET A 63 -10.051 9.660 21.717 1.00 23.31 H new ATOM 0 HB3 MET A 63 -11.709 10.032 22.145 1.00 23.31 H new ATOM 0 HG2 MET A 63 -12.087 11.113 20.003 1.00 50.21 H new ATOM 0 HG3 MET A 63 -10.393 10.970 19.580 1.00 50.21 H new ATOM 0 HE1 MET A 63 -11.982 8.457 17.064 1.00 22.54 H new ATOM 0 HE2 MET A 63 -12.612 10.035 17.592 1.00 22.54 H new ATOM 0 HE3 MET A 63 -10.871 9.829 17.286 1.00 22.54 H new ATOM 375 N TYR A 64 -8.902 11.081 24.040 1.00 44.41 N ATOM 376 CA TYR A 64 -8.487 11.016 25.448 1.00 23.24 C ATOM 377 C TYR A 64 -8.388 12.451 25.968 1.00 13.43 C ATOM 378 O TYR A 64 -8.716 12.740 27.107 1.00 35.11 O ATOM 379 CB TYR A 64 -7.118 10.338 25.609 1.00 31.32 C ATOM 380 CG TYR A 64 -6.768 10.116 27.072 1.00 1.43 C ATOM 381 CD1 TYR A 64 -6.169 11.104 27.831 1.00 4.42 C ATOM 382 CD2 TYR A 64 -7.078 8.934 27.698 1.00 72.03 C ATOM 383 CE1 TYR A 64 -5.896 10.913 29.137 1.00 4.32 C ATOM 384 CE2 TYR A 64 -6.818 8.742 29.004 1.00 33.23 C ATOM 385 CZ TYR A 64 -6.220 9.733 29.723 1.00 33.22 C ATOM 386 OH TYR A 64 -6.017 9.580 31.044 1.00 51.10 O ATOM 0 H TYR A 64 -8.211 10.732 23.376 1.00 44.41 H new ATOM 0 HA TYR A 64 -9.217 10.429 26.005 1.00 23.24 H new ATOM 0 HB2 TYR A 64 -7.122 9.381 25.087 1.00 31.32 H new ATOM 0 HB3 TYR A 64 -6.350 10.953 25.141 1.00 31.32 H new ATOM 0 HD1 TYR A 64 -5.915 12.047 27.369 1.00 4.42 H new ATOM 0 HD2 TYR A 64 -7.541 8.141 27.130 1.00 72.03 H new ATOM 0 HE1 TYR A 64 -5.422 11.694 29.713 1.00 4.32 H new ATOM 0 HE2 TYR A 64 -7.081 7.809 29.479 1.00 33.23 H new ATOM 0 HH TYR A 64 -5.427 10.292 31.369 1.00 51.10 H new ATOM 396 N LYS A 65 -7.944 13.333 25.088 1.00 2.51 N ATOM 397 CA LYS A 65 -7.870 14.764 25.335 1.00 71.20 C ATOM 398 C LYS A 65 -9.231 15.306 25.776 1.00 32.33 C ATOM 399 O LYS A 65 -9.317 16.151 26.651 1.00 1.44 O ATOM 400 CB LYS A 65 -7.437 15.418 24.051 1.00 11.10 C ATOM 401 CG LYS A 65 -7.577 16.913 23.954 1.00 32.22 C ATOM 402 CD LYS A 65 -7.184 17.313 22.564 1.00 64.30 C ATOM 403 CE LYS A 65 -7.395 18.767 22.256 1.00 43.42 C ATOM 404 NZ LYS A 65 -7.100 19.014 20.833 1.00 72.00 N ATOM 0 H LYS A 65 -7.617 13.067 24.159 1.00 2.51 H new ATOM 0 HA LYS A 65 -7.160 14.976 26.134 1.00 71.20 H new ATOM 0 HB2 LYS A 65 -6.390 15.166 23.881 1.00 11.10 H new ATOM 0 HB3 LYS A 65 -8.008 14.973 23.237 1.00 11.10 H new ATOM 0 HG2 LYS A 65 -8.602 17.217 24.165 1.00 32.22 H new ATOM 0 HG3 LYS A 65 -6.941 17.406 24.689 1.00 32.22 H new ATOM 0 HD2 LYS A 65 -6.132 17.071 22.413 1.00 64.30 H new ATOM 0 HD3 LYS A 65 -7.754 16.716 21.852 1.00 64.30 H new ATOM 0 HE2 LYS A 65 -8.423 19.052 22.480 1.00 43.42 H new ATOM 0 HE3 LYS A 65 -6.749 19.381 22.884 1.00 43.42 H new ATOM 0 HZ1 LYS A 65 -7.374 19.986 20.585 1.00 72.00 H new ATOM 0 HZ2 LYS A 65 -6.082 18.887 20.662 1.00 72.00 H new ATOM 0 HZ3 LYS A 65 -7.636 18.343 20.246 1.00 72.00 H new ATOM 418 N LEU A 66 -10.286 14.826 25.161 1.00 54.53 N ATOM 419 CA LEU A 66 -11.616 15.187 25.595 1.00 10.31 C ATOM 420 C LEU A 66 -12.044 14.372 26.807 1.00 1.53 C ATOM 421 O LEU A 66 -12.754 14.882 27.674 1.00 43.43 O ATOM 422 CB LEU A 66 -12.659 15.072 24.470 1.00 0.11 C ATOM 423 CG LEU A 66 -12.873 16.312 23.582 1.00 30.34 C ATOM 424 CD1 LEU A 66 -11.603 16.743 22.864 1.00 42.03 C ATOM 425 CD2 LEU A 66 -13.995 16.063 22.589 1.00 41.14 C ATOM 0 H LEU A 66 -10.251 14.189 24.365 1.00 54.53 H new ATOM 0 HA LEU A 66 -11.569 16.237 25.882 1.00 10.31 H new ATOM 0 HB2 LEU A 66 -12.372 14.241 23.826 1.00 0.11 H new ATOM 0 HB3 LEU A 66 -13.616 14.810 24.921 1.00 0.11 H new ATOM 0 HG LEU A 66 -13.155 17.134 24.240 1.00 30.34 H new ATOM 0 HD11 LEU A 66 -11.811 17.621 22.252 1.00 42.03 H new ATOM 0 HD12 LEU A 66 -10.835 16.986 23.598 1.00 42.03 H new ATOM 0 HD13 LEU A 66 -11.252 15.931 22.226 1.00 42.03 H new ATOM 0 HD21 LEU A 66 -14.135 16.948 21.968 1.00 41.14 H new ATOM 0 HD22 LEU A 66 -13.739 15.213 21.956 1.00 41.14 H new ATOM 0 HD23 LEU A 66 -14.918 15.849 23.129 1.00 41.14 H new ATOM 437 N ASP A 67 -11.576 13.123 26.896 1.00 42.24 N ATOM 438 CA ASP A 67 -11.971 12.243 28.006 1.00 74.44 C ATOM 439 C ASP A 67 -11.371 12.702 29.314 1.00 74.40 C ATOM 440 O ASP A 67 -11.939 12.500 30.333 1.00 45.12 O ATOM 441 CB ASP A 67 -11.541 10.785 27.719 1.00 14.43 C ATOM 442 CG ASP A 67 -11.979 9.794 28.800 1.00 22.42 C ATOM 443 OD1 ASP A 67 -13.192 9.522 28.912 1.00 24.45 O ATOM 444 OD2 ASP A 67 -11.107 9.272 29.543 1.00 61.04 O ATOM 0 H ASP A 67 -10.933 12.701 26.226 1.00 42.24 H new ATOM 0 HA ASP A 67 -13.057 12.289 28.092 1.00 74.44 H new ATOM 0 HB2 ASP A 67 -11.958 10.474 26.761 1.00 14.43 H new ATOM 0 HB3 ASP A 67 -10.456 10.747 27.621 1.00 14.43 H new ATOM 449 N ASN A 68 -10.282 13.423 29.279 1.00 15.23 N ATOM 450 CA ASN A 68 -9.702 13.947 30.532 1.00 65.11 C ATOM 451 C ASN A 68 -9.472 15.385 30.438 1.00 13.51 C ATOM 452 O ASN A 68 -8.721 15.926 31.256 1.00 21.43 O ATOM 453 CB ASN A 68 -8.384 13.303 30.957 1.00 24.20 C ATOM 454 CG ASN A 68 -8.410 11.822 31.361 1.00 33.13 C ATOM 455 OD1 ASN A 68 -9.179 11.017 30.697 1.00 31.00 O flip ATOM 456 ND2 ASN A 68 -7.654 11.405 32.245 1.00 23.14 N flip ATOM 0 H ASN A 68 -9.773 13.668 28.430 1.00 15.23 H new ATOM 0 HA ASN A 68 -10.448 13.699 31.286 1.00 65.11 H new ATOM 0 HB2 ASN A 68 -7.676 13.414 30.135 1.00 24.20 H new ATOM 0 HB3 ASN A 68 -7.988 13.873 31.798 1.00 24.20 H new ATOM 0 HD21 ASN A 68 -7.057 12.056 32.755 1.00 23.14 H new ATOM 0 HD22 ASN A 68 -7.627 10.409 32.465 1.00 23.14 H new ATOM 463 N PHE A 69 -10.158 16.034 29.471 1.00 53.24 N ATOM 464 CA PHE A 69 -10.094 17.499 29.227 1.00 3.31 C ATOM 465 C PHE A 69 -8.672 18.055 29.285 1.00 43.44 C ATOM 466 O PHE A 69 -8.444 19.232 29.619 1.00 23.10 O ATOM 467 CB PHE A 69 -11.053 18.238 30.169 1.00 50.41 C ATOM 468 CG PHE A 69 -11.007 17.805 31.604 1.00 34.43 C ATOM 469 CD1 PHE A 69 -10.083 18.301 32.443 1.00 2.12 C ATOM 470 CD2 PHE A 69 -11.908 16.912 32.079 1.00 73.22 C ATOM 471 CE1 PHE A 69 -10.037 17.928 33.752 1.00 1.12 C ATOM 472 CE2 PHE A 69 -11.901 16.521 33.379 1.00 54.34 C ATOM 473 CZ PHE A 69 -10.960 17.036 34.236 1.00 41.31 C ATOM 0 H PHE A 69 -10.783 15.550 28.826 1.00 53.24 H new ATOM 0 HA PHE A 69 -10.423 17.674 28.203 1.00 3.31 H new ATOM 0 HB2 PHE A 69 -10.832 19.304 30.122 1.00 50.41 H new ATOM 0 HB3 PHE A 69 -12.070 18.107 29.800 1.00 50.41 H new ATOM 0 HD1 PHE A 69 -9.360 19.012 32.071 1.00 2.12 H new ATOM 0 HD2 PHE A 69 -12.649 16.502 31.408 1.00 73.22 H new ATOM 0 HE1 PHE A 69 -9.278 18.332 34.405 1.00 1.12 H new ATOM 0 HE2 PHE A 69 -12.631 15.810 33.737 1.00 54.34 H new ATOM 0 HZ PHE A 69 -10.947 16.743 35.275 1.00 41.31 H new ATOM 483 N ALA A 70 -7.748 17.235 28.843 1.00 13.25 N ATOM 484 CA ALA A 70 -6.351 17.490 28.929 1.00 51.40 C ATOM 485 C ALA A 70 -5.625 16.313 28.343 1.00 2.13 C ATOM 486 O ALA A 70 -6.177 15.200 28.301 1.00 74.41 O ATOM 487 CB ALA A 70 -5.965 17.641 30.399 1.00 74.14 C ATOM 0 H ALA A 70 -7.968 16.343 28.400 1.00 13.25 H new ATOM 0 HA ALA A 70 -6.092 18.401 28.389 1.00 51.40 H new ATOM 0 HB1 ALA A 70 -4.896 17.837 30.476 1.00 74.14 H new ATOM 0 HB2 ALA A 70 -6.518 18.472 30.837 1.00 74.14 H new ATOM 0 HB3 ALA A 70 -6.205 16.722 30.934 1.00 74.14 H new ATOM 493 N TYR A 71 -4.447 16.552 27.836 1.00 14.41 N ATOM 494 CA TYR A 71 -3.597 15.487 27.399 1.00 54.22 C ATOM 495 C TYR A 71 -2.948 14.786 28.594 1.00 1.32 C ATOM 496 O TYR A 71 -2.677 15.423 29.632 1.00 62.45 O ATOM 497 CB TYR A 71 -2.532 15.976 26.419 1.00 15.23 C ATOM 498 CG TYR A 71 -3.033 16.180 25.018 1.00 61.34 C ATOM 499 CD1 TYR A 71 -3.581 15.126 24.317 1.00 33.44 C ATOM 500 CD2 TYR A 71 -2.926 17.393 24.387 1.00 23.21 C ATOM 501 CE1 TYR A 71 -4.015 15.264 23.027 1.00 31.12 C ATOM 502 CE2 TYR A 71 -3.343 17.551 23.084 1.00 73.41 C ATOM 503 CZ TYR A 71 -3.888 16.486 22.401 1.00 65.01 C ATOM 504 OH TYR A 71 -4.284 16.643 21.074 1.00 24.13 O ATOM 0 H TYR A 71 -4.054 17.486 27.716 1.00 14.41 H new ATOM 0 HA TYR A 71 -4.223 14.768 26.871 1.00 54.22 H new ATOM 0 HB2 TYR A 71 -2.120 16.916 26.786 1.00 15.23 H new ATOM 0 HB3 TYR A 71 -1.714 15.256 26.399 1.00 15.23 H new ATOM 0 HD1 TYR A 71 -3.670 14.164 24.800 1.00 33.44 H new ATOM 0 HD2 TYR A 71 -2.509 18.235 24.919 1.00 23.21 H new ATOM 0 HE1 TYR A 71 -4.452 14.426 22.505 1.00 31.12 H new ATOM 0 HE2 TYR A 71 -3.243 18.510 22.598 1.00 73.41 H new ATOM 0 HH TYR A 71 -3.543 17.018 20.554 1.00 24.13 H new ATOM 514 N PRO A 72 -2.688 13.476 28.455 1.00 33.14 N ATOM 515 CA PRO A 72 -2.083 12.642 29.512 1.00 3.22 C ATOM 516 C PRO A 72 -0.674 13.136 29.898 1.00 44.23 C ATOM 517 O PRO A 72 -0.066 13.887 29.151 1.00 11.43 O ATOM 518 CB PRO A 72 -1.976 11.265 28.818 1.00 42.14 C ATOM 519 CG PRO A 72 -2.026 11.547 27.371 1.00 14.21 C ATOM 520 CD PRO A 72 -2.947 12.692 27.234 1.00 52.40 C ATOM 0 HA PRO A 72 -2.662 12.648 30.436 1.00 3.22 H new ATOM 0 HB2 PRO A 72 -1.048 10.761 29.088 1.00 42.14 H new ATOM 0 HB3 PRO A 72 -2.794 10.610 29.118 1.00 42.14 H new ATOM 0 HG2 PRO A 72 -1.037 11.788 26.982 1.00 14.21 H new ATOM 0 HG3 PRO A 72 -2.386 10.683 26.813 1.00 14.21 H new ATOM 0 HD2 PRO A 72 -2.741 13.269 26.333 1.00 52.40 H new ATOM 0 HD3 PRO A 72 -3.986 12.369 27.175 1.00 52.40 H new ATOM 528 N SER A 73 -0.158 12.731 31.046 1.00 62.31 N ATOM 529 CA SER A 73 1.190 13.099 31.401 1.00 65.40 C ATOM 530 C SER A 73 2.071 11.937 31.014 1.00 75.23 C ATOM 531 O SER A 73 1.575 10.822 30.904 1.00 30.10 O ATOM 532 CB SER A 73 1.273 13.397 32.888 1.00 61.12 C ATOM 533 OG SER A 73 0.790 12.301 33.635 1.00 12.23 O ATOM 0 H SER A 73 -0.647 12.157 31.733 1.00 62.31 H new ATOM 0 HA SER A 73 1.513 14.002 30.882 1.00 65.40 H new ATOM 0 HB2 SER A 73 2.305 13.609 33.166 1.00 61.12 H new ATOM 0 HB3 SER A 73 0.691 14.289 33.120 1.00 61.12 H new ATOM 0 HG SER A 73 1.010 12.428 34.582 1.00 12.23 H new ATOM 539 N THR A 74 3.339 12.147 30.778 1.00 11.03 N ATOM 540 CA THR A 74 4.169 11.063 30.306 1.00 23.33 C ATOM 541 C THR A 74 4.374 9.993 31.420 1.00 20.04 C ATOM 542 O THR A 74 4.876 8.880 31.174 1.00 41.15 O ATOM 543 CB THR A 74 5.508 11.586 29.710 1.00 31.24 C ATOM 544 OG1 THR A 74 5.987 10.663 28.708 1.00 61.21 O ATOM 545 CG2 THR A 74 6.568 11.774 30.802 1.00 52.24 C ATOM 0 H THR A 74 3.816 13.040 30.901 1.00 11.03 H new ATOM 0 HA THR A 74 3.650 10.566 29.487 1.00 23.33 H new ATOM 0 HB THR A 74 5.323 12.558 29.253 1.00 31.24 H new ATOM 0 HG1 THR A 74 6.829 10.995 28.333 1.00 61.21 H new ATOM 0 HG21 THR A 74 7.492 12.140 30.353 1.00 52.24 H new ATOM 0 HG22 THR A 74 6.210 12.496 31.536 1.00 52.24 H new ATOM 0 HG23 THR A 74 6.757 10.820 31.294 1.00 52.24 H new ATOM 553 N GLN A 75 3.988 10.338 32.635 1.00 13.41 N ATOM 554 CA GLN A 75 4.001 9.406 33.710 1.00 74.40 C ATOM 555 C GLN A 75 2.581 8.886 34.007 1.00 40.44 C ATOM 556 O GLN A 75 2.261 7.733 33.672 1.00 12.31 O ATOM 557 CB GLN A 75 4.650 10.027 34.937 1.00 71.21 C ATOM 558 CG GLN A 75 6.128 10.326 34.763 1.00 34.10 C ATOM 559 CD GLN A 75 6.715 11.077 35.936 1.00 2.13 C ATOM 560 OE1 GLN A 75 7.194 10.479 36.900 1.00 75.43 O ATOM 561 NE2 GLN A 75 6.683 12.381 35.871 1.00 11.14 N ATOM 0 H GLN A 75 3.661 11.271 32.887 1.00 13.41 H new ATOM 0 HA GLN A 75 4.600 8.543 33.420 1.00 74.40 H new ATOM 0 HB2 GLN A 75 4.128 10.952 35.184 1.00 71.21 H new ATOM 0 HB3 GLN A 75 4.522 9.353 35.784 1.00 71.21 H new ATOM 0 HG2 GLN A 75 6.670 9.390 34.629 1.00 34.10 H new ATOM 0 HG3 GLN A 75 6.271 10.911 33.854 1.00 34.10 H new ATOM 0 HE21 GLN A 75 6.278 12.841 35.056 1.00 11.14 H new ATOM 0 HE22 GLN A 75 7.063 12.939 36.635 1.00 11.14 H new ATOM 570 N GLN A 76 1.684 9.769 34.474 1.00 42.20 N ATOM 571 CA GLN A 76 0.346 9.337 34.903 1.00 31.34 C ATOM 572 C GLN A 76 -0.514 9.066 33.722 1.00 14.41 C ATOM 573 O GLN A 76 -1.238 8.072 33.699 1.00 72.40 O ATOM 574 CB GLN A 76 -0.331 10.373 35.802 1.00 11.33 C ATOM 575 CG GLN A 76 0.415 10.702 37.079 1.00 32.04 C ATOM 576 CD GLN A 76 -0.285 11.776 37.891 1.00 32.41 C ATOM 577 OE1 GLN A 76 -0.976 12.645 37.345 1.00 35.40 O ATOM 578 NE2 GLN A 76 -0.124 11.731 39.188 1.00 44.23 N ATOM 0 H GLN A 76 1.857 10.770 34.563 1.00 42.20 H new ATOM 0 HA GLN A 76 0.475 8.422 35.482 1.00 31.34 H new ATOM 0 HB2 GLN A 76 -0.467 11.292 35.232 1.00 11.33 H new ATOM 0 HB3 GLN A 76 -1.325 10.010 36.064 1.00 11.33 H new ATOM 0 HG2 GLN A 76 0.515 9.800 37.682 1.00 32.04 H new ATOM 0 HG3 GLN A 76 1.424 11.034 36.833 1.00 32.04 H new ATOM 0 HE21 GLN A 76 0.453 11.000 39.605 1.00 44.23 H new ATOM 0 HE22 GLN A 76 -0.575 12.426 39.782 1.00 44.23 H new ATOM 587 N GLY A 77 -0.406 9.912 32.713 1.00 32.34 N ATOM 588 CA GLY A 77 -1.209 9.726 31.569 1.00 13.35 C ATOM 589 C GLY A 77 -0.746 8.585 30.702 1.00 13.14 C ATOM 590 O GLY A 77 -1.518 8.069 29.937 1.00 32.21 O ATOM 0 H GLY A 77 0.224 10.713 32.683 1.00 32.34 H new ATOM 0 HA2 GLY A 77 -2.238 9.544 31.880 1.00 13.35 H new ATOM 0 HA3 GLY A 77 -1.211 10.644 30.981 1.00 13.35 H new ATOM 594 N LEU A 78 0.510 8.174 30.831 1.00 41.54 N ATOM 595 CA LEU A 78 0.993 7.038 30.058 1.00 24.32 C ATOM 596 C LEU A 78 0.301 5.811 30.608 1.00 14.23 C ATOM 597 O LEU A 78 -0.283 5.003 29.869 1.00 32.52 O ATOM 598 CB LEU A 78 2.536 6.921 30.148 1.00 2.43 C ATOM 599 CG LEU A 78 3.255 5.965 29.153 1.00 15.13 C ATOM 600 CD1 LEU A 78 4.746 6.195 29.205 1.00 33.12 C ATOM 601 CD2 LEU A 78 2.975 4.494 29.448 1.00 1.12 C ATOM 0 H LEU A 78 1.199 8.600 31.450 1.00 41.54 H new ATOM 0 HA LEU A 78 0.764 7.157 28.999 1.00 24.32 H new ATOM 0 HB2 LEU A 78 2.955 7.918 30.015 1.00 2.43 H new ATOM 0 HB3 LEU A 78 2.788 6.602 31.159 1.00 2.43 H new ATOM 0 HG LEU A 78 2.864 6.190 28.161 1.00 15.13 H new ATOM 0 HD11 LEU A 78 5.243 5.522 28.506 1.00 33.12 H new ATOM 0 HD12 LEU A 78 4.965 7.227 28.932 1.00 33.12 H new ATOM 0 HD13 LEU A 78 5.109 6.002 30.214 1.00 33.12 H new ATOM 0 HD21 LEU A 78 3.501 3.871 28.724 1.00 1.12 H new ATOM 0 HD22 LEU A 78 3.320 4.252 30.453 1.00 1.12 H new ATOM 0 HD23 LEU A 78 1.904 4.306 29.378 1.00 1.12 H new ATOM 613 N GLU A 79 0.277 5.723 31.920 1.00 20.13 N ATOM 614 CA GLU A 79 -0.407 4.646 32.575 1.00 54.30 C ATOM 615 C GLU A 79 -1.892 4.821 32.525 1.00 2.14 C ATOM 616 O GLU A 79 -2.615 3.933 32.888 1.00 30.13 O ATOM 617 CB GLU A 79 0.068 4.437 33.989 1.00 44.12 C ATOM 618 CG GLU A 79 1.459 3.908 34.032 1.00 21.03 C ATOM 619 CD GLU A 79 1.866 3.466 35.389 1.00 12.30 C ATOM 620 OE1 GLU A 79 2.060 4.308 36.281 1.00 60.53 O ATOM 621 OE2 GLU A 79 1.974 2.237 35.593 1.00 64.44 O ATOM 0 H GLU A 79 0.726 6.389 32.549 1.00 20.13 H new ATOM 0 HA GLU A 79 -0.159 3.742 32.019 1.00 54.30 H new ATOM 0 HB2 GLU A 79 0.021 5.381 34.532 1.00 44.12 H new ATOM 0 HB3 GLU A 79 -0.601 3.743 34.498 1.00 44.12 H new ATOM 0 HG2 GLU A 79 1.545 3.069 33.341 1.00 21.03 H new ATOM 0 HG3 GLU A 79 2.147 4.679 33.685 1.00 21.03 H new ATOM 628 N ALA A 80 -2.329 5.964 32.075 1.00 1.33 N ATOM 629 CA ALA A 80 -3.729 6.226 31.876 1.00 53.33 C ATOM 630 C ALA A 80 -4.107 5.993 30.414 1.00 62.11 C ATOM 631 O ALA A 80 -5.254 6.100 30.031 1.00 60.13 O ATOM 632 CB ALA A 80 -4.080 7.620 32.319 1.00 71.13 C ATOM 0 H ALA A 80 -1.720 6.746 31.834 1.00 1.33 H new ATOM 0 HA ALA A 80 -4.306 5.533 32.489 1.00 53.33 H new ATOM 0 HB1 ALA A 80 -5.144 7.796 32.159 1.00 71.13 H new ATOM 0 HB2 ALA A 80 -3.849 7.734 33.378 1.00 71.13 H new ATOM 0 HB3 ALA A 80 -3.502 8.342 31.741 1.00 71.13 H new ATOM 638 N LEU A 81 -3.104 5.728 29.594 1.00 70.43 N ATOM 639 CA LEU A 81 -3.327 5.332 28.213 1.00 61.34 C ATOM 640 C LEU A 81 -3.313 3.824 28.131 1.00 35.41 C ATOM 641 O LEU A 81 -3.768 3.235 27.158 1.00 70.43 O ATOM 642 CB LEU A 81 -2.243 5.893 27.269 1.00 54.45 C ATOM 643 CG LEU A 81 -2.224 7.407 27.029 1.00 5.32 C ATOM 644 CD1 LEU A 81 -1.032 7.790 26.150 1.00 22.22 C ATOM 645 CD2 LEU A 81 -3.526 7.862 26.378 1.00 5.53 C ATOM 0 H LEU A 81 -2.121 5.780 29.863 1.00 70.43 H new ATOM 0 HA LEU A 81 -4.289 5.735 27.897 1.00 61.34 H new ATOM 0 HB2 LEU A 81 -1.270 5.604 27.666 1.00 54.45 H new ATOM 0 HB3 LEU A 81 -2.352 5.401 26.302 1.00 54.45 H new ATOM 0 HG LEU A 81 -2.125 7.907 27.992 1.00 5.32 H new ATOM 0 HD11 LEU A 81 -1.031 8.868 25.988 1.00 22.22 H new ATOM 0 HD12 LEU A 81 -0.106 7.497 26.645 1.00 22.22 H new ATOM 0 HD13 LEU A 81 -1.108 7.279 25.190 1.00 22.22 H new ATOM 0 HD21 LEU A 81 -3.494 8.939 26.215 1.00 5.53 H new ATOM 0 HD22 LEU A 81 -3.652 7.354 25.422 1.00 5.53 H new ATOM 0 HD23 LEU A 81 -4.364 7.618 27.031 1.00 5.53 H new ATOM 657 N VAL A 82 -2.727 3.205 29.133 1.00 24.41 N ATOM 658 CA VAL A 82 -2.647 1.754 29.190 1.00 52.14 C ATOM 659 C VAL A 82 -3.619 1.193 30.232 1.00 43.55 C ATOM 660 O VAL A 82 -4.325 0.211 29.976 1.00 54.34 O ATOM 661 CB VAL A 82 -1.215 1.296 29.494 1.00 44.23 C ATOM 662 CG1 VAL A 82 -1.090 -0.220 29.401 1.00 41.54 C ATOM 663 CG2 VAL A 82 -0.248 1.982 28.550 1.00 45.30 C ATOM 0 H VAL A 82 -2.296 3.683 29.924 1.00 24.41 H new ATOM 0 HA VAL A 82 -2.931 1.366 28.212 1.00 52.14 H new ATOM 0 HB VAL A 82 -0.967 1.578 30.517 1.00 44.23 H new ATOM 0 HG11 VAL A 82 -0.064 -0.515 29.621 1.00 41.54 H new ATOM 0 HG12 VAL A 82 -1.764 -0.685 30.120 1.00 41.54 H new ATOM 0 HG13 VAL A 82 -1.353 -0.546 28.395 1.00 41.54 H new ATOM 0 HG21 VAL A 82 0.768 1.654 28.769 1.00 45.30 H new ATOM 0 HG22 VAL A 82 -0.499 1.724 27.521 1.00 45.30 H new ATOM 0 HG23 VAL A 82 -0.317 3.062 28.680 1.00 45.30 H new ATOM 673 N LYS A 83 -3.654 1.813 31.389 1.00 53.34 N ATOM 674 CA LYS A 83 -4.580 1.452 32.437 1.00 23.31 C ATOM 675 C LYS A 83 -5.620 2.552 32.551 1.00 12.33 C ATOM 676 O LYS A 83 -5.319 3.698 32.265 1.00 35.31 O ATOM 677 CB LYS A 83 -3.877 1.218 33.804 1.00 63.11 C ATOM 678 CG LYS A 83 -3.169 -0.131 33.962 1.00 73.23 C ATOM 679 CD LYS A 83 -1.741 -0.147 33.431 1.00 51.31 C ATOM 680 CE LYS A 83 -0.814 0.704 34.295 1.00 24.33 C ATOM 681 NZ LYS A 83 0.614 0.532 33.936 1.00 52.12 N ATOM 0 H LYS A 83 -3.036 