USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=33 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= 0.583 K(o=1.4,f=0.8) USER MOD Set 1.2: A 147 TYR OH : rot 74:sc= 0.828 USER MOD Set 2.1: A 112 LYS NZ :NH3+ 175:sc= 0.459 (180deg=0) USER MOD Set 2.2: A 139 SER OG : rot -166:sc= -0.831 USER MOD Set 3.1: A 118 HIS : no HE2:sc= -0.397 K(o=-0.48,f=-3.7!) USER MOD Set 3.2: A 131 ASN : amide:sc= -0.0825 K(o=-0.48,f=-1.7!) USER MOD Set 4.1: A 84 GLN : amide:sc= -0.252 K(o=0.39,f=-1.8!) USER MOD Set 4.2: A 85 THR OG1 : rot 140:sc= 0.676 USER MOD Set 4.3: A 180 SER OG : rot 180:sc= -0.0319 USER MOD Set 5.1: A 80 HIS : no HD1:sc= 0.274 K(o=1.5,f=-3.3!) USER MOD Set 5.2: A 104 THR OG1 : rot 91:sc= 1.26 USER MOD Single : A 76 GLN : amide:sc= -4.84! C(o=-4.8!,f=-10!) USER MOD Single : A 77 SER OG : rot 97:sc= -0.36 USER MOD Single : A 82 SER OG : rot -160:sc= 0 USER MOD Single : A 87 THR OG1 : rot -150:sc= -0.119 USER MOD Single : A 88 LYS NZ :NH3+ 171:sc= 1.24 (180deg=1.12) USER MOD Single : A 90 THR OG1 : rot 140:sc= -0.77! USER MOD Single : A 92 CYS SG : rot 39:sc= 0.0716 USER MOD Single : A 93 SER OG : rot 180:sc= -1.12 USER MOD Single : A 103 ASN : amide:sc= -0.753 K(o=-0.75,f=-2.6) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 175:sc= 1.24 (180deg=1.14) USER MOD Single : A 111 SER OG : rot 159:sc= 0.129 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 0.967 K(o=0.97,f=-9.6!) USER MOD Single : A 125 LYS NZ :NH3+ 169:sc= -0.0133 (180deg=-0.168) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 ASN : amide:sc= -1.21 K(o=-1.2,f=-2.6!) USER MOD Single : A 145 SER OG : rot 74:sc= 1.05 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 107:sc= 1.37 USER MOD Single : A 152 LYS NZ :NH3+ 170:sc=-0.00685 (180deg=-0.112) USER MOD Single : A 153 LYS NZ :NH3+ -170:sc=-0.00728 (180deg=-0.117) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 MET CE :methyl 157:sc= -0.883 (180deg=-1.66) USER MOD Single : A 156 LYS NZ :NH3+ 167:sc= -0.0122 (180deg=-0.181) USER MOD Single : A 160 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 LYS NZ :NH3+ -145:sc= -0.0553 (180deg=-0.072) USER MOD Single : A 165 TYR OH : rot 180:sc= 0 USER MOD Single : A 166 LYS NZ :NH3+ -147:sc= 0.37 (180deg=0.00565) USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot 130:sc= 0.0469 USER MOD Single : A 183 MET CE :methyl -178:sc= -1.38 (180deg=-1.44) USER MOD Single : A 187 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0153) USER MOD Single : A 188 CYS SG : rot 180:sc= -0.0157 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 24.232 6.986 -0.771 1.00 3.12 N ATOM 2 CA ARG A 73 24.112 5.512 -0.847 1.00 2.69 C ATOM 3 C ARG A 73 22.852 5.033 -0.145 1.00 2.08 C ATOM 4 O ARG A 73 22.648 5.312 1.037 1.00 2.31 O ATOM 5 CB ARG A 73 25.324 4.834 -0.208 1.00 3.05 C ATOM 6 CG ARG A 73 26.624 5.026 -0.967 1.00 3.69 C ATOM 7 CD ARG A 73 27.737 4.213 -0.335 1.00 4.24 C ATOM 8 NE ARG A 73 29.010 4.374 -1.030 1.00 4.97 N ATOM 9 CZ ARG A 73 30.011 3.500 -0.951 1.00 5.85 C ATOM 10 NH1 ARG A 73 29.857 2.371 -0.269 1.00 6.18 N ATOM 11 NH2 ARG A 73 31.157 3.747 -1.567 1.00 6.67 N ATOM 0 HA ARG A 73 24.061 5.244 -1.902 1.00 2.69 H new ATOM 0 HB2 ARG A 73 25.448 5.219 0.804 1.00 3.05 H new ATOM 0 HB3 ARG A 73 25.123 3.766 -0.120 1.00 3.05 H new ATOM 0 HG2 ARG A 73 26.492 4.725 -2.006 1.00 3.69 H new ATOM 0 HG3 ARG A 73 26.896 6.082 -0.972 1.00 3.69 H new ATOM 0 HD2 ARG A 73 27.855 4.512 0.706 1.00 4.24 H new ATOM 0 HD3 ARG A 73 27.458 3.159 -0.334 1.00 4.24 H new ATOM 0 HE ARG A 73 29.140 5.203 -1.609 1.00 4.97 H new ATOM 0 HH11 ARG A 73 28.971 2.172 0.195 1.00 6.18 H new ATOM 0 HH12 ARG A 73 30.625 1.702 -0.209 1.00 6.18 H new ATOM 0 HH21 ARG A 73 31.273 4.607 -2.102 1.00 6.67 H new ATOM 0 HH22 ARG A 73 31.924 3.077 -1.506 1.00 6.67 H new ATOM 25 N TRP A 74 22.008 4.320 -0.876 1.00 1.61 N ATOM 26 CA TRP A 74 20.822 3.715 -0.295 1.00 1.14 C ATOM 27 C TRP A 74 20.506 2.412 -1.022 1.00 0.96 C ATOM 28 O TRP A 74 20.539 2.357 -2.251 1.00 1.19 O ATOM 29 CB TRP A 74 19.636 4.677 -0.363 1.00 1.25 C ATOM 30 CG TRP A 74 18.499 4.254 0.510 1.00 1.15 C ATOM 31 CD1 TRP A 74 17.366 3.610 0.121 1.00 1.14 C ATOM 32 CD2 TRP A 74 18.394 4.440 1.924 1.00 1.26 C ATOM 33 NE1 TRP A 74 16.563 3.375 1.208 1.00 1.26 N ATOM 34 CE2 TRP A 74 17.171 3.879 2.325 1.00 1.34 C ATOM 35 CE3 TRP A 74 19.217 5.025 2.889 1.00 1.43 C ATOM 36 CZ2 TRP A 74 16.751 3.884 3.649 1.00 1.61 C ATOM 37 CZ3 TRP A 74 18.799 5.032 4.205 1.00 1.66 C ATOM 38 CH2 TRP A 74 17.575 4.463 4.576 1.00 1.75 C ATOM 0 H TRP A 74 22.124 4.147 -1.874 1.00 1.61 H new ATOM 0 HA TRP A 74 21.012 3.497 0.756 1.00 1.14 H new ATOM 0 HB2 TRP A 74 19.964 5.673 -0.067 1.00 1.25 H new ATOM 0 HB3 TRP A 74 19.290 4.748 -1.394 1.00 1.25 H new ATOM 0 HD1 TRP A 74 17.133 3.325 -0.894 1.00 1.14 H new ATOM 0 HE1 TRP A 74 15.660 2.902 1.187 1.00 1.26 H new ATOM 0 HE3 TRP A 74 20.164 5.464 2.611 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 15.807 3.446 3.937 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 19.426 5.483 4.960 1.00 1.66 H new ATOM 0 HH2 TRP A 74 17.275 4.481 5.613 1.00 1.75 H new ATOM 49 N ASP A 75 20.211 1.364 -0.260 1.00 0.79 N ATOM 50 CA ASP A 75 20.046 0.023 -0.823 1.00 0.78 C ATOM 51 C ASP A 75 18.582 -0.289 -1.106 1.00 0.67 C ATOM 52 O ASP A 75 18.264 -1.014 -2.044 1.00 0.92 O ATOM 53 CB ASP A 75 20.599 -1.038 0.140 1.00 0.92 C ATOM 54 CG ASP A 75 22.039 -0.791 0.536 1.00 1.37 C ATOM 55 OD1 ASP A 75 22.947 -1.382 -0.092 1.00 2.01 O ATOM 56 OD2 ASP A 75 22.274 -0.014 1.489 1.00 1.86 O ATOM 0 H ASP A 75 20.081 1.415 0.750 1.00 0.79 H new ATOM 0 HA ASP A 75 20.601 -0.000 -1.761 1.00 0.78 H new ATOM 0 HB2 ASP A 75 19.981 -1.062 1.038 1.00 0.92 H new ATOM 0 HB3 ASP A 75 20.521 -2.020 -0.327 1.00 0.92 H new ATOM 61 N GLN A 76 17.702 0.285 -0.302 1.00 0.59 N ATOM 62 CA GLN A 76 16.286 -0.086 -0.302 1.00 0.77 C ATOM 63 C GLN A 76 15.483 0.766 -1.282 1.00 0.69 C ATOM 64 O GLN A 76 14.262 0.756 -1.254 1.00 0.94 O ATOM 65 CB GLN A 76 15.701 0.112 1.099 1.00 1.07 C ATOM 66 CG GLN A 76 16.643 -0.266 2.236 1.00 1.21 C ATOM 67 CD GLN A 76 16.885 -1.755 2.337 1.00 1.75 C ATOM 68 OE1 GLN A 76 17.831 -2.293 1.768 1.00 2.30 O ATOM 69 NE2 GLN A 76 16.033 -2.432 3.079 1.00 2.36 N ATOM 0 H GLN A 76 17.941 1.017 0.367 1.00 0.59 H new ATOM 0 HA GLN A 76 16.220 -1.131 -0.605 1.00 0.77 H new ATOM 0 HB2 GLN A 76 15.413 1.157 1.215 1.00 1.07 H new ATOM 0 HB3 GLN A 76 14.790 -0.481 1.186 1.00 1.07 H new ATOM 0 HG2 GLN A 76 17.597 0.242 2.093 1.00 1.21 H new ATOM 0 HG3 GLN A 76 16.228 0.093 3.178 1.00 1.21 H new ATOM 0 HE21 GLN A 76 15.259 -1.950 3.536 1.00 2.36 H new ATOM 0 HE22 GLN A 76 16.147 -3.439 3.197 1.00 2.36 H new ATOM 78 N SER A 77 16.177 1.499 -2.129 1.00 0.51 N ATOM 79 CA SER A 77 15.589 2.594 -2.899 1.00 0.56 C ATOM 80 C SER A 77 14.384 2.217 -3.788 1.00 0.43 C ATOM 81 O SER A 77 13.525 3.066 -4.027 1.00 0.54 O ATOM 82 CB SER A 77 16.679 3.220 -3.766 1.00 0.80 C ATOM 83 OG SER A 77 17.803 3.588 -2.979 1.00 1.52 O ATOM 0 H SER A 77 17.171 1.357 -2.309 1.00 0.51 H new ATOM 0 HA SER A 77 15.188 3.290 -2.162 1.00 0.56 H new ATOM 0 HB2 SER A 77 16.986 2.514 -4.538 1.00 0.80 H new ATOM 0 HB3 SER A 77 16.284 4.098 -4.276 1.00 0.80 H new ATOM 0 HG SER A 77 18.479 2.880 -3.023 1.00 1.52 H new ATOM 89 N ASP A 78 14.284 0.976 -4.259 1.00 0.35 N ATOM 90 CA ASP A 78 13.394 0.708 -5.397 1.00 0.38 C ATOM 91 C ASP A 78 12.393 -0.431 -5.170 1.00 0.33 C ATOM 92 O ASP A 78 12.173 -1.250 -6.060 1.00 0.42 O ATOM 93 CB ASP A 78 14.206 0.447 -6.671 1.00 0.51 C ATOM 94 CG ASP A 78 13.426 0.792 -7.923 1.00 0.94 C ATOM 95 OD1 ASP A 78 13.170 -0.110 -8.743 1.00 1.66 O ATOM 96 OD2 ASP A 78 13.053 1.974 -8.094 1.00 1.66 O ATOM 0 H ASP A 78 14.784 0.166 -3.892 1.00 0.35 H new ATOM 0 HA ASP A 78 12.797 1.613 -5.510 1.00 0.38 H new ATOM 0 HB2 ASP A 78 15.124 1.034 -6.642 1.00 0.51 H new ATOM 0 HB3 ASP A 78 14.500 -0.602 -6.705 1.00 0.51 H new ATOM 101 N LEU A 79 11.814 -0.517 -3.985 1.00 0.26 N ATOM 102 CA LEU A 79 10.697 -1.442 -3.771 1.00 0.26 C ATOM 103 C LEU A 79 9.425 -0.875 -4.406 1.00 0.30 C ATOM 104 O LEU A 79 8.980 0.214 -4.050 1.00 0.51 O ATOM 105 CB LEU A 79 10.467 -1.708 -2.275 1.00 0.28 C ATOM 106 CG LEU A 79 11.335 -2.810 -1.647 1.00 0.28 C ATOM 107 CD1 LEU A 79 11.067 -4.154 -2.303 1.00 0.29 C ATOM 108 CD2 LEU A 79 12.812 -2.460 -1.736 1.00 0.30 C ATOM 0 H LEU A 79 12.086 0.027 -3.166 1.00 0.26 H new ATOM 0 HA LEU A 79 10.948 -2.391 -4.244 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.642 -0.780 -1.730 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.419 -1.971 -2.130 1.00 0.28 H new ATOM 0 HG LEU A 79 11.065 -2.883 -0.593 1.00 0.28 H new ATOM 0 HD11 LEU A 79 11.694 -4.916 -1.840 1.00 0.29 H new ATOM 0 HD12 LEU A 79 10.018 -4.419 -2.173 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.297 -4.092 -3.367 1.00 0.29 H new ATOM 0 HD21 LEU A 79 13.403 -3.257 -1.284 1.00 0.30 H new ATOM 0 HD22 LEU A 79 13.096 -2.346 -2.782 1.00 0.30 H new ATOM 0 HD23 LEU A 79 12.997 -1.526 -1.206 1.00 0.30 H new ATOM 120 N HIS A 80 8.849 -1.606 -5.355 1.00 0.21 N ATOM 121 CA HIS A 80 7.694 -1.111 -6.106 1.00 0.25 C ATOM 122 C HIS A 80 6.451 -1.946 -5.836 1.00 0.22 C ATOM 123 O HIS A 80 6.519 -3.170 -5.803 1.00 0.23 O ATOM 124 CB HIS A 80 7.980 -1.119 -7.613 1.00 0.33 C ATOM 125 CG HIS A 80 8.867 -0.007 -8.078 1.00 1.03 C ATOM 126 ND1 HIS A 80 8.602 0.743 -9.201 1.00 1.94 N ATOM 127 CD2 HIS A 80 10.023 0.474 -7.574 1.00 1.86 C ATOM 128 CE1 HIS A 80 9.558 1.636 -9.365 1.00 2.58 C ATOM 129 NE2 HIS A 80 10.435 1.495 -8.392 1.00 2.50 N ATOM 0 H HIS A 80 9.159 -2.540 -5.624 1.00 0.21 H new ATOM 0 HA HIS A 80 7.513 -0.090 -5.772 1.00 0.25 H new ATOM 0 HB2 HIS A 80 8.441 -2.071 -7.878 1.00 0.33 H new ATOM 0 HB3 HIS A 80 7.034 -1.062 -8.151 1.00 0.33 H new ATOM 0 HD2 HIS A 80 10.531 0.120 -6.689 1.00 1.86 H new ATOM 0 HE1 HIS A 80 9.613 2.361 -10.163 1.00 2.58 H new ATOM 0 HE2 HIS A 80 11.280 2.053 -8.268 1.00 2.50 H new ATOM 138 N ILE A 81 5.318 -1.278 -5.649 1.00 0.23 N ATOM 139 CA ILE A 81 4.040 -1.963 -5.508 1.00 0.23 C ATOM 140 C ILE A 81 3.604 -2.515 -6.862 1.00 0.26 C ATOM 141 O ILE A 81 3.059 -1.789 -7.696 1.00 0.36 O ATOM 142 CB ILE A 81 2.937 -1.024 -4.968 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.332 -0.446 -3.605 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.614 -1.771 -4.862 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.327 0.547 -3.058 1.00 0.27 C ATOM 0 H ILE A 81 5.259 -0.261 -5.592 1.00 0.23 H new ATOM 0 HA ILE A 81 4.178 -2.772 -4.791 1.00 0.23 H new ATOM 0 HB ILE A 81 2.819 -0.197 -5.668 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.449 -1.263 -2.893 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.303 0.042 -3.693 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.846 -1.098 -4.480 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.321 -2.134 -5.847 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.727 -2.616 -4.182 1.00 0.28 H new ATOM 0 HD11 ILE A 81 2.669 0.916 -2.091 1.00 0.27 H new ATOM 0 HD12 ILE A 81 2.227 1.383 -3.751 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.360 0.058 -2.938 1.00 0.27 H new ATOM 157 N SER A 82 3.852 -3.794 -7.075 1.00 0.25 N ATOM 158 CA SER A 82 3.598 -4.411 -8.368 1.00 0.29 C ATOM 159 C SER A 82 2.201 -5.018 -8.434 1.00 0.33 C ATOM 160 O SER A 82 1.575 -5.032 -9.494 1.00 0.43 O ATOM 161 CB SER A 82 4.667 -5.466 -8.659 1.00 0.32 C ATOM 162 OG SER A 82 5.957 -4.872 -8.681 1.00 1.10 O ATOM 0 H SER A 82 4.229 -4.428 -6.370 1.00 0.25 H new ATOM 0 HA SER A 82 3.648 -3.636 -9.133 1.00 0.29 H new ATOM 0 HB2 SER A 82 4.632 -6.247 -7.899 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.464 -5.944 -9.617 1.00 0.32 H new ATOM 0 HG SER A 82 6.578 -5.456 -9.165 1.00 1.10 H new ATOM 168 N ASP A 83 1.709 -5.499 -7.300 1.00 0.33 N ATOM 169 CA ASP A 83 0.381 -6.104 -7.226 1.00 0.38 C ATOM 170 C ASP A 83 -0.249 -5.766 -5.889 1.00 0.30 C ATOM 171 O ASP A 83 0.426 -5.228 -5.012 1.00 0.27 O ATOM 172 CB ASP A 83 0.446 -7.631 -7.408 1.00 0.46 C ATOM 173 CG ASP A 83 0.759 -8.051 -8.833 1.00 1.27 C ATOM 174 OD1 ASP A 83 -0.171 -8.088 -9.670 1.00 2.07 O ATOM 175 OD2 ASP A 83 1.934 -8.354 -9.125 1.00 1.90 O ATOM 0 H ASP A 83 2.211 -5.483 -6.412 1.00 0.33 H new ATOM 0 HA ASP A 83 -0.227 -5.701 -8.036 1.00 0.38 H new ATOM 0 HB2 ASP A 83 1.206 -8.038 -6.741 1.00 0.46 H new ATOM 0 HB3 ASP A 83 -0.507 -8.067 -7.109 1.00 0.46 H new ATOM 180 N GLN A 84 -1.531 -6.069 -5.727 1.00 0.31 N ATOM 181 CA GLN A 84 -2.233 -5.756 -4.488 1.00 0.35 C ATOM 182 C GLN A 84 -3.608 -6.423 -4.453 1.00 0.34 C ATOM 183 O GLN A 84 -3.856 -7.379 -5.189 1.00 0.39 O ATOM 184 CB GLN A 84 -2.381 -4.238 -4.337 1.00 0.49 C ATOM 185 CG GLN A 84 -3.192 -3.593 -5.443 1.00 0.64 C ATOM 186 CD GLN A 84 -4.269 -2.681 -4.902 1.00 1.32 C ATOM 187 OE1 GLN A 84 -4.820 -2.921 -3.830 1.00 2.14 O ATOM 188 NE2 GLN A 84 -4.556 -1.618 -5.628 1.00 1.98 N ATOM 0 H GLN A 84 -2.104 -6.529 -6.434 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.645 -6.144 -3.656 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -2.853 -4.021 -3.379 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -1.390 -3.785 -4.314 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -2.528 -3.023 -6.093 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -3.650 -4.369 -6.056 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -4.073 -1.459 -6.512 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -5.261 -0.955 -5.305 1.00 1.98 H new ATOM 197 N THR A 85 -4.475 -5.920 -3.578 1.00 0.34 N ATOM 198 CA THR A 85 -5.836 -6.416 -3.421 1.00 0.39 C ATOM 199 C THR A 85 -6.556 -6.579 -4.766 1.00 0.50 C ATOM 200 O THR A 85 -6.499 -5.701 -5.633 1.00 0.54 O ATOM 201 CB THR A 85 -6.642 -5.453 -2.530 1.00 0.32 C ATOM 202 OG1 THR A 85 -5.893 -5.152 -1.347 1.00 0.43 O ATOM 203 CG2 THR A 85 -7.985 -6.052 -2.144 1.00 0.42 C ATOM 0 H THR A 85 -4.248 -5.148 -2.952 1.00 0.34 H new ATOM 0 HA THR A 85 -5.769 -7.400 -2.957 1.00 0.39 H new ATOM 0 HB THR A 85 -6.826 -4.540 -3.096 1.00 0.32 H new ATOM 0 HG1 THR A 85 -5.997 -4.203 -1.127 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.530 -5.348 -1.515 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.564 -6.258 -3.044 1.00 0.42 H new ATOM 0 HG23 THR A 85 -7.825 -6.980 -1.595 1.00 0.42 H new ATOM 211 N ASP A 86 -7.244 -7.704 -4.923 1.00 0.69 N ATOM 212 CA ASP A 86 -7.944 -8.016 -6.165 1.00 0.89 C ATOM 213 C ASP A 86 -9.359 -7.446 -6.143 1.00 0.83 C ATOM 214 O ASP A 86 -10.334 -8.164 -5.920 1.00 1.12 O ATOM 215 CB ASP A 86 -7.980 -9.532 -6.393 1.00 1.20 C ATOM 216 CG ASP A 86 -8.631 -9.914 -7.711 1.00 1.67 C ATOM 217 OD1 ASP A 86 -9.628 -10.665 -7.697 1.00 