USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 956 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 170 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 173 ASN : amide:sc= -0.449 K(o=-0.45,f=-4!) USER MOD Set 2.1: A 141 GLN : amide:sc= 0.592 X(o=0.81,f=0.52) USER MOD Set 2.2: A 147 TYR OH : rot -107:sc= 0.215 USER MOD Set 3.1: A 84 GLN : amide:sc= 1.33 K(o=2.5,f=-6.1) USER MOD Set 3.2: A 88 LYS NZ :NH3+ -152:sc= 1.18 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -3.32! C(o=-3.3!,f=-6.9!) USER MOD Single : A 77 SER OG : rot 110:sc= -0.65 USER MOD Single : A 80 HIS : no HD1:sc= 0.773 K(o=0.77,f=-2.8!) USER MOD Single : A 82 SER OG : rot -150:sc= -0.032 USER MOD Single : A 85 THR OG1 : rot 120:sc= 0.84 USER MOD Single : A 87 THR OG1 : rot -56:sc= -0.165 USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.557 USER MOD Single : A 92 CYS SG : rot 36:sc= 0.0706 USER MOD Single : A 93 SER OG : rot 180:sc= -0.218 USER MOD Single : A 103 ASN : amide:sc= -1.1 X(o=-1.1,f=-0.88) USER MOD Single : A 104 THR OG1 : rot 180:sc=-0.00567 USER MOD Single : A 107 LYS NZ :NH3+ -123:sc= 0.55 (180deg=-0.0205) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ -166:sc= -0.0194 (180deg=-0.252) USER MOD Single : A 111 SER OG : rot 172:sc= 1.6 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ -147:sc= 1.26 (180deg=0.578) USER MOD Single : A 118 HIS : no HD1:sc= -4.4 K(o=-4.4,f=-2.6) USER MOD Single : A 119 LYS NZ :NH3+ -164:sc= 1.27 (180deg=0.322) USER MOD Single : A 122 ASN : amide:sc= 0.87 K(o=0.87,f=-7.2!) USER MOD Single : A 125 LYS NZ :NH3+ -163:sc= -0.0588 (180deg=-0.321) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN : amide:sc= -3.7! C(o=-3.7!,f=-7.5!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot -120:sc= -0.0129 USER MOD Single : A 140 ASN : amide:sc= -0.504 X(o=-0.5,f=-0.56) USER MOD Single : A 145 SER OG : rot 72:sc= 1.26 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 102:sc= 1.52 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 MET CE :methyl -126:sc= -0.741 (180deg=-3.06!) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 LYS NZ :NH3+ -173:sc= 0.792 (180deg=0.753) USER MOD Single : A 165 TYR OH : rot 3:sc= 1.29 USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot 150:sc= 0.0347 USER MOD Single : A 180 SER OG : rot 30:sc= -0.847 USER MOD Single : A 183 MET CE :methyl -162:sc= -1.57 (180deg=-2.61) USER MOD Single : A 187 LYS NZ :NH3+ -156:sc= -0.076 (180deg=-0.469) USER MOD Single : A 188 CYS SG : rot 180:sc= -0.0199 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 24.801 5.222 -0.548 1.00 3.12 N ATOM 2 CA ARG A 73 24.784 3.764 -0.299 1.00 2.69 C ATOM 3 C ARG A 73 23.387 3.312 0.100 1.00 2.08 C ATOM 4 O ARG A 73 23.110 3.080 1.279 1.00 2.31 O ATOM 5 CB ARG A 73 25.783 3.388 0.800 1.00 3.05 C ATOM 6 CG ARG A 73 27.245 3.548 0.403 1.00 3.69 C ATOM 7 CD ARG A 73 27.626 2.628 -0.749 1.00 4.24 C ATOM 8 NE ARG A 73 27.143 3.126 -2.037 1.00 4.97 N ATOM 9 CZ ARG A 73 26.685 2.349 -3.018 1.00 5.85 C ATOM 10 NH1 ARG A 73 26.655 1.031 -2.873 1.00 6.18 N ATOM 11 NH2 ARG A 73 26.261 2.897 -4.148 1.00 6.67 N ATOM 0 HA ARG A 73 25.073 3.260 -1.221 1.00 2.69 H new ATOM 0 HB2 ARG A 73 25.588 4.004 1.678 1.00 3.05 H new ATOM 0 HB3 ARG A 73 25.610 2.352 1.093 1.00 3.05 H new ATOM 0 HG2 ARG A 73 27.432 4.583 0.118 1.00 3.69 H new ATOM 0 HG3 ARG A 73 27.880 3.335 1.263 1.00 3.69 H new ATOM 0 HD2 ARG A 73 28.710 2.524 -0.785 1.00 4.24 H new ATOM 0 HD3 ARG A 73 27.216 1.634 -0.569 1.00 4.24 H new ATOM 0 HE ARG A 73 27.158 4.134 -2.194 1.00 4.97 H new ATOM 0 HH11 ARG A 73 26.984 0.606 -2.006 1.00 6.18 H new ATOM 0 HH12 ARG A 73 26.303 0.443 -3.628 1.00 6.18 H new ATOM 0 HH21 ARG A 73 26.286 3.910 -4.264 1.00 6.67 H new ATOM 0 HH22 ARG A 73 25.910 2.306 -4.901 1.00 6.67 H new ATOM 25 N TRP A 74 22.511 3.186 -0.881 1.00 1.61 N ATOM 26 CA TRP A 74 21.140 2.792 -0.617 1.00 1.14 C ATOM 27 C TRP A 74 20.755 1.616 -1.509 1.00 0.96 C ATOM 28 O TRP A 74 20.624 1.763 -2.721 1.00 1.19 O ATOM 29 CB TRP A 74 20.200 3.977 -0.844 1.00 1.25 C ATOM 30 CG TRP A 74 18.924 3.864 -0.073 1.00 1.15 C ATOM 31 CD1 TRP A 74 17.705 3.498 -0.553 1.00 1.14 C ATOM 32 CD2 TRP A 74 18.751 4.119 1.323 1.00 1.26 C ATOM 33 NE1 TRP A 74 16.780 3.508 0.463 1.00 1.26 N ATOM 34 CE2 TRP A 74 17.399 3.886 1.624 1.00 1.34 C ATOM 35 CE3 TRP A 74 19.609 4.521 2.349 1.00 1.43 C ATOM 36 CZ2 TRP A 74 16.885 4.043 2.907 1.00 1.61 C ATOM 37 CZ3 TRP A 74 19.100 4.676 3.622 1.00 1.66 C ATOM 38 CH2 TRP A 74 17.747 4.437 3.894 1.00 1.75 C ATOM 0 H TRP A 74 22.724 3.350 -1.865 1.00 1.61 H new ATOM 0 HA TRP A 74 21.051 2.479 0.423 1.00 1.14 H new ATOM 0 HB2 TRP A 74 20.710 4.898 -0.560 1.00 1.25 H new ATOM 0 HB3 TRP A 74 19.971 4.054 -1.907 1.00 1.25 H new ATOM 0 HD1 TRP A 74 17.495 3.238 -1.580 1.00 1.14 H new ATOM 0 HE1 TRP A 74 15.792 3.272 0.368 1.00 1.26 H new ATOM 0 HE3 TRP A 74 20.654 4.707 2.149 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 15.841 3.860 3.117 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 19.756 4.987 4.422 1.00 1.66 H new ATOM 0 HH2 TRP A 74 17.377 4.566 4.901 1.00 1.75 H new ATOM 49 N ASP A 75 20.591 0.447 -0.900 1.00 0.79 N ATOM 50 CA ASP A 75 20.336 -0.785 -1.651 1.00 0.78 C ATOM 51 C ASP A 75 18.849 -1.038 -1.848 1.00 0.67 C ATOM 52 O ASP A 75 18.454 -1.713 -2.786 1.00 0.92 O ATOM 53 CB ASP A 75 20.947 -1.994 -0.929 1.00 0.92 C ATOM 54 CG ASP A 75 22.457 -2.045 -1.024 1.00 1.37 C ATOM 55 OD1 ASP A 75 22.980 -2.640 -1.987 1.00 2.01 O ATOM 56 OD2 ASP A 75 23.131 -1.502 -0.126 1.00 1.86 O ATOM 0 H ASP A 75 20.629 0.323 0.112 1.00 0.79 H new ATOM 0 HA ASP A 75 20.800 -0.655 -2.629 1.00 0.78 H new ATOM 0 HB2 ASP A 75 20.656 -1.967 0.121 1.00 0.92 H new ATOM 0 HB3 ASP A 75 20.532 -2.909 -1.351 1.00 0.92 H new ATOM 61 N GLN A 76 18.037 -0.499 -0.955 1.00 0.59 N ATOM 62 CA GLN A 76 16.612 -0.835 -0.887 1.00 0.77 C ATOM 63 C GLN A 76 15.745 0.144 -1.686 1.00 0.69 C ATOM 64 O GLN A 76 14.530 0.173 -1.528 1.00 0.94 O ATOM 65 CB GLN A 76 16.176 -0.861 0.578 1.00 1.07 C ATOM 66 CG GLN A 76 16.117 0.516 1.215 1.00 1.21 C ATOM 67 CD GLN A 76 16.402 0.490 2.699 1.00 1.75 C ATOM 68 OE1 GLN A 76 15.517 0.245 3.509 1.00 2.30 O ATOM 69 NE2 GLN A 76 17.637 0.787 3.064 1.00 2.36 N ATOM 0 H GLN A 76 18.338 0.181 -0.257 1.00 0.59 H new ATOM 0 HA GLN A 76 16.472 -1.817 -1.338 1.00 0.77 H new ATOM 0 HB2 GLN A 76 15.194 -1.328 0.649 1.00 1.07 H new ATOM 0 HB3 GLN A 76 16.867 -1.485 1.144 1.00 1.07 H new ATOM 0 HG2 GLN A 76 16.837 1.170 0.723 1.00 1.21 H new ATOM 0 HG3 GLN A 76 15.130 0.946 1.047 1.00 1.21 H new ATOM 0 HE21 GLN A 76 18.344 0.985 2.356 1.00 2.36 H new ATOM 0 HE22 GLN A 76 17.883 0.819 4.053 1.00 2.36 H new ATOM 78 N SER A 77 16.388 0.942 -2.521 1.00 0.51 N ATOM 79 CA SER A 77 15.771 2.105 -3.167 1.00 0.56 C ATOM 80 C SER A 77 14.451 1.829 -3.916 1.00 0.43 C ATOM 81 O SER A 77 13.620 2.731 -4.034 1.00 0.54 O ATOM 82 CB SER A 77 16.773 2.701 -4.150 1.00 0.80 C ATOM 83 OG SER A 77 18.055 2.830 -3.557 1.00 1.52 O ATOM 0 H SER A 77 17.366 0.805 -2.778 1.00 0.51 H new ATOM 0 HA SER A 77 15.510 2.787 -2.358 1.00 0.56 H new ATOM 0 HB2 SER A 77 16.840 2.068 -5.035 1.00 0.80 H new ATOM 0 HB3 SER A 77 16.423 3.678 -4.483 1.00 0.80 H new ATOM 0 HG SER A 77 18.669 2.183 -3.962 1.00 1.52 H new ATOM 89 N ASP A 78 14.240 0.614 -4.412 1.00 0.35 N ATOM 90 CA ASP A 78 13.180 0.394 -5.406 1.00 0.38 C ATOM 91 C ASP A 78 12.150 -0.657 -5.007 1.00 0.33 C ATOM 92 O ASP A 78 11.721 -1.452 -5.843 1.00 0.42 O ATOM 93 CB ASP A 78 13.773 0.051 -6.776 1.00 0.51 C ATOM 94 CG ASP A 78 14.195 1.285 -7.546 1.00 0.94 C ATOM 95 OD1 ASP A 78 13.350 1.855 -8.266 1.00 1.66 O ATOM 96 OD2 ASP A 78 15.376 1.690 -7.444 1.00 1.66 O ATOM 0 H ASP A 78 14.771 -0.218 -4.154 1.00 0.35 H new ATOM 0 HA ASP A 78 12.643 1.341 -5.460 1.00 0.38 H new ATOM 0 HB2 ASP A 78 14.634 -0.603 -6.643 1.00 0.51 H new ATOM 0 HB3 ASP A 78 13.038 -0.504 -7.359 1.00 0.51 H new ATOM 101 N LEU A 79 11.766 -0.686 -3.741 1.00 0.26 N ATOM 102 CA LEU A 79 10.627 -1.506 -3.330 1.00 0.26 C ATOM 103 C LEU A 79 9.336 -0.858 -3.812 1.00 0.30 C ATOM 104 O LEU A 79 8.775 0.011 -3.148 1.00 0.51 O ATOM 105 CB LEU A 79 10.583 -1.698 -1.809 1.00 0.28 C ATOM 106 CG LEU A 79 11.415 -2.862 -1.256 1.00 0.28 C ATOM 107 CD1 LEU A 79 10.930 -4.183 -1.827 1.00 0.29 C ATOM 108 CD2 LEU A 79 12.896 -2.664 -1.548 1.00 0.30 C ATOM 0 H LEU A 79 12.214 -0.163 -2.988 1.00 0.26 H new ATOM 0 HA LEU A 79 10.739 -2.492 -3.781 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.923 -0.777 -1.336 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.545 -1.845 -1.511 1.00 0.28 H new ATOM 0 HG LEU A 79 11.286 -2.884 -0.174 1.00 0.28 H new ATOM 0 HD11 LEU A 79 11.532 -4.997 -1.423 1.00 0.29 H new ATOM 0 HD12 LEU A 79 9.885 -4.335 -1.555 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.024 -4.166 -2.913 1.00 0.29 H new ATOM 0 HD21 LEU A 79 13.462 -3.504 -1.145 1.00 0.30 H new ATOM 0 HD22 LEU A 79 13.050 -2.607 -2.626 1.00 0.30 H new ATOM 0 HD23 LEU A 79 13.238 -1.739 -1.083 1.00 0.30 H new ATOM 120 N HIS A 80 8.867 -1.287 -4.971 1.00 0.21 N ATOM 121 CA HIS A 80 7.751 -0.626 -5.626 1.00 0.25 C ATOM 122 C HIS A 80 6.510 -1.505 -5.615 1.00 0.22 C ATOM 123 O HIS A 80 6.572 -2.691 -5.943 1.00 0.23 O ATOM 124 CB HIS A 80 8.133 -0.272 -7.065 1.00 0.33 C ATOM 125 CG HIS A 80 7.101 0.534 -7.790 1.00 1.03 C ATOM 126 ND1 HIS A 80 6.315 0.024 -8.800 1.00 1.94 N ATOM 127 CD2 HIS A 80 6.729 1.825 -7.642 1.00 1.86 C ATOM 128 CE1 HIS A 80 5.502 0.967 -9.237 1.00 2.58 C ATOM 129 NE2 HIS A 80 5.734 2.068 -8.552 1.00 2.50 N ATOM 0 H HIS A 80 9.241 -2.089 -5.478 1.00 0.21 H new ATOM 0 HA HIS A 80 7.521 0.287 -5.077 1.00 0.25 H new ATOM 0 HB2 HIS A 80 9.071 0.283 -7.055 1.00 0.33 H new ATOM 0 HB3 HIS A 80 8.314 -1.193 -7.619 1.00 0.33 H new ATOM 0 HD2 HIS A 80 7.140 2.533 -6.938 1.00 1.86 H new ATOM 0 HE1 HIS A 80 4.770 0.855 -10.023 1.00 2.58 H new ATOM 0 HE2 HIS A 80 5.251 2.957 -8.679 1.00 2.50 H new ATOM 138 N ILE A 81 5.389 -0.911 -5.231 1.00 0.23 N ATOM 139 CA ILE A 81 4.106 -1.597 -5.237 1.00 0.23 C ATOM 140 C ILE A 81 3.761 -2.048 -6.649 1.00 0.26 C ATOM 141 O ILE A 81 3.542 -1.224 -7.535 1.00 0.36 O ATOM 142 CB ILE A 81 2.974 -0.690 -4.714 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.300 -0.175 -3.308 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.650 -1.443 -4.712 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.289 0.818 -2.782 1.00 0.27 C ATOM 0 H ILE A 81 5.344 0.055 -4.908 1.00 0.23 H new ATOM 0 HA ILE A 81 4.195 -2.460 -4.577 1.00 0.23 H new ATOM 0 HB ILE A 81 2.885 0.168 -5.380 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.357 -1.021 -2.623 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.285 0.292 -3.320 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.861 -0.790 -4.340 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.410 -1.761 -5.727 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.730 -2.318 -4.067 1.00 0.28 H new ATOM 0 HD11 ILE A 81 2.582 1.141 -1.783 1.00 0.27 H new ATOM 0 HD12 ILE A 81 2.249 1.682 -3.445 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.306 0.348 -2.738 1.00 0.27 H new ATOM 157 N SER A 82 3.736 -3.349 -6.857 1.00 0.25 N ATOM 158 CA SER A 82 3.423 -3.898 -8.161 1.00 0.29 C ATOM 159 C SER A 82 1.973 -4.367 -8.213 1.00 0.33 C ATOM 160 O SER A 82 1.286 -4.173 -9.216 1.00 0.43 O ATOM 161 CB SER A 82 4.379 -5.048 -8.488 1.00 0.32 C ATOM 162 OG SER A 82 5.725 -4.607 -8.449 1.00 1.10 O ATOM 0 H SER A 82 3.929 -4.047 -6.139 1.00 0.25 H new ATOM 0 HA SER A 82 3.550 -3.117 -8.910 1.00 0.29 H new ATOM 0 HB2 SER A 82 4.236 -5.860 -7.775 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.151 -5.448 -9.476 1.00 0.32 H new ATOM 0 HG SER A 82 6.260 -5.134 -9.078 1.00 1.10 H new ATOM 168 N ASP A 83 1.495 -4.936 -7.113 1.00 0.33 N ATOM 169 CA ASP A 83 0.150 -5.500 -7.068 1.00 0.38 C ATOM 170 C ASP A 83 -0.531 -5.135 -5.762 1.00 0.30 C ATOM 171 O ASP A 83 0.112 -4.621 -4.846 1.00 0.27 O ATOM 172 CB ASP A 83 0.194 -7.026 -7.229 1.00 0.46 C ATOM 173 CG ASP A 83 0.589 -7.453 -8.627 1.00 1.27 C ATOM 174 OD1 ASP A 83 1.799 -7.599 -8.894 1.00 2.07 O ATOM 175 OD2 ASP A 83 -0.315 -7.650 -9.469 1.00 1.90 O ATOM 0 H ASP A 83 2.017 -5.019 -6.241 1.00 0.33 H new ATOM 0 HA ASP A 83 -0.423 -5.081 -7.895 1.00 0.38 H new ATOM 0 HB2 ASP A 83 0.901 -7.443 -6.512 1.00 0.46 H new ATOM 0 HB3 ASP A 83 -0.785 -7.441 -6.989 1.00 0.46 H new ATOM 180 N GLN A 84 -1.829 -5.397 -5.677 1.00 0.31 N ATOM 181 CA GLN A 84 -2.588 -5.101 -4.476 1.00 0.35 C ATOM 182 C GLN A 84 -3.833 -5.976 -4.379 1.00 0.34 C ATOM 183 O GLN A 84 -3.991 -6.923 -5.155 1.00 0.39 O ATOM 184 CB GLN A 84 -2.942 -3.602 -4.405 1.00 0.49 C ATOM 185 CG GLN A 84 -3.440 -2.989 -5.711 1.00 0.64 C ATOM 186 CD GLN A 84 -4.842 -3.426 -6.094 1.00 1.32 C ATOM 187 OE1 GLN A 84 -5.023 -4.407 -6.813 1.00 2.14 O ATOM 188 NE2 GLN A 84 -5.842 -2.692 -5.633 1.00 1.98 N ATOM 0 H GLN A 84 -2.376 -5.815 -6.429 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.961 -5.334 -3.615 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -3.707 -3.462 -3.641 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -2.060 -3.052 -4.077 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -3.419 -1.903 -5.624 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -2.753 -3.258 -6.514 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -5.651 -1.885 -5.039 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -6.804 -2.933 -5.872 1.00 1.98 H new ATOM 197 N THR A 85 -4.679 -5.666 -3.399 1.00 0.34 N ATOM 198 CA THR A 85 -5.911 -6.402 -3.127 1.00 0.39 C ATOM 199 C THR A 85 -6.675 -6.770 -4.402 1.00 0.50 C ATOM 200 O THR A 85 -6.959 -5.910 -5.239 1.00 0.54 O ATOM 201 CB THR A 85 -6.832 -5.558 -2.231 1.00 0.32 C ATOM 202 OG1 THR A 85 -6.088 -5.049 -1.117 1.00 0.43 O ATOM 203 CG2 THR A 85 -8.010 -6.377 -1.726 1.00 0.42 C ATOM 0 H THR A 85 -4.525 -4.884 -2.762 1.00 0.34 H new ATOM 0 HA THR A 85 -5.621 -7.328 -2.630 1.00 0.39 H new ATOM 0 HB THR A 85 -7.220 -4.731 -2.826 1.00 0.32 H new ATOM 0 HG1 THR A 85 -6.110 -4.069 -1.129 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.643 -5.753 -1.095 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.590 -6.742 -2.574 1.00 0.42 H new ATOM 0 HG23 THR A 85 -7.643 -7.224 -1.146 1.00 0.42 H new ATOM 211 N ASP A 86 -7.020 -8.048 -4.528 1.00 0.69 N ATOM 212 CA ASP A 86 -7.752 -8.539 -5.693 1.00 0.89 C ATOM 213 C ASP A 86 -9.169 -7.976 -5.710 1.00 0.83 C ATOM 214 O ASP A 86 -10.097 -8.563 -5.153 1.00 1.12 O ATOM 215 CB ASP A 86 -7.793 -10.069 -5.714 1.00 1.20 C ATOM 216 CG ASP A 86 -8.556 -10.605 -6.911 1.00 1.67 C ATOM 217 OD1 ASP A 86 -9.532 -11.362 -6.718 1.00 2.32 O