USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=37 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 84 GLN : amide:sc= 0.745 K(o=2,f=-4.6!) USER MOD Set 1.2: A 180 SER OG : rot 9:sc= 1.24 USER MOD Set 2.1: A 141 GLN : amide:sc= 0.812 X(o=-0.096,f=-0.37) USER MOD Set 2.2: A 147 TYR OH : rot -105:sc= -0.908 USER MOD Set 3.1: A 119 LYS NZ :NH3+ -173:sc= 0.378 (180deg=0) USER MOD Set 3.2: A 160 TYR OH : rot -162:sc= 1.59 USER MOD Single : A 76 GLN : amide:sc= -2.47! C(o=-2.5!,f=-8.6!) USER MOD Single : A 77 SER OG : rot 85:sc= 0.479 USER MOD Single : A 80 HIS : no HE2:sc= 0.38 K(o=1.8,f=-10!) USER MOD Single : A 82 SER OG : rot -130:sc= -0.304 USER MOD Single : A 85 THR OG1 : rot 15:sc= 1.83 USER MOD Single : A 87 THR OG1 : rot -160:sc= -0.0805 USER MOD Single : A 88 LYS NZ :NH3+ 167:sc= -0.0357 (180deg=-0.243) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0.63 USER MOD Single : A 92 CYS SG : rot 160:sc= -1.21 USER MOD Single : A 93 SER OG : rot -7:sc= 0.836 USER MOD Single : A 103 ASN : amide:sc= -1.3 K(o=-1.3,f=-5.4!) USER MOD Single : A 104 THR OG1 : rot 114:sc= 1.43 USER MOD Single : A 107 LYS NZ :NH3+ -141:sc=0.000467 (180deg=-0.00121) USER MOD Single : A 109 LYS NZ :NH3+ 162:sc= -0.0963 (180deg=-0.423) USER MOD Single : A 110 LYS NZ :NH3+ 164:sc= -0.0305 (180deg=-0.273) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ -170:sc= -0.0135 (180deg=-0.184) USER MOD Single : A 114 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0529) USER MOD Single : A 118 HIS : no HD1:sc= -1.81 K(o=-1.7,f=-9!) USER MOD Single : A 122 ASN : amide:sc= 1.31 K(o=1.3,f=-10!) USER MOD Single : A 125 LYS NZ :NH3+ 168:sc=-0.00895 (180deg=-0.175) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 1.21 (180deg=1.21) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 LYS NZ :NH3+ -171:sc= -0.0115 (180deg=-0.132) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 ASN : amide:sc= -0.899 X(o=-0.9,f=-0.8) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 112:sc= 0.787 USER MOD Single : A 152 LYS NZ :NH3+ -166:sc= -0.0381 (180deg=-0.243) USER MOD Single : A 153 LYS NZ :NH3+ -164:sc= 1.18 (180deg=1.1) USER MOD Single : A 154 LYS NZ :NH3+ 162:sc= -0.0556 (180deg=-0.418) USER MOD Single : A 155 MET CE :methyl -133:sc= -1.13 (180deg=-2.08!) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 LYS NZ :NH3+ -146:sc= 0.73 (180deg=-0.0705) USER MOD Single : A 165 TYR OH : rot 180:sc= -0.716 USER MOD Single : A 166 LYS NZ :NH3+ -126:sc= 0 (180deg=-0.0782) 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) USER MOD Single : A 175 SER OG : rot -54:sc= 0.282 USER MOD Single : A 176 THR OG1 : rot 59:sc= 0.00904 USER MOD Single : A 183 MET CE :methyl -170:sc= -1.29 (180deg=-1.94!) USER MOD Single : A 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 CYS SG : rot 180:sc= -0.107 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 25.459 4.982 -0.952 1.00 3.12 N ATOM 2 CA ARG A 73 24.956 3.620 -1.235 1.00 2.69 C ATOM 3 C ARG A 73 23.609 3.399 -0.557 1.00 2.08 C ATOM 4 O ARG A 73 23.498 3.474 0.668 1.00 2.31 O ATOM 5 CB ARG A 73 25.964 2.573 -0.747 1.00 3.05 C ATOM 6 CG ARG A 73 25.497 1.135 -0.926 1.00 3.69 C ATOM 7 CD ARG A 73 25.391 0.750 -2.394 1.00 4.24 C ATOM 8 NE ARG A 73 24.775 -0.564 -2.562 1.00 4.97 N ATOM 9 CZ ARG A 73 24.781 -1.257 -3.701 1.00 5.85 C ATOM 10 NH1 ARG A 73 25.394 -0.776 -4.775 1.00 6.18 N ATOM 11 NH2 ARG A 73 24.172 -2.434 -3.758 1.00 6.67 N ATOM 0 HA ARG A 73 24.828 3.515 -2.312 1.00 2.69 H new ATOM 0 HB2 ARG A 73 26.903 2.709 -1.284 1.00 3.05 H new ATOM 0 HB3 ARG A 73 26.172 2.748 0.308 1.00 3.05 H new ATOM 0 HG2 ARG A 73 26.193 0.463 -0.424 1.00 3.69 H new ATOM 0 HG3 ARG A 73 24.527 1.006 -0.446 1.00 3.69 H new ATOM 0 HD2 ARG A 73 24.804 1.499 -2.926 1.00 4.24 H new ATOM 0 HD3 ARG A 73 26.384 0.747 -2.843 1.00 4.24 H new ATOM 0 HE ARG A 73 24.310 -0.979 -1.755 1.00 4.97 H new ATOM 0 HH11 ARG A 73 25.864 0.128 -4.732 1.00 6.18 H new ATOM 0 HH12 ARG A 73 25.395 -1.311 -5.644 1.00 6.18 H new ATOM 0 HH21 ARG A 73 23.702 -2.805 -2.933 1.00 6.67 H new ATOM 0 HH22 ARG A 73 24.174 -2.968 -4.627 1.00 6.67 H new ATOM 25 N TRP A 74 22.590 3.130 -1.358 1.00 1.61 N ATOM 26 CA TRP A 74 21.259 2.869 -0.837 1.00 1.14 C ATOM 27 C TRP A 74 20.640 1.691 -1.587 1.00 0.96 C ATOM 28 O TRP A 74 20.023 1.855 -2.639 1.00 1.19 O ATOM 29 CB TRP A 74 20.383 4.121 -0.956 1.00 1.25 C ATOM 30 CG TRP A 74 19.153 4.067 -0.105 1.00 1.15 C ATOM 31 CD1 TRP A 74 17.866 3.941 -0.532 1.00 1.14 C ATOM 32 CD2 TRP A 74 19.098 4.134 1.324 1.00 1.26 C ATOM 33 NE1 TRP A 74 17.013 3.927 0.544 1.00 1.26 N ATOM 34 CE2 TRP A 74 17.745 4.046 1.694 1.00 1.34 C ATOM 35 CE3 TRP A 74 20.062 4.262 2.328 1.00 1.43 C ATOM 36 CZ2 TRP A 74 17.331 4.079 3.023 1.00 1.61 C ATOM 37 CZ3 TRP A 74 19.650 4.295 3.648 1.00 1.66 C ATOM 38 CH2 TRP A 74 18.294 4.204 3.985 1.00 1.75 C ATOM 0 H TRP A 74 22.661 3.087 -2.375 1.00 1.61 H new ATOM 0 HA TRP A 74 21.328 2.612 0.220 1.00 1.14 H new ATOM 0 HB2 TRP A 74 20.971 4.995 -0.677 1.00 1.25 H new ATOM 0 HB3 TRP A 74 20.090 4.253 -1.998 1.00 1.25 H new ATOM 0 HD1 TRP A 74 17.561 3.863 -1.565 1.00 1.14 H new ATOM 0 HE1 TRP A 74 15.998 3.842 0.494 1.00 1.26 H new ATOM 0 HE3 TRP A 74 21.110 4.334 2.078 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 16.286 4.008 3.285 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 20.387 4.393 4.432 1.00 1.66 H new ATOM 0 HH2 TRP A 74 18.003 4.233 5.025 1.00 1.75 H new ATOM 49 N ASP A 75 20.825 0.502 -1.028 1.00 0.79 N ATOM 50 CA ASP A 75 20.454 -0.751 -1.687 1.00 0.78 C ATOM 51 C ASP A 75 18.953 -0.891 -1.899 1.00 0.67 C ATOM 52 O ASP A 75 18.520 -1.528 -2.841 1.00 0.92 O ATOM 53 CB ASP A 75 20.943 -1.943 -0.856 1.00 0.92 C ATOM 54 CG ASP A 75 22.448 -2.086 -0.854 1.00 1.37 C ATOM 55 OD1 ASP A 75 22.962 -3.035 -1.481 1.00 2.01 O ATOM 56 OD2 ASP A 75 23.132 -1.247 -0.232 1.00 1.86 O ATOM 0 H ASP A 75 21.237 0.375 -0.104 1.00 0.79 H new ATOM 0 HA ASP A 75 20.929 -0.736 -2.668 1.00 0.78 H new ATOM 0 HB2 ASP A 75 20.593 -1.831 0.170 1.00 0.92 H new ATOM 0 HB3 ASP A 75 20.497 -2.858 -1.247 1.00 0.92 H new ATOM 61 N GLN A 76 18.176 -0.298 -1.017 