2.32 O ATOM 218 OD2 ASP A 86 -8.140 -9.475 -8.774 1.00 2.23 O ATOM 0 H ASP A 86 -7.333 -8.420 -4.201 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.402 -7.554 -6.990 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -6.963 -9.923 -6.369 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -8.523 -10.005 -5.575 1.00 1.20 H new ATOM 223 N THR A 87 -9.452 -6.141 -6.341 1.00 0.72 N ATOM 224 CA THR A 87 -10.732 -5.451 -6.406 1.00 0.74 C ATOM 225 C THR A 87 -10.677 -4.326 -7.437 1.00 0.81 C ATOM 226 O THR A 87 -11.287 -4.421 -8.504 1.00 1.42 O ATOM 227 CB THR A 87 -11.131 -4.872 -5.034 1.00 1.14 C ATOM 228 OG1 THR A 87 -9.975 -4.322 -4.389 1.00 1.36 O ATOM 229 CG2 THR A 87 -11.762 -5.932 -4.143 1.00 1.87 C ATOM 0 H THR A 87 -8.644 -5.530 -6.461 1.00 0.72 H new ATOM 0 HA THR A 87 -11.484 -6.182 -6.703 1.00 0.74 H new ATOM 0 HB THR A 87 -11.871 -4.089 -5.200 1.00 1.14 H new ATOM 0 HG1 THR A 87 -10.077 -4.394 -3.417 1.00 1.36 H new ATOM 0 HG21 THR A 87 -12.031 -5.488 -3.184 1.00 1.87 H new ATOM 0 HG22 THR A 87 -12.657 -6.326 -4.624 1.00 1.87 H new ATOM 0 HG23 THR A 87 -11.051 -6.742 -3.981 1.00 1.87 H new ATOM 237 N LYS A 88 -9.934 -3.268 -7.095 1.00 1.18 N ATOM 238 CA LYS A 88 -9.662 -2.128 -7.986 1.00 1.58 C ATOM 239 C LYS A 88 -10.906 -1.265 -8.230 1.00 1.51 C ATOM 240 O LYS A 88 -10.835 -0.037 -8.166 1.00 1.95 O ATOM 241 CB LYS A 88 -9.064 -2.596 -9.323 1.00 1.89 C ATOM 242 CG LYS A 88 -7.788 -3.423 -9.183 1.00 2.02 C ATOM 243 CD LYS A 88 -6.703 -2.677 -8.421 1.00 2.39 C ATOM 244 CE LYS A 88 -5.413 -3.482 -8.347 1.00 2.73 C ATOM 245 NZ LYS A 88 -4.760 -3.621 -9.676 1.00 3.20 N ATOM 0 H LYS A 88 -9.497 -3.175 -6.178 1.00 1.18 H new ATOM 0 HA LYS A 88 -8.929 -1.505 -7.474 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -9.810 -3.187 -9.855 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -8.851 -1.722 -9.939 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -8.016 -4.356 -8.668 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -7.418 -3.688 -10.173 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -6.508 -1.721 -8.907 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -7.053 -2.456 -7.413 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -4.724 -2.998 -7.655 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -5.627 -4.472 -7.944 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -3.816 -4.041 -9.557 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -5.338 -4.236 -10.284 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -4.669 -2.684 -10.118 1.00 3.20 H new ATOM 259 N GLY A 89 -12.030 -1.898 -8.506 1.00 1.22 N ATOM 260 CA GLY A 89 -13.252 -1.164 -8.751 1.00 1.14 C ATOM 261 C GLY A 89 -14.162 -1.152 -7.544 1.00 0.96 C ATOM 262 O GLY A 89 -13.693 -1.206 -6.404 1.00 1.01 O ATOM 0 H GLY A 89 -12.120 -2.912 -8.566 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -13.008 -0.139 -9.031 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -13.778 -1.609 -9.596 1.00 1.14 H new ATOM 266 N THR A 90 -15.460 -1.091 -7.792 1.00 0.97 N ATOM 267 CA THR A 90 -16.440 -1.060 -6.722 1.00 0.88 C ATOM 268 C THR A 90 -16.972 -2.461 -6.437 1.00 0.82 C ATOM 269 O THR A 90 -17.817 -2.983 -7.164 1.00 1.04 O ATOM 270 CB THR A 90 -17.608 -0.117 -7.069 1.00 1.06 C ATOM 271 OG1 THR A 90 -17.102 1.202 -7.328 1.00 1.25 O ATOM 272 CG2 THR A 90 -18.618 -0.062 -5.933 1.00 1.02 C ATOM 0 H THR A 90 -15.860 -1.062 -8.730 1.00 0.97 H new ATOM 0 HA THR A 90 -15.943 -0.682 -5.828 1.00 0.88 H new ATOM 0 HB THR A 90 -18.109 -0.501 -7.958 1.00 1.06 H new ATOM 0 HG1 THR A 90 -17.583 1.594 -8.087 1.00 1.25 H new ATOM 0 HG21 THR A 90 -19.433 0.610 -6.203 1.00 1.02 H new ATOM 0 HG22 THR A 90 -19.016 -1.060 -5.752 1.00 1.02 H new ATOM 0 HG23 THR A 90 -18.130 0.303 -5.030 1.00 1.02 H new ATOM 280 N VAL A 91 -16.448 -3.072 -5.385 1.00 0.65 N ATOM 281 CA VAL A 91 -16.856 -4.409 -4.983 1.00 0.77 C ATOM 282 C VAL A 91 -17.228 -4.404 -3.509 1.00 0.55 C ATOM 283 O VAL A 91 -16.611 -3.693 -2.723 1.00 0.46 O ATOM 284 CB VAL A 91 -15.714 -5.430 -5.199 1.00 1.02 C ATOM 285 CG1 VAL A 91 -16.181 -6.847 -4.906 1.00 1.43 C ATOM 286 CG2 VAL A 91 -15.153 -5.331 -6.609 1.00 1.51 C ATOM 0 H VAL A 91 -15.732 -2.657 -4.789 1.00 0.65 H new ATOM 0 HA VAL A 91 -17.711 -4.699 -5.594 1.00 0.77 H new ATOM 0 HB VAL A 91 -14.916 -5.186 -4.497 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -15.357 -7.542 -5.067 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -16.515 -6.913 -3.871 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -17.006 -7.103 -5.571 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -14.352 -6.060 -6.734 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -15.944 -5.535 -7.331 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -14.760 -4.328 -6.775 1.00 1.51 H new ATOM 296 N CYS A 92 -18.229 -5.174 -3.122 1.00 0.79 N ATOM 297 CA CYS A 92 -18.526 -5.320 -1.712 1.00 0.64 C ATOM 298 C CYS A 92 -17.835 -6.566 -1.186 1.00 0.62 C ATOM 299 O CYS A 92 -18.109 -7.679 -1.636 1.00 1.20 O ATOM 300 CB CYS A 92 -20.038 -5.410 -1.502 1.00 1.10 C ATOM 301 SG CYS A 92 -20.865 -6.606 -2.579 1.00 1.91 S ATOM 0 H CYS A 92 -18.838 -5.697 -3.751 1.00 0.79 H new ATOM 0 HA CYS A 92 -18.159 -4.451 -1.165 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -20.234 -5.676 -0.463 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -20.476 -4.426 -1.667 1.00 1.10 H new ATOM 0 HG CYS A 92 -20.121 -7.665 -2.703 1.00 1.91 H new ATOM 307 N SER A 93 -16.927 -6.378 -0.243 1.00 0.69 N ATOM 308 CA SER A 93 -16.177 -7.488 0.306 1.00 1.02 C ATOM 309 C SER A 93 -15.677 -7.190 1.712 1.00 0.58 C ATOM 310 O SER A 93 -15.114 -6.122 1.955 1.00 0.73 O ATOM 311 CB SER A 93 -14.996 -7.816 -0.611 1.00 1.83 C ATOM 312 OG SER A 93 -14.243 -6.652 -0.912 1.00 2.58 O ATOM 0 H SER A 93 -16.694 -5.468 0.156 1.00 0.69 H new ATOM 0 HA SER A 93 -16.845 -8.347 0.368 1.00 1.02 H new ATOM 0 HB2 SER A 93 -14.353 -8.554 -0.131 1.00 1.83 H new ATOM 0 HB3 SER A 93 -15.362 -8.264 -1.534 1.00 1.83 H new ATOM 0 HG SER A 93 -13.494 -6.889 -1.498 1.00 2.58 H new ATOM 318 N PRO A 94 -15.888 -8.106 2.662 1.00 0.78 N ATOM 319 CA PRO A 94 -15.155 -8.102 3.915 1.00 0.67 C ATOM 320 C PRO A 94 -13.849 -8.858 3.726 1.00 0.53 C ATOM 321 O PRO A 94 -13.843 -10.086 3.639 1.00 0.59 O ATOM 322 CB PRO A 94 -16.077 -8.856 4.885 1.00 0.93 C ATOM 323 CG PRO A 94 -17.247 -9.334 4.069 1.00 1.39 C ATOM 324 CD PRO A 94 -16.864 -9.191 2.621 1.00 1.43 C ATOM 0 HA PRO A 94 -14.907 -7.103 4.274 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -15.555 -9.695 5.345 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -16.407 -8.204 5.694 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -17.483 -10.372 4.304 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -18.138 -8.747 4.292 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -16.434 -10.110 2.222 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -17.722 -8.943 1.996 1.00 1.43 H new ATOM 332 N PHE A 95 -12.743 -8.140 3.666 1.00 0.43 N ATOM 333 CA PHE A 95 -11.504 -8.741 3.209 1.00 0.40 C ATOM 334 C PHE A 95 -10.299 -7.986 3.753 1.00 0.33 C ATOM 335 O PHE A 95 -10.368 -6.778 3.990 1.00 0.32 O ATOM 336 CB PHE A 95 -11.509 -8.726 1.670 1.00 0.46 C ATOM 337 CG PHE A 95 -10.469 -9.597 1.016 1.00 0.50 C ATOM 338 CD1 PHE A 95 -10.524 -10.977 1.134 1.00 1.26 C ATOM 339 CD2 PHE A 95 -9.448 -9.036 0.263 1.00 1.35 C ATOM 340 CE1 PHE A 95 -9.583 -11.779 0.517 1.00 1.33 C ATOM 341 CE2 PHE A 95 -8.504 -9.833 -0.353 1.00 1.36 C ATOM 342 CZ PHE A 95 -8.572 -11.206 -0.226 1.00 0.68 C ATOM 0 H PHE A 95 -12.676 -7.155 3.923 1.00 0.43 H new ATOM 0 HA PHE A 95 -11.431 -9.765 3.574 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -12.493 -9.040 1.323 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.365 -7.700 1.332 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -11.312 -11.431 1.716 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -9.391 -7.963 0.157 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -9.639 -12.853 0.616 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -7.713 -9.383 -0.934 1.00 1.36 H new ATOM 0 HZ PHE A 95 -7.834 -11.831 -0.708 1.00 0.68 H new ATOM 352 N ALA A 96 -9.216 -8.711 3.990 1.00 0.37 N ATOM 353 CA ALA A 96 -7.958 -8.102 4.380 1.00 0.38 C ATOM 354 C ALA A 96 -7.239 -7.589 3.142 1.00 0.35 C ATOM 355 O ALA A 96 -6.957 -8.352 2.217 1.00 0.51 O ATOM 356 CB ALA A 96 -7.085 -9.097 5.132 1.00 0.49 C ATOM 0 H ALA A 96 -9.186 -9.728 3.918 1.00 0.37 H new ATOM 0 HA ALA A 96 -8.162 -7.266 5.049 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.147 -8.618 5.414 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -7.605 -9.432 6.029 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -6.876 -9.954 4.492 1.00 0.49 H new ATOM 362 N LEU A 97 -6.952 -6.302 3.130 1.00 0.24 N ATOM 363 CA LEU A 97 -6.379 -5.658 1.957 1.00 0.22 C ATOM 364 C LEU A 97 -4.868 -5.731 2.006 1.00 0.22 C ATOM 365 O LEU A 97 -4.272 -5.621 3.075 1.00 0.24 O ATOM 366 CB LEU A 97 -6.851 -4.202 1.861 1.00 0.23 C ATOM 367 CG LEU A 97 -8.136 -3.983 1.049 1.00 0.46 C ATOM 368 CD1 LEU A 97 -9.198 -5.010 1.406 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.676 -2.582 1.278 1.00 1.07 C ATOM 0 H LEU A 97 -7.106 -5.677 3.921 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.720 -6.185 1.066 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -7.008 -3.821 2.870 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -6.053 -3.607 1.416 1.00 0.23 H new ATOM 0 HG LEU A 97 -7.885 -4.103 -0.005 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -10.095 -4.827 0.814 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -8.822 -6.011 1.195 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -9.440 -4.929 2.466 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -9.587 -2.443 0.695 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -8.898 -2.446 2.336 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -7.931 -1.850 0.967 1.00 1.07 H new ATOM 381 N PHE A 98 -4.249 -5.922 0.854 1.00 0.23 N ATOM 382 CA PHE A 98 -2.813 -6.108 0.800 1.00 0.23 C ATOM 383 C PHE A 98 -2.203 -5.435 -0.416 1.00 0.22 C ATOM 384 O PHE A 98 -2.901 -5.079 -1.365 1.00 0.25 O ATOM 385 CB PHE A 98 -2.464 -7.605 0.809 1.00 0.24 C ATOM 386 CG PHE A 98 -3.156 -8.407 -0.263 1.00 0.26 C ATOM 387 CD1 PHE A 98 -2.607 -8.524 -1.532 1.00 1.26 C ATOM 388 CD2 PHE A 98 -4.356 -9.048 0.004 1.00 1.18 C ATOM 389 CE1 PHE A 98 -3.245 -9.261 -2.512 1.00 1.31 C ATOM 390 CE2 PHE A 98 -4.996 -9.785 -0.973 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.441 -9.892 -2.231 1.00 0.40 C ATOM 0 H PHE A 98 -4.717 -5.952 -0.052 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.389 -5.637 1.687 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.386 -7.716 0.691 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -2.723 -8.021 1.783 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -1.671 -8.034 -1.756 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -4.795 -8.970 0.987 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -2.809 -9.343 -3.497 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -5.931 -10.278 -0.752 1.00 1.17 H new ATOM 0 HZ PHE A 98 -4.941 -10.468 -2.995 1.00 0.40 H new ATOM 401 N ALA A 99 -0.899 -5.247 -0.349 1.00 0.20 N ATOM 402 CA ALA A 99 -0.115 -4.744 -1.457 1.00 0.19 C ATOM 403 C ALA A 99 1.197 -5.509 -1.521 1.00 0.17 C ATOM 404 O ALA A 99 1.777 -5.847 -0.488 1.00 0.19 O ATOM 405 CB ALA A 99 0.140 -3.251 -1.312 1.00 0.21 C ATOM 0 H ALA A 99 -0.349 -5.442 0.487 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.669 -4.892 -2.384 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.731 -2.899 -2.158 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -0.812 -2.720 -1.288 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.684 -3.063 -0.386 1.00 0.21 H new ATOM 411 N VAL A 100 1.646 -5.805 -2.722 1.00 0.17 N ATOM 412 CA VAL A 100 2.864 -6.566 -2.914 1.00 0.18 C ATOM 413 C VAL A 100 3.946 -5.697 -3.539 1.00 0.19 C ATOM 414 O VAL A 100 3.762 -5.142 -4.624 1.00 0.22 O ATOM 415 CB VAL A 100 2.611 -7.799 -3.804 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.899 -8.566 -4.047 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.560 -8.703 -3.178 1.00 0.25 C ATOM 0 H VAL A 100 1.182 -5.528 -3.587 1.00 0.17 H new ATOM 0 HA VAL A 100 3.200 -6.905 -1.934 1.00 0.18 H new ATOM 0 HB VAL A 100 2.238 -7.451 -4.767 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.694 -9.431 -4.677 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.620 -7.918 -4.544 1.00 0.26 H new ATOM 0 HG13 VAL A 100 4.309 -8.901 -3.094 1.00 0.26 H new ATOM 0 HG21 VAL A 100 1.395 -9.568 -3.820 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.904 -9.038 -2.200 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.627 -8.152 -3.065 1.00 0.25 H new ATOM 427 N LEU A 101 5.067 -5.584 -2.849 1.00 0.19 N ATOM 428 CA LEU A 101 6.179 -4.786 -3.329 1.00 0.19 C ATOM 429 C LEU A 101 7.283 -5.697 -3.838 1.00 0.21 C ATOM 430 O LEU A 101 7.762 -6.574 -3.121 1.00 0.23 O ATOM 431 CB LEU A 101 6.734 -3.858 -2.238 1.00 0.19 C ATOM 432 CG LEU A 101 5.761 -2.804 -1.700 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.867 -3.395 -0.620 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.523 -1.595 -1.171 1.00 0.21 C ATOM 0 H LEU A 101 5.231 -6.038 -1.950 1.00 0.19 H new ATOM 0 HA LEU A 101 5.810 -4.159 -4.140 1.00 0.19 H new ATOM 0 HB2 LEU A 101 7.073 -4.472 -1.403 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.611 -3.347 -2.634 1.00 0.19 H new ATOM 0 HG LEU A 101 5.124 -2.475 -2.521 1.00 0.22 H new ATOM 0 HD11 LEU A 101 4.185 -2.628 -0.253 1.00 0.30 H new ATOM 0 HD12 LEU A 101 4.293 -4.223 -1.036 1.00 0.30 H new ATOM 0 HD13 LEU A 101 5.482 -3.758 0.203 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.816 -0.856 -0.793 1.00 0.21 H new ATOM 0 HD22 LEU A 101 7.187 -1.908 -0.365 1.00 0.21 H new ATOM 0 HD23 LEU A 101 7.112 -1.155 -1.976 1.00 0.21 H new ATOM 446 N GLU A 102 7.674 -5.492 -5.077 1.00 0.24 N ATOM 447 CA GLU A 102 8.691 -6.313 -5.698 1.00 0.29 C ATOM 448 C GLU A 102 10.019 -5.568 -5.754 1.00 0.28 C ATOM 449 O GLU A 102 10.057 -4.359 -5.997 1.00 0.26 O ATOM 450 CB GLU A 102 8.247 -6.721 -7.107 1.00 0.34 C ATOM 451 CG GLU A 102 9.205 -7.676 -7.798 1.00 0.41 C ATOM 452 CD GLU A 102 8.679 -8.170 -9.127 1.00 0.53 C ATOM 453 OE1 GLU A 102 8.038 -9.243 -9.156 1.00 1.32 O ATOM 454 OE2 GLU A 102 8.909 -7.496 -10.153 1.00 0.95 O ATOM 0 H GLU A 102 7.300 -4.758 -5.678 1.00 0.24 H new ATOM 0 HA GLU A 102 8.829 -7.213 -5.098 1.00 0.29 H new ATOM 0 HB2 GLU A 102 7.264 -7.187 -7.047 1.00 0.34 H new ATOM 0 HB3 GLU A 102 8.138 -5.825 -7.718 1.00 0.34 H new ATOM 0 HG2 GLU A 102 