ATOM 218 OD2 ASP A 86 -8.191 -10.258 -8.055 1.00 2.23 O ATOM 0 H ASP A 86 -6.804 -8.765 -3.836 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.226 -8.199 -6.585 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -6.775 -10.458 -5.730 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -8.258 -10.431 -4.797 1.00 1.20 H new ATOM 223 N THR A 87 -9.309 -6.820 -6.333 1.00 0.72 N ATOM 224 CA THR A 87 -10.583 -6.125 -6.419 1.00 0.74 C ATOM 225 C THR A 87 -10.785 -5.569 -7.824 1.00 0.81 C ATOM 226 O THR A 87 -11.641 -6.045 -8.571 1.00 1.42 O ATOM 227 CB THR A 87 -10.635 -4.975 -5.397 1.00 1.14 C ATOM 228 OG1 THR A 87 -9.370 -4.297 -5.383 1.00 1.36 O ATOM 229 CG2 THR A 87 -10.958 -5.492 -4.003 1.00 1.87 C ATOM 0 H THR A 87 -8.541 -6.334 -6.795 1.00 0.72 H new ATOM 0 HA THR A 87 -11.379 -6.835 -6.196 1.00 0.74 H new ATOM 0 HB THR A 87 -11.425 -4.284 -5.692 1.00 1.14 H new ATOM 0 HG1 THR A 87 -8.657 -4.940 -5.188 1.00 1.36 H new ATOM 0 HG21 THR A 87 -10.988 -4.657 -3.303 1.00 1.87 H new ATOM 0 HG22 THR A 87 -11.927 -5.990 -4.015 1.00 1.87 H new ATOM 0 HG23 THR A 87 -10.190 -6.200 -3.691 1.00 1.87 H new ATOM 237 N LYS A 88 -9.976 -4.568 -8.168 1.00 1.18 N ATOM 238 CA LYS A 88 -9.966 -3.980 -9.506 1.00 1.58 C ATOM 239 C LYS A 88 -11.337 -3.404 -9.851 1.00 1.51 C ATOM 240 O LYS A 88 -11.975 -3.818 -10.822 1.00 1.95 O ATOM 241 CB LYS A 88 -9.552 -5.021 -10.558 1.00 1.89 C ATOM 242 CG LYS A 88 -8.318 -5.839 -10.188 1.00 2.02 C ATOM 243 CD LYS A 88 -7.093 -4.969 -9.960 1.00 2.39 C ATOM 244 CE LYS A 88 -5.863 -5.818 -9.680 1.00 2.73 C ATOM 245 NZ LYS A 88 -4.657 -4.990 -9.430 1.00 3.20 N ATOM 0 H LYS A 88 -9.308 -4.142 -7.526 1.00 1.18 H new ATOM 0 HA LYS A 88 -9.235 -3.172 -9.512 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -10.387 -5.702 -10.725 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -9.364 -4.510 -11.502 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -8.524 -6.415 -9.286 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -8.109 -6.555 -10.982 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -6.917 -4.346 -10.837 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -7.272 -4.296 -9.122 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -6.051 -6.454 -8.815 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -5.679 -6.479 -10.527 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -3.807 -5.521 -9.709 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -4.716 -4.114 -9.987 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -4.602 -4.754 -8.419 1.00 3.20 H new ATOM 259 N GLY A 89 -11.790 -2.455 -9.044 1.00 1.22 N ATOM 260 CA GLY A 89 -13.081 -1.841 -9.272 1.00 1.14 C ATOM 261 C GLY A 89 -13.873 -1.684 -7.990 1.00 0.96 C ATOM 262 O GLY A 89 -13.294 -1.601 -6.904 1.00 1.01 O ATOM 0 H GLY A 89 -11.284 -2.099 -8.233 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -12.940 -0.863 -9.733 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -13.650 -2.447 -9.977 1.00 1.14 H new ATOM 266 N THR A 90 -15.194 -1.649 -8.110 1.00 0.97 N ATOM 267 CA THR A 90 -16.059 -1.492 -6.952 1.00 0.88 C ATOM 268 C THR A 90 -16.752 -2.810 -6.612 1.00 0.82 C ATOM 269 O THR A 90 -17.668 -3.244 -7.310 1.00 1.04 O ATOM 270 CB THR A 90 -17.118 -0.399 -7.196 1.00 1.06 C ATOM 271 OG1 THR A 90 -16.474 0.818 -7.597 1.00 1.25 O ATOM 272 CG2 THR A 90 -17.943 -0.147 -5.944 1.00 1.02 C ATOM 0 H THR A 90 -15.688 -1.727 -8.999 1.00 0.97 H new ATOM 0 HA THR A 90 -15.433 -1.192 -6.112 1.00 0.88 H new ATOM 0 HB THR A 90 -17.786 -0.742 -7.986 1.00 1.06 H new ATOM 0 HG1 THR A 90 -17.150 1.510 -7.753 1.00 1.25 H new ATOM 0 HG21 THR A 90 -18.682 0.629 -6.145 1.00 1.02 H new ATOM 0 HG22 THR A 90 -18.452 -1.066 -5.652 1.00 1.02 H new ATOM 0 HG23 THR A 90 -17.288 0.177 -5.136 1.00 1.02 H new ATOM 280 N VAL A 91 -16.288 -3.453 -5.554 1.00 0.65 N ATOM 281 CA VAL A 91 -16.856 -4.716 -5.105 1.00 0.77 C ATOM 282 C VAL A 91 -17.165 -4.642 -3.612 1.00 0.55 C ATOM 283 O VAL A 91 -16.506 -3.907 -2.881 1.00 0.46 O ATOM 284 CB VAL A 91 -15.885 -5.887 -5.396 1.00 1.02 C ATOM 285 CG1 VAL A 91 -14.558 -5.685 -4.678 1.00 1.43 C ATOM 286 CG2 VAL A 91 -16.500 -7.228 -5.017 1.00 1.51 C ATOM 0 H VAL A 91 -15.511 -3.118 -4.984 1.00 0.65 H new ATOM 0 HA VAL A 91 -17.781 -4.898 -5.652 1.00 0.77 H new ATOM 0 HB VAL A 91 -15.697 -5.897 -6.470 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -13.894 -6.521 -4.899 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -14.098 -4.757 -5.017 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -14.730 -5.633 -3.603 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -15.792 -8.028 -5.234 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -16.737 -7.232 -3.953 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -17.412 -7.385 -5.592 1.00 1.51 H new ATOM 296 N CYS A 92 -18.170 -5.370 -3.154 1.00 0.79 N ATOM 297 CA CYS A 92 -18.447 -5.423 -1.733 1.00 0.64 C ATOM 298 C CYS A 92 -17.765 -6.635 -1.131 1.00 0.62 C ATOM 299 O CYS A 92 -18.032 -7.771 -1.524 1.00 1.20 O ATOM 300 CB CYS A 92 -19.954 -5.500 -1.492 1.00 1.10 C ATOM 301 SG CYS A 92 -20.773 -6.870 -2.337 1.00 1.91 S ATOM 0 H CYS A 92 -18.798 -5.924 -3.737 1.00 0.79 H new ATOM 0 HA CYS A 92 -18.064 -4.519 -1.260 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -20.135 -5.589 -0.421 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -20.410 -4.564 -1.815 1.00 1.10 H new ATOM 0 HG CYS A 92 -19.989 -7.907 -2.344 1.00 1.91 H new ATOM 307 N SER A 93 -16.860 -6.391 -0.202 1.00 0.69 N ATOM 308 CA SER A 93 -16.148 -7.466 0.456 1.00 1.02 C ATOM 309 C SER A 93 -15.654 -7.042 1.830 1.00 0.58 C ATOM 310 O SER A 93 -14.999 -6.008 1.959 1.00 0.73 O ATOM 311 CB SER A 93 -14.964 -7.917 -0.403 1.00 1.83 C ATOM 312 OG SER A 93 -15.401 -8.379 -1.673 1.00 2.58 O ATOM 0 H SER A 93 -16.601 -5.456 0.113 1.00 0.69 H new ATOM 0 HA SER A 93 -16.842 -8.297 0.584 1.00 1.02 H new ATOM 0 HB2 SER A 93 -14.269 -7.088 -0.534 1.00 1.83 H new ATOM 0 HB3 SER A 93 -14.421 -8.711 0.109 1.00 1.83 H new ATOM 0 HG SER A 93 -14.626 -8.660 -2.203 1.00 2.58 H new ATOM 318 N PRO A 94 -15.973 -7.802 2.877 1.00 0.78 N ATOM 319 CA PRO A 94 -15.253 -7.710 4.131 1.00 0.67 C ATOM 320 C PRO A 94 -13.993 -8.548 4.013 1.00 0.53 C ATOM 321 O PRO A 94 -14.055 -9.778 4.030 1.00 0.59 O ATOM 322 CB PRO A 94 -16.216 -8.318 5.161 1.00 0.93 C ATOM 323 CG PRO A 94 -17.442 -8.728 4.396 1.00 1.39 C ATOM 324 CD PRO A 94 -17.053 -8.784 2.946 1.00 1.43 C ATOM 0 HA PRO A 94 -14.959 -6.697 4.404 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -15.763 -9.175 5.659 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -16.465 -7.594 5.936 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -17.803 -9.698 4.737 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -18.251 -8.014 4.552 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -16.718 -9.779 2.653 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -17.884 -8.522 2.291 1.00 1.43 H new ATOM 332 N PHE A 95 -12.857 -7.894 3.882 1.00 0.43 N ATOM 333 CA PHE A 95 -11.650 -8.589 3.477 1.00 0.40 C ATOM 334 C PHE A 95 -10.415 -7.845 3.964 1.00 0.33 C ATOM 335 O PHE A 95 -10.454 -6.629 4.159 1.00 0.32 O ATOM 336 CB PHE A 95 -11.661 -8.693 1.944 1.00 0.46 C ATOM 337 CG PHE A 95 -10.620 -9.604 1.351 1.00 0.50 C ATOM 338 CD1 PHE A 95 -9.645 -9.101 0.506 1.00 1.26 C ATOM 339 CD2 PHE A 95 -10.628 -10.964 1.623 1.00 1.35 C ATOM 340 CE1 PHE A 95 -8.698 -9.932 -0.055 1.00 1.33 C ATOM 341 CE2 PHE A 95 -9.680 -11.801 1.064 1.00 1.36 C ATOM 342 CZ PHE A 95 -8.714 -11.283 0.224 1.00 0.68 C ATOM 0 H PHE A 95 -12.743 -6.894 4.048 1.00 0.43 H new ATOM 0 HA PHE A 95 -11.619 -9.585 3.918 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -12.645 -9.039 1.627 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.525 -7.695 1.528 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -9.626 -8.044 0.283 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -11.383 -11.373 2.278 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -7.944 -9.525 -0.713 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -9.695 -12.858 1.284 1.00 1.36 H new ATOM 0 HZ PHE A 95 -7.972 -11.934 -0.214 1.00 0.68 H new ATOM 352 N ALA A 96 -9.339 -8.586 4.200 1.00 0.37 N ATOM 353 CA ALA A 96 -8.072 -7.987 4.576 1.00 0.38 C ATOM 354 C ALA A 96 -7.343 -7.512 3.332 1.00 0.35 C ATOM 355 O ALA A 96 -7.083 -8.295 2.415 1.00 0.51 O ATOM 356 CB ALA A 96 -7.216 -8.970 5.359 1.00 0.49 C ATOM 0 H ALA A 96 -9.322 -9.604 4.137 1.00 0.37 H new ATOM 0 HA ALA A 96 -8.267 -7.131 5.222 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.272 -8.496 5.629 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -7.743 -9.270 6.265 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -7.018 -9.849 4.746 1.00 0.49 H new ATOM 362 N LEU A 97 -7.019 -6.235 3.307 1.00 0.24 N ATOM 363 CA LEU A 97 -6.454 -5.609 2.124 1.00 0.22 C ATOM 364 C LEU A 97 -4.943 -5.706 2.139 1.00 0.22 C ATOM 365 O LEU A 97 -4.326 -5.695 3.203 1.00 0.24 O ATOM 366 CB LEU A 97 -6.905 -4.149 2.038 1.00 0.23 C ATOM 367 CG LEU A 97 -8.206 -3.909 1.259 1.00 0.46 C ATOM 368 CD1 LEU A 97 -9.255 -4.960 1.587 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.750 -2.526 1.561 1.00 1.07 C ATOM 0 H LEU A 97 -7.138 -5.604 4.099 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.815 -6.137 1.241 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -7.031 -3.765 3.050 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -6.110 -3.567 1.573 1.00 0.23 H new ATOM 0 HG LEU A 97 -7.974 -3.983 0.197 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -10.162 -4.759 1.018 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -8.875 -5.948 1.326 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -9.481 -4.928 2.653 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -9.673 -2.368 1.003 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -8.953 -2.440 2.629 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -8.016 -1.775 1.269 1.00 1.07 H new ATOM 381 N PHE A 98 -4.349 -5.804 0.961 1.00 0.23 N ATOM 382 CA PHE A 98 -2.920 -5.997 0.860 1.00 0.23 C ATOM 383 C PHE A 98 -2.332 -5.275 -0.340 1.00 0.22 C ATOM 384 O PHE A 98 -3.041 -4.892 -1.270 1.00 0.25 O ATOM 385 CB PHE A 98 -2.586 -7.495 0.796 1.00 0.24 C ATOM 386 CG PHE A 98 -3.352 -8.259 -0.252 1.00 0.26 C ATOM 387 CD1 PHE A 98 -4.499 -8.959 0.088 1.00 1.26 C ATOM 388 CD2 PHE A 98 -2.924 -8.283 -1.572 1.00 1.18 C ATOM 389 CE1 PHE A 98 -5.205 -9.665 -0.865 1.00 1.31 C ATOM 390 CE2 PHE A 98 -3.629 -8.989 -2.528 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.771 -9.680 -2.173 1.00 0.40 C ATOM 0 H PHE A 98 -4.836 -5.753 0.066 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.469 -5.567 1.754 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.519 -7.609 0.604 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -2.784 -7.941 1.771 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -4.845 -8.952 1.111 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -2.031 -7.745 -1.855 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -6.097 -10.206 -0.586 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -3.287 -9.000 -3.552 1.00 1.17 H new ATOM 0 HZ PHE A 98 -5.323 -10.231 -2.920 1.00 0.40 H new ATOM 401 N ALA A 99 -1.031 -5.074 -0.278 1.00 0.20 N ATOM 402 CA ALA A 99 -0.268 -4.522 -1.376 1.00 0.19 C ATOM 403 C ALA A 99 1.050 -5.265 -1.482 1.00 0.17 C ATOM 404 O ALA A 99 1.659 -5.609 -0.470 1.00 0.19 O ATOM 405 CB ALA A 99 -0.032 -3.032 -1.188 1.00 0.21 C ATOM 0 H ALA A 99 -0.469 -5.292 0.545 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.833 -4.645 -2.300 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.544 -2.646 -2.029 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -0.990 -2.515 -1.137 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.520 -2.865 -0.263 1.00 0.21 H new ATOM 411 N VAL A 100 1.473 -5.534 -2.695 1.00 0.17 N ATOM 412 CA VAL A 100 2.684 -6.294 -2.924 1.00 0.18 C ATOM 413 C VAL A 100 3.770 -5.406 -3.517 1.00 0.19 C ATOM 414 O VAL A 100 3.585 -4.804 -4.576 1.00 0.22 O ATOM 415 CB VAL A 100 2.416 -7.484 -3.862 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.690 -8.260 -4.131 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.348 -8.397 -3.277 1.00 0.25 C ATOM 0 H VAL A 100 0.994 -5.236 -3.545 1.00 0.17 H new ATOM 0 HA VAL A 100 3.024 -6.677 -1.962 1.00 0.18 H new ATOM 0 HB VAL A 100 2.052 -7.091 -4.811 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.473 -9.096 -4.796 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.424 -7.604 -4.599 1.00 0.26 H new ATOM 0 HG13 VAL A 100 4.090 -8.639 -3.191 1.00 0.26 H new ATOM 0 HG21 VAL A 100 1.172 -9.232 -3.955 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.683 -8.777 -2.312 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.423 -7.836 -3.145 1.00 0.25 H new ATOM 427 N LEU A 101 4.896 -5.323 -2.828 1.00 0.19 N ATOM 428 CA LEU A 101 6.009 -4.506 -3.276 1.00 0.19 C ATOM 429 C LEU A 101 7.119 -5.387 -3.812 1.00 0.21 C ATOM 430 O LEU A 101 7.591 -6.301 -3.135 1.00 0.23 O ATOM 431 CB LEU A 101 6.556 -3.613 -2.156 1.00 0.19 C ATOM 432 CG LEU A 101 5.614 -2.510 -1.667 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.584 -3.065 -0.694 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.405 -1.376 -1.032 1.00 0.21 C ATOM 0 H LEU A 101 5.063 -5.815 -1.950 1.00 0.19 H new ATOM 0 HA LEU A 101 5.636 -3.857 -4.068 1.00 0.19 H new ATOM 0 HB2 LEU A 101 6.817 -4.245 -1.307 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.479 -3.149 -2.504 1.00 0.19 H new ATOM 0 HG LEU A 101 5.078 -2.113 -2.529 1.00 0.22 H new ATOM 0 HD11 LEU A 101 3.927 -2.261 -0.362 1.00 0.30 H new ATOM 0 HD12 LEU A 101 3.993 -3.835 -1.190 1.00 0.30 H new ATOM 0 HD13 LEU A 101 5.093 -3.497 0.168 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.719 -0.601 -0.690 1.00 0.21 H new ATOM 0 HD22 LEU A 101 6.972 -1.759 -0.183 1.00 0.21 H new ATOM 0 HD23 LEU A 101 7.091 -0.955 -1.767 1.00 0.21 H new ATOM 446 N GLU A 102 7.528 -5.108 -5.028 1.00 0.24 N ATOM 447 CA GLU A 102 8.568 -5.873 -5.675 1.00 0.29 C ATOM 448 C GLU A 102 9.858 -5.074 -5.693 1.00 0.28 C ATOM 449 O GLU A 102 9.850 -3.880 -6.001 1.00 0.26 O ATOM 450 CB GLU A 102 8.142 -6.220 -7.101 1.00 0.34 C ATOM 451 CG GLU A 102 9.122 -7.114 -7.837 1.00 0.41 C ATOM 452 CD GLU A 102 8.692 -7.394 -9.259 1.00 0.53 C ATOM 453 OE1 GLU A 102 7.810 -8.255 -9.462 1.00 1.32 O ATOM 454 OE2 GLU A 102 9.235 -6.756 -10.183 1.00 0.95 O ATOM 0 H GLU A 102 7.151 -4.348 -5.594 1.00 0.24 H new ATOM 0 HA GLU A 102 8.734 -6.797 -5.121 1.00 0.29 H new ATOM 0 HB2 GLU A 102 7.170 -6.712 -7.069 1.00 0.34 H new ATOM 0 HB3 GLU A 102 8.013 -5.297 -7.666 1.00 0.34 H new ATOM 0 HG2 GLU A 102 10.105 -6.643 -7.844 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.224 -8.057 -7.299 1.00 0.41 H new ATOM 461 N ASN A 103 10.960 -5.717 -5.340 1.00 0.38 N ATOM 462 CA ASN A 103 12.257 -5.076 -5.444 1.00 0.44 C ATOM 463 C ASN A 103 12.806 -5.280 -6.842 1.00 0.37 C ATOM 464 O ASN A 103 13.304 -6.350 -7.182 1.00 0.51 O ATOM 465 CB ASN A 103 13.249 -5.585 -4.379 1.00 0.68 C ATOM 466 CG ASN A 103 13.313 -7.095 -4.252 1.00 0.87 C ATOM 467 OD1 ASN A 103 14.092 -7.763 -4.931 1.00 1.76 O ATOM 468 ND2 ASN A 103 12.509 -7.638 -3.353 1.00 1.64 N ATOM 0 H ASN A 103 10.981 -6.672 -4.983 1.00 0.38 H new ATOM 0 HA ASN A 103 12.126 -4.010 -5.256 1.00 0.44 H new ATOM 0 HB2 ASN A 103 14.244 -5.210 -4.619 1.00 0.68 H new ATOM 0 HB3 ASN A 103 12.974 -5.163 -3.413 1.00 0.68 H new ATOM 0 HD21 ASN A 103 12.520 -8.647 -3.202 1.00 1.64 H new ATOM 0 HD22 ASN A 103 11.878 -7.048 -2.811 1.00 1.64 H new ATOM 475 N THR A 104 12.683 -4.254 -7.665 1.00 0.34 N ATOM 476 CA THR A 104 13.133 -4.324 -9.042 1.00 0.38 C ATOM 477 C THR A 104 14.638 -4.104 -9.138 1.00 0.50 C ATOM 478 O THR A 104 15.113 -3.192 -9.816 1.00 0.70 O ATOM 479 CB THR A 104 12.385 -3.302 -9.914 1.00 0.55 C ATOM 480 OG1 THR A 104 12.393 -2.014 -9.281 1.00 0.77 O ATOM 481 CG2 THR A 104 10.950 -3.748 -10.147 1.00 0.73 C ATOM 0 H THR A 104 12.273 -3.358 -7.401 1.00 0.34 H new ATOM 0 HA THR A 104 12.910 -5.324 -9.414 1.00 0.38 H new ATOM 0 HB THR A 104 12.893 -3.234 -10.876 1.00 0.55 H new ATOM 0 HG1 THR A 104 11.916 -1.370 -9.844 1.00 0.77 H new ATOM 0 HG21 THR A 104 10.436 -3.012 -10.766 1.00 0.73 H new ATOM 0 HG22 THR A 104 10.947 -4.714 -10.653 1.00 0.73 H new ATOM 0 HG23 THR A 104 10.437 -3.838 -9.190 1.00 0.73 H new ATOM 489 N GLY A 105 15.381 -4.938 -8.428 1.00 0.52 N ATOM 490 CA GLY A 105 16.823 -4.864 -8.455 1.00 0.72 C ATOM 491 C GLY A 105 17.384 -4.441 -7.120 1.00 0.66 C ATOM 492 O GLY A 105 18.393 -4.972 -6.657 1.00 0.80 O ATOM 0 H GLY A 105 15.004 -5.672 -7.828 1.00 0.52 H new ATOM 0 HA2 GLY A 105 17.232 -5.836 -8.731 1.00 0.72 H new ATOM 0 HA3 GLY A 105 17.137 -4.157 -9.223 1.00 0.72 H new ATOM 496 N GLU A 106 16.702 -3.504 -6.493 1.00 0.60 N ATOM 497 CA GLU A 106 17.147 -2.940 -5.234 1.00 0.56 C ATOM 498 C GLU A 106 16.640 -3.775 -4.066 1.00 0.65 C ATOM 499 O GLU A 106 15.504 -3.620 -3.620 1.00 1.05 O ATOM 500 CB GLU A 106 16.659 -1.501 -5.120 1.00 0.68 C ATOM 501 CG GLU A 106 17.163 -0.606 -6.241 1.00 1.25 C ATOM 502 CD GLU A 106 18.656 -0.369 -6.183 1.00 1.91 C ATOM 503 OE1 GLU A 106 19.071 0.664 -5.617 1.00 2.54 O ATOM 504 OE2 GLU A 106 19.421 -1.197 -6.723 1.00 2.47 O ATOM 0 H GLU A 106 15.826 -3.113 -6.840 1.00 0.60 H new ATOM 0 HA GLU A 106 18.237 -2.948 -5.204 1.00 0.56 H new ATOM 0 HB2 GLU A 106 15.569 -1.493 -5.120 1.00 0.68 H new ATOM 0 HB3 GLU A 106 16.981 -1.090 -4.163 1.00 0.68 H new ATOM 0 HG2 GLU A 106 16.909 -1.057 -7.200 1.00 1.25 H new ATOM 0 HG3 GLU A 106 16.646 0.353 -6.193 1.00 1.25 H new ATOM 511 N LYS A 107 17.499 -4.660 -3.591 1.00 0.61 N ATOM 512 CA LYS A 107 17.160 -5.592 -2.526 1.00 0.69 C ATOM 513 C LYS A 107 16.947 -4.874 -1.195 1.00 0.66 C ATOM 514 O LYS A 107 17.690 -3.956 -0.837 1.00 0.76 O ATOM 515 CB LYS A 107 18.278 -6.626 -2.359 1.00 0.86 C ATOM 516 CG LYS A 107 18.734 -7.286 -3.655 1.00 1.37 C ATOM 517 CD LYS A 107 17.619 -8.075 -4.320 1.00 1.80 C ATOM 518 CE LYS A 107 18.127 -8.838 -5.536 1.00 2.66 C ATOM 519 NZ LYS A 107 18.558 -7.930 -6.635 1.00 3.32 N ATOM 0 H LYS A 107 18.455 -4.754 -3.933 1.00 0.61 H new ATOM 0 HA LYS A 107 16.229 -6.085 -2.807 1.00 0.69 H new ATOM 0 HB2 LYS A 107 19.136 -6.141 -1.893 1.00 0.86 H new ATOM 0 HB3 LYS A 107 17.938 -7.401 -1.673 1.00 0.86 H new ATOM 0 HG2 LYS A 107 19.096 -6.521 -4.342 1.00 1.37 H new ATOM 0 HG3 LYS A 107 19.573 -7.950 -3.447 1.00 1.37 H new ATOM 0 HD2 LYS A 107 17.189 -8.775 -3.603 1.00 1.80 H new ATOM 0 HD3 LYS A 107 16.821 -7.397 -4.622 1.00 1.80 H new ATOM 0 HE2 LYS A 107 18.964 -9.471 -5.241 1.00 2.66 H new ATOM 0 HE3 LYS A 107 17.341 -9.499 -5.901 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 18.026 -8.155 -7.500 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 18.374 -6.943 -6.362 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 19.575 -8.057 -6.811 1.00 3.32 H new ATOM 533 N LEU A 108 15.934 -5.310 -0.461 1.00 0.59 N ATOM 534 CA LEU A 108 15.688 -4.807 0.881 1.00 0.57 C ATOM 535 C LEU A 108 16.677 -5.475 1.832 1.00 0.63 C ATOM 536 O LEU A 108 16.463 -6.605 2.275 1.00 0.74 O ATOM 537 CB LEU A 108 14.230 -5.109 1.285 1.00 0.60 C ATOM 538 CG LEU A 108 13.679 -4.391 2.533 1.00 0.58 C ATOM 539 CD1 LEU A 108 14.246 -4.977 3.818 1.00 0.61 C ATOM 540 CD2 LEU A 108 13.958 -2.899 2.464 1.00 0.56 C ATOM 0 H LEU A 108 15.266 -6.015 -0.775 1.00 0.59 H new ATOM 0 HA LEU A 108 15.829 -3.727 0.923 1.00 0.57 H new ATOM 0 HB2 LEU A 108 13.587 -4.859 0.441 1.00 0.60 H new ATOM 0 HB3 LEU A 108 14.140 -6.183 1.447 1.00 0.60 H new ATOM 0 HG LEU A 108 12.600 -4.546 2.546 1.00 0.58 H new ATOM 0 HD11 LEU A 108 13.833 -4.444 4.674 1.00 0.61 H new ATOM 0 HD12 LEU A 108 13.980 -6.032 3.885 1.00 0.61 H new ATOM 0 HD13 LEU A 108 15.331 -4.876 3.816 1.00 0.61 H new ATOM 0 HD21 LEU A 108 13.560 -2.413 3.355 1.00 0.56 H new ATOM 0 HD22 LEU A 108 15.034 -2.732 2.409 1.00 0.56 H new ATOM 0 HD23 LEU A 108 13.480 -2.480 1.578 1.00 0.56 H new ATOM 552 N LYS A 109 17.774 -4.790 2.125 1.00 0.62 N ATOM 553 CA LYS A 109 18.843 -5.385 2.915 1.00 0.73 C ATOM 554 C LYS A 109 19.494 -4.346 3.833 1.00 0.75 C ATOM 555 O LYS A 109 20.695 -4.391 4.097 1.00 1.15 O ATOM 556 CB LYS A 109 19.874 -6.002 1.962 1.00 0.92 C ATOM 557 CG LYS A 109 20.854 -6.966 2.620 1.00 1.17 C ATOM 558 CD LYS A 109 21.694 -7.697 1.582 1.00 1.66 C ATOM 559 CE LYS A 109 22.554 -6.740 0.770 1.00 2.07 C ATOM 560 NZ LYS A 109 23.285 -7.438 -0.320 1.00 2.72 N ATOM 0 H LYS A 109 17.947 -3.829 1.830 1.00 0.62 H new ATOM 0 HA LYS A 109 18.430 -6.163 3.557 1.00 0.73 H new ATOM 0 HB2 LYS A 109 19.345 -6.529 1.168 1.00 0.92 H new ATOM 0 HB3 LYS A 109 20.438 -5.198 1.490 1.00 0.92 H new ATOM 0 HG2 LYS A 109 21.507 -6.417 3.298 1.00 1.17 H new ATOM 0 HG3 LYS A 109 20.306 -7.690 3.222 1.00 1.17 H new ATOM 0 HD2 LYS A 109 22.334 -8.425 2.080 1.00 1.66 H new ATOM 0 HD3 LYS A 109 21.039 -8.254 0.912 1.00 1.66 H new ATOM 0 HE2 LYS A 109 21.924 -5.960 0.343 1.00 2.07 H new ATOM 0 HE3 LYS A 109 23.269 -6.247 1.429 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 23.859 -6.751 -0.849 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 23.906 -8.165 0.089 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 22.603 -7.887 -0.964 1.00 2.72 H new ATOM 574 N LYS A 110 18.695 -3.402 4.316 1.00 0.62 N ATOM 575 CA LYS A 110 19.183 -2.393 5.252 1.00 0.73 C ATOM 576 C LYS A 110 18.107 -2.021 6.269 1.00 0.77 C ATOM 577 O LYS A 110 18.145 -2.461 7.416 1.00 1.53 O ATOM 578 CB LYS A 110 19.639 -1.125 4.524 1.00 0.93 C ATOM 579 CG LYS A 110 20.947 -1.258 3.766 1.00 1.14 C ATOM 580 CD LYS A 110 21.333 0.064 3.118 1.00 1.46 C ATOM 581 CE LYS A 110 22.706 0.001 2.470 1.00 1.80 C ATOM 582 NZ LYS A 110 23.788 -0.254 3.456 1.00 1.59 N ATOM 0 H LYS A 110 17.708 -3.313 4.076 1.00 0.62 H new ATOM 0 HA LYS A 110 20.036 -2.831 5.770 1.00 0.73 H new ATOM 0 HB2 LYS A 110 18.859 -0.825 3.824 1.00 0.93 H new ATOM 0 HB3 LYS A 110 19.739 -0.321 5.253 1.00 0.93 H new ATOM 0 HG2 LYS A 110 21.736 -1.579 4.446 1.00 1.14 H new ATOM 0 HG3 LYS A 110 20.853 -2.029 3.001 1.00 1.14 H new ATOM 0 HD2 LYS A 110 20.589 0.330 2.367 1.00 1.46 H new ATOM 0 HD3 LYS A 110 21.323 0.853 3.870 1.00 1.46 H new ATOM 0 HE2 LYS A 110 22.713 -0.786 1.716 1.00 1.80 H new ATOM 0 HE3 LYS A 110 22.904 0.940 1.953 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 24.710 -0.055 3.019 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.657 0.363 4.283 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 23.755 -1.249 3.758 1.00 1.59 H new ATOM 596 N SER A 111 17.142 -1.222 5.829 1.00 0.51 N ATOM 597 CA SER A 111 16.098 -0.717 6.706 1.00 0.52 C ATOM 598 C SER A 111 14.753 -1.322 6.307 1.00 0.48 C ATOM 599 O SER A 111 14.707 -2.366 5.653 1.00 0.86 O ATOM 600 CB SER A 111 16.057 0.818 6.624 1.00 0.72 C ATOM 601 OG SER A 111 15.151 1.373 7.566 1.00 1.55 O ATOM 0 H SER A 111 17.063 -0.909 4.861 1.00 0.51 H new ATOM 0 HA SER A 111 16.310 -1.003 7.736 1.00 0.52 H new ATOM 0 HB2 SER A 111 17.055 1.218 6.801 1.00 0.72 H new ATOM 0 HB3 SER A 111 15.766 1.120 5.618 1.00 0.72 H new ATOM 0 HG SER A 111 15.241 2.349 7.570 1.00 1.55 H new ATOM 607 N LYS A 112 13.670 -0.677 6.712 1.00 0.39 N ATOM 608 CA LYS A 112 12.329 -1.166 6.431 1.00 0.32 C ATOM 609 C LYS A 112 11.475 -0.058 5.826 1.00 0.28 C ATOM 610 O LYS A 112 11.455 1.068 6.332 1.00 0.33 O ATOM 611 CB LYS A 112 11.671 -1.680 7.714 1.00 0.45 C ATOM 612 CG LYS A 112 12.482 -2.741 8.441 1.00 0.55 C ATOM 613 CD LYS A 112 11.751 -3.245 9.674 1.00 0.69 C ATOM 614 CE LYS A 112 12.553 -4.308 10.403 1.00 0.84 C ATOM 615 NZ LYS A 112 11.796 -4.891 11.542 1.00 1.53 N ATOM 0 H LYS A 112 13.695 0.195 7.241 1.00 0.39 H new ATOM 0 HA LYS A 112 12.406 -1.985 5.716 1.00 0.32 H new ATOM 0 HB2 LYS A 112 11.505 -0.839 8.387 1.00 0.45 H new ATOM 0 HB3 LYS A 112 10.691 -2.090 7.469 1.00 0.45 H new ATOM 0 HG2 LYS A 112 12.681 -3.575 7.768 1.00 0.55 H new ATOM 0 HG3 LYS A 112 13.448 -2.328 8.732 1.00 0.55 H new ATOM 0 HD2 LYS A 112 11.554 -2.411 10.348 1.00 0.69 H new ATOM 0 HD3 LYS A 112 10.784 -3.654 9.382 1.00 0.69 H new ATOM 0 HE2 LYS A 112 12.825 -5.100 9.705 1.00 0.84 H new ATOM 0 HE3 LYS A 112 13.483 -3.873 10.770 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 12.379 -5.612 12.013 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 11.558 -4.140 12.221 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 10.921 -5.329 11.189 1.00 1.53 H new ATOM 629 N TRP A 113 10.778 -0.379 4.742 1.00 0.24 N ATOM 630 CA TRP A 113 9.899 0.578 4.081 1.00 0.22 C ATOM 631 C TRP A 113 8.639 0.817 4.902 1.00 0.21 C ATOM 632 O TRP A 113 8.012 -0.129 5.385 1.00 0.25 O ATOM 633 CB TRP A 113 9.527 0.099 2.677 1.00 0.22 C ATOM 634 CG TRP A 113 10.593 0.346 1.656 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.865 -0.147 1.659 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.473 1.141 0.469 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.548 0.309 0.561 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.717 1.098 -0.185 1.00 0.25 C ATOM 639 CE3 TRP A 113 9.439 1.888 -0.104 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.956 1.771 -1.377 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.679 2.554 -1.290 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.930 2.493 -1.915 1.00 0.32 C ATOM 0 H TRP A 113 10.805 -1.298 4.301 1.00 0.24 H new ATOM 0 HA TRP A 113 10.441 1.520 3.995 1.00 0.22 H new ATOM 0 HB2 TRP A 113 9.310 -0.969 2.712 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.611 0.600 2.362 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.274 -0.801 2.415 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.520 0.094 0.337 1.00 0.25 H new ATOM 0 HE3 TRP A 113 8.471 1.943 0.372 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.920 1.724 -1.861 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.887 3.132 -1.743 1.00 0.32 H new ATOM 0 HH2 TRP A 113 11.086 3.027 -2.840 1.00 0.32 H new ATOM 653 N LYS A 114 8.288 2.085 5.063 1.00 0.20 N ATOM 654 CA LYS A 114 7.112 2.472 5.823 1.00 0.24 C ATOM 655 C LYS A 114 5.891 2.534 4.917 1.00 0.20 C ATOM 656 O LYS A 114 5.927 3.163 3.858 1.00 0.24 O ATOM 657 CB LYS A 114 7.338 3.842 6.466 1.00 0.37 C ATOM 658 CG LYS A 114 6.143 4.353 7.257 1.00 0.58 C ATOM 659 CD LYS A 114 5.947 3.579 8.550 1.00 1.04 C ATOM 660 CE LYS A 114 4.671 3.994 9.262 1.00 1.08 C ATOM 661 NZ LYS A 114 4.623 5.457 9.520 1.00 1.66 N ATOM 0 H LYS A 114 8.809 2.870 4.672 1.00 0.20 H new ATOM 0 HA LYS A 114 6.940 1.727 6.600 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.202 3.784 7.128 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.581 4.564 5.686 1.00 0.37 H new ATOM 0 HG2 LYS A 114 6.283 5.410 7.484 1.00 0.58 H new ATOM 0 HG3 LYS A 114 5.243 4.275 6.647 1.00 0.58 H new ATOM 0 HD2 LYS A 114 5.913 2.511 8.334 1.00 1.04 H new ATOM 0 HD3 LYS A 114 6.801 3.744 9.207 1.00 1.04 H new ATOM 0 HE2 LYS A 114 3.810 3.705 8.659 1.00 1.08 H new ATOM 0 HE3 LYS A 114 4.593 3.457 10.207 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 4.116 5.636 10.410 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 5.592 5.829 9.593 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 4.128 5.931 8.738 1.00 1.66 H new ATOM 675 N TRP A 115 4.816 1.880 5.331 1.00 0.17 N ATOM 676 CA TRP A 115 3.568 1.949 4.595 1.00 0.15 C ATOM 677 C TRP A 115 2.440 2.385 5.505 1.00 0.16 C ATOM 678 O TRP A 115 2.457 2.110 6.708 1.00 0.18 O ATOM 679 CB TRP A 115 3.223 0.604 3.957 1.00 0.15 C ATOM 680 CG TRP A 115 2.969 -0.501 4.940 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.889 -1.361 5.447 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.711 -0.875 5.521 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.287 -2.254 6.298 1.00 0.22 N ATOM 684 CE2 TRP A 115 1.952 -1.974 6.364 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.407 -0.389 5.412 1.00 0.18 C ATOM 686 CZ2 TRP A 115 0.942 -2.596 7.091 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.596 -1.006 6.134 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.324 -2.099 6.964 1.00 0.22 C ATOM 0 H TRP A 115 4.785 1.299 6.169 1.00 0.17 H new ATOM 0 HA TRP A 115 3.695 2.684 3.800 1.00 0.15 H new ATOM 0 HB2 TRP A 115 2.339 0.728 3.332 1.00 0.15 H new ATOM 0 HB3 TRP A 115 4.040 0.308 3.299 1.00 0.15 H new ATOM 0 HD1 TRP A 115 4.943 -1.345 5.214 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.760 -3.005 6.800 1.00 0.22 H new ATOM 0 HE3 TRP A 115 0.186 0.454 4.775 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 1.151 -3.440 7.732 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.608 -0.638 6.056 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.131 -2.559 7.515 1.00 0.22 H new ATOM 699 N GLU A 116 1.468 3.067 4.926 1.00 0.17 N ATOM 700 CA GLU A 116 0.299 3.517 5.657 1.00 0.20 C ATOM 701 C GLU A 116 -0.953 3.349 4.801 1.00 0.19 C ATOM 702 O GLU A 116 -0.982 3.765 3.642 1.00 0.25 O ATOM 703 CB GLU A 116 0.488 4.978 6.083 1.00 0.32 C ATOM 704 CG GLU A 116 1.536 5.146 7.175 1.00 0.50 C ATOM 705 CD GLU A 116 2.168 6.517 7.198 1.00 0.64 C ATOM 706 OE1 GLU A 116 3.395 6.600 7.413 1.00 1.40 O ATOM 707 OE2 GLU A 116 1.450 7.519 6.997 1.00 1.22 O ATOM 0 H GLU A 116 1.467 3.323 3.939 1.00 0.17 H new ATOM 0 HA GLU A 116 0.175 2.910 6.554 1.00 0.20 H new ATOM 0 HB2 GLU A 116 0.777 5.570 5.215 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -0.464 