2.588 31.631 1.00 53.34 H new ATOM 0 HA LYS A 83 -5.050 0.504 32.174 1.00 23.31 H new ATOM 0 HB2 LYS A 83 -3.146 2.012 33.957 1.00 63.11 H new ATOM 0 HB3 LYS A 83 -4.620 1.313 34.595 1.00 63.11 H new ATOM 0 HG2 LYS A 83 -3.156 -0.402 35.018 1.00 73.23 H new ATOM 0 HG3 LYS A 83 -3.747 -0.896 33.444 1.00 73.23 H new ATOM 0 HD2 LYS A 83 -1.374 -1.173 33.402 1.00 51.31 H new ATOM 0 HD3 LYS A 83 -1.728 0.225 32.406 1.00 51.31 H new ATOM 0 HE2 LYS A 83 -1.088 1.754 34.190 1.00 24.33 H new ATOM 0 HE3 LYS A 83 -0.956 0.440 35.343 1.00 24.33 H new ATOM 0 HZ1 LYS A 83 1.210 1.008 34.644 1.00 52.12 H new ATOM 0 HZ2 LYS A 83 0.846 -0.481 33.913 1.00 52.12 H new ATOM 0 HZ3 LYS A 83 0.789 0.949 32.999 1.00 52.12 H new ATOM 695 N LYS A 84 -6.831 2.195 32.929 1.00 40.43 N ATOM 696 CA LYS A 84 -7.947 3.115 33.037 1.00 64.02 C ATOM 697 C LYS A 84 -7.566 4.293 33.951 1.00 72.12 C ATOM 698 O LYS A 84 -7.025 4.078 35.045 1.00 33.40 O ATOM 699 CB LYS A 84 -9.068 2.307 33.622 1.00 1.42 C ATOM 700 CG LYS A 84 -10.416 2.949 33.682 1.00 74.24 C ATOM 701 CD LYS A 84 -11.400 1.927 34.172 1.00 71.20 C ATOM 702 CE LYS A 84 -11.188 1.575 35.644 1.00 43.44 C ATOM 703 NZ LYS A 84 -12.081 0.487 36.081 1.00 51.23 N ATOM 0 H LYS A 84 -7.073 1.235 33.175 1.00 40.43 H new ATOM 0 HA LYS A 84 -8.232 3.545 32.077 1.00 64.02 H new ATOM 0 HB2 LYS A 84 -9.158 1.387 33.045 1.00 1.42 H new ATOM 0 HB3 LYS A 84 -8.785 2.021 34.635 1.00 1.42 H new ATOM 0 HG2 LYS A 84 -10.398 3.810 34.350 1.00 74.24 H new ATOM 0 HG3 LYS A 84 -10.707 3.315 32.698 1.00 74.24 H new ATOM 0 HD2 LYS A 84 -12.413 2.306 34.034 1.00 71.20 H new ATOM 0 HD3 LYS A 84 -11.312 1.023 33.569 1.00 71.20 H new ATOM 0 HE2 LYS A 84 -10.151 1.279 35.801 1.00 43.44 H new ATOM 0 HE3 LYS A 84 -11.364 2.458 36.258 1.00 43.44 H new ATOM 0 HZ1 LYS A 84 -11.907 0.277 37.085 1.00 51.23 H new ATOM 0 HZ2 LYS A 84 -13.071 0.779 35.955 1.00 51.23 H new ATOM 0 HZ3 LYS A 84 -11.896 -0.364 35.512 1.00 51.23 H new ATOM 717 N PRO A 85 -7.858 5.535 33.512 1.00 51.41 N ATOM 718 CA PRO A 85 -7.417 6.748 34.176 1.00 24.34 C ATOM 719 C PRO A 85 -7.819 6.813 35.626 1.00 72.21 C ATOM 720 O PRO A 85 -9.010 6.763 35.986 1.00 63.13 O ATOM 721 CB PRO A 85 -8.064 7.881 33.380 1.00 1.13 C ATOM 722 CG PRO A 85 -9.157 7.230 32.624 1.00 13.03 C ATOM 723 CD PRO A 85 -8.674 5.846 32.345 1.00 3.42 C ATOM 0 HA PRO A 85 -6.329 6.804 34.193 1.00 24.34 H new ATOM 0 HB2 PRO A 85 -8.447 8.660 34.039 1.00 1.13 H new ATOM 0 HB3 PRO A 85 -7.346 8.355 32.710 1.00 1.13 H new ATOM 0 HG2 PRO A 85 -10.081 7.215 33.203 1.00 13.03 H new ATOM 0 HG3 PRO A 85 -9.369 7.766 31.699 1.00 13.03 H new ATOM 0 HD2 PRO A 85 -9.502 5.146 32.235 1.00 3.42 H new ATOM 0 HD3 PRO A 85 -8.093 5.801 31.424 1.00 3.42 H new ATOM 731 N THR A 86 -6.831 6.922 36.451 1.00 61.53 N ATOM 732 CA THR A 86 -7.021 6.989 37.872 1.00 11.42 C ATOM 733 C THR A 86 -7.254 8.463 38.285 1.00 64.23 C ATOM 734 O THR A 86 -7.496 8.777 39.455 1.00 45.24 O ATOM 735 CB THR A 86 -5.783 6.365 38.598 1.00 73.41 C ATOM 736 OG1 THR A 86 -6.036 6.163 40.003 1.00 72.52 O ATOM 737 CG2 THR A 86 -4.542 7.238 38.419 1.00 52.10 C ATOM 0 H THR A 86 -5.855 6.968 36.159 1.00 61.53 H new ATOM 0 HA THR A 86 -7.899 6.414 38.167 1.00 11.42 H new ATOM 0 HB THR A 86 -5.602 5.394 38.138 1.00 73.41 H new ATOM 0 HG1 THR A 86 -6.567 6.910 40.350 1.00 72.52 H new ATOM 0 HG21 THR A 86 -3.698 6.780 38.934 1.00 52.10 H new ATOM 0 HG22 THR A 86 -4.313 7.331 37.357 1.00 52.10 H new ATOM 0 HG23 THR A 86 -4.729 8.227 38.838 1.00 52.10 H new ATOM 745 N GLY A 87 -7.183 9.346 37.298 1.00 1.05 N ATOM 746 CA GLY A 87 -7.429 10.754 37.509 1.00 2.52 C ATOM 747 C GLY A 87 -8.904 11.067 37.376 1.00 32.33 C ATOM 748 O GLY A 87 -9.741 10.221 37.682 1.00 0.30 O ATOM 0 H GLY A 87 -6.954 9.101 36.335 1.00 1.05 H new ATOM 0 HA2 GLY A 87 -7.079 11.045 38.499 1.00 2.52 H new ATOM 0 HA3 GLY A 87 -6.862 11.339 36.786 1.00 2.52 H new ATOM 752 N ASN A 88 -9.237 12.243 36.903 1.00 73.03 N ATOM 753 CA ASN A 88 -10.641 12.619 36.757 1.00 62.52 C ATOM 754 C ASN A 88 -10.986 12.824 35.293 1.00 32.44 C ATOM 755 O ASN A 88 -10.627 13.848 34.707 1.00 63.23 O ATOM 756 CB ASN A 88 -10.975 13.901 37.542 1.00 34.01 C ATOM 757 CG ASN A 88 -10.682 13.807 39.022 1.00 41.05 C ATOM 758 OD1 ASN A 88 -11.518 13.359 39.814 1.00 32.54 O ATOM 759 ND2 ASN A 88 -9.518 14.258 39.420 1.00 22.13 N ATOM 0 H ASN A 88 -8.570 12.957 36.612 1.00 73.03 H new ATOM 0 HA ASN A 88 -11.236 11.802 37.165 1.00 62.52 H new ATOM 0 HB2 ASN A 88 -10.408 14.731 37.121 1.00 34.01 H new ATOM 0 HB3 ASN A 88 -12.031 14.135 37.405 1.00 34.01 H new ATOM 0 HD21 ASN A 88 -9.278 14.246 40.411 1.00 22.13 H new ATOM 0 HD22 ASN A 88 -8.852 14.621 38.738 1.00 22.13 H new ATOM 766 N PRO A 89 -11.595 11.831 34.646 1.00 65.11 N ATOM 767 CA PRO A 89 -12.031 11.940 33.276 1.00 50.13 C ATOM 768 C PRO A 89 -13.568 12.166 33.145 1.00 15.44 C ATOM 769 O PRO A 89 -14.337 11.946 34.095 1.00 71.53 O ATOM 770 CB PRO A 89 -11.630 10.565 32.724 1.00 42.33 C ATOM 771 CG PRO A 89 -11.759 9.623 33.897 1.00 63.33 C ATOM 772 CD PRO A 89 -11.840 10.479 35.154 1.00 32.22 C ATOM 0 HA PRO A 89 -11.596 12.792 32.754 1.00 50.13 H new ATOM 0 HB2 PRO A 89 -12.280 10.264 31.902 1.00 42.33 H new ATOM 0 HB3 PRO A 89 -10.611 10.577 32.337 1.00 42.33 H new ATOM 0 HG2 PRO A 89 -12.649 9.002 33.796 1.00 63.33 H new ATOM 0 HG3 PRO A 89 -10.904 8.949 33.945 1.00 63.33 H new ATOM 0 HD2 PRO A 89 -12.815 10.399 35.635 1.00 32.22 H new ATOM 0 HD3 PRO A 89 -11.095 10.184 35.893 1.00 32.22 H new ATOM 780 N GLN A 90 -13.988 12.630 31.990 1.00 3.11 N ATOM 781 CA GLN A 90 -15.391 12.793 31.674 1.00 0.11 C ATOM 782 C GLN A 90 -15.736 11.673 30.721 1.00 22.23 C ATOM 783 O GLN A 90 -15.511 11.806 29.531 1.00 74.41 O ATOM 784 CB GLN A 90 -15.671 14.129 30.989 1.00 2.35 C ATOM 785 CG GLN A 90 -15.273 15.348 31.780 1.00 4.21 C ATOM 786 CD GLN A 90 -15.613 16.624 31.044 1.00 3.44 C ATOM 787 OE1 GLN A 90 -16.699 17.184 31.209 1.00 64.14 O ATOM 788 NE2 GLN A 90 -14.726 17.064 30.195 1.00 3.31 N ATOM 0 H GLN A 90 -13.360 12.908 31.236 1.00 3.11 H new ATOM 0 HA GLN A 90 -15.983 12.771 32.589 1.00 0.11 H new ATOM 0 HB2 GLN A 90 -15.146 14.147 30.034 1.00 2.35 H new ATOM 0 HB3 GLN A 90 -16.737 14.190 30.768 1.00 2.35 H new ATOM 0 HG2 GLN A 90 -15.780 15.338 32.745 1.00 4.21 H new ATOM 0 HG3 GLN A 90 -14.202 15.318 31.982 1.00 4.21 H new ATOM 0 HE21 GLN A 90 -13.838 16.574 30.085 1.00 3.31 H new ATOM 0 HE22 GLN A 90 -14.920 17.898 29.641 1.00 3.31 H new ATOM 797 N PRO A 91 -16.323 10.600 31.238 1.00 4.53 N ATOM 798 CA PRO A 91 -16.501 9.312 30.544 1.00 60.32 C ATOM 799 C PRO A 91 -16.811 9.295 29.026 1.00 34.13 C ATOM 800 O PRO A 91 -17.948 9.572 28.581 1.00 42.32 O ATOM 801 CB PRO A 91 -17.613 8.646 31.325 1.00 2.01 C ATOM 802 CG PRO A 91 -17.404 9.118 32.716 1.00 64.23 C ATOM 803 CD PRO A 91 -16.896 10.532 32.606 1.00 1.14 C ATOM 0 HA PRO A 91 -15.534 8.810 30.535 1.00 60.32 H new ATOM 0 HB2 PRO A 91 -18.594 8.935 30.948 1.00 2.01 H new ATOM 0 HB3 PRO A 91 -17.553 7.560 31.258 1.00 2.01 H new ATOM 0 HG2 PRO A 91 -18.334 9.081 33.284 1.00 64.23 H new ATOM 0 HG3 PRO A 91 -16.686 8.486 33.238 1.00 64.23 H new ATOM 0 HD2 PRO A 91 -17.699 11.257 32.739 1.00 1.14 H new ATOM 0 HD3 PRO A 91 -16.144 10.747 33.365 1.00 1.14 H new ATOM 811 N LYS A 92 -15.773 9.057 28.277 1.00 14.13 N ATOM 812 CA LYS A 92 -15.812 8.610 26.923 1.00 11.10 C ATOM 813 C LYS A 92 -15.321 7.204 27.043 1.00 24.53 C ATOM 814 O LYS A 92 -14.621 6.903 28.020 1.00 14.45 O ATOM 815 CB LYS A 92 -14.891 9.377 25.924 1.00 13.31 C ATOM 816 CG LYS A 92 -15.354 10.766 25.465 1.00 33.34 C ATOM 817 CD LYS A 92 -15.157 11.812 26.522 1.00 55.22 C ATOM 818 CE LYS A 92 -15.610 13.195 26.072 1.00 30.14 C ATOM 819 NZ LYS A 92 -17.052 13.249 25.769 1.00 52.21 N ATOM 0 H LYS A 92 -14.821 9.179 28.621 1.00 14.13 H new ATOM 0 HA LYS A 92 -16.811 8.754 26.512 1.00 11.10 H new ATOM 0 HB2 LYS A 92 -13.909 9.484 26.385 1.00 13.31 H new ATOM 0 HB3 LYS A 92 -14.762 8.755 25.038 1.00 13.31 H new ATOM 0 HG2 LYS A 92 -14.804 11.051 24.568 1.00 33.34 H new ATOM 0 HG3 LYS A 92 -16.408 10.723 25.192 1.00 33.34 H new ATOM 0 HD2 LYS A 92 -15.710 11.527 27.417 1.00 55.22 H new ATOM 0 HD3 LYS A 92 -14.103 11.851 26.797 1.00 55.22 H new ATOM 0 HE2 LYS A 92 -15.379 13.920 26.852 1.00 30.14 H new ATOM 0 HE3 LYS A 92 -15.045 13.488 25.187 1.00 30.14 H new ATOM 0 HZ1 LYS A 92 -17.338 14.237 25.616 1.00 52.21 H new ATOM 0 HZ2 LYS A 92 -17.247 12.696 24.910 1.00 52.21 H new ATOM 0 HZ3 LYS A 92 -17.589 12.852 26.566 1.00 52.21 H new ATOM 833 N ASN A 93 -15.771 6.334 26.197 1.00 13.12 N ATOM 834 CA ASN A 93 -15.342 4.932 26.235 1.00 45.53 C ATOM 835 C ASN A 93 -13.823 4.838 26.080 1.00 72.12 C ATOM 836 O ASN A 93 -13.304 4.832 24.961 1.00 73.22 O ATOM 837 CB ASN A 93 -16.045 4.064 25.162 1.00 0.51 C ATOM 838 CG ASN A 93 -17.565 