10.161 -7.176 -7.953 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.394 -8.529 -7.147 1.00 0.41 H new ATOM 461 N ASN A 103 11.097 -6.294 -5.486 1.00 0.38 N ATOM 462 CA ASN A 103 12.447 -5.757 -5.615 1.00 0.44 C ATOM 463 C ASN A 103 12.803 -5.600 -7.087 1.00 0.37 C ATOM 464 O ASN A 103 13.158 -6.570 -7.759 1.00 0.51 O ATOM 465 CB ASN A 103 13.455 -6.681 -4.917 1.00 0.68 C ATOM 466 CG ASN A 103 14.899 -6.406 -5.310 1.00 0.87 C ATOM 467 OD1 ASN A 103 15.275 -5.281 -5.639 1.00 1.76 O ATOM 468 ND2 ASN A 103 15.721 -7.444 -5.286 1.00 1.64 N ATOM 0 H ASN A 103 11.062 -7.265 -5.175 1.00 0.38 H new ATOM 0 HA ASN A 103 12.487 -4.778 -5.137 1.00 0.44 H new ATOM 0 HB2 ASN A 103 13.352 -6.569 -3.838 1.00 0.68 H new ATOM 0 HB3 ASN A 103 13.212 -7.717 -5.155 1.00 0.68 H new ATOM 0 HD21 ASN A 103 16.700 -7.325 -5.545 1.00 1.64 H new ATOM 0 HD22 ASN A 103 15.375 -8.362 -5.008 1.00 1.64 H new ATOM 475 N THR A 104 12.693 -4.382 -7.584 1.00 0.34 N ATOM 476 CA THR A 104 12.991 -4.102 -8.971 1.00 0.38 C ATOM 477 C THR A 104 14.355 -3.433 -9.123 1.00 0.50 C ATOM 478 O THR A 104 14.495 -2.417 -9.803 1.00 0.70 O ATOM 479 CB THR A 104 11.885 -3.234 -9.597 1.00 0.55 C ATOM 480 OG1 THR A 104 11.537 -2.162 -8.712 1.00 0.77 O ATOM 481 CG2 THR A 104 10.650 -4.073 -9.887 1.00 0.73 C ATOM 0 H THR A 104 12.398 -3.569 -7.043 1.00 0.34 H new ATOM 0 HA THR A 104 13.028 -5.052 -9.503 1.00 0.38 H new ATOM 0 HB THR A 104 12.262 -2.821 -10.533 1.00 0.55 H new ATOM 0 HG1 THR A 104 12.091 -1.379 -8.913 1.00 0.77 H new ATOM 0 HG21 THR A 104 9.878 -3.443 -10.329 1.00 0.73 H new ATOM 0 HG22 THR A 104 10.908 -4.873 -10.581 1.00 0.73 H new ATOM 0 HG23 THR A 104 10.278 -4.505 -8.958 1.00 0.73 H new ATOM 489 N GLY A 105 15.365 -4.019 -8.492 1.00 0.52 N ATOM 490 CA GLY A 105 16.721 -3.529 -8.650 1.00 0.72 C ATOM 491 C GLY A 105 17.378 -3.133 -7.344 1.00 0.66 C ATOM 492 O GLY A 105 18.567 -3.377 -7.149 1.00 0.80 O ATOM 0 H GLY A 105 15.269 -4.825 -7.874 1.00 0.52 H new ATOM 0 HA2 GLY A 105 17.323 -4.300 -9.131 1.00 0.72 H new ATOM 0 HA3 GLY A 105 16.712 -2.668 -9.318 1.00 0.72 H new ATOM 496 N GLU A 106 16.620 -2.537 -6.445 1.00 0.60 N ATOM 497 CA GLU A 106 17.154 -2.149 -5.150 1.00 0.56 C ATOM 498 C GLU A 106 16.471 -2.951 -4.051 1.00 0.65 C ATOM 499 O GLU A 106 15.325 -2.685 -3.691 1.00 1.05 O ATOM 500 CB GLU A 106 16.982 -0.648 -4.930 1.00 0.68 C ATOM 501 CG GLU A 106 17.732 0.200 -5.949 1.00 1.25 C ATOM 502 CD GLU A 106 19.234 0.191 -5.741 1.00 1.91 C ATOM 503 OE1 GLU A 106 19.828 1.282 -5.630 1.00 2.54 O ATOM 504 OE2 GLU A 106 19.836 -0.902 -5.690 1.00 2.47 O ATOM 0 H GLU A 106 15.635 -2.310 -6.584 1.00 0.60 H new ATOM 0 HA GLU A 106 18.222 -2.367 -5.121 1.00 0.56 H new ATOM 0 HB2 GLU A 106 15.921 -0.401 -4.972 1.00 0.68 H new ATOM 0 HB3 GLU A 106 17.329 -0.392 -3.929 1.00 0.68 H new ATOM 0 HG2 GLU A 106 17.508 -0.165 -6.951 1.00 1.25 H new ATOM 0 HG3 GLU A 106 17.370 1.227 -5.895 1.00 1.25 H new ATOM 511 N LYS A 107 17.195 -3.940 -3.543 1.00 0.61 N ATOM 512 CA LYS A 107 16.641 -4.941 -2.635 1.00 0.69 C ATOM 513 C LYS A 107 16.293 -4.374 -1.263 1.00 0.66 C ATOM 514 O LYS A 107 16.781 -3.319 -0.858 1.00 0.76 O ATOM 515 CB LYS A 107 17.642 -6.086 -2.474 1.00 0.86 C ATOM 516 CG LYS A 107 18.947 -5.667 -1.819 1.00 1.37 C ATOM 517 CD LYS A 107 20.003 -6.747 -1.951 1.00 1.80 C ATOM 518 CE LYS A 107 21.307 -6.330 -1.298 1.00 2.66 C ATOM 519 NZ LYS A 107 22.410 -7.281 -1.599 1.00 3.32 N ATOM 0 H LYS A 107 18.185 -4.073 -3.748 1.00 0.61 H new ATOM 0 HA LYS A 107 15.711 -5.297 -3.078 1.00 0.69 H new ATOM 0 HB2 LYS A 107 17.184 -6.876 -1.879 1.00 0.86 H new ATOM 0 HB3 LYS A 107 17.857 -6.510 -3.455 1.00 0.86 H new ATOM 0 HG2 LYS A 107 19.307 -4.746 -2.278 1.00 1.37 H new ATOM 0 HG3 LYS A 107 18.774 -5.452 -0.765 1.00 1.37 H new ATOM 0 HD2 LYS A 107 19.643 -7.668 -1.492 1.00 1.80 H new ATOM 0 HD3 LYS A 107 20.175 -6.962 -3.006 1.00 1.80 H new ATOM 0 HE2 LYS A 107 21.583 -5.334 -1.643 1.00 2.66 H new ATOM 0 HE3 LYS A 107 21.168 -6.266 -0.219 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 23.283 -6.959 -1.134 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 22.159 -8.227 -1.247 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 22.561 -7.323 -2.627 1.00 3.32 H new ATOM 533 N LEU A 108 15.450 -5.106 -0.550 1.00 0.59 N ATOM 534 CA LEU A 108 15.076 -4.753 0.805 1.00 0.57 C ATOM 535 C LEU A 108 15.916 -5.582 1.772 1.00 0.63 C ATOM 536 O LEU A 108 15.590 -6.730 2.064 1.00 0.74 O ATOM 537 CB LEU A 108 13.574 -5.031 1.019 1.00 0.60 C ATOM 538 CG LEU A 108 12.891 -4.333 2.211 1.00 0.58 C ATOM 539 CD1 LEU A 108 13.417 -4.834 3.549 1.00 0.61 C ATOM 540 CD2 LEU A 108 13.057 -2.831 2.105 1.00 0.56 C ATOM 0 H LEU A 108 15.009 -5.958 -0.896 1.00 0.59 H new ATOM 0 HA LEU A 108 15.257 -3.693 0.983 1.00 0.57 H new ATOM 0 HB2 LEU A 108 13.045 -4.743 0.111 1.00 0.60 H new ATOM 0 HB3 LEU A 108 13.443 -6.107 1.137 1.00 0.60 H new ATOM 0 HG LEU A 108 11.830 -4.580 2.169 1.00 0.58 H new ATOM 0 HD11 LEU A 108 12.906 -4.313 4.359 1.00 0.61 H new ATOM 0 HD12 LEU A 108 13.234 -5.905 3.634 1.00 0.61 H new ATOM 0 HD13 LEU A 108 14.488 -4.643 3.613 1.00 0.61 H new ATOM 0 HD21 LEU A 108 12.570 -2.350 2.953 1.00 0.56 H new ATOM 0 HD22 LEU A 108 14.118 -2.581 2.107 1.00 0.56 H new ATOM 0 HD23 LEU A 108 12.603 -2.479 1.179 1.00 0.56 H new ATOM 552 N LYS A 109 17.003 -5.005 2.254 1.00 0.62 N ATOM 553 CA LYS A 109 17.872 -5.705 3.186 1.00 0.73 C ATOM 554 C LYS A 109 17.951 -4.985 4.529 1.00 0.75 C ATOM 555 O LYS A 109 17.714 -5.581 5.578 1.00 1.15 O ATOM 556 CB LYS A 109 19.273 -5.855 2.585 1.00 0.92 C ATOM 557 CG LYS A 109 20.239 -6.640 3.464 1.00 1.17 C ATOM 558 CD LYS A 109 19.742 -8.055 3.735 1.00 1.66 C ATOM 559 CE LYS A 109 19.658 -8.879 2.460 1.00 2.07 C ATOM 560 NZ LYS A 109 19.124 -10.244 2.710 1.00 2.72 N ATOM 0 H LYS A 109 17.304 -4.060 2.018 1.00 0.62 H new ATOM 0 HA LYS A 109 17.446 -6.693 3.363 1.00 0.73 H new ATOM 0 HB2 LYS A 109 19.192 -6.351 1.618 1.00 0.92 H new ATOM 0 HB3 LYS A 109 19.687 -4.864 2.401 1.00 0.92 H new ATOM 0 HG2 LYS A 109 21.215 -6.685 2.980 1.00 1.17 H new ATOM 0 HG3 LYS A 109 20.376 -6.116 4.410 1.00 1.17 H new ATOM 0 HD2 LYS A 109 20.411 -8.546 4.441 1.00 1.66 H new ATOM 0 HD3 LYS A 109 18.759 -8.011 4.205 1.00 1.66 H new ATOM 0 HE2 LYS A 109 19.020 -8.367 1.739 1.00 2.07 H new ATOM 0 HE3 LYS A 109 20.649 -8.954 2.012 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 19.084 -10.771 1.814 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 19.746 -10.743 3.377 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 18.168 -10.174 3.114 1.00 2.72 H new ATOM 574 N LYS A 110 18.265 -3.698 4.487 1.00 0.62 N ATOM 575 CA LYS A 110 18.532 -2.936 5.703 1.00 0.73 C ATOM 576 C LYS A 110 17.260 -2.318 6.290 1.00 0.77 C ATOM 577 O LYS A 110 16.631 -2.896 7.178 1.00 1.53 O ATOM 578 CB LYS A 110 19.559 -1.838 5.419 1.00 0.93 C ATOM 579 CG LYS A 110 20.889 -2.361 4.902 1.00 1.14 C ATOM 580 CD LYS A 110 21.824 -1.222 4.543 1.00 1.46 C ATOM 581 CE LYS A 110 23.154 -1.731 4.021 1.00 1.80 C ATOM 582 NZ LYS A 110 24.003 -0.624 3.513 1.00 1.59 N ATOM 0 H LYS A 110 18.342 -3.158 3.625 1.00 0.62 H new ATOM 0 HA LYS A 110 18.930 -3.632 6.441 1.00 0.73 H new ATOM 0 HB2 LYS A 110 19.143 -1.145 4.688 1.00 0.93 H new ATOM 0 HB3 LYS A 110 19.733 -1.271 6.333 1.00 0.93 H new ATOM 0 HG2 LYS A 110 21.354 -2.992 5.660 1.00 1.14 H new ATOM 0 HG3 LYS A 110 20.721 -2.987 4.026 1.00 1.14 H new ATOM 0 HD2 LYS A 110 21.355 -0.590 3.789 1.00 1.46 H new ATOM 0 HD3 LYS A 110 21.992 -0.599 5.421 1.00 1.46 H new ATOM 0 HE2 LYS A 110 23.680 -2.258 4.817 1.00 1.80 H new ATOM 0 HE3 LYS A 110 22.980 -2.452 3.223 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 24.935 -0.997 3.243 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.550 -0.192 2.683 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 24.120 0.093 4.257 1.00 1.59 H new ATOM 596 N SER A 111 16.886 -1.151 5.781 1.00 0.51 N ATOM 597 CA SER A 111 15.760 -0.395 6.318 1.00 0.52 C ATOM 598 C SER A 111 14.442 -0.841 5.690 1.00 0.48 C ATOM 599 O SER A 111 14.331 -0.955 4.471 1.00 0.86 O ATOM 600 CB SER A 111 15.983 1.093 6.055 1.00 0.72 C ATOM 601 OG SER A 111 17.286 1.492 6.446 1.00 1.55 O ATOM 0 H SER A 111 17.350 -0.704 4.990 1.00 0.51 H new ATOM 0 HA SER A 111 15.699 -0.580 7.391 1.00 0.52 H new ATOM 0 HB2 SER A 111 15.838 1.304 4.995 1.00 0.72 H new ATOM 0 HB3 SER A 111 15.242 1.677 6.601 1.00 0.72 H new ATOM 0 HG SER A 111 17.527 2.321 5.982 1.00 1.55 H new ATOM 607 N LYS A 112 13.441 -1.080 6.523 1.00 0.39 N ATOM 608 CA LYS A 112 12.140 -1.527 6.042 1.00 0.32 C ATOM 609 C LYS A 112 11.287 -0.341 5.594 1.00 0.28 C ATOM 610 O LYS A 112 11.330 0.733 6.198 1.00 0.33 O ATOM 611 CB LYS A 112 11.416 -2.321 7.130 1.00 0.45 C ATOM 612 CG LYS A 112 12.147 -3.588 7.541 1.00 0.55 C ATOM 613 CD LYS A 112 11.388 -4.348 8.614 1.00 0.69 C ATOM 614 CE LYS A 112 12.043 -5.685 8.914 1.00 0.84 C ATOM 615 NZ LYS A 112 11.236 -6.502 9.860 1.00 1.53 N ATOM 0 H LYS A 112 13.503 -0.972 7.535 1.00 0.39 H new ATOM 0 HA LYS A 112 12.300 -2.176 5.181 1.00 0.32 H new ATOM 0 HB2 LYS A 112 11.285 -1.686 8.006 1.00 0.45 H new ATOM 0 HB3 LYS A 112 10.420 -2.584 6.775 1.00 0.45 H new ATOM 0 HG2 LYS A 112 12.285 -4.228 6.670 1.00 0.55 H new ATOM 0 HG3 LYS A 112 13.141 -3.332 7.909 1.00 0.55 H new ATOM 0 HD2 LYS A 112 11.345 -3.750 9.524 1.00 0.69 H new ATOM 0 HD3 LYS A 112 10.360 -4.509 8.290 1.00 0.69 H new ATOM 0 HE2 LYS A 112 12.181 -6.238 7.985 1.00 0.84 H new ATOM 0 HE3 LYS A 112 13.034 -5.517 9.335 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 11.675 -7.438 9.972 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 11.196 -6.026 10.784 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 10.272 -6.614 9.487 1.00 1.53 H new ATOM 629 N TRP A 113 10.526 -0.544 4.522 1.00 0.24 N ATOM 630 CA TRP A 113 9.680 0.506 3.961 1.00 0.22 C ATOM 631 C TRP A 113 8.477 0.779 4.845 1.00 0.21 C ATOM 632 O TRP A 113 7.814 -0.146 5.319 1.00 0.25 O ATOM 633 CB TRP A 113 9.214 0.136 2.548 1.00 0.22 C ATOM 634 CG TRP A 113 10.234 0.431 1.495 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.545 0.061 1.504 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.031 1.152 0.271 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.173 0.521 0.380 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.267 1.189 -0.395 1.00 0.25 C ATOM 639 CE3 TRP A 113 8.929 1.774 -0.328 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.438 1.820 -1.621 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.102 2.397 -1.551 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.350 2.417 -2.184 1.00 0.32 C ATOM 0 H TRP A 113 10.478 -1.432 4.022 1.00 0.24 H new ATOM 0 HA TRP A 113 10.282 1.413 3.909 1.00 0.22 H new ATOM 0 HB2 TRP A 113 8.969 -0.926 2.520 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.298 0.681 2.320 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.020 -0.513 2.286 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.159 0.387 0.156 1.00 0.25 H new ATOM 0 HE3 TRP A 113 7.963 1.768 0.155 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.400 1.837 -2.111 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.259 2.877 -2.026 1.00 0.32 H new ATOM 0 HH2 TRP A 113 10.453 2.915 -3.137 1.00 0.32 H new ATOM 653 N LYS A 114 8.208 2.059 5.053 1.00 0.20 N ATOM 654 CA LYS A 114 7.093 2.500 5.867 1.00 0.24 C ATOM 655 C LYS A 114 5.860 2.692 4.995 1.00 0.20 C ATOM 656 O LYS A 114 5.897 3.430 4.007 1.00 0.24 O ATOM 657 CB LYS A 114 7.454 3.815 6.556 1.00 0.37 C ATOM 658 CG LYS A 114 6.322 4.418 7.369 1.00 0.58 C ATOM 659 CD LYS A 114 6.065 3.660 8.658 1.00 1.04 C ATOM 660 CE LYS A 114 4.849 4.218 9.376 1.00 1.08 C ATOM 661 NZ LYS A 114 4.730 3.701 10.764 1.00 1.66 N ATOM 0 H LYS A 114 8.760 2.821 4.659 1.00 0.20 H new ATOM 0 HA LYS A 114 6.877 1.745 6.623 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.309 3.647 7.211 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.768 4.535 5.800 1.00 0.37 H new ATOM 0 HG2 LYS A 114 6.560 5.456 7.603 1.00 0.58 H new ATOM 0 HG3 LYS A 114 5.412 4.427 6.769 1.00 0.58 H new ATOM 0 HD2 LYS A 114 5.911 2.603 8.440 1.00 1.04 H new ATOM 0 HD3 LYS A 114 6.939 3.728 9.306 1.00 1.04 H new ATOM 0 HE2 LYS A 114 4.911 5.306 9.399 1.00 1.08 H new ATOM 0 HE3 LYS A 114 3.949 3.962 8.816 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 3.886 4.109 11.215 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 4.645 2.665 10.742 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 5.576 3.967 11.307 1.00 1.66 H new ATOM 675 N TRP A 115 4.777 2.027 5.356 1.00 0.17 N ATOM 676 CA TRP A 115 3.545 2.123 4.598 1.00 0.15 C ATOM 677 C TRP A 115 2.396 2.536 5.499 1.00 0.16 C ATOM 678 O TRP A 115 2.400 2.243 6.700 1.00 0.18 O ATOM 679 CB TRP A 115 3.223 0.787 3.923 1.00 0.15 C ATOM 680 CG TRP A 115 3.004 -0.342 4.888 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.955 -1.164 5.409 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.755 -0.777 5.439 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.377 -2.079 6.254 1.00 0.22 N ATOM 684 CE2 TRP A 115 2.029 -1.865 6.286 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.434 -0.353 5.298 1.00 0.18 C ATOM 686 CZ2 TRP A 115 1.033 -2.533 6.989 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.555 -1.016 5.994 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.252 -2.097 6.831 1.00 0.22 C ATOM 0 H TRP A 115 4.727 1.415 6.170 1.00 0.17 H new ATOM 0 HA TRP A 115 3.679 2.883 3.828 1.00 0.15 H new ATOM 0 HB2 TRP A 115 2.330 0.906 3.309 1.00 0.15 H new ATOM 0 HB3 TRP A 115 4.039 0.524 3.250 1.00 0.15 H new ATOM 0 HD1 TRP A 115 5.011 -1.105 5.190 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.874 -2.802 6.774 1.00 0.22 H new ATOM 0 HE3 TRP A 115 0.190 0.480 4.655 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 1.266 -3.366 7.636 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.581 -0.696 5.892 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.050 -2.596 7.362 1.00 0.22 H new ATOM 699 N GLU A 116 1.424 3.225 4.922 1.00 0.17 N ATOM 700 CA GLU A 116 0.218 3.591 5.644 1.00 0.20 C ATOM 701 C GLU A 116 -1.005 3.404 4.753 1.00 0.19 C ATOM 702 O GLU A 116 -1.026 3.853 3.603 1.00 0.25 O ATOM 703 CB GLU A 116 0.296 5.042 6.142 1.00 0.32 C ATOM 704 CG GLU A 116 1.492 5.325 7.041 1.00 0.50 C ATOM 705 CD GLU A 116 1.439 6.701 7.668 1.00 0.64 C ATOM 706 OE1 GLU A 116 1.300 6.787 8.905 1.00 1.40 O ATOM 707 OE2 GLU A 116 1.531 7.702 6.927 1.00 1.22 O ATOM 0 H GLU A 116 1.448 3.542 3.953 1.00 0.17 H new ATOM 0 HA GLU A 116 0.128 2.938 6.512 1.00 0.20 H new ATOM 0 HB2 GLU A 116 0.336 5.709 5.281 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -0.618 