5.374 6.436 1.00 0.32 H new ATOM 0 HG2 GLU A 116 1.075 4.951 8.143 1.00 0.50 H new ATOM 0 HG3 GLU A 116 2.316 4.397 7.037 1.00 0.50 H new ATOM 714 N LEU A 117 -1.970 2.715 5.368 1.00 0.17 N ATOM 715 CA LEU A 117 -3.236 2.520 4.677 1.00 0.16 C ATOM 716 C LEU A 117 -4.127 3.725 4.903 1.00 0.15 C ATOM 717 O LEU A 117 -4.276 4.191 6.033 1.00 0.19 O ATOM 718 CB LEU A 117 -3.944 1.260 5.177 1.00 0.19 C ATOM 719 CG LEU A 117 -5.291 0.969 4.509 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.099 0.408 3.110 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.111 0.019 5.357 1.00 0.25 C ATOM 0 H LEU A 117 -1.942 2.325 6.310 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.033 2.402 3.612 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.286 0.405 5.022 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.100 1.351 6.252 1.00 0.19 H new ATOM 0 HG LEU A 117 -5.833 1.910 4.421 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.072 0.211 2.660 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.557 1.130 2.500 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.530 -0.520 3.165 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.065 -0.176 4.866 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -5.569 -0.918 5.481 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.291 0.467 6.334 1.00 0.25 H new ATOM 733 N HIS A 118 -4.716 4.229 3.837 1.00 0.13 N ATOM 734 CA HIS A 118 -5.503 5.445 3.915 1.00 0.14 C ATOM 735 C HIS A 118 -6.964 5.186 3.603 1.00 0.18 C ATOM 736 O HIS A 118 -7.302 4.261 2.862 1.00 0.21 O ATOM 737 CB HIS A 118 -4.949 6.495 2.953 1.00 0.18 C ATOM 738 CG HIS A 118 -3.608 7.021 3.357 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.326 8.364 3.465 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.467 6.373 3.687 1.00 0.24 C ATOM 741 CE1 HIS A 118 -2.072 8.517 3.849 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.530 7.324 3.990 1.00 0.22 N ATOM 0 H HIS A 118 -4.665 3.816 2.906 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.436 5.815 4.938 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.876 6.061 1.956 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.652 7.325 2.888 1.00 0.18 H new ATOM 0 HD2 HIS A 118 -2.322 5.303 3.708 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.574 9.460 4.019 1.00 0.45 H new ATOM 0 HE2 HIS A 118 -0.569 7.139 4.278 1.00 0.22 H new ATOM 751 N LYS A 119 -7.815 6.011 4.186 1.00 0.22 N ATOM 752 CA LYS A 119 -9.237 5.988 3.909 1.00 0.29 C ATOM 753 C LYS A 119 -9.577 7.090 2.916 1.00 0.27 C ATOM 754 O LYS A 119 -9.668 8.262 3.281 1.00 0.43 O ATOM 755 CB LYS A 119 -10.039 6.187 5.198 1.00 0.43 C ATOM 756 CG LYS A 119 -11.536 6.315 4.961 1.00 0.70 C ATOM 757 CD LYS A 119 -12.138 5.011 4.469 1.00 0.84 C ATOM 758 CE LYS A 119 -13.449 5.238 3.736 1.00 1.04 C ATOM 759 NZ LYS A 119 -14.389 6.097 4.502 1.00 1.69 N ATOM 0 H LYS A 119 -7.537 6.718 4.867 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.498 5.018 3.485 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -9.854 5.346 5.866 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -9.681 7.082 5.706 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -12.027 6.617 5.886 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -11.723 7.101 4.230 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -11.432 4.512 3.805 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -12.305 4.345 5.316 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -13.246 5.699 2.770 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -13.921 4.276 3.537 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -15.346 6.004 4.105 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -14.397 5.800 5.499 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -14.083 7.089 4.439 1.00 1.69 H new ATOM 773 N LEU A 120 -9.762 6.718 1.666 1.00 0.23 N ATOM 774 CA LEU A 120 -10.034 7.692 0.632 1.00 0.26 C ATOM 775 C LEU A 120 -11.533 7.771 0.387 1.00 0.34 C ATOM 776 O LEU A 120 -12.202 6.753 0.212 1.00 0.37 O ATOM 777 CB LEU A 120 -9.287 7.347 -0.666 1.00 0.24 C ATOM 778 CG LEU A 120 -7.750 7.339 -0.575 1.00 0.20 C ATOM 779 CD1 LEU A 120 -7.236 8.561 0.173 1.00 0.25 C ATOM 780 CD2 LEU A 120 -7.243 6.061 0.071 1.00 0.21 C ATOM 0 H LEU A 120 -9.729 5.751 1.343 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.676 8.666 0.967 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.617 6.364 -1.002 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -9.583 8.062 -1.434 1.00 0.24 H new ATOM 0 HG LEU A 120 -7.362 7.379 -1.593 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -6.148 8.527 0.221 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -7.548 9.465 -0.349 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.644 8.567 1.184 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -6.154 6.086 0.121 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.651 5.976 1.078 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.560 5.203 -0.522 1.00 0.21 H new ATOM 792 N GLU A 121 -12.060 8.982 0.402 1.00 0.46 N ATOM 793 CA GLU A 121 -13.491 9.189 0.241 1.00 0.57 C ATOM 794 C GLU A 121 -13.894 9.085 -1.226 1.00 0.58 C ATOM 795 O GLU A 121 -15.066 8.881 -1.546 1.00 0.69 O ATOM 796 CB GLU A 121 -13.900 10.540 0.826 1.00 0.70 C ATOM 797 CG GLU A 121 -13.710 10.629 2.333 1.00 0.80 C ATOM 798 CD GLU A 121 -14.548 9.615 3.091 1.00 1.63 C ATOM 799 OE1 GLU A 121 -13.994 8.598 3.559 1.00 2.36 O ATOM 800 OE2 GLU A 121 -15.771 9.833 3.227 1.00 2.22 O ATOM 0 H GLU A 121 -11.520 9.839 0.524 1.00 0.46 H new ATOM 0 HA GLU A 121 -14.017 8.405 0.786 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -13.317 11.326 0.347 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -14.947 10.729 0.588 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -12.658 10.475 2.572 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -13.970 11.633 2.669 1.00 0.80 H new ATOM 807 N ASN A 122 -12.915 9.215 -2.110 1.00 0.53 N ATOM 808 CA ASN A 122 -13.136 9.028 -3.535 1.00 0.60 C ATOM 809 C ASN A 122 -11.835 8.600 -4.191 1.00 0.62 C ATOM 810 O ASN A 122 -10.751 8.969 -3.734 1.00 1.22 O ATOM 811 CB ASN A 122 -13.670 10.309 -4.206 1.00 0.73 C ATOM 812 CG ASN A 122 -12.608 11.379 -4.398 1.00 1.03 C ATOM 813 OD1 ASN A 122 -11.900 11.394 -5.409 1.00 1.16 O ATOM 814 ND2 ASN A 122 -12.507 12.296 -3.449 1.00 1.87 N ATOM 0 H ASN A 122 -11.954 9.451 -1.862 1.00 0.53 H new ATOM 0 HA ASN A 122 -13.892 8.254 -3.664 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -14.095 10.052 -5.176 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -14.480 10.716 -3.601 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -11.826 13.050 -3.539 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -13.111 12.249 -2.628 1.00 1.87 H new ATOM 821 N ALA A 123 -11.941 7.802 -5.237 1.00 0.67 N ATOM 822 CA ALA A 123 -10.776 7.383 -5.995 1.00 0.66 C ATOM 823 C ALA A 123 -10.800 8.036 -7.368 1.00 0.71 C ATOM 824 O ALA A 123 -10.264 7.508 -8.340 1.00 0.90 O ATOM 825 CB ALA A 123 -10.737 5.868 -6.115 1.00 0.69 C ATOM 0 H ALA A 123 -12.825 7.429 -5.582 1.00 0.67 H new ATOM 0 HA ALA A 123 -9.874 7.700 -5.472 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -9.857 5.571 -6.686 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -10.690 5.425 -5.120 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -11.635 5.520 -6.625 1.00 0.69 H new ATOM 831 N ARG A 124 -11.433 9.194 -7.430 1.00 0.72 N ATOM 832 CA ARG A 124 -11.606 9.911 -8.683 1.00 0.83 C ATOM 833 C ARG A 124 -10.479 10.914 -8.870 1.00 0.75 C ATOM 834 O ARG A 124 -9.846 10.972 -9.927 1.00 0.86 O ATOM 835 CB ARG A 124 -12.966 10.614 -8.697 1.00 1.08 C ATOM 836 CG ARG A 124 -14.137 9.648 -8.622 1.00 1.37 C ATOM 837 CD ARG A 124 -15.457 10.368 -8.405 1.00 1.63 C ATOM 838 NE ARG A 124 -16.577 9.429 -8.326 1.00 2.28 N ATOM 839 CZ ARG A 124 -17.770 9.725 -7.809 1.00 2.84 C ATOM 840 NH1 ARG A 124 -17.994 10.924 -7.288 1.00 2.76 N ATOM 841 NH2 ARG A 124 -18.736 8.814 -7.802 1.00 3.84 N ATOM 0 H ARG A 124 -11.839 9.662 -6.620 1.00 0.72 H new ATOM 0 HA ARG A 124 -11.574 9.202 -9.510 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -13.019 11.306 -7.857 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -13.051 11.209 -9.606 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -14.188 9.068 -9.543 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -13.972 8.941 -7.809 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -15.406 10.953 -7.486 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -15.627 11.070 -9.221 1.00 1.63 H new ATOM 0 HE ARG A 124 -16.436 8.487 -8.690 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -17.252 11.624 -7.282 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -18.908 11.146 -6.894 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -18.566 7.887 -8.192 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -19.648 9.041 -7.406 1.00 3.84 H new ATOM 855 N LYS A 125 -10.229 11.694 -7.831 1.00 0.75 N ATOM 856 CA LYS A 125 -9.134 12.648 -7.826 1.00 0.68 C ATOM 857 C LYS A 125 -7.927 12.033 -7.133 1.00 0.55 C ATOM 858 O LYS A 125 -8.071 11.034 -6.426 1.00 0.53 O ATOM 859 CB LYS A 125 -9.559 13.940 -7.118 1.00 0.79 C ATOM 860 CG LYS A 125 -10.548 14.771 -7.915 1.00 0.93 C ATOM 861 CD LYS A 125 -10.911 16.050 -7.183 1.00 1.64 C ATOM 862 CE LYS A 125 -11.774 16.960 -8.044 1.00 1.90 C ATOM 863 NZ LYS A 125 -11.050 17.438 -9.250 1.00 2.26 N ATOM 0 H LYS A 125 -10.777 11.683 -6.971 1.00 0.75 H new ATOM 0 HA LYS A 125 -8.866 12.894 -8.854 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -10.002 13.688 -6.155 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -8.673 14.541 -6.914 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -10.120 15.015 -8.887 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -11.450 14.188 -8.101 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -11.443 15.806 -6.264 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -10.001 16.576 -6.895 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -12.673 16.424 -8.350 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -12.099 17.816 -7.453 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -11.546 18.260 -9.649 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -10.081 17.711 -8.988 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -11.015 16.677 -9.958 1.00 2.26 H new ATOM 877 N PRO A 126 -6.720 12.590 -7.352 1.00 0.51 N ATOM 878 CA PRO A 126 -5.500 12.118 -6.694 1.00 0.45 C ATOM 879 C PRO A 126 -5.698 11.937 -5.194 1.00 0.39 C ATOM 880 O PRO A 126 -6.261 12.803 -4.516 1.00 0.47 O ATOM 881 CB PRO A 126 -4.470 13.222 -6.973 1.00 0.51 C ATOM 882 CG PRO A 126 -5.236 14.342 -7.601 1.00 0.59 C ATOM 883 CD PRO A 126 -6.434 13.713 -8.251 1.00 0.60 C ATOM 0 HA PRO A 126 -5.191 11.142 -7.068 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -3.986 13.547 -6.052 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -3.684 12.865 -7.638 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -5.538 15.075 -6.853 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -4.626 14.868 -8.335 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -7.273 14.406 -8.316 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -6.218 13.378 -9.265 1.00 0.60 H new ATOM 891 N LEU A 127 -5.234 10.808 -4.687 1.00 0.32 N ATOM 892 CA LEU A 127 -5.467 10.434 -3.303 1.00 0.26 C ATOM 893 C LEU A 127 -4.689 11.336 -2.354 1.00 0.29 C ATOM 894 O LEU A 127 -3.680 11.937 -2.730 1.00 0.37 O ATOM 895 CB LEU A 127 -5.095 8.967 -3.088 1.00 0.24 C ATOM 896 CG LEU A 127 -5.714 7.987 -4.092 1.00 0.26 C ATOM 897 CD1 LEU A 127 -5.400 6.556 -3.702 1.00 0.26 C ATOM 898 CD2 LEU A 127 -7.218 8.194 -4.212 1.00 0.27 C ATOM 0 H LEU A 127 -4.689 10.129 -5.219 1.00 0.32 H new ATOM 0 HA LEU A 127 -6.527 10.561 -3.084 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -4.010 8.873 -3.133 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -5.399 8.674 -2.083 1.00 0.24 H new ATOM 0 HG LEU A 127 -5.272 8.185 -5.069 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.847 5.875 -4.426 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -4.320 6.412 -3.687 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.807 6.351 -2.712 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -7.627 7.484 -4.931 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -7.686 8.036 -3.240 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -7.420 9.210 -4.551 1.00 0.27 H new ATOM 910 N LYS A 128 -5.165 11.424 -1.123 1.00 0.29 N ATOM 911 CA LYS A 128 -4.636 12.382 -0.165 1.00 0.36 C ATOM 912 C LYS A 128 -4.050 11.705 1.070 1.00 0.26 C ATOM 913 O LYS A 128 -4.560 10.690 1.555 1.00 0.23 O ATOM 914 CB LYS A 128 -5.737 13.355 0.255 1.00 0.51 C ATOM 915 CG LYS A 128 -6.979 12.673 0.811 1.00 1.10 C ATOM 916 CD LYS A 128 -8.002 13.681 1.313 1.00 1.37 C ATOM 917 CE LYS A 128 -8.498 14.584 0.195 1.00 1.80 C ATOM 918 NZ LYS A 128 -9.451 15.615 0.688 1.00 2.27 N ATOM 0 H LYS A 128 -5.920 10.841 -0.762 1.00 0.29 H new ATOM 0 HA LYS A 128 -3.826 12.921 -0.657 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -5.340 14.036 1.008 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -6.021 13.961 -0.605 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -7.430 12.053 0.037 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -6.694 12.008 1.626 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -8.846 13.153 1.756 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -7.558 14.289 2.101 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -7.647 15.074 -0.278 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -8.984 13.979 -0.570 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -9.763 16.208 -0.107 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -10.276 15.149 1.117 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -8.981 16.210 1.400 1.00 2.27 H new ATOM 932 N ASP A 129 -2.970 12.285 1.561 1.00 0.32 N ATOM 933 CA ASP A 129 -2.340 11.852 2.798 1.00 0.39 C ATOM 934 C ASP A 129 -3.013 12.540 3.982 1.00 0.45 C ATOM 935 O ASP A 129 -3.685 13.558 3.811 1.00 0.51 O ATOM 936 CB ASP A 129 -0.844 12.192 2.773 1.00 0.59 C ATOM 937 CG ASP A 129 -0.083 11.646 3.969 1.00 1.00 C ATOM 938 OD1 ASP A 129 0.165 12.408 4.925 1.00 1.56 O ATOM 939 OD2 ASP A 129 0.274 10.451 3.955 1.00 1.88 O ATOM 0 H ASP A 129 -2.502 13.073 1.112 1.00 0.32 H new ATOM 0 HA ASP A 129 -2.452 10.773 2.899 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -0.404 11.794 1.859 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -0.725 13.275 2.739 1.00 0.59 H new ATOM 944 N GLY A 130 -2.840 11.985 5.169 1.00 0.51 N ATOM 945 CA GLY A 130 -3.422 12.577 6.359 1.00 0.62 C ATOM 946 C GLY A 130 -4.337 