1.00 0.59 N ATOM 62 CA GLN A 76 16.734 -0.548 -0.949 1.00 0.77 C ATOM 63 C GLN A 76 15.903 0.449 -1.758 1.00 0.69 C ATOM 64 O GLN A 76 14.691 0.537 -1.574 1.00 0.94 O ATOM 65 CB GLN A 76 16.298 -0.544 0.509 1.00 1.07 C ATOM 66 CG GLN A 76 16.875 0.613 1.307 1.00 1.21 C ATOM 67 CD GLN A 76 16.648 0.445 2.786 1.00 1.75 C ATOM 68 OE1 GLN A 76 17.447 0.887 3.605 1.00 2.30 O ATOM 69 NE2 GLN A 76 15.557 -0.205 3.137 1.00 2.36 N ATOM 0 H GLN A 76 18.515 0.370 -0.325 1.00 0.59 H new ATOM 0 HA GLN A 76 16.552 -1.523 -1.401 1.00 0.77 H new ATOM 0 HB2 GLN A 76 15.210 -0.501 0.555 1.00 1.07 H new ATOM 0 HB3 GLN A 76 16.600 -1.483 0.974 1.00 1.07 H new ATOM 0 HG2 GLN A 76 17.944 0.692 1.111 1.00 1.21 H new ATOM 0 HG3 GLN A 76 16.420 1.546 0.974 1.00 1.21 H new ATOM 0 HE21 GLN A 76 14.920 -0.555 2.422 1.00 2.36 H new ATOM 0 HE22 GLN A 76 15.350 -0.358 4.124 1.00 2.36 H new ATOM 78 N SER A 77 16.553 1.198 -2.628 1.00 0.51 N ATOM 79 CA SER A 77 15.929 2.327 -3.322 1.00 0.56 C ATOM 80 C SER A 77 14.660 1.986 -4.139 1.00 0.43 C ATOM 81 O SER A 77 13.827 2.868 -4.357 1.00 0.54 O ATOM 82 CB SER A 77 16.955 2.973 -4.256 1.00 0.80 C ATOM 83 OG SER A 77 18.075 3.460 -3.536 1.00 1.52 O ATOM 0 H SER A 77 17.530 1.047 -2.879 1.00 0.51 H new ATOM 0 HA SER A 77 15.601 3.003 -2.533 1.00 0.56 H new ATOM 0 HB2 SER A 77 17.285 2.244 -4.996 1.00 0.80 H new ATOM 0 HB3 SER A 77 16.487 3.792 -4.802 1.00 0.80 H new ATOM 0 HG SER A 77 18.717 2.733 -3.399 1.00 1.52 H new ATOM 89 N ASP A 78 14.478 0.739 -4.573 1.00 0.35 N ATOM 90 CA ASP A 78 13.510 0.479 -5.651 1.00 0.38 C ATOM 91 C ASP A 78 12.426 -0.544 -5.298 1.00 0.33 C ATOM 92 O ASP A 78 12.062 -1.371 -6.134 1.00 0.42 O ATOM 93 CB ASP A 78 14.235 0.049 -6.932 1.00 0.51 C ATOM 94 CG ASP A 78 13.503 0.486 -8.183 1.00 0.94 C ATOM 95 OD1 ASP A 78 13.339 1.708 -8.380 1.00 1.66 O ATOM 96 OD2 ASP A 78 13.102 -0.383 -8.984 1.00 1.66 O ATOM 0 H ASP A 78 14.965 -0.083 -4.215 1.00 0.35 H new ATOM 0 HA ASP A 78 12.992 1.425 -5.807 1.00 0.38 H new ATOM 0 HB2 ASP A 78 15.240 0.470 -6.936 1.00 0.51 H new ATOM 0 HB3 ASP A 78 14.344 -1.036 -6.938 1.00 0.51 H new ATOM 101 N LEU A 79 11.921 -0.516 -4.075 1.00 0.26 N ATOM 102 CA LEU A 79 10.747 -1.328 -3.738 1.00 0.26 C ATOM 103 C LEU A 79 9.491 -0.681 -4.323 1.00 0.30 C ATOM 104 O LEU A 79 9.196 0.481 -4.044 1.00 0.51 O ATOM 105 CB LEU A 79 10.593 -1.496 -2.217 1.00 0.28 C ATOM 106 CG LEU A 79 11.423 -2.615 -1.567 1.00 0.28 C ATOM 107 CD1 LEU A 79 10.998 -3.976 -2.090 1.00 0.29 C ATOM 108 CD2 LEU A 79 12.913 -2.400 -1.789 1.00 0.30 C ATOM 0 H LEU A 79 12.291 0.046 -3.308 1.00 0.26 H new ATOM 0 HA LEU A 79 10.885 -2.320 -4.169 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.858 -0.552 -1.740 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.541 -1.679 -1.998 1.00 0.28 H new ATOM 0 HG LEU A 79 11.236 -2.583 -0.494 1.00 0.28 H new ATOM 0 HD11 LEU A 79 11.599 -4.752 -1.616 1.00 0.29 H new ATOM 0 HD12 LEU A 79 9.945 -4.141 -1.861 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.144 -4.013 -3.170 1.00 0.29 H new ATOM 0 HD21 LEU A 79 13.472 -3.208 -1.317 1.00 0.30 H new ATOM 0 HD22 LEU A 79 13.124 -2.389 -2.858 1.00 0.30 H new ATOM 0 HD23 LEU A 79 13.213 -1.448 -1.351 1.00 0.30 H new ATOM 120 N HIS A 80 8.767 -1.423 -5.156 1.00 0.21 N ATOM 121 CA HIS A 80 7.592 -0.877 -5.831 1.00 0.25 C ATOM 122 C HIS A 80 6.391 -1.797 -5.687 1.00 0.22 C ATOM 123 O HIS A 80 6.532 -3.017 -5.662 1.00 0.23 O ATOM 124 CB HIS A 80 7.872 -0.662 -7.318 1.00 0.33 C ATOM 125 CG HIS A 80 8.867 0.415 -7.604 1.00 1.03 C ATOM 126 ND1 HIS A 80 8.579 1.757 -7.494 1.00 1.94 N ATOM 127 CD2 HIS A 80 10.153 0.339 -8.002 1.00 1.86 C ATOM 128 CE1 HIS A 80 9.648 2.461 -7.818 1.00 2.58 C ATOM 129 NE2 HIS A 80 10.615 1.622 -8.128 1.00 2.50 N ATOM 0 H HIS A 80 8.971 -2.397 -5.379 1.00 0.21 H new ATOM 0 HA HIS A 80 7.367 0.078 -5.357 1.00 0.25 H new ATOM 0 HB2 HIS A 80 8.232 -1.597 -7.747 1.00 0.33 H new ATOM 0 HB3 HIS A 80 6.936 -0.419 -7.821 1.00 0.33 H new ATOM 0 HD1 HIS A 80 7.681 2.146 -7.207 1.00 1.94 H new ATOM 0 HD2 HIS A 80 10.714 -0.565 -8.187 1.00 1.86 H new ATOM 0 HE1 HIS A 80 9.718 3.539 -7.827 1.00 2.58 H new ATOM 138 N ILE A 81 5.210 -1.197 -5.611 1.00 0.23 N ATOM 139 CA ILE A 81 3.965 -1.945 -5.550 1.00 0.23 C ATOM 140 C ILE A 81 3.658 -2.533 -6.922 1.00 0.26 C ATOM 141 O ILE A 81 3.174 -1.837 -7.818 1.00 0.36 O ATOM 142 CB ILE A 81 2.791 -1.051 -5.098 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.088 -0.435 -3.728 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.497 -1.854 -5.049 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.038 0.553 -3.267 1.00 0.27 C ATOM 0 H ILE A 81 5.090 -0.184 -5.590 1.00 0.23 H new ATOM 0 HA ILE A 81 4.084 -2.743 -4.818 1.00 0.23 H new ATOM 0 HB ILE A 81 2.670 -0.246 -5.823 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.172 -1.233 -2.991 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.055 0.067 -3.766 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.680 -1.208 -4.728 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.278 -2.252 -6.040 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.606 -2.678 -4.344 1.00 0.28 H new ATOM 0 HD11 ILE A 81 2.315 0.948 -2.290 1.00 0.27 H new ATOM 0 HD12 ILE A 81 1.969 1.372 -3.983 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.073 0.051 -3.195 1.00 0.27 H new ATOM 157 N SER A 82 3.965 -3.806 -7.085 1.00 0.25 N ATOM 158 CA SER A 82 3.795 -4.473 -8.365 1.00 0.29 C ATOM 159 C SER A 82 2.428 -5.138 -8.449 1.00 0.33 C ATOM 160 O SER A 82 1.861 -5.293 -9.534 1.00 0.43 O ATOM 161 CB SER A 82 4.912 -5.499 -8.558 1.00 0.32 C ATOM 162 OG SER A 82 6.178 -4.881 -8.395 1.00 1.10 O ATOM 0 H SER A 82 4.335 -4.402 -6.345 1.00 0.25 H new ATOM 0 HA SER A 82 3.852 -3.733 -9.163 1.00 0.29 H new ATOM 0 HB2 SER A 82 4.800 -6.310 -7.838 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.841 -5.942 -9.551 1.00 0.32 H new ATOM 0 HG SER A 82 6.755 -5.111 -9.153 1.00 1.10 H new ATOM 168 N ASP A 83 1.891 -5.514 -7.297 1.00 0.33 N ATOM 169 CA ASP A 83 0.582 -6.144 -7.237 1.00 0.38 C ATOM 170 C ASP A 83 -0.193 -5.576 -6.065 1.00 0.30 C ATOM 171 O ASP A 83 0.397 -5.048 -5.121 