USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 759 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 137 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 138 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 98 SER OG : rot 170:sc= -0.972 USER MOD Set 2.2: A 107 HIS : no HD1:sc= -10.9! C(o=-12!,f=-16!) USER MOD Set 3.1: A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 73 MET CE :methyl 145:sc= -0.288 (180deg=-1.81) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 91:sc= 0.694 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -3.09! C(o=-3.1!,f=-4.8!) USER MOD Single : A 79 HIS : no HD1:sc= -1.28 K(o=-1.3,f=-0.49) USER MOD Single : A 88 SER OG : rot -140:sc= -0.449 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc=-0.00526 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= -0.479 K(o=-0.48,f=-2.4) USER MOD Single : A 106 GLN : amide:sc= -1.13 K(o=-1.1,f=-3!) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot -50:sc= 0.789 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -0.942 K(o=-0.94,f=-0.0018) USER MOD Single : A 127 SER OG : rot 180:sc= -0.224 USER MOD Single : A 129 ASN : amide:sc= -0.556 K(o=-0.56,f=-2.3) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 HIS : no HE2:sc= 0.218 K(o=0.22,f=-2.9!) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 125:sc= 1.58 USER MOD Single : A 143 ASN : amide:sc= -0.0159 X(o=-0.016,f=0) USER MOD Single : A 144 GLN : amide:sc= -0.233 K(o=-0.23,f=-3!) USER MOD Single : A 145 GLN : amide:sc= -0.0616 K(o=-0.062,f=-1.5!) USER MOD Single : A 153 GLN : amide:sc= -0.371 K(o=-0.37,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N TRP A 60 0.921 0.196 -0.182 1.00 63.31 N ATOM 2 CA TRP A 60 1.742 0.162 -1.388 1.00 14.43 C ATOM 3 C TRP A 60 1.919 -1.268 -1.886 1.00 53.42 C ATOM 4 O TRP A 60 2.457 -1.495 -2.970 1.00 33.41 O ATOM 5 CB TRP A 60 3.108 0.794 -1.117 1.00 51.44 C ATOM 6 CG TRP A 60 3.625 0.524 0.263 1.00 14.34 C ATOM 7 CD1 TRP A 60 3.621 1.386 1.323 1.00 34.21 C ATOM 8 CD2 TRP A 60 4.223 -0.689 0.733 1.00 74.05 C ATOM 9 NE1 TRP A 60 4.180 0.781 2.423 1.00 42.13 N ATOM 10 CE2 TRP A 60 4.557 -0.492 2.087 1.00 73.42 C ATOM 11 CE3 TRP A 60 4.506 -1.923 0.141 1.00 5.03 C ATOM 12 CZ2 TRP A 60 5.161 -1.484 2.856 1.00 54.43 C ATOM 13 CZ3 TRP A 60 5.106 -2.906 0.906 1.00 42.43 C ATOM 14 CH2 TRP A 60 5.427 -2.682 2.251 1.00 3.11 C ATOM 0 HA TRP A 60 1.231 0.735 -2.162 1.00 14.43 H new ATOM 0 HB2 TRP A 60 3.825 0.417 -1.846 1.00 51.44 H new ATOM 0 HB3 TRP A 60 3.038 1.871 -1.266 1.00 51.44 H new ATOM 0 HD1 TRP A 60 3.235 2.395 1.300 1.00 34.21 H new ATOM 0 HE1 TRP A 60 4.295 1.210 3.341 1.00 42.13 H new ATOM 0 HE3 TRP A 60 4.261 -2.105 -0.895 1.00 5.03 H new ATOM 0 HZ2 TRP A 60 5.410 -1.314 3.893 1.00 54.43 H new ATOM 0 HZ3 TRP A 60 5.331 -3.863 0.459 1.00 42.43 H new ATOM 0 HH2 TRP A 60 5.894 -3.471 2.822 1.00 3.11 H new ATOM 25 N PHE A 61 1.463 -2.228 -1.089 1.00 60.31 N ATOM 26 CA PHE A 61 1.572 -3.637 -1.450 1.00 2.01 C ATOM 27 C PHE A 61 0.410 -4.061 -2.343 1.00 64.24 C ATOM 28 O PHE A 61 -0.717 -3.594 -2.179 1.00 22.01 O ATOM 29 CB PHE A 61 1.606 -4.506 -0.191 1.00 64.53 C ATOM 30 CG PHE A 61 1.080 -5.896 -0.408 1.00 72.35 C ATOM 31 CD1 PHE A 61 1.669 -6.737 -1.339 1.00 54.13 C ATOM 32 CD2 PHE A 61 -0.004 -6.362 0.318 1.00 53.10 C ATOM 33 CE1 PHE A 61 1.187 -8.017 -1.541 1.00 53.44 C ATOM 34 CE2 PHE A 61 -0.490 -7.641 0.121 1.00 52.44 C ATOM 35 CZ PHE A 61 0.105 -8.469 -0.811 1.00 42.50 C ATOM 0 H PHE A 61 1.015 -2.057 -0.189 1.00 60.31 H new ATOM 0 HA PHE A 61 2.501 -3.774 -2.003 1.00 2.01 H new ATOM 0 HB2 PHE A 61 2.632 -4.567 0.171 1.00 64.53 H new ATOM 0 HB3 PHE A 61 1.020 -4.022 0.591 1.00 64.53 H new ATOM 0 HD1 PHE A 61 2.514 -6.388 -1.913 1.00 54.13 H new ATOM 0 HD2 PHE A 61 -0.475 -5.718 1.046 1.00 53.10 H new ATOM 0 HE1 PHE A 61 1.656 -8.663 -2.269 1.00 53.44 H new ATOM 0 HE2 PHE A 61 -1.334 -7.993 0.695 1.00 52.44 H new ATOM 0 HZ PHE A 61 -0.275 -9.468 -0.969 1.00 42.50 H new ATOM 45 N PHE A 62 0.694 -4.949 -3.290 1.00 72.54 N ATOM 46 CA PHE A 62 -0.326 -5.436 -4.212 1.00 32.32 C ATOM 47 C PHE A 62 -0.228 -6.950 -4.382 1.00 11.45 C ATOM 48 O PHE A 62 0.866 -7.508 -4.448 1.00 70.21 O ATOM 49 CB PHE A 62 -0.185 -4.749 -5.572 1.00 31.14 C ATOM 50 CG PHE A 62 -0.776 -3.369 -5.610 1.00 14.01 C ATOM 51 CD1 PHE A 62 -0.250 -2.353 -4.828 1.00 62.34 C ATOM 52 CD2 PHE A 62 -1.859 -3.087 -6.427 1.00 73.42 C ATOM 53 CE1 PHE A 62 -0.791 -1.082 -4.862 1.00 33.05 C ATOM 54 CE2 PHE A 62 -2.405 -1.818 -6.465 1.00 23.01 C ATOM 55 CZ PHE A 62 -1.871 -0.814 -5.680 1.00 61.42 C ATOM 0 H PHE A 62 1.622 -5.346 -3.439 1.00 72.54 H new ATOM 0 HA PHE A 62 -1.303 -5.197 -3.792 1.00 32.32 H new ATOM 0 HB2 PHE A 62 0.872 -4.690 -5.833 1.00 31.14 H new ATOM 0 HB3 PHE A 62 -0.667 -5.363 -6.332 1.00 31.14 H new ATOM 0 HD1 PHE A 62 0.593 -2.557 -4.184 1.00 62.34 H new ATOM 0 HD2 PHE A 62 -2.282 -3.868 -7.041 1.00 73.42 H new ATOM 0 HE1 PHE A 62 -0.370 -0.299 -4.249 1.00 33.05 H new ATOM 0 HE2 PHE A 62 -3.248 -1.611 -7.108 1.00 23.01 H new ATOM 0 HZ PHE A 62 -2.297 0.178 -5.706 1.00 61.42 H new ATOM 65 N GLY A 63 -1.382 -7.608 -4.450 1.00 45.42 N ATOM 66 CA GLY A 63 -1.404 -9.050 -4.611 1.00 15.34 C ATOM 67 C GLY A 63 -1.042 -9.482 -6.017 1.00 62.44 C ATOM 68 O GLY A 63 -0.150 -8.908 -6.642 1.00 5.15 O ATOM 0 H GLY A 63 -2.301 -7.168 -4.396 1.00 45.42 H new ATOM 0 HA2 GLY A 63 -0.707 -9.502 -3.905 1.00 15.34 H new ATOM 0 HA3 GLY A 63 -2.397 -9.425 -4.363 1.00 15.34 H new ATOM 72 N LYS A 64 -1.734 -10.500 -6.519 1.00 1.14 N ATOM 73 CA LYS A 64 -1.481 -11.011 -7.861 1.00 2.25 C ATOM 74 C LYS A 64 -1.811 -9.959 -8.915 1.00 2.25 C ATOM 75 O LYS A 64 -2.944 -9.877 -9.389 1.00 40.04 O ATOM 76 CB LYS A 64 -2.306 -12.275 -8.111 1.00 65.41 C ATOM 77 CG LYS A 64 -1.506 -13.560 -7.974 1.00 54.22 C ATOM 78 CD LYS A 64 -1.715 -14.204 -6.614 1.00 1.12 C ATOM 79 CE LYS A 64 -1.027 -13.413 -5.511 1.00 73.04 C ATOM 80 NZ LYS A 64 -1.898 -13.258 -4.314 1.00 35.43 N ATOM 0 H LYS A 64 -2.475 -10.988 -6.016 1.00 1.14 H new ATOM 0 HA LYS A 64 -0.421 -11.255 -7.936 1.00 2.25 H new ATOM 0 HB2 LYS A 64 -3.140 -12.299 -7.409 1.00 65.41 H new ATOM 0 HB3 LYS A 64 -2.733 -12.228 -9.113 1.00 65.41 H new ATOM 0 HG2 LYS A 64 -1.800 -14.258 -8.757 1.00 54.22 H new ATOM 0 HG3 LYS A 64 -0.447 -13.347 -8.118 1.00 54.22 H new ATOM 0 HD2 LYS A 64 -2.782 -14.272 -6.403 1.00 1.12 H new ATOM 0 HD3 LYS A 64 -1.327 -15.223 -6.629 1.00 1.12 H new ATOM 0 HE2 LYS A 64 -0.103 -13.916 -5.225 1.00 73.04 H new ATOM 0 HE3 LYS A 64 -0.750 -12.429 -5.889 1.00 73.04 H new ATOM 0 HZ1 LYS A 64 -1.393 -12.714 -3.586 1.00 35.43 H new ATOM 0 HZ2 LYS A 64 -2.768 -12.755 -4.581 1.00 35.43 H new ATOM 0 HZ3 LYS A 64 -2.142 -14.197 -3.938 1.00 35.43 H new ATOM 94 N ILE A 65 -0.814 -9.158 -9.276 1.00 55.45 N ATOM 95 CA ILE A 65 -0.999 -8.113 -10.276 1.00 75.22 C ATOM 96 C ILE A 65 0.078 -8.186 -11.353 1.00 53.01 C ATOM 97 O ILE A 65 1.269 -8.309 -11.067 1.00 50.43 O ATOM 98 CB ILE A 65 -0.977 -6.712 -9.637 1.00 61.03 C ATOM 99 CG1 ILE A 65 0.335 -6.494 -8.881 1.00 1.40 C ATOM 100 CG2 ILE A 65 -2.167 -6.535 -8.706 1.00 71.23 C ATOM 101 CD1 ILE A 65 1.066 -5.234 -9.290 1.00 13.32 C ATOM 0 H ILE A 65 0.129 -9.212 -8.892 1.00 55.45 H new ATOM 0 HA ILE A 65 -1.975 -8.280 -10.730 1.00 75.22 H new ATOM 0 HB ILE A 65 -1.047 -5.966 -10.429 1.00 61.03 H new ATOM 0 HG12 ILE A 65 0.126 -6.453 -7.812 1.00 1.40 H new ATOM 0 HG13 ILE A 65 0.987 -7.352 -9.046 1.00 1.40 H new ATOM 0 HG21 ILE A 65 -2.137 -5.540 -8.262 1.00 71.23 H new ATOM 0 HG22 ILE A 65 -3.092 -6.653 -9.271 1.00 71.23 H new ATOM 0 HG23 ILE A 65 -2.126 -7.286 -7.917 1.00 71.23 H new ATOM 0 HD11 ILE A 65 1.987 -5.144 -8.713 1.00 13.32 H new ATOM 0 HD12 ILE A 65 1.306 -5.281 -10.352 1.00 13.32 H new ATOM 0 HD13 ILE A 65 0.433 -4.368 -9.099 1.00 13.32 H new ATOM 113 N PRO A 66 -0.348 -8.107 -12.622 1.00 74.15 N ATOM 114 CA PRO A 66 0.564 -8.159 -13.769 1.00 22.45 C ATOM 115 C PRO A 66 1.429 -6.909 -13.878 1.00 45.31 C ATOM 116 O PRO A 66 1.036 -5.830 -13.434 1.00 43.34 O ATOM 117 CB PRO A 66 -0.380 -8.263 -14.969 1.00 62.51 C ATOM 118 CG PRO A 66 -1.654 -7.647 -14.504 1.00 4.21 C ATOM 119 CD PRO A 66 -1.754 -7.960 -13.037 1.00 22.13 C ATOM 0 HA PRO A 66 1.269 -8.987 -13.692 1.00 22.45 H new ATOM 0 HB2 PRO A 66 0.021 -7.736 -15.835 1.00 62.51 H new ATOM 0 HB3 PRO A 66 -0.528 -9.301 -15.267 1.00 62.51 H new ATOM 0 HG2 PRO A 66 -1.652 -6.570 -14.674 1.00 4.21 H new ATOM 0 HG3 PRO A 66 -2.506 -8.054 -15.049 1.00 4.21 H new ATOM 0 HD2 PRO A 66 -2.253 -7.161 -12.489 1.00 22.13 H new ATOM 0 HD3 PRO A 66 -2.323 -8.872 -12.859 1.00 22.13 H new ATOM 127 N ARG A 67 2.609 -7.061 -14.472 1.00 13.31 N ATOM 128 CA ARG A 67 3.530 -5.943 -14.639 1.00 12.02 C ATOM 129 C ARG A 67 2.796 -4.704 -15.143 1.00 74.24 C ATOM 130 O ARG A 67 3.035 -3.593 -14.671 1.00 60.33 O ATOM 131 CB ARG A 67 4.649 -6.318 -15.612 1.00 53.44 C ATOM 132 CG ARG A 67 5.445 -5.124 -16.113 1.00 42.13 C ATOM 133 CD ARG A 67 6.585 -5.557 -17.023 1.00 14.52 C ATOM 134 NE ARG A 67 7.803 -5.848 -16.273 1.00 3.23 N ATOM 135 CZ ARG A 67 8.689 -4.922 -15.921 1.00 34.12 C ATOM 136 NH1 ARG A 67 8.491 -3.653 -16.249 1.00 44.30 N ATOM 137 NH2 ARG A 67 9.774 -5.265 -15.239 1.00 33.43 N ATOM 0 H ARG A 67 2.949 -7.947 -14.845 1.00 13.31 H new ATOM 0 HA ARG A 67 3.965 -5.715 -13.666 1.00 12.02 H new ATOM 0 HB2 ARG A 67 5.327 -7.016 -15.121 1.00 53.44 H new ATOM 0 HB3 ARG A 67 4.217 -6.840 -16.466 1.00 53.44 H new ATOM 0 HG2 ARG A 67 4.784 -4.446 -16.653 1.00 42.13 H new ATOM 0 HG3 ARG A 67 5.846 -4.570 -15.264 1.00 42.13 H new ATOM 0 HD2 ARG A 67 6.285 -6.442 -17.584 1.00 14.52 H new ATOM 0 HD3 ARG A 67 6.786 -4.771 -17.751 1.00 14.52 H new ATOM 0 HE ARG A 67 7.984 -6.815 -16.004 1.00 3.23 H new ATOM 0 HH11 ARG A 67 7.657 -3.386 -16.772 1.00 44.30 H new ATOM 0 HH12 ARG A 67 9.172 -2.944 -15.978 1.00 44.30 H new ATOM 0 HH21 ARG A 67 9.929 -6.240 -14.984 1.00 33.43 H new ATOM 0 HH22 ARG A 67 10.453 -4.553 -14.970 1.00 33.43 H new ATOM 151 N ALA A 68 1.901 -4.904 -16.106 1.00 1.21 N ATOM 152 CA ALA A 68 1.131 -3.804 -16.673 1.00 42.14 C ATOM 153 C ALA A 68 0.368 -3.051 -15.589 1.00 4.22 C ATOM 154 O ALA A 68 0.458 -1.827 -15.488 1.00 11.11 O ATOM 155 CB ALA A 68 0.171 -4.323 -17.733 1.00 33.41 C ATOM 0 H ALA A 68 1.692 -5.817 -16.509 1.00 1.21 H new ATOM 0 HA ALA A 68 1.828 -3.108 -17.139 1.00 42.14 H new ATOM 0 HB1 ALA A 68 -0.398 -3.491 -18.148 1.00 33.41 H new ATOM 0 HB2 ALA A 68 0.736 -4.809 -18.529 1.00 33.41 H new ATOM 0 HB3 ALA A 68 -0.514 -5.042 -17.283 1.00 33.41 H new ATOM 161 N LYS A 69 -0.383 -3.789 -14.779 1.00 62.21 N ATOM 162 CA LYS A 69 -1.162 -3.192 -13.701 1.00 23.02 C ATOM 163 C LYS A 69 -0.301 -2.250 -12.865 1.00 40.12 C ATOM 164 O LYS A 69 -0.688 -1.112 -12.599 1.00 30.50 O ATOM 165 CB LYS A 69 -1.756 -4.284 -12.808 1.00 1.20 C ATOM 166 CG LYS A 69 -2.898 -3.798 -11.932 1.00 22.41 C ATOM 167 CD LYS A 69 -4.240 -4.300 -12.437 1.00 53.53 C ATOM 168 CE LYS A 69 -5.327 -4.140 -11.385 1.00 22.11 C ATOM 169 NZ LYS A 69 -6.133 -2.907 -11.602 1.00 42.12 N ATOM 0 H LYS A 69 -0.469 -4.803 -14.849 