11.616 7.083 1.00 0.60 C ATOM 947 O GLY A 130 -4.351 11.564 8.312 1.00 0.75 O ATOM 0 H GLY A 130 -2.305 11.132 5.333 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -2.626 12.895 7.032 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -3.981 13.471 6.082 1.00 0.62 H new ATOM 951 N ASN A 131 -5.097 10.851 6.321 1.00 0.47 N ATOM 952 CA ASN A 131 -5.965 9.834 6.884 1.00 0.46 C ATOM 953 C ASN A 131 -5.260 8.485 6.893 1.00 0.40 C ATOM 954 O ASN A 131 -5.061 7.871 5.852 1.00 0.46 O ATOM 955 CB ASN A 131 -7.274 9.754 6.088 1.00 0.51 C ATOM 956 CG ASN A 131 -7.051 9.748 4.583 1.00 1.32 C ATOM 957 OD1 ASN A 131 -6.875 8.700 3.972 1.00 2.28 O ATOM 958 ND2 ASN A 131 -7.044 10.927 3.974 1.00 1.45 N ATOM 0 H ASN A 131 -5.130 10.916 5.304 1.00 0.47 H new ATOM 0 HA ASN A 131 -6.203 10.105 7.913 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -7.813 8.851 6.374 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -7.907 10.601 6.353 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -6.889 10.980 2.967 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -7.194 11.780 4.513 1.00 1.45 H new ATOM 965 N VAL A 132 -4.847 8.038 8.064 1.00 0.36 N ATOM 966 CA VAL A 132 -4.194 6.747 8.185 1.00 0.31 C ATOM 967 C VAL A 132 -5.006 5.822 9.071 1.00 0.28 C ATOM 968 O VAL A 132 -5.357 6.170 10.201 1.00 0.35 O ATOM 969 CB VAL A 132 -2.764 6.865 8.749 1.00 0.35 C ATOM 970 CG1 VAL A 132 -2.087 5.503 8.787 1.00 0.73 C ATOM 971 CG2 VAL A 132 -1.941 7.842 7.930 1.00 0.71 C ATOM 0 H VAL A 132 -4.951 8.547 8.942 1.00 0.36 H new ATOM 0 HA VAL A 132 -4.127 6.334 7.179 1.00 0.31 H new ATOM 0 HB VAL A 132 -2.833 7.245 9.768 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -1.079 5.609 9.188 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -2.661 4.829 9.422 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -2.035 5.094 7.778 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -0.936 7.909 8.346 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -1.884 7.494 6.898 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.411 8.825 7.956 1.00 0.71 H new ATOM 981 N ILE A 133 -5.300 4.647 8.546 1.00 0.23 N ATOM 982 CA ILE A 133 -6.081 3.656 9.259 1.00 0.26 C ATOM 983 C ILE A 133 -5.159 2.606 9.869 1.00 0.28 C ATOM 984 O ILE A 133 -5.216 2.329 11.065 1.00 0.38 O ATOM 985 CB ILE A 133 -7.093 2.972 8.317 1.00 0.31 C ATOM 986 CG1 ILE A 133 -7.940 4.021 7.585 1.00 0.34 C ATOM 987 CG2 ILE A 133 -7.985 2.012 9.088 1.00 0.38 C ATOM 988 CD1 ILE A 133 -8.765 4.900 8.505 1.00 0.35 C ATOM 0 H ILE A 133 -5.004 4.354 7.615 1.00 0.23 H new ATOM 0 HA ILE A 133 -6.631 4.162 10.052 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.535 2.399 7.576 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.281 4.653 6.990 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.608 3.513 6.890 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -8.691 1.541 8.403 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.371 1.245 9.560 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.534 2.560 9.854 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.335 5.615 7.911 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.451 4.280 9.082 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.103 5.438 9.184 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.283 2.057 9.037 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.337 1.035 9.461 1.00 0.30 C ATOM 1002 C GLU A 134 -1.959 1.370 8.924 1.00 0.23 C ATOM 1003 O GLU A 134 -1.844 2.107 7.947 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.755 -0.346 8.946 1.00 0.43 C ATOM 1005 CG GLU A 134 -5.083 -0.840 9.493 1.00 0.63 C ATOM 1006 CD GLU A 134 -5.087 -0.950 11.003 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -6.120 -0.633 11.626 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -4.050 -1.352 11.574 1.00 1.42 O ATOM 0 H GLU A 134 -4.209 2.308 8.051 1.00 0.25 H new ATOM 0 HA GLU A 134 -3.322 1.011 10.551 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -3.813 -0.313 7.858 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -2.979 -1.067 9.202 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -5.876 -0.161 9.180 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -5.310 -1.815 9.061 1.00 0.63 H new ATOM 1015 N LYS A 135 -0.919 0.840 9.548 1.00 0.28 N ATOM 1016 CA LYS A 135 0.442 1.081 9.085 1.00 0.25 C ATOM 1017 C LYS A 135 1.421 0.076 9.667 1.00 0.27 C ATOM 1018 O LYS A 135 1.096 -0.655 10.606 1.00 0.34 O ATOM 1019 CB LYS A 135 0.885 2.506 9.430 1.00 0.32 C ATOM 1020 CG LYS A 135 0.649 2.891 10.879 1.00 0.56 C ATOM 1021 CD LYS A 135 1.127 4.305 11.154 1.00 0.62 C ATOM 1022 CE LYS A 135 0.896 4.700 12.600 1.00 0.74 C ATOM 1023 NZ LYS A 135 1.312 6.100 12.862 1.00 1.53 N ATOM 0 H LYS A 135 -0.988 0.243 10.372 1.00 0.28 H new ATOM 0 HA LYS A 135 0.442 0.960 8.002 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.946 2.610 9.205 1.00 0.32 H new ATOM 0 HB3 LYS A 135 0.353 3.207 8.787 1.00 0.32 H new ATOM 0 HG2 LYS A 135 -0.413 2.811 11.111 1.00 0.56 H new ATOM 0 HG3 LYS A 135 1.172 2.193 11.534 1.00 0.56 H new ATOM 0 HD2 LYS A 135 2.189 4.383 10.920 1.00 0.62 H new ATOM 0 HD3 LYS A 135 0.604 5.001 10.498 1.00 0.62 H new ATOM 0 HE2 LYS A 135 -0.160 4.583 12.845 1.00 0.74 H new ATOM 0 HE3 LYS A 135 1.451 4.027 13.254 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 1.139 6.333 13.861 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 2.325 6.206 12.653 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 0.764 6.744 12.256 1.00 1.53 H new ATOM 1037 N GLY A 136 2.611 0.037 9.087 1.00 0.30 N ATOM 1038 CA GLY A 136 3.654 -0.845 9.562 1.00 0.38 C ATOM 1039 C GLY A 136 4.864 -0.808 8.656 1.00 0.34 C ATOM 1040 O GLY A 136 5.212 0.250 8.126 1.00 0.29 O ATOM 0 H GLY A 136 2.874 0.609 8.285 1.00 0.30 H new ATOM 0 HA2 GLY A 136 3.945 -0.556 10.572 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.272 -1.864 9.620 1.00 0.38 H new ATOM 1044 N PHE A 137 5.488 -1.959 8.452 1.00 0.38 N ATOM 1045 CA PHE A 137 6.663 -2.048 7.600 1.00 0.32 C ATOM 1046 C PHE A 137 6.496 -3.162 6.569 1.00 0.33 C ATOM 1047 O PHE A 137 5.801 -4.150 6.812 1.00 0.46 O ATOM 1048 CB PHE A 137 7.914 -2.283 8.446 1.00 0.42 C ATOM 1049 CG PHE A 137 8.221 -1.146 9.383 1.00 1.07 C ATOM 1050 CD1 PHE A 137 8.678 0.070 8.892 1.00 2.05 C ATOM 1051 CD2 PHE A 137 8.054 -1.288 10.753 1.00 1.81 C ATOM 1052 CE1 PHE A 137 8.958 1.118 9.747 1.00 2.86 C ATOM 1053 CE2 PHE A 137 8.335 -0.243 11.611 1.00 2.60 C ATOM 1054 CZ PHE A 137 8.786 0.961 11.108 1.00 2.93 C ATOM 0 H PHE A 137 5.199 -2.845 8.866 1.00 0.38 H new ATOM 0 HA PHE A 137 6.777 -1.104 7.067 1.00 0.32 H new ATOM 0 HB2 PHE A 137 7.786 -3.198 9.025 1.00 0.42 H new ATOM 0 HB3 PHE A 137 8.767 -2.441 7.785 1.00 0.42 H new ATOM 0 HD1 PHE A 137 8.816 0.198 7.829 1.00 2.05 H new ATOM 0 HD2 PHE A 137 7.700 -2.227 11.153 1.00 1.81 H new ATOM 0 HE1 PHE A 137 9.311 2.059 9.352 1.00 2.86 H new ATOM 0 HE2 PHE A 137 8.202 -0.368 12.676 1.00 2.60 H new ATOM 0 HZ PHE A 137 9.004 1.779 11.778 1.00 2.93 H new ATOM 1064 N VAL A 138 7.140 -2.990 5.422 1.00 0.27 N ATOM 1065 CA VAL A 138 6.971 -3.888 4.277 1.00 0.41 C ATOM 1066 C VAL A 138 7.737 -5.208 4.451 1.00 0.70 C ATOM 1067 O VAL A 138 7.673 -6.089 3.596 1.00 1.41 O ATOM 1068 CB VAL A 138 7.394 -3.187 2.957 1.00 0.53 C ATOM 1069 CG1 VAL A 138 7.111 -4.056 1.742 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.683 -1.850 2.809 1.00 0.48 C ATOM 0 H VAL A 138 7.795 -2.226 5.255 1.00 0.27 H new ATOM 0 HA VAL A 138 5.910 -4.133 4.223 1.00 0.41 H new ATOM 0 HB VAL A 138 8.470 -3.020 3.011 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.421 -3.530 0.839 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.665 -4.991 1.826 1.00 0.76 H new ATOM 0 HG13 VAL A 138 6.044 -4.271 1.689 1.00 0.76 H new ATOM 0 HG21 VAL A 138 6.992 -1.374 1.878 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.605 -2.011 2.793 1.00 0.48 H new ATOM 0 HG23 VAL A 138 6.941 -1.206 3.649 1.00 0.48 H new ATOM 1080 N SER A 139 8.473 -5.337 5.549 1.00 0.32 N ATOM 1081 CA SER A 139 9.254 -6.545 5.820 1.00 0.51 C ATOM 1082 C SER A 139 8.364 -7.792 5.970 1.00 0.39 C ATOM 1083 O SER A 139 8.043 -8.218 7.082 1.00 1.13 O ATOM 1084 CB SER A 139 10.094 -6.342 7.081 1.00 1.03 C ATOM 1085 OG SER A 139 10.930 -5.204 6.950 1.00 1.68 O ATOM 0 H SER A 139 8.547 -4.619 6.270 1.00 0.32 H new ATOM 0 HA SER A 139 9.907 -6.717 4.964 1.00 0.51 H new ATOM 0 HB2 SER A 139 9.439 -6.221 7.944 1.00 1.03 H new ATOM 0 HB3 SER A 139 10.703 -7.227 7.265 1.00 1.03 H new ATOM 0 HG SER A 139 11.868 -5.476 7.035 1.00 1.68 H new ATOM 1091 N ASN A 140 7.951 -8.338 4.834 1.00 0.51 N ATOM 1092 CA ASN A 140 7.231 -9.604 4.764 1.00 0.34 C ATOM 1093 C ASN A 140 7.620 -10.318 3.473 1.00 0.27 C ATOM 1094 O ASN A 140 7.187 -9.938 2.383 1.00 0.37 O ATOM 1095 CB ASN A 140 5.714 -9.380 4.809 1.00 0.37 C ATOM 1096 CG ASN A 140 4.912 -10.667 4.667 1.00 0.38 C ATOM 1097 OD1 ASN A 140 3.831 -10.673 4.075 1.00 0.94 O ATOM 1098 ND2 ASN A 140 5.408 -11.761 5.230 1.00 0.88 N ATOM 0 H ASN A 140 8.109 -7.909 3.922 1.00 0.51 H new ATOM 0 HA ASN A 140 7.500 -10.216 5.625 1.00 0.34 H new ATOM 0 HB2 ASN A 140 5.452 -8.899 5.751 1.00 0.37 H new ATOM 0 HB3 ASN A 140 5.431 -8.693 4.011 1.00 0.37 H new ATOM 0 HD21 ASN A 140 4.892 -12.639 5.180 1.00 0.88 H new ATOM 0 HD22 ASN A 140 6.306 -11.724 5.713 1.00 0.88 H new ATOM 1105 N GLN A 141 8.454 -11.333 3.604 1.00 0.35 N ATOM 1106 CA GLN A 141 9.023 -12.020 2.454 1.00 0.32 C ATOM 1107 C GLN A 141 8.065 -13.085 1.928 1.00 0.30 C ATOM 1108 O GLN A 141 8.065 -14.219 2.406 1.00 0.36 O ATOM 1109 CB GLN A 141 10.347 -12.677 2.855 1.00 0.39 C ATOM 1110 CG GLN A 141 11.295 -12.932 1.697 1.00 0.39 C ATOM 1111 CD GLN A 141 11.914 -11.654 1.170 1.00 0.52 C ATOM 1112 OE1 GLN A 141 12.950 -11.205 1.662 1.00 0.69 O ATOM 1113 NE2 GLN A 141 11.294 -11.061 0.164 1.00 0.63 N ATOM 0 H GLN A 141 8.756 -11.705 4.504 1.00 0.35 H new ATOM 0 HA GLN A 141 9.195 -11.289 1.664 1.00 0.32 H new ATOM 0 HB2 GLN A 141 10.848 -12.042 3.586 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.134 -13.625 3.350 1.00 0.39 H new ATOM 0 HG2 GLN A 141 12.085 -13.610 2.020 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.756 -13.431 0.892 1.00 0.39 H new ATOM 0 HE21 GLN A 141 10.438 -11.464 -0.216 1.00 0.63 H new ATOM 0 HE22 GLN A 141 11.672 -10.200 -0.232 1.00 0.63 H new ATOM 1122 N ILE A 142 7.242 -12.720 0.956 1.00 0.25 N ATOM 1123 CA ILE A 142 6.337 -13.686 0.343 1.00 0.27 C ATOM 1124 C ILE A 142 7.004 -14.373 -0.841 1.00 0.30 C ATOM 1125 O ILE A 142 6.533 -15.401 -1.329 1.00 0.37 O ATOM 1126 CB ILE A 142 5.009 -13.047 -0.115 1.00 0.27 C ATOM 1127 CG1 ILE A 142 5.251 -11.929 -1.135 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.247 -12.517 1.089 1.00 0.29 C ATOM 1129 CD1 ILE A 142 3.998 -11.497 -1.865 1.00 0.26 C ATOM 0 H ILE A 142 7.180 -11.775 0.577 1.00 0.25 H new ATOM 0 HA ILE A 142 6.104 -14.422 1.113 1.00 0.27 H new ATOM 0 HB ILE A 142 4.411 -13.815 -0.605 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.679 -11.067 -0.623 1.00 0.24 H new ATOM 0 HG13 ILE A 142 5.989 -12.266 -1.863 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.311 -12.067 0.758 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.033 -13.337 1.774 1.00 0.29 H new ATOM 0 HG23 ILE A 142 4.850 -11.766 1.599 1.00 0.29 H new ATOM 0 HD11 ILE A 142 4.243 -10.703 -2.571 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.580 -12.347 -2.405 1.00 0.26 H new ATOM 0 HD13 ILE A 142 3.266 -11.129 -1.146 1.00 0.26 H new ATOM 1141 N GLY A 143 8.097 -13.793 -1.302 1.00 0.28 N ATOM 1142 CA GLY A 143 8.871 -14.390 -2.368 1.00 0.34 C ATOM 1143 C GLY A 143 10.317 -13.985 -2.257 1.00 0.40 C ATOM 1144 O GLY A 143 10.640 -13.115 -1.454 1.00 0.53 O ATOM 0 H GLY A 143 8.467 -12.909 -0.953 1.00 0.28 H new ATOM 0 HA2 GLY A 143 8.786 -15.476 -2.323 1.00 0.34 H new ATOM 0 HA3 GLY A 143 8.473 -14.079 -3.334 1.00 0.34 H new ATOM 1148 N ASP A 144 11.182 -14.590 -3.057 1.00 0.48 N ATOM 1149 CA ASP A 144 12.617 -14.312 -2.978 1.00 0.56 C ATOM 1150 C ASP A 144 12.909 -12.851 -3.305 1.00 0.48 C ATOM 1151 O ASP A 144 13.861 -12.266 -2.788 1.00 0.56 O ATOM 1152 CB ASP A 144 13.408 -15.230 -3.918 1.00 0.70 C ATOM 1153 CG ASP A 144 13.130 -14.963 -5.385 1.00 1.63 C ATOM 1154 OD1 ASP A 144 12.185 -15.571 -5.934 1.00 2.49 O ATOM 1155 OD2 ASP A 144 13.855 -14.149 -5.996 1.00 2.30 O ATOM 0 H ASP A 144 10.922 -15.275 -3.767 1.00 0.48 H new ATOM 0 HA ASP A 144 12.934 -14.509 -1.954 1.00 0.56 H new ATOM 0 HB2 ASP A 144 14.474 -15.103 -3.728 1.00 0.70 H new ATOM 0 HB3 ASP A 144 13.165 -16.268 -3.692 1.00 0.70 H new ATOM 1160 N SER A 145 12.081 -12.265 -4.155 1.00 0.38 N ATOM 1161 CA SER A 145 12.231 -10.869 -4.528 1.00 0.35 C ATOM 1162 C SER A 145 10.883 -10.160 -4.480 1.00 0.31 C ATOM 1163 O SER A 145 10.601 -9.279 -5.293 1.00 0.36 O ATOM 1164 CB SER A 145 12.842 -10.765 -5.923 1.00 0.38 C ATOM 1165 OG SER A 145 14.070 -11.477 -5.989 1.00 1.08 O ATOM 0 H SER A 145 11.295 -12.738 -4.601 1.00 0.38 H new ATOM 0 HA SER A 145 12.899 -10.383 -3.817 1.00 0.35 H new ATOM 0 HB2 SER A 145 12.145 -11.163 -6.661 1.00 0.38 H new ATOM 0 HB3 SER A 145 13.009 -9.718 -6.175 1.00 0.38 H new ATOM 0 HG SER A 145 13.891 -12.440 -5.969 1.00 1.08 H new ATOM 1171 N LEU A 146 10.057 -10.533 -3.511 1.00 0.27 N ATOM 1172 CA LEU A 146 8.721 -9.980 -3.417 1.00 0.22 C ATOM 1173 C LEU A 146 8.316 -9.796 -1.960 1.00 0.21 C ATOM 1174 O LEU A 146 8.518 -10.690 -1.131 1.00 0.23 O ATOM 1175 CB LEU A 146 7.738 -10.904 -4.127 1.00 0.23 C ATOM 1176 CG LEU A 146 6.431 -10.256 -4.565 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.706 -9.125 -5.541 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.516 -11.293 -5.192 1.00 0.27 C ATOM 0 H LEU A 146 10.290 -11.211 -2.786 1.00 0.27 H new ATOM 0 HA LEU A 146 8.708 -9.002 -3.898 1.00 0.22 H new ATOM 0 HB2 LEU A 146 8.229 -11.322 -5.006 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.506 -11.738 -3.464 1.00 0.23 H new ATOM 0 HG LEU A 146 5.933 -9.841 -3.689 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.763 -8.670 -5.846 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.332 -8.374 -5.060 1.00 0.26 H new ATOM 0 HD13 LEU A 146 7.220 -9.518 -6.418 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.585 -10.818 -5.501 1.00 0.27 H new ATOM 0 HD22 LEU A 146 6.005 -11.732 -6.062 1.00 0.27 H new ATOM 0 HD23 LEU A 146 5.300 -12.075 -4.464 1.00 0.27 H new ATOM 1190 N TYR A 147 7.757 -8.636 -1.653 1.00 0.18 N ATOM 1191 CA TYR A 147 7.305 -8.327 -0.305 1.00 0.18 C ATOM 1192 C TYR A 147 5.821 -8.003 -0.311 1.00 0.16 C ATOM 1193 O TYR A 147 5.263 -7.645 -1.346 1.00 0.19 O ATOM 1194 CB TYR A 147 8.088 -7.149 