1.00 0.27 O ATOM 172 CB ASP A 83 0.694 -7.670 -7.115 1.00 0.46 C ATOM 173 CG ASP A 83 1.432 -8.306 -8.278 1.00 1.27 C ATOM 174 OD1 ASP A 83 2.666 -8.466 -8.193 1.00 2.07 O ATOM 175 OD2 ASP A 83 0.778 -8.654 -9.286 1.00 1.90 O ATOM 0 H ASP A 83 2.343 -5.393 -6.391 1.00 0.33 H new ATOM 0 HA ASP A 83 0.053 -5.931 -8.166 1.00 0.38 H new ATOM 0 HB2 ASP A 83 1.208 -7.918 -6.187 1.00 0.46 H new ATOM 0 HB3 ASP A 83 -0.306 -8.098 -7.049 1.00 0.46 H new ATOM 180 N GLN A 84 -1.504 -5.685 -6.122 1.00 0.31 N ATOM 181 CA GLN A 84 -2.370 -5.061 -5.138 1.00 0.35 C ATOM 182 C GLN A 84 -3.641 -5.878 -4.957 1.00 0.34 C ATOM 183 O GLN A 84 -3.803 -6.921 -5.592 1.00 0.39 O ATOM 184 CB GLN A 84 -2.702 -3.626 -5.575 1.00 0.49 C ATOM 185 CG GLN A 84 -3.053 -3.517 -7.055 1.00 0.64 C ATOM 186 CD GLN A 84 -3.290 -2.093 -7.521 1.00 1.32 C ATOM 187 OE1 GLN A 84 -2.734 -1.137 -6.974 1.00 2.14 O ATOM 188 NE2 GLN A 84 -4.094 -1.949 -8.561 1.00 1.98 N ATOM 0 H GLN A 84 -1.999 -6.205 -6.846 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.853 -5.024 -4.179 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -3.538 -3.256 -4.981 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -1.849 -2.981 -5.362 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -2.246 -3.953 -7.644 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -3.947 -4.108 -7.252 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -4.533 -2.767 -8.983 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -4.275 -1.020 -8.941 1.00 1.98 H new ATOM 197 N THR A 85 -4.523 -5.420 -4.083 1.00 0.34 N ATOM 198 CA THR A 85 -5.793 -6.090 -3.857 1.00 0.39 C ATOM 199 C THR A 85 -6.622 -6.129 -5.145 1.00 0.50 C ATOM 200 O THR A 85 -6.810 -5.104 -5.806 1.00 0.54 O ATOM 201 CB THR A 85 -6.582 -5.386 -2.739 1.00 0.32 C ATOM 202 OG1 THR A 85 -5.755 -5.269 -1.573 1.00 0.43 O ATOM 203 CG2 THR A 85 -7.846 -6.156 -2.389 1.00 0.42 C ATOM 0 H THR A 85 -4.381 -4.584 -3.517 1.00 0.34 H new ATOM 0 HA THR A 85 -5.586 -7.115 -3.548 1.00 0.39 H new ATOM 0 HB THR A 85 -6.872 -4.397 -3.094 1.00 0.32 H new ATOM 0 HG1 THR A 85 -4.821 -5.439 -1.816 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.382 -5.634 -1.596 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.483 -6.230 -3.270 1.00 0.42 H new ATOM 0 HG23 THR A 85 -7.580 -7.157 -2.049 1.00 0.42 H new ATOM 211 N ASP A 86 -7.116 -7.313 -5.491 1.00 0.69 N ATOM 212 CA ASP A 86 -7.828 -7.529 -6.749 1.00 0.89 C ATOM 213 C ASP A 86 -9.292 -7.096 -6.663 1.00 0.83 C ATOM 214 O ASP A 86 -10.179 -7.735 -7.226 1.00 1.12 O ATOM 215 CB ASP A 86 -7.738 -9.003 -7.157 1.00 1.20 C ATOM 216 CG ASP A 86 -8.240 -9.941 -6.076 1.00 1.67 C ATOM 217 OD1 ASP A 86 -9.389 -10.425 -6.178 1.00 2.32 O ATOM 218 OD2 ASP A 86 -7.489 -10.200 -5.113 1.00 2.23 O ATOM 0 H ASP A 86 -7.036 -8.148 -4.911 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.348 -6.910 -7.507 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -8.318 -9.160 -8.067 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -6.702 -9.248 -7.393 1.00 1.20 H new ATOM 223 N THR A 87 -9.534 -5.998 -5.972 1.00 0.72 N ATOM 224 CA THR A 87 -10.864 -5.426 -5.878 1.00 0.74 C ATOM 225 C THR A 87 -10.965 -4.209 -6.785 1.00 0.81 C ATOM 226 O THR A 87 -10.786 -3.073 -6.347 1.00 1.42 O ATOM 227 CB THR A 87 -11.191 -5.028 -4.431 1.00 1.14 C ATOM 228 OG1 THR A 87 -10.069 -4.349 -3.858 1.00 1.36 O ATOM 229 CG2 THR A 87 -11.537 -6.249 -3.591 1.00 1.87 C ATOM 0 H THR A 87 -8.818 -5.480 -5.462 1.00 0.72 H new ATOM 0 HA THR A 87 -11.585 -6.179 -6.196 1.00 0.74 H new ATOM 0 HB THR A 87 -12.058 -4.367 -4.443 1.00 1.14 H new ATOM 0 HG1 THR A 87 -10.135 -4.375 -2.881 1.00 1.36 H new ATOM 0 HG21 THR A 87 -11.764 -5.937 -2.572 1.00 1.87 H new ATOM 0 HG22 THR A 87 -12.405 -6.751 -4.019 1.00 1.87 H new ATOM 0 HG23 THR A 87 -10.690 -6.935 -3.580 1.00 1.87 H new ATOM 237 N LYS A 88 -11.234 -4.456 -8.055 1.00 1.18 N ATOM 238 CA LYS A 88 -11.236 -3.401 -9.052 1.00 1.58 C ATOM 239 C LYS A 88 -12.610 -2.753 -9.147 1.00 1.51 C ATOM 240 O LYS A 88 -13.529 -3.303 -9.758 1.00 1.95 O ATOM 241 CB LYS A 88 -10.813 -3.965 -10.410 1.00 1.89 C ATOM 242 CG LYS A 88 -9.503 -4.740 -10.369 1.00 2.02 C ATOM 243 CD LYS A 88 -8.346 -3.870 -9.902 1.00 2.39 C ATOM 244 CE LYS A 88 -7.045 -4.654 -9.843 1.00 2.73 C ATOM 245 NZ LYS A 88 -6.668 -5.222 -11.166 1.00 3.20 N ATOM 0 H LYS A 88 -11.455 -5.382 -8.421 1.00 1.18 H new ATOM 0 HA LYS A 88 -10.521 -2.635 -8.751 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -11.601 -4.620 -10.783 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -10.717 -3.144 -11.121 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -9.607 -5.595 -9.701 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -9.283 -5.135 -11.361 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -8.231 -3.023 -10.578 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -8.571 -3.463 -8.916 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -6.246 -4.002 -9.489 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -7.143 -5.462 -9.118 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -5.683 -5.554 -11.133 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -7.295 -6.020 -11.392 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -6.762 -4.489 -11.898 1.00 3.20 H new ATOM 259 N GLY A 89 -12.744 -1.590 -8.529 1.00 1.22 N ATOM 260 CA GLY A 89 -14.009 -0.887 -8.524 1.00 1.14 C ATOM 261 C GLY A 89 -14.722 -1.045 -7.200 1.00 0.96 C ATOM 262 O GLY A 89 -14.082 -1.059 -6.148 1.00 1.01 O ATOM 0 H GLY A 89 -11.992 -1.117 -8.027 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -13.840 0.171 -8.724 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -14.641 -1.266 -9.327 1.00 1.14 H new ATOM 266 N THR A 90 -16.041 -1.167 -7.240 1.00 0.97 N ATOM 267 CA THR A 90 -16.815 -1.386 -6.031 1.00 0.88 C ATOM 268 C THR A 90 -17.127 -2.866 -5.862 1.00 0.82 C ATOM 269 O THR A 90 -17.896 -3.445 -6.634 1.00 1.04 O ATOM 270 CB THR A 90 -18.131 -0.582 -6.037 1.00 1.06 C ATOM 271 OG1 THR A 90 -17.856 0.806 -6.280 1.00 1.25 O ATOM 272 CG2 THR A 90 -18.864 -0.734 -4.709 1.00 1.02 C ATOM 0 H THR A 90 -16.595 -1.118 -8.095 1.00 0.97 H new ATOM 0 