3.967 25.325 1.00 42.04 C ATOM 839 OD1 ASN A 93 -18.229 4.894 25.783 1.00 50.02 O ATOM 840 ND2 ASN A 93 -18.126 2.846 24.966 1.00 41.54 N ATOM 0 H ASN A 93 -16.441 6.550 25.459 1.00 13.12 H new ATOM 0 HA ASN A 93 -15.634 4.536 27.207 1.00 45.53 H new ATOM 0 HB2 ASN A 93 -15.823 4.474 24.177 1.00 0.51 H new ATOM 0 HB3 ASN A 93 -15.624 3.059 25.191 1.00 0.51 H new ATOM 0 HD21 ASN A 93 -19.134 2.726 25.063 1.00 41.54 H new ATOM 0 HD22 ASN A 93 -17.557 2.089 24.588 1.00 41.54 H new ATOM 847 N TRP A 94 -13.135 4.825 27.220 1.00 3.34 N ATOM 848 CA TRP A 94 -11.710 4.802 27.316 1.00 13.53 C ATOM 849 C TRP A 94 -11.089 3.644 26.549 1.00 34.41 C ATOM 850 O TRP A 94 -11.598 2.513 26.555 1.00 55.32 O ATOM 851 CB TRP A 94 -11.305 4.789 28.798 1.00 55.30 C ATOM 852 CG TRP A 94 -9.841 4.726 29.015 1.00 2.21 C ATOM 853 CD1 TRP A 94 -8.966 5.769 29.078 1.00 53.34 C ATOM 854 CD2 TRP A 94 -9.074 3.544 29.187 1.00 63.04 C ATOM 855 NE1 TRP A 94 -7.705 5.289 29.256 1.00 73.10 N ATOM 856 CE2 TRP A 94 -7.747 3.933 29.328 1.00 42.53 C ATOM 857 CE3 TRP A 94 -9.392 2.189 29.229 1.00 30.23 C ATOM 858 CZ2 TRP A 94 -6.731 3.025 29.504 1.00 32.02 C ATOM 859 CZ3 TRP A 94 -8.383 1.287 29.408 1.00 20.55 C ATOM 860 CH2 TRP A 94 -7.069 1.709 29.545 1.00 70.10 C ATOM 0 H TRP A 94 -13.593 4.831 28.132 1.00 3.34 H new ATOM 0 HA TRP A 94 -11.320 5.704 26.845 1.00 13.53 H new ATOM 0 HB2 TRP A 94 -11.697 5.685 29.280 1.00 55.30 H new ATOM 0 HB3 TRP A 94 -11.773 3.934 29.286 1.00 55.30 H new ATOM 0 HD1 TRP A 94 -9.232 6.813 28.999 1.00 53.34 H new ATOM 0 HE1 TRP A 94 -6.861 5.858 29.325 1.00 73.10 H new ATOM 0 HE3 TRP A 94 -10.415 1.859 29.122 1.00 30.23 H new ATOM 0 HZ2 TRP A 94 -5.704 3.344 29.606 1.00 32.02 H new ATOM 0 HZ3 TRP A 94 -8.611 0.232 29.443 1.00 20.55 H new ATOM 0 HH2 TRP A 94 -6.293 0.972 29.688 1.00 70.10 H new ATOM 871 N ASN A 95 -9.987 3.929 25.926 1.00 22.20 N ATOM 872 CA ASN A 95 -9.277 2.980 25.138 1.00 22.32 C ATOM 873 C ASN A 95 -7.853 2.814 25.670 1.00 45.03 C ATOM 874 O ASN A 95 -7.211 3.793 26.015 1.00 61.30 O ATOM 875 CB ASN A 95 -9.196 3.441 23.696 1.00 24.43 C ATOM 876 CG ASN A 95 -8.367 2.493 22.838 1.00 53.13 C ATOM 877 OD1 ASN A 95 -7.604 2.927 22.016 1.00 52.21 O ATOM 878 ND2 ASN A 95 -8.559 1.204 22.974 1.00 24.24 N ATOM 0 H ASN A 95 -9.550 4.850 25.955 1.00 22.20 H new ATOM 0 HA ASN A 95 -9.811 2.032 25.193 1.00 22.32 H new ATOM 0 HB2 ASN A 95 -10.202 3.517 23.283 1.00 24.43 H new ATOM 0 HB3 ASN A 95 -8.759 4.439 23.659 1.00 24.43 H new ATOM 0 HD21 ASN A 95 -8.057 0.548 22.376 1.00 24.24 H new ATOM 0 HD22 ASN A 95 -9.211 0.857 23.678 1.00 24.24 H new ATOM 885 N LYS A 96 -7.366 1.594 25.733 1.00 64.52 N ATOM 886 CA LYS A 96 -6.006 1.369 26.170 1.00 72.33 C ATOM 887 C LYS A 96 -5.055 1.318 24.987 1.00 4.40 C ATOM 888 O LYS A 96 -5.444 1.523 23.829 1.00 43.23 O ATOM 889 CB LYS A 96 -5.858 0.057 26.941 1.00 70.02 C ATOM 890 CG LYS A 96 -5.982 -1.191 26.093 1.00 32.01 C ATOM 891 CD LYS A 96 -5.823 -2.427 26.940 1.00 63.22 C ATOM 892 CE LYS A 96 -5.839 -3.679 26.094 1.00 71.25 C ATOM 893 NZ LYS A 96 -5.623 -4.890 26.903 1.00 14.31 N ATOM 0 H LYS A 96 -7.885 0.750 25.490 1.00 64.52 H new ATOM 0 HA LYS A 96 -5.759 2.205 26.825 1.00 72.33 H new ATOM 0 HB2 LYS A 96 -4.887 0.049 27.435 1.00 70.02 H new ATOM 0 HB3 LYS A 96 -6.615 0.024 27.725 1.00 70.02 H new ATOM 0 HG2 LYS A 96 -6.953 -1.206 25.598 1.00 32.01 H new ATOM 0 HG3 LYS A 96 -5.225 -1.181 25.309 1.00 32.01 H new ATOM 0 HD2 LYS A 96 -4.886 -2.372 27.494 1.00 63.22 H new ATOM 0 HD3 LYS A 96 -6.626 -2.472 27.675 1.00 63.22 H new ATOM 0 HE2 LYS A 96 -6.795 -3.755 25.575 1.00 71.25 H new ATOM 0 HE3 LYS A 96 -5.065 -3.610 25.329 1.00 71.25 H new ATOM 0 HZ1 LYS A 96 -5.641 -5.727 26.286 1.00 14.31 H new ATOM 0 HZ2 LYS A 96 -4.700 -4.830 27.378 1.00 14.31 H new ATOM 0 HZ3 LYS A 96 -6.375 -4.970 27.617 1.00 14.31 H new ATOM 907 N ASP A 97 -3.801 1.075 25.320 1.00 71.05 N ATOM 908 CA ASP A 97 -2.706 0.845 24.390 1.00 3.00 C ATOM 909 C ASP A 97 -2.415 2.097 23.576 1.00 74.04 C ATOM 910 O ASP A 97 -1.871 2.047 22.471 1.00 31.41 O ATOM 911 CB ASP A 97 -2.938 -0.423 23.524 1.00 0.43 C ATOM 912 CG ASP A 97 -1.658 -0.951 22.892 1.00 25.24 C ATOM 913 OD1 ASP A 97 -0.625 -1.008 23.583 1.00 74.10 O ATOM 914 OD2 ASP A 97 -1.663 -1.356 21.705 1.00 32.21 O ATOM 0 H ASP A 97 -3.502 1.030 26.294 1.00 71.05 H new ATOM 0 HA ASP A 97 -1.804 0.636 24.965 1.00 3.00 H new ATOM 0 HB2 ASP A 97 -3.380 -1.204 24.143 1.00 0.43 H new ATOM 0 HB3 ASP A 97 -3.657 -0.193 22.738 1.00 0.43 H new ATOM 919 N GLY A 98 -2.789 3.228 24.151 1.00 51.22 N ATOM 920 CA GLY A 98 -2.368 4.504 23.619 1.00 54.21 C ATOM 921 C GLY A 98 -3.455 5.319 22.993 1.00 21.21 C ATOM 922 O GLY A 98 -3.172 6.375 22.464 1.00 21.04 O ATOM 0 H GLY A 98 -3.380 3.284 24.981 1.00 51.22 H new ATOM 0 HA2 GLY A 98 -1.917 5.085 24.424 1.00 54.21 H new ATOM 0 HA3 GLY A 98 -1.590 4.332 22.875 1.00 54.21 H new ATOM 926 N TYR A 99 -4.700 4.850 23.097 1.00 12.03 N ATOM 927 CA TYR A 99 -5.842 5.495 22.440 1.00 73.10 C ATOM 928 C TYR A 99 -5.653 5.518 20.924 1.00 41.22 C ATOM 929 O TYR A 99 -5.062 6.427 20.349 1.00 52.43 O ATOM 930 CB TYR A 99 -6.182 6.900 23.004 1.00 34.25 C ATOM 931 CG TYR A 99 -7.502 6.983 23.705 1.00 43.40 C ATOM 932 CD1 TYR A 99 -7.602 6.709 25.043 1.00 11.43 C ATOM 933 CD2 TYR A 99 -8.648 7.360 23.029 1.00 15.50 C ATOM 934 CE1 TYR A 99 -8.800 6.804 25.688 1.00 32.13 C ATOM 935 CE2 TYR A 99 -9.851 7.458 23.671 1.00 11.12 C ATOM 936 CZ TYR A 99 -9.918 7.179 24.998 1.00 74.25 C ATOM 937 OH TYR A 99 -11.096 7.266 25.642 1.00 15.41 O ATOM 0 H TYR A 99 -4.946 4.019 23.635 1.00 12.03 H new ATOM 0 HA TYR A 99 -6.713 4.882 22.671 1.00 73.10 H new ATOM 0 HB2 TYR A 99 -5.397 7.199 23.698 1.00 34.25 H new ATOM 0 HB3 TYR A 99 -6.174 7.619 22.184 1.00 34.25 H new ATOM 0 HD1 TYR A 99 -6.721 6.414 25.594 1.00 11.43 H new ATOM 0 HD2 TYR A 99 -8.592 7.581 21.973 1.00 15.50 H new ATOM 0 HE1 TYR A 99 -8.865 6.583 26.743 1.00 32.13 H new ATOM 0 HE2 TYR A 99 -10.737 7.754 23.129 1.00 11.12 H new ATOM 0 HH TYR A 99 -11.793 7.546 25.012 1.00 15.41 H new ATOM 947 N LEU A 100 -6.132 4.488 20.310 1.00 74.41 N ATOM 948 CA LEU A 100 -6.052 4.288 18.903 1.00 21.32 C ATOM 949 C LEU A 100 -7.412 3.752 18.523 1.00 12.30 C ATOM 950 O LEU A 100 -8.076 3.137 19.348 1.00 0.25 O ATOM 951 CB LEU A 100 -4.932 3.246 18.626 1.00 52.24 C ATOM 952 CG LEU A 100 -4.360 3.096 17.196 1.00 4.24 C ATOM 953 CD1 LEU A 100 -3.117 2.243 17.242 1.00 31.30 C ATOM 954 CD2 LEU A 100 -5.334 2.460 16.232 1.00 15.23 C ATOM 0 H LEU A 100 -6.610 3.730 20.797 1.00 74.41 H new ATOM 0 HA LEU A 100 -5.812 5.187 18.335 1.00 21.32 H new ATOM 0 HB2 LEU A 100 -4.098 3.481 19.287 1.00 52.24 H new ATOM 0 HB3 LEU A 100 -5.313 2.270 18.928 1.00 52.24 H new ATOM 0 HG LEU A 100 -4.145 4.103 16.838 1.00 4.24 H new ATOM 0 HD11 LEU A 100 -2.712 2.136 16.236 1.00 31.30 H new ATOM 0 HD12 LEU A 100 -2.374 2.717 17.884 1.00 31.30 H new ATOM 0 HD13 LEU A 100 -3.365 1.259 17.640 1.00 31.30 H new ATOM 0 HD21 LEU A 100 -4.873 2.383 15.247 1.00 15.23 H new ATOM 0 HD22 LEU A 100 -5.600 1.464 16.587 1.00 15.23 H new ATOM 0 HD23 LEU A 100 -6.233 3.073 16.165 1.00 15.23 H new ATOM 966 N LYS A 101 -7.858 3.998 17.323 1.00 74.51 N ATOM 967 CA LYS A 101 -9.146 3.479 16.898 1.00 21.11 C ATOM 968 C LYS A 101 -9.128 1.953 16.782 1.00 1.22 C ATOM 969 O LYS A 101 -8.151 1.292 17.164 1.00 63.32 O ATOM 970 CB LYS A 101 -9.578 4.098 15.591 1.00 32.21 C ATOM 971 CG LYS A 101 -9.848 5.581 15.677 1.00 4.13 C ATOM 972 CD LYS A 101 -10.573 6.067 14.446 1.00 64.11 C ATOM 973 CE LYS A 101 -9.750 5.892 13.183 1.00 63.02 C ATOM 974 NZ LYS A 101 -10.430 6.458 12.011 1.00 42.41 N ATOM 0 H LYS A 101 -7.362 4.548 16.622 1.00 74.51 H new ATOM 0 HA LYS A 101 -9.870 3.751 17.666 1.00 21.11 H new ATOM 0 HB2 LYS A 101 -8.804 3.922 14.844 1.00 32.21 H new ATOM 0 HB3 LYS A 101 -10.479 3.594 15.242 1.00 32.21 H new ATOM 0 HG2 LYS A 101 -10.444 5.796 16.564 1.00 4.13 H new ATOM 0 HG3 LYS A 101 -8.907 6.121 15.787 1.00 4.13 H new ATOM 0 HD2 LYS A 101 -11.512 5.524 14.343 1.00 64.11 H new ATOM 0 HD3 LYS A 101 -10.826 7.120 14.569 1.00 64.11 H new ATOM 0 HE2 LYS A 101 -8.781 6.374 13.310 1.00 63.02 H new ATOM 0 HE3 LYS A 101 -9.559 4.832 13.017 1.00 63.02 H new ATOM 0 HZ1 LYS A 101 -9.839 6.320 11.167 1.00 42.41 H new ATOM 0 HZ2 LYS A 101 -11.344 5.980 11.876 1.00 42.41 H new ATOM 0 HZ3 LYS A 101 -10.590 7.475 12.160 1.00 42.41 H new ATOM 988 N LYS A 102 -10.183 1.384 16.263 1.00 4.41 N ATOM 989 CA LYS A 102 -10.246 -0.063 16.138 1.00 63.32 C ATOM 990 C LYS A 102 -9.476 -0.549 14.917 1.00 71.33 C ATOM 991 O LYS A 102 -10.043 -0.942 13.903 1.00 35.41 O ATOM 992 CB LYS A 102 -11.690 -0.608 16.221 1.00 45.51 C ATOM 993 CG LYS A 102 -12.228 -0.771 17.663 1.00 22.52 C ATOM 994 CD LYS A 102 -12.200 0.523 18.497 1.00 53.41 C ATOM 995 CE LYS A 102 -13.248 1.544 18.069 1.00 74.31 C ATOM 996 NZ LYS A 102 -14.626 1.063 18.309 1.00 64.00 N ATOM 0 H LYS A 102 -11.004 1.884 15.922 1.00 4.41 H new ATOM 0 HA LYS A 102 -9.741 -0.487 17.006 1.00 63.32 H new ATOM 0 HB2 LYS A 102 -12.351 0.063 15.673 1.00 45.51 H new ATOM 0 HB3 LYS A 102 -11.730 -1.575 15.719 1.00 45.51 H new ATOM 0 HG2 LYS A 102 -13.253 -1.138 17.617 1.00 22.52 H new ATOM 0 HG3 LYS A 102 -11.639 -1.533 18.175 1.00 22.52 H new ATOM 0 HD2 LYS A 102 -12.355 0.273 19.547 1.00 53.41 H new ATOM 0 HD3 LYS A 102 -11.211 0.975 18.420 1.00 53.41 H new ATOM 0 HE2 LYS A 102 -13.090 2.475 18.614 1.00 74.31 H new ATOM 0 HE3 LYS A 102 -13.123 1.769 17.010 1.00 74.31 H new ATOM 0 HZ1 LYS A 102 -15.292 1.856 18.214 1.00 64.00 H new ATOM 0 HZ2 LYS A 102 -14.863 0.327 17.613 1.00 64.00 H new ATOM 0 HZ3 LYS A 102 -14.693 0.667 19.268 1.00 64.00 H new ATOM 1010 N LEU A 103 -8.180 -0.382 15.019 1.00 62.43 N ATOM 1011 CA LEU A 103 -7.195 -0.740 14.032 1.00 30.10 C ATOM 1012 C LEU A 103 -6.086 -1.517 14.749 1.00 5.33 C ATOM 1013 O LEU A 103 -5.876 -1.290 15.959 1.00 61.33 O ATOM 1014 CB LEU A 103 -6.626 0.538 13.394 1.00 24.34 C ATOM 1015 CG LEU A 103 -7.622 1.420 12.634 1.00 30.24 C ATOM 1016 CD1 LEU A 103 -6.953 2.702 12.195 1.00 61.41 C ATOM 1017 CD2 LEU A 103 -8.184 0.684 11.427 1.00 53.11 C ATOM 0 H LEU A 103 -7.759 0.035 15.849 1.00 62.43 H new ATOM 0 HA LEU A 103 -7.633 -1.352 13.243 1.00 30.10 H new ATOM 0 HB2 LEU A 103 -6.169 1.138 14.180 1.00 24.34 H new ATOM 0 HB3 LEU A 103 -5.829 0.252 12.707 1.00 24.34 H new ATOM 0 HG LEU A 103 -8.447 1.661 13.304 1.00 30.24 H new ATOM 0 HD11 LEU A 103 -7.670 3.321 11.656 1.00 61.41 H new ATOM 0 HD12 LEU A 103 -6.593 3.243 13.070 1.00 61.41 H new ATOM 0 HD13 LEU A 103 -6.112 2.468 11.542 1.00 61.41 H new ATOM 0 HD21 LEU A 103 -8.889 1.330 10.903 1.00 53.11 H new ATOM 0 HD22 LEU A 103 -7.370 0.414 10.754 1.00 53.11 H new ATOM 0 HD23 LEU A 103 -8.696 -0.219 11.758 1.00 53.11 H new ATOM 1029 N PRO A 104 -5.422 -2.480 14.082 1.00 32.13 N ATOM 1030 CA PRO A 104 -4.319 -3.266 14.681 1.00 24.13 C ATOM 1031 C PRO A 104 -3.075 -2.413 15.021 1.00 51.13 C ATOM 1032 O PRO A 104 -3.092 -1.174 14.936 1.00 14.33 O ATOM 1033 CB PRO A 104 -3.957 -4.280 13.578 1.00 23.20 C ATOM 1034 CG PRO A 104 -5.121 -4.285 12.658 1.00 61.24 C ATOM 1035 CD PRO A 104 -5.687 -2.903 12.701 1.00 73.44 C ATOM 0 HA PRO A 104 -4.628 -3.712 15.626 1.00 24.13 H new ATOM 0 HB2 PRO A 104 -3.045 -3.987 13.058 1.00 23.20 H new ATOM 0 HB3 PRO A 104 -3.781 -5.271 13.996 1.00 23.20 H new ATOM 0 HG2 PRO A 104 -4.817 -4.550 11.646 1.00 61.24 H new ATOM 0 HG3 PRO A 104 -5.862 -5.020 12.971 1.00 61.24 H new ATOM 0 HD2 PRO A 104 -5.203 -2.246 11.978 1.00 73.44 H new ATOM 0 HD3 PRO A 104 -6.753 -2.896 12.474 1.00 73.44 H new ATOM 1043 N VAL A 105 -2.004 -3.083 15.394 1.00 15.44 N ATOM 1044 CA VAL A 105 -0.763 -2.420 15.726 1.00 51.12 C ATOM 1045 C VAL A 105 0.041 -2.192 14.420 1.00 12.23 C ATOM 1046 O VAL A 105 -0.374 -2.687 13.360 1.00 3.25 O ATOM 1047 CB VAL A 105 0.023 -3.250 16.772 1.00 1.13 C ATOM 1048 CG1 VAL A 105 0.744 -4.452 16.175 1.00 50.45 C ATOM 1049 CG2 VAL A 105 0.928 -2.391 17.623 1.00 74.30 C ATOM 0 H VAL A 105 -1.971 -4.099 15.475 1.00 15.44 H new ATOM 0 HA VAL A 105 -0.955 -1.448 16.181 1.00 51.12 H new ATOM 0 HB VAL A 105 -0.728 -3.669 17.441 1.00 1.13 H new ATOM 0 HG11 VAL A 105 1.273 -4.987 16.963 1.00 50.45 H new ATOM 0 HG12 VAL A 105 0.017 -5.118 15.709 1.00 50.45 H new ATOM 0 HG13 VAL A 105 1.458 -4.112 15.425 1.00 50.45 H new ATOM 0 HG21 VAL A 105 1.457 -3.019 18.340 1.00 74.30 H new ATOM 0 HG22 VAL A 105 1.650 -1.881 16.986 1.00 74.30 H new ATOM 0 HG23 VAL A 105 0.331 -1.653 18.158 1.00 74.30 H new ATOM 1059 N ASP A 106 1.178 -1.503 14.477 1.00 33.41 N ATOM 1060 CA ASP A 106 1.861 -1.090 13.238 1.00 61.42 C ATOM 1061 C ASP A 106 2.607 -2.285 12.637 1.00 11.31 C ATOM 1062 O ASP A 106 2.803 -3.303 13.338 1.00 61.24 O ATOM 1063 CB ASP A 106 2.828 0.083 13.531 1.00 64.34 C ATOM 1064 CG ASP A 106 2.934 1.076 12.396 1.00 70.00 C ATOM 1065 OD1 ASP A 106 1.867 1.622 11.957 1.00 55.43 O ATOM 1066 OD2 ASP A 106 4.055 1.348 11.968 1.00 32.20 O ATOM 0 H ASP A 106 1.642 -1.221 15.340 1.00 33.41 H new ATOM 0 HA ASP A 106 1.124 -0.746 12.513 1.00 61.42 H new ATOM 0 HB2 ASP A 106 2.493 0.604 14.428 1.00 64.34 H new ATOM 0 HB3 ASP A 106 3.818 -0.318 13.746 1.00 64.34 H new ATOM 1071 N PRO A 107 2.922 -2.264 11.309 1.00 40.12 N ATOM 1072 CA PRO A 107 3.757 -3.278 10.663 1.00 64.11 C ATOM 1073 C PRO A 107 5.042 -3.594 11.422 1.00 4.14 C ATOM 1074 O PRO A 107 5.425 -2.915 12.374 1.00 23.32 O ATOM 1075 CB PRO A 107 4.141 -2.620 9.357 1.00 54.35 C ATOM 1076 CG PRO A 107 2.974 -1.775 9.013 1.00 74.33 C ATOM 1077 CD PRO A 107 2.416 -1.290 10.318 1.00 3.32 C ATOM 0 HA PRO A 107 3.218 -4.222 10.586 1.00 64.11 H new ATOM 0 HB2 PRO A 107 5.046 -2.023 9.464 1.00 54.35 H new ATOM 0 HB3 PRO A 107 4.338 -3.361 8.582 1.00 54.35 H new ATOM 0 HG2 PRO A 107 3.271 -0.938 8.381 1.00 74.33 H new ATOM 0 HG3 PRO A 107 2.229 -2.345 8.458 1.00 74.33 H new ATOM 0 HD2 PRO A 107 2.753 -0.279 10.545 1.00 3.32 H new ATOM 0 HD3 PRO A 107 1.326 -1.267 10.302 1.00 3.32 H new ATOM 1085 N TRP A 108 5.703 -4.636 10.960 1.00 43.43 N ATOM 1086 CA TRP A 108 6.978 -5.148 11.477 1.00 55.11 C ATOM 1087 C TRP A 108 6.806 -5.677 12.917 1.00 75.21 C ATOM 1088 O TRP A 108 7.780 -5.905 13.641 1.00 53.23 O ATOM 1089 CB TRP A 108 8.091 -4.080 11.466 1.00 63.31 C ATOM 1090 CG TRP A 108 8.076 -3.174 10.290 1.00 31.12 C ATOM 1091 CD1 TRP A 108 8.347 -3.491 9.008 1.00 2.22 C ATOM 1092 CD2 TRP A 108 7.753 -1.779 10.310 1.00 24.22 C ATOM 1093 NE1 TRP A 108 8.225 -2.372 8.221 1.00 53.34 N ATOM 1094 CE2 TRP A 108 7.855 -1.311 9.008 1.00 42.11 C ATOM 1095 CE3 TRP A 108 7.385 -0.884 11.322 1.00 23.40 C ATOM 1096 CZ2 TRP A 108 7.603 0.012 8.678 1.00 73.14 C ATOM 1097 CZ3 TRP A 108 7.127 0.418 11.001 1.00 41.44 C ATOM 1098 CH2 TRP A 108 7.235 0.861 9.701 1.00 21.34 C ATOM 0 H TRP A 108 5.356 -5.184 10.173 1.00 43.43 H new ATOM 0 HA TRP A 108 7.278 -5.958 10.812 1.00 55.11 H new ATOM 0 HB2 TRP A 108 8.006 -3.478 12.371 1.00 63.31 H new ATOM 0 HB3 TRP A 108 9.057 -4.583 11.507 1.00 63.31 H new ATOM 0 HD1 TRP A 108 8.619 -4.475 8.654 1.00 2.22 H new ATOM 0 HE1 TRP A 108 8.384 -2.336 7.214 1.00 53.34 H new ATOM 0 HE3 TRP A 108 7.306 -1.220 12.345 1.00 23.40 H new ATOM 0 HZ2 TRP A 108 7.691 0.364 7.661 1.00 73.14 H new ATOM 0 HZ3 TRP A 108 6.834 1.110 11.777 1.00 41.44 H new ATOM 0 HH2 TRP A 108 7.027 1.897 9.478 1.00 21.34 H new ATOM 1109 N GLY A 109 5.552 -5.878 13.297 1.00 21.30 N ATOM 1110 CA GLY A 109 5.181 -6.399 14.612 1.00 1.44 C ATOM 1111 C GLY A 109 5.374 -5.419 15.775 1.00 15.44 C ATOM 1112 O GLY A 109 5.134 -5.782 16.935 1.00 5.43 O ATOM 0 H GLY A 109 4.751 -5.683 12.696 1.00 21.30 H new ATOM 0 HA2 GLY A 109 4.135 -6.704 14.583 1.00 1.44 H new ATOM 0 HA3 GLY A 109 5.769 -7.295 14.810 1.00 1.44 H new ATOM 1116 N ASN A 110 5.815 -4.211 15.482 1.00 12.43 N ATOM 1117 CA ASN A 110 6.083 -3.199 16.499 1.00 43.44 C ATOM 1118 C ASN A 110 4.843 -2.651 17.151 1.00 70.32 C ATOM 1119 O ASN A 110 3.869 -2.251 16.462 1.00 43.33 O ATOM 1120 CB ASN A 110 6.871 -2.002 15.947 1.00 22.11 C ATOM 1121 CG ASN A 110 8.202 -2.369 15.384 1.00 0.20 C ATOM 1122 OD1 ASN A 110 8.251 -2.512 14.105 1.00 3.34 O flip ATOM 1123 ND2 ASN A 110 9.207 -2.473 16.106 1.00 2.32 N flip ATOM 0 H ASN A 110 6.000 -3.897 14.529 1.00 12.43 H new ATOM 0 HA ASN A 110 6.673 -3.736 17.242 1.00 43.44 H new ATOM 0 HB2 ASN A 110 6.280 -1.516 15.171 1.00 22.11 H new ATOM 0 HB3 ASN A 110 7.012 -1.272 16.744 1.00 22.11 H new ATOM 0 HD21 ASN A 110 9.124 -2.352 17.115 1.00 2.32 H new ATOM 0 HD22 ASN A 110 10.115 -2.679 15.690 1.00 2.32 H new ATOM 1130 N PRO A 111 4.826 -2.671 18.495 1.00 22.44 N ATOM 1131 CA PRO A 111 3.858 -1.930 19.261 1.00 35.33 C ATOM 1132 C PRO A 111 4.129 -0.453 19.086 1.00 13.03 C ATOM 1133 O PRO A 111 5.289 -0.052 18.929 1.00 22.24 O ATOM 1134 CB PRO A 111 4.127 -2.333 20.723 1.00 31.24 C ATOM 1135 CG PRO A 111 4.969 -3.554 20.651 1.00 5.24 C ATOM 1136 CD PRO A 111 5.721 -3.468 19.360 1.00 24.02 C ATOM 0 HA PRO A 111 2.830 -2.131 18.959 1.00 35.33 H new ATOM 0 HB2 PRO A 111 4.638 -1.535 21.262 1.00 31.24 H new ATOM 0 HB3 PRO A 111 3.195 -2.530 21.253 1.00 31.24 H new ATOM 0 HG2 PRO A 111 5.654 -3.605 21.498 1.00 5.24 H new ATOM 0 HG3 PRO A 111 4.354 -4.453 20.684 1.00 5.24 H new ATOM 0 HD2 PRO A 111 6.689 -2.985 19.490 1.00 24.02 H new ATOM 0 HD3 PRO A 111 5.912 -4.455 18.940 1.00 24.02 H new ATOM 1144 N TYR A 112 3.095 0.348 19.095 1.00 23.52 N ATOM 1145 CA TYR A 112 3.267 1.772 18.990 1.00 64.33 C ATOM 1146 C TYR A 112 3.895 2.280 20.256 1.00 23.25 C ATOM 1147 O TYR A 112 3.588 1.792 21.354 1.00 10.44 O ATOM 1148 CB TYR A 112 1.957 2.521 18.723 1.00 62.34 C ATOM 1149 CG TYR A 112 1.386 