USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=36 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 141 GLN : amide:sc= 0.492 K(o=0.36,f=-0.35) USER MOD Set 1.2: A 147 TYR OH : rot -90:sc= -0.134 USER MOD Set 2.1: A 112 LYS NZ :NH3+ -169:sc= -0.028 (180deg=-0.216) USER MOD Set 2.2: A 139 SER OG : rot -120:sc= 0 USER MOD Set 3.1: A 114 LYS NZ :NH3+ -172:sc= 0.919 (180deg=-0.389) USER MOD Set 3.2: A 165 TYR OH : rot -130:sc= 0.152 USER MOD Set 4.1: A 85 THR OG1 : rot 110:sc= 0.108 USER MOD Set 4.2: A 183 MET CE :methyl -172:sc= -1.32 (180deg=-1.78) USER MOD Set 5.1: A 80 HIS : no HD1:sc= 0.666 K(o=0.3,f=-4.2!) USER MOD Set 5.2: A 104 THR OG1 : rot -150:sc= -0.366 USER MOD Set 6.1: A 77 SER OG : rot -38:sc= 0.678 USER MOD Set 6.2: A 166 LYS NZ :NH3+ -161:sc= -0.522 (180deg=-1.41!) USER MOD Single : A 76 GLN : amide:sc= -3.48! C(o=-3.5!,f=-7.8!) USER MOD Single : A 82 SER OG : rot -160:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -0.914 K(o=-0.91,f=-1.8!) USER MOD Single : A 87 THR OG1 : rot -140:sc= 0.00158 USER MOD Single : A 88 LYS NZ :NH3+ -147:sc= 1.93 (180deg=1.46) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 CYS SG : rot 30:sc= 0.0749 USER MOD Single : A 93 SER OG : rot -3:sc= 0.224 USER MOD Single : A 103 ASN : amide:sc= -1.64 K(o=-1.6,f=-13!) USER MOD Single : A 107 LYS NZ :NH3+ 169:sc= -0.0104 (180deg=-0.145) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 161:sc= 1.18 (180deg=0.215) USER MOD Single : A 111 SER OG : rot 180:sc= 0.364 USER MOD Single : A 118 HIS : no HE2:sc= -4.2! C(o=-4.2!,f=-6.3!) USER MOD Single : A 119 LYS NZ :NH3+ -167:sc= -0.0195 (180deg=-0.192) USER MOD Single : A 122 ASN : amide:sc= 1.66 K(o=1.7,f=-11!) USER MOD Single : A 125 LYS NZ :NH3+ -164:sc= -0.0773 (180deg=-0.35) USER MOD Single : A 128 LYS NZ :NH3+ -160:sc= 1.28 (180deg=1.22) USER MOD Single : A 131 ASN : amide:sc= -2.37! C(o=-2.4!,f=-8.1!) USER MOD Single : A 135 LYS NZ :NH3+ 164:sc= -0.109 (180deg=-0.455) USER MOD Single : A 140 ASN : amide:sc= -0.724 K(o=-0.72,f=0) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 146:sc= 0.065 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 104:sc= 0.935 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 154:sc= -2.74! (180deg=-3.59!) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 TYR OH : rot -154:sc= 1.11 USER MOD Single : A 163 LYS NZ :NH3+ -161:sc= 1.56 (180deg=1.09) USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 ASN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 175 SER OG : rot 5:sc= 0.9 USER MOD Single : A 176 THR OG1 : rot 180:sc= 0 USER MOD Single : A 180 SER OG : rot 140:sc= 0.976 USER MOD Single : A 187 LYS NZ :NH3+ -151:sc=-0.00549 (180deg=-0.164) USER MOD Single : A 188 CYS SG : rot 180:sc= -0.133 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 26.167 5.485 -2.594 1.00 3.12 N ATOM 2 CA ARG A 73 25.378 4.304 -3.007 1.00 2.69 C ATOM 3 C ARG A 73 24.156 4.152 -2.116 1.00 2.08 C ATOM 4 O ARG A 73 24.068 4.779 -1.060 1.00 2.31 O ATOM 5 CB ARG A 73 26.227 3.028 -2.933 1.00 3.05 C ATOM 6 CG ARG A 73 26.775 2.730 -1.546 1.00 3.69 C ATOM 7 CD ARG A 73 27.344 1.321 -1.452 1.00 4.24 C ATOM 8 NE ARG A 73 28.441 1.093 -2.392 1.00 4.97 N ATOM 9 CZ ARG A 73 29.201 -0.005 -2.394 1.00 5.85 C ATOM 10 NH1 ARG A 73 28.995 -0.961 -1.492 1.00 6.18 N ATOM 11 NH2 ARG A 73 30.166 -0.145 -3.296 1.00 6.67 N ATOM 0 HA ARG A 73 25.059 4.454 -4.038 1.00 2.69 H new ATOM 0 HB2 ARG A 73 25.624 2.183 -3.264 1.00 3.05 H new ATOM 0 HB3 ARG A 73 27.060 3.117 -3.630 1.00 3.05 H new ATOM 0 HG2 ARG A 73 27.553 3.453 -1.300 1.00 3.69 H new ATOM 0 HG3 ARG A 73 25.982 2.851 -0.808 1.00 3.69 H new ATOM 0 HD2 ARG A 73 27.698 1.143 -0.436 1.00 4.24 H new ATOM 0 HD3 ARG A 73 26.550 0.599 -1.644 1.00 4.24 H new ATOM 0 HE ARG A 73 28.637 1.814 -3.086 1.00 4.97 H new ATOM 0 HH11 ARG A 73 28.256 -0.856 -0.797 1.00 6.18 H new ATOM 0 HH12 ARG A 73 29.577 -1.799 -1.495 1.00 6.18 H new ATOM 0 HH21 ARG A 73 30.327 0.587 -3.988 1.00 6.67 H new ATOM 0 HH22 ARG A 73 30.746 -0.984 -3.296 1.00 6.67 H new ATOM 25 N TRP A 74 23.219 3.323 -2.546 1.00 1.61 N ATOM 26 CA TRP A 74 22.054 2.992 -1.741 1.00 1.14 C ATOM 27 C TRP A 74 21.493 1.654 -2.206 1.00 0.96 C ATOM 28 O TRP A 74 21.692 1.257 -3.355 1.00 1.19 O ATOM 29 CB TRP A 74 20.988 4.087 -1.832 1.00 1.25 C ATOM 30 CG TRP A 74 19.877 3.898 -0.847 1.00 1.15 C ATOM 31 CD1 TRP A 74 18.665 3.329 -1.085 1.00 1.14 C ATOM 32 CD2 TRP A 74 19.887 4.259 0.538 1.00 1.26 C ATOM 33 NE1 TRP A 74 17.911 3.324 0.063 1.00 1.26 N ATOM 34 CE2 TRP A 74 18.640 3.888 1.073 1.00 1.34 C ATOM 35 CE3 TRP A 74 20.826 4.862 1.376 1.00 1.43 C ATOM 36 CZ2 TRP A 74 18.310 4.097 2.405 1.00 1.61 C ATOM 37 CZ3 TRP A 74 20.498 5.072 2.700 1.00 1.66 C ATOM 38 CH2 TRP A 74 19.249 4.689 3.205 1.00 1.75 C ATOM 0 H TRP A 74 23.243 2.863 -3.456 1.00 1.61 H new ATOM 0 HA TRP A 74 22.354 2.918 -0.696 1.00 1.14 H new ATOM 0 HB2 TRP A 74 21.455 5.057 -1.664 1.00 1.25 H new ATOM 0 HB3 TRP A 74 20.575 4.102 -2.840 1.00 1.25 H new ATOM 0 HD1 TRP A 74 18.342 2.938 -2.038 1.00 1.14 H new ATOM 0 HE1 TRP A 74 16.962 2.959 0.148 1.00 1.26 H new ATOM 0 HE3 TRP A 74 21.792 5.159 0.995 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 17.347 3.803 2.796 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 21.216 5.539 3.357 1.00 1.66 H new ATOM 0 HH2 TRP A 74 19.023 4.864 4.246 1.00 1.75 H new ATOM 49 N ASP A 75 20.815 0.959 -1.307 1.00 0.79 N ATOM 50 CA ASP A 75 20.368 -0.400 -1.565 1.00 0.78 C ATOM 51 C ASP A 75 18.855 -0.487 -1.746 1.00 0.67 C ATOM 52 O ASP A 75 18.376 -0.829 -2.817 1.00 0.92 O ATOM 53 CB ASP A 75 20.814 -1.332 -0.417 1.00 0.92 C ATOM 54 CG ASP A 75 20.348 -0.865 0.955 1.00 1.37 C ATOM 55 OD1 ASP A 75 19.872 -1.705 1.751 1.00 2.01 O ATOM 56 OD2 ASP A 75 20.463 0.349 1.245 1.00 1.86 O ATOM 0 H ASP A 75 20.561 1.317 -0.386 1.00 0.79 H new ATOM 0 HA ASP A 75 20.828 -0.720 -2.500 1.00 0.78 H new ATOM 0 HB2 ASP A 75 20.428 -2.335 -0.602 1.00 0.92 H new ATOM 0 HB3 ASP A 75 21.902 -1.404 -0.418 1.00 0.92 H new ATOM 61 N GLN A 76 18.119 -0.110 -0.719 1.00 0.59 N ATOM 62 CA GLN A 76 16.711 -0.483 -0.585 1.00 0.77 C ATOM 63 C GLN A 76 15.725 0.475 -1.260 1.00 0.69 C ATOM 64 O GLN A 76 14.537 0.397 -1.000 1.00 0.94 O ATOM 65 CB GLN A 76 16.364 -0.586 0.899 1.00 1.07 C ATOM 66 CG GLN A 76 16.705 0.670 1.687 1.00 1.21 C ATOM 67 CD GLN A 76 16.272 0.589 3.135 1.00 1.75 C ATOM 68 OE1 GLN A 76 16.899 1.170 4.017 1.00 2.30 O ATOM 69 NE2 GLN A 76 15.188 -0.120 3.389 1.00 2.36 N ATOM 0 H GLN A 76 18.472 0.462 0.048 1.00 0.59 H new ATOM 0 HA GLN A 76 16.603 -1.437 -1.100 1.00 0.77 H new ATOM 0 HB2 GLN A 76 15.299 -0.793 1.002 1.00 1.07 H new ATOM 0 HB3 GLN A 76 16.897 -1.433 1.331 1.00 1.07 H new ATOM 0 HG2 GLN A 76 17.781 0.840 1.643 1.00 1.21 H new ATOM 0 HG3 GLN A 76 16.227 1.529 1.217 1.00 1.21 H new ATOM 0 HE21 GLN A 76 14.695 -0.588 2.629 1.00 2.36 H new ATOM 0 HE22 GLN A 76 14.843 -0.200 4.346 1.00 2.36 H new ATOM 78 N SER A 77 16.184 1.377 -2.105 1.00 0.51 N ATOM 79 CA SER A 77 15.303 2.432 -2.615 1.00 0.56 C ATOM 80 C SER A 77 14.388 1.969 -3.763 1.00 0.43 C ATOM 81 O SER A 77 13.657 2.785 -4.324 1.00 0.54 O ATOM 82 CB SER A 77 16.121 3.644 -3.068 1.00 0.80 C ATOM 83 OG SER A 77 15.285 4.751 -3.363 1.00 1.52 O ATOM 0 H SER A 77 17.142 1.410 -2.453 1.00 0.51 H new ATOM 0 HA SER A 77 14.654 2.706 -1.783 1.00 0.56 H new ATOM 0 HB2 SER A 77 16.830 3.919 -2.287 1.00 0.80 H new ATOM 0 HB3 SER A 77 16.705 3.382 -3.950 1.00 0.80 H new ATOM 0 HG SER A 77 14.468 4.436 -3.802 1.00 1.52 H new ATOM 89 N ASP A 78 14.401 0.690 -4.123 1.00 0.35 N ATOM 90 CA ASP A 78 13.714 0.276 -5.353 1.00 0.38 C ATOM 91 C ASP A 78 12.550 -0.691 -5.108 1.00 0.33 C ATOM 92 O ASP A 78 12.321 -1.610 -5.898 1.00 0.42 O ATOM 93 CB ASP A 78 14.705 -0.336 -6.349 1.00 0.51 C ATOM 94 CG ASP A 78 14.291 -0.107 -7.788 1.00 0.94 C ATOM 95 OD1 ASP A 78 14.525 -0.999 -8.627 1.00 1.66 O ATOM 96 OD2 ASP A 78 13.731 0.969 -8.086 1.00 1.66 O ATOM 0 H ASP A 78 14.861 -0.059 -3.605 1.00 0.35 H new ATOM 0 HA ASP A 78 13.283 1.184 -5.775 1.00 0.38 H new ATOM 0 HB2 ASP A 78 15.693 0.094 -6.185 1.00 0.51 H new ATOM 0 HB3 ASP A 78 14.788 -1.407 -6.163 1.00 0.51 H new ATOM 101 N LEU A 79 11.812 -0.498 -4.020 1.00 0.26 N ATOM 102 CA LEU A 79 10.566 -1.244 -3.820 1.00 0.26 C ATOM 103 C LEU A 79 9.437 -0.556 -4.577 1.00 0.30 C ATOM 104 O LEU A 79 9.223 0.647 -4.425 1.00 0.51 O ATOM 105 CB LEU A 79 10.180 -1.357 -2.336 1.00 0.28 C ATOM 106 CG LEU A 79 10.855 -2.480 -1.533 1.00 0.28 C ATOM 107 CD1 LEU A 79 10.677 -3.832 -2.206 1.00 0.29 C ATOM 108 CD2 LEU A 79 12.323 -2.181 -1.319 1.00 0.30 C ATOM 0 H LEU A 79 12.046 0.156 -3.273 1.00 0.26 H new ATOM 0 HA LEU A 79 10.728 -2.254 -4.198 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.408 -0.408 -1.852 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.101 -1.496 -2.274 1.00 0.28 H new ATOM 0 HG LEU A 79 10.366 -2.526 -0.560 1.00 0.28 H new ATOM 0 HD11 LEU A 79 11.167 -4.602 -1.610 1.00 0.29 H new ATOM 0 HD12 LEU A 79 9.614 -4.060 -2.290 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.122 -3.805 -3.201 1.00 0.29 H new ATOM 0 HD21 LEU A 79 12.780 -2.990 -0.748 1.00 0.30 H new ATOM 0 HD22 LEU A 79 12.821 -2.092 -2.285 1.00 0.30 H new ATOM 0 HD23 LEU A 79 12.427 -1.245 -0.770 1.00 0.30 H new ATOM 120 N HIS A 80 8.727 -1.307 -5.405 1.00 0.21 N ATOM 121 CA HIS A 80 7.639 -0.739 -6.193 1.00 0.25 C ATOM 122 C HIS A 80 6.369 -1.556 -6.012 1.00 0.22 C ATOM 123 O HIS A 80 6.403 -2.783 -6.085 1.00 0.23 O ATOM 124 CB HIS A 80 8.010 -0.690 -7.681 1.00 0.33 C ATOM 125 CG HIS A 80 9.186 0.185 -8.001 1.00 1.03 C ATOM 126 ND1 HIS A 80 9.077 1.529 -8.286 1.00 1.94 N ATOM 127 CD2 HIS A 80 10.503 -0.108 -8.093 1.00 1.86 C ATOM 128 CE1 HIS A 80 10.276 2.022 -8.540 1.00 2.58 C ATOM 129 NE2 HIS A 80 11.157 1.049 -8.429 1.00 2.50 N ATOM 0 H HIS A 80 8.881 -2.305 -5.550 1.00 0.21 H new ATOM 0 HA HIS A 80 7.465 0.278 -5.840 1.00 0.25 H new ATOM 0 HB2 HIS A 80 8.223 -1.703 -8.023 1.00 0.33 H new ATOM 0 HB3 HIS A 80 7.147 -0.338 -8.246 1.00 0.33 H new ATOM 0 HD2 HIS A 80 10.956 -1.075 -7.932 1.00 1.86 H new ATOM 0 HE1 HIS A 80 10.496 3.048 -8.795 1.00 2.58 H new ATOM 0 HE2 HIS A 80 12.163 1.141 -8.570 1.00 2.50 H new ATOM 138 N ILE A 81 5.255 -0.875 -5.762 1.00 0.23 N ATOM 139 CA ILE A 81 3.963 -1.539 -5.659 1.00 0.23 C ATOM 140 C ILE A 81 3.541 -2.046 -7.030 1.00 0.26 C ATOM 141 O ILE A 81 3.157 -1.266 -7.903 1.00 0.36 O ATOM 142 CB ILE A 81 2.867 -0.600 -5.107 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.231 -0.107 -3.703 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.521 -1.319 -5.082 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.242 0.891 -3.141 1.00 0.27 C ATOM 0 H ILE A 81 5.222 0.136 -5.627 1.00 0.23 H new ATOM 0 HA ILE A 81 4.076 -2.369 -4.961 1.00 0.23 H new ATOM 0 HB ILE A 81 2.793 0.266 -5.765 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.294 -0.963 -3.031 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.220 0.350 -3.732 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.757 -0.647 -4.691 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.253 -1.624 -6.093 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.591 -2.200 -4.444 1.00 0.28 H new ATOM 0 HD11 ILE A 81 2.561 1.198 -2.145 1.00 0.27 H new ATOM 0 HD12 ILE A 81 2.196 1.764 -3.792 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.256 0.431 -3.080 1.00 0.27 H new ATOM 157 N SER A 82 3.635 -3.348 -7.222 1.00 0.25 N ATOM 158 CA SER A 82 3.345 -3.942 -8.514 1.00 0.29 C ATOM 159 C SER A 82 1.914 -4.466 -8.571 1.00 0.33 C ATOM 160 O SER A 82 1.344 -4.618 -9.654 1.00 0.43 O ATOM 161 CB SER A 82 4.354 -5.052 -8.812 1.00 0.32 C ATOM 162 OG SER A 82 5.673 -4.532 -8.812 1.00 1.10 O ATOM 0 H SER A 82 3.910 -4.015 -6.501 1.00 0.25 H new ATOM 0 HA SER A 82 3.437 -3.173 -9.281 1.00 0.29 H new ATOM 0 HB2 SER A 82 4.267 -5.841 -8.065 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.134 -5.503 -9.780 1.00 0.32 H new ATOM 0 HG SER A 82 6.265 -5.142 -9.300 1.00 1.10 H new ATOM 168 N ASP A 83 1.325 -4.717 -7.406 1.00 0.33 N ATOM 169 CA ASP A 83 -0.057 -5.176 -7.340 1.00 0.38 C ATOM 170 C ASP A 83 -0.596 -4.998 -5.929 1.00 0.30 C ATOM 171 O ASP A 83 0.119 -4.527 -5.043 1.00 0.27 O ATOM 172 CB ASP A 83 -0.173 -6.643 -7.767 1.00 0.46 C ATOM 173 CG ASP A 83 -1.512 -6.941 -8.419 1.00 1.27 C ATOM 174 OD1 ASP A 83 -1.577 -6.957 -9.666 1.00 2.07 O ATOM 175 OD2 ASP A 83 -2.509 -7.139 -7.691 1.00 1.90 O ATOM 0 H ASP A 83 1.781 -4.611 -6.500 1.00 0.33 H new ATOM 0 HA ASP A 83 -0.649 -4.575 -8.030 1.00 0.38 H new ATOM 0 HB2 ASP A 83 0.631 -6.883 -8.463 1.00 0.46 H new ATOM 0 HB3 ASP A 83 -0.043 -7.286 -6.896 1.00 0.46 H new ATOM 180 N GLN A 84 -1.845 -5.389 -5.720 1.00 0.31 N ATOM 181 CA GLN A 84 -2.515 -5.191 -4.445 1.00 0.35 C ATOM 182 C GLN A 84 -3.779 -6.046 -4.359 1.00 0.34 C ATOM 183 O GLN A 84 -3.944 -6.985 -5.141 1.00 0.39 O ATOM 184 CB GLN A 84 -2.815 -3.692 -4.227 1.00 0.49 C ATOM 185 CG GLN A 84 -3.319 -2.957 -5.464 1.00 0.64 C ATOM 186 CD GLN A 84 -4.786 -3.184 -5.747 1.00 1.32 C ATOM 187 OE1 GLN A 84 -5.584 -3.405 -4.838 1.00 2.14 O ATOM 188 NE2 GLN A 84 -5.156 -3.119 -7.015 1.00 1.98 N ATOM 0 H GLN A 84 -2.419 -5.850 -6.426 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.853 -5.516 -3.642 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -3.558 -3.595 -3.436 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -1.908 -3.201 -3.874 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -3.143 -1.889 -5.338 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -2.737 -3.277 -6.328 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -4.463 -2.933 -7.740 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -6.135 -3.254 -7.268 1.00 1.98 H new ATOM 197 N THR A 85 -4.636 -5.721 -3.394 1.00 0.34 N ATOM 198 CA THR A 85 -5.866 -6.459 -3.098 1.00 0.39 C ATOM 199 C THR A 85 -6.564 -7.016 -4.347 1.00 0.50 C ATOM 200 O THR A 85 -6.651 -6.353 -5.388 1.00 0.54 O ATOM 201 CB THR A 85 -6.839 -5.542 -2.342 1.00 0.32 C ATOM 202 OG1 THR A 85 -6.146 -4.898 -1.265 1.00 0.43 O ATOM 203 CG2 THR A 85 -8.022 -6.322 -1.789 1.00 0.42 C ATOM 0 H THR A 85 -4.493 -4.919 -2.781 1.00 0.34 H new ATOM 0 HA THR A 85 -5.578 -7.316 -2.490 1.00 0.39 H new ATOM 0 HB THR A 85 -7.221 -4.799 -3.042 1.00 0.32 H new ATOM 0 HG1 THR A 85 -6.043 -3.944 -1.466 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.690 -5.643 -1.260 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.561 -6.796 -2.609 1.00 0.42 H new ATOM 0 HG23 THR A 85 -7.663 -7.087 -1.101 1.00 0.42 H new ATOM 211 N ASP A 86 -7.071 -8.240 -4.224 1.00 0.69 N ATOM 212 CA ASP A 86 -7.738 -8.918 -5.330 1.00 0.89 C ATOM 213 C ASP A 86 -9.189 -8.453 -5.442 1.00 