HA THR A 90 -16.209 -1.040 -5.194 1.00 0.88 H new ATOM 0 HB THR A 90 -18.767 -0.972 -6.832 1.00 1.06 H new ATOM 0 HG1 THR A 90 -18.696 1.310 -6.284 1.00 1.25 H new ATOM 0 HG21 THR A 90 -19.789 -0.158 -4.736 1.00 1.02 H new ATOM 0 HG22 THR A 90 -19.096 -1.786 -4.540 1.00 1.02 H new ATOM 0 HG23 THR A 90 -18.232 -0.367 -3.900 1.00 1.02 H new ATOM 280 N VAL A 91 -16.507 -3.477 -4.869 1.00 0.65 N ATOM 281 CA VAL A 91 -16.742 -4.877 -4.560 1.00 0.77 C ATOM 282 C VAL A 91 -17.187 -5.001 -3.112 1.00 0.55 C ATOM 283 O VAL A 91 -16.628 -4.341 -2.236 1.00 0.46 O ATOM 284 CB VAL A 91 -15.464 -5.720 -4.768 1.00 1.02 C ATOM 285 CG1 VAL A 91 -15.733 -7.196 -4.522 1.00 1.43 C ATOM 286 CG2 VAL A 91 -14.896 -5.508 -6.163 1.00 1.51 C ATOM 0 H VAL A 91 -15.830 -3.021 -4.257 1.00 0.65 H new ATOM 0 HA VAL A 91 -17.515 -5.250 -5.232 1.00 0.77 H new ATOM 0 HB VAL A 91 -14.725 -5.385 -4.040 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -14.815 -7.764 -4.676 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -16.079 -7.337 -3.498 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -16.497 -7.547 -5.215 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -13.997 -6.112 -6.285 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -15.636 -5.805 -6.906 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -14.647 -4.455 -6.299 1.00 1.51 H new ATOM 296 N CYS A 92 -18.176 -5.838 -2.843 1.00 0.79 N ATOM 297 CA CYS A 92 -18.619 -6.011 -1.475 1.00 0.64 C ATOM 298 C CYS A 92 -17.900 -7.200 -0.866 1.00 0.62 C ATOM 299 O CYS A 92 -18.077 -8.338 -1.304 1.00 1.20 O ATOM 300 CB CYS A 92 -20.131 -6.244 -1.437 1.00 1.10 C ATOM 301 SG CYS A 92 -21.103 -4.958 -2.255 1.00 1.91 S ATOM 0 H CYS A 92 -18.675 -6.395 -3.537 1.00 0.79 H new ATOM 0 HA CYS A 92 -18.390 -5.111 -0.904 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -20.351 -7.203 -1.906 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -20.449 -6.318 -0.397 1.00 1.10 H new ATOM 0 HG CYS A 92 -22.281 -5.424 -2.548 1.00 1.91 H new ATOM 307 N SER A 93 -17.083 -6.931 0.137 1.00 0.69 N ATOM 308 CA SER A 93 -16.331 -7.970 0.808 1.00 1.02 C ATOM 309 C SER A 93 -15.924 -7.535 2.208 1.00 0.58 C ATOM 310 O SER A 93 -15.459 -6.409 2.396 1.00 0.73 O ATOM 311 CB SER A 93 -15.082 -8.329 -0.002 1.00 1.83 C ATOM 312 OG SER A 93 -15.431 -8.869 -1.268 1.00 2.58 O ATOM 0 H SER A 93 -16.925 -5.993 0.505 1.00 0.69 H new ATOM 0 HA SER A 93 -16.973 -8.847 0.890 1.00 1.02 H new ATOM 0 HB2 SER A 93 -14.466 -7.440 -0.140 1.00 1.83 H new ATOM 0 HB3 SER A 93 -14.481 -9.051 0.551 1.00 1.83 H new ATOM 0 HG SER A 93 -16.402 -8.996 -1.313 1.00 2.58 H new ATOM 318 N PRO A 94 -16.101 -8.395 3.211 1.00 0.78 N ATOM 319 CA PRO A 94 -15.361 -8.274 4.451 1.00 0.67 C ATOM 320 C PRO A 94 -14.014 -8.955 4.267 1.00 0.53 C ATOM 321 O PRO A 94 -13.932 -10.185 4.258 1.00 0.59 O ATOM 322 CB PRO A 94 -16.219 -9.038 5.472 1.00 0.93 C ATOM 323 CG PRO A 94 -17.398 -9.575 4.710 1.00 1.39 C ATOM 324 CD PRO A 94 -17.040 -9.513 3.250 1.00 1.43 C ATOM 0 HA PRO A 94 -15.178 -7.246 4.763 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -15.650 -9.847 5.930 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -16.543 -8.380 6.278 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -17.618 -10.599 5.010 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -18.291 -8.984 4.914 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -16.584 -10.440 2.903 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -17.914 -9.333 2.624 1.00 1.43 H new ATOM 332 N PHE A 95 -12.956 -8.175 4.125 1.00 0.43 N ATOM 333 CA PHE A 95 -11.695 -8.727 3.667 1.00 0.40 C ATOM 334 C PHE A 95 -10.514 -7.885 4.137 1.00 0.33 C ATOM 335 O PHE A 95 -10.643 -6.675 4.344 1.00 0.32 O ATOM 336 CB PHE A 95 -11.732 -8.801 2.131 1.00 0.46 C ATOM 337 CG PHE A 95 -10.640 -9.629 1.507 1.00 0.50 C ATOM 338 CD1 PHE A 95 -9.617 -9.025 0.792 1.00 1.26 C ATOM 339 CD2 PHE A 95 -10.646 -11.011 1.624 1.00 1.35 C ATOM 340 CE1 PHE A 95 -8.621 -9.784 0.209 1.00 1.33 C ATOM 341 CE2 PHE A 95 -9.650 -11.773 1.045 1.00 1.36 C ATOM 342 CZ PHE A 95 -8.636 -11.159 0.336 1.00 0.68 C ATOM 0 H PHE A 95 -12.944 -7.173 4.317 1.00 0.43 H new ATOM 0 HA PHE A 95 -11.561 -9.723 4.089 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -12.696 -9.208 1.825 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.673 -7.788 1.732 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -9.599 -7.950 0.690 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -11.438 -11.497 2.174 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -7.830 -9.302 -0.346 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -9.664 -12.848 1.147 1.00 1.36 H new ATOM 0 HZ PHE A 95 -7.857 -11.753 -0.118 1.00 0.68 H new ATOM 352 N ALA A 96 -9.381 -8.547 4.342 1.00 0.37 N ATOM 353 CA ALA A 96 -8.133 -7.871 4.655 1.00 0.38 C ATOM 354 C ALA A 96 -7.387 -7.548 3.365 1.00 0.35 C ATOM 355 O ALA A 96 -7.117 -8.435 2.558 1.00 0.51 O ATOM 356 CB ALA A 96 -7.273 -8.733 5.568 1.00 0.49 C ATOM 0 H ALA A 96 -9.304 -9.563 4.296 1.00 0.37 H new ATOM 0 HA ALA A 96 -8.355 -6.941 5.179 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.343 -8.211 5.792 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -7.811 -8.929 6.496 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -7.049 -9.677 5.072 1.00 0.49 H new ATOM 362 N LEU A 97 -7.048 -6.285 3.187 1.00 0.24 N ATOM 363 CA LEU A 97 -6.482 -5.810 1.930 1.00 0.22 C ATOM 364 C LEU A 97 -4.981 -6.038 1.908 1.00 0.22 C ATOM 365 O LEU A 97 -4.351 -6.118 2.961 1.00 0.24 O ATOM 366 CB LEU A 97 -6.796 -4.318 1.722 1.00 0.23 C ATOM 367 CG LEU A 97 -8.284 -3.962 1.590 1.00 0.46 C ATOM 368 CD1 LEU A 97 -8.998 -4.083 2.925 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.448 -2.560 1.033 1.00 1.07 C ATOM 0 H LEU A 97 -7.154 -5.563 3.899 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.935 -6.375 1.115 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -6.380 -3.758 2.560 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -6.279 -3.979 0.824 1.00 0.23 H new ATOM 0 HG LEU A 97 -8.737 -4.671 0.897 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -10.050 -3.825 2.800 