5.278 6.686 1.00 0.32 H new ATOM 0 HG2 GLU A 116 1.535 4.573 7.829 1.00 0.50 H new ATOM 0 HG3 GLU A 116 2.409 5.230 6.459 1.00 0.50 H new ATOM 714 N LEU A 117 -2.009 2.718 5.277 1.00 0.17 N ATOM 715 CA LEU A 117 -3.265 2.532 4.574 1.00 0.16 C ATOM 716 C LEU A 117 -4.186 3.688 4.901 1.00 0.15 C ATOM 717 O LEU A 117 -4.370 4.032 6.070 1.00 0.19 O ATOM 718 CB LEU A 117 -3.941 1.220 4.978 1.00 0.19 C ATOM 719 CG LEU A 117 -5.274 0.940 4.278 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.055 0.424 2.868 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.108 -0.038 5.083 1.00 0.25 C ATOM 0 H LEU A 117 -1.975 2.278 6.196 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.060 2.494 3.504 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.258 0.397 4.769 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.108 1.231 6.055 1.00 0.19 H new ATOM 0 HG LEU A 117 -5.819 1.881 4.209 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.019 0.234 2.396 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.508 1.168 2.289 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.480 -0.502 2.904 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.051 -0.223 4.568 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -5.564 -0.976 5.192 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.310 0.381 6.069 1.00 0.25 H new ATOM 733 N HIS A 118 -4.758 4.288 3.881 1.00 0.13 N ATOM 734 CA HIS A 118 -5.587 5.457 4.079 1.00 0.14 C ATOM 735 C HIS A 118 -7.012 5.196 3.641 1.00 0.18 C ATOM 736 O HIS A 118 -7.262 4.365 2.767 1.00 0.21 O ATOM 737 CB HIS A 118 -5.001 6.655 3.334 1.00 0.18 C ATOM 738 CG HIS A 118 -3.663 7.064 3.870 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.509 8.011 4.856 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.418 6.621 3.581 1.00 0.24 C ATOM 741 CE1 HIS A 118 -2.228 8.134 5.150 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.545 7.303 4.389 1.00 0.22 N ATOM 0 H HIS A 118 -4.666 3.988 2.910 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.605 5.686 5.145 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.906 6.410 2.276 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.690 7.496 3.406 1.00 0.18 H new ATOM 0 HD1 HIS A 118 -4.267 8.536 5.292 1.00 0.50 H new ATOM 0 HD2 HIS A 118 -2.160 5.870 2.850 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.811 8.802 5.889 1.00 0.45 H new ATOM 751 N LYS A 119 -7.937 5.894 4.277 1.00 0.22 N ATOM 752 CA LYS A 119 -9.343 5.801 3.932 1.00 0.29 C ATOM 753 C LYS A 119 -9.688 6.954 3.003 1.00 0.27 C ATOM 754 O LYS A 119 -10.001 8.054 3.450 1.00 0.43 O ATOM 755 CB LYS A 119 -10.190 5.843 5.214 1.00 0.43 C ATOM 756 CG LYS A 119 -11.623 5.347 5.055 1.00 0.70 C ATOM 757 CD LYS A 119 -12.540 6.394 4.445 1.00 0.84 C ATOM 758 CE LYS A 119 -13.974 5.897 4.384 1.00 1.04 C ATOM 759 NZ LYS A 119 -14.908 6.942 3.891 1.00 1.69 N ATOM 0 H LYS A 119 -7.735 6.537 5.042 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.555 4.861 3.422 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -9.696 5.242 5.978 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -10.215 6.869 5.582 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -11.627 4.456 4.428 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -12.012 5.053 6.030 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -12.494 7.310 5.034 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -12.195 6.643 3.441 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -14.028 5.026 3.731 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -14.287 5.571 5.376 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -15.875 6.559 3.866 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -14.877 7.764 4.528 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -14.627 7.236 2.934 1.00 1.69 H new ATOM 773 N LEU A 120 -9.624 6.695 1.710 1.00 0.23 N ATOM 774 CA LEU A 120 -9.796 7.739 0.720 1.00 0.26 C ATOM 775 C LEU A 120 -11.275 7.942 0.439 1.00 0.34 C ATOM 776 O LEU A 120 -12.055 6.994 0.464 1.00 0.37 O ATOM 777 CB LEU A 120 -9.039 7.401 -0.575 1.00 0.24 C ATOM 778 CG LEU A 120 -7.506 7.362 -0.466 1.00 0.20 C ATOM 779 CD1 LEU A 120 -6.982 8.567 0.303 1.00 0.25 C ATOM 780 CD2 LEU A 120 -7.032 6.070 0.173 1.00 0.21 C ATOM 0 H LEU A 120 -9.454 5.768 1.321 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.380 8.666 1.115 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.383 6.430 -0.931 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -9.311 8.134 -1.334 1.00 0.24 H new ATOM 0 HG LEU A 120 -7.103 7.403 -1.478 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -5.895 8.514 0.365 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -7.272 9.482 -0.213 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.403 8.568 1.308 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -5.944 6.073 0.236 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.453 5.984 1.175 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.358 5.224 -0.432 1.00 0.21 H new ATOM 792 N GLU A 121 -11.661 9.176 0.177 1.00 0.46 N ATOM 793 CA GLU A 121 -13.064 9.503 -0.004 1.00 0.57 C ATOM 794 C GLU A 121 -13.407 9.600 -1.484 1.00 0.58 C ATOM 795 O GLU A 121 -14.552 9.861 -1.853 1.00 0.69 O ATOM 796 CB GLU A 121 -13.390 10.810 0.715 1.00 0.70 C ATOM 797 CG GLU A 121 -13.031 10.787 2.193 1.00 0.80 C ATOM 798 CD GLU A 121 -13.464 12.039 2.919 1.00 1.63 C ATOM 799 OE1 GLU A 121 -14.491 11.990 3.628 1.00 2.36 O ATOM 800 OE2 GLU A 121 -12.779 13.078 2.789 1.00 2.22 O ATOM 0 H GLU A 121 -11.025 9.968 0.085 1.00 0.46 H new ATOM 0 HA GLU A 121 -13.669 8.706 0.428 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -12.855 11.627 0.231 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -14.454 11.019 0.610 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -13.497 9.921 2.662 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -11.953 10.665 2.299 1.00 0.80 H new ATOM 807 N ASN A 122 -12.408 9.383 -2.323 1.00 0.53 N ATOM 808 CA ASN A 122 -12.596 9.390 -3.764 1.00 0.60 C ATOM 809 C ASN A 122 -11.547 8.501 -4.420 1.00 0.62 C ATOM 810 O ASN A 122 -10.360 8.606 -4.111 1.00 1.22 O ATOM 811 CB ASN A 122 -12.498 10.817 -4.304 1.00 0.73 C ATOM 812 CG ASN A 122 -12.937 10.925 -5.750 1.00 1.03 C ATOM 813 OD1 ASN A 122 -12.137 10.754 -6.668 1.00 1.16 O ATOM 814 ND2 ASN A 122 -14.209 11.219 -5.961 1.00 1.87 N ATOM 0 H ASN A 122 -11.450 9.198 -2.027 1.00 0.53 H new ATOM 0 HA ASN A 122 -13.588 9.002 -3.998 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -13.113 11.476 -3.691 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -11.469 11.166 -4.214 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -14.560 11.312 -6.914 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -14.839 11.353 -5.170 1.00 1.87 H new ATOM 821 N ALA A 123 -11.985 7.632 -5.321 1.00 0.67 N ATOM 822 CA ALA A 123 -11.091 6.659 -5.945 1.00 0.66 C ATOM 823 C ALA A 123 -10.753 7.059 -7.374 1.00 0.71 C ATOM 824 O ALA A 123 -10.523 6.209 -8.240 1.00 0.90 O ATOM 825 CB ALA A 123 -11.719 5.274 -5.921 1.00 0.69 C ATOM 0 H ALA A 123 -12.953 7.579 -5.638 1.00 0.67 H new ATOM 0 HA ALA A 123 -10.164 6.638 -5.372 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -11.042 4.559 -6.389 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -11.904 4.976 -4.889 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -12.662 5.292 -6.468 1.00 0.69 H new ATOM 831 N ARG A 124 -10.720 8.356 -7.616 1.00 0.72 N ATOM 832 CA ARG A 124 -10.444 8.877 -8.943 1.00 0.83 C ATOM 833 C ARG A 124 -9.464 10.042 -8.864 1.00 0.75 C ATOM 834 O ARG A 124 -8.451 10.069 -9.565 1.00 0.86 O ATOM 835 CB ARG A 124 -11.754 9.311 -9.598 1.00 1.08 C ATOM 836 CG ARG A 124 -11.626 9.677 -11.064 1.00 1.37 C ATOM 837 CD ARG A 124 -12.994 9.888 -11.688 1.00 1.63 C ATOM 838 NE ARG A 124 -13.849 8.709 -11.526 1.00 2.28 N ATOM 839 CZ ARG A 124 -14.734 8.297 -12.430 1.00 2.84 C ATOM 840 NH1 ARG A 124 -14.906 8.974 -13.556 1.00 2.76 N ATOM 841 NH2 ARG A 124 -15.455 7.207 -12.200 1.00 3.84 N ATOM 0 H ARG A 124 -10.882 9.072 -6.908 1.00 0.72 H new ATOM 0 HA ARG A 124 -9.986 8.097 -9.551 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -12.481 8.505 -9.499 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -12.152 10.168 -9.055 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -11.031 10.584 -11.166 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -11.097 8.887 -11.596 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -13.474 10.752 -11.229 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -12.880 10.112 -12.749 1.00 1.63 H new ATOM 0 HE ARG A 124 -13.760 8.170 -10.665 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -14.358 9.816 -13.734 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -15.586 8.653 -14.245 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -15.330 6.687 -11.332 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -16.134 6.889 -12.892 1.00 3.84 H new ATOM 855 N LYS A 125 -9.778 11.000 -8.004 1.00 0.75 N ATOM 856 CA LYS A 125 -8.897 12.129 -7.735 1.00 0.68 C ATOM 857 C LYS A 125 -7.588 11.647 -7.118 1.00 0.55 C ATOM 858 O LYS A 125 -7.522 10.531 -6.594 1.00 0.53 O ATOM 859 CB LYS A 125 -9.591 13.103 -6.778 1.00 0.79 C ATOM 860 CG LYS A 125 -10.878 13.691 -7.330 1.00 0.93 C ATOM 861 CD LYS A 125 -11.586 14.556 -6.300 1.00 1.64 C ATOM 862 CE LYS A 125 -10.762 15.776 -5.916 1.00 1.90 C ATOM 863 NZ LYS A 125 -10.520 16.677 -7.075 1.00 2.26 N ATOM 0 H LYS A 125 -10.649 11.017 -7.473 1.00 0.75 H new ATOM 0 HA LYS A 125 -8.675 12.635 -8.675 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -9.810 12.586 -5.844 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -8.904 13.915 -6.540 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -10.656 14.287 -8.215 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -11.540 12.885 -7.646 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -12.548 14.879 -6.698 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -11.792 13.963 -5.409 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -11.277 16.328 -5.130 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -9.806 15.452 -5.504 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -10.122 17.577 -6.738 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -9.851 16.226 -7.731 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -11.418 16.859 -7.567 1.00 2.26 H new ATOM 877 N PRO A 126 -6.527 12.468 -7.188 1.00 0.51 N ATOM 878 CA PRO A 126 -5.248 12.151 -6.554 1.00 0.45 C ATOM 879 C PRO A 126 -5.425 11.881 -5.067 1.00 0.39 C ATOM 880 O PRO A 126 -6.015 12.689 -4.345 1.00 0.47 O ATOM 881 CB PRO A 126 -4.399 13.412 -6.773 1.00 0.51 C ATOM 882 CG PRO A 126 -5.374 14.472 -7.157 1.00 0.59 C ATOM 883 CD PRO A 126 -6.477 13.762 -7.883 1.00 0.60 C ATOM 0 HA PRO A 126 -4.791 11.254 -6.972 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -3.856 13.684 -5.868 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -3.656 13.257 -7.556 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -5.755 14.992 -6.278 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -4.906 15.223 -7.793 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -7.423 14.299 -7.811 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -6.256 13.646 -8.944 1.00 0.60 H new ATOM 891 N LEU A 127 -4.920 10.749 -4.616 1.00 0.32 N ATOM 892 CA LEU A 127 -5.126 10.318 -3.246 1.00 0.26 C ATOM 893 C LEU A 127 -4.261 11.127 -2.294 1.00 0.29 C ATOM 894 O LEU A 127 -3.247 11.704 -2.694 1.00 0.37 O ATOM 895 CB LEU A 127 -4.829 8.827 -3.113 1.00 0.24 C ATOM 896 CG LEU A 127 -5.549 7.930 -4.126 1.00 0.26 C ATOM 897 CD1 LEU A 127 -5.286 6.470 -3.819 1.00 0.26 C ATOM 898 CD2 LEU A 127 -7.046 8.215 -4.145 1.00 0.27 C ATOM 0 H LEU A 127 -4.362 10.109 -5.181 1.00 0.32 H new ATOM 0 HA LEU A 127 -6.169 10.488 -2.980 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -3.754 8.675 -3.216 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -5.102 8.506 -2.108 1.00 0.24 H new ATOM 0 HG LEU A 127 -5.154 8.153 -5.117 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.804 5.846 -4.547 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -4.215 6.275 -3.871 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.649 6.237 -2.818 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -7.531 7.564 -4.873 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -7.464 8.029 -3.156 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -7.215 9.256 -4.420 1.00 0.27 H new ATOM 910 N LYS A 128 -4.666 11.169 -1.036 1.00 0.29 N ATOM 911 CA LYS A 128 -4.009 12.010 -0.055 1.00 0.36 C ATOM 912 C LYS A 128 -3.865 11.301 1.286 1.00 0.26 C ATOM 913 O LYS A 128 -4.634 10.400 1.622 1.00 0.23 O ATOM 914 CB LYS A 128 -4.795 13.308 0.119 1.00 0.51 C ATOM 915 CG LYS A 128 -6.259 13.094 0.476 1.00 1.10 C ATOM 916 CD LYS A 128 -7.001 14.414 0.616 1.00 1.37 C ATOM 917 CE LYS A 128 -7.057 15.177 -0.701 1.00 1.80 C ATOM 918 NZ LYS A 128 -7.714 16.499 -0.543 1.00 2.27 N ATOM 0 H LYS A 128 -5.450 10.628 -0.671 1.00 0.29 H new ATOM 0 HA LYS A 128 -3.006 12.235 -0.419 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -4.324 13.906 0.899 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -4.736 13.885 -0.804 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -6.737 12.488 -0.294 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -6.328 12.536 1.410 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -8.015 14.225 0.969 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -6.510 15.028 1.371 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -6.046 15.317 -1.084 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -7.599 14.587 -1.440 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -7.733 16.989 -1.460 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -8.687 16.364 -0.202 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -7.182 17.071 0.144 1.00 2.27 H new ATOM 932 N ASP A 129 -2.853 11.711 2.029 1.00 0.32 N ATOM 933 CA ASP A 129 -2.583 11.181 3.355 1.00 0.39 C ATOM 934 C ASP A 129 -3.222 12.065 4.421 1.00 0.45 C ATOM 935 O ASP A 129 -3.679 13.173 4.131 1.00 0.51 O ATOM 936 CB ASP A 129 -1.071 11.051 3.602 1.00 0.59 C ATOM 937 CG ASP A 129 -0.358 12.384 3.701 1.00 1.00 C ATOM 938 OD1 ASP A 129 -0.202 12.901 4.823 1.00 1.56 O ATOM 939 OD2 ASP A 129 0.078 12.905 2.656 1.00 1.88 O ATOM 0 H ASP A 129 -2.190 12.426 1.728 1.00 0.32 H new ATOM 0 HA ASP A 129 -3.022 10.185 3.416 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -0.908 10.492 4.523 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -0.627 10.470 2.794 1.00 0.59 H new ATOM 944 N GLY A 130 -3.264 11.558 5.645 1.00 0.51 N ATOM 945 CA GLY A 130 -3.883 12.280 6.743 1.00 0.62 C ATOM 946 C GLY