0.83 C ATOM 214 O ASP A 86 -10.132 -9.236 -5.347 1.00 1.12 O ATOM 215 CB ASP A 86 -7.668 -10.438 -5.148 1.00 1.20 C ATOM 216 CG ASP A 86 -8.192 -11.195 -6.353 1.00 1.67 C ATOM 217 OD1 ASP A 86 -7.575 -11.096 -7.435 1.00 2.32 O ATOM 218 OD2 ASP A 86 -9.213 -11.904 -6.224 1.00 2.23 O ATOM 0 H ASP A 86 -7.031 -8.785 -3.363 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.223 -8.661 -6.256 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -6.635 -10.730 -4.961 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -8.244 -10.722 -4.267 1.00 1.20 H new ATOM 223 N THR A 87 -9.350 -7.156 -5.609 1.00 0.72 N ATOM 224 CA THR A 87 -10.653 -6.555 -5.811 1.00 0.74 C ATOM 225 C THR A 87 -10.725 -5.935 -7.199 1.00 0.81 C ATOM 226 O THR A 87 -11.622 -6.251 -7.978 1.00 1.42 O ATOM 227 CB THR A 87 -10.927 -5.488 -4.736 1.00 1.14 C ATOM 228 OG1 THR A 87 -9.699 -4.838 -4.382 1.00 1.36 O ATOM 229 CG2 THR A 87 -11.550 -6.113 -3.496 1.00 1.87 C ATOM 0 H THR A 87 -8.580 -6.488 -5.608 1.00 0.72 H new ATOM 0 HA THR A 87 -11.415 -7.330 -5.727 1.00 0.74 H new ATOM 0 HB THR A 87 -11.628 -4.759 -5.143 1.00 1.14 H new ATOM 0 HG1 THR A 87 -9.677 -4.686 -3.414 1.00 1.36 H new ATOM 0 HG21 THR A 87 -11.734 -5.338 -2.751 1.00 1.87 H new ATOM 0 HG22 THR A 87 -12.493 -6.590 -3.764 1.00 1.87 H new ATOM 0 HG23 THR A 87 -10.870 -6.859 -3.084 1.00 1.87 H new ATOM 237 N LYS A 88 -9.755 -5.072 -7.497 1.00 1.18 N ATOM 238 CA LYS A 88 -9.605 -4.475 -8.821 1.00 1.58 C ATOM 239 C LYS A 88 -10.918 -3.860 -9.305 1.00 1.51 C ATOM 240 O LYS A 88 -11.429 -4.207 -10.372 1.00 1.95 O ATOM 241 CB LYS A 88 -9.098 -5.525 -9.820 1.00 1.89 C ATOM 242 CG LYS A 88 -7.787 -6.200 -9.410 1.00 2.02 C ATOM 243 CD LYS A 88 -6.662 -5.191 -9.222 1.00 2.39 C ATOM 244 CE LYS A 88 -5.301 -5.868 -9.103 1.00 2.73 C ATOM 245 NZ LYS A 88 -5.189 -6.722 -7.889 1.00 3.20 N ATOM 0 H LYS A 88 -9.050 -4.767 -6.825 1.00 1.18 H new ATOM 0 HA LYS A 88 -8.871 -3.672 -8.751 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -9.864 -6.290 -9.945 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -8.961 -5.050 -10.791 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -7.938 -6.752 -8.482 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -7.500 -6.926 -10.170 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -6.651 -4.500 -10.065 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -6.852 -4.599 -8.327 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -5.124 -6.478 -9.989 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -4.522 -5.106 -9.080 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -4.210 -6.702 -7.539 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -5.827 -6.362 -7.151 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -5.451 -7.700 -8.127 1.00 3.20 H new ATOM 259 N GLY A 89 -11.463 -2.951 -8.512 1.00 1.22 N ATOM 260 CA GLY A 89 -12.714 -2.313 -8.865 1.00 1.14 C ATOM 261 C GLY A 89 -13.615 -2.116 -7.663 1.00 0.96 C ATOM 262 O GLY A 89 -13.140 -2.083 -6.524 1.00 1.01 O ATOM 0 H GLY A 89 -11.060 -2.643 -7.627 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -12.510 -1.347 -9.326 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -13.231 -2.918 -9.609 1.00 1.14 H new ATOM 266 N THR A 90 -14.913 -1.989 -7.910 1.00 0.97 N ATOM 267 CA THR A 90 -15.880 -1.798 -6.841 1.00 0.88 C ATOM 268 C THR A 90 -16.498 -3.136 -6.435 1.00 0.82 C ATOM 269 O THR A 90 -17.426 -3.630 -7.079 1.00 1.04 O ATOM 270 CB THR A 90 -16.989 -0.813 -7.263 1.00 1.06 C ATOM 271 OG1 THR A 90 -16.396 0.400 -7.750 1.00 1.25 O ATOM 272 CG2 THR A 90 -17.914 -0.491 -6.097 1.00 1.02 C ATOM 0 H THR A 90 -15.319 -2.015 -8.845 1.00 0.97 H new ATOM 0 HA THR A 90 -15.353 -1.375 -5.986 1.00 0.88 H new ATOM 0 HB THR A 90 -17.579 -1.283 -8.050 1.00 1.06 H new ATOM 0 HG1 THR A 90 -17.102 1.024 -8.019 1.00 1.25 H new ATOM 0 HG21 THR A 90 -18.685 0.206 -6.426 1.00 1.02 H new ATOM 0 HG22 THR A 90 -18.382 -1.408 -5.740 1.00 1.02 H new ATOM 0 HG23 THR A 90 -17.338 -0.039 -5.289 1.00 1.02 H new ATOM 280 N VAL A 91 -15.969 -3.718 -5.371 1.00 0.65 N ATOM 281 CA VAL A 91 -16.408 -5.026 -4.906 1.00 0.77 C ATOM 282 C VAL A 91 -16.865 -4.928 -3.458 1.00 0.55 C ATOM 283 O VAL A 91 -16.310 -4.149 -2.686 1.00 0.46 O ATOM 284 CB VAL A 91 -15.260 -6.059 -5.001 1.00 1.02 C ATOM 285 CG1 VAL A 91 -15.736 -7.453 -4.619 1.00 1.43 C ATOM 286 CG2 VAL A 91 -14.654 -6.069 -6.393 1.00 1.51 C ATOM 0 H VAL A 91 -15.228 -3.301 -4.808 1.00 0.65 H new ATOM 0 HA VAL A 91 -17.232 -5.353 -5.539 1.00 0.77 H new ATOM 0 HB VAL A 91 -14.490 -5.759 -4.291 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -14.906 -8.155 -4.696 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -16.108 -7.442 -3.595 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -16.536 -7.762 -5.292 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -13.849 -6.803 -6.434 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -15.421 -6.330 -7.122 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -14.256 -5.081 -6.624 1.00 1.51 H new ATOM 296 N CYS A 92 -17.868 -5.702 -3.080 1.00 0.79 N ATOM 297 CA CYS A 92 -18.278 -5.726 -1.693 1.00 0.64 C ATOM 298 C CYS A 92 -17.583 -6.877 -0.989 1.00 0.62 C ATOM 299 O CYS A 92 -17.764 -8.043 -1.342 1.00 1.20 O ATOM 300 CB CYS A 92 -19.798 -5.876 -1.596 1.00 1.10 C ATOM 301 SG CYS A 92 -20.474 -7.297 -2.491 1.00 1.91 S ATOM 0 H CYS A 92 -18.402 -6.309 -3.702 1.00 0.79 H new ATOM 0 HA CYS A 92 -17.997 -4.789 -1.212 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -20.075 -5.960 -0.545 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -20.265 -4.968 -1.977 1.00 1.10 H new ATOM 0 HG CYS A 92 -19.593 -8.252 -2.517 1.00 1.91 H new ATOM 307 N SER A 93 -16.758 -6.546 -0.011 1.00 0.69 N ATOM 308 CA SER A 93 -16.032 -7.554 0.735 1.00 1.02 C ATOM 309 C SER A 93 -15.639 -7.049 2.114 1.00 0.58 C ATOM 310 O SER A 93 -15.284 -5.883 2.272 1.00 0.73 O ATOM 311 CB SER A 93 -14.771 -7.969 -0.029 1.00 1.83 C ATOM 312 OG SER A 93 -15.094 -8.512 -1.299 1.00 2.58 O ATOM 0 H SER A 93 -16.575 -5.587 0.284 1.00 0.69 H new ATOM 0 HA SER A 93 -16.691 -8.413 0.856 1.00 1.02 H new ATOM 0 HB2 SER A 93 -14.119 -7.105 -0.156 1.00 1.83 H new ATOM 0 HB3 SER A 93 -14.216 -8.705 0.553 1.00 1.83 H new ATOM 0 HG SER A 93 -16.068 -8.546 -1.402 1.00 2.58 H new ATOM 318 N PRO A 94 -15.724 -7.906 3.133 1.00 0.78 N ATOM 319 CA PRO A 94 -14.952 -7.735 4.344 1.00 0.67 C ATOM 320 C PRO A 94 -13.635 -8.478 4.173 1.00 0.53 C ATOM 321 O PRO A 94 -13.602 -9.709 4.217 1.00 0.59 O ATOM 322 CB PRO A 94 -15.817 -8.401 5.421 1.00 0.93 C ATOM 323 CG PRO A 94 -16.911 -9.134 4.693 1.00 1.39 C ATOM 324 CD PRO A 94 -16.589 -9.078 3.220 1.00 1.43 C ATOM 0 HA PRO A 94 -14.721 -6.699 4.590 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -15.224 -9.088 6.025 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -16.233 -7.657 6.100 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -16.973 -10.168 5.033 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -17.879 -8.675 4.892 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -16.084 -9.982 2.880 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -17.487 -8.967 2.612 1.00 1.43 H new ATOM 332 N PHE A 95 -12.553 -7.752 3.973 1.00 0.43 N ATOM 333 CA PHE A 95 -11.330 -8.384 3.508 1.00 0.40 C ATOM 334 C PHE A 95 -10.094 -7.718 4.097 1.00 0.33 C ATOM 335 O PHE A 95 -10.094 -6.518 4.381 1.00 0.32 O ATOM 336 CB PHE A 95 -11.296 -8.310 1.974 1.00 0.46 C ATOM 337 CG PHE A 95 -10.342 -9.274 1.319 1.00 0.50 C ATOM 338 CD1 PHE A 95 -10.741 -10.568 1.017 1.00 1.26 C ATOM 339 CD2 PHE A 95 -9.054 -8.885 0.992 1.00 1.35 C ATOM 340 CE1 PHE A 95 -9.873 -11.452 0.403 1.00 1.33 C ATOM 341 CE2 PHE A 95 -8.183 -9.764 0.382 1.00 1.36 C ATOM 342 CZ PHE A 95 -8.591 -11.048 0.087 1.00 0.68 C ATOM 0 H PHE A 95 -12.492 -6.745 4.121 1.00 0.43 H new ATOM 0 HA PHE A 95 -11.321 -9.423 3.837 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -12.300 -8.497 1.592 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.027 -7.296 1.678 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -11.742 -10.889 1.265 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -8.727 -7.881 1.217 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -10.197 -12.456 0.171 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -7.181 -9.446 0.135 1.00 1.36 H new ATOM 0 HZ PHE A 95 -7.909 -11.736 -0.390 1.00 0.68 H new ATOM 352 N ALA A 96 -9.056 -8.519 4.303 1.00 0.37 N ATOM 353 CA ALA A 96 -7.757 -8.010 4.710 1.00 0.38 C ATOM 354 C ALA A 96 -6.988 -7.552 3.481 1.00 0.35 C ATOM 355 O ALA A 96 -6.376 -8.357 2.778 1.00 0.51 O ATOM 356 CB ALA A 96 -6.972 -9.073 5.467 1.00 0.49 C ATOM 0 H ALA A 96 -9.092 -9.532 4.193 1.00 0.37 H new ATOM 0 HA ALA A 96 -7.902 -7.163 5.381 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.003 -8.669 5.761 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -7.527 -9.370 6.357 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -6.823 -9.941 4.825 1.00 0.49 H new ATOM 362 N LEU A 97 -7.037 -6.257 3.229 1.00 0.24 N ATOM 363 CA LEU A 97 -6.456 -5.673 2.028 1.00 0.22 C ATOM 364 C LEU A 97 -4.945 -5.786 2.053 1.00 0.22 C ATOM 365 O LEU A 97 -4.332 -5.763 3.120 1.00 0.24 O ATOM 366 CB LEU A 97 -6.891 -4.207 1.895 1.00 0.23 C ATOM 367 CG LEU A 97 -8.197 -3.973 1.122 1.00 0.46 C ATOM 368 CD1 LEU A 97 -9.267 -4.977 1.514 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.706 -2.563 1.363 1.00 1.07 C ATOM 0 H LEU A 97 -7.480 -5.578 3.849 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.818 -6.224 1.160 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -7.000 -3.786 2.895 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -6.093 -3.653 1.402 1.00 0.23 H new ATOM 0 HG LEU A 97 -7.979 -4.106 0.062 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -10.176 -4.780 0.946 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -8.916 -5.986 1.298 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -9.478 -4.887 2.580 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -9.632 -2.411 0.809 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -8.892 -2.420 2.427 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -7.959 -1.844 1.026 1.00 1.07 H new ATOM 381 N PHE A 98 -4.343 -5.913 0.884 1.00 0.23 N ATOM 382 CA PHE A 98 -2.915 -6.119 0.809 1.00 0.23 C ATOM 383 C PHE A 98 -2.312 -5.393 -0.379 1.00 0.22 C ATOM 384 O PHE A 98 -3.015 -4.998 -1.306 1.00 0.25 O ATOM 385 CB PHE A 98 -2.587 -7.619 0.749 1.00 0.24 C ATOM 386 CG PHE A 98 -3.234 -8.363 -0.393 1.00 0.26 C ATOM 387 CD1 PHE A 98 -4.415 -9.064 -0.195 1.00 1.26 C ATOM 388 CD2 PHE A 98 -2.659 -8.373 -1.655 1.00 1.18 C ATOM 389 CE1 PHE A 98 -5.008 -9.756 -1.234 1.00 1.31 C ATOM 390 CE2 PHE A 98 -3.251 -9.064 -2.696 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.425 -9.755 -2.484 1.00 0.40 C ATOM 0 H PHE A 98 -4.819 -5.877 -0.017 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.472 -5.702 1.713 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.506 -7.737 0.675 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -2.895 -8.082 1.687 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -4.876 -9.069 0.782 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -1.738 -7.835 -1.827 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -5.928 -10.297 -1.067 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -2.794 -9.062 -3.675 1.00 1.17 H new ATOM 0 HZ PHE A 98 -4.888 -10.295 -3.296 1.00 0.40 H new ATOM 401 N ALA A 99 -1.009 -5.201 -0.319 1.00 0.20 N ATOM 402 CA ALA A 99 -0.262 -4.622 -1.417 1.00 0.19 C ATOM 403 C ALA A 99 1.024 -5.401 -1.617 1.00 0.17 C ATOM 404 O ALA A 99 1.650 -5.837 -0.649 1.00 0.19 O ATOM 405 CB ALA A 99 0.038 -3.155 -1.166 1.00 0.21 C ATOM 0 H ALA A 99 -0.439 -5.442 0.492 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.867 -4.683 -2.321 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.599 -2.749 -2.008 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -0.897 -2.606 -1.055 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.628 -3.055 -0.255 1.00 0.21 H new ATOM 411 N VAL A 100 1.400 -5.594 -2.865 1.00 0.17 N ATOM 412 CA VAL A 100 2.588 -6.353 -3.192 1.00 0.18 C ATOM 413 C VAL A 100 3.664 -5.442 -3.765 1.00 0.19 C ATOM 414 O VAL A 100 3.480 -4.826 -4.817 1.00 0.22 O ATOM 415 CB VAL A 100 2.270 -7.475 -4.198 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.518 -8.276 -4.529 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.179 -8.386 -3.656 1.00 0.25 C ATOM 0 H VAL A 100 0.895 -5.232 -3.674 1.00 0.17 H new ATOM 0 HA VAL A 100 2.955 -6.805 -2.271 1.00 0.18 H new ATOM 0 HB VAL A 100 1.909 -7.013 -5.117 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.267 -9.062 -5.241 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.268 -7.617 -4.965 1.00 0.26 H new ATOM 0 HG13 VAL A 100 3.915 -8.724 -3.618 1.00 0.26 H new ATOM 0 HG21 VAL A 100 0.968 -9.172 -4.381 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.511 -8.835 -2.720 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.274 -7.804 -3.478 1.00 0.25 H new ATOM 427 N LEU A 101 4.780 -5.352 -3.062 1.00 0.19 N ATOM 428 CA LEU A 101 5.896 -4.536 -3.502 1.00 0.19 C ATOM 429 C LEU A 101 7.005 -5.434 -4.013 1.00 0.21 C ATOM 430 O LEU A 101 7.498 -6.304 -3.294 1.00 0.23 O ATOM 431 CB LEU A 101 6.427 -3.632 -2.383 1.00 0.19 C ATOM 432 CG LEU A 101 5.463 -2.551 -1.886 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.436 -3.134 -0.925 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.234 -1.415 -1.230 1.00 0.21 C ATOM 0 H LEU A 101 4.937 -5.838 -2.179 1.00 0.19 H new ATOM 0 HA LEU A 101 5.541 -3.886 -4.302 1.00 0.19 H new ATOM 0 HB2 LEU A 101 6.707 -4.259 -1.537 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.337 -3.147 -2.735 1.00 0.19 H new ATOM 0 HG LEU A 101 4.925 -2.152 -2.746 1.00 0.22 H new ATOM 0 HD11 LEU A 101 3.764 -2.345 -0.588 1.00 0.30 H new ATOM 0 HD12 LEU A 101 3.860 -3.908 -1.433 1.00 0.30 H new ATOM 0 HD13 LEU A 101 4.947 -3.568 -0.065 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.535 -0.654 -0.882 1.00 0.21 H new ATOM 0 HD22 LEU A 101 6.801 -1.802 -0.383 1.00 0.21 H new ATOM 0 HD23 LEU A 101 6.919 -0.974 -1.954 1.00 0.21 H new ATOM 446 N GLU A 102 7.386 -5.228 -5.254 1.00 0.24 N ATOM 447 CA GLU A 102 8.353 -6.085 -5.903 1.00 0.29 C ATOM 448 C GLU A 102 9.767 -5.543 -5.754 1.00 0.28 C ATOM 449 O GLU A 102 10.034 -4.369 -6.032 1.00 0.26 O ATOM 450 CB GLU A 102 7.996 -6.242 -7.380 1.00 0.34 C ATOM 451 CG GLU A 102 8.962 -7.117 -8.155 1.00 0.41 C ATOM 452 CD GLU A 102 8.567 -7.269 -9.606 1.00 0.53 C ATOM 453 OE1 GLU A 102 8.020 -8.333 -9.969 1.00 1.32 O ATOM 454 OE2 GLU A 102 8.799 -6.327 -10.392 1.00 0.95 O ATOM 0 H GLU A 102 7.038 -4.468 -5.838 1.00 0.24 H new ATOM 