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -8.917 -5.107 3.290 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -8.541 -3.404 3.645 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -9.509 -2.325 0.946 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -7.971 -1.844 1.703 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -7.982 -2.502 0.049 1.00 1.07 H new ATOM 381 N PHE A 98 -4.409 -6.140 0.716 1.00 0.23 N ATOM 382 CA PHE A 98 -2.988 -6.418 0.587 1.00 0.23 C ATOM 383 C PHE A 98 -2.373 -5.702 -0.607 1.00 0.22 C ATOM 384 O PHE A 98 -3.061 -5.342 -1.566 1.00 0.25 O ATOM 385 CB PHE A 98 -2.739 -7.930 0.473 1.00 0.24 C ATOM 386 CG PHE A 98 -3.471 -8.588 -0.670 1.00 0.26 C ATOM 387 CD1 PHE A 98 -4.701 -9.193 -0.466 1.00 1.26 C ATOM 388 CD2 PHE A 98 -2.927 -8.601 -1.948 1.00 1.18 C ATOM 389 CE1 PHE A 98 -5.375 -9.794 -1.512 1.00 1.31 C ATOM 390 CE2 PHE A 98 -3.597 -9.202 -2.995 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.822 -9.799 -2.777 1.00 0.40 C ATOM 0 H PHE A 98 -4.905 -6.035 -0.169 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.506 -6.040 1.489 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.670 -8.104 0.354 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -3.038 -8.408 1.406 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -5.138 -9.195 0.522 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -1.969 -8.136 -2.125 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -6.334 -10.260 -1.340 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -3.163 -9.205 -3.984 1.00 1.17 H new ATOM 0 HZ PHE A 98 -5.347 -10.270 -3.595 1.00 0.40 H new ATOM 401 N ALA A 99 -1.072 -5.497 -0.520 1.00 0.20 N ATOM 402 CA ALA A 99 -0.282 -4.972 -1.616 1.00 0.19 C ATOM 403 C ALA A 99 1.063 -5.679 -1.637 1.00 0.17 C ATOM 404 O ALA A 99 1.572 -6.082 -0.590 1.00 0.19 O ATOM 405 CB ALA A 99 -0.096 -3.467 -1.489 1.00 0.21 C ATOM 0 H ALA A 99 -0.530 -5.692 0.322 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.807 -5.155 -2.554 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.500 -3.102 -2.325 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -1.070 -2.978 -1.498 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.415 -3.241 -0.553 1.00 0.21 H new ATOM 411 N VAL A 100 1.622 -5.855 -2.816 1.00 0.17 N ATOM 412 CA VAL A 100 2.873 -6.579 -2.961 1.00 0.18 C ATOM 413 C VAL A 100 3.952 -5.685 -3.557 1.00 0.19 C ATOM 414 O VAL A 100 3.754 -5.073 -4.609 1.00 0.22 O ATOM 415 CB VAL A 100 2.684 -7.824 -3.849 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.988 -8.583 -4.011 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.600 -8.731 -3.281 1.00 0.25 C ATOM 0 H VAL A 100 1.231 -5.507 -3.691 1.00 0.17 H new ATOM 0 HA VAL A 100 3.188 -6.897 -1.967 1.00 0.18 H new ATOM 0 HB VAL A 100 2.367 -7.487 -4.836 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.825 -9.456 -4.642 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.731 -7.934 -4.474 1.00 0.26 H new ATOM 0 HG13 VAL A 100 4.346 -8.904 -3.033 1.00 0.26 H new ATOM 0 HG21 VAL A 100 1.483 -9.604 -3.923 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.883 -9.053 -2.279 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.657 -8.186 -3.234 1.00 0.25 H new ATOM 427 N LEU A 101 5.090 -5.617 -2.882 1.00 0.19 N ATOM 428 CA LEU A 101 6.201 -4.800 -3.332 1.00 0.19 C ATOM 429 C LEU A 101 7.336 -5.683 -3.814 1.00 0.21 C ATOM 430 O LEU A 101 7.826 -6.539 -3.079 1.00 0.23 O ATOM 431 CB LEU A 101 6.713 -3.865 -2.227 1.00 0.19 C ATOM 432 CG LEU A 101 5.705 -2.843 -1.695 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.808 -3.466 -0.633 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.428 -1.625 -1.142 1.00 0.21 C ATOM 0 H LEU A 101 5.266 -6.123 -2.014 1.00 0.19 H new ATOM 0 HA LEU A 101 5.837 -4.182 -4.153 1.00 0.19 H new ATOM 0 HB2 LEU A 101 7.057 -4.475 -1.392 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.581 -3.326 -2.607 1.00 0.19 H new ATOM 0 HG LEU A 101 5.072 -2.523 -2.523 1.00 0.22 H new ATOM 0 HD11 LEU A 101 4.101 -2.720 -0.271 1.00 0.30 H new ATOM 0 HD12 LEU A 101 4.262 -4.305 -1.065 1.00 0.30 H new ATOM 0 HD13 LEU A 101 5.419 -3.820 0.197 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.698 -0.907 -0.768 1.00 0.21 H new ATOM 0 HD22 LEU A 101 7.086 -1.931 -0.329 1.00 0.21 H new ATOM 0 HD23 LEU A 101 7.019 -1.162 -1.933 1.00 0.21 H new ATOM 446 N GLU A 102 7.740 -5.482 -5.048 1.00 0.24 N ATOM 447 CA GLU A 102 8.830 -6.242 -5.625 1.00 0.29 C ATOM 448 C GLU A 102 10.086 -5.384 -5.670 1.00 0.28 C ATOM 449 O GLU A 102 10.022 -4.202 -6.021 1.00 0.26 O ATOM 450 CB GLU A 102 8.453 -6.717 -7.034 1.00 0.34 C ATOM 451 CG GLU A 102 9.531 -7.544 -7.717 1.00 0.41 C ATOM 452 CD GLU A 102 9.079 -8.125 -9.040 1.00 0.53 C ATOM 453 OE1 GLU A 102 8.939 -9.366 -9.134 1.00 1.32 O ATOM 454 OE2 GLU A 102 8.864 -7.350 -9.996 1.00 0.95 O ATOM 0 H GLU A 102 7.327 -4.793 -5.677 1.00 0.24 H new ATOM 0 HA GLU A 102 9.024 -7.118 -5.006 1.00 0.29 H new ATOM 0 HB2 GLU A 102 7.539 -7.308 -6.975 1.00 0.34 H new ATOM 0 HB3 GLU A 102 8.231 -5.847 -7.652 1.00 0.34 H new ATOM 0 HG2 GLU A 102 10.410 -6.921 -7.881 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.834 -8.355 -7.055 1.00 0.41 H new ATOM 461 N ASN A 103 11.219 -5.958 -5.285 1.00 0.38 N ATOM 462 CA ASN A 103 12.482 -5.242 -5.379 1.00 0.44 C ATOM 463 C ASN A 103 13.071 -5.413 -6.771 1.00 0.37 C ATOM 464 O ASN A 103 13.744 -6.398 -7.068 1.00 0.51 O ATOM 465 CB ASN A 103 13.483 -5.671 -4.285 1.00 0.68 C ATOM 466 CG ASN A 103 13.675 -7.172 -4.144 1.00 0.87 C ATOM 467 OD1 ASN A 103 12.961 -7.827 -3.389 1.00 1.76 O ATOM 468 ND2 ASN A 103 14.657 -7.722 -4.841 1.00 1.64 N ATOM 0 H ASN A 103 11.289 -6.904 -4.910 1.00 0.38 H new ATOM 0 HA ASN A 103 12.281 -4.184 -5.209 1.00 0.44 H new ATOM 0 HB2 ASN A 103 14.450 -5.215 -4.499 1.00 0.68 H new ATOM 0 HB3 ASN A 103 13.146 -5.271 -3.328 1.00 0.68 H new ATOM 0 HD21 ASN A 103 14.841 -8.722 -4.761 1.00 1.64 H new ATOM 0 HD22 ASN A 103 15.229 -7.146 -5.458 1.00 1.64 H new ATOM 475 N THR A 104 12.787 -4.449 -7.630 1.00 0.34 N ATOM 476 CA THR A 104 13.242 -4.479 -9.008 1.00 0.38 C ATOM 477 C THR A 104 14.710 -4.082 -9.129 1.00 