0.273 1.00 0.19 C ATOM 1195 CG TYR A 147 9.525 -7.476 0.616 1.00 0.23 C ATOM 1196 CD1 TYR A 147 10.529 -7.368 -0.336 1.00 1.21 C ATOM 1197 CD2 TYR A 147 9.875 -7.895 1.893 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.838 -7.670 -0.027 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.183 -8.197 2.210 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.160 -8.083 1.247 1.00 0.36 C ATOM 1201 OH TYR A 147 13.464 -8.399 1.554 1.00 0.43 O ATOM 0 H TYR A 147 7.604 -7.886 -2.327 1.00 0.18 H new ATOM 0 HA TYR A 147 7.479 -9.202 0.321 1.00 0.18 H new ATOM 0 HB2 TYR A 147 8.074 -6.329 -0.445 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.582 -6.795 1.171 1.00 0.19 H new ATOM 0 HD1 TYR A 147 10.281 -7.042 -1.335 1.00 1.21 H new ATOM 0 HD2 TYR A 147 9.110 -7.986 2.650 1.00 1.10 H new ATOM 0 HE1 TYR A 147 12.607 -7.583 -0.780 1.00 1.24 H new ATOM 0 HE2 TYR A 147 11.439 -8.521 3.208 1.00 1.10 H new ATOM 0 HH TYR A 147 13.551 -9.370 1.650 1.00 0.43 H new ATOM 1211 N LYS A 148 5.187 -8.123 0.841 1.00 0.17 N ATOM 1212 CA LYS A 148 3.754 -7.900 0.942 1.00 0.18 C ATOM 1213 C LYS A 148 3.393 -7.155 2.219 1.00 0.19 C ATOM 1214 O LYS A 148 4.010 -7.347 3.265 1.00 0.28 O ATOM 1215 CB LYS A 148 3.023 -9.240 0.900 1.00 0.26 C ATOM 1216 CG LYS A 148 1.511 -9.141 1.041 1.00 0.34 C ATOM 1217 CD LYS A 148 0.872 -10.515 0.980 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.610 -10.466 1.312 1.00 0.62 C ATOM 1219 NZ LYS A 148 -1.254 -11.795 1.156 1.00 0.84 N ATOM 0 H LYS A 148 5.640 -8.373 1.720 1.00 0.17 H new ATOM 0 HA LYS A 148 3.447 -7.284 0.097 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.255 -9.736 -0.042 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.408 -9.875 1.698 1.00 0.26 H new ATOM 0 HG2 LYS A 148 1.260 -8.660 1.987 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.108 -8.512 0.247 1.00 0.34 H new ATOM 0 HD2 LYS A 148 1.007 -10.934 -0.017 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.378 -11.182 1.678 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -0.742 -10.116 2.336 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -1.104 -9.744 0.662 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -2.264 -11.721 1.391 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -1.150 -12.118 0.173 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.799 -12.478 1.794 1.00 0.84 H new ATOM 1233 N ILE A 149 2.392 -6.298 2.113 1.00 0.15 N ATOM 1234 CA ILE A 149 1.844 -5.594 3.256 1.00 0.18 C ATOM 1235 C ILE A 149 0.337 -5.771 3.286 1.00 0.22 C ATOM 1236 O ILE A 149 -0.309 -5.723 2.243 1.00 0.35 O ATOM 1237 CB ILE A 149 2.195 -4.096 3.215 1.00 0.18 C ATOM 1238 CG1 ILE A 149 1.798 -3.474 1.871 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.678 -3.916 3.462 1.00 0.19 C ATOM 1240 CD1 ILE A 149 2.086 -1.994 1.774 1.00 0.20 C ATOM 0 H ILE A 149 1.936 -6.071 1.229 1.00 0.15 H new ATOM 0 HA ILE A 149 2.284 -6.016 4.160 1.00 0.18 H new ATOM 0 HB ILE A 149 1.634 -3.585 3.997 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.329 -3.991 1.071 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.733 -3.639 1.706 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.926 -2.855 3.433 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.936 -4.322 4.440 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.242 -4.441 2.691 1.00 0.19 H new ATOM 0 HD11 ILE A 149 1.778 -1.627 0.795 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.534 -1.464 2.550 1.00 0.20 H new ATOM 0 HD13 ILE A 149 3.154 -1.822 1.906 1.00 0.20 H new ATOM 1252 N GLU A 150 -0.221 -5.994 4.464 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.639 -6.295 4.576 1.00 0.27 C ATOM 1254 C GLU A 150 -2.231 -5.798 5.888 1.00 0.24 C ATOM 1255 O GLU A 150 -1.513 -5.520 6.850 1.00 0.31 O ATOM 1256 CB GLU A 150 -1.876 -7.804 4.398 1.00 0.40 C ATOM 1257 CG GLU A 150 -0.858 -8.706 5.089 1.00 1.08 C ATOM 1258 CD GLU A 150 -1.013 -8.759 6.592 1.00 1.55 C ATOM 1259 OE1 GLU A 150 -1.956 -9.424 7.070 1.00 2.03 O ATOM 1260 OE2 GLU A 150 -0.176 -8.160 7.301 1.00 2.30 O ATOM 0 H GLU A 150 0.282 -5.973 5.351 1.00 0.24 H new ATOM 0 HA GLU A 150 -2.155 -5.761 3.778 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -2.869 -8.047 4.776 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -1.876 -8.033 3.332 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -0.949 -9.715 4.688 1.00 1.08 H new ATOM 0 HG3 GLU A 150 0.146 -8.356 4.848 1.00 1.08 H new ATOM 1267 N THR A 151 -3.548 -5.658 5.897 1.00 0.21 N ATOM 1268 CA THR A 151 -4.270 -5.217 7.073 1.00 0.23 C ATOM 1269 C THR A 151 -4.555 -6.396 7.997 1.00 0.24 C ATOM 1270 O THR A 151 -4.929 -7.483 7.550 1.00 0.27 O ATOM 1271 CB THR A 151 -5.594 -4.525 6.678 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.453 -5.436 5.979 1.00 0.25 O ATOM 1273 CG2 THR A 151 -5.324 -3.319 5.795 1.00 0.29 C ATOM 0 H THR A 151 -4.142 -5.847 5.090 1.00 0.21 H new ATOM 0 HA THR A 151 -3.646 -4.496 7.601 1.00 0.23 H new ATOM 0 HB THR A 151 -6.085 -4.199 7.595 1.00 0.25 H new ATOM 0 HG1 THR A 151 -7.150 -5.760 6.587 1.00 0.25 H new ATOM 0 HG21 THR A 151 -6.268 -2.845 5.527 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.700 -2.606 6.334 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.809 -3.639 4.889 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.373 -6.168 9.293 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.516 -7.216 10.299 1.00 0.38 C ATOM 1283 C LYS A 152 -5.969 -7.672 10.426 1.00 0.39 C ATOM 1284 O LYS A 152 -6.247 -8.765 10.921 1.00 0.51 O ATOM 1285 CB LYS A 152 -3.999 -6.708 11.651 1.00 0.48 C ATOM 1286 CG LYS A 152 -3.946 -7.769 12.739 1.00 0.80 C ATOM 1287 CD LYS A 152 -3.368 -7.211 14.029 1.00 1.02 C ATOM 1288 CE LYS A 152 -3.266 -8.279 15.104 1.00 1.99 C ATOM 1289 NZ LYS A 152 -2.620 -7.766 16.340 1.00 2.42 N ATOM 0 H LYS A 152 -4.123 -5.256 9.675 1.00 0.31 H new ATOM 0 HA LYS A 152 -3.925 -8.076 9.984 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -3.000 -6.296 11.513 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.637 -5.891 11.987 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -4.949 -8.153 12.924 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -3.340 -8.610 12.401 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -2.380 -6.794 13.835 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -3.995 -6.394 14.386 1.00 1.02 H new ATOM 0 HE2 LYS A 152 -4.263 -8.649 15.343 1.00 1.99 H new ATOM 0 HE3 LYS A 152 -2.695 -9.125 14.721 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 -2.571 -8.527 17.047 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 -1.659 -7.436 16.118 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 -3.178 -6.975 16.721 1.00 2.42 H new ATOM 1303 N LYS A 153 -6.889 -6.837 9.969 1.00 0.37 N ATOM 1304 CA LYS A 153 -8.309 -7.147 10.046 1.00 0.43 C ATOM 1305 C LYS A 153 -8.984 -6.907 8.702 1.00 0.40 C ATOM 1306 O LYS A 153 -8.401 -6.289 7.805 1.00 0.40 O ATOM 1307 CB LYS A 153 -8.979 -6.293 11.129 1.00 0.51 C ATOM 1308 CG LYS A 153 -8.881 -4.795 10.879 1.00 0.57 C ATOM 1309 CD LYS A 153 -9.588 -4.003 11.963 1.00 0.66 C ATOM 1310 CE LYS A 153 -9.438 -2.508 11.747 1.00 0.69 C ATOM 1311 NZ LYS A 153 -10.113 -1.723 12.813 1.00 1.29 N ATOM 0 H LYS A 153 -6.677 -5.936 9.539 1.00 0.37 H new ATOM 0 HA LYS A 153 -8.417 -8.200 10.306 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -10.030 -6.572 11.200 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.523 -6.522 12.092 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -7.833 -4.500 10.837 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -9.319 -4.557 9.909 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -10.646 -4.266 11.976 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -9.181 -4.274 12.937 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -8.379 -2.249 11.721 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -9.856 -2.238 10.777 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -9.987 -0.707 12.629 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -11.128 -1.950 12.822 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -9.697 -1.961 13.736 1.00 1.29 H new ATOM 1325 N LYS A 154 -10.205 -7.410 8.569 1.00 0.43 N ATOM 1326 CA LYS A 154 -11.007 -7.181 7.376 1.00 0.44 C ATOM 1327 C LYS A 154 -11.607 -5.786 7.435 1.00 0.53 C ATOM 1328 O LYS A 154 -12.199 -5.402 8.444 1.00 0.67 O ATOM 1329 CB LYS A 154 -12.118 -8.229 7.267 1.00 0.44 C ATOM 1330 CG LYS A 154 -11.607 -9.657 7.171 1.00 0.47 C ATOM 1331 CD LYS A 154 -12.753 -10.647 7.050 1.00 0.54 C ATOM 1332 CE LYS A 154 -12.247 -12.074 6.917 1.00 0.66 C ATOM 1333 NZ LYS A 154 -13.363 -13.047 6.783 1.00 1.41 N ATOM 0 H LYS A 154 -10.663 -7.983 9.278 1.00 0.43 H new ATOM 0 HA LYS A 154 -10.370 -7.266 6.496 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.771 -8.144 8.136 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.726 -8.011 6.389 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -10.949 -9.752 6.308 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -11.012 -9.893 8.053 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -13.397 -10.569 7.926 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -13.363 -10.394 6.183 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -11.594 -12.148 6.047 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -11.646 -12.329 7.790 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -12.977 -14.008 6.695 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -13.972 -12.995 7.624 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -13.922 -12.820 5.936 1.00 1.41 H new ATOM 1347 N MET A 155 -11.450 -5.031 6.359 1.00 0.61 N ATOM 1348 CA MET A 155 -11.849 -3.633 6.352 1.00 0.76 C ATOM 1349 C MET A 155 -13.337 -3.448 6.113 1.00 0.62 C ATOM 1350 O MET A 155 -14.052 -4.382 5.736 1.00 0.57 O ATOM 1351 CB MET A 155 -11.041 -2.851 5.320 1.00 1.01 C ATOM 1352 CG MET A 155 -9.659 -2.488 5.823 1.00 1.22 C ATOM 1353 SD MET A 155 -9.737 -1.575 7.377 1.00 0.95 S ATOM 1354 CE MET A 155 -8.006 -1.497 7.809 1.00 0.80 C ATOM 0 H MET A 155 -11.050 -5.362 5.481 1.00 0.61 H new ATOM 0 HA MET A 155 -11.638 -3.240 7.347 1.00 0.76 H new ATOM 0 HB2 MET A 155 -10.949 -3.443 4.410 1.00 1.01 H new ATOM 0 HB3 MET A 155 -11.579 -1.941 5.055 1.00 1.01 H new ATOM 0 HG2 MET A 155 -9.072 -3.396 5.963 1.00 1.22 H new ATOM 0 HG3 MET A 155 -9.144 -1.888 5.073 1.00 1.22 H new ATOM 0 HE1 MET A 155 -7.864 -1.891 8.815 1.00 0.80 H new ATOM 0 HE2 MET A 155 -7.427 -2.091 7.102 1.00 0.80 H new ATOM 0 HE3 MET A 155 -7.668 -0.461 7.774 1.00 0.80 H new ATOM 1364 N LYS A 156 -13.779 -2.223 6.350 1.00 0.65 N ATOM 1365 CA LYS A 156 -15.180 -1.850 6.258 1.00 0.59 C ATOM 1366 C LYS A 156 -15.469 -1.259 4.881 1.00 0.44 C ATOM 1367 O LYS A 156 -14.539 -0.946 4.142 1.00 0.42 O ATOM 1368 CB LYS A 156 -15.492 -0.822 7.353 1.00 0.72 C ATOM 1369 CG LYS A 156 -15.262 -1.349 8.761 1.00 1.28 C ATOM 1370 CD LYS A 156 -15.376 -0.251 9.809 1.00 1.79 C ATOM 1371 CE LYS A 156 -14.288 0.801 9.641 1.00 2.54 C ATOM 1372 NZ LYS A 156 -14.281 1.780 10.760 1.00 3.40 N ATOM 0 H LYS A 156 -13.167 -1.451 6.615 1.00 0.65 H new ATOM 0 HA LYS A 156 -15.808 -2.730 6.396 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -14.873 0.062 7.198 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -16.530 -0.504 7.257 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -15.988 -2.133 8.977 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -14.274 -1.805 8.820 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -16.355 0.223 9.735 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -15.308 -0.689 10.805 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -13.316 0.311 9.582 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -14.436 1.329 8.699 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -13.526 2.478 10.606 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -15.199 2.267 10.801 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -14.113 1.281 11.657 1.00 3.40 H new ATOM 1386 N PRO A 157 -16.753 -1.126 4.503 1.00 0.46 N ATOM 1387 CA PRO A 157 -17.139 -0.481 3.248 1.00 0.41 C ATOM 1388 C PRO A 157 -16.499 0.895 3.079 1.00 0.37 C ATOM 1389 O PRO A 157 -16.702 1.796 3.896 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.667 -0.350 3.344 1.00 0.52 C ATOM 1391 CG PRO A 157 -19.016 -0.706 4.751 1.00 0.63 C ATOM 1392 CD PRO A 157 -17.925 -1.616 5.235 1.00 0.63 C ATOM 0 HA PRO A 157 -16.808 -1.061 2.387 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.989 0.664 3.105 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -19.162 -1.016 2.637 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -19.083 0.186 5.373 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -19.986 -1.201 4.798 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -17.788 -1.546 6.314 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -18.138 -2.661 5.008 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.721 1.040 2.020 1.00 0.32 N ATOM 1401 CA GLY A 158 -15.065 2.289 1.734 1.00 0.33 C ATOM 1402 C GLY A 158 -13.952 2.116 0.728 1.00 0.27 C ATOM 1403 O GLY A 158 -13.686 1.003 0.272 1.00 0.27 O ATOM 0 H GLY A 158 -15.532 0.299 1.345 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.794 3.004 1.352 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.661 2.708 2.656 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.307 3.211 0.372 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.194 3.172 -0.557 1.00 0.26 C ATOM 1409 C ILE A 159 -10.890 3.263 0.216 1.00 0.21 C ATOM 1410 O ILE A 159 -10.703 4.169 1.028 1.00 0.24 O ATOM 1411 CB ILE A 159 -12.271 4.322 -1.581 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.625 4.298 -2.295 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -11.128 4.222 -2.584 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.858 5.484 -3.199 1.00 0.44 C ATOM 0 H ILE A 159 -13.537 4.144 0.715 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.241 2.231 -1.105 1.00 0.26 H new ATOM 0 HB ILE A 159 -12.174 5.271 -1.053 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.698 3.384 -2.884 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.418 4.261 -1.548 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -11.199 5.042 -3.299 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -10.176 4.281 -2.057 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -11.191 3.272 -3.114 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.837 5.396 -3.669 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.818 6.402 -2.613 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -13.087 5.512 -3.969 1.00 0.44 H new ATOM 1426 N TYR A 160 -10.003 2.317 -0.020 