1.00 62.21 H new ATOM 0 HA LYS A 69 -1.972 -2.616 -14.148 1.00 23.02 H new ATOM 0 HB2 LYS A 69 -2.113 -5.101 -13.435 1.00 1.20 H new ATOM 0 HB3 LYS A 69 -0.969 -4.690 -12.173 1.00 1.20 H new ATOM 0 HG2 LYS A 69 -2.743 -4.138 -10.908 1.00 22.41 H new ATOM 0 HG3 LYS A 69 -2.901 -2.708 -11.908 1.00 22.41 H new ATOM 0 HD2 LYS A 69 -4.520 -3.752 -13.337 1.00 53.53 H new ATOM 0 HD3 LYS A 69 -4.155 -5.350 -12.717 1.00 53.53 H new ATOM 0 HE2 LYS A 69 -5.983 -5.010 -11.405 1.00 22.11 H new ATOM 0 HE3 LYS A 69 -4.872 -4.107 -10.395 1.00 22.11 H new ATOM 0 HZ1 LYS A 69 -6.863 -2.835 -10.864 1.00 42.12 H new ATOM 0 HZ2 LYS A 69 -5.512 -2.074 -11.557 1.00 42.12 H new ATOM 0 HZ3 LYS A 69 -6.588 -2.950 -12.536 1.00 42.12 H new ATOM 183 N ALA A 70 0.868 -2.731 -12.456 1.00 4.43 N ATOM 184 CA ALA A 70 1.785 -1.930 -11.654 1.00 10.23 C ATOM 185 C ALA A 70 2.121 -0.616 -12.352 1.00 24.51 C ATOM 186 O ALA A 70 2.023 0.456 -11.756 1.00 62.24 O ATOM 187 CB ALA A 70 3.055 -2.715 -11.362 1.00 21.11 C ATOM 0 H ALA A 70 1.203 -3.671 -12.667 1.00 4.43 H new ATOM 0 HA ALA A 70 1.292 -1.694 -10.711 1.00 10.23 H new ATOM 0 HB1 ALA A 70 3.730 -2.105 -10.763 1.00 21.11 H new ATOM 0 HB2 ALA A 70 2.804 -3.623 -10.814 1.00 21.11 H new ATOM 0 HB3 ALA A 70 3.542 -2.981 -12.300 1.00 21.11 H new ATOM 193 N GLU A 71 2.519 -0.709 -13.617 1.00 41.00 N ATOM 194 CA GLU A 71 2.871 0.473 -14.395 1.00 4.13 C ATOM 195 C GLU A 71 1.707 1.458 -14.446 1.00 74.41 C ATOM 196 O GLU A 71 1.905 2.661 -14.609 1.00 61.15 O ATOM 197 CB GLU A 71 3.279 0.074 -15.814 1.00 42.04 C ATOM 198 CG GLU A 71 4.502 -0.826 -15.866 1.00 62.20 C ATOM 199 CD GLU A 71 4.840 -1.271 -17.276 1.00 32.33 C ATOM 200 OE1 GLU A 71 4.060 -2.059 -17.851 1.00 61.21 O ATOM 201 OE2 GLU A 71 5.883 -0.832 -17.803 1.00 60.53 O ATOM 0 H GLU A 71 2.606 -1.590 -14.124 1.00 41.00 H new ATOM 0 HA GLU A 71 3.715 0.960 -13.906 1.00 4.13 H new ATOM 0 HB2 GLU A 71 2.443 -0.435 -16.294 1.00 42.04 H new ATOM 0 HB3 GLU A 71 3.477 0.976 -16.393 1.00 42.04 H new ATOM 0 HG2 GLU A 71 5.356 -0.298 -15.441 1.00 62.20 H new ATOM 0 HG3 GLU A 71 4.329 -1.704 -15.244 1.00 62.20 H new ATOM 208 N GLU A 72 0.492 0.936 -14.306 1.00 11.01 N ATOM 209 CA GLU A 72 -0.705 1.769 -14.338 1.00 24.11 C ATOM 210 C GLU A 72 -0.934 2.444 -12.989 1.00 20.24 C ATOM 211 O GLU A 72 -1.242 3.633 -12.922 1.00 51.33 O ATOM 212 CB GLU A 72 -1.927 0.930 -14.715 1.00 72.40 C ATOM 213 CG GLU A 72 -1.964 0.532 -16.181 1.00 40.42 C ATOM 214 CD GLU A 72 -2.371 1.679 -17.086 1.00 75.22 C ATOM 215 OE1 GLU A 72 -3.567 2.041 -17.085 1.00 24.41 O ATOM 216 OE2 GLU A 72 -1.494 2.214 -17.796 1.00 12.44 O ATOM 0 H GLU A 72 0.311 -0.058 -14.170 1.00 11.01 H new ATOM 0 HA GLU A 72 -0.558 2.543 -15.092 1.00 24.11 H new ATOM 0 HB2 GLU A 72 -1.941 0.029 -14.102 1.00 72.40 H new ATOM 0 HB3 GLU A 72 -2.830 1.492 -14.477 1.00 72.40 H new ATOM 0 HG2 GLU A 72 -0.981 0.169 -16.480 1.00 40.42 H new ATOM 0 HG3 GLU A 72 -2.662 -0.295 -16.312 1.00 40.42 H new ATOM 223 N MET A 73 -0.782 1.675 -11.915 1.00 62.35 N ATOM 224 CA MET A 73 -0.972 2.198 -10.568 1.00 24.14 C ATOM 225 C MET A 73 -0.024 3.363 -10.298 1.00 74.22 C ATOM 226 O MET A 73 -0.352 4.282 -9.546 1.00 72.23 O ATOM 227 CB MET A 73 -0.748 1.094 -9.533 1.00 20.34 C ATOM 228 CG MET A 73 -1.711 -0.074 -9.672 1.00 12.01 C ATOM 229 SD MET A 73 -3.431 0.454 -9.789 1.00 11.55 S ATOM 230 CE MET A 73 -3.725 0.264 -11.545 1.00 54.50 C ATOM 0 H MET A 73 -0.528 0.688 -11.952 1.00 62.35 H new ATOM 0 HA MET A 73 -1.997 2.560 -10.487 1.00 24.14 H new ATOM 0 HB2 MET A 73 0.274 0.725 -9.623 1.00 20.34 H new ATOM 0 HB3 MET A 73 -0.846 1.519 -8.534 1.00 20.34 H new ATOM 0 HG2 MET A 73 -1.451 -0.651 -10.560 1.00 12.01 H new ATOM 0 HG3 MET A 73 -1.596 -0.738 -8.815 1.00 12.01 H new ATOM 0 HE1 MET A 73 -4.752 -0.061 -11.709 1.00 54.50 H new ATOM 0 HE2 MET A 73 -3.562 1.218 -12.046 1.00 54.50 H new ATOM 0 HE3 MET A 73 -3.040 -0.480 -11.950 1.00 54.50 H new ATOM 240 N LEU A 74 1.151 3.319 -10.916 1.00 30.43 N ATOM 241 CA LEU A 74 2.146 4.371 -10.742 1.00 64.23 C ATOM 242 C LEU A 74 1.907 5.514 -11.723 1.00 61.14 C ATOM 243 O LEU A 74 1.937 6.685 -11.346 1.00 53.34 O ATOM 244 CB LEU A 74 3.554 3.805 -10.935 1.00 24.33 C ATOM 245 CG LEU A 74 3.856 2.493 -10.209 1.00 14.14 C ATOM 246 CD1 LEU A 74 5.103 1.839 -10.783 1.00 13.20 C ATOM 247 CD2 LEU A 74 4.018 2.735 -8.715 1.00 52.51 C ATOM 0 H LEU A 74 1.438 2.566 -11.542 1.00 30.43 H new ATOM 0 HA LEU A 74 2.053 4.761 -9.728 1.00 64.23 H new ATOM 0 HB2 LEU A 74 3.720 3.653 -12.002 1.00 24.33 H new ATOM 0 HB3 LEU A 74 4.273 4.554 -10.604 1.00 24.33 H new ATOM 0 HG LEU A 74 3.015 1.816 -10.358 1.00 14.14 H new ATOM 0 HD11 LEU A 74 5.302 0.907 -10.254 1.00 13.20 H new ATOM 0 HD12 LEU A 74 4.949 1.629 -11.842 1.00 13.20 H new ATOM 0 HD13 LEU A 74 5.953 2.511 -10.666 1.00 13.20 H new ATOM 0 HD21 LEU A 74 4.232 1.791 -8.215 1.00 52.51 H new ATOM 0 HD22 LEU A 74 4.840 3.430 -8.546 1.00 52.51 H new ATOM 0 HD23 LEU A 74 3.097 3.158 -8.313 1.00 52.51 H new ATOM 259 N SER A 75 1.668 5.165 -12.984 1.00 10.14 N ATOM 260 CA SER A 75 1.425 6.162 -14.020 1.00 32.03 C ATOM 261 C SER A 75 0.253 7.064 -13.642 1.00 24.42 C ATOM 262 O SER A 75 0.360 8.290 -13.680 1.00 25.54 O ATOM 263 CB SER A 75 1.145 5.478 -15.359 1.00 43.24 C ATOM 264 OG SER A 75 2.348 5.051 -15.974 1.00 62.45 O ATOM 0 H SER A 75 1.638 4.200 -13.312 1.00 10.14 H new ATOM 0 HA SER A 75 2.319 6.778 -14.114 1.00 32.03 H new ATOM 0 HB2 SER A 75 0.488 4.622 -15.204 1.00 43.24 H new ATOM 0 HB3 SER A 75 0.619 6.167 -16.020 1.00 43.24 H new ATOM 0 HG SER A 75 2.549 4.133 -15.696 1.00 62.45 H new ATOM 270 N LYS A 76 -0.866 6.447 -13.277 1.00 43.12 N ATOM 271 CA LYS A 76 -2.059 7.191 -12.891 1.00 4.23 C ATOM 272 C LYS A 76 -1.714 8.291 -11.891 1.00 20.50 C ATOM 273 O LYS A 76 -2.373 9.329 -11.846 1.00 30.21 O ATOM 274 CB LYS A 76 -3.101 6.247 -12.287 1.00 64.32 C ATOM 275 CG LYS A 76 -2.694 5.673 -10.941 1.00 70.30 C ATOM 276 CD LYS A 76 -3.906 5.268 -10.119 1.00 22.35 C ATOM 277 CE LYS A 76 -4.500 3.957 -10.610 1.00 21.52 C ATOM 278 NZ LYS A 76 -5.883 4.135 -11.132 1.00 11.44 N ATOM 0 H LYS A 76 -0.971 5.433 -13.240 1.00 43.12 H new ATOM 0 HA LYS A 76 -2.473 7.654 -13.786 1.00 4.23 H new ATOM 0 HB2 LYS A 76 -4.043 6.784 -12.174 1.00 64.32 H new ATOM 0 HB3 LYS A 76 -3.283 5.427 -12.982 1.00 64.32 H new ATOM 0 HG2 LYS A 76 -2.050 4.807 -11.093 1.00 70.30 H new ATOM 0 HG3 LYS A 76 -2.110 6.411 -10.391 1.00 70.30 H new ATOM 0 HD2 LYS A 76 -3.620 5.169 -9.072 1.00 22.35 H new ATOM 0 HD3 LYS A 76 -4.661 6.053 -10.171 1.00 22.35 H new ATOM 0 HE2 LYS A 76 -3.867 3.543 -11.394 1.00 21.52 H new ATOM 0 HE3 LYS A 76 -4.510 3.235 -9.794 1.00 21.52 H new ATOM 0 HZ1 LYS A 76 -6.252 3.219 -11.457 1.00 11.44 H new ATOM 0 HZ2 LYS A 76 -6.494 4.506 -10.377 1.00 11.44 H new ATOM 0 HZ3 LYS A 76 -5.870 4.805 -11.928 1.00 11.44 H new ATOM 292 N GLN A 77 -0.677 8.055 -11.093 1.00 74.12 N ATOM 293 CA GLN A 77 -0.246 9.026 -10.095 1.00 42.42 C ATOM 294 C GLN A 77 0.196 10.327 -10.757 1.00 43.33 C ATOM 295 O GLN A 77 0.223 10.433 -11.984 1.00 12.14 O ATOM 296 CB GLN A 77 0.897 8.453 -9.256 1.00 4.42 C ATOM 297 CG GLN A 77 0.591 7.088 -8.662 1.00 12.02 C ATOM 298 CD GLN A 77 -0.284 7.172 -7.426 1.00 42.14 C ATOM 299 OE1 GLN A 77 -0.314 8.195 -6.742 1.00 12.04 O ATOM 300 NE2 GLN A 77 -1.002 6.094 -7.135 1.00 23.24 N ATOM 0 H GLN A 77 -0.121 7.200 -11.119 1.00 74.12 H new ATOM 0 HA GLN A 77 -1.093 9.241 -9.444 1.00 42.42 H new ATOM 0 HB2 GLN A 77 1.790 8.378 -9.877 1.00 4.42 H new ATOM 0 HB3 GLN A 77 1.128 9.148 -8.449 1.00 4.42 H new ATOM 0 HG2 GLN A 77 0.095 6.472 -9.412 1.00 12.02 H new ATOM 0 HG3 GLN A 77 1.526 6.589 -8.407 1.00 12.02 H new ATOM 0 HE21 GLN A 77 -0.946 5.268 -7.731 1.00 23.24 H new ATOM 0 HE22 GLN A 77 -1.610 6.092 -6.316 1.00 23.24 H new ATOM 309 N ARG A 78 0.542 11.315 -9.938 1.00 21.21 N ATOM 310 CA ARG A 78 0.982 12.609 -10.444 1.00 55.44 C ATOM 311 C ARG A 78 2.388 12.937 -9.952 1.00 21.11 C ATOM 312 O ARG A 78 3.171 13.574 -10.657 1.00 5.02 O ATOM 313 CB ARG A 78 0.009 13.708 -10.010 1.00 60.42 C ATOM 314 CG ARG A 78 -1.452 13.298 -10.100 1.00 21.45 C ATOM 315 CD ARG A 78 -1.817 12.840 -11.503 1.00 32.42 C ATOM 316 NE ARG A 78 -3.084 13.410 -11.953 1.00 0.45 N ATOM 317 CZ ARG A 78 -3.297 14.715 -12.083 1.00 41.03 C ATOM 318 NH1 ARG A 78 -2.332 15.579 -11.800 1.00 41.25 N ATOM 319 NH2 ARG A 78 -4.477 15.158 -12.498 1.00 60.42 N ATOM 0 H ARG A 78 0.526 11.244 -8.921 1.00 21.21 H new ATOM 0 HA ARG A 78 1.000 12.557 -11.533 1.00 55.44 H new ATOM 0 HB2 ARG A 78 0.234 13.996 -8.983 1.00 60.42 H new ATOM 0 HB3 ARG A 78 0.169 14.589 -10.631 1.00 60.42 H new ATOM 0 HG2 ARG A 78 -1.650 12.494 -9.391 1.00 21.45 H new ATOM 0 HG3 ARG A 78 -2.085 14.138 -9.814 1.00 21.45 H new ATOM 0 HD2 ARG A 78 -1.025 13.126 -12.195 1.00 32.42 H new ATOM 0 HD3 ARG A 78 -1.881 11.752 -11.524 1.00 32.42 H new ATOM 0 HE ARG A 78 -3.847 12.772 -12.180 1.00 0.45 H new ATOM 0 HH11 ARG A 78 -1.423 15.242 -11.482 1.00 41.25 H new ATOM 0 HH12 ARG A 78 -2.498 16.580 -11.901 1.00 41.25 H new ATOM 0 HH21 ARG A 78 -5.222 14.496 -12.718 1.00 60.42 H new ATOM 0 HH22 ARG A 78 -4.639 16.160 -12.597 1.00 60.42 H new ATOM 333 N HIS A 79 2.702 12.497 -8.737 1.00 54.32 N ATOM 334 CA HIS A 79 4.014 12.744 -8.150 1.00 71.31 C ATOM 335 C HIS A 79 5.111 12.076 -8.973 1.00 43.04 C ATOM 336 O HIS A 79 4.858 11.563 -10.063 1.00 72.23 O ATOM 337 CB HIS A 79 4.056 12.230 -6.710 1.00 45.45 C ATOM 338 CG HIS A 79 2.723 12.246 -6.029 1.00 53.13 C ATOM 339 ND1 HIS A 79 2.302 11.248 -5.176 1.00 13.32 N ATOM 340 CD2 HIS A 79 1.714 13.148 -6.078 1.00 61.54 C ATOM 341 CE1 HIS A 79 1.091 11.534 -4.731 1.00 3.33 C ATOM 342 NE2 HIS A 79 0.712 12.682 -5.263 1.00 50.11 N ATOM 0 H HIS A 79 2.066 11.968 -8.140 1.00 54.32 H new ATOM 0 HA HIS A 79 4.189 13.820 -8.149 1.00 71.31 H new ATOM 0 HB2 HIS A 79 4.444 11.211 -6.708 1.00 45.45 H new ATOM 0 HB3 HIS A 79 4.755 12.838 -6.136 1.00 45.45 H new ATOM 0 HD2 HIS A 79 1.700 14.063 -6.651 1.00 61.54 H new ATOM 0 HE1 HIS A 79 0.510 10.932 -4.048 1.00 3.33 H new ATOM 0 HE2 HIS A 79 -0.180 13.147 -5.096 1.00 50.11 H new ATOM 350 N ASP A 80 6.330 12.088 -8.445 1.00 62.52 N ATOM 351 CA ASP A 80 7.466 11.483 -9.131 1.00 24.11 C ATOM 352 C ASP A 80 8.219 10.534 -8.203 1.00 51.12 C ATOM 353 O ASP A 80 8.946 10.969 -7.311 1.00 33.22 O ATOM 354 CB ASP A 80 8.413 12.567 -9.649 1.00 13.23 C ATOM 355 CG ASP A 80 8.130 13.924 -9.035 1.00 15.12 C ATOM 356 OD1 ASP A 80 7.143 14.568 -9.449 1.00 42.01 O ATOM 357 OD2 ASP A 80 8.895 14.343 -8.141 1.00 33.33 O ATOM 0 H ASP A 80 6.557 12.510 -7.544 1.00 62.52 H new ATOM 0 HA ASP A 80 7.085 10.910 -9.976 1.00 24.11 H new ATOM 0 HB2 ASP A 80 9.442 12.281 -9.432 1.00 13.23 H new ATOM 0 HB3 ASP A 80 8.323 12.636 -10.733 1.00 13.23 H new ATOM 362 N GLY A 81 8.038 9.235 -8.420 1.00 61.22 N ATOM 363 CA GLY A 81 8.705 8.245 -7.595 1.00 24.01 C ATOM 364 C GLY A 81 7.738 7.245 -6.993 1.00 3.24 C ATOM 365 O GLY A 81 8.035 6.620 -5.975 1.00 11.43 O ATOM 0 H GLY A 81 7.441 8.851 -9.152 1.00 61.22 H new ATOM 0 HA2 GLY A 81 9.444 7.715 -8.195 1.00 