0.50 C ATOM 478 O THR A 104 15.055 -3.079 -9.756 1.00 0.70 O ATOM 479 CB THR A 104 12.370 -3.559 -9.874 1.00 0.55 C ATOM 480 OG1 THR A 104 11.758 -2.560 -9.045 1.00 0.77 O ATOM 481 CG2 THR A 104 11.299 -4.358 -10.593 1.00 0.73 C ATOM 0 H THR A 104 12.235 -3.625 -7.392 1.00 0.34 H new ATOM 0 HA THR A 104 13.148 -5.505 -9.365 1.00 0.38 H new ATOM 0 HB THR A 104 13.001 -3.078 -10.621 1.00 0.55 H new ATOM 0 HG1 THR A 104 12.116 -1.678 -9.278 1.00 0.77 H new ATOM 0 HG21 THR A 104 10.692 -3.688 -11.201 1.00 0.73 H new ATOM 0 HG22 THR A 104 11.770 -5.103 -11.234 1.00 0.73 H new ATOM 0 HG23 THR A 104 10.665 -4.858 -9.861 1.00 0.73 H new ATOM 489 N GLY A 105 15.569 -4.867 -8.501 1.00 0.52 N ATOM 490 CA GLY A 105 16.994 -4.654 -8.616 1.00 0.72 C ATOM 491 C GLY A 105 17.613 -4.239 -7.306 1.00 0.66 C ATOM 492 O GLY A 105 18.698 -4.694 -6.942 1.00 0.80 O ATOM 0 H GLY A 105 15.302 -5.654 -7.909 1.00 0.52 H new ATOM 0 HA2 GLY A 105 17.470 -5.570 -8.967 1.00 0.72 H new ATOM 0 HA3 GLY A 105 17.186 -3.887 -9.366 1.00 0.72 H new ATOM 496 N GLU A 106 16.906 -3.393 -6.589 1.00 0.60 N ATOM 497 CA GLU A 106 17.399 -2.843 -5.344 1.00 0.56 C ATOM 498 C GLU A 106 16.910 -3.677 -4.165 1.00 0.65 C ATOM 499 O GLU A 106 15.720 -3.700 -3.862 1.00 1.05 O ATOM 500 CB GLU A 106 16.941 -1.392 -5.210 1.00 0.68 C ATOM 501 CG GLU A 106 17.448 -0.493 -6.326 1.00 1.25 C ATOM 502 CD GLU A 106 18.957 -0.466 -6.417 1.00 1.91 C ATOM 503 OE1 GLU A 106 19.592 0.213 -5.589 1.00 2.54 O ATOM 504 OE2 GLU A 106 19.514 -1.107 -7.333 1.00 2.47 O ATOM 0 H GLU A 106 15.976 -3.067 -6.851 1.00 0.60 H new ATOM 0 HA GLU A 106 18.489 -2.869 -5.345 1.00 0.56 H new ATOM 0 HB2 GLU A 106 15.851 -1.363 -5.197 1.00 0.68 H new ATOM 0 HB3 GLU A 106 17.282 -0.998 -4.253 1.00 0.68 H new ATOM 0 HG2 GLU A 106 17.037 -0.834 -7.276 1.00 1.25 H new ATOM 0 HG3 GLU A 106 17.080 0.520 -6.165 1.00 1.25 H new ATOM 511 N LYS A 107 17.840 -4.357 -3.510 1.00 0.61 N ATOM 512 CA LYS A 107 17.506 -5.289 -2.441 1.00 0.69 C ATOM 513 C LYS A 107 17.208 -4.566 -1.125 1.00 0.66 C ATOM 514 O LYS A 107 17.850 -3.573 -0.781 1.00 0.76 O ATOM 515 CB LYS A 107 18.657 -6.280 -2.224 1.00 0.86 C ATOM 516 CG LYS A 107 19.106 -7.018 -3.480 1.00 1.37 C ATOM 517 CD LYS A 107 17.973 -7.798 -4.123 1.00 1.80 C ATOM 518 CE LYS A 107 18.480 -8.729 -5.216 1.00 2.66 C ATOM 519 NZ LYS A 107 19.136 -7.996 -6.336 1.00 3.32 N ATOM 0 H LYS A 107 18.839 -4.280 -3.702 1.00 0.61 H new ATOM 0 HA LYS A 107 16.607 -5.823 -2.747 1.00 0.69 H new ATOM 0 HB2 LYS A 107 19.510 -5.741 -1.811 1.00 0.86 H new ATOM 0 HB3 LYS A 107 18.352 -7.013 -1.478 1.00 0.86 H new ATOM 0 HG2 LYS A 107 19.504 -6.301 -4.198 1.00 1.37 H new ATOM 0 HG3 LYS A 107 19.917 -7.701 -3.228 1.00 1.37 H new ATOM 0 HD2 LYS A 107 17.453 -8.380 -3.361 1.00 1.80 H new ATOM 0 HD3 LYS A 107 17.246 -7.104 -4.545 1.00 1.80 H new ATOM 0 HE2 LYS A 107 19.189 -9.436 -4.785 1.00 2.66 H new ATOM 0 HE3 LYS A 107 17.646 -9.312 -5.607 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 18.881 -8.442 -7.240 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 18.818 -7.006 -6.337 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 20.168 -8.027 -6.214 1.00 3.32 H new ATOM 533 N LEU A 108 16.237 -5.089 -0.388 1.00 0.59 N ATOM 534 CA LEU A 108 15.888 -4.567 0.928 1.00 0.57 C ATOM 535 C LEU A 108 16.904 -5.075 1.947 1.00 0.63 C ATOM 536 O LEU A 108 16.850 -6.232 2.369 1.00 0.74 O ATOM 537 CB LEU A 108 14.460 -5.015 1.301 1.00 0.60 C ATOM 538 CG LEU A 108 13.787 -4.303 2.491 1.00 0.58 C ATOM 539 CD1 LEU A 108 14.387 -4.726 3.824 1.00 0.61 C ATOM 540 CD2 LEU A 108 13.874 -2.798 2.329 1.00 0.56 C ATOM 0 H LEU A 108 15.671 -5.884 -0.684 1.00 0.59 H new ATOM 0 HA LEU A 108 15.911 -3.477 0.920 1.00 0.57 H new ATOM 0 HB2 LEU A 108 13.825 -4.883 0.425 1.00 0.60 H new ATOM 0 HB3 LEU A 108 14.487 -6.083 1.517 1.00 0.60 H new ATOM 0 HG LEU A 108 12.739 -4.601 2.494 1.00 0.58 H new ATOM 0 HD11 LEU A 108 13.882 -4.199 4.634 1.00 0.61 H new ATOM 0 HD12 LEU A 108 14.260 -5.801 3.955 1.00 0.61 H new ATOM 0 HD13 LEU A 108 15.449 -4.482 3.839 1.00 0.61 H new ATOM 0 HD21 LEU A 108 13.394 -2.312 3.178 1.00 0.56 H new ATOM 0 HD22 LEU A 108 14.921 -2.497 2.283 1.00 0.56 H new ATOM 0 HD23 LEU A 108 13.370 -2.501 1.409 1.00 0.56 H new ATOM 552 N LYS A 109 17.842 -4.216 2.326 1.00 0.62 N ATOM 553 CA LYS A 109 18.924 -4.623 3.211 1.00 0.73 C ATOM 554 C LYS A 109 18.943 -3.845 4.522 1.00 0.75 C ATOM 555 O LYS A 109 18.891 -4.436 5.597 1.00 1.15 O ATOM 556 CB LYS A 109 20.271 -4.457 2.509 1.00 0.92 C ATOM 557 CG LYS A 109 20.477 -5.405 1.342 1.00 1.17 C ATOM 558 CD LYS A 109 20.421 -6.857 1.791 1.00 1.66 C ATOM 559 CE LYS A 109 20.770 -7.803 0.657 1.00 2.07 C ATOM 560 NZ LYS A 109 22.149 -7.574 0.155 1.00 2.72 N ATOM 0 H LYS A 109 17.875 -3.239 2.036 1.00 0.62 H new ATOM 0 HA LYS A 109 18.748 -5.671 3.453 1.00 0.73 H new ATOM 0 HB2 LYS A 109 20.359 -3.431 2.151 1.00 0.92 H new ATOM 0 HB3 LYS A 109 21.069 -4.611 3.235 1.00 0.92 H new ATOM 0 HG2 LYS A 109 19.712 -5.226 0.587 1.00 1.17 H new ATOM 0 HG3 LYS A 109 21.441 -5.204 0.874 1.00 1.17 H new ATOM 0 HD2 LYS A 109 21.112 -7.010 2.620 1.00 1.66 H new ATOM 0 HD3 LYS A 109 19.422 -7.086 2.163 1.00 1.66 H new ATOM 0 HE2 LYS A 109 20.674 -8.833 1.000 1.00 2.07 H new ATOM 0 HE3 LYS A 109 20.059 -7.671 -0.159 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 22.464 -8.404 -0.387 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 22.160 -6.735 -0.460 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 22.790 -7.422 0.959 1.00 2.72 H new ATOM 574 N LYS A 110 19.016 -2.524 4.433 1.00 0.62 N ATOM 575 CA LYS A 110 19.303 -1.704 5.610 1.00 0.73 C ATOM 576 C LYS A 110 18.047 -1.414 6.432 1.00 0.77 C ATOM 577 O LYS A 110 17.753 -2.114 7.402 1.00 1.53 O ATOM 578 CB LYS A 110 19.982 -0.394 5.194 1.00 0.93 C ATOM 579 CG LYS A 110 21.244 -0.594 4.365 1.00 1.14 C ATOM 580 CD LYS A 110 21.912 0.731 4.031 1.00 1.46 C ATOM 581 CE LYS A 110 22.597 1.341 5.247 1.00 1.80 C ATOM 582 NZ LYS A 110 23.749 0.520 5.708 1.00 1.59 N ATOM 0 H LYS A 110 18.883 -1.998 3.569 1.00 0.62 H new ATOM 0 HA LYS A 110 19.981 -2.274 6.245 1.00 0.73 H new ATOM 0 HB2 