A 130 -4.919 11.441 7.463 1.00 0.60 C ATOM 947 O GLY A 130 -5.011 11.480 8.690 1.00 0.75 O ATOM 0 H GLY A 130 -2.876 10.650 5.901 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -3.115 12.592 7.450 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -4.353 13.187 6.361 1.00 0.62 H new ATOM 951 N ASN A 131 -5.688 10.669 6.713 1.00 0.47 N ATOM 952 CA ASN A 131 -6.571 9.679 7.306 1.00 0.46 C ATOM 953 C ASN A 131 -5.941 8.300 7.195 1.00 0.40 C ATOM 954 O ASN A 131 -5.911 7.702 6.126 1.00 0.46 O ATOM 955 CB ASN A 131 -7.949 9.694 6.633 1.00 0.51 C ATOM 956 CG ASN A 131 -7.888 9.896 5.125 1.00 1.32 C ATOM 957 OD1 ASN A 131 -6.915 9.529 4.463 1.00 2.28 O ATOM 958 ND2 ASN A 131 -8.933 10.489 4.572 1.00 1.45 N ATOM 0 H ASN A 131 -5.719 10.709 5.694 1.00 0.47 H new ATOM 0 HA ASN A 131 -6.712 9.926 8.358 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -8.458 8.754 6.845 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -8.551 10.489 7.074 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -8.951 10.656 3.566 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -9.721 10.779 5.152 1.00 1.45 H new ATOM 965 N VAL A 132 -5.433 7.793 8.298 1.00 0.36 N ATOM 966 CA VAL A 132 -4.739 6.521 8.281 1.00 0.31 C ATOM 967 C VAL A 132 -5.485 5.489 9.115 1.00 0.28 C ATOM 968 O VAL A 132 -6.023 5.795 10.181 1.00 0.35 O ATOM 969 CB VAL A 132 -3.278 6.661 8.771 1.00 0.35 C ATOM 970 CG1 VAL A 132 -3.225 7.165 10.200 1.00 0.73 C ATOM 971 CG2 VAL A 132 -2.527 5.346 8.634 1.00 0.71 C ATOM 0 H VAL A 132 -5.486 8.239 9.214 1.00 0.36 H new ATOM 0 HA VAL A 132 -4.710 6.178 7.247 1.00 0.31 H new ATOM 0 HB VAL A 132 -2.786 7.399 8.137 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -2.186 7.253 10.516 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -3.707 8.141 10.260 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -3.745 6.464 10.853 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -1.503 5.473 8.986 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -3.023 4.580 9.230 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.516 5.041 7.588 1.00 0.71 H new ATOM 981 N ILE A 133 -5.538 4.275 8.601 1.00 0.23 N ATOM 982 CA ILE A 133 -6.266 3.197 9.242 1.00 0.26 C ATOM 983 C ILE A 133 -5.304 2.115 9.713 1.00 0.28 C ATOM 984 O ILE A 133 -5.355 1.671 10.857 1.00 0.38 O ATOM 985 CB ILE A 133 -7.286 2.589 8.260 1.00 0.31 C ATOM 986 CG1 ILE A 133 -8.167 3.689 7.657 1.00 0.34 C ATOM 987 CG2 ILE A 133 -8.140 1.536 8.950 1.00 0.38 C ATOM 988 CD1 ILE A 133 -9.051 4.394 8.664 1.00 0.35 C ATOM 0 H ILE A 133 -5.079 4.009 7.730 1.00 0.23 H new ATOM 0 HA ILE A 133 -6.795 3.602 10.105 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.737 2.103 7.453 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.528 4.426 7.172 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.795 3.252 6.881 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -8.852 1.121 8.237 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.500 0.739 9.329 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.681 1.992 9.779 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.642 5.157 8.158 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.718 3.670 9.133 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.430 4.863 9.428 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.407 1.723 8.820 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.419 0.694 9.104 1.00 0.30 C ATOM 1002 C GLU A 134 -2.048 1.219 8.720 1.00 0.23 C ATOM 1003 O GLU A 134 -1.939 2.029 7.802 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.726 -0.578 8.304 1.00 0.43 C ATOM 1005 CG GLU A 134 -5.080 -1.199 8.608 1.00 0.63 C ATOM 1006 CD GLU A 134 -5.137 -1.825 9.981 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -5.803 -1.261 10.874 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -4.508 -2.884 10.176 1.00 1.42 O ATOM 0 H GLU A 134 -4.344 2.110 7.878 1.00 0.25 H new ATOM 0 HA GLU A 134 -3.445 0.449 10.166 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -3.677 -0.344 7.240 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -2.948 -1.315 8.504 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -5.852 -0.434 8.529 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -5.305 -1.957 7.858 1.00 0.63 H new ATOM 1015 N LYS A 135 -1.008 0.782 9.410 1.00 0.28 N ATOM 1016 CA LYS A 135 0.341 1.240 9.102 1.00 0.25 C ATOM 1017 C LYS A 135 1.397 0.359 9.741 1.00 0.27 C ATOM 1018 O LYS A 135 1.143 -0.323 10.733 1.00 0.34 O ATOM 1019 CB LYS A 135 0.540 2.693 9.546 1.00 0.32 C ATOM 1020 CG LYS A 135 -0.014 3.000 10.928 1.00 0.56 C ATOM 1021 CD LYS A 135 0.296 4.427 11.341 1.00 0.62 C ATOM 1022 CE LYS A 135 -0.406 4.807 12.633 1.00 0.74 C ATOM 1023 NZ LYS A 135 -0.108 6.208 13.034 1.00 1.53 N ATOM 0 H LYS A 135 -1.068 0.117 10.181 1.00 0.28 H new ATOM 0 HA LYS A 135 0.457 1.178 8.020 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.605 2.923 9.534 1.00 0.32 H new ATOM 0 HB3 LYS A 135 0.063 3.352 8.820 1.00 0.32 H new ATOM 0 HG2 LYS A 135 -1.093 2.844 10.933 1.00 0.56 H new ATOM 0 HG3 LYS A 135 0.411 2.308 11.655 1.00 0.56 H new ATOM 0 HD2 LYS A 135 1.373 4.543 11.465 1.00 0.62 H new ATOM 0 HD3 LYS A 135 -0.009 5.109 10.548 1.00 0.62 H new ATOM 0 HE2 LYS A 135 -1.482 4.685 12.511 1.00 0.74 H new ATOM 0 HE3 LYS A 135 -0.097 4.128 13.428 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 -0.606 6.429 13.920 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 0.916 6.318 13.175 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 -0.426 6.858 12.287 1.00 1.53 H new ATOM 1037 N GLY A 136 2.581 0.382 9.150 1.00 0.30 N ATOM 1038 CA GLY A 136 3.695 -0.369 9.677 1.00 0.38 C ATOM 1039 C GLY A 136 4.850 -0.400 8.707 1.00 0.34 C ATOM 1040 O GLY A 136 5.074 0.563 7.968 1.00 0.29 O ATOM 0 H GLY A 136 2.789 0.914 8.305 1.00 0.30 H new ATOM 0 HA2 GLY A 136 4.021 0.074 10.618 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.376 -1.388 9.898 1.00 0.38 H new ATOM 1044 N PHE A 137 5.573 -1.504 8.700 1.00 0.38 N ATOM 1045 CA PHE A 137 6.664 -1.702 7.767 1.00 0.32 C ATOM 1046 C PHE A 137 6.385 -2.938 6.931 1.00 0.33 C ATOM 1047 O PHE A 137 5.610 -3.801 7.353 1.00 0.46 O ATOM 1048 CB PHE A 137 7.997 -1.854 8.505 1.00 0.42 C ATOM 1049 CG PHE A 137 8.419 -0.623 9.259 1.00 1.07 C ATOM 1050 CD1 PHE A 137 8.225 -0.532 10.629 1.00 2.05 C ATOM 1051 CD2 PHE A 137 9.011 0.443 8.599 1.00 1.81 C ATOM 1052 CE1 PHE A 137 8.612 0.598 11.323 1.00 2.86 C ATOM 1053 CE2 PHE A 137 9.399 1.573 9.290 1.00 2.60 C ATOM 1054 CZ PHE A 137 9.199 1.651 10.653 1.00 2.93 C ATOM 0 H PHE A 137 5.421 -2.285 9.338 1.00 0.38 H new ATOM 0 HA PHE A 137 6.738 -0.828 7.120 1.00 0.32 H new ATOM 0 HB2 PHE A 137 7.922 -2.688 9.203 1.00 0.42 H new ATOM 0 HB3 PHE A 137 8.773 -2.111 7.784 1.00 0.42 H new ATOM 0 HD1 PHE A 137 7.766 -1.354 11.159 1.00 2.05 H new ATOM 0 HD2 PHE A 137 9.170 0.389 7.532 1.00 1.81 H new ATOM 0 HE1 PHE A 137 8.455 0.657 12.390 1.00 2.86 H new ATOM 0 HE2 PHE A 137 9.859 2.396 8.764 1.00 2.60 H new ATOM 0 HZ PHE A 137 9.502 2.535 11.194 1.00 2.93 H new ATOM 1064 N VAL A 138 6.974 -3.017 5.746 1.00 0.27 N ATOM 1065 CA VAL A 138 6.686 -4.123 4.839 1.00 0.41 C ATOM 1066 C VAL A 138 7.034 -5.473 5.466 1.00 0.70 C ATOM 1067 O VAL A 138 6.134 -6.254 5.781 1.00 1.41 O ATOM 1068 CB VAL A 138 7.408 -3.955 3.485 1.00 0.53 C ATOM 1069 CG1 VAL A 138 7.183 -5.168 2.605 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.923 -2.703 2.771 1.00 0.48 C ATOM 0 H VAL A 138 7.647 -2.338 5.391 1.00 0.27 H new ATOM 0 HA VAL A 138 5.612 -4.103 4.653 1.00 0.41 H new ATOM 0 HB VAL A 138 8.475 -3.857 3.683 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.700 -5.030 1.655 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.571 -6.056 3.104 1.00 0.76 H new ATOM 0 HG13 VAL A 138 6.116 -5.292 2.422 1.00 0.76 H new ATOM 0 HG21 VAL A 138 7.444 -2.602 1.819 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.851 -2.779 2.592 1.00 0.48 H new ATOM 0 HG23 VAL A 138 7.127 -1.829 3.390 1.00 0.48 H new ATOM 1080 N SER A 139 8.330 -5.720 5.667 1.00 0.32 N ATOM 1081 CA SER A 139 8.818 -6.903 6.385 1.00 0.51 C ATOM 1082 C SER A 139 8.545 -8.232 5.657 1.00 0.39 C ATOM 1083 O SER A 139 9.483 -8.934 5.276 1.00 1.13 O ATOM 1084 CB SER A 139 8.217 -6.947 7.794 1.00 1.03 C ATOM 1085 OG SER A 139 8.641 -5.833 8.565 1.00 1.68 O ATOM 0 H SER A 139 9.074 -5.105 5.336 1.00 0.32 H new ATOM 0 HA SER A 139 9.902 -6.800 6.436 1.00 0.51 H new ATOM 0 HB2 SER A 139 7.129 -6.955 7.729 1.00 1.03 H new ATOM 0 HB3 SER A 139 8.513 -7.871 8.291 1.00 1.03 H new ATOM 0 HG SER A 139 8.434 -5.991 9.510 1.00 1.68 H new ATOM 1091 N ASN A 140 7.269 -8.561 5.468 1.00 0.51 N ATOM 1092 CA ASN A 140 6.846 -9.890 5.016 1.00 0.34 C ATOM 1093 C ASN A 140 7.485 -10.296 3.688 1.00 0.27 C ATOM 1094 O ASN A 140 7.325 -9.626 2.666 1.00 0.37 O ATOM 1095 CB ASN A 140 5.323 -9.943 4.889 1.00 0.37 C ATOM 1096 CG ASN A 140 4.806 -11.320 4.510 1.00 0.38 C ATOM 1097 OD1 ASN A 140 3.823 -11.441 3.783 1.00 0.94 O ATOM 1098 ND2 ASN A 140 5.438 -12.367 5.022 1.00 0.88 N ATOM 0 H ASN A 140 6.496 -7.914 5.624 1.00 0.51 H new ATOM 0 HA ASN A 140 7.185 -10.600 5.770 1.00 0.34 H new ATOM 0 HB2 ASN A 140 4.874 -9.640 5.835 1.00 0.37 H new ATOM 0 HB3 ASN A 140 5.001 -9.221 4.138 1.00 0.37 H new ATOM 0 HD21 ASN A 140 5.111 -13.311 4.816 1.00 0.88 H new ATOM 0 HD22 ASN A 140 6.251 -12.229 5.622 1.00 0.88 H new ATOM 1105 N GLN A 141 8.190 -11.420 3.724 1.00 0.35 N ATOM 1106 CA GLN A 141 8.859 -11.973 2.559 1.00 0.32 C ATOM 1107 C GLN A 141 8.035 -13.127 1.989 1.00 0.30 C ATOM 1108 O GLN A 141 8.065 -14.236 2.521 1.00 0.36 O ATOM 1109 CB GLN A 141 10.243 -12.494 2.967 1.00 0.39 C ATOM 1110 CG GLN A 141 11.147 -12.861 1.801 1.00 0.39 C ATOM 1111 CD GLN A 141 11.864 -11.657 1.227 1.00 0.52 C ATOM 1112 OE1 GLN A 141 12.966 -11.316 1.658 1.00 0.69 O ATOM 1113 NE2 GLN A 141 11.248 -11.001 0.258 1.00 0.63 N ATOM 0 H GLN A 141 8.313 -11.976 4.570 1.00 0.35 H new ATOM 0 HA GLN A 141 8.965 -11.196 1.802 1.00 0.32 H new ATOM 0 HB2 GLN A 141 10.740 -11.734 3.571 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.115 -13.371 3.601 1.00 0.39 H new ATOM 0 HG2 GLN A 141 11.882 -13.595 2.131 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.553 -13.334 1.019 1.00 0.39 H new ATOM 0 HE21 GLN A 141 10.335 -11.316 -0.071 1.00 0.63 H new ATOM 0 HE22 GLN A 141 11.686 -10.180 -0.160 1.00 0.63 H new ATOM 1122 N ILE A 142 7.281 -12.870 0.928 1.00 0.25 N ATOM 1123 CA ILE A 142 6.493 -13.927 0.299 1.00 0.27 C ATOM 1124 C ILE A 142 7.283 -14.616 -0.809 1.00 0.30 C ATOM 1125 O ILE A 142 6.976 -15.743 -1.202 1.00 0.37 O ATOM 1126 CB ILE A 142 5.142 -13.418 -0.256 1.00 0.27 C ATOM 1127 CG1 ILE A 142 5.338 -12.253 -1.233 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.234 -13.003 0.890 1.00 0.29 C ATOM 1129 CD1 ILE A 142 4.067 -11.852 -1.954 1.00 0.26 C ATOM 0 H ILE A 142 7.197 -11.953 0.488 1.00 0.25 H new ATOM 0 HA ILE A 142 6.272 -14.649 1.085 1.00 0.27 H new ATOM 0 HB ILE A 142 4.674 -14.234 -0.807 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.724 -11.392 -0.687 1.00 0.24 H new ATOM 0 HG13 ILE A 142 6.093 -12.529 -1.969 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.285 -12.646 0.491 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.055 -13.859 1.541 1.00 0.29 H new ATOM 0 HG23 ILE A 142 4.710 -12.206 1.461 1.00 0.29 H new ATOM 0 HD11 ILE A 142 4.278 -11.023 -2.629 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.691 -12.700 -2.527 1.00 0.26 H new ATOM 0 HD13 ILE A 142 3.317 -11.545 -1.225 1.00 0.26 H new ATOM 1141 N GLY A 143 8.314 -13.941 -1.287 1.00 0.28 N ATOM 1142 CA GLY A 143 9.189 -14.511 -2.291 1.00 0.34 C ATOM 1143 C GLY A 143 10.584 -13.958 -2.142 1.00 0.40 C ATOM 1144 O GLY A 143 10.769 -12.990 -1.420 1.00 0.53 O ATOM 0 H GLY A 143 8.564 -12.996 -0.994 1.00 0.28 H new ATOM 0 HA2 GLY A 143 9.208 -15.596 -2.193 1.00 0.34 H new ATOM 0 HA3 GLY A 143 8.806 -14.287 -3.287 1.00 0.34 H new ATOM 1148 N ASP A 144 11.552 -14.546 -2.832 1.00 0.48 N ATOM 1149 CA ASP A 144 12.957 -14.155 -2.683 1.00 0.56 C ATOM 1150 C ASP A 144 13.159 -12.667 -2.972 1.00 0.48 C ATOM 1151 O ASP A 144 14.037 -12.023 -2.396 1.00 0.56 O ATOM 1152 CB ASP A 144 13.847 -14.986 -3.616 1.00 0.70 C ATOM 1153 CG ASP A 144 13.728 -14.571 -5.071 1.00 1.63 C ATOM 1154 OD1 ASP A 144 12.693 -14.863 -5.697 1.00 2.49 O ATOM 1155 OD2 ASP A 144 14.673 -13.941 -5.594 1.00 2.30 O ATOM 0 H ASP A 144 11.395 -15.298 -3.503 1.00 0.48 H new ATOM 0 HA ASP A 144 13.240 -14.345 -1.648 1.00 0.56 H new ATOM 0 HB2 ASP A 144 14.886 -14.890 -3.300 1.00 0.70 H new ATOM 0 HB3 ASP A 144 13.581 -16.039 -3.521 1.00 0.70 H new ATOM 1160 N SER A 145 12.343 -12.127 -3.863 1.00 0.38 N ATOM 1161 CA SER A 145 12.426 -10.723 -4.225 1.00 0.35 C ATOM 1162 C SER A 145 11.044 -10.083 -4.184 1.00 0.31 C ATOM 1163 O SER A 145 10.784 -9.089 -4.863 1.00 0.36 O ATOM 1164 CB SER A 145 13.030 -10.586 -5.623 1.00 0.38 C ATOM 1165 OG SER A 145 14.287 -11.238 -5.694 1.00 1.08 O ATOM 0 H SER A 145 11.612 -12.644 -4.351 1.00 0.38 H new ATOM 0 HA SER A 145 13.066 -10.209 -3.508 1.00 0.35 H new ATOM 0 HB2 SER A 145 12.351 -11.014 -6.361 1.00 0.38 H new ATOM 0 HB3 SER A 145 13.148 -9.531 -5.872 1.00 0.38 H new ATOM 0 HG SER A 145 14.151 -12.208 -5.715 1.00 1.08 H new ATOM 1171 N LEU A 146 10.167 -10.646 -3.366 1.00 0.27 N ATOM 1172 CA LEU A 146 8.781 -10.217 -3.335 1.00 0.22 C ATOM 1173 C LEU A 146 8.322 -10.023 -1.893 1.00 0.21 C ATOM 1174 O LEU A 146 8.510 -10.901 -1.044 1.00 0.23 O ATOM 1175 CB LEU A 146 7.914 -11.259 -4.040 1.00 0.23 C ATOM 1176 CG LEU A 146 6.584 -10.754 -4.585 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.810 -9.704 -5.660 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.768 -11.913 -5.135 1.00 0.27 C ATOM 0 H LEU A 146 10.392 -11.400 -2.717 1.00 0.27 H new ATOM 0 HA LEU A 146 8.684 -9.263 -3.854 1.00 0.22 H new ATOM 0 HB2 LEU A 146 8.486 -11.682 -4.865 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.714 -12.071 -3.341 1.00 0.23 H new ATOM 0 HG LEU A 146 6.028 -10.292 -3.769 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.848 -9.356 -6.037 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.360 -8.863 -5.237 1.00 0.26 H new ATOM 0 HD13 LEU A 146 7.384 -10.139 -6.478 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.820 -11.539 -5.522 1.00 0.27 H new ATOM 0 HD22 LEU A 146 6.321 -12.399 -5.939 1.00 0.27 H new ATOM 0 HD23 LEU A 146 5.577 -12.633 -4.340 1.00 0.27 H new ATOM 1190 N TYR A 147 7.736 -8.868 -1.617 1.00 0.18 N ATOM 1191 CA TYR A 147 7.301 -8.524 -0.272 1.00 0.18 C ATOM 1192 C TYR A 147 5.809 -8.220 -0.245 1.00 0.16 C ATOM 1193 O TYR A 147 5.235 -7.828 -1.255 1.00 0.19 O ATOM 1194 CB