0 HA GLU A 102 8.322 -7.061 -5.418 1.00 0.29 H new ATOM 0 HB2 GLU A 102 6.994 -6.665 -7.459 1.00 0.34 H new ATOM 0 HB3 GLU A 102 7.963 -5.256 -7.843 1.00 0.34 H new ATOM 0 HG2 GLU A 102 9.962 -6.688 -8.097 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.009 -8.101 -7.689 1.00 0.41 H new ATOM 461 N ASN A 103 10.660 -6.409 -5.295 1.00 0.38 N ATOM 462 CA ASN A 103 12.083 -6.110 -5.256 1.00 0.44 C ATOM 463 C ASN A 103 12.586 -6.025 -6.686 1.00 0.37 C ATOM 464 O ASN A 103 12.808 -7.045 -7.338 1.00 0.51 O ATOM 465 CB ASN A 103 12.834 -7.210 -4.488 1.00 0.68 C ATOM 466 CG ASN A 103 14.333 -6.970 -4.358 1.00 0.87 C ATOM 467 OD1 ASN A 103 14.957 -6.292 -5.176 1.00 1.76 O ATOM 468 ND2 ASN A 103 14.927 -7.555 -3.329 1.00 1.64 N ATOM 0 H ASN A 103 10.419 -7.335 -4.941 1.00 0.38 H new ATOM 0 HA ASN A 103 12.256 -5.164 -4.743 1.00 0.44 H new ATOM 0 HB2 ASN A 103 12.404 -7.299 -3.490 1.00 0.68 H new ATOM 0 HB3 ASN A 103 12.672 -8.163 -4.991 1.00 0.68 H new ATOM 0 HD21 ASN A 103 15.933 -7.451 -3.194 1.00 1.64 H new ATOM 0 HD22 ASN A 103 14.379 -8.109 -2.671 1.00 1.64 H new ATOM 475 N THR A 104 12.751 -4.812 -7.175 1.00 0.34 N ATOM 476 CA THR A 104 13.111 -4.605 -8.564 1.00 0.38 C ATOM 477 C THR A 104 14.636 -4.640 -8.742 1.00 0.50 C ATOM 478 O THR A 104 15.186 -4.141 -9.725 1.00 0.70 O ATOM 479 CB THR A 104 12.516 -3.276 -9.065 1.00 0.55 C ATOM 480 OG1 THR A 104 11.168 -3.155 -8.578 1.00 0.77 O ATOM 481 CG2 THR A 104 12.498 -3.219 -10.582 1.00 0.73 C ATOM 0 H THR A 104 12.642 -3.955 -6.632 1.00 0.34 H new ATOM 0 HA THR A 104 12.695 -5.415 -9.164 1.00 0.38 H new ATOM 0 HB THR A 104 13.136 -2.459 -8.696 1.00 0.55 H new ATOM 0 HG1 THR A 104 10.636 -2.632 -9.214 1.00 0.77 H new ATOM 0 HG21 THR A 104 12.072 -2.269 -10.905 1.00 0.73 H new ATOM 0 HG22 THR A 104 13.516 -3.309 -10.962 1.00 0.73 H new ATOM 0 HG23 THR A 104 11.893 -4.038 -10.970 1.00 0.73 H new ATOM 489 N GLY A 105 15.312 -5.257 -7.782 1.00 0.52 N ATOM 490 CA GLY A 105 16.748 -5.419 -7.870 1.00 0.72 C ATOM 491 C GLY A 105 17.487 -4.519 -6.909 1.00 0.66 C ATOM 492 O GLY A 105 18.595 -4.068 -7.197 1.00 0.80 O ATOM 0 H GLY A 105 14.888 -5.649 -6.941 1.00 0.52 H new ATOM 0 HA2 GLY A 105 17.007 -6.457 -7.664 1.00 0.72 H new ATOM 0 HA3 GLY A 105 17.074 -5.205 -8.888 1.00 0.72 H new ATOM 496 N GLU A 106 16.885 -4.273 -5.760 1.00 0.60 N ATOM 497 CA GLU A 106 17.461 -3.368 -4.779 1.00 0.56 C ATOM 498 C GLU A 106 18.084 -4.134 -3.622 1.00 0.65 C ATOM 499 O GLU A 106 19.110 -3.718 -3.080 1.00 1.05 O ATOM 500 CB GLU A 106 16.401 -2.374 -4.285 1.00 0.68 C ATOM 501 CG GLU A 106 15.060 -2.985 -3.885 1.00 1.25 C ATOM 502 CD GLU A 106 15.078 -3.608 -2.506 1.00 1.91 C ATOM 503 OE1 GLU A 106 15.321 -2.880 -1.530 1.00 2.54 O ATOM 504 OE2 GLU A 106 14.844 -4.828 -2.399 1.00 2.47 O ATOM 0 H GLU A 106 15.996 -4.687 -5.482 1.00 0.60 H new ATOM 0 HA GLU A 106 18.260 -2.804 -5.260 1.00 0.56 H new ATOM 0 HB2 GLU A 106 16.805 -1.836 -3.428 1.00 0.68 H new ATOM 0 HB3 GLU A 106 16.225 -1.638 -5.070 1.00 0.68 H new ATOM 0 HG2 GLU A 106 14.292 -2.213 -3.918 1.00 1.25 H new ATOM 0 HG3 GLU A 106 14.781 -3.744 -4.616 1.00 1.25 H new ATOM 511 N LYS A 107 17.485 -5.267 -3.288 1.00 0.61 N ATOM 512 CA LYS A 107 17.937 -6.094 -2.176 1.00 0.69 C ATOM 513 C LYS A 107 17.890 -5.329 -0.859 1.00 0.66 C ATOM 514 O LYS A 107 18.909 -4.826 -0.379 1.00 0.76 O ATOM 515 CB LYS A 107 19.341 -6.642 -2.431 1.00 0.86 C ATOM 516 CG LYS A 107 19.416 -7.580 -3.624 1.00 1.37 C ATOM 517 CD LYS A 107 18.464 -8.754 -3.470 1.00 1.80 C ATOM 518 CE LYS A 107 18.556 -9.709 -4.647 1.00 2.66 C ATOM 519 NZ LYS A 107 19.885 -10.370 -4.732 1.00 3.32 N ATOM 0 H LYS A 107 16.672 -5.640 -3.779 1.00 0.61 H new ATOM 0 HA LYS A 107 17.251 -6.938 -2.098 1.00 0.69 H new ATOM 0 HB2 LYS A 107 20.025 -5.808 -2.590 1.00 0.86 H new ATOM 0 HB3 LYS A 107 19.684 -7.170 -1.541 1.00 0.86 H new ATOM 0 HG2 LYS A 107 19.175 -7.032 -4.535 1.00 1.37 H new ATOM 0 HG3 LYS A 107 20.436 -7.949 -3.734 1.00 1.37 H new ATOM 0 HD2 LYS A 107 18.692 -9.289 -2.548 1.00 1.80 H new ATOM 0 HD3 LYS A 107 17.442 -8.385 -3.380 1.00 1.80 H new ATOM 0 HE2 LYS A 107 17.779 -10.469 -4.558 1.00 2.66 H new ATOM 0 HE3 LYS A 107 18.364 -9.164 -5.571 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 19.845 -11.143 -5.427 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 20.600 -9.675 -5.028 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 20.141 -10.755 -3.801 1.00 3.32 H new ATOM 533 N LEU A 108 16.678 -5.235 -0.321 1.00 0.59 N ATOM 534 CA LEU A 108 16.415 -4.691 1.012 1.00 0.57 C ATOM 535 C LEU A 108 17.454 -5.207 2.009 1.00 0.63 C ATOM 536 O LEU A 108 17.436 -6.385 2.371 1.00 0.74 O ATOM 537 CB LEU A 108 14.997 -5.130 1.435 1.00 0.60 C ATOM 538 CG LEU A 108 14.350 -4.427 2.643 1.00 0.58 C ATOM 539 CD1 LEU A 108 15.034 -4.792 3.950 1.00 0.61 C ATOM 540 CD2 LEU A 108 14.345 -2.926 2.446 1.00 0.56 C ATOM 0 H LEU A 108 15.834 -5.540 -0.806 1.00 0.59 H new ATOM 0 HA LEU A 108 16.480 -3.603 0.996 1.00 0.57 H new ATOM 0 HB2 LEU A 108 14.337 -4.996 0.578 1.00 0.60 H new ATOM 0 HB3 LEU A 108 15.029 -6.198 1.649 1.00 0.60 H new ATOM 0 HG LEU A 108 13.320 -4.777 2.708 1.00 0.58 H new ATOM 0 HD11 LEU A 108 14.544 -4.273 4.774 1.00 0.61 H new ATOM 0 HD12 LEU A 108 14.967 -5.868 4.108 1.00 0.61 H new ATOM 0 HD13 LEU A 108 16.082 -4.497 3.907 1.00 0.61 H new ATOM 0 HD21 LEU A 108 13.884 -2.447 3.310 1.00 0.56 H new ATOM 0 HD22 LEU A 108 15.369 -2.570 2.338 1.00 0.56 H new ATOM 0 HD23 LEU A 108 13.778 -2.679 1.549 1.00 0.56 H new ATOM 552 N LYS A 109 18.371 -4.342 2.424 1.00 0.62 N ATOM 553 CA LYS A 109 19.399 -4.732 3.379 1.00 0.73 C ATOM 554 C LYS A 109 19.378 -3.859 4.632 1.00 0.75 C ATOM 555 O LYS A 109 19.373 -4.378 5.750 1.00 1.15 O ATOM 556 CB LYS A 109 20.785 -4.675 2.729 1.00 0.92 C ATOM 557 CG LYS A 109 21.039 -5.783 1.719 1.00 1.17 C ATOM 558 CD LYS A 109 22.383 -5.607 1.033 1.00 1.66 C ATOM 559 CE LYS A 109 22.651 -6.722 0.036 1.00 2.07 C ATOM 560 NZ LYS A 109 23.903 -6.493 -0.732 1.00 2.72 N ATOM 0 H LYS A 109 18.424 -3.371 2.116 1.00 0.62 H new ATOM 0 HA LYS A 109 19.183 -5.756 3.682 1.00 0.73 H new ATOM 0 HB2 LYS A 109 20.904 -3.711 2.234 1.00 0.92 H new ATOM 0 HB3 LYS A 109 21.544 -4.728 3.510 1.00 0.92 H new ATOM 0 HG2 LYS A 109 21.009 -6.750 2.221 1.00 1.17 H new ATOM 0 HG3 LYS A 109 20.245 -5.787 0.972 1.00 1.17 H new ATOM 0 HD2 LYS A 109 22.407 -4.646 0.520 1.00 1.66 H new ATOM 0 HD3 LYS A 109 23.175 -5.589 1.782 1.00 1.66 H new ATOM 0 HE2 LYS A 109 22.719 -7.673 0.565 1.00 2.07 H new ATOM 0 HE3 LYS A 109 21.811 -6.801 -0.655 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 24.048 -7.276 -1.400 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 23.829 -5.599 -1.257 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 24.709 -6.444 -0.076 1.00 2.72 H new ATOM 574 N LYS A 110 19.367 -2.541 4.445 1.00 0.62 N ATOM 575 CA LYS A 110 19.474 -1.606 5.568 1.00 0.73 C ATOM 576 C LYS A 110 18.237 -1.603 6.468 1.00 0.77 C ATOM 577 O LYS A 110 18.155 -2.356 7.442 1.00 1.53 O ATOM 578 CB LYS A 110 19.728 -0.178 5.079 1.00 0.93 C ATOM 579 CG LYS A 110 21.105 0.052 4.488 1.00 1.14 C ATOM 580 CD LYS A 110 21.305 1.520 4.159 1.00 1.46 C ATOM 581 CE LYS A 110 22.656 1.773 3.519 1.00 1.80 C ATOM 582 NZ LYS A 110 22.845 0.956 2.293 1.00 1.59 N ATOM 0 H LYS A 110 19.286 -2.095 3.531 1.00 0.62 H new ATOM 0 HA LYS A 110 20.321 -1.957 6.157 1.00 0.73 H new ATOM 0 HB2 LYS A 110 18.979 0.074 4.329 1.00 0.93 H new ATOM 0 HB3 LYS A 110 19.586 0.508 5.914 1.00 0.93 H new ATOM 0 HG2 LYS A 110 21.869 -0.276 5.193 1.00 1.14 H new ATOM 0 HG3 LYS A 110 21.225 -0.548 3.586 1.00 1.14 H new ATOM 0 HD2 LYS A 110 20.515 1.853 3.485 1.00 1.46 H new ATOM 0 HD3 LYS A 110 21.217 2.112 5.070 1.00 1.46 H new ATOM 0 HE2 LYS A 110 22.748 2.830 3.270 1.00 1.80 H new ATOM 0 HE3 LYS A 110 23.446 1.544 4.234 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 23.604 1.369 1.714 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.102 -0.016 2.560 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 21.961 0.942 1.745 1.00 1.59 H new ATOM 596 N SER A 111 17.280 -0.749 6.138 1.00 0.51 N ATOM 597 CA SER A 111 16.146 -0.494 7.006 1.00 0.52 C ATOM 598 C SER A 111 14.894 -1.191 6.472 1.00 0.48 C ATOM 599 O SER A 111 14.984 -2.083 5.631 1.00 0.86 O ATOM 600 CB SER A 111 15.931 1.021 7.110 1.00 0.72 C ATOM 601 OG SER A 111 14.996 1.352 8.126 1.00 1.55 O ATOM 0 H SER A 111 17.269 -0.218 5.267 1.00 0.51 H new ATOM 0 HA SER A 111 16.346 -0.896 7.999 1.00 0.52 H new ATOM 0 HB2 SER A 111 16.883 1.510 7.319 1.00 0.72 H new ATOM 0 HB3 SER A 111 15.579 1.405 6.153 1.00 0.72 H new ATOM 0 HG SER A 111 14.886 2.325 8.165 1.00 1.55 H new ATOM 607 N LYS A 112 13.736 -0.784 6.968 1.00 0.39 N ATOM 608 CA LYS A 112 12.474 -1.406 6.596 1.00 0.32 C ATOM 609 C LYS A 112 11.504 -0.348 6.086 1.00 0.28 C ATOM 610 O LYS A 112 11.351 0.708 6.698 1.00 0.33 O ATOM 611 CB LYS A 112 11.881 -2.143 7.800 1.00 0.45 C ATOM 612 CG LYS A 112 12.835 -3.162 8.398 1.00 0.55 C ATOM 613 CD LYS A 112 12.237 -3.863 9.605 1.00 0.69 C ATOM 614 CE LYS A 112 13.231 -4.829 10.234 1.00 0.84 C ATOM 615 NZ LYS A 112 13.674 -5.877 9.276 1.00 1.53 N ATOM 0 H LYS A 112 13.644 -0.018 7.636 1.00 0.39 H new ATOM 0 HA LYS A 112 12.651 -2.128 5.799 1.00 0.32 H new ATOM 0 HB2 LYS A 112 11.607 -1.417 8.565 1.00 0.45 H new ATOM 0 HB3 LYS A 112 10.964 -2.647 7.495 1.00 0.45 H new ATOM 0 HG2 LYS A 112 13.095 -3.902 7.641 1.00 0.55 H new ATOM 0 HG3 LYS A 112 13.760 -2.665 8.689 1.00 0.55 H new ATOM 0 HD2 LYS A 112 11.930 -3.122 10.343 1.00 0.69 H new ATOM 0 HD3 LYS A 112 11.340 -4.405 9.306 1.00 0.69 H new ATOM 0 HE2 LYS A 112 14.099 -4.274 10.591 1.00 0.84 H new ATOM 0 HE3 LYS A 112 12.775 -5.302 11.104 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 14.198 -6.616 9.787 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 12.843 -6.299 8.814 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 14.291 -5.450 8.556 1.00 1.53 H new ATOM 629 N TRP A 113 10.857 -0.637 4.962 1.00 0.24 N ATOM 630 CA TRP A 113 9.969 0.326 4.316 1.00 0.22 C ATOM 631 C TRP A 113 8.686 0.524 5.105 1.00 0.21 C ATOM 632 O TRP A 113 8.078 -0.435 5.581 1.00 0.25 O ATOM 633 CB TRP A 113 9.632 -0.114 2.890 1.00 0.22 C ATOM 634 CG TRP A 113 10.677 0.252 1.887 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.997 -0.088 1.914 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.481 1.018 0.691 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.635 0.433 0.820 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.727 1.111 0.052 1.00 0.25 C ATOM 639 CE3 TRP A 113 9.374 1.638 0.097 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.903 1.795 -1.147 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.551 2.314 -1.095 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.808 2.388 -1.706 1.00 0.32 C ATOM 0 H TRP A 113 10.930 -1.532 4.478 1.00 0.24 H new ATOM 0 HA TRP A 113 10.501 1.277 4.282 1.00 0.22 H new ATOM 0 HB2 TRP A 113 9.490 -1.195 2.876 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.684 0.336 2.595 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.469 -0.680 2.684 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.628 0.332 0.611 1.00 0.25 H new ATOM 0 HE3 TRP A 113 8.401 1.589 0.562 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.873 1.855 -1.619 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.704 2.794 -1.564 1.00 0.32 H new ATOM 0 HH2 TRP A 113 10.914 2.924 -2.637 1.00 0.32 H new ATOM 653 N LYS A 114 8.291 1.779 5.224 1.00 0.20 N ATOM 654 CA LYS A 114 7.101 2.168 5.952 1.00 0.24 C ATOM 655 C LYS A 114 5.920 2.342 5.000 1.00 0.20 C ATOM 656 O LYS A 114 6.053 2.962 3.941 1.00 0.24 O ATOM 657 CB LYS A 114 7.386 3.478 6.687 1.00 0.37 C ATOM 658 CG LYS A 114 6.149 4.216 7.155 1.00 0.58 C ATOM 659 CD LYS A 114 5.464 3.540 8.325 1.00 1.04 C ATOM 660 CE LYS A 114 4.168 4.255 8.667 1.00 1.08 C ATOM 661 NZ LYS A 114 4.381 5.714 8.864 1.00 1.66 N ATOM 0 H LYS A 114 8.795 2.564 4.812 1.00 0.20 H new ATOM 0 HA LYS A 114 6.841 1.389 6.668 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.016 3.266 7.551 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.957 4.133 6.029 1.00 0.37 H new ATOM 0 HG2 LYS A 114 6.424 5.232 7.440 1.00 0.58 H new ATOM 0 HG3 LYS A 114 5.445 4.297 6.326 1.00 0.58 H new ATOM 0 HD2 LYS A 114 5.258 2.498 8.081 1.00 1.04 H new ATOM 0 HD3 LYS A 114 6.126 3.540 9.191 1.00 1.04 H new ATOM 0 HE2 LYS A 114 3.443 4.097 7.868 1.00 1.08 H new ATOM 0 HE3 LYS A 114 3.742 3.824 9.573 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 3.508 6.146 9.227 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 5.151 5.863 9.547 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 4.634 6.154 7.956 1.00 1.66 H new ATOM 675 N TRP A 115 4.775 1.790 5.376 1.00 0.17 N ATOM 676 CA TRP A 115 3.562 1.942 4.589 1.00 0.15 C ATOM 677 C TRP A 115 2.414 2.438 5.455 1.00 0.16 C ATOM 678 O TRP A 115 2.399 2.221 6.669 1.00 0.18 O ATOM 679 CB TRP A 115 3.176 0.619 3.924 1.00 0.15 C ATOM 680 CG TRP A 115 2.912 -0.498 4.891 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.824 -1.379 5.384 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.653 -0.862 5.472 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.213 -2.269 6.231 1.00 0.22 N ATOM 684 CE2 TRP A 115 1.883 -1.973 6.303 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.357 -0.357 5.372 1.00 0.18 C ATOM 686 CZ2 TRP A 115 0.868 -2.587 7.028 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.652 -0.968 6.092 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.391 -2.073 6.910 1.00 0.22 C ATOM 0 H TRP A 115 4.662 1.232 6.223 1.00 0.17 H new ATOM 0 HA TRP A 115 3.760 2.681 3.812 1.00 0.15 H new ATOM 0 HB2 TRP A 115 2.286 0.777 3.316 1.00 0.15 H new ATOM 0 HB3 TRP A 115 3.975 0.318 3.247 1.00 0.15 H new ATOM 0 HD1 TRP A 115 4.877 -1.378 5.143 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.678 -3.029 6.727 1.00 0.22 H new ATOM 0 HE3 TRP A 115 0.146 0.496 4.744 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 1.068 -3.439 7.661 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.660 -0.586 6.022 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.202 -2.528 7.459 1.00 0.22 H new ATOM 699 N GLU A 116 1.463 3.109 4.823 1.00 0.17 N ATOM 700 CA GLU A 116 0.268 3.588 5.503 1.00 0.20 C ATOM 701 C GLU A 116 -0.967 3.223 4.688 1.00 0.19 C ATOM 702 O GLU A 116 -1.006 3.469 3.483 1.00 0.25 O ATOM 703 CB GLU A 116 0.317 5.113 5.661 1.00 0.32 C ATOM 704 CG GLU A 116 1.624 5.659 6.202 1.00 0.50 C ATOM 705 CD GLU A 116 1.674 7.170 6.120 1.00 0.64 C ATOM 706 OE1 GLU A 116 1.474 7.834 7.158 1.00 1.40 O ATOM 707 OE2 GLU A 116 1.882 7.704 5.009 1.00 1.22 O ATOM 0 H GLU A 116 1.497 3.336 3.829 1.00 0.17 H