24.01 H new ATOM 0 HA3 GLY A 81 9.247 8.749 -6.795 1.00 24.01 H new ATOM 369 N ALA A 82 6.577 7.094 -7.622 1.00 3.54 N ATOM 370 CA ALA A 82 5.564 6.164 -7.142 1.00 34.54 C ATOM 371 C ALA A 82 6.101 4.737 -7.106 1.00 62.11 C ATOM 372 O ALA A 82 6.550 4.206 -8.123 1.00 13.44 O ATOM 373 CB ALA A 82 4.321 6.240 -8.016 1.00 32.41 C ATOM 0 H ALA A 82 6.315 7.604 -8.465 1.00 3.54 H new ATOM 0 HA ALA A 82 5.297 6.450 -6.124 1.00 34.54 H new ATOM 0 HB1 ALA A 82 3.572 5.540 -7.646 1.00 32.41 H new ATOM 0 HB2 ALA A 82 3.917 7.252 -7.987 1.00 32.41 H new ATOM 0 HB3 ALA A 82 4.582 5.983 -9.043 1.00 32.41 H new ATOM 379 N PHE A 83 6.054 4.121 -5.930 1.00 30.24 N ATOM 380 CA PHE A 83 6.538 2.756 -5.762 1.00 21.45 C ATOM 381 C PHE A 83 5.386 1.804 -5.452 1.00 51.20 C ATOM 382 O PHE A 83 4.373 2.204 -4.876 1.00 21.10 O ATOM 383 CB PHE A 83 7.579 2.695 -4.642 1.00 1.22 C ATOM 384 CG PHE A 83 6.978 2.674 -3.265 1.00 43.53 C ATOM 385 CD1 PHE A 83 6.546 1.485 -2.702 1.00 15.12 C ATOM 386 CD2 PHE A 83 6.846 3.845 -2.535 1.00 71.32 C ATOM 387 CE1 PHE A 83 5.993 1.462 -1.435 1.00 54.41 C ATOM 388 CE2 PHE A 83 6.294 3.828 -1.268 1.00 42.11 C ATOM 389 CZ PHE A 83 5.866 2.636 -0.718 1.00 31.31 C ATOM 0 H PHE A 83 5.686 4.545 -5.079 1.00 30.24 H new ATOM 0 HA PHE A 83 7.002 2.445 -6.698 1.00 21.45 H new ATOM 0 HB2 PHE A 83 8.193 1.804 -4.775 1.00 1.22 H new ATOM 0 HB3 PHE A 83 8.243 3.555 -4.727 1.00 1.22 H new ATOM 0 HD1 PHE A 83 6.642 0.565 -3.259 1.00 15.12 H new ATOM 0 HD2 PHE A 83 7.178 4.780 -2.961 1.00 71.32 H new ATOM 0 HE1 PHE A 83 5.661 0.528 -1.007 1.00 54.41 H new ATOM 0 HE2 PHE A 83 6.197 4.747 -0.708 1.00 42.11 H new ATOM 0 HZ PHE A 83 5.433 2.621 0.271 1.00 31.31 H new ATOM 399 N LEU A 84 5.547 0.544 -5.839 1.00 25.31 N ATOM 400 CA LEU A 84 4.521 -0.466 -5.604 1.00 24.31 C ATOM 401 C LEU A 84 5.133 -1.863 -5.558 1.00 35.02 C ATOM 402 O LEU A 84 5.683 -2.343 -6.549 1.00 73.32 O ATOM 403 CB LEU A 84 3.453 -0.400 -6.697 1.00 22.31 C ATOM 404 CG LEU A 84 2.532 -1.616 -6.809 1.00 42.34 C ATOM 405 CD1 LEU A 84 1.183 -1.212 -7.384 1.00 44.12 C ATOM 406 CD2 LEU A 84 3.177 -2.696 -7.666 1.00 30.04 C ATOM 0 H LEU A 84 6.378 0.197 -6.317 1.00 25.31 H new ATOM 0 HA LEU A 84 4.057 -0.261 -4.639 1.00 24.31 H new ATOM 0 HB2 LEU A 84 2.837 0.482 -6.523 1.00 22.31 H new ATOM 0 HB3 LEU A 84 3.951 -0.257 -7.656 1.00 22.31 H new ATOM 0 HG LEU A 84 2.372 -2.020 -5.810 1.00 42.34 H new ATOM 0 HD11 LEU A 84 0.541 -2.090 -7.457 1.00 44.12 H new ATOM 0 HD12 LEU A 84 0.716 -0.474 -6.732 1.00 44.12 H new ATOM 0 HD13 LEU A 84 1.324 -0.783 -8.376 1.00 44.12 H new ATOM 0 HD21 LEU A 84 2.508 -3.554 -7.735 1.00 30.04 H new ATOM 0 HD22 LEU A 84 3.367 -2.303 -8.665 1.00 30.04 H new ATOM 0 HD23 LEU A 84 4.119 -3.006 -7.213 1.00 30.04 H new ATOM 418 N ILE A 85 5.030 -2.510 -4.402 1.00 22.12 N ATOM 419 CA ILE A 85 5.570 -3.853 -4.228 1.00 51.12 C ATOM 420 C ILE A 85 4.525 -4.913 -4.562 1.00 45.43 C ATOM 421 O ILE A 85 3.440 -4.934 -3.982 1.00 2.24 O ATOM 422 CB ILE A 85 6.070 -4.077 -2.789 1.00 10.11 C ATOM 423 CG1 ILE A 85 7.113 -3.021 -2.418 1.00 64.01 C ATOM 424 CG2 ILE A 85 6.649 -5.476 -2.641 1.00 33.10 C ATOM 425 CD1 ILE A 85 7.693 -3.205 -1.033 1.00 42.31 C ATOM 0 H ILE A 85 4.578 -2.126 -3.572 1.00 22.12 H new ATOM 0 HA ILE A 85 6.411 -3.946 -4.915 1.00 51.12 H new ATOM 0 HB ILE A 85 5.225 -3.981 -2.107 1.00 10.11 H new ATOM 0 HG12 ILE A 85 7.922 -3.048 -3.148 1.00 64.01 H new ATOM 0 HG13 ILE A 85 6.657 -2.033 -2.484 1.00 64.01 H new ATOM 0 HG21 ILE A 85 6.998 -5.619 -1.618 1.00 33.10 H new ATOM 0 HG22 ILE A 85 5.880 -6.214 -2.868 1.00 33.10 H new ATOM 0 HG23 ILE A 85 7.485 -5.599 -3.330 1.00 33.10 H new ATOM 0 HD11 ILE A 85 8.425 -2.421 -0.838 1.00 42.31 H new ATOM 0 HD12 ILE A 85 6.894 -3.148 -0.293 1.00 42.31 H new ATOM 0 HD13 ILE A 85 8.178 -4.179 -0.968 1.00 42.31 H new ATOM 437 N ARG A 86 4.862 -5.792 -5.501 1.00 13.35 N ATOM 438 CA ARG A 86 3.953 -6.855 -5.912 1.00 22.33 C ATOM 439 C ARG A 86 4.451 -8.213 -5.426 1.00 32.42 C ATOM 440 O ARG A 86 5.643 -8.398 -5.185 1.00 43.21 O ATOM 441 CB ARG A 86 3.806 -6.869 -7.434 1.00 71.03 C ATOM 442 CG ARG A 86 5.113 -6.639 -8.175 1.00 1.52 C ATOM 443 CD ARG A 86 5.193 -5.228 -8.737 1.00 63.15 C ATOM 444 NE ARG A 86 5.269 -5.224 -10.196 1.00 25.11 N ATOM 445 CZ ARG A 86 6.382 -5.480 -10.874 1.00 45.24 C ATOM 446 NH1 ARG A 86 7.507 -5.759 -10.229 1.00 52.34 N ATOM 447 NH2 ARG A 86 6.372 -5.457 -12.201 1.00 61.31 N ATOM 0 H ARG A 86 5.757 -5.789 -5.991 1.00 13.35 H new ATOM 0 HA ARG A 86 2.979 -6.661 -5.462 1.00 22.33 H new ATOM 0 HB2 ARG A 86 3.388 -7.828 -7.741 1.00 71.03 H new ATOM 0 HB3 ARG A 86 3.091 -6.101 -7.728 1.00 71.03 H new ATOM 0 HG2 ARG A 86 5.951 -6.811 -7.499 1.00 1.52 H new ATOM 0 HG3 ARG A 86 5.205 -7.361 -8.986 1.00 1.52 H new ATOM 0 HD2 ARG A 86 4.319 -4.660 -8.418 1.00 63.15 H new ATOM 0 HD3 ARG A 86 6.068 -4.723 -8.327 1.00 63.15 H new ATOM 0 HE ARG A 86 4.421 -5.013 -10.723 1.00 25.11 H new ATOM 0 HH11 ARG A 86 7.519 -5.777 -9.209 1.00 52.34 H new ATOM 0 HH12 ARG A 86 8.360 -5.955 -10.753 1.00 52.34 H new ATOM 0 HH21 ARG A 86 5.509 -5.243 -12.701 1.00 61.31 H new ATOM 0 HH22 ARG A 86 7.227 -5.654 -12.721 1.00 61.31 H new ATOM 461 N GLU A 87 3.528 -9.160 -5.284 1.00 1.13 N ATOM 462 CA GLU A 87 3.874 -10.500 -4.825 1.00 71.22 C ATOM 463 C GLU A 87 3.542 -11.542 -5.890 1.00 4.11 C ATOM 464 O GLU A 87 2.493 -11.478 -6.531 1.00 23.03 O ATOM 465 CB GLU A 87 3.131 -10.827 -3.528 1.00 3.12 C ATOM 466 CG GLU A 87 3.664 -12.059 -2.815 1.00 52.24 C ATOM 467 CD GLU A 87 2.695 -12.599 -1.782 1.00 20.25 C ATOM 468 OE1 GLU A 87 2.535 -11.955 -0.724 1.00 22.33 O ATOM 469 OE2 GLU A 87 2.096 -13.667 -2.031 1.00 44.51 O ATOM 0 H GLU A 87 2.536 -9.024 -5.480 1.00 1.13 H new ATOM 0 HA GLU A 87 4.947 -10.526 -4.637 1.00 71.22 H new ATOM 0 HB2 GLU A 87 3.197 -9.972 -2.856 1.00 3.12 H new ATOM 0 HB3 GLU A 87 2.075 -10.976 -3.752 1.00 3.12 H new ATOM 0 HG2 GLU A 87 3.877 -12.836 -3.549 1.00 52.24 H new ATOM 0 HG3 GLU A 87 4.608 -11.813 -2.329 1.00 52.24 H new ATOM 476 N SER A 88 4.445 -12.500 -6.073 1.00 60.31 N ATOM 477 CA SER A 88 4.252 -13.554 -7.063 1.00 15.43 C ATOM 478 C SER A 88 2.964 -14.325 -6.790 1.00 71.31 C ATOM 479 O SER A 88 2.296 -14.101 -5.782 1.00 13.15 O ATOM 480 CB SER A 88 5.444 -14.512 -7.059 1.00 3.33 C ATOM 481 OG SER A 88 6.646 -13.831 -7.377 1.00 30.33 O ATOM 0 H SER A 88 5.317 -12.568 -5.549 1.00 60.31 H new ATOM 0 HA SER A 88 4.175 -13.087 -8.045 1.00 15.43 H new ATOM 0 HB2 SER A 88 5.536 -14.980 -6.079 1.00 3.33 H new ATOM 0 HB3 SER A 88 5.274 -15.312 -7.779 1.00 3.33 H new ATOM 0 HG SER A 88 7.196 -14.393 -7.962 1.00 30.33 H new ATOM 487 N GLU A 89 2.623 -15.235 -7.697 1.00 63.25 N ATOM 488 CA GLU A 89 1.415 -16.040 -7.555 1.00 44.45 C ATOM 489 C GLU A 89 1.756 -17.458 -7.106 1.00 51.30 C ATOM 490 O GLU A 89 1.020 -18.068 -6.331 1.00 2.05 O ATOM 491 CB GLU A 89 0.646 -16.083 -8.877 1.00 43.35 C ATOM 492 CG GLU A 89 1.450 -15.582 -10.066 1.00 21.51 C ATOM 493 CD GLU A 89 0.668 -15.639 -11.364 1.00 44.51 C ATOM 494 OE1 GLU A 89 0.178 -16.732 -11.715 1.00 51.32 O ATOM 495 OE2 GLU A 89 0.547 -14.588 -12.029 1.00 23.03 O ATOM 0 H GLU A 89 3.166 -15.433 -8.538 1.00 63.25 H new ATOM 0 HA GLU A 89 0.788 -15.577 -6.793 1.00 44.45 H new ATOM 0 HB2 GLU A 89 0.329 -17.108 -9.070 1.00 43.35 H new ATOM 0 HB3 GLU A 89 -0.258 -15.482 -8.781 1.00 43.35 H new ATOM 0 HG2 GLU A 89 1.765 -14.555 -9.880 1.00 21.51 H new ATOM 0 HG3 GLU A 89 2.356 -16.180 -10.165 1.00 21.51 H new ATOM 502 N SER A 90 2.876 -17.976 -7.600 1.00 1.33 N ATOM 503 CA SER A 90 3.313 -19.323 -7.253 1.00 73.11 C ATOM 504 C SER A 90 4.612 -19.285 -6.454 1.00 52.51 C ATOM 505 O SER A 90 5.145 -20.323 -6.065 1.00 61.11 O ATOM 506 CB SER A 90 3.504 -20.161 -8.519 1.00 32.44 C ATOM 507 OG SER A 90 2.371 -20.975 -8.767 1.00 74.12 O ATOM 0 H SER A 90 3.497 -17.483 -8.242 1.00 1.33 H new ATOM 0 HA SER A 90 2.541 -19.781 -6.635 1.00 73.11 H new ATOM 0 HB2 SER A 90 3.677 -19.504 -9.371 1.00 32.44 H new ATOM 0 HB3 SER A 90 4.390 -20.787 -8.414 1.00 32.44 H new ATOM 0 HG SER A 90 2.517 -21.499 -9.582 1.00 74.12 H new ATOM 513 N ALA A 91 5.115 -18.078 -6.213 1.00 64.43 N ATOM 514 CA ALA A 91 6.350 -17.903 -5.459 1.00 44.23 C ATOM 515 C ALA A 91 6.087 -17.207 -4.128 1.00 52.13 C ATOM 516 O ALA A 91 6.115 -15.980 -4.025 1.00 75.34 O ATOM 517 CB ALA A 91 7.361 -17.114 -6.278 1.00 62.05 C ATOM 0 H ALA A 91 4.686 -17.208 -6.529 1.00 64.43 H new ATOM 0 HA ALA A 91 6.761 -18.890 -5.248 1.00 44.23 H new ATOM 0 HB1 ALA A 91 8.279 -16.991 -5.703 1.00 62.05 H new ATOM 0 HB2 ALA A 91 7.581 -17.651 -7.201 1.00 62.05 H new ATOM 0 HB3 ALA A 91 6.949 -16.134 -6.518 1.00 62.05 H new ATOM 523 N PRO A 92 5.824 -18.006 -3.084 1.00 30.04 N ATOM 524 CA PRO A 92 5.550 -17.488 -1.740 1.00 30.00 C ATOM 525 C PRO A 92 6.788 -16.881 -1.089 1.00 41.32 C ATOM 526 O PRO A 92 7.760 -17.581 -0.807 1.00 53.32 O ATOM 527 CB PRO A 92 5.094 -18.729 -0.968 1.00 0.53 C ATOM 528 CG PRO A 92 5.723 -19.873 -1.684 1.00 24.20 C ATOM 529 CD PRO A 92 5.775 -19.477 -3.134 1.00 14.14 C ATOM 0 HA PRO A 92 4.814 -16.684 -1.755 1.00 30.00 H new ATOM 0 HB2 PRO A 92 5.416 -18.688 0.073 1.00 0.53 H new ATOM 0 HB3 PRO A 92 4.007 -18.815 -0.963 1.00 0.53 H new ATOM 0 HG2 PRO A 92 6.723 -20.073 -1.298 1.00 24.20 H new ATOM 0 HG3 PRO A 92 5.141 -20.785 -1.549 1.00 24.20 H new ATOM 0 HD2 PRO A 92 6.651 -19.892 -3.633 1.00 14.14 H new ATOM 0 HD3 PRO A 92 4.900 -19.832 -3.679 1.00 14.14 H new ATOM 537 N GLY A 93 6.746 -15.573 -0.853 1.00 12.12 N ATOM 538 CA GLY A 93 7.871 -14.894 -0.236 1.00 55.24 C ATOM 539 C GLY A 93 8.629 -14.021 -1.217 1.00 32.03 C ATOM 540 O GLY A 93 9.562 -13.315 -0.836 1.00 4.42 O ATOM 0 H GLY A 93 5.953 -14.972 -1.078 1.00 12.12 H new ATOM 0 HA2 GLY A 93 7.512 -14.280 0.590 1.00 55.24 H new ATOM 0 HA3 GLY A 93 8.550 -15.634 0.188 1.00 55.24 H new ATOM 544 N ASP A 94 8.229 -14.071 -2.482 1.00 53.54 N ATOM 545 CA ASP A 94 8.878 -13.279 -3.521 1.00 14.40 C ATOM 546 C ASP A 94 8.302 -11.867 -3.567 1.00 10.40 C ATOM 547 O ASP A 94 7.112 -11.678 -3.821 1.00 42.04 O ATOM 548 CB ASP A 94 8.715 -13.954 -4.884 1.00 14.24 C ATOM 549 CG ASP A 94 9.825 -13.587 -5.848 1.00 41.52 C ATOM 550 OD1 ASP A 94 9.843 -12.430 -6.319 1.00 24.14 O ATOM 551 OD2 ASP A 94 10.675 -14.456 -6.133 1.00 44.14 O ATOM 0 H ASP A 94 7.459 -14.651 -2.814 1.00 53.54 H new ATOM 0 HA ASP A 94 9.939 -13.212 -3.282 1.00 14.40 H new ATOM 0 HB2 ASP A 94 8.696 -15.036 -4.751 1.00 14.24 H new ATOM 0 HB3 ASP A 94 7.755 -13.669 -5.315 1.00 14.24 H new ATOM 556 N PHE A 95 9.154 -10.877 -3.318 1.00 32.50 N ATOM 557 CA PHE A 95 8.730 -9.482 -3.329 1.00 34.31 C ATOM 558 C PHE A 95 9.472 -8.696 -4.406 1.00 21.54 C ATOM 559 O PHE A 95 10.665 -8.904 -4.629 1.00 54.15 O ATOM 560 CB PHE A 95 8.969 -8.844 -1.959 1.00 52.31 C ATOM 561 CG PHE A 95 7.846 -9.070 -0.988 1.00 31.22 C ATOM 562 CD1 PHE A 95 6.605 -8.490 -1.195 1.00 50.04 C ATOM 563 CD2 PHE A 95 8.031 -9.863 0.133 1.00 4.04 C ATOM 564 CE1 PHE A 95 5.569 -8.697 -0.304 1.00 2.43 C ATOM 565 CE2 PHE A 95 6.999 -10.074 1.028 1.00 4.53 C ATOM 566 CZ PHE A 95 5.767 -9.489 