TYR A 147 8.093 -7.322 0.245 1.00 0.19 C ATOM 1195 CG TYR A 147 9.537 -7.634 0.572 1.00 0.23 C ATOM 1196 CD1 TYR A 147 9.916 -7.991 1.862 1.00 1.21 C ATOM 1197 CD2 TYR A 147 10.519 -7.586 -0.408 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.230 -8.292 2.162 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.834 -7.881 -0.115 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.185 -8.237 1.170 1.00 0.36 C ATOM 1201 OH TYR A 147 13.490 -8.554 1.460 1.00 0.43 O ATOM 0 H TYR A 147 7.549 -8.147 -2.314 1.00 0.18 H new ATOM 0 HA TYR A 147 7.487 -9.379 0.377 1.00 0.18 H new ATOM 0 HB2 TYR A 147 8.063 -6.530 -0.504 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.604 -6.934 1.139 1.00 0.19 H new ATOM 0 HD1 TYR A 147 9.170 -8.033 2.642 1.00 1.21 H new ATOM 0 HD2 TYR A 147 10.249 -7.313 -1.417 1.00 1.10 H new ATOM 0 HE1 TYR A 147 11.508 -8.569 3.168 1.00 1.24 H new ATOM 0 HE2 TYR A 147 12.586 -7.833 -0.889 1.00 1.10 H new ATOM 0 HH TYR A 147 13.575 -9.524 1.567 1.00 0.43 H new ATOM 1211 N LYS A 148 5.190 -8.396 0.913 1.00 0.17 N ATOM 1212 CA LYS A 148 3.746 -8.229 1.036 1.00 0.18 C ATOM 1213 C LYS A 148 3.366 -7.434 2.285 1.00 0.19 C ATOM 1214 O LYS A 148 3.933 -7.629 3.360 1.00 0.28 O ATOM 1215 CB LYS A 148 3.077 -9.605 1.073 1.00 0.26 C ATOM 1216 CG LYS A 148 1.586 -9.574 1.374 1.00 0.34 C ATOM 1217 CD LYS A 148 1.033 -10.982 1.519 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.409 -10.976 2.007 1.00 0.62 C ATOM 1219 NZ LYS A 148 -0.908 -12.351 2.283 1.00 0.84 N ATOM 0 H LYS A 148 5.662 -8.654 1.780 1.00 0.17 H new ATOM 0 HA LYS A 148 3.398 -7.665 0.171 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.231 -10.096 0.112 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.574 -10.217 1.826 1.00 0.26 H new ATOM 0 HG2 LYS A 148 1.408 -9.013 2.291 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.060 -9.053 0.574 1.00 0.34 H new ATOM 0 HD2 LYS A 148 1.090 -11.495 0.559 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.651 -11.545 2.218 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -0.483 -10.374 2.913 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -1.044 -10.503 1.258 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -1.893 -12.303 2.613 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -0.862 -12.918 1.413 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.318 -12.794 3.017 1.00 0.84 H new ATOM 1233 N ILE A 149 2.405 -6.537 2.127 1.00 0.15 N ATOM 1234 CA ILE A 149 1.838 -5.800 3.248 1.00 0.18 C ATOM 1235 C ILE A 149 0.325 -5.914 3.246 1.00 0.22 C ATOM 1236 O ILE A 149 -0.326 -5.541 2.278 1.00 0.35 O ATOM 1237 CB ILE A 149 2.226 -4.306 3.226 1.00 0.18 C ATOM 1238 CG1 ILE A 149 2.018 -3.692 1.836 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.659 -4.143 3.669 1.00 0.19 C ATOM 1240 CD1 ILE A 149 2.287 -2.205 1.777 1.00 0.20 C ATOM 0 H ILE A 149 1.997 -6.299 1.223 1.00 0.15 H new ATOM 0 HA ILE A 149 2.249 -6.246 4.154 1.00 0.18 H new ATOM 0 HB ILE A 149 1.574 -3.774 3.919 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.671 -4.198 1.125 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.993 -3.879 1.517 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.927 -3.087 3.651 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.773 -4.530 4.682 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.313 -4.695 2.994 1.00 0.19 H new ATOM 0 HD11 ILE A 149 2.118 -1.845 0.762 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.616 -1.686 2.462 1.00 0.20 H new ATOM 0 HD13 ILE A 149 3.320 -2.011 2.064 1.00 0.20 H new ATOM 1252 N GLU A 150 -0.231 -6.450 4.315 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.671 -6.585 4.422 1.00 0.27 C ATOM 1254 C GLU A 150 -2.175 -5.907 5.686 1.00 0.24 C ATOM 1255 O GLU A 150 -1.409 -5.652 6.617 1.00 0.31 O ATOM 1256 CB GLU A 150 -2.091 -8.064 4.408 1.00 0.40 C ATOM 1257 CG GLU A 150 -1.715 -8.846 5.661 1.00 1.08 C ATOM 1258 CD GLU A 150 -0.237 -9.176 5.748 1.00 1.55 C ATOM 1259 OE1 GLU A 150 0.545 -8.330 6.230 1.00 2.03 O ATOM 1260 OE2 GLU A 150 0.147 -10.300 5.361 1.00 2.30 O ATOM 0 H GLU A 150 0.290 -6.798 5.120 1.00 0.24 H new ATOM 0 HA GLU A 150 -2.120 -6.096 3.557 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -3.171 -8.119 4.272 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -1.636 -8.548 3.544 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -2.003 -8.269 6.540 1.00 1.08 H new ATOM 0 HG3 GLU A 150 -2.288 -9.773 5.687 1.00 1.08 H new ATOM 1267 N THR A 151 -3.459 -5.597 5.699 1.00 0.21 N ATOM 1268 CA THR A 151 -4.087 -4.995 6.856 1.00 0.23 C ATOM 1269 C THR A 151 -4.187 -6.008 7.992 1.00 0.24 C ATOM 1270 O THR A 151 -4.323 -7.208 7.738 1.00 0.27 O ATOM 1271 CB THR A 151 -5.485 -4.452 6.495 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.315 -5.504 5.980 1.00 0.25 O ATOM 1273 CG2 THR A 151 -5.371 -3.354 5.452 1.00 0.29 C ATOM 0 H THR A 151 -4.090 -5.755 4.913 1.00 0.21 H new ATOM 0 HA THR A 151 -3.470 -4.160 7.187 1.00 0.23 H new ATOM 0 HB THR A 151 -5.935 -4.048 7.402 1.00 0.25 H new ATOM 0 HG1 THR A 151 -6.985 -5.750 6.651 1.00 0.25 H new ATOM 0 HG21 THR A 151 -6.365 -2.980 5.207 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.764 -2.539 5.846 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.902 -3.754 4.553 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.108 -5.539 9.234 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.128 -6.434 10.390 1.00 0.38 C ATOM 1283 C LYS A 152 -5.401 -7.274 10.372 1.00 0.39 C ATOM 1284 O LYS A 152 -5.378 -8.476 10.652 1.00 0.51 O ATOM 1285 CB LYS A 152 -4.027 -5.613 11.688 1.00 0.48 C ATOM 1286 CG LYS A 152 -3.734 -6.422 12.951 1.00 0.80 C ATOM 1287 CD LYS A 152 -4.960 -7.163 13.467 1.00 1.02 C ATOM 1288 CE LYS A 152 -4.657 -7.928 14.747 1.00 1.99 C ATOM 1289 NZ LYS A 152 -4.353 -7.020 15.887 1.00 2.42 N ATOM 0 H LYS A 152 -4.030 -4.549 9.467 1.00 0.31 H new ATOM 0 HA LYS A 152 -3.272 -7.108 10.344 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -3.244 -4.865 11.565 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.963 -5.073 11.831 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -2.941 -7.140 12.743 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -3.363 -5.754 13.729 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -5.765 -6.451 13.650 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -5.314 -7.856 12.704 1.00 1.02 H new ATOM 0 HE2 LYS A 152 -5.510 -8.557 15.003 1.00 1.99 H new ATOM 0 HE3 LYS A 152 -3.810 -8.593 14.579 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 -4.320 -7.570 16.769 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 -3.433 -6.562 15.730 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 -5.094 -6.293 15.959 1.00 2.42 H new ATOM 1303 N LYS A 153 -6.500 -6.636 10.004 1.00 0.37 N ATOM 1304 CA LYS A 153 -7.799 -7.285 9.985 1.00 0.43 C ATOM 1305 C LYS A 153 -8.568 -6.928 8.720 1.00 0.40 C ATOM 1306 O LYS A 153 -8.127 -6.082 7.937 1.00 0.40 O ATOM 1307 CB LYS A 153 -8.599 -6.909 11.245 1.00 0.51 C ATOM 1308 CG LYS A 153 -8.409 -5.467 11.712 1.00 0.57 C ATOM 1309 CD LYS A 153 -9.060 -4.461 10.774 1.00 0.66 C ATOM 1310 CE LYS A 153 -8.660 -3.034 11.118 1.00 0.69 C ATOM 1311 NZ LYS A 153 -8.933 -2.702 12.541 1.00 1.29 N ATOM 0 H LYS A 153 -6.516 -5.659 9.712 1.00 0.37 H new ATOM 0 HA LYS A 153 -7.647 -8.364 9.984 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -9.658 -7.078 11.051 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.313 -7.580 12.055 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -8.830 -5.353 12.711 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -7.343 -5.251 11.789 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -8.773 -4.682 9.746 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -10.144 -4.559 10.830 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -7.599 -2.896 10.912 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -9.202 -2.341 10.475 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -8.806 -1.681 12.690 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -9.910 -2.968 12.778 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -8.274 -3.225 13.152 1.00 1.29 H new ATOM 1325 N LYS A 154 -9.702 -7.589 8.516 1.00 0.43 N ATOM 1326 CA LYS A 154 -10.561 -7.312 7.371 1.00 0.44 C ATOM 1327 C LYS A 154 -11.074 -5.878 7.436 1.00 0.53 C ATOM 1328 O LYS A 154 -11.493 -5.405 8.496 1.00 0.67 O ATOM 1329 CB LYS A 154 -11.725 -8.304 7.331 1.00 0.44 C ATOM 1330 CG LYS A 154 -11.274 -9.748 7.162 1.00 0.47 C ATOM 1331 CD LYS A 154 -12.440 -10.718 7.254 1.00 0.54 C ATOM 1332 CE LYS A 154 -11.972 -12.157 7.100 1.00 0.66 C ATOM 1333 NZ LYS A 154 -13.079 -13.129 7.304 1.00 1.41 N ATOM 0 H LYS A 154 -10.049 -8.324 9.132 1.00 0.43 H new ATOM 0 HA LYS A 154 -9.981 -7.429 6.456 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.302 -8.215 8.252 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.392 -8.040 6.510 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -10.780 -9.864 6.197 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -10.538 -9.991 7.928 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -12.942 -10.597 8.214 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -13.171 -10.486 6.480 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -11.547 -12.295 6.106 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -11.176 -12.358 7.818 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -12.716 -14.097 7.190 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -13.468 -13.016 8.262 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -13.827 -12.955 6.603 1.00 1.41 H new ATOM 1347 N MET A 155 -11.030 -5.194 6.305 1.00 0.61 N ATOM 1348 CA MET A 155 -11.284 -3.765 6.268 1.00 0.76 C ATOM 1349 C MET A 155 -12.767 -3.453 6.075 1.00 0.62 C ATOM 1350 O MET A 155 -13.512 -4.242 5.490 1.00 0.57 O ATOM 1351 CB MET A 155 -10.453 -3.133 5.152 1.00 1.01 C ATOM 1352 CG MET A 155 -10.401 -1.619 5.226 1.00 1.22 C ATOM 1353 SD MET A 155 -9.956 -1.025 6.873 1.00 0.95 S ATOM 1354 CE MET A 155 -8.376 -1.830 7.118 1.00 0.80 C ATOM 0 H MET A 155 -10.820 -5.608 5.397 1.00 0.61 H new ATOM 0 HA MET A 155 -10.993 -3.341 7.229 1.00 0.76 H new ATOM 0 HB2 MET A 155 -9.438 -3.527 5.197 1.00 1.01 H new ATOM 0 HB3 MET A 155 -10.867 -3.429 4.188 1.00 1.01 H new ATOM 0 HG2 MET A 155 -9.677 -1.247 4.501 1.00 1.22 H new ATOM 0 HG3 MET A 155 -11.372 -1.211 4.945 1.00 1.22 H new ATOM 0 HE1 MET A 155 -7.797 -1.277 7.857 1.00 0.80 H new ATOM 0 HE2 MET A 155 -8.537 -2.848 7.472 1.00 0.80 H new ATOM 0 HE3 MET A 155 -7.831 -1.856 6.175 1.00 0.80 H new ATOM 1364 N LYS A 156 -13.174 -2.291 6.582 1.00 0.65 N ATOM 1365 CA LYS A 156 -14.562 -1.842 6.527 1.00 0.59 C ATOM 1366 C LYS A 156 -14.904 -1.293 5.142 1.00 0.44 C ATOM 1367 O LYS A 156 -14.012 -0.970 4.364 1.00 0.42 O ATOM 1368 CB LYS A 156 -14.794 -0.753 7.581 1.00 0.72 C ATOM 1369 CG LYS A 156 -14.561 -1.215 9.007 1.00 1.28 C ATOM 1370 CD LYS A 156 -14.920 -0.130 10.006 1.00 1.79 C ATOM 1371 CE LYS A 156 -14.656 -0.573 11.438 1.00 2.54 C ATOM 1372 NZ LYS A 156 -13.213 -0.841 11.688 1.00 3.40 N ATOM 0 H LYS A 156 -12.547 -1.632 7.044 1.00 0.65 H new ATOM 0 HA LYS A 156 -15.208 -2.696 6.730 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -14.134 0.089 7.370 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -15.817 -0.387 7.491 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -15.158 -2.106 9.205 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -13.516 -1.497 9.134 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -14.342 0.769 9.791 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -15.972 0.133 9.895 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -15.005 0.198 12.125 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -15.233 -1.473 11.650 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -13.047 -0.923 12.711 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -12.939 -1.729 11.220 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -12.644 -0.059 11.307 1.00 3.40 H new ATOM 1386 N PRO A 157 -16.208 -1.200 4.815 1.00 0.46 N ATOM 1387 CA PRO A 157 -16.674 -0.616 3.553 1.00 0.41 C ATOM 1388 C PRO A 157 -16.200 0.824 3.344 1.00 0.37 C ATOM 1389 O PRO A 157 -16.425 1.696 4.187 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.204 -0.647 3.668 1.00 0.52 C ATOM 1391 CG PRO A 157 -18.491 -0.900 5.109 1.00 0.63 C ATOM 1392 CD PRO A 157 -17.330 -1.691 5.630 1.00 0.63 C ATOM 0 HA PRO A 157 -16.281 -1.172 2.702 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.641 0.296 3.341 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -18.629 -1.430 3.040 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -18.601 0.037 5.655 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -19.424 -1.451 5.230 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -17.165 -1.515 6.693 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -17.482 -2.763 5.504 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.571 1.062 2.204 1.00 0.32 N ATOM 1401 CA GLY A 158 -15.066 2.373 1.870 1.00 0.33 C ATOM 1402 C GLY A 158 -13.987 2.291 0.813 1.00 0.27 C ATOM 1403 O GLY A 158 -13.750 1.223 0.250 1.00 0.27 O ATOM 0 H GLY A 158 -15.400 0.352 1.492 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.883 3.000 1.512 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.667 2.851 2.765 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.333 3.406 0.540 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.246 3.430 -0.425 1.00 0.26 C ATOM 1409 C ILE A 159 -10.919 3.445 0.314 1.00 0.21 C ATOM 1410 O ILE A 159 -10.723 4.246 1.225 1.00 0.24 O ATOM 1411 CB ILE A 159 -12.324 4.664 -1.350 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.701 4.748 -2.017 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -11.222 4.609 -2.400 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.941 6.044 -2.758 1.00 0.44 C ATOM 0 H ILE A 159 -13.535 4.307 0.973 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.331 2.538 -1.046 1.00 0.26 H new ATOM 0 HB ILE A 159 -12.181 5.560 -0.746 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.808 3.917 -2.714 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.471 4.627 -1.255 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -11.290 5.485 -3.045 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -10.250 4.595 -1.907 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -11.337 3.707 -3.001 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.936 6.030 -3.203 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.867 6.880 -2.062 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -13.194 6.158 -3.543 1.00 0.44 H new ATOM 1426 N TYR A 160 -10.021 2.552 -0.055 