new ATOM 0 HA GLU A 116 0.222 3.122 6.487 1.00 0.20 H new ATOM 0 HB2 GLU A 116 0.123 5.570 4.691 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -0.491 5.421 6.325 1.00 0.32 H new ATOM 0 HG2 GLU A 116 1.748 5.346 7.239 1.00 0.50 H new ATOM 0 HG3 GLU A 116 2.456 5.236 5.639 1.00 0.50 H new ATOM 714 N LEU A 117 -1.974 2.646 5.325 1.00 0.17 N ATOM 715 CA LEU A 117 -3.235 2.389 4.645 1.00 0.16 C ATOM 716 C LEU A 117 -4.164 3.570 4.842 1.00 0.15 C ATOM 717 O LEU A 117 -4.358 4.035 5.965 1.00 0.19 O ATOM 718 CB LEU A 117 -3.923 1.128 5.154 1.00 0.19 C ATOM 719 CG LEU A 117 -5.268 0.837 4.481 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.074 0.245 3.094 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.111 -0.076 5.345 1.00 0.25 C ATOM 0 H LEU A 117 -1.945 2.350 6.301 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.010 2.243 3.588 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.260 0.277 5.000 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.079 1.220 6.229 1.00 0.19 H new ATOM 0 HG LEU A 117 -5.797 1.783 4.366 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.047 0.050 2.643 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.520 0.948 2.472 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.516 -0.688 3.171 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.062 -0.270 4.849 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -5.584 -1.017 5.501 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.295 0.401 6.308 1.00 0.25 H new ATOM 733 N HIS A 118 -4.731 4.049 3.755 1.00 0.13 N ATOM 734 CA HIS A 118 -5.586 5.219 3.803 1.00 0.14 C ATOM 735 C HIS A 118 -6.994 4.875 3.364 1.00 0.18 C ATOM 736 O HIS A 118 -7.188 4.046 2.472 1.00 0.21 O ATOM 737 CB HIS A 118 -5.024 6.321 2.904 1.00 0.18 C ATOM 738 CG HIS A 118 -3.722 6.886 3.384 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.503 8.235 3.537 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.571 6.279 3.757 1.00 0.24 C ATOM 741 CE1 HIS A 118 -2.280 8.430 3.987 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.691 7.262 4.131 1.00 0.22 N ATOM 0 H HIS A 118 -4.616 3.646 2.825 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.617 5.574 4.833 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.888 5.923 1.898 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.755 7.127 2.832 1.00 0.18 H new ATOM 0 HD1 HIS A 118 -4.181 8.969 3.334 1.00 0.50 H new ATOM 0 HD2 HIS A 118 -2.381 5.216 3.760 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.834 9.390 4.202 1.00 0.45 H new ATOM 751 N LYS A 119 -7.969 5.499 4.002 1.00 0.22 N ATOM 752 CA LYS A 119 -9.348 5.388 3.570 1.00 0.29 C ATOM 753 C LYS A 119 -9.727 6.656 2.822 1.00 0.27 C ATOM 754 O LYS A 119 -10.129 7.656 3.422 1.00 0.43 O ATOM 755 CB LYS A 119 -10.291 5.171 4.754 1.00 0.43 C ATOM 756 CG LYS A 119 -11.732 4.933 4.328 1.00 0.70 C ATOM 757 CD LYS A 119 -12.650 4.720 5.518 1.00 0.84 C ATOM 758 CE LYS A 119 -14.104 4.609 5.081 1.00 1.04 C ATOM 759 NZ LYS A 119 -14.628 5.898 4.552 1.00 1.69 N ATOM 0 H LYS A 119 -7.829 6.089 4.822 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.444 4.521 2.916 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -9.944 4.318 5.336 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -10.250 6.042 5.409 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -12.084 5.786 3.747 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -11.778 4.062 3.675 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -12.357 3.814 6.049 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -12.540 5.549 6.218 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -14.194 3.839 4.315 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -14.713 4.290 5.927 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -15.664 5.846 4.473 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -14.369 6.670 5.199 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -14.218 6.080 3.614 1.00 1.69 H new ATOM 773 N LEU A 120 -9.600 6.606 1.511 1.00 0.23 N ATOM 774 CA LEU A 120 -9.775 7.781 0.686 1.00 0.26 C ATOM 775 C LEU A 120 -11.255 8.052 0.478 1.00 0.34 C ATOM 776 O LEU A 120 -12.042 7.140 0.220 1.00 0.37 O ATOM 777 CB LEU A 120 -9.049 7.622 -0.662 1.00 0.24 C ATOM 778 CG LEU A 120 -7.513 7.530 -0.589 1.00 0.20 C ATOM 779 CD1 LEU A 120 -6.940 8.631 0.292 1.00 0.25 C ATOM 780 CD2 LEU A 120 -7.064 6.162 -0.103 1.00 0.21 C ATOM 0 H LEU A 120 -9.375 5.757 0.993 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.333 8.635 1.198 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.425 6.724 -1.152 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -9.314 8.467 -1.298 1.00 0.24 H new ATOM 0 HG LEU A 120 -7.127 7.669 -1.599 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -5.854 8.542 0.326 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -7.212 9.604 -0.118 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.343 8.537 1.300 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -5.975 6.130 -0.063 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.470 5.978 0.892 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.425 5.396 -0.789 1.00 0.21 H new ATOM 792 N GLU A 121 -11.626 9.316 0.608 1.00 0.46 N ATOM 793 CA GLU A 121 -13.021 9.726 0.541 1.00 0.57 C ATOM 794 C GLU A 121 -13.548 9.656 -0.888 1.00 0.58 C ATOM 795 O GLU A 121 -14.754 9.709 -1.120 1.00 0.69 O ATOM 796 CB GLU A 121 -13.172 11.142 1.096 1.00 0.70 C ATOM 797 CG GLU A 121 -12.761 11.272 2.554 1.00 0.80 C ATOM 798 CD GLU A 121 -12.849 12.695 3.060 1.00 1.63 C ATOM 799 OE1 GLU A 121 -11.800 13.373 3.133 1.00 2.36 O ATOM 800 OE2 GLU A 121 -13.966 13.140 3.390 1.00 2.22 O ATOM 0 H GLU A 121 -10.973 10.084 0.762 1.00 0.46 H new ATOM 0 HA GLU A 121 -13.611 9.039 1.147 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -12.571 11.825 0.496 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -14.211 11.456 0.991 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -13.398 10.633 3.165 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -11.740 10.911 2.673 1.00 0.80 H new ATOM 807 N ASN A 122 -12.635 9.534 -1.839 1.00 0.53 N ATOM 808 CA ASN A 122 -12.991 9.403 -3.243 1.00 0.60 C ATOM 809 C ASN A 122 -11.780 8.911 -4.018 1.00 0.62 C ATOM 810 O ASN A 122 -10.643 9.112 -3.588 1.00 1.22 O ATOM 811 CB ASN A 122 -13.479 10.744 -3.821 1.00 0.73 C ATOM 812 CG ASN A 122 -12.356 11.743 -4.031 1.00 1.03 C ATOM 813 OD1 ASN A 122 -11.731 11.771 -5.088 1.00 1.16 O ATOM 814 ND2 ASN A 122 -12.106 12.582 -3.041 1.00 1.87 N ATOM 0 H ASN A 122 -11.631 9.523 -1.660 1.00 0.53 H new ATOM 0 HA ASN A 122 -13.807 8.686 -3.333 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -13.979 10.563 -4.772 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -14.220 11.175 -3.148 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -11.372 13.284 -3.140 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -12.647 12.528 -2.178 1.00 1.87 H new ATOM 821 N ALA A 123 -12.023 8.251 -5.135 1.00 0.67 N ATOM 822 CA ALA A 123 -10.948 7.805 -6.006 1.00 0.66 C ATOM 823 C ALA A 123 -11.005 8.579 -7.314 1.00 0.71 C ATOM 824 O ALA A 123 -10.701 8.058 -8.385 1.00 0.90 O ATOM 825 CB ALA A 123 -11.045 6.307 -6.247 1.00 0.69 C ATOM 0 H ALA A 123 -12.959 8.010 -5.463 1.00 0.67 H new ATOM 0 HA ALA A 123 -9.988 7.999 -5.527 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -10.233 5.990 -6.901 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -10.971 5.780 -5.296 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -12.001 6.075 -6.717 1.00 0.69 H new ATOM 831 N ARG A 124 -11.415 9.831 -7.204 1.00 0.72 N ATOM 832 CA ARG A 124 -11.575 10.702 -8.357 1.00 0.83 C ATOM 833 C ARG A 124 -10.478 11.758 -8.385 1.00 0.75 C ATOM 834 O ARG A 124 -9.925 12.078 -9.437 1.00 0.86 O ATOM 835 CB ARG A 124 -12.948 11.372 -8.308 1.00 1.08 C ATOM 836 CG ARG A 124 -14.101 10.395 -8.472 1.00 1.37 C ATOM 837 CD ARG A 124 -15.433 11.028 -8.102 1.00 1.63 C ATOM 838 NE ARG A 124 -15.738 12.202 -8.917 1.00 2.28 N ATOM 839 CZ ARG A 124 -16.841 12.934 -8.773 1.00 2.84 C ATOM 840 NH1 ARG A 124 -17.749 12.600 -7.864 1.00 2.76 N ATOM 841 NH2 ARG A 124 -17.040 13.995 -9.541 1.00 3.84 N ATOM 0 H ARG A 124 -11.646 10.273 -6.314 1.00 0.72 H new ATOM 0 HA ARG A 124 -11.499 10.103 -9.264 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -13.056 11.894 -7.357 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -13.005 12.125 -9.094 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -14.138 10.046 -9.504 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -13.928 9.520 -7.846 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -16.227 10.291 -8.220 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -15.417 11.314 -7.050 1.00 1.63 H new ATOM 0 HE ARG A 124 -15.069 12.476 -9.636 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -17.603 11.781 -7.274 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -18.593 13.162 -7.756 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -16.348 14.253 -10.244 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -17.886 14.554 -9.429 1.00 3.84 H new ATOM 855 N LYS A 125 -10.175 12.293 -7.217 1.00 0.75 N ATOM 856 CA LYS A 125 -9.119 13.274 -7.060 1.00 0.68 C ATOM 857 C LYS A 125 -7.827 12.562 -6.704 1.00 0.55 C ATOM 858 O LYS A 125 -7.864 11.418 -6.246 1.00 0.53 O ATOM 859 CB LYS A 125 -9.491 14.263 -5.947 1.00 0.79 C ATOM 860 CG LYS A 125 -10.792 15.015 -6.192 1.00 0.93 C ATOM 861 CD LYS A 125 -10.701 15.927 -7.407 1.00 1.64 C ATOM 862 CE LYS A 125 -9.718 17.068 -7.185 1.00 1.90 C ATOM 863 NZ LYS A 125 -10.079 17.898 -6.004 1.00 2.26 N ATOM 0 H LYS A 125 -10.656 12.058 -6.349 1.00 0.75 H new ATOM 0 HA LYS A 125 -8.988 13.823 -7.993 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -9.570 13.720 -5.005 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -8.683 14.985 -5.832 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -11.603 14.301 -6.334 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -11.040 15.607 -5.311 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -10.393 15.345 -8.276 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -11.687 16.335 -7.630 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -8.716 16.661 -7.048 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -9.688 17.698 -8.074 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -9.563 18.800 -6.043 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -11.102 18.084 -6.010 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -9.824 17.391 -5.132 1.00 2.26 H new ATOM 877 N PRO A 126 -6.670 13.206 -6.925 1.00 0.51 N ATOM 878 CA PRO A 126 -5.385 12.661 -6.500 1.00 0.45 C ATOM 879 C PRO A 126 -5.423 12.298 -5.023 1.00 0.39 C ATOM 880 O PRO A 126 -5.767 13.133 -4.181 1.00 0.47 O ATOM 881 CB PRO A 126 -4.389 13.804 -6.752 1.00 0.51 C ATOM 882 CG PRO A 126 -5.227 15.011 -7.018 1.00 0.59 C ATOM 883 CD PRO A 126 -6.512 14.501 -7.601 1.00 0.60 C ATOM 0 HA PRO A 126 -5.118 11.750 -7.035 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -3.742 13.958 -5.889 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -3.742 13.581 -7.600 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -5.409 15.570 -6.100 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -4.727 15.689 -7.709 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -7.346 15.172 -7.395 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -6.452 14.390 -8.684 1.00 0.60 H new ATOM 891 N LEU A 127 -5.103 11.048 -4.721 1.00 0.32 N ATOM 892 CA LEU A 127 -5.209 10.538 -3.362 1.00 0.26 C ATOM 893 C LEU A 127 -4.366 11.365 -2.405 1.00 0.29 C ATOM 894 O LEU A 127 -3.287 11.848 -2.756 1.00 0.37 O ATOM 895 CB LEU A 127 -4.803 9.065 -3.298 1.00 0.24 C ATOM 896 CG LEU A 127 -5.551 8.130 -4.259 1.00 0.26 C ATOM 897 CD1 LEU A 127 -5.278 6.678 -3.907 1.00 0.26 C ATOM 898 CD2 LEU A 127 -7.050 8.410 -4.251 1.00 0.27 C ATOM 0 H LEU A 127 -4.767 10.366 -5.401 1.00 0.32 H new ATOM 0 HA LEU A 127 -6.252 10.618 -3.056 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -3.735 8.991 -3.505 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -4.956 8.708 -2.279 1.00 0.24 H new ATOM 0 HG LEU A 127 -5.182 8.321 -5.267 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.816 6.029 -4.598 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -4.209 6.480 -3.981 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.613 6.481 -2.889 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -7.551 7.731 -4.942 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -7.443 8.259 -3.246 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -7.229 9.440 -4.560 1.00 0.27 H new ATOM 910 N LYS A 128 -4.871 11.521 -1.197 1.00 0.29 N ATOM 911 CA LYS A 128 -4.282 12.426 -0.230 1.00 0.36 C ATOM 912 C LYS A 128 -3.870 11.702 1.043 1.00 0.26 C ATOM 913 O LYS A 128 -4.499 10.724 1.463 1.00 0.23 O ATOM 914 CB LYS A 128 -5.279 13.532 0.113 1.00 0.51 C ATOM 915 CG LYS A 128 -6.608 13.006 0.632 1.00 1.10 C ATOM 916 CD LYS A 128 -7.556 14.131 1.002 1.00 1.37 C ATOM 917 CE LYS A 128 -8.887 13.586 1.492 1.00 1.80 C ATOM 918 NZ LYS A 128 -9.842 14.668 1.847 1.00 2.27 N ATOM 0 H LYS A 128 -5.697 11.027 -0.859 1.00 0.29 H new ATOM 0 HA LYS A 128 -3.386 12.854 -0.678 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -4.838 14.189 0.863 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -5.458 14.138 -0.775 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -7.071 12.376 -0.128 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -6.433 12.377 1.505 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -7.105 14.750 1.778 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -7.719 14.773 0.136 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -9.326 12.956 0.719 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -8.719 12.952 2.363 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -10.579 14.288 2.475 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -9.334 15.434 2.333 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -10.283 15.039 0.982 1.00 2.27 H new ATOM 932 N ASP A 129 -2.799 12.189 1.640 1.00 0.32 N ATOM 933 CA ASP A 129 -2.334 11.697 2.922 1.00 0.39 C ATOM 934 C ASP A 129 -3.077 12.405 4.047 1.00 0.45 C ATOM 935 O ASP A 129 -3.697 13.447 3.831 1.00 0.51 O ATOM 936 CB ASP A 129 -0.827 11.926 3.069 1.00 0.59 C ATOM 937 CG ASP A 129 -0.463 13.394 3.069 1.00 1.00 C ATOM 938 OD1 ASP A 129 -0.447 14.000 1.981 1.00 1.56 O ATOM 939 OD2 ASP A 129 -0.185 13.946 4.154 1.00 1.88 O ATOM 0 H ASP A 129 -2.227 12.937 1.249 1.00 0.32 H new ATOM 0 HA ASP A 129 -2.531 10.626 2.978 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -0.482 11.469 3.996 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -0.305 11.425 2.254 1.00 0.59 H new