2.381 17.324 1.00 74.03 C ATOM 1150 CD1 TYR A 112 1.770 3.254 16.309 1.00 73.01 C ATOM 1151 CD2 TYR A 112 0.432 1.423 17.031 1.00 11.22 C ATOM 1152 CE1 TYR A 112 1.211 3.177 15.044 1.00 11.43 C ATOM 1153 CE2 TYR A 112 -0.122 1.330 15.766 1.00 3.12 C ATOM 1154 CZ TYR A 112 0.264 2.208 14.779 1.00 4.30 C ATOM 1155 OH TYR A 112 -0.323 2.126 13.535 1.00 22.30 O ATOM 0 H TYR A 112 2.126 0.038 19.174 1.00 23.52 H new ATOM 0 HA TYR A 112 3.911 1.961 18.131 1.00 64.33 H new ATOM 0 HB2 TYR A 112 1.210 2.172 19.436 1.00 62.34 H new ATOM 0 HB3 TYR A 112 2.119 3.580 18.924 1.00 62.34 H new ATOM 0 HD1 TYR A 112 2.518 4.006 16.512 1.00 73.01 H new ATOM 0 HD2 TYR A 112 0.114 0.736 17.802 1.00 11.22 H new ATOM 0 HE1 TYR A 112 1.513 3.869 14.272 1.00 11.43 H new ATOM 0 HE2 TYR A 112 -0.857 0.568 15.553 1.00 3.12 H new ATOM 0 HH TYR A 112 0.347 1.851 12.875 1.00 22.30 H new ATOM 1165 N GLN A 113 4.726 3.250 20.136 1.00 44.52 N ATOM 1166 CA GLN A 113 5.414 3.755 21.289 1.00 14.45 C ATOM 1167 C GLN A 113 4.671 5.004 21.671 1.00 3.11 C ATOM 1168 O GLN A 113 4.628 5.987 20.907 1.00 23.41 O ATOM 1169 CB GLN A 113 6.886 4.177 20.976 1.00 22.24 C ATOM 1170 CG GLN A 113 7.542 3.601 19.709 1.00 73.35 C ATOM 1171 CD GLN A 113 7.717 2.103 19.665 1.00 4.32 C ATOM 1172 OE1 GLN A 113 7.677 1.510 18.588 1.00 72.24 O ATOM 1173 NE2 GLN A 113 7.963 1.491 20.788 1.00 64.12 N ATOM 0 H GLN A 113 4.953 3.716 19.257 1.00 44.52 H new ATOM 0 HA GLN A 113 5.447 2.985 22.060 1.00 14.45 H new ATOM 0 HB2 GLN A 113 6.915 5.264 20.904 1.00 22.24 H new ATOM 0 HB3 GLN A 113 7.503 3.898 21.830 1.00 22.24 H new ATOM 0 HG2 GLN A 113 6.944 3.900 18.848 1.00 73.35 H new ATOM 0 HG3 GLN A 113 8.522 4.063 19.592 1.00 73.35 H new ATOM 0 HE21 GLN A 113 7.988 2.018 21.661 1.00 64.12 H new ATOM 0 HE22 GLN A 113 8.131 0.485 20.794 1.00 64.12 H new ATOM 1182 N TYR A 114 4.046 4.949 22.818 1.00 70.45 N ATOM 1183 CA TYR A 114 3.245 6.035 23.285 1.00 63.23 C ATOM 1184 C TYR A 114 3.900 6.768 24.439 1.00 61.41 C ATOM 1185 O TYR A 114 4.213 6.185 25.481 1.00 51.11 O ATOM 1186 CB TYR A 114 1.801 5.555 23.638 1.00 35.25 C ATOM 1187 CG TYR A 114 1.681 4.175 24.335 1.00 15.52 C ATOM 1188 CD1 TYR A 114 2.367 3.873 25.504 1.00 73.13 C ATOM 1189 CD2 TYR A 114 0.863 3.185 23.801 1.00 21.33 C ATOM 1190 CE1 TYR A 114 2.249 2.636 26.108 1.00 14.14 C ATOM 1191 CE2 TYR A 114 0.739 1.938 24.406 1.00 63.54 C ATOM 1192 CZ TYR A 114 1.435 1.674 25.550 1.00 42.04 C ATOM 1193 OH TYR A 114 1.321 0.430 26.150 1.00 1.33 O ATOM 0 H TYR A 114 4.082 4.149 23.449 1.00 70.45 H new ATOM 0 HA TYR A 114 3.160 6.755 22.471 1.00 63.23 H new ATOM 0 HB2 TYR A 114 1.341 6.304 24.283 1.00 35.25 H new ATOM 0 HB3 TYR A 114 1.217 5.524 22.718 1.00 35.25 H new ATOM 0 HD1 TYR A 114 3.006 4.621 25.950 1.00 73.13 H new ATOM 0 HD2 TYR A 114 0.311 3.389 22.895 1.00 21.33 H new ATOM 0 HE1 TYR A 114 2.794 2.423 27.016 1.00 14.14 H new ATOM 0 HE2 TYR A 114 0.097 1.185 23.974 1.00 63.54 H new ATOM 0 HH TYR A 114 0.707 -0.129 25.630 1.00 1.33 H new ATOM 1203 N LEU A 115 4.159 8.017 24.220 1.00 60.25 N ATOM 1204 CA LEU A 115 4.663 8.898 25.229 1.00 54.32 C ATOM 1205 C LEU A 115 3.796 10.143 25.249 1.00 21.33 C ATOM 1206 O LEU A 115 3.194 10.502 24.234 1.00 52.50 O ATOM 1207 CB LEU A 115 6.138 9.234 24.987 1.00 24.41 C ATOM 1208 CG LEU A 115 7.158 8.107 25.177 1.00 70.42 C ATOM 1209 CD1 LEU A 115 8.544 8.586 24.783 1.00 3.44 C ATOM 1210 CD2 LEU A 115 7.166 7.623 26.619 1.00 33.32 C ATOM 0 H LEU A 115 4.023 8.465 23.314 1.00 60.25 H new ATOM 0 HA LEU A 115 4.618 8.412 26.203 1.00 54.32 H new ATOM 0 HB2 LEU A 115 6.235 9.608 23.968 1.00 24.41 H new ATOM 0 HB3 LEU A 115 6.411 10.052 25.654 1.00 24.41 H new ATOM 0 HG LEU A 115 6.871 7.274 24.535 1.00 70.42 H new ATOM 0 HD11 LEU A 115 9.262 7.777 24.922 1.00 3.44 H new ATOM 0 HD12 LEU A 115 8.540 8.892 23.737 1.00 3.44 H new ATOM 0 HD13 LEU A 115 8.827 9.433 25.407 1.00 3.44 H new ATOM 0 HD21 LEU A 115 7.898 6.823 26.730 1.00 33.32 H new ATOM 0 HD22 LEU A 115 7.429 8.450 27.279 1.00 33.32 H new ATOM 0 HD23 LEU A 115 6.177 7.249 26.883 1.00 33.32 H new ATOM 1222 N ALA A 116 3.719 10.795 26.360 1.00 14.11 N ATOM 1223 CA ALA A 116 2.891 11.941 26.477 1.00 52.20 C ATOM 1224 C ALA A 116 3.794 13.206 26.453 1.00 64.34 C ATOM 1225 O ALA A 116 4.988 13.018 26.350 1.00 71.03 O ATOM 1226 CB ALA A 116 2.000 11.766 27.675 1.00 70.51 C ATOM 0 H ALA A 116 4.228 10.547 27.209 1.00 14.11 H new ATOM 0 HA ALA A 116 2.206 12.073 25.640 1.00 52.20 H new ATOM 0 HB1 ALA A 116 1.356 12.639 27.780 1.00 70.51 H new ATOM 0 HB2 ALA A 116 1.385 10.875 27.544 1.00 70.51 H new ATOM 0 HB3 ALA A 116 2.612 11.657 28.571 1.00 70.51 H new ATOM 1232 N PRO A 117 3.272 14.482 26.578 1.00 63.53 N ATOM 1233 CA PRO A 117 4.033 15.720 26.260 1.00 31.23 C ATOM 1234 C PRO A 117 5.472 15.745 26.735 1.00 63.23 C ATOM 1235 O PRO A 117 5.750 15.782 27.953 1.00 22.23 O ATOM 1236 CB PRO A 117 3.242 16.845 26.931 1.00 53.05 C ATOM 1237 CG PRO A 117 2.225 16.172 27.775 1.00 24.23 C ATOM 1238 CD PRO A 117 1.983 14.836 27.146 1.00 1.13 C ATOM 0 HA PRO A 117 4.122 15.810 25.177 1.00 31.23 H new ATOM 0 HB2 PRO A 117 3.894 17.477 27.533 1.00 53.05 H new ATOM 0 HB3 PRO A 117 2.771 17.489 26.189 1.00 53.05 H new ATOM 0 HG2 PRO A 117 2.580 16.062 28.800 1.00 24.23 H new ATOM 0 HG3 PRO A 117 1.305 16.755 27.817 1.00 24.23 H new ATOM 0 HD2 PRO A 117 1.654 14.101 27.881 1.00 1.13 H new ATOM 0 HD3 PRO A 117 1.209 14.889 26.380 1.00 1.13 H new ATOM 1289 N GLY A 121 6.056 19.243 22.625 1.00 22.25 N ATOM 1290 CA GLY A 121 4.642 19.427 22.671 1.00 33.04 C ATOM 1291 C GLY A 121 3.837 18.311 23.286 1.00 65.14 C ATOM 1292 O GLY A 121 4.391 17.284 23.684 1.00 51.32 O ATOM 0 HA2 GLY A 121 4.435 20.342 23.226 1.00 33.04 H new ATOM 0 HA3 GLY A 121 4.285 19.584 21.653 1.00 33.04 H new ATOM 1296 N PRO A 122 2.494 18.560 23.361 1.00 13.25 N ATOM 1297 CA PRO A 122 1.418 17.697 23.927 1.00 43.21 C ATOM 1298 C PRO A 122 1.506 16.165 23.808 1.00 53.03 C ATOM 1299 O PRO A 122 0.784 15.494 24.535 1.00 1.12 O ATOM 1300 CB PRO A 122 0.207 18.197 23.199 1.00 73.34 C ATOM 1301 CG PRO A 122 0.418 19.649 23.148 1.00 34.14 C ATOM 1302 CD PRO A 122 1.889 19.828 22.884 1.00 42.03 C ATOM 0 HA PRO A 122 1.451 17.792 25.012 1.00 43.21 H new ATOM 0 HB2 PRO A 122 0.132 17.766 22.201 1.00 73.34 H new ATOM 0 HB3 PRO A 122 -0.713 17.943 23.726 1.00 73.34 H new ATOM 0 HG2 PRO A 122 -0.181 20.106 22.361 1.00 34.14 H new ATOM 0 HG3 PRO A 122 0.126 20.122 24.086 1.00 34.14 H new ATOM 0 HD2 PRO A 122 2.088 19.992 21.825 1.00 42.03 H new ATOM 0 HD3 PRO A 122 2.289 20.688 23.420 1.00 42.03 H new ATOM 1310 N PHE A 123 2.297 15.612 22.896 1.00 63.11 N ATOM 1311 CA PHE A 123 2.531 14.149 22.884 1.00 22.20 C ATOM 1312 C PHE A 123 3.609 13.713 21.914 1.00 54.33 C ATOM 1313 O PHE A 123 3.827 14.346 20.868 1.00 13.02 O ATOM 1314 CB PHE A 123 1.247 13.250 22.738 1.00 14.12 C ATOM 1315 CG PHE A 123 0.452 13.350 21.447 1.00 62.14 C ATOM 1316 CD1 PHE A 123 0.906 12.755 20.279 1.00 2.02 C ATOM 1317 CD2 PHE A 123 -0.776 13.989 21.423 1.00 41.21 C ATOM 1318 CE1 PHE A 123 0.163 12.804 19.122 1.00 53.15 C ATOM 1319 CE2 PHE A 123 -1.527 14.043 20.261 1.00 62.00 C ATOM 1320 CZ PHE A 123 -1.055 13.449 19.110 1.00 25.35 C ATOM 0 H PHE A 123 2.784 16.130 22.164 1.00 63.11 H new ATOM 0 HA PHE A 123 2.896 13.970 23.895 1.00 22.20 H new ATOM 0 HB2 PHE A 123 1.550 12.211 22.864 1.00 14.12 H new ATOM 0 HB3 PHE A 123 0.576 13.489 23.563 1.00 14.12 H new ATOM 0 HD1 PHE A 123 1.858 12.245 20.278 1.00 2.02 H new ATOM 0 HD2 PHE A 123 -1.153 14.452 22.323 1.00 41.21 H new ATOM 0 HE1 PHE A 123 0.535 12.336 18.222 1.00 53.15 H new ATOM 0 HE2 PHE A 123 -2.481 14.550 20.256 1.00 62.00 H new ATOM 0 HZ PHE A 123 -1.638 13.489 18.202 1.00 25.35 H new ATOM 1330 N ASP A 124 4.235 12.605 22.265 1.00 35.44 N ATOM 1331 CA ASP A 124 5.281 11.957 21.487 1.00 20.54 C ATOM 1332 C ASP A 124 4.714 10.639 20.991 1.00 34.24 C ATOM 1333 O ASP A 124 4.531 9.701 21.777 1.00 32.25 O ATOM 1334 CB ASP A 124 6.505 11.607 22.368 1.00 2.24 C ATOM 1335 CG ASP A 124 7.425 12.734 22.805 1.00 73.13 C ATOM 1336 OD1 ASP A 124 7.002 13.663 23.524 1.00 1.14 O ATOM 1337 OD2 ASP A 124 8.642 12.638 22.536 1.00 72.12 O ATOM 0 H ASP A 124 4.023 12.111 23.132 1.00 35.44 H new ATOM 0 HA ASP A 124 5.592 12.627 20.685 1.00 20.54 H new ATOM 0 HB2 ASP A 124 6.137 11.111 23.266 1.00 2.24 H new ATOM 0 HB3 ASP A 124 7.107 10.878 21.826 1.00 2.24 H new ATOM 1342 N LEU A 125 4.408 10.546 19.729 1.00 41.44 N ATOM 1343 CA LEU A 125 3.810 9.344 19.223 1.00 4.33 C ATOM 1344 C LEU A 125 4.597 8.840 18.026 1.00 14.24 C ATOM 1345 O LEU A 125 4.846 9.597 17.085 1.00 42.53 O ATOM 1346 CB LEU A 125 2.333 9.651 18.870 1.00 0.35 C ATOM 1347 CG LEU A 125 1.393 8.494 18.487 1.00 22.20 C ATOM 1348 CD1 LEU A 125 1.705 7.903 17.112 1.00 72.20 C ATOM 1349 CD2 LEU A 125 1.394 