0.810 1.00 3.32 C ATOM 0 H PHE A 95 10.142 -11.016 -3.106 1.00 32.50 H new ATOM 0 HA PHE A 95 7.664 -9.454 -3.554 1.00 34.31 H new ATOM 0 HB2 PHE A 95 9.890 -9.245 -1.536 1.00 52.31 H new ATOM 0 HB3 PHE A 95 9.117 -7.772 -2.087 1.00 52.31 H new ATOM 0 HD1 PHE A 95 6.445 -7.868 -2.064 1.00 50.04 H new ATOM 0 HD2 PHE A 95 8.993 -10.322 0.310 1.00 4.04 H new ATOM 0 HE1 PHE A 95 4.606 -8.240 -0.479 1.00 2.43 H new ATOM 0 HE2 PHE A 95 7.156 -10.696 1.897 1.00 4.53 H new ATOM 0 HZ PHE A 95 4.960 -9.651 1.509 1.00 3.32 H new ATOM 576 N SER A 96 8.757 -7.794 -5.070 1.00 5.32 N ATOM 577 CA SER A 96 9.346 -6.979 -6.126 1.00 64.33 C ATOM 578 C SER A 96 8.790 -5.559 -6.092 1.00 33.23 C ATOM 579 O SER A 96 7.576 -5.354 -6.142 1.00 2.00 O ATOM 580 CB SER A 96 9.080 -7.610 -7.494 1.00 71.43 C ATOM 581 OG SER A 96 8.794 -8.993 -7.371 1.00 41.11 O ATOM 0 H SER A 96 7.769 -7.609 -4.896 1.00 5.32 H new ATOM 0 HA SER A 96 10.422 -6.933 -5.957 1.00 64.33 H new ATOM 0 HB2 SER A 96 8.243 -7.104 -7.975 1.00 71.43 H new ATOM 0 HB3 SER A 96 9.949 -7.471 -8.137 1.00 71.43 H new ATOM 0 HG SER A 96 8.626 -9.373 -8.259 1.00 41.11 H new ATOM 587 N LEU A 97 9.685 -4.582 -6.005 1.00 41.34 N ATOM 588 CA LEU A 97 9.285 -3.179 -5.964 1.00 23.41 C ATOM 589 C LEU A 97 9.248 -2.582 -7.367 1.00 3.01 C ATOM 590 O LEU A 97 10.153 -2.804 -8.171 1.00 64.10 O ATOM 591 CB LEU A 97 10.247 -2.380 -5.082 1.00 74.42 C ATOM 592 CG LEU A 97 9.994 -0.874 -5.007 1.00 62.25 C ATOM 593 CD1 LEU A 97 10.350 -0.207 -6.327 1.00 75.33 C ATOM 594 CD2 LEU A 97 8.544 -0.594 -4.639 1.00 45.15 C ATOM 0 H LEU A 97 10.693 -4.735 -5.961 1.00 41.34 H new ATOM 0 HA LEU A 97 8.282 -3.125 -5.540 1.00 23.41 H new ATOM 0 HB2 LEU A 97 10.204 -2.786 -4.071 1.00 74.42 H new ATOM 0 HB3 LEU A 97 11.261 -2.540 -5.447 1.00 74.42 H new ATOM 0 HG LEU A 97 10.632 -0.456 -4.228 1.00 62.25 H new ATOM 0 HD11 LEU A 97 10.164 0.865 -6.255 1.00 75.33 H new ATOM 0 HD12 LEU A 97 11.403 -0.378 -6.549 1.00 75.33 H new ATOM 0 HD13 LEU A 97 9.738 -0.629 -7.124 1.00 75.33 H new ATOM 0 HD21 LEU A 97 8.382 0.483 -4.590 1.00 45.15 H new ATOM 0 HD22 LEU A 97 7.887 -1.026 -5.394 1.00 45.15 H new ATOM 0 HD23 LEU A 97 8.323 -1.038 -3.669 1.00 45.15 H new ATOM 606 N SER A 98 8.197 -1.821 -7.653 1.00 74.20 N ATOM 607 CA SER A 98 8.041 -1.193 -8.959 1.00 53.55 C ATOM 608 C SER A 98 7.938 0.324 -8.824 1.00 70.40 C ATOM 609 O SER A 98 6.950 0.847 -8.308 1.00 25.02 O ATOM 610 CB SER A 98 6.798 -1.738 -9.667 1.00 25.15 C ATOM 611 OG SER A 98 6.453 -0.936 -10.783 1.00 3.14 O ATOM 0 H SER A 98 7.441 -1.624 -6.998 1.00 74.20 H new ATOM 0 HA SER A 98 8.923 -1.429 -9.555 1.00 53.55 H new ATOM 0 HB2 SER A 98 6.981 -2.762 -9.994 1.00 25.15 H new ATOM 0 HB3 SER A 98 5.963 -1.772 -8.967 1.00 25.15 H new ATOM 0 HG SER A 98 5.761 -1.388 -11.310 1.00 3.14 H new ATOM 617 N VAL A 99 8.966 1.024 -9.292 1.00 2.32 N ATOM 618 CA VAL A 99 8.993 2.480 -9.225 1.00 11.54 C ATOM 619 C VAL A 99 8.866 3.097 -10.613 1.00 51.01 C ATOM 620 O VAL A 99 9.359 2.545 -11.597 1.00 52.43 O ATOM 621 CB VAL A 99 10.289 2.988 -8.566 1.00 2.40 C ATOM 622 CG1 VAL A 99 10.840 4.186 -9.325 1.00 65.31 C ATOM 623 CG2 VAL A 99 10.043 3.339 -7.107 1.00 13.45 C ATOM 0 H VAL A 99 9.791 0.606 -9.722 1.00 2.32 H new ATOM 0 HA VAL A 99 8.141 2.784 -8.616 1.00 11.54 H new ATOM 0 HB VAL A 99 11.031 2.191 -8.604 1.00 2.40 H new ATOM 0 HG11 VAL A 99 11.756 4.531 -8.845 1.00 65.31 H new ATOM 0 HG12 VAL A 99 11.056 3.897 -10.353 1.00 65.31 H new ATOM 0 HG13 VAL A 99 10.103 4.989 -9.321 1.00 65.31 H new ATOM 0 HG21 VAL A 99 10.970 3.696 -6.657 1.00 13.45 H new ATOM 0 HG22 VAL A 99 9.285 4.119 -7.043 1.00 13.45 H new ATOM 0 HG23 VAL A 99 9.698 2.454 -6.573 1.00 13.45 H new ATOM 633 N LYS A 100 8.202 4.246 -10.686 1.00 33.51 N ATOM 634 CA LYS A 100 8.010 4.940 -11.953 1.00 43.25 C ATOM 635 C LYS A 100 9.045 6.048 -12.129 1.00 34.44 C ATOM 636 O LYS A 100 9.263 6.855 -11.225 1.00 52.45 O ATOM 637 CB LYS A 100 6.600 5.529 -12.028 1.00 73.01 C ATOM 638 CG LYS A 100 6.390 6.457 -13.212 1.00 12.22 C ATOM 639 CD LYS A 100 4.934 6.873 -13.343 1.00 42.02 C ATOM 640 CE LYS A 100 4.802 8.366 -13.599 1.00 41.45 C ATOM 641 NZ LYS A 100 5.037 9.164 -12.364 1.00 40.11 N ATOM 0 H LYS A 100 7.788 4.716 -9.881 1.00 33.51 H new ATOM 0 HA LYS A 100 8.138 4.216 -12.758 1.00 43.25 H new ATOM 0 HB2 LYS A 100 5.878 4.715 -12.083 1.00 73.01 H new ATOM 0 HB3 LYS A 100 6.394 6.076 -11.108 1.00 73.01 H new ATOM 0 HG2 LYS A 100 7.014 7.343 -13.096 1.00 12.22 H new ATOM 0 HG3 LYS A 100 6.711 5.959 -14.127 1.00 12.22 H new ATOM 0 HD2 LYS A 100 4.469 6.320 -14.159 1.00 42.02 H new ATOM 0 HD3 LYS A 100 4.396 6.610 -12.432 1.00 42.02 H new ATOM 0 HE2 LYS A 100 5.515 8.667 -14.367 1.00 41.45 H new ATOM 0 HE3 LYS A 100 3.806 8.581 -13.986 1.00 41.45 H new ATOM 0 HZ1 LYS A 100 4.938 10.176 -12.581 1.00 40.11 H new ATOM 0 HZ2 LYS A 100 4.341 8.895 -11.639 1.00 40.11 H new ATOM 0 HZ3 LYS A 100 5.996 8.978 -12.008 1.00 40.11 H new ATOM 655 N PHE A 101 9.678 6.080 -13.296 1.00 50.14 N ATOM 656 CA PHE A 101 10.689 7.089 -13.590 1.00 1.11 C ATOM 657 C PHE A 101 10.411 7.765 -14.930 1.00 34.55 C ATOM 658 O PHE A 101 10.742 7.231 -15.987 1.00 71.42 O ATOM 659 CB PHE A 101 12.082 6.456 -13.605 1.00 1.42 C ATOM 660 CG PHE A 101 12.605 6.127 -12.236 1.00 65.31 C ATOM 661 CD1 PHE A 101 12.528 7.053 -11.209 1.00 32.04 C ATOM 662 CD2 PHE A 101 13.176 4.891 -11.977 1.00 74.31 C ATOM 663 CE1 PHE A 101 13.008 6.753 -9.948 1.00 21.23 C ATOM 664 CE2 PHE A 101 13.657 4.585 -10.718 1.00 61.33 C ATOM 665 CZ PHE A 101 13.574 5.517 -9.703 1.00 4.23 C ATOM 0 H PHE A 101 9.509 5.419 -14.054 1.00 50.14 H new ATOM 0 HA PHE A 101 10.649 7.846 -12.807 1.00 1.11 H new ATOM 0 HB2 PHE A 101 12.052 5.545 -14.203 1.00 1.42 H new ATOM 0 HB3 PHE A 101 12.777 7.137 -14.097 1.00 1.42 H new ATOM 0 HD1 PHE A 101 12.088 8.021 -11.396 1.00 32.04 H new ATOM 0 HD2 PHE A 101 13.246 4.159 -12.768 1.00 74.31 H new ATOM 0 HE1 PHE A 101 12.941 7.484 -9.156 1.00 21.23 H new ATOM 0 HE2 PHE A 101 14.098 3.617 -10.528 1.00 61.33 H new ATOM 0 HZ PHE A 101 13.951 5.280 -8.719 1.00 4.23 H new ATOM 675 N GLY A 102 9.798 8.944 -14.875 1.00 62.52 N ATOM 676 CA GLY A 102 9.484 9.673 -16.090 1.00 3.01 C ATOM 677 C GLY A 102 8.477 8.946 -16.959 1.00 2.21 C ATOM 678 O GLY A 102 7.298 8.863 -16.617 1.00 24.20 O ATOM 0 H GLY A 102 9.514 9.407 -14.012 1.00 62.52 H new ATOM 0 HA2 GLY A 102 9.091 10.656 -15.829 1.00 3.01 H new ATOM 0 HA3 GLY A 102 10.399 9.836 -16.659 1.00 3.01 H new ATOM 682 N ASN A 103 8.942 8.420 -18.087 1.00 42.03 N ATOM 683 CA ASN A 103 8.073 7.698 -19.009 1.00 53.44 C ATOM 684 C ASN A 103 8.436 6.217 -19.053 1.00 50.32 C ATOM 685 O ASN A 103 8.068 5.505 -19.987 1.00 61.33 O ATOM 686 CB ASN A 103 8.171 8.301 -20.412 1.00 74.35 C ATOM 687 CG ASN A 103 7.048 7.837 -21.320 1.00 70.24 C ATOM 688 OD1 ASN A 103 6.149 7.112 -20.894 1.00 21.22 O ATOM 689 ND2 ASN A 103 7.095 8.254 -22.580 1.00 44.02 N ATOM 0 H ASN A 103 9.916 8.480 -18.385 1.00 42.03 H new ATOM 0 HA ASN A 103 7.048 7.791 -18.651 1.00 53.44 H new ATOM 0 HB2 ASN A 103 8.150 9.388 -20.340 1.00 74.35 H new ATOM 0 HB3 ASN A 103 9.129 8.029 -20.855 1.00 74.35 H new ATOM 0 HD21 ASN A 103 6.367 7.974 -23.237 1.00 44.02 H new ATOM 0 HD22 ASN A 103 7.859 8.854 -22.890 1.00 44.02 H new ATOM 696 N ASP A 104 9.159 5.761 -18.037 1.00 3.04 N ATOM 697 CA ASP A 104 9.571 4.364 -17.957 1.00 42.35 C ATOM 698 C ASP A 104 9.363 3.815 -16.550 1.00 13.35 C ATOM 699 O ASP A 104 9.751 4.442 -15.564 1.00 25.34 O ATOM 700 CB ASP A 104 11.039 4.220 -18.363 1.00 31.54 C ATOM 701 CG ASP A 104 11.207 3.956 -19.846 1.00 52.52 C ATOM 702 OD1 ASP A 104 11.088 2.783 -20.258 1.00 44.32 O ATOM 703 OD2 ASP A 104 11.456 4.924 -20.595 1.00 73.23 O ATOM 0 H ASP A 104 9.472 6.338 -17.257 1.00 3.04 H new ATOM 0 HA ASP A 104 8.953 3.788 -18.646 1.00 42.35 H new ATOM 0 HB2 ASP A 104 11.578 5.129 -18.096 1.00 31.54 H new ATOM 0 HB3 ASP A 104 11.491 3.404 -17.798 1.00 31.54 H new ATOM 708 N VAL A 105 8.745 2.641 -16.463 1.00 44.20 N ATOM 709 CA VAL A 105 8.485 2.007 -15.176 1.00 51.41 C ATOM 710 C VAL A 105 9.568 0.990 -14.836 1.00 33.45 C ATOM 711 O VAL A 105 9.631 -0.086 -15.430 1.00 54.14 O ATOM 712 CB VAL A 105 7.114 1.306 -15.163 1.00 71.33 C ATOM 713 CG1 VAL A 105 6.893 0.589 -13.840 1.00 12.32 C ATOM 714 CG2 VAL A 105 6.001 2.308 -15.429 1.00 74.30 C ATOM 0 H VAL A 105 8.415 2.110 -17.269 1.00 44.20 H new ATOM 0 HA VAL A 105 8.487 2.798 -14.427 1.00 51.41 H new ATOM 0 HB VAL A 105 7.099 0.561 -15.959 1.00 71.33 H new ATOM 0 HG11 VAL A 105 5.919 0.100 -13.850 1.00 12.32 H new ATOM 0 HG12 VAL A 105 7.673 -0.158 -13.696 1.00 12.32 H new ATOM 0 HG13 VAL A 105 6.928 1.311 -13.024 1.00 12.32 H new ATOM 0 HG21 VAL A 105 5.039 1.795 -15.416 1.00 74.30 H new ATOM 0 HG22 VAL A 105 6.012 3.078 -14.657 1.00 74.30 H new ATOM 0 HG23 VAL A 105 6.153 2.770 -16.404 1.00 74.30 H new ATOM 724 N GLN A 106 10.417 1.337 -13.874 1.00 44.04 N ATOM 725 CA GLN A 106 11.498 0.453 -13.455 1.00 24.11 C ATOM 726 C GLN A 106 11.085 -0.376 -12.243 1.00 54.13 C ATOM 727 O GLN A 106 10.030 -0.145 -11.651 1.00 74.24 O ATOM 728 CB GLN A 106 12.752 1.266 -13.128 1.00 23.54 C ATOM 729 CG GLN A 106 13.145 2.245 -14.222 1.00 24.13 C ATOM 730 CD GLN A 106 13.369 1.567 -15.559 1.00 25.10 C ATOM 731 OE1 GLN A 106 13.452 0.341 -15.640 1.00 53.04 O ATOM 732 NE2 GLN A 106 13.469 2.363 -16.617 1.00 65.22 N ATOM 0 H GLN A 106 10.377 2.223 -13.371 1.00 44.04 H new ATOM 0 HA GLN A 106 11.718 -0.226 -14.279 1.00 24.11 H new ATOM 0 HB2 GLN A 106 12.587 1.816 -12.202 1.00 23.54 H new ATOM 0 HB3 GLN A 106 13.582 0.582 -12.949 1.00 23.54 H new ATOM 0 HG2 GLN A 106 12.365 2.999 -14.327 1.00 24.13 H new ATOM 0 HG3 GLN A 106 14.055 2.768 -13.927 1.00 24.13 H new ATOM 0 HE21 GLN A 106 13.394 3.374 -16.504 1.00 65.22 H new ATOM 0 HE22 GLN A 106 13.621 1.964 -17.543 1.00 65.22 H new ATOM 741 N HIS A 107 11.922 -1.342 -11.879 1.00 71.14 N ATOM 742 CA HIS A 107 11.643 -2.206 -10.738 1.00 12.45 C ATOM 743 C HIS A 107 12.938 -2.673 -10.080 1.00 41.24 C ATOM 744 O HIS A 107 14.019 -2.547 -10.656 1.00 71.25 O ATOM 745 CB HIS A 107 10.815 -3.414 -11.175 1.00 73.04 C ATOM 746 CG HIS A 107 9.760 -3.083 -12.186 1.00 10.11 C ATOM 747 ND1 HIS A 107 8.425 -3.374 -12.003 1.00 73.41 N ATOM 748 CD2 HIS A 107 9.850 -2.480 -13.394 1.00 51.33 C ATOM 749 CE1 HIS A 107 7.739 -2.967 -13.056 1.00 41.41 C ATOM 750 NE2 HIS A 107 8.581 -2.420 -13.915 1.00 14.42 N ATOM 0 H HIS A 107 12.799 -1.546 -12.358 1.00 71.14 H new ATOM 0 HA HIS A 107 11.073 -1.630 -10.009 1.00 12.45 H new ATOM 0 HB2 HIS A 107 11.481 -4.169 -11.591 1.00 73.04 H new ATOM 0 HB3 HIS A 107 10.341 -3.855 -10.298 1.00 73.04 H new ATOM 0 HD2 HIS A 107 10.752 -2.114 -13.861 1.00 51.33 H new ATOM 0 HE1 HIS A 107 6.672 -3.065 -13.192 1.00 41.41 H new ATOM 0 HE2 HIS A 107 8.329 -2.018 -14.818 1.00 14.42 H new ATOM 758 N PHE A 108 12.822 -3.211 -8.871 1.00 74.41 N ATOM 759 CA PHE A 108 13.983 -3.696 -8.135 1.00 4.32 C ATOM 760 C PHE A 108 13.680 -5.029 -7.456 1.00 45.53 C ATOM 761 O PHE A 108 12.863 -5.100 -6.538 1.00 40.24 O ATOM 762 CB PHE A 108 