ATOM 944 N GLY A 130 -3.018 11.837 5.240 1.00 0.51 N ATOM 945 CA GLY A 130 -3.682 12.440 6.376 1.00 0.62 C ATOM 946 C GLY A 130 -4.675 11.496 7.017 1.00 0.60 C ATOM 947 O GLY A 130 -4.795 11.444 8.241 1.00 0.75 O ATOM 0 H GLY A 130 -2.522 10.969 5.443 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -2.938 12.740 7.114 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -4.197 13.346 6.056 1.00 0.62 H new ATOM 951 N ASN A 131 -5.389 10.751 6.191 1.00 0.47 N ATOM 952 CA ASN A 131 -6.287 9.719 6.678 1.00 0.46 C ATOM 953 C ASN A 131 -5.567 8.379 6.692 1.00 0.40 C ATOM 954 O ASN A 131 -5.315 7.790 5.653 1.00 0.46 O ATOM 955 CB ASN A 131 -7.556 9.645 5.808 1.00 0.51 C ATOM 956 CG ASN A 131 -7.259 9.546 4.316 1.00 1.32 C ATOM 957 OD1 ASN A 131 -7.158 8.456 3.759 1.00 2.28 O ATOM 958 ND2 ASN A 131 -7.107 10.688 3.660 1.00 1.45 N ATOM 0 H ASN A 131 -5.364 10.843 5.175 1.00 0.47 H new ATOM 0 HA ASN A 131 -6.593 9.968 7.694 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -8.147 8.781 6.112 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -8.166 10.529 5.992 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -6.899 10.679 2.661 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -7.198 11.576 4.154 1.00 1.45 H new ATOM 965 N VAL A 132 -5.212 7.908 7.866 1.00 0.36 N ATOM 966 CA VAL A 132 -4.513 6.643 7.974 1.00 0.31 C ATOM 967 C VAL A 132 -5.252 5.709 8.918 1.00 0.28 C ATOM 968 O VAL A 132 -5.732 6.117 9.976 1.00 0.35 O ATOM 969 CB VAL A 132 -3.045 6.828 8.429 1.00 0.35 C ATOM 970 CG1 VAL A 132 -2.970 7.509 9.782 1.00 0.73 C ATOM 971 CG2 VAL A 132 -2.310 5.495 8.460 1.00 0.71 C ATOM 0 H VAL A 132 -5.393 8.376 8.754 1.00 0.36 H new ATOM 0 HA VAL A 132 -4.489 6.196 6.980 1.00 0.31 H new ATOM 0 HB VAL A 132 -2.554 7.472 7.699 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -1.926 7.625 10.074 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -3.441 8.490 9.722 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -3.489 6.902 10.524 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -1.281 5.654 8.783 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -2.809 4.821 9.156 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.313 5.054 7.463 1.00 0.71 H new ATOM 981 N ILE A 133 -5.375 4.463 8.501 1.00 0.23 N ATOM 982 CA ILE A 133 -6.066 3.457 9.281 1.00 0.26 C ATOM 983 C ILE A 133 -5.054 2.502 9.897 1.00 0.28 C ATOM 984 O ILE A 133 -4.960 2.366 11.118 1.00 0.38 O ATOM 985 CB ILE A 133 -7.052 2.661 8.398 1.00 0.31 C ATOM 986 CG1 ILE A 133 -7.958 3.610 7.603 1.00 0.34 C ATOM 987 CG2 ILE A 133 -7.886 1.712 9.243 1.00 0.38 C ATOM 988 CD1 ILE A 133 -8.838 4.493 8.463 1.00 0.35 C ATOM 0 H ILE A 133 -5.000 4.122 7.616 1.00 0.23 H new ATOM 0 HA ILE A 133 -6.629 3.958 10.069 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.471 2.070 7.691 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.336 4.243 6.970 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.591 3.020 6.941 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -8.574 1.162 8.601 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.229 1.010 9.757 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.454 2.283 9.978 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.447 5.133 7.824 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.488 3.870 9.078 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.214 5.112 9.107 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.267 1.879 9.036 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.273 0.910 9.455 1.00 0.30 C ATOM 1002 C GLU A 134 -1.920 1.323 8.905 1.00 0.23 C ATOM 1003 O GLU A 134 -1.848 2.082 7.939 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.622 -0.491 8.945 1.00 0.43 C ATOM 1005 CG GLU A 134 -4.992 -0.993 9.369 1.00 0.63 C ATOM 1006 CD GLU A 134 -5.162 -1.065 10.873 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -4.411 -1.815 11.525 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -6.061 -0.394 11.407 1.00 1.42 O ATOM 0 H GLU A 134 -4.300 2.032 8.028 1.00 0.25 H new ATOM 0 HA GLU A 134 -3.249 0.882 10.544 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -3.570 -0.491 7.856 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -2.866 -1.192 9.300 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -5.757 -0.336 8.954 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -5.157 -1.983 8.943 1.00 0.63 H new ATOM 1015 N LYS A 135 -0.858 0.824 9.508 1.00 0.28 N ATOM 1016 CA LYS A 135 0.490 1.160 9.078 1.00 0.25 C ATOM 1017 C LYS A 135 1.500 0.192 9.670 1.00 0.27 C ATOM 1018 O LYS A 135 1.234 -0.458 10.684 1.00 0.34 O ATOM 1019 CB LYS A 135 0.837 2.595 9.484 1.00 0.32 C ATOM 1020 CG LYS A 135 0.421 2.935 10.901 1.00 0.56 C ATOM 1021 CD LYS A 135 0.906 4.308 11.317 1.00 0.62 C ATOM 1022 CE LYS A 135 0.502 4.622 12.747 1.00 0.74 C ATOM 1023 NZ LYS A 135 0.974 3.580 13.700 1.00 1.53 N ATOM 0 H LYS A 135 -0.901 0.182 10.300 1.00 0.28 H new ATOM 0 HA LYS A 135 0.530 1.081 7.992 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.912 2.744 9.383 1.00 0.32 H new ATOM 0 HB3 LYS A 135 0.353 3.287 8.795 1.00 0.32 H new ATOM 0 HG2 LYS A 135 -0.665 2.894 10.980 1.00 0.56 H new ATOM 0 HG3 LYS A 135 0.819 2.186 11.586 1.00 0.56 H new ATOM 0 HD2 LYS A 135 1.991 4.357 11.223 1.00 0.62 H new ATOM 0 HD3 LYS A 135 0.494 5.061 10.646 1.00 0.62 H new ATOM 0 HE2 LYS A 135 0.912 5.590 13.036 1.00 0.74 H new ATOM 0 HE3 LYS A 135 -0.583 4.704 12.808 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 0.924 3.949 14.671 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 0.371 2.737 13.619 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 1.957 3.325 13.477 1.00 1.53 H new ATOM 1037 N GLY A 136 2.649 0.095 9.024 1.00 0.30 N ATOM 1038 CA GLY A 136 3.696 -0.781 9.501 1.00 0.38 C ATOM 1039 C GLY A 136 4.870 -0.823 8.553 1.00 0.34 C ATOM 1040 O GLY A 136 5.204 0.187 7.928 1.00 0.29 O ATOM 0 H GLY A 136 2.877 0.610 8.173 1.00 0.30 H new ATOM 0 HA2 GLY A 136 4.033 -0.444 10.481 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.297 -1.787 9.630 1.00 0.38 H new ATOM 1044 N PHE A 137 5.482 -1.993 8.424 1.00 0.38 N ATOM 1045 CA PHE A 137 6.641 -2.158 7.562 1.00 0.32 C ATOM 1046 C PHE A 137 6.385 -3.227 6.501 1.00 0.33 C ATOM 1047 O PHE A 137 5.594 -4.148 6.705 1.00 0.46 O ATOM 1048 CB PHE A 137 7.876 -2.512 8.393 1.00 0.42 C ATOM 1049 CG PHE A 137 8.307 -1.404 9.314 1.00 1.07 C ATOM 1050 CD1 PHE A 137 8.136 -1.510 10.685 1.00 2.05 C ATOM 1051 CD2 PHE A 137 8.878 -0.249 8.801 1.00 1.81 C ATOM 1052 CE1 PHE A 137 8.528 -0.486 11.526 1.00 2.86 C ATOM 1053 CE2 PHE A 137 9.272 0.775 9.637 1.00 2.60 C ATOM 1054 CZ PHE A 137 9.096 0.657 11.001 1.00 2.93 C ATOM 0 H PHE A 137 5.193 -2.843 8.908 1.00 0.38 H new ATOM 0 HA PHE A 137 6.823 -1.212 7.051 1.00 0.32 H new ATOM 0 HB2 PHE A 137 7.666 -3.405 8.982 1.00 0.42 H new ATOM 0 HB3 PHE A 137 8.699 -2.759 7.722 1.00 0.42 H new ATOM 0 HD1 PHE A 137 7.692 -2.402 11.101 1.00 2.05 H new ATOM 0 HD2 PHE A 137 9.016 -0.150 7.734 1.00 1.81 H new ATOM 0 HE1 PHE A 137 8.390 -0.580 12.593 1.00 2.86 H new ATOM 0 HE2 PHE A 137 9.718 1.668 9.225 1.00 2.60 H new ATOM 0 HZ PHE A 137 9.403 1.458 11.657 1.00 2.93 H new ATOM 1064 N VAL A 138 7.059 -3.087 5.368 1.00 0.27 N ATOM 1065 CA VAL A 138 6.841 -3.952 4.209 1.00 0.41 C ATOM 1066 C VAL A 138 7.626 -5.264 4.319 1.00 0.70 C ATOM 1067 O VAL A 138 7.524 -6.130 3.454 1.00 1.41 O ATOM 1068 CB VAL A 138 7.206 -3.220 2.889 1.00 0.53 C ATOM 1069 CG1 VAL A 138 6.835 -4.046 1.669 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.520 -1.865 2.816 1.00 0.48 C ATOM 0 H VAL A 138 7.772 -2.372 5.223 1.00 0.27 H new ATOM 0 HA VAL A 138 5.779 -4.197 4.192 1.00 0.41 H new ATOM 0 HB VAL A 138 8.286 -3.076 2.890 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.106 -3.501 0.765 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.371 -4.995 1.695 1.00 0.76 H new ATOM 0 HG13 VAL A 138 5.762 -4.236 1.671 1.00 0.76 H new ATOM 0 HG21 VAL A 138 6.790 -1.370 1.883 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.439 -2.002 2.855 1.00 0.48 H new ATOM 0 HG23 VAL A 138 6.838 -1.250 3.658 1.00 0.48 H new ATOM 1080 N SER A 139 8.409 -5.401 5.383 1.00 0.32 N ATOM 1081 CA SER A 139 9.271 -6.567 5.580 1.00 0.51 C ATOM 1082 C SER A 139 8.485 -7.878 5.751 1.00 0.39 C ATOM 1083 O SER A 139 8.404 -8.435 6.846 1.00 1.13 O ATOM 1084 CB SER A 139 10.168 -6.334 6.793 1.00 1.03 C ATOM 1085 OG SER A 139 10.964 -5.175 6.614 1.00 1.68 O ATOM 0 H SER A 139 8.466 -4.711 6.132 1.00 0.32 H new ATOM 0 HA SER A 139 9.871 -6.681 4.677 1.00 0.51 H new ATOM 0 HB2 SER A 139 9.556 -6.226 7.688 1.00 1.03 H new ATOM 0 HB3 SER A 139 10.810 -7.201 6.949 1.00 1.03 H new ATOM 0 HG SER A 139 11.912 -5.420 6.651 1.00 1.68 H new ATOM 1091 N ASN A 140 7.909 -8.353 4.657 1.00 0.51 N ATOM 1092 CA ASN A 140 7.282 -9.666 4.592 1.00 0.34 C ATOM 1093 C ASN A 140 7.654 -10.315 3.266 1.00 0.27 C ATOM 1094 O ASN A 140 7.130 -9.948 2.212 1.00 0.37 O ATOM 1095 CB ASN A 140 5.756 -9.562 4.720 1.00 0.37 C ATOM 1096 CG ASN A 140 5.060 -10.913 4.631 1.00 0.38 C ATOM 1097 OD1 ASN A 140 3.948 -11.015 4.112 1.00 0.94 O ATOM 1098 ND2 ASN A 140 5.691 -11.957 5.149 1.00 0.88 N ATOM 0 H ASN A 140 7.863 -7.833 3.781 1.00 0.51 H new ATOM 0 HA ASN A 140 7.639 -10.274 5.423 1.00 0.34 H new ATOM 0 HB2 ASN A 140 5.508 -9.093 5.672 1.00 0.37 H new ATOM 0 HB3 ASN A 140 5.374 -8.910 3.934 1.00 0.37 H new ATOM 0 HD21 ASN A 140 5.256 -12.879 5.125 1.00 0.88 H new ATOM 0 HD22 ASN A 140 6.612 -11.838 5.572 1.00 0.88 H new ATOM 1105 N GLN A 141 8.575 -11.261 3.324 1.00 0.35 N ATOM 1106 CA GLN A 141 9.138 -11.860 2.126 1.00 0.32 C ATOM 1107 C GLN A 141 8.265 -13.013 1.635 1.00 0.30 C ATOM 1108 O GLN A 141 8.468 -14.163 2.024 1.00 0.36 O ATOM 1109 CB GLN A 141 10.554 -12.368 2.418 1.00 0.39 C ATOM 1110 CG GLN A 141 11.403 -12.575 1.175 1.00 0.39 C ATOM 1111 CD GLN A 141 11.937 -11.269 0.617 1.00 0.52 C ATOM 1112 OE1 GLN A 141 13.032 -10.834 0.971 1.00 0.69 O ATOM 1113 NE2 GLN A 141 11.169 -10.631 -0.253 1.00 0.63 N ATOM 0 H GLN A 141 8.952 -11.634 4.196 1.00 0.35 H new ATOM 0 HA GLN A 141 9.178 -11.101 1.345 1.00 0.32 H new ATOM 0 HB2 GLN A 141 11.056 -11.657 3.075 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.486 -13.311 2.961 1.00 0.39 H new ATOM 0 HG2 GLN A 141 12.238 -13.234 1.414 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.809 -13.078 0.412 1.00 0.39 H new ATOM 0 HE21 GLN A 141 10.267 -11.024 -0.522 1.00 0.63 H new ATOM 0 HE22 GLN A 141 11.479 -9.746 -0.655 1.00 0.63 H new ATOM 1122 N ILE A 142 7.290 -12.705 0.790 1.00 0.25 N ATOM 1123 CA ILE A 142 6.431 -13.739 0.216 1.00 0.27 C ATOM 1124 C ILE A 142 7.106 -14.397 -0.982 1.00 0.30 C ATOM 1125 O ILE A 142 6.665 -15.439 -1.471 1.00 0.37 O ATOM 1126 CB ILE A 142 5.054 -13.189 -0.216 1.00 0.27 C ATOM 1127 CG1 ILE A 142 5.207 -12.074 -1.256 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.290 -12.689 1.000 1.00 0.29 C ATOM 1129 CD1 ILE A 142 3.915 -11.723 -1.962 1.00 0.26 C ATOM 0 H ILE A 142 7.073 -11.756 0.487 1.00 0.25 H new ATOM 0 HA ILE A 142 6.269 -14.477 1.002 1.00 0.27 H new ATOM 0 HB ILE A 142 4.489 -13.998 -0.679 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.597 -11.182 -0.766 1.00 0.24 H new ATOM 0 HG13 ILE A 142 5.945 -12.379 -1.998 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.320 -12.303 0.687 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.144 -13.511 1.701 1.00 0.29 H new ATOM 0 HG23 ILE A 142 4.857 -11.895 1.485 1.00 0.29 H new ATOM 0 HD11 ILE A 142 4.099 -10.927 -2.683 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.534 -12.602 -2.481 1.00 0.26 H new ATOM 0 HD13 ILE A 142 3.180 -11.387 -1.230 1.00 0.26 H new ATOM 1141 N GLY A 143 8.167 -13.767 -1.454 1.00 0.28 N ATOM 1142 CA GLY A 143 8.967 -14.330 -2.516 1.00 0.34 C ATOM 1143 C GLY A 143 10.377 -13.807 -2.440 1.00 0.40 C ATOM 1144 O GLY A 143 10.603 -12.771 -1.823 1.00 0.53 O ATOM 0 H GLY A 143 8.492 -12.862 -1.114 1.00 0.28 H new ATOM 0 HA2 GLY A 143 8.970 -15.417 -2.441 1.00 0.34 H new ATOM 0 HA3 GLY A 143 8.530 -14.079 -3.482 1.00 0.34 H new ATOM 1148 N ASP A 144 11.318 -14.501 -3.070 1.00 0.48 N ATOM 1149 CA ASP A 144 12.736 -14.142 -2.981 1.00 0.56 C ATOM 1150 C ASP A 144 12.974 -12.687 -3.373 1.00 0.48 C ATOM 1151 O ASP A 144 13.892 -12.040 -2.865 1.00 0.56 O ATOM 1152 CB ASP A 144 13.588 -15.063 -3.859 1.00 0.70 C ATOM 1153 CG ASP A 144 13.737 -16.456 -3.280 1.00 1.63 C ATOM 1154 OD1 ASP A 144 14.652 -16.668 -2.454 1.00 2.49 O ATOM 1155 OD2 ASP A 144 12.944 -17.348 -3.648 1.00 2.30 O ATOM 0 H ASP A 144 11.128 -15.318 -3.650 1.00 0.48 H new ATOM 0 HA ASP A 144 13.034 -14.267 -1.940 1.00 0.56 H new ATOM 0 HB2 ASP A 144 13.137 -15.133 -4.849 1.00 0.70 H new ATOM 0 HB3 ASP A 144 14.576 -14.621 -3.989 1.00 0.70 H new ATOM 1160 N SER A 145 12.144 -12.179 -4.268 1.00 0.38 N ATOM 1161 CA SER A 145 12.216 -10.785 -4.674 1.00 0.35 C ATOM 1162 C SER A 145 10.831 -10.145 -4.637 1.00 0.31 C ATOM 1163 O SER A 145 10.506 -9.291 -5.460 1.00 0.36 O ATOM 1164 CB SER A 145 12.808 -10.678 -6.080 1.00 0.38 C ATOM 1165 OG SER A 145 14.073 -11.317 -6.147 1.00 1.08 O ATOM 0 H SER A 145 11.409 -12.714 -4.730 1.00 0.38 H new ATOM 0 HA SER A 145 12.862 -10.253 -3.976 1.00 0.35 H new ATOM 0 HB2 SER A 145 12.128 -11.132 -6.801 1.00 0.38 H new ATOM 0 HB3 SER A 145 12.911 -9.629 -6.357 1.00 0.38 H new ATOM 0 HG SER A 145 14.432 -11.237 -7.055 1.00 1.08 H new ATOM 1171 N LEU A 146 10.015 -10.549 -3.673 1.00 0.27 N ATOM 1172 CA LEU A 146 8.651 -10.056 -3.591 1.00 0.22 C ATOM 1173 C LEU A 146 8.241 -9.835 -2.138 1.00 0.21 C ATOM 1174 O LEU A 146 8.441 -10.706 -1.287 1.00 0.23 O ATOM 1175 CB LEU A 146 7.706 -11.051 -4.260 1.00 0.23 C ATOM 1176 CG LEU A 146 6.362 -10.487 -4.710 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.561 -9.419 -5.772 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.474 -11.602 -5.234 1.00 0.27 C ATOM 0 H LEU A 146 10.273 -11.212 -2.942 1.00 0.27 H new ATOM 0 HA LEU A 146 8.593 -9.099 -4.109 1.00 0.22 H new ATOM 0 HB2 LEU A 146 8.210 -11.475 -5.128 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.521 -11.871 -3.566 1.00 0.23 H new ATOM 0 HG LEU A 146 5.872 -10.027 -3.851 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.592 -9.028 -6.081 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.166 -8.609 -5.364 1.00 0.26 H new ATOM 0 HD13 LEU A 146 7.069 -9.853 -6.634 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.518 -11.187 -5.552 1.00 0.27 H new ATOM 0 HD22 LEU A 146 5.959 -12.086 -6.082 1.00 0.27 H new ATOM 0 HD23 LEU A 146 5.307 -12.335 -4.445 1.00 0.27 H new ATOM 1190 N TYR A 147 7.688 -8.663 -1.860 1.00 0.18 N ATOM 1191 CA TYR A 147 7.222 -8.321 -0.523 1.00 0.18 C ATOM 1192 C TYR A 147 5.720 -8.082 -0.530 1.00 0.16 C ATOM 1193 O TYR A 147 5.136 -7.784 -1.572 1.00 0.19 O ATOM 1194 CB TYR A 147 7.932 -7.070 -0.004 1.00 0.19 C ATOM 1195 CG TYR A 147 9.373 -7.289 0.402 1.00 0.23 C ATOM 1196 CD1 TYR A 147 10.404 -7.181 -0.522 1.00 1.21 C ATOM 1197 CD2 TYR A 147 9.702 -7.592 1.717 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.719 -7.368 -0.146 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.014 -7.782 2.100 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.018 -7.668 1.164 1.00 0.36 C ATOM 1201 OH TYR A 147 13.328 -7.853 1.539 1.00 0.43 O ATOM 0 H TYR A 147 7.550 -7.925 -2.551 1.00 0.18 H new ATOM 0 HA TYR A 147 7.452 -9.158 0.136 1.00 0.18 H new ATOM 0 HB2 TYR A 147 7.898 -6.302 -0.776 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.381 -6.684 0.854 1.00 0.19 H new ATOM 0 HD1 TYR A 147 10.173 -6.947 -1.551 1.00 1.21 H new ATOM 0 HD2 TYR A 147 8.917 -7.680 2.453 1.00 1.10 H new ATOM 0 HE1 TYR A 147 12.510 -7.279 -0.876 1.00 1.24 H new ATOM 0 HE2 TYR A 147 11.252 -8.018 3.127 1.00 1.10 H new ATOM 0 HH TYR A 147 13.565 -8.799 1.445 1.00 0.43 H new ATOM 1211 N LYS A 148 5.101 -8.204 0.634 1.00 0.17 N ATOM 1212 CA LYS A 148 3.662 -8.030 0.754 1.00 0.18 C ATOM 1213 C LYS A 148 3.303 -7.356 2.076 1.00 0.19 C ATOM 1214 O LYS A 148 3.966 -7.563 3.094 1.00 0.28 O ATOM 1215 CB LYS A 148 2.972 -9.391 0.649 1.00 0.26 C ATOM 1216 CG LYS A 148 1.457 -9.348 0.777 1.00 0.34 C ATOM 1217 CD LYS A 148 0.865 -10.742 0.671 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.590 -10.771 1.113 1.00 0.62 C ATOM 1219 NZ LYS A 148 -1.140 -12.152 1.131 1.00 0.84 N ATOM 0 H LYS A 148 5.574 -8.423 1.511 1.00 0.17 H new ATOM 0 HA LYS A 148 3.319 -7.386 -0.056 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.229 -9.840 -0.310 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.370 -10.045 1.424 1.00 0.26 H new ATOM 0 HG2 LYS A 148 1.181 -8.903 1.733 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.040 -8.711 -0.003 1.00 0.34 H new ATOM 0 HD2 LYS A 148 0.939 -11.091 -0.359 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.445 -11.431 1.284 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -0.675 -10.334 2.108 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -1.185 -10.153 0.441 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -1.826 -12.242 1.907 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -1.613 -12.349 0.226 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.366 -12.832 1.272 1.00 0.84 H new ATOM 1233 N ILE A 149 2.267 -6.536 2.042 1.00 0.15 N ATOM 1234 CA ILE A 149 1.752 -5.881 3.234 1.00 0.18 C ATOM 1235 C ILE A 149 0.245 -6.065 3.327 1.00 0.22 C ATOM 1236 O ILE A 149 -0.454 -5.920 2.329 1.00 0.35 O ATOM 1237 CB ILE A 149 2.095 -4.377 3.247 1.00 0.18 C ATOM 1238 CG1 ILE A 149 1.747 -3.718 1.906 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.562 -4.189 3.567 1.00 0.19 C ATOM 1240 CD1 ILE A 149 2.056 -2.238 1.858 1.00 0.20 C ATOM 0 H ILE A 149 1.759 -6.305 1.188 1.00 0.15 H new ATOM 0 HA ILE A 149 2.229 -6.345 4.097 1.00 0.18 H new ATOM 0 HB ILE A 149 1.497 -3.893 4.019 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.297 -4.221 1.110 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.686 -3.866 1.703 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.799 -3.125 3.575 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.779 -4.616 4.546 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.166 -4.690 2.811 1.00 0.19 H new ATOM 0 HD11 ILE A 149 1.784 -1.841 0.880 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.486 -1.722 2.631 1.00 0.20 H new ATOM 0 HD13 ILE A 149 3.121 -2.083 2.029 1.00 0.20 H new ATOM 1252 N GLU A 150 -0.244 -6.399 4.514 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.667 -6.651 4.713 1.00 0.27 C ATOM 1254 C GLU A 150 -2.229 -5.761 5.809 1.00 0.24 C ATOM 1255 O GLU A 150 -1.494 -5.263 6.663 1.00 0.31 O ATOM 1256 CB GLU A 150 -1.914 -8.114 5.085 1.00 0.40 C ATOM 1257 CG GLU A 150 -1.452 -9.107 4.037 1.00 1.08 C ATOM 1258 CD GLU A 150 -1.912 -10.518 4.329 1.00 1.55 C ATOM 1259 OE1 GLU A 150 -1.420 -11.123 5.303 1.00 2.03 O ATOM 1260 OE2 GLU A 150 -2.761 -11.037 3.579 1.00 2.30 O ATOM 0 H GLU A 150 0.324 -6.502 5.355 1.00 0.24 H new ATOM 0 HA GLU A 150 -2.171 -6.426 3.773 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -1.404 -8.330 6.024 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -2.980 -8.258 5.261 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -1.828 -8.801 3.061 1.00 1.08 H new ATOM 0 HG3 GLU A 150 -0.364 -9.088 3.979 1.00 1.08 H new ATOM 1267 N THR A 151 -3.537 -5.562 5.774 1.00 0.21 N ATOM 1268 CA THR A 151 -4.223 -4.825 6.814 1.00 0.23 C ATOM 1269 C THR A 151 -4.463 -5.723 8.024 1.00 0.24 C ATOM 1270 O THR A 151 -4.788 -6.902 7.879 1.00 0.27 O ATOM 1271 CB THR A 151 -5.561 -4.257 6.301 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.446 -5.318 5.914 1.00 0.25 O ATOM 1273 CG2 THR A 151 -5.326 -3.343 5.114 1.00 0.29 C ATOM 0 H THR A 151 -4.145 -5.905 5.030 1.00 0.21 H new ATOM 0 HA THR A 151 -3.590 -3.988 7.110 1.00 0.23 H new ATOM 0 HB THR A 151 -6.018 -3.688 7.111 1.00 0.25 H new ATOM 0 HG1 THR A 151 -7.135 -5.436 6.600 1.00 0.25 H new ATOM 0 HG21 THR A 151 -6.280 -2.950 4.763 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.681 -2.517 5.413 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.848 -3.905 4.311 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.292 -5.152 9.213 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.372 -5.908 10.463 1.00 0.38 C ATOM 1283 C LYS A 152 -5.799 -6.390 10.744 1.00 0.39 C ATOM 1284 O LYS A 152 -6.015 -7.269 11.578 1.00 0.51 O ATOM 1285 CB LYS A 152 -3.854 -5.040 11.618 1.00 0.48 C ATOM 1286 CG LYS A 152 -3.778 -5.755 12.961 1.00 0.80 C ATOM 1287 CD LYS A 152 -3.053 -4.919 14.005 1.00 1.02 C ATOM 1288 CE LYS A 152 -3.745 -3.589 14.244 1.00 1.99 C ATOM 1289 NZ LYS A 152 -3.013 -2.742 15.220 1.00 2.42 N ATOM 0 H LYS A 152 -4.095 -4.159 9.339 1.00 0.31 H new ATOM 0 HA LYS A 152 -3.748 -6.797 10.369 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -2.861 -4.670 11.361 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.502 -4.169 11.720 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -4.786 -5.980 13.311 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -3.264 -6.708 12.837 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -2.999 -5.474 14.942 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -2.028 -4.742 13.680 1.00 1.02 H new ATOM 0 HE2 LYS A 152 -3.837 -3.054 13.299 1.00 1.99 H new ATOM 0 HE3 LYS A 152 -4.757 -3.768 14.608 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 -3.522 -1.845 15.351 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 -2.947 -3.240 16.131 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 -2.056 -2.548 14.862 1.00 2.42 H new ATOM 1303 N LYS A 153 -6.767 -5.818 10.044 1.00 0.37 N ATOM 1304 CA LYS A 153 -8.156 -6.231 10.183 1.00 0.43 C ATOM 1305 C LYS A 153 -8.852 -6.186 8.827 1.00 0.40 C ATOM 1306 O LYS A 153 -8.376 -5.526 7.897 1.00 0.40 O ATOM 1307 CB LYS A 153 -8.894 -5.327 11.179 1.00 0.51 C ATOM 1308 CG LYS A 153 -9.119 -3.908 10.678 1.00 0.57 C ATOM 1309 CD LYS A 153 -9.986 -3.110 11.639 1.00 0.66 C ATOM 1310 CE LYS A 153 -10.294 -1.725 11.095 1.00 0.69 C ATOM 1311 NZ LYS A 153 -11.175 -0.950 12.007 1.00 1.29 N ATOM 0 H LYS A 153 -6.616 -5.065 9.373 1.00 0.37 H new ATOM 0 HA LYS A 153 -8.175 -7.253 10.563 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -9.859 -5.775 11.415 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.326 -5.287 12.108 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -8.158 -3.409 10.552 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -9.593 -3.938 9.697 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -10.918 -3.646 11.820 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -9.478 -3.020 12.599 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -9.362 -1.180 10.942 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -10.773 -1.817 10.120 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -11.360 -0.012 11.597 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -12.075 -1.456 12.133 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -10.708 -0.839 12.930 1.00 1.29 H new ATOM 1325 N LYS A 154 -9.964 -6.902 8.715 1.00 0.43 N ATOM 1326 CA LYS A 154 -10.777 -6.867 7.510 1.00 0.44 C ATOM 1327 C LYS A 154 -11.565 -5.569 7.468 1.00 0.53 C ATOM 1328 O LYS A 154 -12.386 -5.297 8.344 1.00 0.67 O ATOM 1329 CB LYS A 154 -11.711 -8.078 7.453 1.00 0.44 C ATOM 1330 CG LYS A 154 -10.966 -9.401 7.353 1.00 0.47 C ATOM 1331 CD LYS A 154 -11.914 -10.577 7.193 1.00 0.54 C ATOM 1332 CE LYS A 154 -11.148 -11.881 7.028 1.00 0.66 C ATOM 1333 NZ LYS A 154 -12.051 -13.044 6.824 1.00 1.41 N ATOM 0 H LYS A 154 -10.323 -7.515 9.447 1.00 0.43 H new ATOM 0 HA LYS A 154 -10.126 -6.912 6.637 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.339 -8.088 8.344 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.376 -7.976 6.595 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -10.282 -9.369 6.505 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -10.359 -9.544 8.247 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -12.566 -10.643 8.064 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -12.555 -10.416 6.326 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -10.470 -11.797 6.178 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -10.532 -12.052 7.911 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -11.484 -13.909 6.717 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -12.681 -13.143 7.646 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -12.621 -12.895 5.967 1.00 1.41 H new ATOM 1347 N MET A 155 -11.302 -4.774 6.444 1.00 0.61 N ATOM 1348 CA MET A 155 -11.779 -3.399 6.384 1.00 0.76 C ATOM 1349 C MET A 155 -13.278 -3.287 6.167 1.00 0.62 C ATOM 1350 O MET A 155 -13.910 -4.142 5.539 1.00 0.57 O ATOM 1351 CB MET A 155 -11.033 -2.639 5.292 1.00 1.01 C ATOM 1352 CG MET A 155 -9.594 -2.360 5.666 1.00 1.22 C ATOM 1353 SD MET A 155 -9.475 -1.384 7.177 1.00 0.95 S ATOM 1354 CE MET A 155 -7.833 -1.818 7.721 1.00 0.80 C ATOM 0 H MET A 155 -10.754 -5.061 5.633 1.00 0.61 H new ATOM 0 HA MET A 155 -11.576 -2.956 7.359 1.00 0.76 H new ATOM 0 HB2 MET A 155 -11.060 -3.216 4.368 1.00 1.01 H new ATOM 0 HB3 MET A 155 -11.544 -1.697 5.095 1.00 1.01 H new ATOM 0 HG2 MET A 155 -9.063 -3.303 5.799 1.00 1.22 H new ATOM 0 HG3 MET A 155 -9.102 -1.830 4.851 1.00 1.22 H new ATOM 0 HE1 MET A 155 -7.427 -1.011 8.331 1.00 0.80 H new ATOM 0 HE2 MET A 155 -7.875 -2.733 8.312 1.00 0.80 H new ATOM 0 HE3 MET A 155 -7.192 -1.975 6.854 1.00 0.80 H new ATOM 1364 N LYS A 156 -13.831 -2.221 6.729 1.00 0.65 N ATOM 1365 CA LYS A 156 -15.225 -1.861 6.543 1.00 0.59 C ATOM 1366 C LYS A 156 -15.378 -1.136 5.208 1.00 0.44 C ATOM 1367 O LYS A 156 -14.379 -0.683 4.648 1.00 0.42 O ATOM 1368 CB LYS A 156 -15.677 -0.959 7.699 1.00 0.72 C ATOM 1369 CG LYS A 156 -15.508 -1.589 9.076 1.00 1.28 C ATOM 1370 CD LYS A 156 -16.472 -2.746 9.300 1.00 1.79 C ATOM 1371 CE LYS A 156 -17.915 -2.267 9.353 1.00 2.54 C ATOM 1372 NZ LYS A 156 -18.863 -3.379 9.622 1.00 3.40 N ATOM 0 H LYS A 156 -13.318 -1.578 7.332 1.00 0.65 H new ATOM 0 HA LYS A 156 -15.846 -2.756 6.535 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -15.110 -0.029 7.664 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -16.726 -0.699 7.555 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -14.484 -1.945 9.188 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -15.668 -0.831 9.843 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -16.359 -3.476 8.498 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -16.222 -3.254 10.231 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -18.017 -1.509 10.129 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -18.174 -1.791 8.407 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -19.834 -3.008 9.650 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -18.786 -4.091 8.868 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -18.634 -3.817 10.537 1.00 3.40 H new ATOM 1386 N PRO A 157 -16.611 -1.015 4.680 1.00 0.46 N ATOM 1387 CA PRO A 157 -16.857 -0.386 3.374 1.00 0.41 C ATOM 1388 C PRO A 157 -16.167 0.969 3.204 1.00 0.37 C ATOM 1389 O PRO A 157 -16.098 1.773 4.138 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.373 -0.208 3.342 1.00 0.52 C ATOM 1391 CG PRO A 157 -18.900 -1.275 4.233 1.00 0.63 C ATOM 1392 CD PRO A 157 -17.862 -1.490 5.302 1.00 0.63 C ATOM 0 HA PRO A 157 -16.457 -0.999 2.567 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.663 0.781 3.696 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -18.762 -0.311 2.329 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -19.853 -0.979 4.671 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -19.078 -2.194 3.675 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -18.097 -0.929 6.206 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -17.793 -2.540 5.587 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.663 1.209 2.002 1.00 0.32 N ATOM 1401 CA GLY A 158 -15.007 2.460 1.698 1.00 0.33 C ATOM 1402 C GLY A 158 -13.944 2.294 0.634 1.00 0.27 C ATOM 1403 O GLY A 158 -13.787 1.211 0.071 1.00 0.27 O ATOM 0 H GLY A 158 -15.699 0.549 1.225 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.747 3.186 1.362 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.554 2.862 2.604 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.214 3.361 0.360 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.142 3.323 -0.620 1.00 0.26 C ATOM 1409 C ILE A 159 -10.810 3.314 0.103 1.00 0.21 C ATOM 1410 O ILE A 159 -10.565 4.159 0.957 1.00 0.24 O ATOM 1411 CB ILE A 159 -12.198 4.535 -1.573 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.600 4.669 -2.174 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -11.149 4.399 -2.671 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.763 5.864 -3.081 1.00 0.44 C ATOM 0 H ILE A 159 -13.345 4.269 0.805 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.259 2.420 -1.218 1.00 0.26 H new ATOM 0 HB ILE A 159 -11.978 5.439 -1.005 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.832 3.764 -2.736 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.327 4.737 -1.365 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -11.202 5.262 -3.334 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -10.157 4.347 -2.222 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -11.336 3.490 -3.243 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.782 5.891 -3.468 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.564 6.777 -2.520 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -13.061 