7.414 19.569 1.00 32.12 C ATOM 0 H LEU A 125 4.561 11.280 19.037 1.00 41.44 H new ATOM 0 HA LEU A 125 3.831 8.551 19.970 1.00 4.33 H new ATOM 0 HB2 LEU A 125 1.891 10.162 19.725 1.00 0.35 H new ATOM 0 HB3 LEU A 125 2.335 10.359 18.042 1.00 0.35 H new ATOM 0 HG LEU A 125 0.390 8.914 18.417 1.00 22.20 H new ATOM 0 HD11 LEU A 125 1.009 7.092 16.898 1.00 72.20 H new ATOM 0 HD12 LEU A 125 1.604 8.677 16.352 1.00 72.20 H new ATOM 0 HD13 LEU A 125 2.725 7.518 17.104 1.00 72.20 H new ATOM 0 HD21 LEU A 125 0.723 6.606 19.277 1.00 32.12 H new ATOM 0 HD22 LEU A 125 2.404 7.021 19.690 1.00 32.12 H new ATOM 0 HD23 LEU A 125 1.056 7.844 20.512 1.00 32.12 H new ATOM 1361 N TYR A 126 4.981 7.569 18.052 1.00 10.34 N ATOM 1362 CA TYR A 126 5.717 6.977 16.945 1.00 4.11 C ATOM 1363 C TYR A 126 5.750 5.463 17.032 1.00 21.15 C ATOM 1364 O TYR A 126 5.352 4.894 18.030 1.00 13.25 O ATOM 1365 CB TYR A 126 7.151 7.568 16.799 1.00 54.53 C ATOM 1366 CG TYR A 126 8.111 7.369 17.971 1.00 60.51 C ATOM 1367 CD1 TYR A 126 8.040 8.166 19.110 1.00 42.31 C ATOM 1368 CD2 TYR A 126 9.114 6.410 17.911 1.00 4.24 C ATOM 1369 CE1 TYR A 126 8.935 8.006 20.152 1.00 65.22 C ATOM 1370 CE2 TYR A 126 10.018 6.249 18.941 1.00 40.03 C ATOM 1371 CZ TYR A 126 9.923 7.048 20.061 1.00 24.23 C ATOM 1372 OH TYR A 126 10.834 6.897 21.087 1.00 72.41 O ATOM 0 H TYR A 126 4.795 6.931 18.826 1.00 10.34 H new ATOM 0 HA TYR A 126 5.171 7.242 16.039 1.00 4.11 H new ATOM 0 HB2 TYR A 126 7.607 7.131 15.911 1.00 54.53 H new ATOM 0 HB3 TYR A 126 7.058 8.639 16.616 1.00 54.53 H new ATOM 0 HD1 TYR A 126 7.273 8.923 19.181 1.00 42.31 H new ATOM 0 HD2 TYR A 126 9.188 5.777 17.039 1.00 4.24 H new ATOM 0 HE1 TYR A 126 8.861 8.628 21.032 1.00 65.22 H new ATOM 0 HE2 TYR A 126 10.795 5.502 18.871 1.00 40.03 H new ATOM 0 HH TYR A 126 11.739 7.060 20.748 1.00 72.41 H new ATOM 1382 N SER A 127 6.119 4.842 15.954 1.00 32.32 N ATOM 1383 CA SER A 127 6.334 3.420 15.876 1.00 43.24 C ATOM 1384 C SER A 127 7.739 3.204 15.333 1.00 54.21 C ATOM 1385 O SER A 127 8.170 3.947 14.442 1.00 34.22 O ATOM 1386 CB SER A 127 5.285 2.781 14.957 1.00 31.41 C ATOM 1387 OG SER A 127 5.441 1.385 14.851 1.00 41.34 O ATOM 0 H SER A 127 6.286 5.324 15.070 1.00 32.32 H new ATOM 0 HA SER A 127 6.236 2.954 16.856 1.00 43.24 H new ATOM 0 HB2 SER A 127 4.288 3.004 15.338 1.00 31.41 H new ATOM 0 HB3 SER A 127 5.355 3.228 13.965 1.00 31.41 H new ATOM 0 HG SER A 127 5.424 1.125 13.906 1.00 41.34 H new ATOM 1393 N LEU A 128 8.464 2.259 15.891 1.00 60.32 N ATOM 1394 CA LEU A 128 9.817 1.952 15.444 1.00 70.13 C ATOM 1395 C LEU A 128 9.826 1.381 14.035 1.00 52.12 C ATOM 1396 O LEU A 128 9.130 0.415 13.756 1.00 75.40 O ATOM 1397 CB LEU A 128 10.499 0.960 16.394 1.00 13.32 C ATOM 1398 CG LEU A 128 10.789 1.457 17.818 1.00 30.01 C ATOM 1399 CD1 LEU A 128 11.453 0.364 18.638 1.00 43.31 C ATOM 1400 CD2 LEU A 128 11.664 2.709 17.793 1.00 10.10 C ATOM 0 H LEU A 128 8.139 1.680 16.665 1.00 60.32 H new ATOM 0 HA LEU A 128 10.370 2.891 15.445 1.00 70.13 H new ATOM 0 HB2 LEU A 128 9.872 0.071 16.465 1.00 13.32 H new ATOM 0 HB3 LEU A 128 11.442 0.650 15.943 1.00 13.32 H new ATOM 0 HG LEU A 128 9.839 1.716 18.285 1.00 30.01 H new ATOM 0 HD11 LEU A 128 11.651 0.734 19.644 1.00 43.31 H new ATOM 0 HD12 LEU A 128 10.793 -0.502 18.693 1.00 43.31 H new ATOM 0 HD13 LEU A 128 12.392 0.075 18.166 1.00 43.31 H new ATOM 0 HD21 LEU A 128 11.854 3.040 18.814 1.00 10.10 H new ATOM 0 HD22 LEU A 128 12.611 2.482 17.303 1.00 10.10 H new ATOM 0 HD23 LEU A 128 11.152 3.500 17.244 1.00 10.10 H new ATOM 1412 N GLY A 129 10.646 1.971 13.165 1.00 43.35 N ATOM 1413 CA GLY A 129 10.789 1.477 11.804 1.00 53.52 C ATOM 1414 C GLY A 129 11.392 0.104 11.781 1.00 32.51 C ATOM 1415 O GLY A 129 11.907 -0.372 12.805 1.00 24.32 O ATOM 0 H GLY A 129 11.217 2.788 13.381 1.00 43.35 H new ATOM 0 HA2 GLY A 129 9.813 1.456 11.319 1.00 53.52 H new ATOM 0 HA3 GLY A 129 11.415 2.161 11.231 1.00 53.52 H new ATOM 1419 N ALA A 130 11.403 -0.504 10.625 1.00 75.43 N ATOM 1420 CA ALA A 130 11.830 -1.895 10.446 1.00 73.31 C ATOM 1421 C ALA A 130 13.298 -2.184 10.786 1.00 44.23 C ATOM 1422 O ALA A 130 13.728 -3.328 10.716 1.00 52.15 O ATOM 1423 CB ALA A 130 11.531 -2.342 9.054 1.00 24.51 C ATOM 0 H ALA A 130 11.114 -0.052 9.757 1.00 75.43 H new ATOM 0 HA ALA A 130 11.254 -2.465 11.175 1.00 73.31 H new ATOM 0 HB1 ALA A 130 11.851 -3.376 8.927 1.00 24.51 H new ATOM 0 HB2 ALA A 130 10.459 -2.268 8.871 1.00 24.51 H new ATOM 0 HB3 ALA A 130 12.065 -1.708 8.346 1.00 24.51 H new ATOM 1429 N ASP A 131 14.065 -1.181 11.138 1.00 21.15 N ATOM 1430 CA ASP A 131 15.447 -1.420 11.543 1.00 73.15 C ATOM 1431 C ASP A 131 15.549 -1.402 13.076 1.00 50.24 C ATOM 1432 O ASP A 131 16.599 -1.663 13.658 1.00 15.12 O ATOM 1433 CB ASP A 131 16.407 -0.405 10.891 1.00 73.35 C ATOM 1434 CG ASP A 131 17.875 -0.711 11.157 1.00 1.52 C ATOM 1435 OD1 ASP A 131 18.281 -1.871 11.043 1.00 41.35 O ATOM 1436 OD2 ASP A 131 18.656 0.225 11.448 1.00 12.10 O ATOM 0 H ASP A 131 13.772 -0.204 11.156 1.00 21.15 H new ATOM 0 HA ASP A 131 15.752 -2.406 11.191 1.00 73.15 H new ATOM 0 HB2 ASP A 131 16.235 -0.391 9.815 1.00 73.35 H new ATOM 0 HB3 ASP A 131 16.177 0.593 11.263 1.00 73.35 H new ATOM 1441 N GLY A 132 14.412 -1.137 13.722 1.00 11.23 N ATOM 1442 CA GLY A 132 14.350 -1.076 15.177 1.00 21.23 C ATOM 1443 C GLY A 132 15.052 0.147 15.696 1.00 62.12 C ATOM 1444 O GLY A 132 15.733 0.107 16.722 1.00 11.35 O ATOM 0 H GLY A 132 13.522 -0.961 13.256 1.00 11.23 H new ATOM 0 HA2 GLY A 132 13.309 -1.066 15.500 1.00 21.23 H new ATOM 0 HA3 GLY A 132 14.807 -1.970 15.602 1.00 21.23 H new ATOM 1448 N LYS A 133 14.886 1.234 14.982 1.00 21.22 N ATOM 1449 CA LYS A 133 15.577 2.468 15.268 1.00 30.45 C ATOM 1450 C LYS A 133 14.626 3.611 15.099 1.00 13.30 C ATOM 1451 O LYS A 133 13.699 3.532 14.271 1.00 1.33 O ATOM 1452 CB LYS A 133 16.678 2.699 14.226 1.00 43.25 C ATOM 1453 CG LYS A 133 17.672 1.581 14.033 1.00 52.41 C ATOM 1454 CD LYS A 133 18.656 1.448 15.166 1.00 74.20 C ATOM 1455 CE LYS A 133 19.662 0.352 14.850 1.00 54.52 C ATOM 1456 NZ LYS A 133 20.331 0.573 13.541 1.00 4.43 N ATOM 0 H LYS A 133 14.261 1.287 14.178 1.00 21.22 H new ATOM 0 HA LYS A 133 15.981 2.408 16.278 1.00 30.45 H new ATOM 0 HB2 LYS A 133 16.202 2.901 13.266 1.00 43.25 H new ATOM 0 HB3 LYS A 133 17.227 3.598 14.505 1.00 43.25 H new ATOM 0 HG2 LYS A 133 17.132 0.641 13.920 1.00 52.41 H new ATOM 0 HG3 LYS A 133 18.219 1.748 13.105 1.00 52.41 H new ATOM 0 HD2 LYS A 133 19.173 2.394 15.323 1.00 74.20 H new ATOM 0 HD3 LYS A 133 18.129 1.215 16.091 1.00 74.20 H new ATOM 0 HE2 LYS A 133 20.413 0.310 15.639 1.00 54.52 H new ATOM 0 HE3 LYS A 133 19.156 -0.613 14.840 1.00 54.52 H new ATOM 0 HZ1 LYS A 133 21.234 0.058 13.521 1.00 4.43 H new ATOM 0 HZ2 LYS A 133 19.718 0.227 12.775 1.00 4.43 H new ATOM 0 HZ3 LYS A 133 20.509 1.589 13.409 1.00 4.43 H new ATOM 1470 N GLU A 134 14.808 4.641 15.873 1.00 12.44 N ATOM 1471 CA GLU A 134 14.154 5.866 15.574 1.00 51.24 C ATOM 1472 C GLU A 134 15.186 6.726 14.836 1.00 63.44 C ATOM 1473 O GLU A 134 16.150 7.262 15.424 1.00 53.24 O ATOM 1474 CB GLU A 134 13.566 6.528 16.840 1.00 40.21 C ATOM 1475 CG GLU A 134 14.506 6.623 18.020 1.00 74.21 C ATOM 1476 CD GLU A 134 13.890 7.345 19.181 1.00 1.33 C ATOM 1477 OE1 GLU A 134 14.025 8.597 19.256 1.00 22.20 O ATOM 1478 OE2 GLU A 134 13.280 6.693 20.062 1.00 73.22 O ATOM 0 H GLU A 134 15.398 4.651 16.705 1.00 12.44 H new ATOM 0 HA GLU A 134 13.281 5.719 14.938 1.00 51.24 H new ATOM 0 HB2 GLU A 134 13.232 7.533 16.582 1.00 40.21 H new ATOM 0 HB3 GLU A 134 12.683 5.967 17.145 1.00 40.21 H new ATOM 0 HG2 GLU A 134 14.797 5.620 18.332 1.00 74.21 H new ATOM 0 HG3 GLU A 134 15.417 7.139 17.716 1.00 74.21 H new ATOM 1485 N GLY A 135 15.001 6.788 13.547 1.00 31.24 N ATOM 1486 CA GLY A 135 15.946 7.386 12.647 1.00 75.42 C ATOM 1487 C GLY A 135 15.264 7.936 11.432 1.00 21.51 C ATOM 1488 O GLY A 135 14.040 7.959 11.387 1.00 63.34 O ATOM 0 H GLY A 135 14.172 6.416 13.084 1.00 31.24 H new ATOM 0 HA2 GLY A 135 16.484 8.185 13.158 1.00 75.42 H new ATOM 0 HA3 GLY A 135 16.686 6.644 12.347 1.00 75.42 H new ATOM 1492 N GLY A 136 16.036 8.376 10.450 1.00 14.12 N ATOM 1493 CA GLY A 136 15.451 8.893 9.237 1.00 74.13 C ATOM 1494 C GLY A 136 15.656 7.923 8.096 1.00 12.12 C ATOM 1495 O GLY A 136 16.787 7.488 7.823 1.00 43.14 O ATOM 0 H GLY A 136 17.056 8.383 10.474 1.00 14.12 H new ATOM 0 HA2 GLY A 136 14.386 9.069 9.386 1.00 74.13 H new ATOM 0 HA3 GLY A 136 15.901 9.855 8.990 1.00 74.13 H new ATOM 1499 N SER A 137 14.562 7.602 7.451 1.00 70.12 N ATOM 1500 CA SER A 137 14.416 6.633 6.374 1.00 52.33 C ATOM 1501 C SER A 137 12.928 6.614 6.027 1.00 10.02 C ATOM 1502 O SER A 137 12.179 7.427 6.569 1.00 13.21 O ATOM 1503 CB SER A 137 14.896 5.222 6.811 1.00 54.44 C ATOM 1504 OG SER A 137 16.318 5.106 6.811 1.00 31.33 