14.417 -2.666 -7.090 1.00 2.32 C ATOM 763 CG PHE A 108 14.921 -1.382 -7.686 1.00 74.31 C ATOM 764 CD1 PHE A 108 14.040 -0.367 -8.024 1.00 32.44 C ATOM 765 CD2 PHE A 108 16.275 -1.191 -7.910 1.00 34.13 C ATOM 766 CE1 PHE A 108 14.500 0.815 -8.572 1.00 52.02 C ATOM 767 CE2 PHE A 108 16.740 -0.011 -8.458 1.00 3.15 C ATOM 768 CZ PHE A 108 15.852 0.993 -8.790 1.00 72.13 C ATOM 0 H PHE A 108 11.935 -3.322 -8.380 1.00 74.41 H new ATOM 0 HA PHE A 108 14.795 -3.847 -8.846 1.00 4.32 H new ATOM 0 HB2 PHE A 108 13.573 -2.447 -6.436 1.00 2.32 H new ATOM 0 HB3 PHE A 108 15.199 -3.100 -6.467 1.00 2.32 H new ATOM 0 HD1 PHE A 108 12.981 -0.502 -7.857 1.00 32.44 H new ATOM 0 HD2 PHE A 108 16.974 -1.973 -7.653 1.00 34.13 H new ATOM 0 HE1 PHE A 108 13.803 1.599 -8.830 1.00 52.02 H new ATOM 0 HE2 PHE A 108 17.798 0.126 -8.627 1.00 3.15 H new ATOM 0 HZ PHE A 108 16.214 1.916 -9.219 1.00 72.13 H new ATOM 778 N LYS A 109 14.345 -6.084 -7.915 1.00 40.43 N ATOM 779 CA LYS A 109 14.149 -7.415 -7.354 1.00 63.12 C ATOM 780 C LYS A 109 14.646 -7.477 -5.913 1.00 42.24 C ATOM 781 O LYS A 109 15.845 -7.374 -5.655 1.00 25.11 O ATOM 782 CB LYS A 109 14.878 -8.460 -8.202 1.00 24.34 C ATOM 783 CG LYS A 109 13.987 -9.144 -9.224 1.00 31.13 C ATOM 784 CD LYS A 109 13.957 -10.650 -9.019 1.00 43.54 C ATOM 785 CE LYS A 109 15.165 -11.322 -9.653 1.00 43.15 C ATOM 786 NZ LYS A 109 14.886 -12.740 -10.013 1.00 11.32 N ATOM 0 H LYS A 109 15.025 -6.043 -8.674 1.00 40.43 H new ATOM 0 HA LYS A 109 13.081 -7.631 -7.360 1.00 63.12 H new ATOM 0 HB2 LYS A 109 15.708 -7.980 -8.720 1.00 24.34 H new ATOM 0 HB3 LYS A 109 15.307 -9.215 -7.543 1.00 24.34 H new ATOM 0 HG2 LYS A 109 12.975 -8.746 -9.150 1.00 31.13 H new ATOM 0 HG3 LYS A 109 14.345 -8.920 -10.229 1.00 31.13 H new ATOM 0 HD2 LYS A 109 13.933 -10.873 -7.952 1.00 43.54 H new ATOM 0 HD3 LYS A 109 13.043 -11.059 -9.450 1.00 43.54 H new ATOM 0 HE2 LYS A 109 15.459 -10.772 -10.547 1.00 43.15 H new ATOM 0 HE3 LYS A 109 16.007 -11.282 -8.962 1.00 43.15 H new ATOM 0 HZ1 LYS A 109 15.734 -13.162 -10.442 1.00 11.32 H new ATOM 0 HZ2 LYS A 109 14.630 -13.272 -9.157 1.00 11.32 H new ATOM 0 HZ3 LYS A 109 14.099 -12.777 -10.692 1.00 11.32 H new ATOM 800 N VAL A 110 13.717 -7.647 -4.978 1.00 52.33 N ATOM 801 CA VAL A 110 14.061 -7.725 -3.564 1.00 10.13 C ATOM 802 C VAL A 110 14.760 -9.041 -3.240 1.00 52.41 C ATOM 803 O VAL A 110 14.230 -10.120 -3.507 1.00 33.01 O ATOM 804 CB VAL A 110 12.811 -7.588 -2.674 1.00 5.54 C ATOM 805 CG1 VAL A 110 13.129 -7.990 -1.242 1.00 31.24 C ATOM 806 CG2 VAL A 110 12.272 -6.166 -2.729 1.00 72.35 C ATOM 0 H VAL A 110 12.720 -7.733 -5.175 1.00 52.33 H new ATOM 0 HA VAL A 110 14.738 -6.896 -3.357 1.00 10.13 H new ATOM 0 HB VAL A 110 12.041 -8.260 -3.053 1.00 5.54 H new ATOM 0 HG11 VAL A 110 12.234 -7.887 -0.628 1.00 31.24 H new ATOM 0 HG12 VAL A 110 13.466 -9.026 -1.221 1.00 31.24 H new ATOM 0 HG13 VAL A 110 13.915 -7.345 -0.849 1.00 31.24 H new ATOM 0 HG21 VAL A 110 11.389 -6.087 -2.095 1.00 72.35 H new ATOM 0 HG22 VAL A 110 13.036 -5.473 -2.376 1.00 72.35 H new ATOM 0 HG23 VAL A 110 12.004 -5.918 -3.756 1.00 72.35 H new ATOM 816 N LEU A 111 15.953 -8.944 -2.663 1.00 75.21 N ATOM 817 CA LEU A 111 16.725 -10.127 -2.302 1.00 25.44 C ATOM 818 C LEU A 111 16.367 -10.604 -0.898 1.00 33.22 C ATOM 819 O LEU A 111 16.330 -9.815 0.046 1.00 2.22 O ATOM 820 CB LEU A 111 18.223 -9.827 -2.383 1.00 41.02 C ATOM 821 CG LEU A 111 18.979 -10.492 -3.534 1.00 24.23 C ATOM 822 CD1 LEU A 111 18.937 -12.006 -3.396 1.00 30.13 C ATOM 823 CD2 LEU A 111 18.400 -10.060 -4.873 1.00 70.50 C ATOM 0 H LEU A 111 16.406 -8.059 -2.435 1.00 75.21 H new ATOM 0 HA LEU A 111 16.480 -10.919 -3.009 1.00 25.44 H new ATOM 0 HB2 LEU A 111 18.353 -8.748 -2.465 1.00 41.02 H new ATOM 0 HB3 LEU A 111 18.686 -10.134 -1.445 1.00 41.02 H new ATOM 0 HG LEU A 111 20.020 -10.173 -3.492 1.00 24.23 H new ATOM 0 HD11 LEU A 111 19.480 -12.462 -4.224 1.00 30.13 H new ATOM 0 HD12 LEU A 111 19.400 -12.298 -2.453 1.00 30.13 H new ATOM 0 HD13 LEU A 111 17.901 -12.344 -3.412 1.00 30.13 H new ATOM 0 HD21 LEU A 111 18.950 -10.543 -5.680 1.00 70.50 H new ATOM 0 HD22 LEU A 111 17.350 -10.349 -4.926 1.00 70.50 H new ATOM 0 HD23 LEU A 111 18.484 -8.978 -4.974 1.00 70.50 H new ATOM 835 N ARG A 112 16.105 -11.901 -0.768 1.00 15.42 N ATOM 836 CA ARG A 112 15.750 -12.483 0.521 1.00 52.11 C ATOM 837 C ARG A 112 16.665 -13.657 0.857 1.00 13.24 C ATOM 838 O ARG A 112 16.959 -14.492 0.002 1.00 24.03 O ATOM 839 CB ARG A 112 14.292 -12.945 0.512 1.00 74.35 C ATOM 840 CG ARG A 112 13.302 -11.835 0.198 1.00 4.55 C ATOM 841 CD ARG A 112 12.110 -12.356 -0.588 1.00 50.21 C ATOM 842 NE ARG A 112 12.075 -11.822 -1.947 1.00 13.41 N ATOM 843 CZ ARG A 112 12.655 -12.414 -2.985 1.00 3.44 C ATOM 844 NH1 ARG A 112 13.312 -13.554 -2.820 1.00 1.53 N ATOM 845 NH2 ARG A 112 12.579 -11.866 -4.191 1.00 1.43 N ATOM 0 H ARG A 112 16.132 -12.568 -1.539 1.00 15.42 H new ATOM 0 HA ARG A 112 15.876 -11.716 1.285 1.00 52.11 H new ATOM 0 HB2 ARG A 112 14.177 -13.741 -0.223 1.00 74.35 H new ATOM 0 HB3 ARG A 112 14.049 -13.372 1.485 1.00 74.35 H new ATOM 0 HG2 ARG A 112 12.956 -11.381 1.127 1.00 4.55 H new ATOM 0 HG3 ARG A 112 13.801 -11.052 -0.373 1.00 4.55 H new ATOM 0 HD2 ARG A 112 12.149 -13.445 -0.627 1.00 50.21 H new ATOM 0 HD3 ARG A 112 11.189 -12.089 -0.070 1.00 50.21 H new ATOM 0 HE ARG A 112 11.578 -10.946 -2.108 1.00 13.41 H new ATOM 0 HH11 ARG A 112 13.373 -13.978 -1.894 1.00 1.53 H new ATOM 0 HH12 ARG A 112 13.757 -14.007 -3.619 1.00 1.53 H new ATOM 0 HH21 ARG A 112 12.075 -10.989 -4.322 1.00 1.43 H new ATOM 0 HH22 ARG A 112 13.025 -12.322 -4.987 1.00 1.43 H new ATOM 859 N ASP A 113 17.111 -13.713 2.107 1.00 12.14 N ATOM 860 CA ASP A 113 17.992 -14.784 2.557 1.00 33.35 C ATOM 861 C ASP A 113 17.817 -15.040 4.051 1.00 21.02 C ATOM 862 O ASP A 113 17.260 -14.213 4.772 1.00 62.10 O ATOM 863 CB ASP A 113 19.450 -14.436 2.254 1.00 12.01 C ATOM 864 CG ASP A 113 19.912 -14.991 0.921 1.00 24.13 C ATOM 865 OD1 ASP A 113 19.412 -14.522 -0.122 1.00 42.01 O ATOM 866 OD2 ASP A 113 20.774 -15.895 0.922 1.00 61.33 O ATOM 0 H ASP A 113 16.877 -13.029 2.827 1.00 12.14 H new ATOM 0 HA ASP A 113 17.724 -15.692 2.017 1.00 33.35 H new ATOM 0 HB2 ASP A 113 19.570 -13.353 2.254 1.00 12.01 H new ATOM 0 HB3 ASP A 113 20.087 -14.827 3.048 1.00 12.01 H new ATOM 871 N GLY A 114 18.297 -16.193 4.509 1.00 14.54 N ATOM 872 CA GLY A 114 18.183 -16.537 5.914 1.00 35.25 C ATOM 873 C GLY A 114 16.830 -17.128 6.259 1.00 54.14 C ATOM 874 O GLY A 114 16.734 -18.289 6.655 1.00 5.11 O ATOM 0 H GLY A 114 18.762 -16.894 3.932 1.00 14.54 H new ATOM 0 HA2 GLY A 114 18.965 -17.251 6.175 1.00 35.25 H new ATOM 0 HA3 GLY A 114 18.351 -15.645 6.518 1.00 35.25 H new ATOM 878 N ALA A 115 15.780 -16.326 6.108 1.00 22.33 N ATOM 879 CA ALA A 115 14.426 -16.777 6.406 1.00 42.43 C ATOM 880 C ALA A 115 13.397 -15.730 5.993 1.00 74.45 C ATOM 881 O ALA A 115 12.507 -16.004 5.188 1.00 62.51 O ATOM 882 CB ALA A 115 14.290 -17.098 7.887 1.00 42.33 C ATOM 0 H ALA A 115 15.841 -15.362 5.781 1.00 22.33 H new ATOM 0 HA ALA A 115 14.236 -17.683 5.831 1.00 42.43 H new ATOM 0 HB1 ALA A 115 13.274 -17.433 8.095 1.00 42.33 H new ATOM 0 HB2 ALA A 115 14.994 -17.886 8.155 1.00 42.33 H new ATOM 0 HB3 ALA A 115 14.504 -16.205 8.474 1.00 42.33 H new ATOM 888 N GLY A 116 13.523 -14.530 6.550 1.00 41.34 N ATOM 889 CA GLY A 116 12.596 -13.461 6.227 1.00 11.11 C ATOM 890 C GLY A 116 13.264 -12.101 6.205 1.00 43.43 C ATOM 891 O GLY A 116 12.635 -11.086 6.504 1.00 11.25 O ATOM 0 H GLY A 116 14.250 -14.279 7.219 1.00 41.34 H new ATOM 0 HA2 GLY A 116 12.145 -13.657 5.254 1.00 11.11 H new ATOM 0 HA3 GLY A 116 11.787 -13.453 6.957 1.00 11.11 H new ATOM 895 N LYS A 117 14.545 -12.078 5.850 1.00 34.00 N ATOM 896 CA LYS A 117 15.301 -10.833 5.790 1.00 54.32 C ATOM 897 C LYS A 117 15.506 -10.390 4.345 1.00 73.15 C ATOM 898 O LYS A 117 15.833 -11.201 3.478 1.00 44.34 O ATOM 899 CB LYS A 117 16.656 -11.001 6.480 1.00 10.11 C ATOM 900 CG LYS A 117 16.558 -11.124 7.991 1.00 40.41 C ATOM 901 CD LYS A 117 17.690 -10.385 8.685 1.00 63.31 C ATOM 902 CE LYS A 117 18.160 -11.127 9.927 1.00 3.30 C ATOM 903 NZ LYS A 117 17.162 -11.050 11.029 1.00 22.35 N ATOM 0 H LYS A 117 15.081 -12.909 5.599 1.00 34.00 H new ATOM 0 HA LYS A 117 14.729 -10.064 6.310 1.00 54.32 H new ATOM 0 HB2 LYS A 117 17.149 -11.888 6.083 1.00 10.11 H new ATOM 0 HB3 LYS A 117 17.288 -10.148 6.234 1.00 10.11 H new ATOM 0 HG2 LYS A 117 15.601 -10.725 8.328 1.00 40.41 H new ATOM 0 HG3 LYS A 117 16.582 -12.176 8.274 1.00 40.41 H new ATOM 0 HD2 LYS A 117 18.525 -10.264 7.994 1.00 63.31 H new ATOM 0 HD3 LYS A 117 17.357 -9.384 8.961 1.00 63.31 H new ATOM 0 HE2 LYS A 117 18.346 -12.172 9.678 1.00 3.30 H new ATOM 0 HE3 LYS A 117 19.107 -10.707 10.265 1.00 3.30 H new ATOM 0 HZ1 LYS A 117 17.519 -11.568 11.857 1.00 22.35 H new ATOM 0 HZ2 LYS A 117 17.003 -10.054 11.285 1.00 22.35 H new ATOM 0 HZ3 LYS A 117 16.266 -11.474 10.716 1.00 22.35 H new ATOM 917 N TYR A 118 15.312 -9.100 4.093 1.00 64.44 N ATOM 918 CA TYR A 118 15.475 -8.551 2.752 1.00 4.40 C ATOM 919 C TYR A 118 16.768 -7.748 2.646 1.00 45.11 C ATOM 920 O TYR A 118 17.352 -7.353 3.655 1.00 4.23 O ATOM 921 CB TYR A 118 14.281 -7.665 2.392 1.00 22.05 C ATOM 922 CG TYR A 118 12.943 -8.319 2.650 1.00 32.43 C ATOM 923 CD1 TYR A 118 12.395 -9.210 1.735 1.00 51.53 C ATOM 924 CD2 TYR A 118 12.226 -8.047 3.809 1.00 54.14 C ATOM 925 CE1 TYR A 118 11.172 -9.809 1.966 1.00 70.34 C ATOM 926 CE2 TYR A 118 11.003 -8.643 4.048 1.00 32.25 C ATOM 927 CZ TYR A 118 10.480 -9.523 3.124 1.00 21.30 C ATOM 928 OH TYR A 118 9.262 -10.118 3.359 1.00 74.24 O ATOM 0 H TYR A 118 15.042 -8.415 4.799 1.00 64.44 H new ATOM 0 HA TYR A 118 15.526 -9.383 2.050 1.00 4.40 H new ATOM 0 HB2 TYR A 118 14.340 -6.740 2.965 1.00 22.05 H new ATOM 0 HB3 TYR A 118 14.346 -7.393 1.339 1.00 22.05 H new ATOM 0 HD1 TYR A 118 12.935 -9.438 0.828 1.00 51.53 H new ATOM 0 HD2 TYR A 118 12.632 -7.358 4.535 1.00 54.14 H new ATOM 0 HE1 TYR A 118 10.760 -10.498 1.243 1.00 70.34 H new ATOM 0 HE2 TYR A 118 10.459 -8.421 4.954 1.00 32.25 H new ATOM 0 HH TYR A 118 8.687 -10.007 2.573 1.00 74.24 H new ATOM 938 N PHE A 119 17.210 -7.510 1.415 1.00 10.33 N ATOM 939 CA PHE A 119 18.434 -6.754 1.175 1.00 30.31 C ATOM 940 C PHE A 119 18.601 -6.447 -0.310 1.00 70.32 C ATOM 941 O PHE A 119 17.892 -6.999 -1.153 1.00 44.25 O ATOM 942 CB PHE A 119 19.648 -7.533 1.686 1.00 32.30 C ATOM 943 CG PHE A 119 19.771 -8.907 1.092 1.00 24.43 C ATOM 944 CD1 PHE A 119 18.841 -9.890 1.387 1.00 33.45 C ATOM 945 CD2 PHE A 119 20.819 -9.216 0.239 1.00 31.24 C ATOM 946 CE1 PHE A 119 18.951 -11.156 0.843 1.00 44.14 C ATOM 947 CE2 PHE A 119 20.934 -10.480 -0.309 1.00 4.32 C ATOM 948 CZ PHE A 119 20.000 -11.451 -0.006 1.00 23.01 C ATOM 0 H PHE A 119 16.739 -7.830 0.569 1.00 10.33 H new ATOM 0 HA PHE A 119 18.361 -5.811 1.717 1.00 30.31 H new ATOM 0 HB2 PHE A 119 20.553 -6.967 1.464 1.00 32.30 H new ATOM 0 HB3 PHE A 119 19.584 -7.619 2.771 1.00 32.30 H new ATOM 0 HD1 PHE A 119 18.019 -9.665 2.051 1.00 33.45 H new ATOM 0 HD2 PHE A 119 21.554 -8.461 -0.000 1.00 31.24 H new ATOM 0 HE1 PHE A 119 18.218 -11.913 1.081 1.00 44.14 H new ATOM 0 HE2 PHE A 119 21.754 -10.708 -0.974 1.00 4.32 H new ATOM 0 HZ PHE A 119 20.090 -12.439 -0.432 1.00 23.01 H new ATOM 958 N LEU A 120 19.542 -5.564 -0.623 1.00 50.52 N ATOM 959 CA LEU A 120 19.803 -5.181 -2.007 1.00 21.43 C ATOM 960 C LEU A 120 21.243 -5.499 -2.397 1.00 30.21 C ATOM 961 O LEU A 120 21.534 -6.582 -2.904 1.00 62.42 O ATOM 962 CB LEU A 120 19.526 -3.690 -2.206 1.00 31.33 C ATOM 963 CG LEU A 120 18.054 -3.277 -2.219 1.00 32.13 C ATOM 964 CD1 LEU A 120 17.902 -1.828 -1.783 1.00 43.24 C ATOM 965 CD2 LEU A 120 17.453 -3.486 -3.601 1.00 64.23 C ATOM 0 H LEU A 120 20.138 -5.099 0.062 1.00 50.52 H new ATOM 0 HA LEU A 120 19.136 -5.756 -2.649 1.00 21.43 H new ATOM 0 HB2 LEU A 120 20.031 -3.138 -1.413 1.00 31.33 H new ATOM 0 HB3 LEU A 120 19.978 -3.379 -3.148 1.00 31.33 H new ATOM 0 HG LEU A 120 17.514 -3.906 -1.511 1.00 32.13 H new ATOM 0 HD11 LEU A 120 16.848 -1.552 -1.799 1.00 43.24 H new ATOM 0 HD12 LEU A 120 18.293 -1.709 -0.773 1.00 43.24 H new ATOM 0 HD13 LEU A 120 18.456 -1.183 -2.465 1.00 43.24 H new ATOM 0 HD21 LEU A 120 16.405 -3.187 -3.591 1.00 64.23 H new ATOM 0 HD22 LEU A 120 17.996 -2.883 -4.329 1.00 64.23 H new ATOM 0 HD23 LEU A 120 17.527 -4.538 -3.875 1.00 64.23 H new ATOM 977 N TRP A 121 22.139 -4.549 -2.155 1.00 60.41 N ATOM 978 CA TRP A 121 23.550 -4.729 -2.479 1.00 73.34 C ATOM 979 C TRP A 121 24.420 -3.770 -1.674 1.00 72.44 C ATOM 980 O TRP A 121 25.565 -3.503 -2.037 1.00 44.33 O ATOM 981 CB TRP A 121 23.782 -4.514 -3.976 1.00 15.11 C ATOM 982 CG TRP A 121 22.966 -3.394 -4.548 1.00 71.33 C ATOM 983 CD1 TRP A 121 22.386 -2.367 -3.860 1.00 22.45 C ATOM 984 CD2 TRP A 121 22.638 -3.191 -5.927 1.00 43.21 C ATOM 985 NE1 TRP A 121 21.718 -1.538 -4.727 1.00 52.42 N ATOM 986 CE2 TRP A 121 21.858 -2.020 -6.001 1.00 70.34 C ATOM 987 CE3 TRP A 121 22.930 -3.882 -7.106 1.00 52.21 C ATOM 988 CZ2 TRP A 121 21.366 -1.529 -7.208 1.00 24.21 C ATOM 989 CZ3 TRP A 121 22.441 -3.393 -8.303 1.00 32.33 C ATOM 990 CH2 TRP A 121 21.667 -2.226 -8.347 1.00 10.13 C ATOM 0 H TRP A 121 21.914 -3.647 -1.736 1.00 60.41 H new ATOM 0 HA TRP A 121 23.830 -5.750 -2.218 1.00 73.34 H new ATOM 0 HB2 TRP A 121 24.839 -4.308 -4.147 1.00 15.11 H new ATOM 0 HB3 TRP A 121 23.546 -5.435 -4.509 1.00 15.11 H new ATOM 0 HD1 TRP A 121 22.444 -2.227 -2.791 1.00 22.45 H new ATOM 0 HE1 TRP A 121 21.201 -0.699 -4.465 1.00 52.42 H new ATOM 0 HE3 TRP A 121 23.527 -4.782 -7.082 1.00 52.21 H new ATOM 0 HZ2 TRP A 121 20.768 -0.630 -7.244 1.00 24.21 H new ATOM 0 HZ3 TRP A 121 22.659 -3.920 -9.220 1.00 32.33 H new ATOM 0 HH2 TRP A 121 21.301 -1.869 -9.298 1.00 10.13 H new ATOM 1001 N VAL A 122 23.869 -3.256 -0.579 1.00 44.23 N ATOM 1002 CA VAL A 122 24.597 -2.327 0.278 1.00 74.40 C ATOM 1003 C VAL A 122 24.226 -2.527 1.743 1.00 21.22 C ATOM 1004 O VAL A 122 25.088 -2.498 2.622 1.00 15.33 O ATOM 1005 CB VAL A 122 24.318 -0.865 -0.116 1.00 3.53 C ATOM 1006 CG1 VAL A 122 25.035 -0.514 -1.411 1.00 22.23 C ATOM 1007 CG2 VAL A 122 22.822 -0.623 -0.243 1.00 12.01 C ATOM 0 H VAL A 122 22.922 -3.467 -0.264 1.00 44.23 H new ATOM 0 HA VAL A 122 25.658 -2.535 0.143 1.00 74.40 H new ATOM 0 HB VAL A 122 24.702 -0.216 0.671 1.00 3.53 H new ATOM 0 HG11 VAL A 122 24.826 0.523 -1.673 1.00 22.23 H new ATOM 0 HG12 VAL A 122 26.109 -0.645 -1.279 1.00 22.23 H new ATOM 0 HG13 VAL A 122 24.685 -1.168 -2.210 1.00 22.23 H new ATOM 0 HG21 VAL A 122 22.644 0.416 -0.522 1.00 12.01 H new ATOM 0 HG22 VAL A 122 22.411 -1.280 -1.009 1.00 12.01 H new ATOM 0 HG23 VAL A 122 22.338 -0.831 0.711 1.00 12.01 H new ATOM 1017 N VAL A 123 22.938 -2.731 2.000 1.00 71.32 N ATOM 1018 CA VAL A 123 22.452 -2.938 3.359 1.00 44.00 C ATOM 1019 C VAL A 123 21.323 -3.961 3.389 1.00 33.24 C ATOM 1020 O VAL A 123 20.808 -4.366 2.347 1.00 64.34 O ATOM 1021 CB VAL A 123 21.955 -1.621 3.983 1.00 15.04 C ATOM 1022 CG1 VAL A 123 20.626 -1.208 3.369 1.00 13.44 C ATOM 1023 CG2 VAL A 123 21.833 -1.760 5.493 1.00 22.24 C ATOM 0 H VAL A 123 22.212 -2.757 1.284 1.00 71.32 H new ATOM 0 HA VAL A 123 23.293 -3.313 3.943 1.00 44.00 H new ATOM 0 HB VAL A 123 22.685 -0.840 3.771 1.00 15.04 H new ATOM 0 HG11 VAL A 123 20.290 -0.275 3.822 1.00 13.44 H new ATOM 0 HG12 VAL A 123 20.750 -1.066 2.295 1.00 13.44 H new ATOM 0 HG13 VAL A 123 19.885 -1.986 3.549 1.00 13.44 H new ATOM 0 HG21 VAL A 123 21.481 -0.820 5.918 1.00 22.24 H new ATOM 0 HG22 VAL A 123 21.124 -2.553 5.729 1.00 22.24 H new ATOM 0 HG23 VAL A 123 22.807 -2.006 5.916 1.00 22.24 H new ATOM 1033 N LYS A 124 20.940 -4.376 4.592 1.00 14.32 N ATOM 1034 CA LYS A 124 19.869 -5.351 4.761 1.00 52.12 C ATOM 1035 C LYS A 124 18.698 -4.746 5.528 1.00 13.24 C ATOM 1036 O LYS A 124 18.721 -3.569 5.889 1.00 11.13 O ATOM 1037 CB LYS A 124 20.389 -6.588 5.496 1.00 61.43 C ATOM 1038 CG LYS A 124 20.904 -6.294 6.894 1.00 51.21 C ATOM 1039 CD LYS A 124 21.913 -7.336 7.348 1.00 53.53 C ATOM 1040 CE LYS A 124 21.636 -7.797 8.770 1.00 2.45 C ATOM 1041 NZ LYS A 124 22.382 -6.985 9.772 1.00 42.15 N ATOM 0 H LYS A 124 21.356 -4.052 5.465 1.00 14.32 H new ATOM 0 HA LYS A 124 19.519 -5.644 3.771 1.00 52.12 H new ATOM 0 HB2 LYS A 124 19.589 -7.325 5.560 1.00 61.43 H new ATOM 0 HB3 LYS A 124 21.190 -7.038 4.910 1.00 61.43 H new ATOM 0 HG2 LYS A 124 21.366 -5.307 6.912 1.00 51.21 H new ATOM 0 HG3 LYS A 124 20.068 -6.268 7.593 1.00 51.21 H new ATOM 0 HD2 LYS A 124 21.882 -8.192 6.674 1.00 53.53 H new ATOM 0 HD3 LYS A 124 22.919 -6.920 7.289 1.00 53.53 H new ATOM 0 HE2 LYS A 124 20.567 -7.730 8.972 1.00 2.45 H new ATOM 0 HE3 LYS A 124 21.915 -8.846 8.873 1.00 2.45 H new ATOM 0 HZ1 LYS A 124 22.166 -7.331 10.729 1.00 42.15 H new ATOM 0 HZ2 LYS A 124 23.404 -7.069 9.596 1.00 42.15 H new ATOM 0 HZ3 LYS A 124 22.098 -5.988 9.692 1.00 42.15 H new ATOM 1055 N PHE A 125 17.676 -5.558 5.776 1.00 75.00 N ATOM 1056 CA PHE A 125 16.495 -5.102 6.502 1.00 64.55 C ATOM 1057 C PHE A 125 15.737 -6.282 7.103 1.00 64.53 C ATOM 1058 O PHE A 125 15.894 -7.422 6.666 1.00 5.12 O ATOM 1059 CB PHE A 125 15.574 -4.310 5.572 1.00 12.13 C ATOM 1060 CG PHE A 125 16.312 -3.484 4.558 1.00 73.14 C ATOM 1061 CD1 PHE A 125 16.969 -4.089 3.499 1.00 62.15 C ATOM 1062 CD2 PHE A 125 16.348 -2.103 4.663 1.00 75.04 C ATOM 1063 CE1 PHE A 125 17.650 -3.331 2.564 1.00 34.51 C ATOM 1064 CE2 PHE A 125 17.026 -1.340 3.731 1.00 60.22 C ATOM 1065 CZ PHE A 125 17.677 -1.955 2.680 1.00 60.34 C ATOM 0 H PHE A 125 17.641 -6.535 5.485 1.00 75.00 H new ATOM 0 HA PHE A 125 16.825 -4.454 7.314 1.00 64.55 H new ATOM 0 HB2 PHE A 125 14.913 -5.003 5.052 1.00 12.13 H new ATOM 0 HB3 PHE A 125 14.942 -3.655 6.171 1.00 12.13 H new ATOM 0 HD1 PHE A 125 16.949 -5.164 3.403 1.00 62.15 H new ATOM 0 HD2 PHE A 125 15.840 -1.617 5.483 1.00 75.04 H new ATOM 0 HE1 PHE A 125 18.160 -3.814 1.744 1.00 34.51 H new ATOM 0 HE2 PHE A 125 17.047 -0.264 3.825 1.00 60.22 H new ATOM 0 HZ PHE A 125 18.206 -1.361 1.950 1.00 60.34 H new ATOM 1075 N ASN A 126 14.915 -6.000 8.108 1.00 3.30 N ATOM 1076 CA ASN A 126 14.133 -7.037 8.771 1.00 63.02 C ATOM 1077 C ASN A 126 12.779 -7.215 8.091 1.00 21.22 C ATOM 1078 O ASN A 126 12.262 -8.328 7.996 1.00 65.41 O ATOM 1079 CB ASN A 126 13.934 -6.689 10.247 1.00 33.34 C ATOM 1080 CG ASN A 126 15.169 -6.973 11.080 1.00 31.13 C ATOM 1081 OD1 ASN A 126 15.103 -7.675 12.090 1.00 53.33 O ATOM 1082 ND2 ASN A 126 16.304 -6.427 10.660 1.00 60.12 N ATOM 0 H ASN A 126 14.773 -5.062 8.481 1.00 3.30 H new ATOM 0 HA ASN A 126 14.683 -7.975 8.697 1.00 63.02 H new ATOM 0 HB2 ASN A 126 13.673 -5.634 10.337 1.00 33.34 H new ATOM 0 HB3 ASN A 126 13.094 -7.260 10.642 1.00 33.34 H new ATOM 0 HD21 ASN A 126 17.168 -6.582 11.180 1.00 60.12 H new ATOM 0 HD22 ASN A 126 16.312 -5.852 9.817 1.00 60.12 H new ATOM 1089 N SER A 127 12.210 -6.110 7.620 1.00 72.42 N ATOM 1090 CA SER A 127 10.914 -6.143 6.952 1.00 61.53 C ATOM 1091 C SER A 127 10.925 -5.269 5.701 1.00 22.33 C ATOM 1092 O SER A 127 11.885 -4.541 5.447 1.00 4.22 O ATOM 1093 CB SER A 127 9.813 -5.676 7.905 1.00 12.40 C ATOM 1094 OG SER A 127 8.536 -5.777 7.298 1.00 21.25 O ATOM 0 H SER A 127 12.626 -5.181 7.689 1.00 72.42 H new ATOM 0 HA SER A 127 10.713 -7.172 6.653 1.00 61.53 H new ATOM 0 HB2 SER A 127 9.836 -6.277 8.814 1.00 12.40 H new ATOM 0 HB3 SER A 127 9.998 -4.643 8.201 1.00 12.40 H new ATOM 0 HG SER A 127 7.849 -5.474 7.928 1.00 21.25 H new ATOM 1100 N LEU A 128 9.851 -5.347 4.923 1.00 22.14 N ATOM 1101 CA LEU A 128 9.735 -4.563 3.698 1.00 24.54 C ATOM 1102 C LEU A 128 9.487 -3.092 4.015 1.00 71.24 C ATOM 1103 O LEU A 128 10.117 -2.208 3.436 1.00 55.11 O ATOM 1104 CB LEU A 128 8.603 -5.108 2.826 1.00 14.05 C ATOM 1105 CG LEU A 128 8.821 -6.501 2.234 1.00 4.42 C ATOM 1106 CD1 LEU A 128 7.671 -6.875 1.313 1.00 62.54 C ATOM 1107 CD2 LEU A 128 10.146 -6.561 1.488 1.00 4.32 C ATOM 0 H LEU A 128 9.048 -5.945 5.118 1.00 22.14 H new ATOM 0 HA LEU A 128 10.675 -4.644 3.153 1.00 24.54 H new ATOM 0 HB2 LEU A 128 7.690 -5.127 3.421 1.00 14.05 H new ATOM 0 HB3 LEU A 128 8.434 -4.409 2.006 1.00 14.05 H new ATOM 0 HG LEU A 128 8.854 -7.222 3.051 1.00 4.42 H new ATOM 0 HD11 LEU A 128 7.843 -7.869 0.901 1.00 62.54 H new ATOM 0 HD12 LEU A 128 6.738 -6.872 1.876 1.00 62.54 H new ATOM 0 HD13 LEU A 128 7.606 -6.152 0.500 1.00 62.54 H new ATOM 0 HD21 LEU A 128 10.285 -7.559 1.073 1.00 4.32 H new ATOM 0 HD22 LEU A 128 10.142 -5.830 0.680 1.00 4.32 H new ATOM 0 HD23 LEU A 128 10.961 -6.337 2.176 1.00 4.32 H new ATOM 1119 N ASN A 129 8.566 -2.838 4.939 1.00 71.24 N ATOM 1120 CA ASN A 129 8.235 -1.474 5.333 1.00 3.34 C ATOM 1121 C ASN A 129 9.500 -0.661 5.595 1.00 60.45 C ATOM 1122 O ASN A 129 9.561 0.527 5.283 1.00 53.42 O ATOM 1123 CB ASN A 129 7.354 -1.482 6.584 1.00 53.11 C ATOM 1124 CG ASN A 129 8.163 -1.386 7.863 1.00 43.23 C ATOM 1125 OD1 ASN A 129 8.967 -2.266 8.169 1.00 24.30 O ATOM 1126 ND2 ASN A 129 7.953 -0.313 8.616 1.00 5.23 N ATOM 0 H ASN A 129 8.036 -3.559 5.429 1.00 71.24 H new ATOM 0 HA ASN A 129 7.688 -1.009 4.513 1.00 3.34 H new ATOM 0 HB2 ASN A 129 6.654 -0.648 6.537 1.00 53.11 H new ATOM 0 HB3 ASN A 129 6.760 -2.396 6.601 1.00 53.11 H new ATOM 0 HD21 ASN A 129 8.468 -0.193 9.488 1.00 5.23 H new ATOM 0 HD22 ASN A 129 7.276 0.391 8.323 1.00 5.23 H new ATOM 1133 N GLU A 130 10.507 -1.313 6.168 1.00 43.52 N ATOM 1134 CA GLU A 130 11.770 -0.650 6.471 1.00 45.03 C ATOM 1135 C GLU A 130 12.446 -0.157 5.194 1.00 21.22 C ATOM 1136 O GLU A 130 13.060 0.910 5.176 1.00 44.34 O ATOM 1137 CB GLU A 130 12.705 -1.602 7.220 1.00 34.32 C ATOM 1138 CG GLU A 130 13.270 -1.016 8.503 1.00 70.11 C ATOM 1139 CD GLU A 130 14.436 -0.080 8.252 1.00 1.20 C ATOM 1140 OE1 GLU A 130 14.462 0.560 7.180 1.00 41.22 O ATOM 1141 OE2 GLU A 130 15.322 0.013 9.127 1.00 62.22 O ATOM 0 H GLU A 130 10.473 -2.298 6.431 1.00 43.52 H new ATOM 0 HA GLU A 130 11.556 0.211 7.104 1.00 45.03 H new ATOM 0 HB2 GLU A 130 12.164 -2.518 7.456 1.00 34.32 H new ATOM 0 HB3 GLU A 130 13.530 -1.879 6.563 1.00 34.32 H new ATOM 0 HG2 GLU A 130 12.483 -0.477 9.029 1.00 70.11 H new ATOM 0 HG3 GLU A 130 13.593 -1.826 9.157 1.00 70.11 H new ATOM 