5.789 -3.912 1.00 0.44 H new ATOM 1426 N TYR A 160 -9.963 2.356 -0.211 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.699 2.231 0.489 1.00 0.17 C ATOM 1428 C TYR A 160 -7.540 2.167 -0.489 1.00 0.16 C ATOM 1429 O TYR A 160 -7.699 1.731 -1.627 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.699 0.990 1.389 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.722 1.040 2.510 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -9.359 1.413 3.799 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -11.053 0.714 2.276 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -10.292 1.458 4.818 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -11.988 0.759 3.290 1.00 1.24 C ATOM 1436 CZ TYR A 160 -11.603 1.132 4.557 1.00 0.35 C ATOM 1437 OH TYR A 160 -12.537 1.181 5.569 1.00 0.43 O ATOM 0 H TYR A 160 -10.123 1.659 -0.938 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.574 3.116 1.113 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -8.890 0.109 0.776 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.706 0.868 1.822 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -8.331 1.672 4.008 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -11.361 0.420 1.283 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -9.993 1.748 5.815 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -13.018 0.502 3.090 1.00 1.24 H new ATOM 0 HH TYR A 160 -13.270 0.563 5.368 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.385 2.619 -0.036 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.168 2.560 -0.825 1.00 0.14 C ATOM 1449 C ALA A 161 -3.955 2.562 0.092 1.00 0.14 C ATOM 1450 O ALA A 161 -4.016 3.072 1.215 1.00 0.14 O ATOM 1451 CB ALA A 161 -5.101 3.727 -1.797 1.00 0.14 C ATOM 0 H ALA A 161 -6.264 3.036 0.887 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.172 1.636 -1.404 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.181 3.664 -2.379 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -5.958 3.690 -2.469 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -5.115 4.665 -1.241 1.00 0.14 H new ATOM 1457 N PHE A 162 -2.867 1.985 -0.382 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.637 1.917 0.386 1.00 0.15 C ATOM 1459 C PHE A 162 -0.678 3.010 -0.049 1.00 0.15 C ATOM 1460 O PHE A 162 -0.396 3.166 -1.236 1.00 0.15 O ATOM 1461 CB PHE A 162 -0.968 0.551 0.222 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.700 -0.573 0.903 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -1.434 -0.885 2.226 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -2.648 -1.320 0.222 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -2.096 -1.920 2.857 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -3.313 -2.355 0.848 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.038 -2.656 2.167 1.00 0.24 C ATOM 0 H PHE A 162 -2.810 1.553 -1.304 1.00 0.14 H new ATOM 0 HA PHE A 162 -1.890 2.060 1.437 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -0.883 0.325 -0.841 1.00 0.17 H new ATOM 0 HB3 PHE A 162 0.046 0.604 0.619 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -0.699 -0.311 2.771 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -2.869 -1.090 -0.810 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -1.877 -2.153 3.889 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -4.049 -2.930 0.306 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.559 -3.465 2.658 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.192 3.763 0.920 1.00 0.16 N ATOM 1478 CA LYS A 163 0.763 4.825 0.667 1.00 0.18 C ATOM 1479 C LYS A 163 2.133 4.415 1.185 1.00 0.20 C ATOM 1480 O LYS A 163 2.412 4.517 2.382 1.00 0.23 O ATOM 1481 CB LYS A 163 0.307 6.126 1.347 1.00 0.23 C ATOM 1482 CG LYS A 163 1.287 7.287 1.197 1.00 0.31 C ATOM 1483 CD LYS A 163 0.771 8.538 1.905 1.00 0.45 C ATOM 1484 CE LYS A 163 1.866 9.578 2.101 1.00 0.74 C ATOM 1485 NZ LYS A 163 2.957 9.071 2.971 1.00 1.28 N ATOM 0 H LYS A 163 -0.447 3.656 1.902 1.00 0.16 H new ATOM 0 HA LYS A 163 0.824 4.999 -0.407 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.656 6.422 0.931 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.150 5.932 2.408 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.255 7.005 1.610 1.00 0.31 H new ATOM 0 HG3 LYS A 163 1.442 7.502 0.140 1.00 0.31 H new ATOM 0 HD2 LYS A 163 -0.042 8.973 1.324 1.00 0.45 H new ATOM 0 HD3 LYS A 163 0.357 8.261 2.875 1.00 0.45 H new ATOM 0 HE2 LYS A 163 2.276 9.862 1.132 1.00 0.74 H new ATOM 0 HE3 LYS A 163 1.438 10.478 2.542 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 3.505 9.873 3.343 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 2.549 8.534 3.762 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 3.582 8.451 2.418 1.00 1.28 H new ATOM 1499 N VAL A 164 2.972 3.925 0.292 1.00 0.22 N ATOM 1500 CA VAL A 164 4.330 3.555 0.656 1.00 0.26 C ATOM 1501 C VAL A 164 5.278 4.638 0.158 1.00 0.33 C ATOM 1502 O VAL A 164 4.997 5.291 -0.849 1.00 0.34 O ATOM 1503 CB VAL A 164 4.734 2.170 0.078 1.00 0.28 C ATOM 1504 CG1 VAL A 164 3.624 1.154 0.299 1.00 0.27 C ATOM 1505 CG2 VAL A 164 5.100 2.258 -1.397 1.00 0.29 C ATOM 0 H VAL A 164 2.739 3.773 -0.689 1.00 0.22 H new ATOM 0 HA VAL A 164 4.389 3.470 1.741 1.00 0.26 H new ATOM 0 HB VAL A 164 5.623 1.837 0.614 1.00 0.28 H new ATOM 0 HG11 VAL A 164 3.925 0.191 -0.112 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.434 1.049 1.367 1.00 0.27 H new ATOM 0 HG13 VAL A 164 2.716 1.493 -0.199 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.376 1.269 -1.763 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.245 2.628 -1.963 1.00 0.29 H new ATOM 0 HG23 VAL A 164 5.941 2.940 -1.523 1.00 0.29 H new ATOM 1515 N TYR A 165 6.368 4.871 0.870 1.00 0.45 N ATOM 1516 CA TYR A 165 7.307 5.901 0.458 1.00 0.57 C ATOM 1517 C TYR A 165 8.750 5.477 0.692 1.00 0.70 C ATOM 1518 O TYR A 165 9.482 5.217 -0.260 1.00 1.67 O ATOM 1519 CB TYR A 165 7.001 7.249 1.140 1.00 0.62 C ATOM 1520 CG TYR A 165 6.590 7.178 2.605 1.00 0.63 C ATOM 1521 CD1 TYR A 165 5.293 6.825 2.967 1.00 1.30 C ATOM 1522 CD2 TYR A 165 7.484 7.500 3.620 1.00 1.38 C ATOM 1523 CE1 TYR A 165 4.903 6.796 4.292 1.00 1.31 C ATOM 1524 CE2 TYR A 165 7.100 7.466 4.949 1.00 1.45 C ATOM 1525 CZ TYR A 165 5.808 7.116 5.279 1.00 0.79 C ATOM 1526 OH TYR A 165 5.413 7.094 6.598 1.00 0.93 O ATOM 0 H TYR A 165 6.622 4.371 1.722 1.00 0.45 H new ATOM 0 HA TYR A 165 7.181 6.039 -0.616 1.00 0.57 H new ATOM 0 HB2 TYR A 165 7.885 7.882 1.061 1.00 0.62 H new ATOM 0 HB3 TYR A 165 6.205 7.743 0.583 1.00 0.62 H new ATOM 0 HD1 TYR A 165 4.579 6.569 2.198 1.00 1.30 H new ATOM 0 HD2 TYR A 165 8.495 7.781 3.367 1.00 1.38 H new ATOM 0 HE1 TYR A 165 3.891 6.523 4.553 1.00 1.31 H new ATOM 0 HE2 TYR A 165 7.810 7.713 5.725 1.00 1.45 H new ATOM 0 HH TYR A 165 5.675 7.933 7.032 1.00 0.93 H new ATOM 1536 N LYS A 166 9.152 5.400 1.946 1.00 0.48 N ATOM 1537 CA LYS A 166 10.521 5.058 2.300 1.00 0.49 C ATOM 1538 C LYS A 166 10.544 4.431 3.691 1.00 0.46 C ATOM 1539 O LYS A 166 9.511 4.399 4.361 1.00 0.55 O ATOM 1540 CB LYS A 166 11.409 6.316 2.267 1.00 0.57 C ATOM 1541 CG LYS A 166 11.867 6.735 0.873 1.00 0.71 C ATOM 1542 CD LYS A 166 12.700 5.644 0.209 1.00 0.94 C ATOM 1543 CE LYS A 166 13.966 6.197 -0.435 1.00 1.35 C ATOM 1544 NZ LYS A 166 13.679 7.185 -1.507 1.00 1.53 N ATOM 0 H LYS A 166 8.544 5.571 2.747 1.00 0.48 H new ATOM 0 HA LYS A 166 10.911 4.342 1.577 1.00 0.49 H new ATOM 0 HB2 LYS A 166 10.861 7.143 2.719 1.00 0.57 H new ATOM 0 HB3 LYS A 166 12.289 6.140 2.886 1.00 0.57 H new ATOM 0 HG2 LYS A 166 10.998 6.958 0.255 1.00 0.71 H new ATOM 0 HG3 LYS A 166 12.453 7.651 0.941 1.00 0.71 H new ATOM 0 HD2 LYS A 166 12.970 4.893 0.952 1.00 0.94 H new ATOM 0 HD3 LYS A 166 12.099 5.141 -0.549 1.00 0.94 H new ATOM 0 HE2 LYS A 166 14.583 6.667 0.331 1.00 1.35 H new ATOM 0 HE3 LYS A 166 14.547 5.374 -0.851 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 14.515 7.287 -2.118 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 12.873 6.856 -2.076 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 13.449 8.104 -1.079 1.00 1.53 H new ATOM 1558 N PRO A 167 11.694 3.888 4.136 1.00 0.44 N ATOM 1559 CA PRO A 167 11.843 3.404 5.516 1.00 0.47 C ATOM 1560 C PRO A 167 11.519 4.492 6.534 1.00 0.47 C ATOM 1561 O PRO A 167 11.831 5.666 6.323 1.00 0.50 O ATOM 1562 CB PRO A 167 13.324 3.018 5.595 1.00 0.58 C ATOM 1563 CG PRO A 167 13.691 2.690 4.193 1.00 0.60 C ATOM 1564 CD PRO A 167 12.925 3.665 3.346 1.00 0.49 C ATOM 0 HA PRO A 167 11.165 2.582 5.744 1.00 0.47 H new ATOM 0 HB2 PRO A 167 13.929 3.837 5.984 1.00 0.58 H new ATOM 0 HB3 PRO A 167 13.479 2.166 6.257 1.00 0.58 H new ATOM 0 HG2 PRO A 167 14.765 2.789 4.034 1.00 0.60 H new ATOM 0 HG3 PRO A 167 13.426 1.662 3.947 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.480 4.590 3.192 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.704 3.258 2.359 1.00 0.49 H new ATOM 1572 N ALA A 168 10.883 4.095 7.630 1.00 0.53 N ATOM 1573 CA ALA A 168 10.490 5.034 8.674 1.00 0.64 C ATOM 1574 C ALA A 168 11.697 5.802 9.199 1.00 0.71 C ATOM 1575 O ALA A 168 12.652 5.206 9.707 1.00 0.76 O ATOM 1576 CB ALA A 168 9.796 4.302 9.812 1.00 0.72 C ATOM 0 H ALA A 168 10.628 3.126 7.819 1.00 0.53 H new ATOM 0 HA ALA A 168 9.792 5.750 8.240 1.00 0.64 H new ATOM 0 HB1 ALA A 168 9.509 5.017 10.583 1.00 0.72 H new ATOM 0 HB2 ALA A 168 8.906 3.801 9.433 1.00 0.72 H new ATOM 0 HB3 ALA A 168 10.475 3.563 10.237 1.00 0.72 H new ATOM 1582 N GLY A 169 11.647 7.121 9.080 1.00 0.82 N ATOM 1583 CA GLY A 169 12.760 7.951 9.493 1.00 0.95 C ATOM 1584 C GLY A 169 13.437 8.626 8.318 1.00 0.96 C ATOM 1585 O GLY A 169 14.014 9.707 8.463 1.00 1.14 O ATOM 0 H GLY A 169 10.850 7.634 8.702 1.00 0.82 H new ATOM 0 HA2 GLY A 169 12.406 8.710 10.191 1.00 0.95 H new ATOM 0 HA3 GLY A 169 13.488 7.340 10.028 1.00 0.95 H new ATOM 1589 N TYR A 170 13.359 8.004 7.149 1.00 0.80 N ATOM 1590 CA TYR A 170 13.978 8.551 5.950 1.00 0.82 C ATOM 1591 C TYR A 170 13.093 9.654 5.369 1.00 0.86 C ATOM 1592 O TYR A 170 11.898 9.443 5.153 1.00 0.89 O ATOM 1593 CB TYR A 170 14.194 7.440 4.913 1.00 0.83 C ATOM 1594 CG TYR A 170 15.158 7.805 3.798 1.00 0.91 C ATOM 1595 CD1 TYR A 170 14.749 8.568 2.706 1.00 1.15 C ATOM 1596 CD2 TYR A 170 16.482 7.381 3.837 1.00 1.74 C ATOM 1597 CE1 TYR A 170 15.631 8.893 1.691 1.00 1.21 C ATOM 1598 CE2 TYR A 170 17.367 7.705 2.824 1.00 1.82 C ATOM 1599 CZ TYR A 170 16.936 8.459 1.756 1.00 1.11 C ATOM 1600 OH TYR A 170 17.815 8.784 0.748 1.00 1.24 O ATOM 0 H TYR A 170 12.872 7.119 7.006 1.00 0.80 H new ATOM 0 HA TYR A 170 14.948 8.976 6.211 1.00 0.82 H new ATOM 0 HB2 TYR A 170 14.566 6.551 5.422 1.00 0.83 H new ATOM 0 HB3 TYR A 170 13.232 7.177 4.474 1.00 0.83 H new ATOM 0 HD1 TYR A 170 13.726 8.911 2.651 1.00 1.15 H new ATOM 0 HD2 TYR A 170 16.825 6.789 4.672 1.00 1.74 H new ATOM 0 HE1 TYR A 170 15.297 9.485 0.851 1.00 1.21 H new ATOM 0 HE2 TYR A 170 18.392 7.368 2.871 1.00 1.82 H new ATOM 0 HH TYR A 170 18.696 8.402 0.946 1.00 1.24 H new ATOM 1610 N PRO A 171 13.657 10.851 5.127 1.00 0.97 N ATOM 1611 CA PRO A 171 12.901 11.980 4.570 1.00 1.10 C ATOM 1612 C PRO A 171 12.372 11.688 3.167 1.00 1.07 C ATOM 1613 O PRO A 171 13.139 11.355 2.264 1.00 1.05 O ATOM 1614 CB PRO A 171 13.928 13.120 4.525 1.00 1.25 C ATOM 1615 CG PRO A 171 15.258 12.451 4.562 1.00 1.31 C ATOM 1616 CD PRO A 171 15.069 11.206 5.379 1.00 1.07 C ATOM 0 HA PRO A 171 12.019 12.209 5.168 1.00 1.10 H new ATOM 0 HB2 PRO A 171 13.813 13.718 3.621 1.00 1.25 H new ATOM 0 HB3 PRO A 171 13.804 13.795 5.371 1.00 1.25 H new ATOM 0 HG2 PRO A 171 15.602 12.210 3.556 1.00 1.31 H new ATOM 0 HG3 PRO A 171 16.010 13.101 5.009 1.00 1.31 H new ATOM 0 HD2 PRO A 171 15.746 10.412 5.066 1.00 1.07 H new ATOM 0 HD3 PRO A 171 15.257 11.386 6.438 1.00 1.07 H new ATOM 1624 N ALA A 172 11.064 11.815 2.985 1.00 1.22 N ATOM 1625 CA ALA A 172 10.447 11.560 1.691 1.00 1.31 C ATOM 1626 C ALA A 172 10.339 12.851 0.889 1.00 1.40 C ATOM 1627 O ALA A 172 9.331 13.558 0.956 1.00 1.67 O ATOM 1628 CB ALA A 172 9.074 10.923 1.867 1.00 1.60 C ATOM 0 H ALA A 172 10.410 12.093 3.717 1.00 1.22 H new ATOM 0 HA ALA A 172 11.079 10.863 1.140 1.00 1.31 H new ATOM 0 HB1 ALA A 172 8.630 10.740 0.889 1.00 1.60 H new ATOM 0 HB2 ALA A 172 9.177 9.978 2.401 1.00 1.60 H new ATOM 0 HB3 ALA A 172 8.432 11.594 2.438 1.00 1.60 H new ATOM 1634 N ASN A 173 11.385 13.160 0.139 1.00 1.38 N ATOM 1635 CA ASN A 173 11.423 14.380 -0.657 1.00 1.53 C ATOM 1636 C ASN A 173 11.473 14.048 -2.138 1.00 1.91 C ATOM 1637 O ASN A 173 12.191 13.138 -2.552 1.00 2.60 O ATOM 1638 CB ASN A 173 12.635 15.233 -0.275 1.00 1.89 C ATOM 1639 CG ASN A 173 12.533 15.799 1.125 1.00 2.51 C ATOM 1640 OD1 ASN A 173 11.440 16.084 1.615 1.00 2.97 O ATOM 1641 ND2 ASN A 173 13.668 15.968 1.778 1.00 3.18 N ATOM 0 H ASN A 173 12.222 12.582 0.064 1.00 1.38 H new ATOM 0 HA ASN A 173 10.515 14.947 -0.453 1.00 1.53 H new ATOM 0 HB2 ASN A 173 13.539 14.629 -0.353 1.00 1.89 H new ATOM 0 HB3 ASN A 173 12.737 16.052 -0.987 1.00 1.89 H new ATOM 0 HD21 ASN A 173 13.660 16.347 2.725 1.00 3.18 H new ATOM 0 HD22 ASN A 173 14.553 15.719 1.336 1.00 3.18 H new ATOM 1648 N GLY A 174 10.705 14.781 -2.929 1.00 2.02 N ATOM 1649 CA GLY A 174 10.680 14.539 -4.357 1.00 2.69 C ATOM 1650 C GLY A 174 9.541 13.629 -4.755 1.00 2.26 C ATOM 1651 O GLY A 174 9.678 12.828 -5.680 1.00 2.93 O ATOM 0 H GLY A 174 10.100 15.537 -2.609 1.00 2.02 H new ATOM 0 HA2 GLY A 174 10.587 15.488 -4.884 1.00 2.69 H new ATOM 0 HA3 GLY A 174 11.626 14.094 -4.666 1.00 2.69 H new ATOM 1655 N SER A 175 8.422 13.749 -4.035 1.00 1.44 N ATOM 1656 CA SER A 175 7.232 12.923 -4.253 1.00 1.23 C ATOM 1657 C SER A 175 7.593 11.439 -4.232 1.00 0.94 C ATOM 1658 O SER A 175 7.303 10.695 -5.167 1.00 1.36 O ATOM 1659 CB SER A 175 6.511 13.307 -5.559 1.00 1.79 C ATOM 1660 OG SER A 175 7.336 13.125 -6.700 1.00 2.26 O ATOM 0 H SER A 175 8.316 14.426 -3.280 1.00 1.44 H new ATOM 0 HA SER A 175 6.538 13.112 -3.434 1.00 1.23 H new ATOM 0 HB2 SER A 175 5.609 12.704 -5.665 1.00 1.79 H new ATOM 0 HB3 SER A 175 6.194 14.348 -5.504 1.00 1.79 H new ATOM 0 HG SER A 175 8.181 12.710 -6.430 1.00 2.26 H new ATOM 1666 N THR A 176 8.213 11.018 -3.140 1.00 0.64 N ATOM 1667 CA THR A 176 8.697 9.654 -2.999 1.00 0.90 C ATOM 1668 C THR A 176 7.569 8.705 -2.583 1.00 0.80 C ATOM 1669 O THR A 176 7.804 7.548 -2.233 1.00 1.05 O ATOM 1670 CB THR A 176 9.824 9.593 -1.951 1.00 1.30 C ATOM 1671 OG1 THR A 176 10.666 10.747 -2.071 1.00 1.49 O ATOM 1672 CG2 THR A 176 10.663 8.341 -2.135 1.00 1.76 C ATOM 0 H THR A 176 8.394 11.610 -2.330 1.00 0.64 H new ATOM 0 HA THR A 176 9.080 9.338 -3.969 1.00 0.90 H new ATOM 0 HB THR A 176 9.368 9.571 -0.961 1.00 1.30 H new ATOM 0 HG1 THR A 176 11.380 10.702 -1.401 1.00 1.49 H new ATOM 0 HG21 THR A 