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.748 2.441 0.636 1.00 0.17 C ATOM 1428 C TYR A 160 -7.607 2.331 -0.356 1.00 0.16 C ATOM 1429 O TYR A 160 -7.806 1.941 -1.503 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.751 1.226 1.570 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.753 1.338 2.700 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -11.080 0.964 2.524 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -9.371 1.826 3.943 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -11.994 1.075 3.552 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -10.283 1.935 4.973 1.00 1.24 C ATOM 1436 CZ TYR A 160 -11.588 1.561 4.775 1.00 0.35 C ATOM 1437 OH TYR A 160 -12.488 1.668 5.810 1.00 0.43 O ATOM 0 H TYR A 160 -10.147 1.895 -0.825 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.604 3.343 1.231 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -8.969 0.330 0.988 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.753 1.098 1.990 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -11.401 0.580 1.567 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -8.346 2.124 4.106 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -13.022 0.782 3.398 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -9.970 2.314 5.934 1.00 1.24 H new ATOM 0 HH TYR A 160 -12.035 2.028 6.601 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.418 2.695 0.094 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.220 2.581 -0.716 1.00 0.14 C ATOM 1449 C ALA A 161 -3.987 2.583 0.171 1.00 0.14 C ATOM 1450 O ALA A 161 -4.008 3.134 1.277 1.00 0.14 O ATOM 1451 CB ALA A 161 -5.144 3.716 -1.722 1.00 0.14 C ATOM 0 H ALA A 161 -6.258 3.076 1.027 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.261 1.639 -1.263 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.238 3.612 -2.320 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -6.016 3.682 -2.375 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -5.123 4.669 -1.194 1.00 0.14 H new ATOM 1457 N PHE A 162 -2.923 1.966 -0.310 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.671 1.919 0.427 1.00 0.15 C ATOM 1459 C PHE A 162 -0.725 2.983 -0.095 1.00 0.15 C ATOM 1460 O PHE A 162 -0.450 3.038 -1.294 1.00 0.15 O ATOM 1461 CB PHE A 162 -1.003 0.545 0.293 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.756 -0.577 0.951 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -2.667 -1.339 0.236 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -1.544 -0.876 2.287 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -3.350 -2.375 0.843 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -2.225 -1.910 2.898 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.129 -2.660 2.175 1.00 0.24 C ATOM 0 H PHE A 162 -2.900 1.489 -1.211 1.00 0.14 H new ATOM 0 HA PHE A 162 -1.893 2.100 1.479 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -0.883 0.314 -0.766 1.00 0.17 H new ATOM 0 HB3 PHE A 162 -0.003 0.597 0.723 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -2.845 -1.120 -0.807 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -0.837 -0.293 2.858 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -4.057 -2.962 0.275 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -2.050 -2.131 3.941 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.663 -3.469 2.651 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.244 3.833 0.795 1.00 0.16 N ATOM 1478 CA LYS A 163 0.742 4.828 0.418 1.00 0.18 C ATOM 1479 C LYS A 163 2.089 4.436 0.982 1.00 0.20 C ATOM 1480 O LYS A 163 2.336 4.573 2.181 1.00 0.23 O ATOM 1481 CB LYS A 163 0.367 6.233 0.912 1.00 0.23 C ATOM 1482 CG LYS A 163 1.377 7.301 0.491 1.00 0.31 C ATOM 1483 CD LYS A 163 0.999 8.688 1.005 1.00 0.45 C ATOM 1484 CE LYS A 163 2.105 9.703 0.745 1.00 0.74 C ATOM 1485 NZ LYS A 163 1.744 11.067 1.218 1.00 1.28 N ATOM 0 H LYS A 163 -0.518 3.854 1.777 1.00 0.16 H new ATOM 0 HA LYS A 163 0.780 4.863 -0.671 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.617 6.498 0.525 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.290 6.222 1.999 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.364 7.033 0.867 1.00 0.31 H new ATOM 0 HG3 LYS A 163 1.446 7.325 -0.597 1.00 0.31 H new ATOM 0 HD2 LYS A 163 0.080 9.018 0.521 1.00 0.45 H new ATOM 0 HD3 LYS A 163 0.795 8.637 2.075 1.00 0.45 H new ATOM 0 HE2 LYS A 163 3.018 9.378 1.244 1.00 0.74 H new ATOM 0 HE3 LYS A 163 2.320 9.737 -0.323 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 2.146 11.776 0.572 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 0.709 11.165 1.238 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 2.124 11.215 2.175 1.00 1.28 H new ATOM 1499 N VAL A 164 2.943 3.916 0.125 1.00 0.22 N ATOM 1500 CA VAL A 164 4.299 3.610 0.517 1.00 0.26 C ATOM 1501 C VAL A 164 5.202 4.700 -0.038 1.00 0.33 C ATOM 1502 O VAL A 164 5.019 5.153 -1.167 1.00 0.34 O ATOM 1503 CB VAL A 164 4.757 2.208 0.024 1.00 0.28 C ATOM 1504 CG1 VAL A 164 3.706 1.158 0.346 1.00 0.27 C ATOM 1505 CG2 VAL A 164 5.078 2.200 -1.464 1.00 0.29 C ATOM 0 H VAL A 164 2.721 3.697 -0.846 1.00 0.22 H new ATOM 0 HA VAL A 164 4.357 3.579 1.605 1.00 0.26 H new ATOM 0 HB VAL A 164 5.676 1.964 0.556 1.00 0.28 H new ATOM 0 HG11 VAL A 164 4.045 0.184 -0.007 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.549 1.119 1.424 1.00 0.27 H new ATOM 0 HG13 VAL A 164 2.770 1.417 -0.148 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.393 1.200 -1.763 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.191 2.485 -2.029 1.00 0.29 H new ATOM 0 HG23 VAL A 164 5.880 2.909 -1.667 1.00 0.29 H new ATOM 1515 N TYR A 165 6.122 5.180 0.768 1.00 0.45 N ATOM 1516 CA TYR A 165 7.025 6.208 0.304 1.00 0.57 C ATOM 1517 C TYR A 165 8.452 5.702 0.313 1.00 0.70 C ATOM 1518 O TYR A 165 8.962 5.274 -0.715 1.00 1.67 O ATOM 1519 CB TYR A 165 6.878 7.512 1.112 1.00 0.62 C ATOM 1520 CG TYR A 165 6.315 7.345 2.514 1.00 0.63 C ATOM 1521 CD1 TYR A 165 7.153 7.265 3.620 1.00 1.30 C ATOM 1522 CD2 TYR A 165 4.941 7.288 2.728 1.00 1.38 C ATOM 1523 CE1 TYR A 165 6.637 7.133 4.897 1.00 1.31 C ATOM 1524 CE2 TYR A 165 4.422 7.153 4.002 1.00 1.45 C ATOM 1525 CZ TYR A 165 5.272 7.075 5.080 1.00 0.79 C ATOM 1526 OH TYR A 165 4.753 6.948 6.348 1.00 0.93 O ATOM 0 H TYR A 165 6.264 4.881 1.733 1.00 0.45 H new ATOM 0 HA TYR A 165 6.757 6.449 -0.725 1.00 0.57 H new ATOM 0 HB2 TYR A 165 7.856 7.988 1.185 1.00 0.62 H new ATOM 0 HB3 TYR A 165 6.233 8.193 0.557 1.00 0.62 H new ATOM 0 HD1 TYR A 165 8.223 7.307 3.480 1.00 1.30 H new ATOM 0 HD2 TYR A 165 4.269 7.350 1.885 1.00 1.38 H new ATOM 0 HE1 TYR A 165 7.301 7.076 5.747 1.00 1.31 H new ATOM 0 HE2 TYR A 165 3.353 7.109 4.150 1.00 1.45 H new ATOM 0 HH TYR A 165 3.774 6.923 6.300 1.00 0.93 H new ATOM 1536 N LYS A 166 9.083 5.729 1.472 1.00 0.48 N ATOM 1537 CA LYS A 166 10.450 5.259 1.619 1.00 0.49 C ATOM 1538 C LYS A 166 10.615 4.681 3.020 1.00 0.46 C ATOM 1539 O LYS A 166 9.732 4.855 3.861 1.00 0.55 O ATOM 1540 CB LYS A 166 11.444 6.414 1.372 1.00 0.57 C ATOM 1541 CG LYS A 166 11.431 6.955 -0.054 1.00 0.71 C ATOM 1542 CD LYS A 166 11.854 5.895 -1.071 1.00 0.94 C ATOM 1543 CE LYS A 166 11.580 6.353 -2.497 1.00 1.35 C ATOM 1544 NZ LYS A 166 11.852 5.283 -3.492 1.00 1.53 N ATOM 0 H LYS A 166 8.665 6.076 2.336 1.00 0.48 H new ATOM 0 HA LYS A 166 10.661 4.484 0.883 1.00 0.49 H new ATOM 0 HB2 LYS A 166 11.216 7.228 2.060 1.00 0.57 H new ATOM 0 HB3 LYS A 166 12.451 6.069 1.609 1.00 0.57 H new ATOM 0 HG2 LYS A 166 10.430 7.312 -0.297 1.00 0.71 H new ATOM 0 HG3 LYS A 166 12.101 7.812 -0.123 1.00 0.71 H new ATOM 0 HD2 LYS A 166 12.916 5.680 -0.954 1.00 0.94 H new ATOM 0 HD3 LYS A 166 11.317 4.967 -0.876 1.00 0.94 H new ATOM 0 HE2 LYS A 166 10.541 6.670 -2.582 1.00 1.35 H new ATOM 0 HE3 LYS A 166 12.198 7.222 -2.723 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 12.199 5.710 -4.374 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 12.571 4.633 -3.115 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 10.976 4.756 -3.684 1.00 1.53 H new ATOM 1558 N PRO A 167 11.715 3.957 3.293 1.00 0.44 N ATOM 1559 CA PRO A 167 11.976 3.418 4.629 1.00 0.47 C ATOM 1560 C PRO A 167 12.099 4.530 5.660 1.00 0.47 C ATOM 1561 O PRO A 167 12.737 5.555 5.406 1.00 0.50 O ATOM 1562 CB PRO A 167 13.315 2.685 4.475 1.00 0.58 C ATOM 1563 CG PRO A 167 13.457 2.446 3.012 1.00 0.60 C ATOM 1564 CD PRO A 167 12.783 3.606 2.342 1.00 0.49 C ATOM 0 HA PRO A 167 11.170 2.772 4.977 1.00 0.47 H new ATOM 0 HB2 PRO A 167 14.140 3.285 4.859 1.00 0.58 H new ATOM 0 HB3 PRO A 167 13.318 1.747 5.030 1.00 0.58 H new ATOM 0 HG2 PRO A 167 14.507 2.385 2.726 1.00 0.60 H new ATOM 0 HG3 PRO A 167 12.992 1.503 2.723 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.471 4.436 2.182 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.382 3.332 1.366 1.00 0.49 H new ATOM 1572 N ALA A 168 11.473 4.328 6.814 1.00 0.53 N ATOM 1573 CA ALA A 168 11.500 5.320 7.878 1.00 0.64 C ATOM 1574 C ALA A 168 12.937 5.674 8.240 1.00 0.71 C ATOM 1575 O ALA A 168 13.768 4.789 8.467 1.00 0.76 O ATOM 1576 CB ALA A 168 10.748 4.814 9.098 1.00 0.72 C ATOM 0 H ALA A 168 10.941 3.486 7.035 1.00 0.53 H new ATOM 0 HA ALA A 168 11.004 6.223 7.521 1.00 0.64 H new ATOM 0 HB1 ALA A 168 10.779 5.569 9.883 1.00 0.72 H new ATOM 0 HB2 ALA A 168 9.711 4.613 8.829 1.00 0.72 H new ATOM 0 HB3 ALA A 168 11.214 3.897 9.458 1.00 0.72 H new ATOM 1582 N GLY A 169 13.224 6.965 8.294 1.00 0.82 N ATOM 1583 CA GLY A 169 14.585 7.416 8.485 1.00 0.95 C ATOM 1584 C GLY A 169 15.114 8.125 7.255 1.00 0.96 C ATOM 1585 O GLY A 169 15.995 8.979 7.355 1.00 1.14 O ATOM 0 H GLY A 169 12.534 7.712 8.208 1.00 0.82 H new ATOM 0 HA2 GLY A 169 14.629 8.089 9.341 1.00 0.95 H new ATOM 0 HA3 GLY A 169 15.223 6.563 8.717 1.00 0.95 H new ATOM 1589 N TYR A 170 14.575 7.779 6.092 1.00 0.80 N ATOM 1590 CA TYR A 170 14.931 8.461 4.857 1.00 0.82 C ATOM 1591 C TYR A 170 13.981 9.641 4.649 1.00 0.86 C ATOM 1592 O TYR A 170 12.761 9.469 4.716 1.00 0.89 O ATOM 1593 CB TYR A 170 14.848 7.495 3.665 1.00 0.83 C ATOM 1594 CG TYR A 170 15.440 8.045 2.376 1.00 0.91 C ATOM 1595 CD1 TYR A 170 14.703 8.883 1.544 1.00 1.15 C ATOM 1596 CD2 TYR A 170 16.739 7.723 1.992 1.00 1.74 C ATOM 1597 CE1 TYR A 170 15.242 9.385 0.373 1.00 1.21 C ATOM 1598 CE2 TYR A 170 17.282 8.222 0.820 1.00 1.82 C ATOM 1599 CZ TYR A 170 16.529 9.052 0.017 1.00 1.11 C ATOM 1600 OH TYR A 170 17.066 9.555 -1.148 1.00 1.24 O ATOM 0 H TYR A 170 13.891 7.031 5.980 1.00 0.80 H new ATOM 0 HA TYR A 170 15.956 8.824 4.927 1.00 0.82 H new ATOM 0 HB2 TYR A 170 15.365 6.571 3.924 1.00 0.83 H new ATOM 0 HB3 TYR A 170 13.803 7.238 3.491 1.00 0.83 H new ATOM 0 HD1 TYR A 170 13.692 9.146 1.818 1.00 1.15 H new ATOM 0 HD2 TYR A 170 17.333 7.074 2.618 1.00 1.74 H new ATOM 0 HE1 TYR A 170 14.655 10.035 -0.259 1.00 1.21 H new ATOM 0 HE2 TYR A 170 18.291 7.962 0.536 1.00 1.82 H new ATOM 0 HH TYR A 170 17.983 9.226 -1.254 1.00 1.24 H new ATOM 1610 N PRO A 171 14.512 10.858 4.436 1.00 0.97 N ATOM 1611 CA PRO A 171 13.681 12.046 4.214 1.00 1.10 C ATOM 1612 C PRO A 171 12.853 11.941 2.933 1.00 1.07 C ATOM 1613 O PRO A 171 13.401 11.834 1.834 1.00 1.05 O ATOM 1614 CB PRO A 171 14.697 13.191 4.102 1.00 1.25 C ATOM 1615 CG PRO A 171 15.986 12.532 3.749 1.00 1.31 C ATOM 1616 CD PRO A 171 15.952 11.180 4.405 1.00 1.07 C ATOM 0 HA PRO A 171 12.956 12.186 5.016 1.00 1.10 H new ATOM 0 HB2 PRO A 171 14.399 13.909 3.338 1.00 1.25 H new ATOM 0 HB3 PRO A 171 14.778 13.739 5.041 1.00 1.25 H new ATOM 0 HG2 PRO A 171 16.094 12.439 2.668 1.00 1.31 H new ATOM 0 HG3 PRO A 171 16.834 13.117 4.105 1.00 1.31 H new ATOM 0 HD2 PRO A 171 16.518 10.442 3.836 1.00 1.07 H new ATOM 0 HD3 PRO A 171 16.380 11.207 5.407 1.00 1.07 H new ATOM 1624 N ALA A 172 11.535 11.967 3.078 1.00 1.22 N ATOM 1625 CA ALA A 172 10.646 11.894 1.928 1.00 1.31 C ATOM 1626 C ALA A 172 10.705 13.195 1.139 1.00 1.40 C ATOM 1627 O ALA A 172 10.231 14.232 1.606 1.00 1.67 O ATOM 1628 CB ALA A 172 9.220 11.600 2.372 1.00 1.60 C ATOM 0 H ALA A 172 11.060 12.038 3.978 1.00 1.22 H new ATOM 0 HA ALA A 172 10.975 11.079 1.283 1.00 1.31 H new ATOM 0 HB1 ALA A 172 8.570 11.549 1.498 1.00 1.60 H new ATOM 0 HB2 ALA A 172 9.193 10.647 2.901 1.00 1.60 H new ATOM 0 HB3 ALA A 172 8.875 12.393 3.035 1.00 1.60 H new ATOM 1634 N ASN A 173 11.307 13.142 -0.040 1.00 1.38 N ATOM 1635 CA ASN A 173 11.466 14.323 -0.877 1.00 1.53 C ATOM 1636 C ASN A 173 11.804 13.918 -2.302 1.00 1.91 C ATOM 1637 O ASN A 173 12.669 13.069 -2.525 1.00 2.60 O ATOM 1638 CB ASN A 173 12.569 15.228 -0.317 1.00 1.89 C ATOM 1639 CG ASN A 173 12.835 16.437 -1.194 1.00 2.51 C ATOM 1640 OD1 ASN A 173 13.671 16.393 -2.098 1.00 2.97 O ATOM 1641 ND2 ASN A 173 12.134 17.529 -0.933 1.00 3.18 N ATOM 0 H ASN A 173 11.696 12.288 -0.441 1.00 1.38 H new ATOM 0 HA ASN A 173 10.525 14.873 -0.880 1.00 1.53 H new ATOM 0 HB2 ASN A 173 12.287 15.563 0.681 1.00 1.89 H new ATOM 0 HB3 ASN A 173 13.488 14.651 -0.212 1.00 1.89 H new ATOM 0 HD21 ASN A 173 12.277 18.372 -1.489 1.00 3.18 H new ATOM 0 HD22 ASN A 173 11.450 17.527 -0.176 1.00 3.18 H new ATOM 1648 N GLY A 174 11.121 14.528 -3.259 1.00 2.02 N ATOM 1649 CA GLY A 174 11.368 14.226 -4.654 1.00 2.69 C ATOM 1650 C GLY A 174 10.290 13.344 -5.250 1.00 2.26 C ATOM 1651 O GLY A 174 10.573 12.513 -6.114 1.00 2.93 O ATOM 0 H GLY A 174 10.398 15.229 -3.094 1.00 2.02 H new ATOM 0 HA2 GLY A 174 11.428 15.156 -5.220 1.00 2.69 H new ATOM 0 HA3 GLY A 174 12.334 13.731 -4.751 1.00 2.69 H new ATOM 1655 N SER A 175 9.057 13.524 -4.777 1.00 1.44 N ATOM 1656 CA SER A 175 7.925 12.715 -5.220 1.00 1.23 C ATOM 1657 C SER A 175 8.177 11.242 -4.904 1.00 0.94 C ATOM 1658 O SER A 175 7.999 10.365 -5.749 1.00 1.36 O ATOM 1659 CB SER A 175 7.670 12.915 -6.717 1.00 1.79 C ATOM 1660 OG SER A 175 7.471 14.289 -7.017 1.00 2.26 O ATOM 0 H SER A 175 8.817 14.230 -4.081 1.00 1.44 H new ATOM 0 HA SER A 175 7.034 13.037 -4.682 1.00 1.23 H new ATOM 0 HB2 SER A 175 8.516 12.532 -7.289 1.00 1.79 H new ATOM 0 HB3 SER A 175 6.794 12.342 -7.021 1.00 1.79 H new ATOM 0 HG SER A 175 7.312 14.394 -7.978 1.00 2.26 H new ATOM 1666 N THR A 176 8.585 10.990 -3.670 1.00 0.64 N ATOM 1667 CA THR A 176 8.955 9.655 -3.228 1.00 0.90 C ATOM 1668 C THR A 176 7.743 8.835 -2.792 1.00 0.80 C ATOM 1669 O THR A 176 7.890 7.764 -2.210 1.00 1.05 O ATOM 1670 CB THR A 176 9.952 9.737 -2.060 1.00 1.30 C ATOM 1671 OG1 THR A 176 9.527 10.740 -1.127 1.00 1.49 O ATOM 1672 CG2 THR A 176 11.353 10.059 -2.556 1.00 1.76 C ATOM 0 H THR A 176 8.669 11.705 -2.947 1.00 0.64 H new ATOM 0 HA THR A 176 9.415 9.155 -4.081 1.00 0.90 H new ATOM 0 HB THR A 176 9.978 8.765 -1.567 1.00 1.30 H new ATOM 0 HG1 THR A 176 9.528 10.366 -0.221 1.00 1.49 H new ATOM 0 HG21 THR A 176 12.036 10.111 -1.708 1.00 1.76 H new ATOM 0 HG22 THR A 176 11.684 9.279 -3.242 1.00 1.76 H new ATOM 0 HG23 THR A 176 11.344 11.018 -3.074 1.00 1.76 H new ATOM 1680 N PHE A 177 6.551 9.336 -3.073 1.00 0.52 N ATOM 1681 CA PHE A 177 5.331 8.660 -2.652 1.00 0.45 C ATOM 1682 C PHE A 177 4.807 7.753 -3.759 1.00 0.41 C ATOM 1683 O PHE A 177 4.946 8.062 -4.945 1.00 0.50 O ATOM 1684 CB PHE A 177 4.252 9.680 -2.243 1.00 0.49 C ATOM 1685 CG PHE A 177 3.902 10.689 -3.312 1.00 0.55 C ATOM 1686 CD1 PHE A 177 2.859 10.452 -4.200 1.00 1.37 C ATOM 1687 CD2 PHE A 177 4.610 11.878 -3.424 1.00 1.31 C ATOM 1688 CE1 PHE A 177 2.535 11.378 -5.173 1.00 1.46 C ATOM 1689 CE2 PHE A 177 4.288 12.806 -4.396 1.00 1.38 C ATOM 1690 CZ PHE A 177 3.250 12.555 -5.272 1.00 0.86 C ATOM 0 H PHE A 177 6.401 10.204 -3.588 1.00 0.52 H new ATOM 0 HA PHE A 177 5.571 8.045 -1.784 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.348 9.140 -1.962 1.00 0.49 H new ATOM 0 HB3 PHE A 177 4.593 10.214 -1.356 1.00 0.49 H new ATOM 0 HD1 PHE A 177 2.295 9.533 -4.129 1.00 1.37 H new ATOM 0 HD2 PHE A 177 5.423 12.080 -2.743 1.00 1.31 H new ATOM 0 HE1 PHE A 177 1.722 11.181 -5.856 1.00 1.46 H new ATOM 0 HE2 PHE A 177 4.848 13.727 -4.471 1.00 1.38 H new ATOM 0 HZ PHE A 177 2.998 13.278 -6.033 1.00 0.86 H new ATOM 1700 N GLU A 178 4.230 6.626 -3.366 1.00 0.34 N ATOM 1701 CA GLU A 178 3.619 5.706 -4.308 1.00 0.32 C ATOM 1702 C GLU A 178 2.292 5.208 -3.751 1.00 0.28 C ATOM 1703 O GLU A 178 2.252 4.574 -2.693 1.00 0.28 O ATOM 1704 CB GLU A 178 4.543 4.514 -4.566 1.00 0.37 C ATOM 1705 CG GLU A 178 4.093 3.629 -5.716 1.00 0.40 C ATOM 1706 CD GLU A 178 4.277 4.293 -7.065 1.00 1.20 C ATOM 1707 OE1 GLU A 178 3.297 4.845 -7.612 1.00 1.91 O ATOM 1708 OE2 GLU A 178 5.412 4.272 -7.586 1.00 1.96 O ATOM 0 H GLU A 178 4.174 6.327 -2.392 1.00 0.34 H new ATOM 0 HA GLU A 178 3.449 6.231 -5.248 1.00 0.32 H new ATOM 0 HB2 GLU A 178 5.547 4.883 -4.775 1.00 0.37 H new ATOM 0 HB3 GLU A 178 4.606 3.912 -3.659 1.00 0.37 H new ATOM 0 HG2 GLU A 178 4.656 2.696 -5.694 1.00 0.40 H new ATOM 0 HG3 GLU A 178 3.043 3.371 -5.582 1.00 0.40 H new ATOM 1715 N TRP A 179 1.211 5.512 -4.445 1.00 0.28 N ATOM 1716 CA TRP A 179 -0.099 5.023 -4.056 1.00 0.26 C ATOM 1717 C TRP A 179 -0.443 3.762 -4.825 1.00 0.27 C ATOM 1718 O TRP A 179 -0.190 3.663 -6.027 1.00 0.38 O ATOM 1719 CB TRP A 179 -1.189 6.061 -4.331 1.00 0.27 C ATOM 1720 CG TRP A 179 -1.261 7.182 -3.344 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -0.782 8.450 -3.503 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.878 7.143 -2.053 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -1.077 9.202 -2.394 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.742 8.423 -1.491 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.535 6.152 -1.316 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -2.239 8.742 -0.233 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -3.026 6.470 -0.065 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.876 7.757 0.464 1.00 0.24 C ATOM 0 H TRP A 179 1.214 6.096 -5.282 1.00 0.28 H new ATOM 0 HA TRP A 179 -0.058 4.817 -2.986 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -1.027 6.481 -5.324 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -2.154 5.555 -4.353 1.00 0.27 H new ATOM 0 HD1 TRP A 179 -0.250 8.808 -4.372 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -0.838 10.185 -2.265 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.656 5.157 -1.718 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -2.125 9.734 0.178 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.534 5.713 0.514 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -3.273 7.975 1.445 1.00 0.24 H new ATOM 1739 N SER A 180 -1.009 2.797 -4.128 1.00 0.23 N ATOM 1740 CA SER A 180 -1.596 1.647 -4.783 1.00 0.28 C ATOM 1741 C SER A 180 -2.952 2.073 -5.337 1.00 0.28 C ATOM 1742 O SER A 180 -3.529 3.056 -4.861 1.00 0.36 O ATOM 1743 CB SER A 180 -1.751 0.491 -3.788 1.00 0.33 C ATOM 1744 OG SER A 180 -1.971 -0.735 -4.458 1.00 1.06 O ATOM 0 H SER A 180 -1.075 2.787 -3.110 1.00 0.23 H new ATOM 0 HA SER A 180 -0.955 1.297 -5.592 1.00 0.28 H new ATOM 0 HB2 SER A 180 -0.855 0.416 -3.172 1.00 0.33 H new ATOM 0 HB3 SER A 180 -2.584 0.696 -3.116 1.00 0.33 H new ATOM 0 HG SER A 180 -2.065 -1.455 -3.800 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.448 1.370 -6.348 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.744 1.710 -6.934 1.00 0.38 C ATOM 1752 C GLU A 181 -5.828 1.651 -5.867 1.00 0.34 C ATOM 1753 O GLU A 181 -5.957 0.649 -5.166 1.00 0.49 O ATOM 1754 CB GLU A 181 -5.097 0.763 -8.079 1.00 0.56 C ATOM 1755 CG GLU A 181 -4.228 0.927 -9.313 1.00 0.74 C ATOM 1756 CD GLU A 181 -4.547 -0.102 -10.372 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -3.940 -1.191 -10.348 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -5.419 0.167 -11.225 1.00 1.91 O ATOM 0 H GLU A 181 -2.982 0.570 -6.777 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.679 2.722 -7.334 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -5.015 -0.264 -7.724 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -6.139 0.921 -8.358 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -4.369 1.926 -9.725 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -3.178 0.843 -9.031 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.616 2.724 -5.727 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.615 2.822 -4.667 1.00 0.26 C ATOM 1767 C PRO A 182 -8.743 1.816 -4.852 1.00 0.28 C ATOM 1768 O PRO A 182 -9.520 1.901 -5.805 1.00 0.32 O ATOM 1769 CB PRO A 182 -8.137 4.258 -4.785 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.835 4.673 -6.186 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.606 3.909 -6.601 1.00 0.39 C ATOM 0 HA PRO A 182 -7.194 2.600 -3.686 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.207 4.305 -4.583 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -7.647 4.915 -4.066 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -8.673 4.449 -6.846 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -7.662 5.748 -6.244 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -6.645 3.630 -7.654 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.701 4.501 -6.462 1.00 0.39 H new ATOM 1779 N MET A 183 -8.820 0.864 -3.940 1.00 0.28 N ATOM 1780 CA MET A 183 -9.855 -0.150 -3.981 1.00 0.30 C ATOM 1781 C MET A 183 -11.057 0.302 -3.176 1.00 0.26 C ATOM 1782 O MET A 183 -10.919 0.842 -2.076 1.00 0.25 O ATOM 1783 CB MET A 183 -9.343 -1.503 -3.464 1.00 0.34 C ATOM 1784 CG MET A 183 -8.570 -1.434 -2.156 1.00 0.29 C ATOM 1785 SD MET A 183 -6.872 -0.864 -2.391 1.00 0.31 S ATOM 1786 CE MET A 183 -6.239 -0.969 -0.724 1.00 0.27 C ATOM 0 H MET A 183 -8.173 0.773 -3.157 1.00 0.28 H new ATOM 0 HA MET A 183 -10.150 -0.286 -5.021 1.00 0.30 H new ATOM 0 HB2 MET A 183 -10.194 -2.171 -3.332 1.00 0.34 H new ATOM 0 HB3 MET A 183 -8.703 -1.948 -4.225 1.00 0.34 H new ATOM 0 HG2 MET A 183 -9.084 -0.763 -1.468 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.559 -2.420 -1.691 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.208 -0.614 -0.703 1.00 0.27 H new ATOM 0 HE2 MET A 183 -6.849 -0.352 -0.064 1.00 0.27 H new ATOM 0 HE3 MET A 183 -6.273 -2.005 -0.386 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.235 0.086 -3.730 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.457 0.549 -3.112 1.00 0.29 C ATOM 1798 C ARG A 184 -14.318 -0.630 -2.690 1.00 0.31 C ATOM 1799 O ARG A 184 -14.936 -1.294 -3.524 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.221 1.450 -4.084 1.00 0.35 C ATOM 1801 CG ARG A 184 -15.540 1.975 -3.540 1.00 1.17 C ATOM 1802 CD ARG A 184 -16.309 2.745 -4.603 1.00 1.16 C ATOM 1803 NE ARG A 184 -17.534 3.335 -4.073 1.00 1.88 N ATOM 1804 CZ ARG A 184 -18.619 3.588 -4.803 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -18.665 3.243 -6.085 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -19.668 4.171 -4.242 1.00 3.32 N ATOM 0 H ARG A 184 -12.369 -0.410 -4.611 1.00 0.28 H new ATOM 0 HA ARG A 184 -13.207 1.125 -2.221 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -13.588 2.296 -4.351 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -14.414 0.894 -5.002 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -16.145 1.142 -3.182 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -15.351 2.623 -2.684 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -15.675 3.532 -5.010 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -16.556 2.076 -5.427 1.00 1.16 H new ATOM 0 HE ARG A 184 -17.561 3.568 -3.080 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -17.865 2.781 -6.518 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -19.500 3.441 -6.637 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -19.643 4.425 -3.254 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -20.501 4.366 -4.798 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.343 -0.893 -1.394 1.00 0.28 N ATOM 1821 CA LEU A 185 -15.174 -1.952 -0.860 1.00 0.32 C ATOM 1822 C LEU A 185 -16.506 -1.345 -0.456 1.00 0.36 C ATOM 1823 O LEU A 185 -16.651 -0.820 0.639 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.511 -2.611 0.356 1.00 0.36 C ATOM 1825 CG LEU A 185 -13.014 -2.907 0.227 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.515 -3.630 1.465 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.717 -3.725 -1.021 1.00 0.74 C ATOM 0 H LEU A 185 -13.798 -0.387 -0.696 1.00 0.28 H new ATOM 0 HA LEU A 185 -15.316 -2.722 -1.618 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.660 -1.964 1.221 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -15.029 -3.547 0.565 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.489 -1.956 0.135 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -11.449 -3.835 1.362 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.681 -3.005 2.343 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -13.056 -4.569 1.581 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.646 -3.918 -1.083 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -13.254 -4.672 -0.972 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -13.038 -3.172 -1.904 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.478 -1.420 -1.336 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.724 -0.703 -1.133 1.00 0.77 C ATOM 1841 C ALA A 186 -19.871 -1.643 -0.807 1.00 1.02 C ATOM 1842 O ALA A 186 -20.316 -2.413 -1.657 1.00 1.53 O ATOM 1843 CB ALA A 186 -19.051 0.127 -2.360 1.00 1.00 C ATOM 0 H ALA A 186 -17.434 -1.966 -2.196 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.592 -0.042 -0.276 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -19.987 0.661 -2.199 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -18.250 0.844 -2.538 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -19.151 -0.527 -3.226 1.00 1.00 H new ATOM 1849 N LYS A 187 -20.352 -1.572 0.423 1.00 0.89 N ATOM 1850 CA LYS A 187 -21.491 -2.370 0.844 1.00 1.11 C ATOM 1851 C LYS A 187 -22.728 -1.485 0.906 1.00 1.49 C ATOM 1852 O LYS A 187 -22.998 -0.852 1.928 1.00 1.61 O ATOM 1853 CB LYS A 187 -21.243 -3.003 2.215 1.00 1.11 C ATOM 1854 CG LYS A 187 -20.027 -3.910 2.276 1.00 1.17 C ATOM 1855 CD LYS A 187 -19.913 -4.558 3.644 1.00 1.45 C ATOM 1856 CE LYS A 187 -18.628 -5.356 3.794 1.00 1.82 C ATOM 1857 NZ LYS A 187 -18.546 -6.018 5.124 1.00 2.78 N ATOM 0 H LYS A 187 -19.969 -0.967 1.150 1.00 0.89 H new ATOM 0 HA LYS A 187 -21.640 -3.172 0.121 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -21.126 -2.209 2.953 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -22.124 -3.577 2.501 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -20.102 -4.680 1.508 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -19.126 -3.334 2.064 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -19.953 -3.787 4.414 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -20.768 -5.215 3.806 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -18.573 -6.109 3.008 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -17.771 -4.695 3.663 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -17.615 -6.468 5.231 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -18.676 -5.309 5.873 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -19.290 -6.740 5.199 1.00 2.78 H new ATOM 1871 N CYS A 188 -23.466 -1.428 -0.188 1.00 1.82 N ATOM 1872 CA CYS A 188 -24.624 -0.559 -0.274 1.00 2.29 C ATOM 1873 C CYS A 188 -25.825 -1.316 -0.827 1.00 2.51 C ATOM 1874 O CYS A 188 -25.784 -1.843 -1.939 1.00 2.68 O ATOM 1875 CB CYS A 188 -24.308 0.651 -1.159 1.00 2.71 C ATOM 1876 SG CYS A 188 -22.893 1.626 -0.591 1.00 3.14 S ATOM 0 H CYS A 188 -23.283 -1.974 -1.030 1.00 1.82 H new ATOM 0 HA CYS A 188 -24.870 -0.210 0.729 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -24.114 0.305 -2.174 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -25.186 1.295 -1.204 1.00 2.71 H new ATOM 0 HG CYS A 188 -22.701 2.625 -1.401 1.00 3.14 H new ATOM 1882 N ASP A 189 -26.885 -1.376 -0.039 1.00 2.70 N ATOM 1883 CA ASP A 189 -28.130 -1.994 -0.470 1.00 3.08 C ATOM 1884 C ASP A 189 -29.277 -1.024 -0.261 1.00 3.61 C ATOM 1885 O ASP A 189 -29.957 -1.055 0.768 1.00 3.87 O ATOM 1886 CB ASP A 189 -28.398 -3.297 0.290 1.00 3.12 C ATOM 1887 CG ASP A 189 -27.437 -4.406 -0.082 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -26.400 -4.554 0.598 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -27.721 -5.144 -1.050 1.00 4.05 O ATOM 0 H ASP A 189 -26.909 -1.002 0.910 1.00 2.70 H new ATOM 0 HA ASP A 189 -28.044 -2.237 -1.529 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -28.329 -3.107 1.361 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -29.418 -3.625 0.090 1.00 3.12 H new ATOM 1894 N GLU A 190 -29.483 -0.161 -1.239 1.00 3.97 N ATOM 1895 CA GLU A 190 -30.474 0.891 -1.139 1.00 4.63 C ATOM 1896 C GLU A 190 -31.086 1.159 -2.507 1.00 5.25 C ATOM 1897 O GLU A 190 -30.554 2.013 -3.247 1.00 5.64 O ATOM 1898 CB GLU A 190 -29.816 2.155 -0.577 1.00 4.83 C ATOM 1899 CG GLU A 190 -30.776 3.302 -0.325 1.00 5.57 C ATOM 1900 CD GLU A 190 -30.089 4.482 0.331 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -30.151 4.594 1.575 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -29.463 5.287 -0.390 1.00 6.43 O ATOM 1903 OXT GLU A 190 -32.082 0.490 -2.852 1.00 5.62 O ATOM 0 H GLU A 190 -28.970 -0.170 -2.121 1.00 3.97 H new ATOM 0 HA GLU A 190 -31.273 0.582 -0.465 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -29.315 1.904 0.358 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -29.045 2.488 -1.272 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -31.218 3.619 -1.269 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -31.593 2.959 0.310 1.00 5.57 H new TER 1910 GLU A 190