O ATOM 0 H SER A 137 13.672 8.045 7.679 1.00 70.12 H new ATOM 0 HA SER A 137 15.027 6.909 5.515 1.00 52.33 H new ATOM 0 HB2 SER A 137 14.517 5.006 7.810 1.00 54.44 H new ATOM 0 HB3 SER A 137 14.473 4.474 6.140 1.00 54.44 H new ATOM 0 HG SER A 137 16.718 5.992 6.934 1.00 31.33 H new ATOM 1510 N ASP A 138 12.503 5.790 5.114 1.00 20.03 N ATOM 1511 CA ASP A 138 11.070 5.629 4.898 1.00 23.22 C ATOM 1512 C ASP A 138 10.529 4.517 5.768 1.00 50.13 C ATOM 1513 O ASP A 138 9.800 4.766 6.727 1.00 11.01 O ATOM 1514 CB ASP A 138 10.701 5.391 3.424 1.00 32.05 C ATOM 1515 CG ASP A 138 10.513 6.667 2.639 1.00 30.22 C ATOM 1516 OD1 ASP A 138 11.502 7.291 2.231 1.00 73.12 O ATOM 1517 OD2 ASP A 138 9.357 7.062 2.404 1.00 64.25 O ATOM 0 H ASP A 138 13.102 5.225 4.512 1.00 20.03 H new ATOM 0 HA ASP A 138 10.604 6.573 5.182 1.00 23.22 H new ATOM 0 HB2 ASP A 138 11.483 4.795 2.953 1.00 32.05 H new ATOM 0 HB3 ASP A 138 9.783 4.806 3.377 1.00 32.05 H new ATOM 1522 N ASN A 139 10.956 3.311 5.481 1.00 33.41 N ATOM 1523 CA ASN A 139 10.470 2.103 6.165 1.00 33.01 C ATOM 1524 C ASN A 139 11.271 1.811 7.435 1.00 23.12 C ATOM 1525 O ASN A 139 10.780 1.226 8.396 1.00 50.42 O ATOM 1526 CB ASN A 139 10.556 0.917 5.177 1.00 22.23 C ATOM 1527 CG ASN A 139 10.265 -0.443 5.785 1.00 74.21 C ATOM 1528 OD1 ASN A 139 9.133 -0.920 5.806 1.00 14.25 O ATOM 1529 ND2 ASN A 139 11.282 -1.069 6.282 1.00 44.32 N ATOM 0 H ASN A 139 11.656 3.122 4.763 1.00 33.41 H new ATOM 0 HA ASN A 139 9.437 2.258 6.476 1.00 33.01 H new ATOM 0 HB2 ASN A 139 9.855 1.091 4.361 1.00 22.23 H new ATOM 0 HB3 ASN A 139 11.555 0.898 4.741 1.00 22.23 H new ATOM 0 HD21 ASN A 139 11.157 -1.987 6.708 1.00 44.32 H new ATOM 0 HD22 ASN A 139 12.209 -0.644 6.248 1.00 44.32 H new ATOM 1536 N ASP A 140 12.497 2.235 7.442 1.00 51.52 N ATOM 1537 CA ASP A 140 13.407 1.929 8.542 1.00 20.33 C ATOM 1538 C ASP A 140 13.497 3.081 9.524 1.00 33.13 C ATOM 1539 O ASP A 140 14.321 3.087 10.434 1.00 14.02 O ATOM 1540 CB ASP A 140 14.790 1.546 7.997 1.00 4.13 C ATOM 1541 CG ASP A 140 14.790 0.223 7.231 1.00 44.34 C ATOM 1542 OD1 ASP A 140 13.962 0.040 6.295 1.00 35.51 O ATOM 1543 OD2 ASP A 140 15.641 -0.641 7.515 1.00 63.22 O ATOM 0 H ASP A 140 12.909 2.800 6.699 1.00 51.52 H new ATOM 0 HA ASP A 140 13.007 1.075 9.089 1.00 20.33 H new ATOM 0 HB2 ASP A 140 15.147 2.339 7.340 1.00 4.13 H new ATOM 0 HB3 ASP A 140 15.494 1.478 8.826 1.00 4.13 H new ATOM 1548 N ALA A 141 12.630 4.034 9.339 1.00 0.25 N ATOM 1549 CA ALA A 141 12.525 5.197 10.193 1.00 15.43 C ATOM 1550 C ALA A 141 11.355 5.047 11.090 1.00 13.11 C ATOM 1551 O ALA A 141 10.433 4.308 10.769 1.00 1.31 O ATOM 1552 CB ALA A 141 12.310 6.422 9.385 1.00 31.23 C ATOM 0 H ALA A 141 11.957 4.030 8.573 1.00 0.25 H new ATOM 0 HA ALA A 141 13.451 5.282 10.762 1.00 15.43 H new ATOM 0 HB1 ALA A 141 12.234 7.285 10.046 1.00 31.23 H new ATOM 0 HB2 ALA A 141 13.149 6.560 8.703 1.00 31.23 H new ATOM 0 HB3 ALA A 141 11.389 6.322 8.811 1.00 31.23 H new ATOM 1558 N ASP A 142 11.366 5.740 12.191 1.00 2.31 N ATOM 1559 CA ASP A 142 10.242 5.695 13.068 1.00 72.20 C ATOM 1560 C ASP A 142 9.192 6.587 12.480 1.00 74.45 C ATOM 1561 O ASP A 142 9.458 7.736 12.099 1.00 13.24 O ATOM 1562 CB ASP A 142 10.583 6.152 14.507 1.00 31.32 C ATOM 1563 CG ASP A 142 10.971 7.621 14.629 1.00 51.24 C ATOM 1564 OD1 ASP A 142 12.060 7.996 14.146 1.00 72.22 O ATOM 1565 OD2 ASP A 142 10.193 8.425 15.206 1.00 72.43 O ATOM 0 H ASP A 142 12.135 6.336 12.498 1.00 2.31 H new ATOM 0 HA ASP A 142 9.898 4.664 13.155 1.00 72.20 H new ATOM 0 HB2 ASP A 142 9.722 5.962 15.148 1.00 31.32 H new ATOM 0 HB3 ASP A 142 11.403 5.540 14.884 1.00 31.32 H new ATOM 1570 N ILE A 143 8.044 6.061 12.323 1.00 12.01 N ATOM 1571 CA ILE A 143 6.971 6.807 11.780 1.00 60.41 C ATOM 1572 C ILE A 143 6.164 7.340 12.917 1.00 5.42 C ATOM 1573 O ILE A 143 5.923 6.630 13.887 1.00 1.45 O ATOM 1574 CB ILE A 143 6.132 5.983 10.730 1.00 73.23 C ATOM 1575 CG1 ILE A 143 5.679 4.598 11.243 1.00 63.23 C ATOM 1576 CG2 ILE A 143 6.906 5.818 9.441 1.00 53.23 C ATOM 1577 CD1 ILE A 143 4.463 4.612 12.132 1.00 13.43 C ATOM 0 H ILE A 143 7.814 5.097 12.566 1.00 12.01 H new ATOM 0 HA ILE A 143 7.352 7.647 11.199 1.00 60.41 H new ATOM 0 HB ILE A 143 5.227 6.565 10.554 1.00 73.23 H new ATOM 0 HG12 ILE A 143 5.475 3.959 10.384 1.00 63.23 H new ATOM 0 HG13 ILE A 143 6.505 4.143 11.790 1.00 63.23 H new ATOM 0 HG21 ILE A 143 6.310 5.247 8.729 1.00 53.23 H new ATOM 0 HG22 ILE A 143 7.129 6.799 9.022 1.00 53.23 H new ATOM 0 HG23 ILE A 143 7.838 5.289 9.641 1.00 53.23 H new ATOM 0 HD11 ILE A 143 4.225 3.594 12.439 1.00 13.43 H new ATOM 0 HD12 ILE A 143 4.664 5.220 13.014 1.00 13.43 H new ATOM 0 HD13 ILE A 143 3.618 5.033 11.587 1.00 13.43 H new ATOM 1589 N GLY A 144 5.822 8.585 12.872 1.00 43.33 N ATOM 1590 CA GLY A 144 5.155 9.124 13.996 1.00 51.33 C ATOM 1591 C GLY A 144 4.362 10.334 13.708 1.00 51.10 C ATOM 1592 O GLY A 144 4.466 10.933 12.635 1.00 62.23 O ATOM 0 H GLY A 144 5.988 9.225 12.095 1.00 43.33 H new ATOM 0 HA2 GLY A 144 4.496 8.362 14.413 1.00 51.33 H new ATOM 0 HA3 GLY A 144 5.893 9.361 14.763 1.00 51.33 H new ATOM 1596 N ASN A 145 3.596 10.695 14.673 1.00 21.42 N ATOM 1597 CA ASN A 145 2.726 11.814 14.618 1.00 13.44 C ATOM 1598 C ASN A 145 2.966 12.591 15.878 1.00 41.20 C ATOM 1599 O ASN A 145 3.250 11.999 16.918 1.00 44.31 O ATOM 1600 CB ASN A 145 1.268 11.353 14.516 1.00 65.04 C ATOM 1601 CG ASN A 145 0.301 12.503 14.524 1.00 71.23 C ATOM 1602 OD1 ASN A 145 -0.015 13.072 13.480 1.00 42.15 O ATOM 1603 ND2 ASN A 145 -0.185 12.847 15.691 1.00 45.32 N ATOM 0 H ASN A 145 3.557 10.197 15.562 1.00 21.42 H new ATOM 0 HA ASN A 145 2.918 12.431 13.740 1.00 13.44 H new ATOM 0 HB2 ASN A 145 1.135 10.777 13.600 1.00 65.04 H new ATOM 0 HB3 ASN A 145 1.042 10.686 15.348 1.00 65.04 H new ATOM 0 HD21 ASN A 145 -0.853 13.614 15.759 1.00 45.32 H new ATOM 0 HD22 ASN A 145 0.105 12.347 16.532 1.00 45.32 H new ATOM 1610 N TRP A 146 2.823 13.869 15.831 1.00 22.13 N ATOM 1611 CA TRP A 146 3.237 14.664 16.935 1.00 1.55 C ATOM 1612 C TRP A 146 2.294 15.820 17.130 1.00 32.33 C ATOM 1613 O TRP A 146 1.877 16.466 16.157 1.00 23.11 O ATOM 1614 CB TRP A 146 4.613 15.205 16.591 1.00 40.02 C ATOM 1615 CG TRP A 146 5.597 15.136 17.681 1.00 51.13 C ATOM 1616 CD1 TRP A 146 5.936 16.122 18.546 1.00 45.22 C ATOM 1617 CD2 TRP A 146 6.390 14.002 18.016 1.00 74.41 C ATOM 1618 NE1 TRP A 146 6.912 15.675 19.392 1.00 62.21 N ATOM 1619 CE2 TRP A 146 7.204 14.368 19.085 1.00 30.51 C ATOM 1620 CE3 TRP A 146 6.490 12.701 17.504 1.00 41.02 C ATOM 1621 CZ2 TRP A 146 8.110 13.488 19.653 1.00 52.14 C ATOM 1622 CZ3 TRP A 146 7.388 11.832 18.081 1.00 62.52 C ATOM 1623 CH2 TRP A 146 8.184 12.228 19.141 1.00 32.24 C ATOM 0 H TRP A 146 2.425 14.385 15.046 1.00 22.13 H new ATOM 0 HA TRP A 146 3.249 14.071 17.850 1.00 1.55 H new ATOM 0 HB2 TRP A 146 5.001 14.652 15.736 1.00 40.02 H new ATOM 0 HB3 TRP A 146 4.511 16.244 16.279 1.00 40.02 H new ATOM 0 HD1 TRP A 146 5.501 17.110 18.564 1.00 45.22 H new ATOM 0 HE1 TRP A 146 7.352 16.223 20.131 1.00 62.21 H new ATOM 0 HE3 TRP A 146 5.875 12.387 16.674 1.00 41.02 H new ATOM 0 HZ2 TRP A 146 8.739 13.792 20.477 1.00 52.14 H new ATOM 0 HZ3 TRP A 146 7.473 10.825 17.700 1.00 62.52 H new ATOM 0 HH2 TRP A 146 8.879 11.523 19.572 1.00 32.24 H new ATOM 1634 N ASP A 147 1.919 16.063 18.353 1.00 2.12 N ATOM 1635 CA ASP A 147 1.118 17.224 18.657 1.00 42.03 C ATOM 1636 C ASP A 147 2.039 18.189 19.294 1.00 74.51 C ATOM 1637 O ASP A 147 2.501 17.969 20.404 1.00 44.43 O ATOM 1638 CB ASP A 147 -0.037 16.924 19.616 1.00 64.55 C ATOM 1639 CG ASP A 147 -1.058 18.077 19.759 1.00 2.11 C ATOM 1640 OD1 ASP A 147 -0.669 19.263 19.955 1.00 55.21 O ATOM 1641 OD2 ASP A 147 -2.285 17.808 19.620 1.00 44.54 O ATOM 0 H ASP A 147 2.151 15.478 19.156 1.00 2.12 H new ATOM 0 HA ASP A 147 0.660 17.600 17.742 1.00 42.03 H new ATOM 0 HB2 ASP A 147 -0.559 16.032 19.270 1.00 64.55 H new ATOM 0 HB3 ASP A 147 0.373 16.692 20.599 1.00 64.55 H new ATOM 1646 N ASN A 148 2.391 19.169 18.560 1.00 1.23 N ATOM 1647 CA ASN A 148 3.234 20.212 19.006 1.00 63.54 C ATOM 1648 C ASN A 148 2.627 21.467 18.507 1.00 5.14 C ATOM 1649 O ASN A 148 2.369 22.364 19.303 1.00 12.45 O ATOM 1650 CB ASN A 148 4.697 20.032 18.531 1.00 1.14 C ATOM 1651 CG ASN A 148 4.869 19.996 17.019 1.00 25.43 C ATOM 1652 OD1 ASN A 148 4.797 18.819 16.443 1.00 14.23 O flip ATOM 1653 ND2 ASN A 148 5.094 21.026 16.376 1.00 14.33 N flip ATOM 1654 OXT ASN A 148 2.206 21.474 17.343 1.00 0.00 O ATOM 0 H ASN A 148 2.089 19.275 17.591 1.00 1.23 H new ATOM 0 HA ASN A 148 3.304 20.220 20.094 1.00 63.54 H new ATOM 0 HB2 ASN A 148 5.299 20.847 18.933 1.00 1.14 H new ATOM 0 HB3 ASN A 148 5.091 19.107 18.951 1.00 1.14 H new ATOM 0 HD21 ASN A 148 5.144 21.925 16.855 1.00 14.33 H new ATOM 0 HD22 ASN A 148 5.230 20.977 15.366 1.00 14.33 H new