1148 N LEU A 131 12.329 -0.942 4.129 1.00 73.20 N ATOM 1149 CA LEU A 131 12.928 -0.587 2.847 1.00 21.32 C ATOM 1150 C LEU A 131 12.135 0.522 2.164 1.00 3.40 C ATOM 1151 O LEU A 131 12.705 1.387 1.497 1.00 32.35 O ATOM 1152 CB LEU A 131 12.997 -1.815 1.937 1.00 5.30 C ATOM 1153 CG LEU A 131 14.134 -2.798 2.221 1.00 13.33 C ATOM 1154 CD1 LEU A 131 13.673 -3.882 3.183 1.00 4.13 C ATOM 1155 CD2 LEU A 131 14.643 -3.413 0.926 1.00 4.20 C ATOM 0 H LEU A 131 11.825 -1.829 4.128 1.00 73.20 H new ATOM 0 HA LEU A 131 13.938 -0.223 3.034 1.00 21.32 H new ATOM 0 HB2 LEU A 131 12.052 -2.352 2.013 1.00 5.30 H new ATOM 0 HB3 LEU A 131 13.088 -1.474 0.906 1.00 5.30 H new ATOM 0 HG LEU A 131 14.954 -2.252 2.687 1.00 13.33 H new ATOM 0 HD11 LEU A 131 14.495 -4.573 3.374 1.00 4.13 H new ATOM 0 HD12 LEU A 131 13.357 -3.426 4.121 1.00 4.13 H new ATOM 0 HD13 LEU A 131 12.836 -4.426 2.744 1.00 4.13 H new ATOM 0 HD21 LEU A 131 15.452 -4.110 1.147 1.00 4.20 H new ATOM 0 HD22 LEU A 131 13.830 -3.945 0.432 1.00 4.20 H new ATOM 0 HD23 LEU A 131 15.012 -2.625 0.270 1.00 4.20 H new ATOM 1167 N VAL A 132 10.818 0.493 2.336 1.00 15.31 N ATOM 1168 CA VAL A 132 9.946 1.498 1.739 1.00 3.51 C ATOM 1169 C VAL A 132 10.330 2.901 2.198 1.00 71.20 C ATOM 1170 O VAL A 132 10.519 3.802 1.381 1.00 1.32 O ATOM 1171 CB VAL A 132 8.469 1.241 2.091 1.00 0.21 C ATOM 1172 CG1 VAL A 132 7.647 2.507 1.903 1.00 72.00 C ATOM 1173 CG2 VAL A 132 7.912 0.103 1.249 1.00 15.43 C ATOM 0 H VAL A 132 10.331 -0.216 2.884 1.00 15.31 H new ATOM 0 HA VAL A 132 10.072 1.425 0.659 1.00 3.51 H new ATOM 0 HB VAL A 132 8.408 0.950 3.140 1.00 0.21 H new ATOM 0 HG11 VAL A 132 6.606 2.306 2.156 1.00 72.00 H new ATOM 0 HG12 VAL A 132 8.034 3.292 2.553 1.00 72.00 H new ATOM 0 HG13 VAL A 132 7.711 2.832 0.864 1.00 72.00 H new ATOM 0 HG21 VAL A 132 6.867 -0.065 1.510 1.00 15.43 H new ATOM 0 HG22 VAL A 132 7.984 0.363 0.193 1.00 15.43 H new ATOM 0 HG23 VAL A 132 8.485 -0.805 1.440 1.00 15.43 H new ATOM 1183 N ASP A 133 10.444 3.077 3.510 1.00 54.54 N ATOM 1184 CA ASP A 133 10.807 4.370 4.078 1.00 14.34 C ATOM 1185 C ASP A 133 12.250 4.728 3.737 1.00 53.20 C ATOM 1186 O ASP A 133 12.523 5.802 3.201 1.00 43.25 O ATOM 1187 CB ASP A 133 10.617 4.355 5.596 1.00 42.10 C ATOM 1188 CG ASP A 133 9.228 4.798 6.010 1.00 12.15 C ATOM 1189 OD1 ASP A 133 8.246 4.183 5.545 1.00 30.13 O ATOM 1190 OD2 ASP A 133 9.122 5.761 6.799 1.00 23.34 O ATOM 0 H ASP A 133 10.290 2.341 4.199 1.00 54.54 H new ATOM 0 HA ASP A 133 10.152 5.126 3.645 1.00 14.34 H new ATOM 0 HB2 ASP A 133 10.801 3.349 5.972 1.00 42.10 H new ATOM 0 HB3 ASP A 133 11.357 5.009 6.058 1.00 42.10 H new ATOM 1195 N TYR A 134 13.169 3.823 4.052 1.00 32.53 N ATOM 1196 CA TYR A 134 14.584 4.044 3.782 1.00 4.13 C ATOM 1197 C TYR A 134 14.778 4.788 2.465 1.00 53.35 C ATOM 1198 O TYR A 134 15.455 5.815 2.411 1.00 2.24 O ATOM 1199 CB TYR A 134 15.332 2.710 3.742 1.00 3.41 C ATOM 1200 CG TYR A 134 16.800 2.849 3.405 1.00 13.02 C ATOM 1201 CD1 TYR A 134 17.209 3.188 2.122 1.00 42.34 C ATOM 1202 CD2 TYR A 134 17.777 2.642 4.371 1.00 31.31 C ATOM 1203 CE1 TYR A 134 18.549 3.315 1.809 1.00 12.13 C ATOM 1204 CE2 TYR A 134 19.119 2.768 4.068 1.00 31.22 C ATOM 1205 CZ TYR A 134 19.500 3.104 2.786 1.00 52.21 C ATOM 1206 OH TYR A 134 20.835 3.231 2.479 1.00 2.01 O ATOM 0 H TYR A 134 12.959 2.929 4.495 1.00 32.53 H new ATOM 0 HA TYR A 134 14.990 4.656 4.587 1.00 4.13 H new ATOM 0 HB2 TYR A 134 15.235 2.219 4.710 1.00 3.41 H new ATOM 0 HB3 TYR A 134 14.859 2.060 3.006 1.00 3.41 H new ATOM 0 HD1 TYR A 134 16.467 3.355 1.355 1.00 42.34 H new ATOM 0 HD2 TYR A 134 17.482 2.378 5.376 1.00 31.31 H new ATOM 0 HE1 TYR A 134 18.850 3.578 0.806 1.00 12.13 H new ATOM 0 HE2 TYR A 134 19.866 2.604 4.831 1.00 31.22 H new ATOM 0 HH TYR A 134 21.373 3.051 3.278 1.00 2.01 H new ATOM 1216 N HIS A 135 14.177 4.262 1.402 1.00 55.52 N ATOM 1217 CA HIS A 135 14.280 4.877 0.083 1.00 65.41 C ATOM 1218 C HIS A 135 13.433 6.143 0.005 1.00 71.22 C ATOM 1219 O HIS A 135 13.823 7.125 -0.627 1.00 24.32 O ATOM 1220 CB HIS A 135 13.843 3.889 -0.999 1.00 20.52 C ATOM 1221 CG HIS A 135 14.777 2.729 -1.164 1.00 53.20 C ATOM 1222 ND1 HIS A 135 14.878 1.707 -0.244 1.00 10.33 N ATOM 1223 CD2 HIS A 135 15.653 2.432 -2.152 1.00 4.24 C ATOM 1224 CE1 HIS A 135 15.778 0.833 -0.657 1.00 72.12 C ATOM 1225 NE2 HIS A 135 16.263 1.249 -1.813 1.00 0.31 N ATOM 0 H HIS A 135 13.614 3.412 1.428 1.00 55.52 H new ATOM 0 HA HIS A 135 15.322 5.149 -0.083 1.00 65.41 H new ATOM 0 HB2 HIS A 135 12.849 3.513 -0.756 1.00 20.52 H new ATOM 0 HB3 HIS A 135 13.761 4.417 -1.949 1.00 20.52 H new ATOM 0 HD1 HIS A 135 14.341 1.637 0.621 1.00 10.33 H new ATOM 0 HD2 HIS A 135 15.838 3.016 -3.041 1.00 4.24 H new ATOM 0 HE1 HIS A 135 16.068 -0.069 -0.138 1.00 72.12 H new ATOM 1233 N ARG A 136 12.271 6.112 0.650 1.00 43.22 N ATOM 1234 CA ARG A 136 11.368 7.257 0.651 1.00 31.55 C ATOM 1235 C ARG A 136 12.118 8.541 0.991 1.00 44.13 C ATOM 1236 O ARG A 136 11.704 9.634 0.605 1.00 10.22 O ATOM 1237 CB ARG A 136 10.233 7.036 1.654 1.00 43.23 C ATOM 1238 CG ARG A 136 9.222 8.171 1.688 1.00 24.32 C ATOM 1239 CD ARG A 136 8.421 8.164 2.981 1.00 61.44 C ATOM 1240 NE ARG A 136 7.533 9.319 3.080 1.00 22.14 N ATOM 1241 CZ ARG A 136 6.636 9.475 4.047 1.00 34.42 C ATOM 1242 NH1 ARG A 136 6.508 8.554 4.992 1.00 31.53 N ATOM 1243 NH2 ARG A 136 5.864 10.554 4.070 1.00 32.31 N ATOM 0 H ARG A 136 11.933 5.307 1.178 1.00 43.22 H new ATOM 0 HA ARG A 136 10.947 7.357 -0.349 1.00 31.55 H new ATOM 0 HB2 ARG A 136 9.717 6.108 1.408 1.00 43.23 H new ATOM 0 HB3 ARG A 136 10.658 6.909 2.650 1.00 43.23 H new ATOM 0 HG2 ARG A 136 9.740 9.124 1.585 1.00 24.32 H new ATOM 0 HG3 ARG A 136 8.545 8.082 0.839 1.00 24.32 H new ATOM 0 HD2 ARG A 136 7.833 7.248 3.038 1.00 61.44 H new ATOM 0 HD3 ARG A 136 9.104 8.158 3.831 1.00 61.44 H new ATOM 0 HE ARG A 136 7.606 10.046 2.368 1.00 22.14 H new ATOM 0 HH11 ARG A 136 7.099 7.723 4.978 1.00 31.53 H new ATOM 0 HH12 ARG A 136 5.818 8.676 5.733 1.00 31.53 H new ATOM 0 HH21 ARG A 136 5.959 11.265 3.345 1.00 32.31 H new ATOM 0 HH22 ARG A 136 5.175 10.673 4.813 1.00 32.31 H new ATOM 1257 N SER A 137 13.224 8.401 1.715 1.00 61.31 N ATOM 1258 CA SER A 137 14.030 9.550 2.110 1.00 61.10 C ATOM 1259 C SER A 137 15.384 9.531 1.407 1.00 2.22 C ATOM 1260 O SER A 137 15.959 10.580 1.113 1.00 65.41 O ATOM 1261 CB SER A 137 14.230 9.562 3.627 1.00 41.13 C ATOM 1262 OG SER A 137 14.659 8.295 4.095 1.00 45.34 O ATOM 0 H SER A 137 13.582 7.503 2.040 1.00 61.31 H new ATOM 0 HA SER A 137 13.499 10.455 1.814 1.00 61.10 H new ATOM 0 HB2 SER A 137 14.966 10.320 3.894 1.00 41.13 H new ATOM 0 HB3 SER A 137 13.297 9.837 4.118 1.00 41.13 H new ATOM 0 HG SER A 137 14.781 8.329 5.067 1.00 45.34 H new ATOM 1268 N THR A 138 15.889 8.331 1.140 1.00 31.55 N ATOM 1269 CA THR A 138 17.175 8.173 0.474 1.00 43.13 C ATOM 1270 C THR A 138 16.992 7.796 -0.992 1.00 24.42 C ATOM 1271 O THR A 138 16.116 7.001 -1.333 1.00 43.24 O ATOM 1272 CB THR A 138 18.039 7.101 1.164 1.00 34.44 C ATOM 1273 OG1 THR A 138 18.192 7.415 2.553 1.00 35.51 O ATOM 1274 CG2 THR A 138 19.407 7.002 0.508 1.00 42.22 C ATOM 0 H THR A 138 15.426 7.453 1.375 1.00 31.55 H new ATOM 0 HA THR A 138 17.684 9.135 0.539 1.00 43.13 H new ATOM 0 HB THR A 138 17.535 6.140 1.062 1.00 34.44 H new ATOM 0 HG1 THR A 138 18.741 6.728 2.985 1.00 35.51 H new ATOM 0 HG21 THR A 138 19.998 6.238 1.013 1.00 42.22 H new ATOM 0 HG22 THR A 138 19.289 6.734 -0.542 1.00 42.22 H new ATOM 0 HG23 THR A 138 19.916 7.963 0.582 1.00 42.22 H new ATOM 1282 N SER A 139 17.825 8.370 -1.854 1.00 60.44 N ATOM 1283 CA SER A 139 17.753 8.095 -3.285 1.00 13.23 C ATOM 1284 C SER A 139 17.457 6.621 -3.541 1.00 21.53 C ATOM 1285 O SER A 139 17.679 5.772 -2.677 1.00 30.21 O ATOM 1286 CB SER A 139 19.063 8.490 -3.968 1.00 42.52 C ATOM 1287 OG SER A 139 20.046 7.483 -3.807 1.00 63.45 O ATOM 0 H SER A 139 18.557 9.028 -1.587 1.00 60.44 H new ATOM 0 HA SER A 139 16.940 8.688 -3.703 1.00 13.23 H new ATOM 0 HB2 SER A 139 18.886 8.663 -5.029 1.00 42.52 H new ATOM 0 HB3 SER A 139 19.427 9.428 -3.549 1.00 42.52 H new ATOM 0 HG SER A 139 20.873 7.759 -4.254 1.00 63.45 H new ATOM 1293 N VAL A 140 16.954 6.323 -4.735 1.00 23.23 N ATOM 1294 CA VAL A 140 16.629 4.951 -5.107 1.00 14.23 C ATOM 1295 C VAL A 140 17.122 4.631 -6.513 1.00 43.21 C ATOM 1296 O VAL A 140 17.580 3.521 -6.784 1.00 10.02 O ATOM 1297 CB VAL A 140 15.111 4.696 -5.037 1.00 2.03 C ATOM 1298 CG1 VAL A 140 14.360 5.702 -5.896 1.00 22.04 C ATOM 1299 CG2 VAL A 140 14.791 3.272 -5.465 1.00 54.13 C ATOM 0 H VAL A 140 16.763 7.013 -5.461 1.00 23.23 H new ATOM 0 HA VAL A 140 17.133 4.301 -4.392 1.00 14.23 H new ATOM 0 HB VAL A 140 14.785 4.823 -4.004 1.00 2.03 H new ATOM 0 HG11 VAL A 140 13.290 5.506 -5.834 1.00 22.04 H new ATOM 0 HG12 VAL A 140 14.566 6.711 -5.538 1.00 22.04 H new ATOM 0 HG13 VAL A 140 14.686 5.611 -6.932 1.00 22.04 H new ATOM 0 HG21 VAL A 140 13.715 3.109 -5.410 1.00 54.13 H new ATOM 0 HG22 VAL A 140 15.130 3.115 -6.489 1.00 54.13 H new ATOM 0 HG23 VAL A 140 15.299 2.570 -4.803 1.00 54.13 H new ATOM 1309 N SER A 141 17.027 5.612 -7.405 1.00 72.23 N ATOM 1310 CA SER A 141 17.461 5.434 -8.786 1.00 31.00 C ATOM 1311 C SER A 141 18.960 5.684 -8.921 1.00 12.52 C ATOM 1312 O SER A 141 19.483 6.674 -8.409 1.00 3.21 O ATOM 1313 CB SER A 141 16.689 6.377 -9.711 1.00 5.41 C ATOM 1314 OG SER A 141 16.209 5.691 -10.854 1.00 3.10 O ATOM 0 H SER A 141 16.654 6.538 -7.196 1.00 72.23 H new ATOM 0 HA SER A 141 17.255 4.404 -9.076 1.00 31.00 H new ATOM 0 HB2 SER A 141 15.852 6.818 -9.170 1.00 5.41 H new ATOM 0 HB3 SER A 141 17.336 7.198 -10.021 1.00 5.41 H new ATOM 0 HG SER A 141 15.240 5.818 -10.929 1.00 3.10 H new ATOM 1320 N ARG A 142 19.645 4.780 -9.613 1.00 55.24 N ATOM 1321 CA ARG A 142 21.083 4.901 -9.815 1.00 43.31 C ATOM 1322 C ARG A 142 21.390 5.748 -11.047 1.00 2.33 C ATOM 1323 O ARG A 142 22.383 5.521 -11.736 1.00 43.43 O ATOM 1324 CB ARG A 142 21.717 3.517 -9.964 1.00 62.02 C ATOM 1325 CG ARG A 142 21.444 2.592 -8.789 1.00 43.40 C ATOM 1326 CD ARG A 142 22.440 1.444 -8.741 1.00 31.11 C ATOM 1327 NE ARG A 142 22.494 0.713 -10.004 1.00 50.23 N ATOM 1328 CZ ARG A 142 23.460 -0.144 -10.317 1.00 14.23 C ATOM 1329 NH1 ARG A 142 24.446 -0.377 -9.462 1.00 10.21 N ATOM 1330 NH2 ARG A 142 23.439 -0.770 -11.486 1.00 64.42 N ATOM 0 H ARG A 142 19.227 3.955 -10.043 1.00 55.24 H new ATOM 0 HA ARG A 142 21.507 5.395 -8.941 1.00 43.31 H new ATOM 0 HB2 ARG A 142 21.343 3.052 -10.876 1.00 62.02 H new ATOM 0 HB3 ARG A 142 22.794 3.631 -10.083 1.00 62.02 H new ATOM 0 HG2 ARG A 142 21.495 3.158 -7.859 1.00 43.40 H new ATOM 0 HG3 ARG A 142 20.432 2.194 -8.865 1.00 43.40 H new ATOM 0 HD2 ARG A 142 23.430 1.833 -8.505 1.00 31.11 H new ATOM 0 HD3 ARG A 142 22.166 0.760 -7.938 1.00 31.11 H new ATOM 0 HE ARG A 142 21.749 0.869 -10.683 1.00 50.23 H new ATOM 0 HH11 ARG A 142 24.464 0.102 -8.562 1.00 10.21 H new ATOM 0 HH12 ARG A 142 25.186 -1.035 -9.704 1.00 10.21 H new ATOM 0 HH21 ARG A 142 22.681 -0.594 -12.145 1.00 64.42 H new ATOM 0 HH22 ARG A 142 24.181 -1.428 -11.726 1.00 64.42 H new ATOM 1344 