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.745 2.277 0.702 1.00 0.17 C ATOM 1428 C TYR A 160 -7.584 2.148 -0.267 1.00 0.16 C ATOM 1429 O TYR A 160 -7.735 1.616 -1.366 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.726 1.107 1.694 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.796 1.179 2.770 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -9.548 1.801 3.989 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -11.051 0.616 2.567 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -10.521 1.859 4.972 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -12.026 0.674 3.544 1.00 1.24 C ATOM 1436 CZ TYR A 160 -11.758 1.294 4.743 1.00 0.35 C ATOM 1437 OH TYR A 160 -12.728 1.349 5.721 1.00 0.43 O ATOM 0 H TYR A 160 -10.128 1.569 -0.702 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.643 3.209 1.258 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -8.846 0.176 1.141 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.748 1.069 2.173 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -8.581 2.246 4.172 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -11.267 0.125 1.630 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -10.312 2.344 5.914 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -12.996 0.234 3.367 1.00 1.24 H new ATOM 0 HH TYR A 160 -13.541 0.906 5.401 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.432 2.649 0.144 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.221 2.547 -0.647 1.00 0.14 C ATOM 1449 C ALA A 161 -4.004 2.571 0.262 1.00 0.14 C ATOM 1450 O ALA A 161 -4.052 3.129 1.362 1.00 0.14 O ATOM 1451 CB ALA A 161 -5.145 3.678 -1.659 1.00 0.14 C ATOM 0 H ALA A 161 -6.311 3.136 1.032 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.239 1.602 -1.191 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.229 3.583 -2.242 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -6.006 3.629 -2.325 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -5.145 4.635 -1.136 1.00 0.14 H new ATOM 1457 N PHE A 162 -2.926 1.960 -0.191 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.691 1.927 0.574 1.00 0.15 C ATOM 1459 C PHE A 162 -0.737 2.993 0.067 1.00 0.15 C ATOM 1460 O PHE A 162 -0.471 3.075 -1.131 1.00 0.15 O ATOM 1461 CB PHE A 162 -1.018 0.554 0.477 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.782 -0.558 1.146 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -2.723 -1.296 0.445 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -1.549 -0.870 2.476 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -3.414 -2.322 1.058 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -2.240 -1.895 3.093 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.173 -2.622 2.383 1.00 0.24 C ATOM 0 H PHE A 162 -2.879 1.478 -1.088 1.00 0.14 H new ATOM 0 HA PHE A 162 -1.937 2.120 1.618 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -0.880 0.303 -0.575 1.00 0.17 H new ATOM 0 HB3 PHE A 162 -0.025 0.616 0.922 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -2.918 -1.066 -0.592 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -0.819 -0.305 3.037 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -4.144 -2.890 0.500 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -2.050 -2.127 4.131 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.714 -3.424 2.863 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.236 3.811 0.975 1.00 0.16 N ATOM 1478 CA LYS A 163 0.714 4.847 0.618 1.00 0.18 C ATOM 1479 C LYS A 163 2.083 4.516 1.184 1.00 0.20 C ATOM 1480 O LYS A 163 2.322 4.657 2.384 1.00 0.23 O ATOM 1481 CB LYS A 163 0.252 6.219 1.128 1.00 0.23 C ATOM 1482 CG LYS A 163 1.255 7.340 0.864 1.00 0.31 C ATOM 1483 CD LYS A 163 0.647 8.711 1.138 1.00 0.45 C ATOM 1484 CE LYS A 163 1.711 9.797 1.228 1.00 0.74 C ATOM 1485 NZ LYS A 163 2.528 9.673 2.464 1.00 1.28 N ATOM 0 H LYS A 163 -0.472 3.777 1.967 1.00 0.16 H new ATOM 0 HA LYS A 163 0.776 4.891 -0.469 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.696 6.473 0.654 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.066 6.155 2.200 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.134 7.199 1.493 1.00 0.31 H new ATOM 0 HG3 LYS A 163 1.593 7.291 -0.171 1.00 0.31 H new ATOM 0 HD2 LYS A 163 -0.059 8.960 0.346 1.00 0.45 H new ATOM 0 HD3 LYS A 163 0.082 8.678 2.070 1.00 0.45 H new ATOM 0 HE2 LYS A 163 2.362 9.740 0.356 1.00 0.74 H new ATOM 0 HE3 LYS A 163 1.233 10.776 1.206 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 3.159 10.495 2.547 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 1.900 9.633 3.292 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 3.097 8.803 2.419 1.00 1.28 H new ATOM 1499 N VAL A 164 2.967 4.050 0.321 1.00 0.22 N ATOM 1500 CA VAL A 164 4.341 3.794 0.709 1.00 0.26 C ATOM 1501 C VAL A 164 5.210 4.904 0.139 1.00 0.33 C ATOM 1502 O VAL A 164 4.892 5.466 -0.911 1.00 0.34 O ATOM 1503 CB VAL A 164 4.839 2.409 0.214 1.00 0.28 C ATOM 1504 CG1 VAL A 164 3.807 1.333 0.510 1.00 0.27 C ATOM 1505 CG2 VAL A 164 5.191 2.425 -1.267 1.00 0.29 C ATOM 0 H VAL A 164 2.757 3.841 -0.655 1.00 0.22 H new ATOM 0 HA VAL A 164 4.403 3.778 1.797 1.00 0.26 H new ATOM 0 HB VAL A 164 5.753 2.178 0.761 1.00 0.28 H new ATOM 0 HG11 VAL A 164 4.174 0.370 0.156 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.633 1.282 1.585 1.00 0.27 H new ATOM 0 HG13 VAL A 164 2.873 1.575 0.002 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.535 1.436 -1.570 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.309 2.697 -1.848 1.00 0.29 H new ATOM 0 HG23 VAL A 164 5.982 3.154 -1.445 1.00 0.29 H new ATOM 1515 N TYR A 165 6.266 5.268 0.839 1.00 0.45 N ATOM 1516 CA TYR A 165 7.157 6.292 0.330 1.00 0.57 C ATOM 1517 C TYR A 165 8.615 5.882 0.464 1.00 0.70 C ATOM 1518 O TYR A 165 9.208 5.401 -0.497 1.00 1.67 O ATOM 1519 CB TYR A 165 6.884 7.668 0.969 1.00 0.62 C ATOM 1520 CG TYR A 165 6.527 7.660 2.447 1.00 0.63 C ATOM 1521 CD1 TYR A 165 5.217 7.446 2.865 1.00 1.30 C ATOM 1522 CD2 TYR A 165 7.491 7.900 3.419 1.00 1.38 C ATOM 1523 CE1 TYR A 165 4.881 7.473 4.207 1.00 1.31 C ATOM 1524 CE2 TYR A 165 7.164 7.921 4.761 1.00 1.45 C ATOM 1525 CZ TYR A 165 5.858 7.710 5.149 1.00 0.79 C ATOM 1526 OH TYR A 165 5.527 7.749 6.484 1.00 0.93 O ATOM 0 H TYR A 165 6.525 4.879 1.745 1.00 0.45 H new ATOM 0 HA TYR A 165 6.948 6.396 -0.735 1.00 0.57 H new ATOM 0 HB2 TYR A 165 7.768 8.291 0.833 1.00 0.62 H new ATOM 0 HB3 TYR A 165 6.071 8.145 0.422 1.00 0.62 H new ATOM 0 HD1 TYR A 165 4.450 7.256 2.129 1.00 1.30 H new ATOM 0 HD2 TYR A 165 8.514 8.073 3.120 1.00 1.38 H new ATOM 0 HE1 TYR A 165 3.859 7.309 4.514 1.00 1.31 H new ATOM 0 HE2 TYR A 165 7.928 8.102 5.503 1.00 1.45 H new ATOM 0 HH TYR A 165 4.575 7.544 6.591 1.00 0.93 H new ATOM 1536 N LYS A 166 9.193 6.047 1.640 1.00 0.48 N ATOM 1537 CA LYS A 166 10.599 5.733 1.835 1.00 0.49 C ATOM 1538 C LYS A 166 10.785 4.921 3.113 1.00 0.46 C ATOM 1539 O LYS A 166 9.917 4.929 3.987 1.00 0.55 O ATOM 1540 CB LYS A 166 11.439 7.021 1.907 1.00 0.57 C ATOM 1541 CG LYS A 166 11.307 7.944 0.695 1.00 0.71 C ATOM 1542 CD LYS A 166 11.584 7.232 -0.632 1.00 0.94 C ATOM 1543 CE LYS A 166 12.962 6.592 -0.690 1.00 1.35 C ATOM 1544 NZ LYS A 166 13.254 6.057 -2.048 1.00 1.53 N ATOM 0 H LYS A 166 8.715 6.395 2.471 1.00 0.48 H new ATOM 0 HA LYS A 166 10.939 5.143 0.984 1.00 0.49 H new ATOM 0 HB2 LYS A 166 11.152 7.575 2.801 1.00 0.57 H new ATOM 0 HB3 LYS A 166 12.488 6.748 2.025 1.00 0.57 H new ATOM 0 HG2 LYS A 166 10.301 8.364 0.673 1.00 0.71 H new ATOM 0 HG3 LYS A 166 11.999 8.779 0.804 1.00 0.71 H new ATOM 0 HD2 LYS A 166 10.827 6.464 -0.790 1.00 0.94 H new ATOM 0 HD3 LYS A 166 11.488 7.948 -1.448 1.00 0.94 H new ATOM 0 HE2 LYS A 166 13.719 7.327 -0.416 1.00 1.35 H new ATOM 0 HE3 LYS A 166 13.022 5.786 0.041 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 14.201 5.627 -2.055 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 12.545 5.338 -2.298 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 13.220 6.832 -2.741 1.00 1.53 H new ATOM 1558 N PRO A 167 11.907 4.190 3.230 1.00 0.44 N ATOM 1559 CA PRO A 167 12.237 3.438 4.445 1.00 0.47 C ATOM 1560 C PRO A 167 12.540 4.354 5.617 1.00 0.47 C ATOM 1561 O PRO A 167 12.987 5.490 5.435 1.00 0.50 O ATOM 1562 CB PRO A 167 13.498 2.651 4.060 1.00 0.58 C ATOM 1563 CG PRO A 167 13.558 2.710 2.573 1.00 0.60 C ATOM 1564 CD PRO A 167 12.934 4.014 2.193 1.00 0.49 C ATOM 0 HA PRO A 167 11.407 2.808 4.765 1.00 0.47 H new ATOM 0 HB2 PRO A 167 14.389 3.092 4.508 1.00 0.58 H new ATOM 0 HB3 PRO A 167 13.441 1.621 4.411 1.00 0.58 H new ATOM 0 HG2 PRO A 167 14.588 2.652 2.220 1.00 0.60 H new ATOM 0 HG3 PRO A 167 13.020 1.874 2.126 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.659 4.828 2.198 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.500 3.980 1.194 1.00 0.49 H new ATOM 1572 N ALA A 168 12.280 3.853 6.817 1.00 0.53 N ATOM 1573 CA ALA A 168 12.568 4.594 8.036 1.00 0.64 C ATOM 1574 C ALA A 168 14.052 4.943 8.102 1.00 0.71 C ATOM 1575 O ALA A 168 14.908 4.055 8.053 1.00 0.76 O ATOM 1576 CB ALA A 168 12.154 3.782 9.253 1.00 0.72 C ATOM 0 H ALA A 168 11.868 2.933 6.972 1.00 0.53 H new ATOM 0 HA ALA A 168 11.996 5.522 8.029 1.00 0.64 H new ATOM 0 HB1 ALA A 168 12.374 4.346 10.159 1.00 0.72 H new ATOM 0 HB2 ALA A 168 11.085 3.575 9.206 1.00 0.72 H new ATOM 0 HB3 ALA A 168 12.706 2.842 9.268 1.00 0.72 H new ATOM 1582 N GLY A 169 14.352 6.229 8.205 1.00 0.82 N ATOM 1583 CA GLY A 169 15.729 6.675 8.184 1.00 0.95 C ATOM 1584 C GLY A 169 16.050 7.471 6.933 1.00 0.96 C ATOM 1585 O GLY A 169 17.031 8.214 6.896 1.00 1.14 O ATOM 0 H GLY A 169 13.663 6.974 8.303 1.00 0.82 H new ATOM 0 HA2 GLY A 169 15.925 7.288 9.064 1.00 0.95 H new ATOM 0 HA3 GLY A 169 16.391 5.811 8.244 1.00 0.95 H new ATOM 1589 N TYR A 170 15.225 7.312 5.905 1.00 0.80 N ATOM 1590 CA TYR A 170 15.394 8.057 4.664 1.00 0.82 C ATOM 1591 C TYR A 170 14.364 9.181 4.593 1.00 0.86 C ATOM 1592 O TYR A 170 13.158 8.920 4.599 1.00 0.89 O ATOM 1593 CB TYR A 170 15.237 7.123 3.457 1.00 0.83 C ATOM 1594 CG TYR A 170 15.747 7.701 2.146 1.00 0.91 C ATOM 1595 CD1 TYR A 170 15.028 8.672 1.455 1.00 1.15 C ATOM 1596 CD2 TYR A 170 16.946 7.264 1.592 1.00 1.74 C ATOM 1597 CE1 TYR A 170 15.490 9.187 0.258 1.00 1.21 C ATOM 1598 CE2 TYR A 170 17.413 7.777 0.398 1.00 1.82 C ATOM 1599 CZ TYR A 170 16.681 8.735 -0.264 1.00 1.11 C ATOM 1600 OH TYR A 170 17.141 9.246 -1.457 1.00 1.24 O ATOM 0 H TYR A 170 14.431 6.672 5.907 1.00 0.80 H new ATOM 0 HA TYR A 170 16.395 8.487 4.643 1.00 0.82 H new ATOM 0 HB2 TYR A 170 15.768 6.193 3.661 1.00 0.83 H new ATOM 0 HB3 TYR A 170 14.183 6.870 3.343 1.00 0.83 H new ATOM 0 HD1 TYR A 170 14.093 9.029 1.861 1.00 1.15 H new ATOM 0 HD2 TYR A 170 17.523 6.509 2.106 1.00 1.74 H new ATOM 0 HE1 TYR A 170 14.919 9.940 -0.265 1.00 1.21 H new ATOM 0 HE2 TYR A 170 18.348 7.428 -0.014 1.00 1.82 H new ATOM 0 HH TYR A 170 17.995 8.823 -1.686 1.00 1.24 H new ATOM 1610 N PRO A 171 14.818 10.444 4.542 1.00 0.97 N ATOM 1611 CA PRO A 171 13.921 11.597 4.436 1.00 1.10 C ATOM 1612 C PRO A 171 13.190 11.624 3.098 1.00 1.07 C ATOM 1613 O PRO A 171 13.820 11.561 2.038 1.00 1.05 O ATOM 1614 CB PRO A 171 14.850 12.815 4.551 1.00 1.25 C ATOM 1615 CG PRO A 171 16.166 12.286 5.016 1.00 1.31 C ATOM 1616 CD PRO A 171 16.231 10.848 4.589 1.00 1.07 C ATOM 0 HA PRO A 171 13.146 11.572 5.203 1.00 1.10 H new ATOM 0 HB2 PRO A 171 14.950 13.321 3.591 1.00 1.25 H new ATOM 0 HB3 PRO A 171 14.452 13.545 5.256 1.00 1.25 H new ATOM 0 HG2 PRO A 171 16.987 12.856 4.581 1.00 1.31 H new ATOM 0 HG3 PRO A 171 16.256 12.372 6.099 1.00 1.31 H new ATOM 0 HD2 PRO A 171 16.713 10.738 3.618 1.00 1.07 H new ATOM 0 HD3 PRO A 171 16.799 10.244 5.297 1.00 1.07 H new ATOM 1624 N ALA A 172 11.863 11.711 3.150 1.00 1.22 N ATOM 1625 CA ALA A 172 11.049 11.754 1.942 1.00 1.31 C ATOM 1626 C ALA A 172 11.425 12.960 1.087 1.00 1.40 C ATOM 1627 O ALA A 172 11.523 14.078 1.588 1.00 1.67 O ATOM 1628 CB ALA A 172 9.570 11.793 2.297 1.00 1.60 C ATOM 0 H ALA A 172 11.329 11.753 4.018 1.00 1.22 H new ATOM 0 HA ALA A 172 11.241 10.849 1.365 1.00 1.31 H new ATOM 0 HB1 ALA A 172 8.977 11.825 1.383 1.00 1.60 H new ATOM 0 HB2 ALA A 172 9.309 10.902 2.868 1.00 1.60 H new ATOM 0 HB3 ALA A 172 9.363 12.680 2.895 1.00 1.60 H new ATOM 1634 N ASN A 173 11.627 12.727 -0.204 1.00 1.38 N ATOM 1635 CA ASN A 173 12.092 13.775 -1.108 1.00 1.53 C ATOM 1636 C ASN A 173 10.944 14.677 -1.544 1.00 1.91 C ATOM 1637 O ASN A 173 11.157 15.701 -2.191 1.00 2.60 O ATOM 1638 CB ASN A 173 12.765 13.166 -2.341 1.00 1.89 C ATOM 1639 CG ASN A 173 14.039 12.410 -2.013 1.00 2.51 C ATOM 1640 OD1 ASN A 173 14.017 11.204 -1.768 1.00 2.97 O ATOM 1641 ND2 ASN A 173 15.160 13.114 -2.008 1.00 3.18 N ATOM 0 H ASN A 173 11.476 11.822 -0.650 1.00 1.38 H new ATOM 0 HA ASN A 173 12.820 14.378 -0.564 1.00 1.53 H new ATOM 0 HB2 ASN A 173 12.065 12.490 -2.833 1.00 1.89 H new ATOM 0 HB3 ASN A 173 12.994 13.960 -3.052 1.00 1.89 H new ATOM 0 HD21 ASN A 173 16.047 12.658 -1.796 1.00 3.18 H new ATOM 0 HD22 ASN A 173 15.136 14.112 -2.216 1.00 3.18 H new ATOM 1648 N GLY A 174 9.727 14.280 -1.202 1.00 2.02 N ATOM 1649 CA GLY A 174 8.559 15.082 -1.524 1.00 2.69 C ATOM 1650 C GLY A 174 7.781 14.521 -2.694 1.00 2.26 C ATOM 1651 O GLY A 174 6.568 14.709 -2.791 1.00 2.93 O ATOM 0 H GLY A 174 9.525 13.413 -0.705 1.00 2.02 H new ATOM 0 HA2 GLY A 174 7.908 15.138 -0.651 1.00 2.69 H new ATOM 0 HA3 GLY A 174 8.873 16.100 -1.754 1.00 2.69 H new ATOM 1655 N SER A 175 8.479 13.829 -3.581 1.00 1.44 N ATOM 1656 CA SER A 175 7.850 13.176 -4.718 1.00 1.23 C ATOM 1657 C SER A 175 8.231 11.703 -4.727 1.00 0.94 C ATOM 1658 O SER A 175 8.561 11.130 -5.766 1.00 1.36 O ATOM 1659 CB SER A 175 8.286 13.850 -6.021 1.00 1.79 C ATOM 1660 OG SER A 175 8.081 15.253 -5.957 1.00 2.26 O ATOM 0 H SER A 175 9.490 13.705 -3.534 1.00 1.44 H new ATOM 0 HA SER A 175 6.767 13.264 -4.634 1.00 1.23 H new ATOM 0 HB2 SER A 175 9.339 13.640 -6.209 1.00 1.79 H new ATOM 0 HB3 SER A 175 7.724 13.434 -6.857 1.00 1.79 H new ATOM 0 HG SER A 175 8.368 15.664 -6.799 1.00 2.26 H new ATOM 1666 N THR A 176 8.196 11.105 -3.548 1.00 0.64 N ATOM 1667 CA THR A 176 8.620 9.727 -3.371 1.00 0.90 C ATOM 1668 C THR A 176 7.478 8.838 -2.892 1.00 0.80 C ATOM 1669 O THR A 176 7.700 7.707 -2.459 1.00 1.05 O ATOM 1670 CB THR A 176 9.793 9.638 -2.381 1.00 1.30 C ATOM 1671 OG1 THR A 176 9.645 10.621 -1.344 1.00 1.49 O ATOM 1672 CG2 THR A 176 11.121 9.837 -3.091 1.00 1.76 C ATOM 0 H THR A 176 7.875 11.558 -2.692 1.00 0.64 H new ATOM 0 HA THR A 176 8.945 9.368 -4.348 1.00 0.90 H new ATOM 0 HB THR A 176 9.784 8.643 -1.937 1.00 1.30 H new ATOM 0 HG1 THR A 176 10.053 10.289 -0.517 1.00 1.49 H new ATOM 0 HG21 THR A 176 11.934 9.769 -2.368 1.00 1.76 H new ATOM 0 HG22 