176 11.453 8.319 -1.384 1.00 1.76 H new ATOM 0 HG22 THR A 176 10.031 7.460 -2.023 1.00 1.76 H new ATOM 0 HG23 THR A 176 11.108 8.344 -3.130 1.00 1.76 H new ATOM 1680 N PHE A 177 6.341 9.194 -2.633 1.00 0.52 N ATOM 1681 CA PHE A 177 5.198 8.403 -2.211 1.00 0.45 C ATOM 1682 C PHE A 177 4.578 7.677 -3.401 1.00 0.41 C ATOM 1683 O PHE A 177 4.570 8.187 -4.523 1.00 0.50 O ATOM 1684 CB PHE A 177 4.153 9.290 -1.510 1.00 0.49 C ATOM 1685 CG PHE A 177 3.831 10.571 -2.242 1.00 0.55 C ATOM 1686 CD1 PHE A 177 4.372 11.780 -1.823 1.00 1.37 C ATOM 1687 CD2 PHE A 177 2.988 10.570 -3.344 1.00 1.31 C ATOM 1688 CE1 PHE A 177 4.078 12.956 -2.488 1.00 1.46 C ATOM 1689 CE2 PHE A 177 2.694 11.742 -4.012 1.00 1.38 C ATOM 1690 CZ PHE A 177 3.238 12.936 -3.583 1.00 0.86 C ATOM 0 H PHE A 177 6.111 10.132 -2.961 1.00 0.52 H new ATOM 0 HA PHE A 177 5.544 7.655 -1.497 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.234 8.717 -1.383 1.00 0.49 H new ATOM 0 HB3 PHE A 177 4.515 9.537 -0.512 1.00 0.49 H new ATOM 0 HD1 PHE A 177 5.030 11.802 -0.967 1.00 1.37 H new ATOM 0 HD2 PHE A 177 2.556 9.640 -3.684 1.00 1.31 H new ATOM 0 HE1 PHE A 177 4.505 13.889 -2.151 1.00 1.46 H new ATOM 0 HE2 PHE A 177 2.038 11.725 -4.870 1.00 1.38 H new ATOM 0 HZ PHE A 177 3.007 13.853 -4.104 1.00 0.86 H new ATOM 1700 N GLU A 178 4.089 6.472 -3.154 1.00 0.34 N ATOM 1701 CA GLU A 178 3.443 5.680 -4.182 1.00 0.32 C ATOM 1702 C GLU A 178 2.136 5.118 -3.645 1.00 0.28 C ATOM 1703 O GLU A 178 2.111 4.493 -2.582 1.00 0.28 O ATOM 1704 CB GLU A 178 4.360 4.538 -4.629 1.00 0.37 C ATOM 1705 CG GLU A 178 3.820 3.748 -5.812 1.00 0.40 C ATOM 1706 CD GLU A 178 3.733 4.579 -7.075 1.00 1.20 C ATOM 1707 OE1 GLU A 178 4.755 4.704 -7.775 1.00 1.91 O ATOM 1708 OE2 GLU A 178 2.646 5.116 -7.372 1.00 1.96 O ATOM 0 H GLU A 178 4.129 6.020 -2.241 1.00 0.34 H new ATOM 0 HA GLU A 178 3.236 6.316 -5.043 1.00 0.32 H new ATOM 0 HB2 GLU A 178 5.335 4.948 -4.892 1.00 0.37 H new ATOM 0 HB3 GLU A 178 4.515 3.859 -3.791 1.00 0.37 H new ATOM 0 HG2 GLU A 178 4.462 2.886 -5.992 1.00 0.40 H new ATOM 0 HG3 GLU A 178 2.831 3.363 -5.566 1.00 0.40 H new ATOM 1715 N TRP A 179 1.056 5.363 -4.368 1.00 0.28 N ATOM 1716 CA TRP A 179 -0.246 4.845 -3.989 1.00 0.26 C ATOM 1717 C TRP A 179 -0.548 3.555 -4.739 1.00 0.27 C ATOM 1718 O TRP A 179 -0.232 3.426 -5.925 1.00 0.38 O ATOM 1719 CB TRP A 179 -1.350 5.862 -4.301 1.00 0.27 C ATOM 1720 CG TRP A 179 -1.336 7.089 -3.440 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -0.836 8.319 -3.762 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.870 7.208 -2.119 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -1.036 9.194 -2.723 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.664 8.537 -1.704 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.506 6.321 -1.245 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -2.069 9.000 -0.460 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -2.906 6.783 -0.010 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.687 8.113 0.373 1.00 0.24 C ATOM 0 H TRP A 179 1.056 5.919 -5.223 1.00 0.28 H new ATOM 0 HA TRP A 179 -0.222 4.651 -2.917 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -1.260 6.166 -5.344 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -2.317 5.371 -4.194 1.00 0.27 H new ATOM 0 HD1 TRP A 179 -0.354 8.567 -4.696 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -0.760 10.176 -2.714 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.680 5.295 -1.532 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -1.901 10.024 -0.162 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.397 6.108 0.675 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -3.014 8.443 1.348 1.00 0.24 H new ATOM 1739 N SER A 180 -1.149 2.603 -4.049 1.00 0.23 N ATOM 1740 CA SER A 180 -1.681 1.423 -4.706 1.00 0.28 C ATOM 1741 C SER A 180 -2.982 1.807 -5.396 1.00 0.28 C ATOM 1742 O SER A 180 -3.580 2.832 -5.057 1.00 0.36 O ATOM 1743 CB SER A 180 -1.929 0.308 -3.685 1.00 0.33 C ATOM 1744 OG SER A 180 -2.888 0.702 -2.721 1.00 1.06 O ATOM 0 H SER A 180 -1.281 2.623 -3.038 1.00 0.23 H new ATOM 0 HA SER A 180 -0.965 1.051 -5.439 1.00 0.28 H new ATOM 0 HB2 SER A 180 -2.273 -0.590 -4.199 1.00 0.33 H new ATOM 0 HB3 SER A 180 -0.993 0.052 -3.188 1.00 0.33 H new ATOM 0 HG SER A 180 -3.482 -0.052 -2.523 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.414 1.019 -6.369 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.666 1.311 -7.052 1.00 0.38 C ATOM 1752 C GLU A 181 -5.819 1.199 -6.067 1.00 0.34 C ATOM 1753 O GLU A 181 -5.997 0.163 -5.430 1.00 0.49 O ATOM 1754 CB GLU A 181 -4.876 0.380 -8.248 1.00 0.56 C ATOM 1755 CG GLU A 181 -3.782 0.496 -9.302 1.00 0.74 C ATOM 1756 CD GLU A 181 -3.469 1.935 -9.656 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -4.128 2.486 -10.561 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -2.562 2.521 -9.030 1.00 1.91 O ATOM 0 H GLU A 181 -2.926 0.186 -6.700 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.625 2.329 -7.439 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -4.922 -0.650 -7.894 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -5.839 0.602 -8.708 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -2.877 0.010 -8.937 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -4.090 -0.037 -10.201 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.608 2.277 -5.929 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.627 2.379 -4.887 1.00 0.26 C ATOM 1767 C PRO A 182 -8.709 1.319 -5.028 1.00 0.28 C ATOM 1768 O PRO A 182 -9.461 1.298 -6.008 1.00 0.32 O ATOM 1769 CB PRO A 182 -8.218 3.783 -5.073 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.844 4.199 -6.454 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.578 3.464 -6.800 1.00 0.39 C ATOM 0 HA PRO A 182 -7.201 2.221 -3.896 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.301 3.772 -4.947 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -7.818 4.477 -4.333 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -8.638 3.955 -7.160 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -7.692 5.277 -6.505 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -6.553 3.186 -7.854 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.696 4.076 -6.611 1.00 0.39 H new ATOM 1779 N MET A 183 -8.770 0.426 -4.056 1.00 0.28 N ATOM 1780 CA MET A 183 -9.804 -0.587 -4.024 1.00 0.30 C ATOM 1781 C MET A 183 -11.010 -0.061 -3.274 1.00 0.26 C ATOM 1782 O MET A 183 -10.879 0.572 -2.224 1.00 0.25 O ATOM 1783 CB MET A 183 -9.312 -1.895 -3.389 1.00 0.34 C ATOM 1784 CG MET A 183 -8.525 -1.725 -2.099 1.00 0.29 C ATOM 1785 SD MET A 183 -6.820 -1.207 -2.392 1.00 0.31 S ATOM 1786 CE MET A 183 -6.195 -1.121 -0.721 1.00 0.27 C ATOM 0 H MET A 183 -8.113 0.384 -3.277 1.00 0.28 H new ATOM 0 HA MET A 183 -10.081 -0.813 -5.054 1.00 0.30 H new ATOM 0 HB2 MET A 183 -10.174 -2.532 -3.190 1.00 0.34 H new ATOM 0 HB3 MET A 183 -8.688 -2.420 -4.112 1.00 0.34 H new ATOM 0 HG2 MET A 183 -9.022 -0.988 -1.468 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.526 -2.667 -1.550 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.199 -0.679 -0.727 1.00 0.27 H new ATOM 0 HE2 MET A 183 -6.861 -0.507 -0.115 1.00 0.27 H new ATOM 0 HE3 MET A 183 -6.143 -2.125 -0.300 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.182 -0.309 -3.823 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.407 0.185 -3.234 1.00 0.29 C ATOM 1798 C ARG A 184 -14.219 -0.974 -2.696 1.00 0.31 C ATOM 1799 O ARG A 184 -14.790 -1.751 -3.463 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.239 0.962 -4.260 1.00 0.35 C ATOM 1801 CG ARG A 184 -13.488 2.082 -4.960 1.00 1.17 C ATOM 1802 CD ARG A 184 -14.381 2.797 -5.965 1.00 1.16 C ATOM 1803 NE ARG A 184 -15.571 3.371 -5.335 1.00 1.88 N ATOM 1804 CZ ARG A 184 -16.610 3.862 -6.014 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -16.595 3.887 -7.341 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -17.659 4.339 -5.358 1.00 3.32 N ATOM 0 H ARG A 184 -12.311 -0.851 -4.678 1.00 0.28 H new ATOM 0 HA ARG A 184 -13.145 0.862 -2.421 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -14.610 0.265 -5.011 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -15.110 1.383 -3.759 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -13.122 2.796 -4.222 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -12.615 1.675 -5.470 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -13.813 3.588 -6.455 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -14.685 2.096 -6.742 1.00 1.16 H new ATOM 0 HE ARG A 184 -15.609 3.397 -4.316 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -15.786 3.529 -7.849 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -17.393 4.264 -7.853 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -17.670 4.330 -4.338 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -18.455 4.715 -5.873 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.255 -1.097 -1.383 1.00 0.28 N ATOM 1821 CA LEU A 185 -15.055 -2.125 -0.752 1.00 0.32 C ATOM 1822 C LEU A 185 -16.432 -1.551 -0.497 1.00 0.36 C ATOM 1823 O LEU A 185 -16.658 -0.874 0.501 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.428 -2.587 0.568 1.00 0.36 C ATOM 1825 CG LEU A 185 -12.934 -2.915 0.519 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.478 -3.474 1.855 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.619 -3.896 -0.600 1.00 0.74 C ATOM 0 H LEU A 185 -13.741 -0.499 -0.736 1.00 0.28 H new ATOM 0 HA LEU A 185 -15.112 -2.994 -1.407 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.585 -1.809 1.315 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -14.963 -3.472 0.912 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.392 -1.992 0.315 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -11.414 -3.704 1.809 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.656 -2.737 2.638 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -13.036 -4.383 2.079 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.550 -4.108 -0.608 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -13.171 -4.822 -0.439 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -12.910 -3.462 -1.557 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.349 -1.808 -1.401 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.651 -1.180 -1.331 1.00 0.77 C ATOM 1841 C ALA A 186 -19.741 -2.190 -1.023 1.00 1.02 C ATOM 1842 O ALA A 186 -20.130 -2.976 -1.881 1.00 1.53 O ATOM 1843 CB ALA A 186 -18.948 -0.463 -2.635 1.00 1.00 C ATOM 0 H ALA A 186 -17.221 -2.443 -2.189 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.634 -0.456 -0.517 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -19.929 0.008 -2.576 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -18.190 0.300 -2.812 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -18.939 -1.181 -3.455 1.00 1.00 H new ATOM 1849 N LYS A 187 -20.236 -2.153 0.202 1.00 0.89 N ATOM 1850 CA LYS A 187 -21.352 -2.995 0.600 1.00 1.11 C ATOM 1851 C LYS A 187 -22.643 -2.207 0.443 1.00 1.49 C ATOM 1852 O LYS A 187 -23.059 -1.490 1.354 1.00 1.61 O ATOM 1853 CB LYS A 187 -21.194 -3.468 2.051 1.00 1.11 C ATOM 1854 CG LYS A 187 -20.188 -4.594 2.232 1.00 1.17 C ATOM 1855 CD LYS A 187 -19.979 -4.908 3.707 1.00 1.45 C ATOM 1856 CE LYS A 187 -19.260 -6.232 3.911 1.00 1.82 C ATOM 1857 NZ LYS A 187 -20.128 -7.390 3.569 1.00 2.78 N ATOM 0 H LYS A 187 -19.881 -1.546 0.941 1.00 0.89 H new ATOM 0 HA LYS A 187 -21.376 -3.879 -0.037 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -20.890 -2.621 2.667 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -22.164 -3.799 2.421 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -20.538 -5.486 1.713 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -19.238 -4.314 1.778 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -19.402 -4.107 4.170 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -20.945 -4.938 4.212 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -18.362 -6.257 3.294 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -18.937 -6.314 4.949 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -19.850 -8.213 4.141 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -21.120 -7.150 3.767 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -20.022 -7.618 2.560 1.00 2.78 H new ATOM 1871 N CYS A 188 -23.264 -2.331 -0.715 1.00 1.82 N ATOM 1872 CA CYS A 188 -24.431 -1.526 -1.033 1.00 2.29 C ATOM 1873 C CYS A 188 -25.714 -2.317 -0.833 1.00 2.51 C ATOM 1874 O CYS A 188 -25.919 -3.358 -1.457 1.00 2.68 O ATOM 1875 CB CYS A 188 -24.343 -1.035 -2.480 1.00 2.71 C ATOM 1876 SG CYS A 188 -22.754 -0.284 -2.900 1.00 3.14 S ATOM 0 H CYS A 188 -22.982 -2.979 -1.450 1.00 1.82 H new ATOM 0 HA CYS A 188 -24.450 -0.671 -0.358 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -24.526 -1.875 -3.151 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -25.136 -0.308 -2.656 1.00 2.71 H new ATOM 0 HG CYS A 188 -22.770 0.099 -4.142 1.00 3.14 H new ATOM 1882 N ASP A 189 -26.566 -1.825 0.050 1.00 2.70 N ATOM 1883 CA ASP A 189 -27.897 -2.382 0.217 1.00 3.08 C ATOM 1884 C ASP A 189 -28.895 -1.500 -0.521 1.00 3.61 C ATOM 1885 O ASP A 189 -29.508 -0.593 0.044 1.00 3.87 O ATOM 1886 CB ASP A 189 -28.257 -2.523 1.707 1.00 3.12 C ATOM 1887 CG ASP A 189 -28.084 -1.238 2.495 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -29.092 -0.699 2.995 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -26.933 -0.763 2.624 1.00 4.05 O ATOM 0 H ASP A 189 -26.358 -1.038 0.664 1.00 2.70 H new ATOM 0 HA ASP A 189 -27.928 -3.386 -0.207 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -29.291 -2.856 1.793 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -27.634 -3.299 2.151 1.00 3.12 H new ATOM 1894 N GLU A 190 -29.031 -1.767 -1.806 1.00 3.97 N ATOM 1895 CA GLU A 190 -29.830 -0.934 -2.680 1.00 4.63 C ATOM 1896 C GLU A 190 -30.974 -1.745 -3.275 1.00 5.25 C ATOM 1897 O GLU A 190 -30.716 -2.565 -4.183 1.00 5.64 O ATOM 1898 CB GLU A 190 -28.945 -0.360 -3.791 1.00 4.83 C ATOM 1899 CG GLU A 190 -29.540 0.849 -4.486 1.00 5.57 C ATOM 1900 CD GLU A 190 -29.761 2.003 -3.533 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -30.928 2.391 -3.324 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -28.770 2.517 -2.973 1.00 6.43 O ATOM 1903 OXT GLU A 190 -32.125 -1.564 -2.832 1.00 5.62 O ATOM 0 H GLU A 190 -28.593 -2.563 -2.270 1.00 3.97 H new ATOM 0 HA GLU A 190 -30.255 -0.111 -2.105 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -27.979 -0.085 -3.367 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -28.758 -1.138 -4.532 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -28.877 1.166 -5.291 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -30.489 0.572 -4.945 1.00 5.57 H new TER 1910 GLU A 190