N ASN A 143 20.530 6.725 -11.316 1.00 72.23 N ATOM 1345 CA ASN A 143 20.708 7.605 -12.465 1.00 44.22 C ATOM 1346 C ASN A 143 20.559 9.068 -12.058 1.00 62.11 C ATOM 1347 O ASN A 143 21.433 9.890 -12.332 1.00 10.12 O ATOM 1348 CB ASN A 143 19.695 7.263 -13.559 1.00 33.41 C ATOM 1349 CG ASN A 143 20.132 7.751 -14.926 1.00 63.13 C ATOM 1350 OD1 ASN A 143 19.517 8.647 -15.504 1.00 1.42 O ATOM 1351 ND2 ASN A 143 21.200 7.161 -15.451 1.00 3.30 N ATOM 0 H ASN A 143 19.703 6.927 -10.754 1.00 72.23 H new ATOM 0 HA ASN A 143 21.715 7.455 -12.853 1.00 44.22 H new ATOM 0 HB2 ASN A 143 19.550 6.183 -13.591 1.00 33.41 H new ATOM 0 HB3 ASN A 143 18.731 7.707 -13.309 1.00 33.41 H new ATOM 0 HD21 ASN A 143 21.541 7.447 -16.369 1.00 3.30 H new ATOM 0 HD22 ASN A 143 21.679 6.422 -14.936 1.00 3.30 H new ATOM 1358 N GLN A 144 19.447 9.384 -11.403 1.00 31.43 N ATOM 1359 CA GLN A 144 19.184 10.747 -10.958 1.00 54.10 C ATOM 1360 C GLN A 144 18.935 10.791 -9.454 1.00 23.31 C ATOM 1361 O GLN A 144 19.128 9.796 -8.755 1.00 53.22 O ATOM 1362 CB GLN A 144 17.979 11.325 -11.703 1.00 1.32 C ATOM 1363 CG GLN A 144 18.235 12.700 -12.300 1.00 64.50 C ATOM 1364 CD GLN A 144 18.427 12.656 -13.803 1.00 44.02 C ATOM 1365 OE1 GLN A 144 18.188 11.631 -14.442 1.00 20.22 O ATOM 1366 NE2 GLN A 144 18.861 13.772 -14.377 1.00 64.14 N ATOM 0 H GLN A 144 18.714 8.715 -11.169 1.00 31.43 H new ATOM 0 HA GLN A 144 20.064 11.351 -11.180 1.00 54.10 H new ATOM 0 HB2 GLN A 144 17.692 10.639 -12.500 1.00 1.32 H new ATOM 0 HB3 GLN A 144 17.134 11.387 -11.017 1.00 1.32 H new ATOM 0 HG2 GLN A 144 17.398 13.356 -12.063 1.00 64.50 H new ATOM 0 HG3 GLN A 144 19.121 13.134 -11.837 1.00 64.50 H new ATOM 0 HE21 GLN A 144 19.047 14.599 -13.809 1.00 64.14 H new ATOM 0 HE22 GLN A 144 19.009 13.803 -15.386 1.00 64.14 H new ATOM 1375 N GLN A 145 18.508 11.950 -8.963 1.00 74.51 N ATOM 1376 CA GLN A 145 18.234 12.122 -7.541 1.00 43.13 C ATOM 1377 C GLN A 145 16.735 12.224 -7.284 1.00 34.23 C ATOM 1378 O GLN A 145 16.142 13.294 -7.425 1.00 21.01 O ATOM 1379 CB GLN A 145 18.941 13.372 -7.013 1.00 34.34 C ATOM 1380 CG GLN A 145 20.232 13.072 -6.268 1.00 72.15 C ATOM 1381 CD GLN A 145 20.673 14.218 -5.380 1.00 42.42 C ATOM 1382 OE1 GLN A 145 19.853 15.009 -4.914 1.00 55.43 O ATOM 1383 NE2 GLN A 145 21.976 14.314 -5.140 1.00 53.34 N ATOM 0 H GLN A 145 18.344 12.783 -9.528 1.00 74.51 H new ATOM 0 HA GLN A 145 18.615 11.247 -7.014 1.00 43.13 H new ATOM 0 HB2 GLN A 145 19.160 14.036 -7.849 1.00 34.34 H new ATOM 0 HB3 GLN A 145 18.264 13.909 -6.348 1.00 34.34 H new ATOM 0 HG2 GLN A 145 20.097 12.178 -5.660 1.00 72.15 H new ATOM 0 HG3 GLN A 145 21.020 12.852 -6.988 1.00 72.15 H new ATOM 0 HE21 GLN A 145 22.621 13.636 -5.547 1.00 53.34 H new ATOM 0 HE22 GLN A 145 22.332 15.065 -4.549 1.00 53.34 H new ATOM 1392 N ILE A 146 16.127 11.104 -6.906 1.00 10.22 N ATOM 1393 CA ILE A 146 14.697 11.068 -6.628 1.00 15.30 C ATOM 1394 C ILE A 146 14.406 10.313 -5.336 1.00 23.53 C ATOM 1395 O ILE A 146 15.221 9.513 -4.875 1.00 61.54 O ATOM 1396 CB ILE A 146 13.915 10.410 -7.781 1.00 5.32 C ATOM 1397 CG1 ILE A 146 14.380 10.971 -9.126 1.00 45.13 C ATOM 1398 CG2 ILE A 146 12.421 10.626 -7.599 1.00 14.41 C ATOM 1399 CD1 ILE A 146 14.229 9.996 -10.272 1.00 60.44 C ATOM 0 H ILE A 146 16.603 10.210 -6.785 1.00 10.22 H new ATOM 0 HA ILE A 146 14.371 12.103 -6.522 1.00 15.30 H new ATOM 0 HB ILE A 146 14.111 9.338 -7.768 1.00 5.32 H new ATOM 0 HG12 ILE A 146 13.811 11.874 -9.350 1.00 45.13 H new ATOM 0 HG13 ILE A 146 15.426 11.265 -9.046 1.00 45.13 H new ATOM 0 HG21 ILE A 146 11.882 10.155 -8.422 1.00 14.41 H new ATOM 0 HG22 ILE A 146 12.102 10.183 -6.656 1.00 14.41 H new ATOM 0 HG23 ILE A 146 12.206 11.695 -7.589 1.00 14.41 H new ATOM 0 HD11 ILE A 146 14.578 10.461 -11.194 1.00 60.44 H new ATOM 0 HD12 ILE A 146 14.820 9.103 -10.070 1.00 60.44 H new ATOM 0 HD13 ILE A 146 13.180 9.720 -10.379 1.00 60.44 H new ATOM 1411 N PHE A 147 13.239 10.570 -4.755 1.00 51.35 N ATOM 1412 CA PHE A 147 12.840 9.914 -3.516 1.00 73.31 C ATOM 1413 C PHE A 147 11.627 9.015 -3.742 1.00 42.45 C ATOM 1414 O PHE A 147 10.807 9.271 -4.626 1.00 23.43 O ATOM 1415 CB PHE A 147 12.523 10.956 -2.441 1.00 61.42 C ATOM 1416 CG PHE A 147 13.689 11.839 -2.101 1.00 1.11 C ATOM 1417 CD1 PHE A 147 14.970 11.318 -2.022 1.00 44.01 C ATOM 1418 CD2 PHE A 147 13.504 13.191 -1.859 1.00 74.12 C ATOM 1419 CE1 PHE A 147 16.046 12.128 -1.710 1.00 13.45 C ATOM 1420 CE2 PHE A 147 14.575 14.006 -1.547 1.00 11.13 C ATOM 1421 CZ PHE A 147 15.847 13.474 -1.471 1.00 3.15 C ATOM 0 H PHE A 147 12.553 11.229 -5.123 1.00 51.35 H new ATOM 0 HA PHE A 147 13.671 9.295 -3.178 1.00 73.31 H new ATOM 0 HB2 PHE A 147 11.694 11.577 -2.781 1.00 61.42 H new ATOM 0 HB3 PHE A 147 12.189 10.445 -1.538 1.00 61.42 H new ATOM 0 HD1 PHE A 147 15.130 10.266 -2.206 1.00 44.01 H new ATOM 0 HD2 PHE A 147 12.511 13.612 -1.915 1.00 74.12 H new ATOM 0 HE1 PHE A 147 17.040 11.709 -1.653 1.00 13.45 H new ATOM 0 HE2 PHE A 147 14.418 15.058 -1.363 1.00 11.13 H new ATOM 0 HZ PHE A 147 16.685 14.109 -1.225 1.00 3.15 H new ATOM 1431 N LEU A 148 11.520 7.963 -2.939 1.00 63.23 N ATOM 1432 CA LEU A 148 10.409 7.025 -3.051 1.00 75.11 C ATOM 1433 C LEU A 148 9.107 7.664 -2.577 1.00 42.02 C ATOM 1434 O LEU A 148 8.917 7.895 -1.383 1.00 55.31 O ATOM 1435 CB LEU A 148 10.696 5.763 -2.236 1.00 64.33 C ATOM 1436 CG LEU A 148 10.367 4.434 -2.918 1.00 15.14 C ATOM 1437 CD1 LEU A 148 11.535 3.967 -3.771 1.00 44.32 C ATOM 1438 CD2 LEU A 148 10.005 3.379 -1.882 1.00 51.13 C ATOM 0 H LEU A 148 12.189 7.738 -2.203 1.00 63.23 H new ATOM 0 HA LEU A 148 10.299 6.755 -4.101 1.00 75.11 H new ATOM 0 HB2 LEU A 148 11.753 5.760 -1.969 1.00 64.33 H new ATOM 0 HB3 LEU A 148 10.132 5.820 -1.305 1.00 64.33 H new ATOM 0 HG LEU A 148 9.507 4.586 -3.570 1.00 15.14 H new ATOM 0 HD11 LEU A 148 11.282 3.020 -4.248 1.00 44.32 H new ATOM 0 HD12 LEU A 148 11.748 4.713 -4.536 1.00 44.32 H new ATOM 0 HD13 LEU A 148 12.414 3.832 -3.141 1.00 44.32 H new ATOM 0 HD21 LEU A 148 9.774 2.440 -2.385 1.00 51.13 H new ATOM 0 HD22 LEU A 148 10.846 3.231 -1.205 1.00 51.13 H new ATOM 0 HD23 LEU A 148 9.136 3.710 -1.314 1.00 51.13 H new ATOM 1450 N ARG A 149 8.214 7.945 -3.520 1.00 42.15 N ATOM 1451 CA ARG A 149 6.930 8.556 -3.199 1.00 42.42 C ATOM 1452 C ARG A 149 5.900 7.494 -2.827 1.00 22.10 C ATOM 1453 O ARG A 149 5.771 6.475 -3.506 1.00 51.55 O ATOM 1454 CB ARG A 149 6.423 9.381 -4.384 1.00 21.31 C ATOM 1455 CG ARG A 149 7.328 10.547 -4.746 1.00 61.24 C ATOM 1456 CD ARG A 149 7.236 11.664 -3.719 1.00 30.12 C ATOM 1457 NE ARG A 149 8.066 12.810 -4.080 1.00 54.24 N ATOM 1458 CZ ARG A 149 8.236 13.870 -3.298 1.00 24.22 C ATOM 1459 NH1 ARG A 149 7.639 13.928 -2.116 1.00 13.32 N ATOM 1460 NH2 ARG A 149 9.007 14.874 -3.697 1.00 30.40 N ATOM 0 H ARG A 149 8.356 7.759 -4.513 1.00 42.15 H new ATOM 0 HA ARG A 149 7.073 9.214 -2.342 1.00 42.42 H new ATOM 0 HB2 ARG A 149 6.320 8.729 -5.252 1.00 21.31 H new ATOM 0 HB3 ARG A 149 5.429 9.762 -4.151 1.00 21.31 H new ATOM 0 HG2 ARG A 149 8.359 10.200 -4.817 1.00 61.24 H new ATOM 0 HG3 ARG A 149 7.053 10.931 -5.728 1.00 61.24 H new ATOM 0 HD2 ARG A 149 6.198 11.984 -3.624 1.00 30.12 H new ATOM 0 HD3 ARG A 149 7.544 11.286 -2.744 1.00 30.12 H new ATOM 0 HE ARG A 149 8.541 12.796 -4.982 1.00 54.24 H new ATOM 0 HH11 ARG A 149 7.047 13.157 -1.805 1.00 13.32 H new ATOM 0 HH12 ARG A 149 7.771 14.743 -1.517 1.00 13.32 H new ATOM 0 HH21 ARG A 149 9.470 14.832 -4.605 1.00 30.40 H new ATOM 0 HH22 ARG A 149 9.137 15.688 -3.096 1.00 30.40 H new ATOM 1474 N ASP A 150 5.171 7.739 -1.744 1.00 74.42 N ATOM 1475 CA ASP A 150 4.152 6.804 -1.282 1.00 34.45 C ATOM 1476 C ASP A 150 2.964 6.777 -2.238 1.00 54.32 C ATOM 1477 O ASP A 150 2.180 7.725 -2.296 1.00 52.30 O ATOM 1478 CB ASP A 150 3.682 7.182 0.124 1.00 0.20 C ATOM 1479 CG ASP A 150 4.177 6.214 1.180 1.00 33.51 C ATOM 1480 OD1 ASP A 150 4.204 4.997 0.902 1.00 21.41 O ATOM 1481 OD2 ASP A 150 4.536 6.672 2.285 1.00 15.31 O ATOM 0 H ASP A 150 5.267 8.577 -1.170 1.00 74.42 H new ATOM 0 HA ASP A 150 4.595 5.808 -1.254 1.00 34.45 H new ATOM 0 HB2 ASP A 150 4.032 8.186 0.363 1.00 0.20 H new ATOM 0 HB3 ASP A 150 2.593 7.211 0.144 1.00 0.20 H new ATOM 1486 N ILE A 151 2.838 5.687 -2.987 1.00 52.12 N ATOM 1487 CA ILE A 151 1.746 5.538 -3.941 1.00 53.11 C ATOM 1488 C ILE A 151 0.393 5.724 -3.262 1.00 22.23 C ATOM 1489 O ILE A 151 0.243 5.450 -2.071 1.00 43.15 O ATOM 1490 CB ILE A 151 1.779 4.158 -4.624 1.00 43.22 C ATOM 1491 CG1 ILE A 151 1.025 4.205 -5.955 1.00 0.04 C ATOM 1492 CG2 ILE A 151 1.184 3.099 -3.708 1.00 53.25 C ATOM 1493 CD1 ILE A 151 0.894 2.854 -6.623 1.00 44.41 C ATOM 0 H ILE A 151 3.479 4.894 -2.952 1.00 52.12 H new ATOM 0 HA ILE A 151 1.880 6.312 -4.697 1.00 53.11 H new ATOM 0 HB ILE A 151 2.817 3.893 -4.826 1.00 43.22 H new ATOM 0 HG12 ILE A 151 0.030 4.615 -5.785 1.00 0.04 H new ATOM 0 HG13 ILE A 151 1.540 4.887 -6.631 1.00 0.04 H new ATOM 0 HG21 ILE A 151 1.214 2.129 -4.205 1.00 53.25 H new ATOM 0 HG22 ILE A 151 1.760 3.052 -2.784 1.00 53.25 H new ATOM 0 HG23 ILE A 151 0.150 3.356 -3.478 1.00 53.25 H new ATOM 0 HD11 ILE A 151 0.349 2.963 -7.561 1.00 44.41 H new ATOM 0 HD12 ILE A 151 1.886 2.450 -6.825 1.00 44.41 H new ATOM 0 HD13 ILE A 151 0.352 2.174 -5.966 1.00 44.41 H new ATOM 1505 N GLU A 152 -0.589 6.189 -4.028 1.00 2.15 N ATOM 1506 CA GLU A 152 -1.930 6.410 -3.499 1.00 4.12 C ATOM 1507 C GLU A 152 -2.830 5.210 -3.779 1.00 24.01 C ATOM 1508 O GLU A 152 -3.516 5.161 -4.799 1.00 40.52 O ATOM 1509 CB GLU A 152 -2.541 7.673 -4.109 1.00 42.20 C ATOM 1510 CG GLU A 152 -2.150 8.950 -3.384 1.00 31.13 C ATOM 1511 CD GLU A 152 -3.351 9.719 -2.868 1.00 72.13 C ATOM 1512 OE1 GLU A 152 -4.256 10.016 -3.677 1.00 2.15 O ATOM 1513 OE2 GLU A 152 -3.387 10.024 -1.658 1.00 25.40 O ATOM 0 H GLU A 152 -0.481 6.420 -5.016 1.00 2.15 H new ATOM 0 HA GLU A 152 -1.850 6.538 -2.420 1.00 4.12 H new ATOM 0 HB2 GLU A 152 -2.233 7.748 -5.152 1.00 42.20 H new ATOM 0 HB3 GLU A 152 -3.627 7.580 -4.104 1.00 42.20 H new ATOM 0 HG2 GLU A 152 -1.495 8.703 -2.548 1.00 31.13 H new ATOM 0 HG3 GLU A 152 -1.579 9.587 -4.060 1.00 31.13 H new ATOM 1520 N GLN A 153 -2.819 4.244 -2.866 1.00 14.22 N ATOM 1521 CA GLN A 153 -3.633 3.044 -3.015 1.00 74.32 C ATOM 1522 C GLN A 153 -5.119 3.385 -2.975 1.00 53.12 C ATOM 1523 O GLN A 153 -5.512 4.434 -2.465 1.00 53.43 O ATOM 1524 CB GLN A 153 -3.300 2.036 -1.914 1.00 62.53 C ATOM 1525 CG GLN A 153 -3.469 0.587 -2.344 1.00 11.21 C ATOM 1526 CD GLN A 153 -4.506 -0.149 -1.519 1.00 11.13 C ATOM 1527 OE1 GLN A 153 -5.073 0.404 -0.576 1.00 2.32 O ATOM 1528 NE2 GLN A 153 -4.760 -1.404 -1.870 1.00 33.02 N ATOM 0 H GLN A 153 -2.256 4.269 -2.016 1.00 14.22 H new ATOM 0 HA GLN A 153 -3.406 2.601 -3.985 1.00 74.32 H new ATOM 0 HB2 GLN A 153 -2.271 2.192 -1.589 1.00 62.53 H new ATOM 0 HB3 GLN A 153 -3.939 2.227 -1.052 1.00 62.53 H new ATOM 0 HG2 GLN A 153 -3.757 0.555 -3.395 1.00 11.21 H new ATOM 0 HG3 GLN A 153 -2.512 0.073 -2.260 1.00 11.21 H new ATOM 0 HE21 GLN A 153 -4.267 -1.823 -2.658 1.00 33.02 H new ATOM 0 HE22 GLN A 153 -5.448 -1.949 -1.351 1.00 33.02 H new