THR A 176 11.246 9.066 -3.851 1.00 1.76 H new ATOM 0 HG23 THR A 176 11.137 10.819 -3.564 1.00 1.76 H new ATOM 1680 N PHE A 177 6.260 9.352 -2.957 1.00 0.52 N ATOM 1681 CA PHE A 177 5.105 8.608 -2.475 1.00 0.45 C ATOM 1682 C PHE A 177 4.469 7.815 -3.609 1.00 0.41 C ATOM 1683 O PHE A 177 4.345 8.307 -4.733 1.00 0.50 O ATOM 1684 CB PHE A 177 4.071 9.549 -1.835 1.00 0.49 C ATOM 1685 CG PHE A 177 3.561 10.641 -2.743 1.00 0.55 C ATOM 1686 CD1 PHE A 177 2.385 10.471 -3.459 1.00 1.37 C ATOM 1687 CD2 PHE A 177 4.249 11.841 -2.871 1.00 1.31 C ATOM 1688 CE1 PHE A 177 1.906 11.471 -4.284 1.00 1.46 C ATOM 1689 CE2 PHE A 177 3.774 12.842 -3.697 1.00 1.38 C ATOM 1690 CZ PHE A 177 2.602 12.657 -4.403 1.00 0.86 C ATOM 0 H PHE A 177 6.045 10.274 -3.336 1.00 0.52 H new ATOM 0 HA PHE A 177 5.449 7.910 -1.711 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.223 8.955 -1.493 1.00 0.49 H new ATOM 0 HB3 PHE A 177 4.516 10.008 -0.952 1.00 0.49 H new ATOM 0 HD1 PHE A 177 1.836 9.545 -3.371 1.00 1.37 H new ATOM 0 HD2 PHE A 177 5.165 11.993 -2.319 1.00 1.31 H new ATOM 0 HE1 PHE A 177 0.989 11.325 -4.835 1.00 1.46 H new ATOM 0 HE2 PHE A 177 4.320 13.769 -3.790 1.00 1.38 H new ATOM 0 HZ PHE A 177 2.230 13.440 -5.048 1.00 0.86 H new ATOM 1700 N GLU A 178 4.082 6.586 -3.317 1.00 0.34 N ATOM 1701 CA GLU A 178 3.467 5.729 -4.309 1.00 0.32 C ATOM 1702 C GLU A 178 2.144 5.195 -3.781 1.00 0.28 C ATOM 1703 O GLU A 178 2.109 4.502 -2.761 1.00 0.28 O ATOM 1704 CB GLU A 178 4.406 4.570 -4.653 1.00 0.37 C ATOM 1705 CG GLU A 178 3.952 3.745 -5.844 1.00 0.40 C ATOM 1706 CD GLU A 178 3.973 4.531 -7.140 1.00 1.20 C ATOM 1707 OE1 GLU A 178 5.044 4.604 -7.780 1.00 1.91 O ATOM 1708 OE2 GLU A 178 2.920 5.069 -7.533 1.00 1.96 O ATOM 0 H GLU A 178 4.184 6.160 -2.396 1.00 0.34 H new ATOM 0 HA GLU A 178 3.278 6.307 -5.213 1.00 0.32 H new ATOM 0 HB2 GLU A 178 5.400 4.968 -4.857 1.00 0.37 H new ATOM 0 HB3 GLU A 178 4.496 3.918 -3.784 1.00 0.37 H new ATOM 0 HG2 GLU A 178 4.596 2.871 -5.943 1.00 0.40 H new ATOM 0 HG3 GLU A 178 2.942 3.377 -5.663 1.00 0.40 H new ATOM 1715 N TRP A 179 1.059 5.538 -4.457 1.00 0.28 N ATOM 1716 CA TRP A 179 -0.256 5.061 -4.068 1.00 0.26 C ATOM 1717 C TRP A 179 -0.555 3.718 -4.710 1.00 0.27 C ATOM 1718 O TRP A 179 -0.433 3.559 -5.926 1.00 0.38 O ATOM 1719 CB TRP A 179 -1.351 6.051 -4.474 1.00 0.27 C ATOM 1720 CG TRP A 179 -1.431 7.276 -3.620 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -1.031 8.538 -3.951 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.965 7.360 -2.293 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -1.297 9.401 -2.917 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.863 8.703 -1.890 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.521 6.431 -1.407 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -2.296 9.143 -0.647 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -2.951 6.870 -0.172 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.836 8.216 0.198 1.00 0.24 C ATOM 0 H TRP A 179 1.064 6.145 -5.277 1.00 0.28 H new ATOM 0 HA TRP A 179 -0.249 4.958 -2.983 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -1.183 6.355 -5.507 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -2.313 5.540 -4.445 1.00 0.27 H new ATOM 0 HD1 TRP A 179 -0.573 8.817 -4.888 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -1.103 10.402 -2.916 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.612 5.391 -1.684 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -2.209 10.180 -0.359 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.384 6.164 0.521 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -3.182 8.527 1.173 1.00 0.24 H new ATOM 1739 N SER A 180 -0.946 2.759 -3.893 1.00 0.23 N ATOM 1740 CA SER A 180 -1.435 1.491 -4.400 1.00 0.28 C ATOM 1741 C SER A 180 -2.789 1.729 -5.051 1.00 0.28 C ATOM 1742 O SER A 180 -3.495 2.668 -4.676 1.00 0.36 O ATOM 1743 CB SER A 180 -1.568 0.475 -3.262 1.00 0.33 C ATOM 1744 OG SER A 180 -1.752 -0.835 -3.759 1.00 1.06 O ATOM 0 H SER A 180 -0.935 2.833 -2.876 1.00 0.23 H new ATOM 0 HA SER A 180 -0.733 1.088 -5.130 1.00 0.28 H new ATOM 0 HB2 SER A 180 -0.675 0.507 -2.638 1.00 0.33 H new ATOM 0 HB3 SER A 180 -2.411 0.746 -2.627 1.00 0.33 H new ATOM 0 HG SER A 180 -1.305 -0.922 -4.627 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.142 0.900 -6.026 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.415 1.048 -6.719 1.00 0.38 C ATOM 1752 C GLU A 181 -5.559 0.994 -5.714 1.00 0.34 C ATOM 1753 O GLU A 181 -5.715 0.005 -4.997 1.00 0.49 O ATOM 1754 CB GLU A 181 -4.594 -0.040 -7.784 1.00 0.56 C ATOM 1755 CG GLU A 181 -3.518 -0.029 -8.861 1.00 0.74 C ATOM 1756 CD GLU A 181 -3.299 1.349 -9.453 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -2.215 1.928 -9.235 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -4.213 1.866 -10.127 1.00 1.91 O ATOM 0 H GLU A 181 -2.568 0.123 -6.353 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.422 2.015 -7.222 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -4.597 -1.015 -7.297 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -5.569 0.084 -8.256 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -2.581 -0.391 -8.437 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -3.797 -0.721 -9.655 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.357 2.068 -5.637 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.413 2.187 -4.638 1.00 0.26 C ATOM 1767 C PRO A 182 -8.526 1.170 -4.853 1.00 0.28 C ATOM 1768 O PRO A 182 -9.245 1.209 -5.858 1.00 0.32 O ATOM 1769 CB PRO A 182 -7.939 3.614 -4.818 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.533 4.018 -6.196 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.289 3.238 -6.528 1.00 0.39 C ATOM 0 HA PRO A 182 -7.040 1.993 -3.633 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.022 3.651 -4.701 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -7.515 4.286 -4.071 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -8.327 3.803 -6.912 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -7.342 5.090 -6.244 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -6.271 2.941 -7.577 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.389 3.826 -6.348 1.00 0.39 H new ATOM 1779 N MET A 183 -8.654 0.254 -3.911 1.00 0.28 N ATOM 1780 CA MET A 183 -9.727 -0.722 -3.935 1.00 0.30 C ATOM 1781 C MET A 183 -10.950 -0.152 -3.247 1.00 0.26 C ATOM 1782 O MET A 183 -10.845 0.479 -2.192 1.00 0.25 O ATOM 1783 CB MET A 183 -9.311 -2.042 -3.274 1.00 0.34 C ATOM 1784 CG MET A 183 -8.554 -1.881 -1.967 1.00 0.29 C ATOM 1785 SD MET A 183 -6.815 -1.464 -2.224 1.00 0.31 S ATOM 1786 CE MET A 183 -6.273 -1.181 -0.546 1.00 0.27 C ATOM 0 H MET A 183 -8.023 0.166 -3.114 1.00 0.28 H new ATOM 0 HA MET A 183 -9.962 -0.940 -4.977 1.00 0.30 H new ATOM 0 HB2 MET A 183 -10.204 -2.639 -3.091 1.00 0.34 H new ATOM 0 HB3 MET A 183 -8.690 -2.603 -3.972 1.00 0.34 H new ATOM 0 HG2 MET A 183 -9.027 -1.101 -1.370 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.622 -2.806 -1.395 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.340 -0.617 -0.555 1.00 0.27 H new ATOM 0 HE2 MET A 183 -7.034 -0.615 -0.009 1.00 0.27 H new ATOM 0 HE3 MET A 183 -6.114 -2.138 -0.049 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.106 -0.365 -3.847 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.335 0.192 -3.324 1.00 0.29 C ATOM 1798 C ARG A 184 -14.232 -0.922 -2.822 1.00 0.31 C ATOM 1799 O ARG A 184 -14.847 -1.638 -3.612 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.073 0.997 -4.399 1.00 0.35 C ATOM 1801 CG ARG A 184 -13.182 1.917 -5.218 1.00 1.17 C ATOM 1802 CD ARG A 184 -13.974 2.617 -6.310 1.00 1.16 C ATOM 1803 NE ARG A 184 -13.111 3.371 -7.217 1.00 1.88 N ATOM 1804 CZ ARG A 184 -13.560 4.214 -8.144 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -14.863 4.424 -8.286 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -12.706 4.841 -8.937 1.00 3.32 N ATOM 0 H ARG A 184 -12.218 -0.919 -4.696 1.00 0.28 H new ATOM 0 HA ARG A 184 -13.083 0.861 -2.501 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -14.576 0.304 -5.073 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -14.848 1.595 -3.920 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -12.723 2.659 -4.565 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -12.372 1.341 -5.665 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -14.539 1.878 -6.878 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -14.699 3.292 -5.855 1.00 1.16 H new ATOM 0 HE ARG A 184 -12.102 3.243 -7.135 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -15.527 3.938 -7.683 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -15.201 5.071 -8.998 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -11.704 4.678 -8.838 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -13.050 5.487 -9.647 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.294 -1.077 -1.513 1.00 0.28 N ATOM 1821 CA LEU A 185 -15.166 -2.071 -0.921 1.00 0.32 C ATOM 1822 C LEU A 185 -16.506 -1.419 -0.636 1.00 0.36 C ATOM 1823 O LEU A 185 -16.681 -0.768 0.381 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.567 -2.627 0.377 1.00 0.36 C ATOM 1825 CG LEU A 185 -13.098 -3.054 0.304 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.659 -3.648 1.632 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.873 -4.050 -0.824 1.00 0.74 C ATOM 0 H LEU A 185 -13.753 -0.530 -0.843 1.00 0.28 H new ATOM 0 HA LEU A 185 -15.287 -2.904 -1.613 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.667 -1.870 1.155 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -15.160 -3.486 0.690 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.496 -2.170 0.096 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -11.613 -3.948 1.568 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.776 -2.904 2.420 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -13.273 -4.519 1.862 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.822 -4.336 -0.853 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -13.485 -4.936 -0.655 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -13.151 -3.593 -1.774 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.447 -1.578 -1.537 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.720 -0.890 -1.415 1.00 0.77 C ATOM 1841 C ALA A 186 -19.859 -1.872 -1.232 1.00 1.02 C ATOM 1842 O ALA A 186 -20.197 -2.613 -2.148 1.00 1.53 O ATOM 1843 CB ALA A 186 -18.962 -0.021 -2.635 1.00 1.00 C ATOM 0 H ALA A 186 -17.360 -2.174 -2.360 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.680 -0.256 -0.529 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -19.919 0.490 -2.533 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -18.164 0.716 -2.721 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -18.977 -0.645 -3.529 1.00 1.00 H new ATOM 1849 N LYS A 187 -20.447 -1.872 -0.047 1.00 0.89 N ATOM 1850 CA LYS A 187 -21.559 -2.759 0.254 1.00 1.11 C ATOM 1851 C LYS A 187 -22.877 -2.110 -0.140 1.00 1.49 C ATOM 1852 O LYS A 187 -23.420 -1.288 0.602 1.00 1.61 O ATOM 1853 CB LYS A 187 -21.573 -3.132 1.738 1.00 1.11 C ATOM 1854 CG LYS A 187 -20.536 -4.175 2.107 1.00 1.17 C ATOM 1855 CD LYS A 187 -20.638 -4.566 3.569 1.00 1.45 C ATOM 1856 CE LYS A 187 -20.070 -5.955 3.807 1.00 1.82 C ATOM 1857 NZ LYS A 187 -20.903 -7.006 3.164 1.00 2.78 N ATOM 0 H LYS A 187 -20.171 -1.265 0.725 1.00 0.89 H new ATOM 0 HA LYS A 187 -21.431 -3.673 -0.326 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -21.402 -2.234 2.332 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -22.563 -3.505 2.002 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -20.669 -5.059 1.483 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -19.538 -3.787 1.902 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -20.101 -3.841 4.180 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -21.681 -4.538 3.884 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -19.054 -6.005 3.415 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -20.008 -6.144 4.879 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -20.755 -7.913 3.652 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -21.906 -6.739 3.225 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -20.631 -7.102 2.165 1.00 2.78 H new ATOM 1871 N CYS A 188 -23.370 -2.462 -1.315 1.00 1.82 N ATOM 1872 CA CYS A 188 -24.615 -1.912 -1.818 1.00 2.29 C ATOM 1873 C CYS A 188 -25.500 -3.029 -2.354 1.00 2.51 C ATOM 1874 O CYS A 188 -25.105 -3.764 -3.258 1.00 2.68 O ATOM 1875 CB CYS A 188 -24.331 -0.891 -2.926 1.00 2.71 C ATOM 1876 SG CYS A 188 -23.232 0.457 -2.422 1.00 3.14 S ATOM 0 H CYS A 188 -22.923 -3.131 -1.942 1.00 1.82 H new ATOM 0 HA CYS A 188 -25.134 -1.411 -1.001 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -23.888 -1.408 -3.777 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -25.276 -0.468 -3.267 1.00 2.71 H new ATOM 0 HG CYS A 188 -23.050 1.266 -3.423 1.00 3.14 H new ATOM 1882 N ASP A 189 -26.690 -3.168 -1.782 1.00 2.70 N ATOM 1883 CA ASP A 189 -27.637 -4.181 -2.242 1.00 3.08 C ATOM 1884 C ASP A 189 -28.355 -3.700 -3.493 1.00 3.61 C ATOM 1885 O ASP A 189 -29.453 -3.143 -3.423 1.00 3.87 O ATOM 1886 CB ASP A 189 -28.664 -4.519 -1.155 1.00 3.12 C ATOM 1887 CG ASP A 189 -28.049 -5.221 0.036 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -27.665 -4.533 1.007 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -27.949 -6.462 0.012 1.00 4.05 O ATOM 0 H ASP A 189 -27.022 -2.598 -1.004 1.00 2.70 H new ATOM 0 HA ASP A 189 -27.072 -5.084 -2.472 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -29.147 -3.601 -0.820 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -29.443 -5.152 -1.581 1.00 3.12 H new ATOM 1894 N GLU A 190 -27.727 -3.916 -4.636 1.00 3.97 N ATOM 1895 CA GLU A 190 -28.280 -3.487 -5.905 1.00 4.63 C ATOM 1896 C GLU A 190 -27.715 -4.346 -7.030 1.00 5.25 C ATOM 1897 O GLU A 190 -28.401 -5.299 -7.452 1.00 5.64 O ATOM 1898 CB GLU A 190 -27.949 -2.011 -6.143 1.00 4.83 C ATOM 1899 CG GLU A 190 -28.711 -1.388 -7.298 1.00 5.57 C ATOM 1900 CD GLU A 190 -30.203 -1.362 -7.054 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -30.666 -0.504 -6.271 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -30.921 -2.197 -7.641 1.00 6.43 O ATOM 1903 OXT GLU A 190 -26.577 -4.081 -7.465 1.00 5.62 O ATOM 0 H GLU A 190 -26.827 -4.390 -4.709 1.00 3.97 H new ATOM 0 HA GLU A 190 -29.364 -3.604 -5.885 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -28.164 -1.449 -5.234 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -26.880 -1.914 -6.332 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -28.354 -0.371 -7.459 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -28.504 -1.947 -8.211 1.00 5.57 H new TER 1910 GLU A 190