LYS A 110 19.274 0.206 4.622 1.00 0.93 H new ATOM 0 HB3 LYS A 110 20.233 0.175 6.089 1.00 0.93 H new ATOM 0 HG2 LYS A 110 21.943 -1.226 4.912 1.00 1.14 H new ATOM 0 HG3 LYS A 110 20.995 -1.119 3.443 1.00 1.14 H new ATOM 0 HD2 LYS A 110 22.645 0.579 3.239 1.00 1.46 H new ATOM 0 HD3 LYS A 110 21.167 1.427 3.646 1.00 1.46 H new ATOM 0 HE2 LYS A 110 22.942 2.345 5.003 1.00 1.80 H new ATOM 0 HE3 LYS A 110 21.875 1.441 6.058 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 24.345 1.085 6.346 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.398 -0.318 6.214 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 24.311 0.218 4.887 1.00 1.59 H new ATOM 596 N SER A 111 17.311 -0.387 6.041 1.00 0.51 N ATOM 597 CA SER A 111 16.132 0.042 6.777 1.00 0.52 C ATOM 598 C SER A 111 14.887 -0.673 6.253 1.00 0.48 C ATOM 599 O SER A 111 14.977 -1.520 5.367 1.00 0.86 O ATOM 600 CB SER A 111 15.986 1.560 6.639 1.00 0.72 C ATOM 601 OG SER A 111 17.180 2.219 7.034 1.00 1.55 O ATOM 0 H SER A 111 17.511 0.170 5.210 1.00 0.51 H new ATOM 0 HA SER A 111 16.244 -0.214 7.831 1.00 0.52 H new ATOM 0 HB2 SER A 111 15.749 1.815 5.606 1.00 0.72 H new ATOM 0 HB3 SER A 111 15.154 1.907 7.252 1.00 0.72 H new ATOM 0 HG SER A 111 17.067 3.188 6.937 1.00 1.55 H new ATOM 607 N LYS A 112 13.730 -0.338 6.799 1.00 0.39 N ATOM 608 CA LYS A 112 12.485 -0.975 6.390 1.00 0.32 C ATOM 609 C LYS A 112 11.516 0.053 5.812 1.00 0.28 C ATOM 610 O LYS A 112 11.360 1.148 6.357 1.00 0.33 O ATOM 611 CB LYS A 112 11.844 -1.700 7.578 1.00 0.45 C ATOM 612 CG LYS A 112 12.769 -2.706 8.246 1.00 0.55 C ATOM 613 CD LYS A 112 12.055 -3.486 9.338 1.00 0.69 C ATOM 614 CE LYS A 112 13.010 -4.396 10.099 1.00 0.84 C ATOM 615 NZ LYS A 112 13.760 -5.309 9.194 1.00 1.53 N ATOM 0 H LYS A 112 13.625 0.370 7.526 1.00 0.39 H new ATOM 0 HA LYS A 112 12.713 -1.706 5.614 1.00 0.32 H new ATOM 0 HB2 LYS A 112 11.528 -0.963 8.316 1.00 0.45 H new ATOM 0 HB3 LYS A 112 10.946 -2.215 7.237 1.00 0.45 H new ATOM 0 HG2 LYS A 112 13.156 -3.398 7.498 1.00 0.55 H new ATOM 0 HG3 LYS A 112 13.627 -2.185 8.672 1.00 0.55 H new ATOM 0 HD2 LYS A 112 11.584 -2.791 10.033 1.00 0.69 H new ATOM 0 HD3 LYS A 112 11.258 -4.084 8.896 1.00 0.69 H new ATOM 0 HE2 LYS A 112 13.716 -3.787 10.664 1.00 0.84 H new ATOM 0 HE3 LYS A 112 12.447 -4.986 10.822 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 14.267 -6.019 9.760 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 13.094 -5.787 8.554 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 14.444 -4.759 8.635 1.00 1.53 H new ATOM 629 N TRP A 113 10.878 -0.308 4.703 1.00 0.24 N ATOM 630 CA TRP A 113 9.913 0.570 4.043 1.00 0.22 C ATOM 631 C TRP A 113 8.638 0.660 4.866 1.00 0.21 C ATOM 632 O TRP A 113 8.117 -0.357 5.333 1.00 0.25 O ATOM 633 CB TRP A 113 9.588 0.061 2.632 1.00 0.22 C ATOM 634 CG TRP A 113 10.642 0.369 1.605 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.954 -0.014 1.628 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.466 1.112 0.389 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.604 0.457 0.513 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.714 1.148 -0.263 1.00 0.25 C ATOM 639 CE3 TRP A 113 9.377 1.755 -0.215 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.904 1.796 -1.479 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.570 2.396 -1.426 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.825 2.412 -2.045 1.00 0.32 C ATOM 0 H TRP A 113 11.012 -1.207 4.239 1.00 0.24 H new ATOM 0 HA TRP A 113 10.357 1.562 3.960 1.00 0.22 H new ATOM 0 HB2 TRP A 113 9.441 -1.018 2.673 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.644 0.499 2.309 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.413 -0.602 2.409 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.591 0.314 0.298 1.00 0.25 H new ATOM 0 HE3 TRP A 113 8.405 1.750 0.256 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.871 1.811 -1.959 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.737 2.893 -1.902 1.00 0.32 H new ATOM 0 HH2 TRP A 113 10.942 2.922 -2.990 1.00 0.32 H new ATOM 653 N LYS A 114 8.143 1.876 5.043 1.00 0.20 N ATOM 654 CA LYS A 114 6.958 2.106 5.844 1.00 0.24 C ATOM 655 C LYS A 114 5.749 2.311 4.944 1.00 0.20 C ATOM 656 O LYS A 114 5.837 2.983 3.914 1.00 0.24 O ATOM 657 CB LYS A 114 7.151 3.326 6.742 1.00 0.37 C ATOM 658 CG LYS A 114 6.095 3.445 7.827 1.00 0.58 C ATOM 659 CD LYS A 114 6.251 4.727 8.621 1.00 1.04 C ATOM 660 CE LYS A 114 5.136 4.890 9.642 1.00 1.08 C ATOM 661 NZ LYS A 114 5.171 3.836 10.690 1.00 1.66 N ATOM 0 H LYS A 114 8.549 2.720 4.639 1.00 0.20 H new ATOM 0 HA LYS A 114 6.789 1.231 6.472 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.136 3.275 7.207 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.135 4.227 6.128 1.00 0.37 H new ATOM 0 HG2 LYS A 114 5.104 3.415 7.375 1.00 0.58 H new ATOM 0 HG3 LYS A 114 6.165 2.590 8.499 1.00 0.58 H new ATOM 0 HD2 LYS A 114 7.215 4.726 9.130 1.00 1.04 H new ATOM 0 HD3 LYS A 114 6.251 5.579 7.941 1.00 1.04 H new ATOM 0 HE2 LYS A 114 5.218 5.870 10.113 1.00 1.08 H new ATOM 0 HE3 LYS A 114 4.173 4.861 9.132 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 4.458 4.046 11.417 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 4.965 2.912 10.260 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 6.114 3.812 11.127 1.00 1.66 H new ATOM 675 N TRP A 115 4.626 1.732 5.330 1.00 0.17 N ATOM 676 CA TRP A 115 3.415 1.830 4.538 1.00 0.15 C ATOM 677 C TRP A 115 2.247 2.317 5.382 1.00 0.16 C ATOM 678 O TRP A 115 2.222 2.122 6.601 1.00 0.18 O ATOM 679 CB TRP A 115 3.077 0.477 3.908 1.00 0.15 C ATOM 680 CG TRP A 115 2.843 -0.609 4.913 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.783 -1.411 5.484 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.585 -1.014 5.461 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.189 -2.286 6.358 1.00 0.22 N ATOM 684 CE2 TRP A 115 1.842 -2.063 6.362 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.270 -0.589 5.281 1.00 0.18 C ATOM 686 CZ2 TRP A 115 0.831 -2.693 7.076 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.732 -1.215 5.990 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.449 -2.258 6.880 1.00 0.22 C ATOM 0 H TRP A 115 4.528 1.189 6.188 1.00 0.17 H new ATOM 0 HA TRP A 115 3.592 2.557 3.745 1.00 0.15 H new ATOM 0 HB2 TRP A 115 2.187 0.586 3.289 1.00 0.15 H new ATOM 0 HB3 TRP A 115 3.891 0.180 3.247 1.00 0.15 H new ATOM 0 HD1 TRP A 115 4.842 -1.365 5.279 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.675 -2.989 6.915 1.00 0.22 H new ATOM 0 HE3 TRP A 115 0.041 0.216 4.599 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 1.049 -3.498 7.762 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.755 -0.895 5.857 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.257 -2.727 7.421 1.00 0.22 H new ATOM 699 N GLU A 116 1.297 2.962 4.725 1.00 0.17 N ATOM 700 CA GLU A 116 0.090 3.441 5.377 1.00 0.20 C ATOM 701 C GLU A 116 -1.131 3.112 4.523 1.00 0.19 C ATOM 702 O GLU A 116 -1.163 3.432 3.336 1.00 0.25 O ATOM 703 CB GLU A 116 0.145 4.959 5.565 1.00 0.32 C ATOM 704 CG GLU A 116 1.402 5.487 6.234 1.00 0.50 C ATOM 705 CD GLU A 116 1.497 6.995 6.120 1.00 0.64 C ATOM 706 OE1 GLU A 116 2.515 7.572 6.547 1.00 1.40 O ATOM 707 OE2 GLU A 116 0.555 7.614 5.573 1.00 1.22 O ATOM 0 H GLU A 116 1.341 3.168 3.727 1.00 0.17 H new ATOM 0 HA GLU A 116 0.017 2.951 6.348 1.00 0.20 H new ATOM 0 HB2 GLU A 116 0.047 5.433 4.588 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -0.718 5.266 6.156 1.00 0.32 H new ATOM 0 HG2 GLU A 116 1.405 5.199 7.285 1.00 0.50 H new ATOM 0 HG3 GLU A 116 2.279 5.030 5.776 1.00 0.50 H new ATOM 714 N LEU A 117 -2.133 2.486 5.114 1.00 0.17 N ATOM 715 CA LEU A 117 -3.397 2.280 4.426 1.00 0.16 C ATOM 716 C LEU A 117 -4.285 3.485 4.666 1.00 0.15 C ATOM 717 O LEU A 117 -4.538 3.856 5.810 1.00 0.19 O ATOM 718 CB LEU A 117 -4.116 1.020 4.908 1.00 0.19 C ATOM 719 CG LEU A 117 -5.443 0.738 4.195 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.211 0.128 2.822 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.325 -0.159 5.039 1.00 0.25 C ATOM 0 H LEU A 117 -2.098 2.113 6.063 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.188 2.154 3.364 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.455 0.164 4.772 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.304 1.110 5.978 1.00 0.19 H new ATOM 0 HG LEU A 117 -5.956 1.690 4.055 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.171 -0.061 2.341 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.628 0.818 2.211 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.667 -0.811 2.928 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.262 -0.346 4.514 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -5.815 -1.105 5.220 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.534 0.328 5.991 1.00 0.25 H new ATOM 733 N HIS A 118 -4.747 4.100 3.598 1.00 0.13 N ATOM 734 CA HIS A 118 -5.524 5.319 3.712 1.00 0.14 C ATOM 735 C HIS A 118 -6.968 5.092 3.327 1.00 0.18 C ATOM 736 O HIS A 118 -7.266 4.297 2.438 1.00 0.21 O ATOM 737 CB HIS A 118 -4.938 6.421 2.829 1.00 0.18 C ATOM 738 CG HIS A 118 -3.646 6.981 3.336 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.367 8.328 3.339 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.560 6.373 3.869 1.00 0.24 C ATOM 741 CE1 HIS A 118 -2.168 8.523 3.855 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.656 7.357 4.185 1.00 0.22 N ATOM 0 H HIS A 118 -4.599 3.778 2.642 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.483 5.629 4.756 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.782 6.025 1.826 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.664 7.229 2.743 1.00 0.18 H new ATOM 0 HD2 HIS A 118 -2.429 5.311 4.018 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.687 9.481 3.985 1.00 0.45 H new ATOM 0 HE2 HIS A 118 -0.739 7.208 4.606 1.00 0.22 H new ATOM 751 N LYS A 119 -7.853 5.784 4.019 1.00 0.22 N ATOM 752 CA LYS A 119 -9.236 5.875 3.604 1.00 0.29 C ATOM 753 C LYS A 119 -9.412 7.145 2.789 1.00 0.27 C ATOM 754 O LYS A 119 -9.418 8.254 3.330 1.00 0.43 O ATOM 755 CB LYS A 119 -10.179 5.867 4.807 1.00 0.43 C ATOM 756 CG LYS A 119 -11.626 6.164 4.439 1.00 0.70 C ATOM 757 CD LYS A 119 -12.590 5.684 5.507 1.00 0.84 C ATOM 758 CE LYS A 119 -12.782 4.182 5.426 1.00 1.04 C ATOM 759 NZ LYS A 119 -13.666 3.666 6.500 1.00 1.69 N ATOM 0 H LYS A 119 -7.635 6.293 4.875 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.488 5.006 2.996 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -10.128 4.893 5.294 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -9.837 6.605 5.533 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -11.751 7.237 4.293 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -11.866 5.683 3.491 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -12.211 5.954 6.493 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -13.551 6.185 5.387 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -13.206 3.924 4.455 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -11.811 3.690 5.491 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -13.672 2.626 6.475 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -13.314 3.988 7.424 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -14.633 4.021 6.355 1.00 1.69 H new ATOM 773 N LEU A 120 -9.521 6.978 1.486 1.00 0.23 N ATOM 774 CA LEU A 120 -9.576 8.108 0.583 1.00 0.26 C ATOM 775 C LEU A 120 -11.015 8.553 0.402 1.00 0.34 C ATOM 776 O LEU A 120 -11.925 7.732 0.287 1.00 0.37 O ATOM 777 CB LEU A 120 -8.936 7.762 -0.771 1.00 0.24 C ATOM 778 CG LEU A 120 -7.426 7.480 -0.738 1.00 0.20 C ATOM 779 CD1 LEU A 120 -6.694 8.528 0.087 1.00 0.25 C ATOM 780 CD2 LEU A 120 -7.139 6.086 -0.212 1.00 0.21 C ATOM 0 H LEU A 120 -9.573 6.068 1.029 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.006 8.930 1.017 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.442 6.887 -1.179 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -9.119 8.586 -1.460 1.00 0.24 H new ATOM 0 HG LEU A 120 -7.057 7.535 -1.762 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -5.627 8.305 0.094 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -6.856 9.513 -0.350 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.074 8.517 1.109 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -6.062 5.916 -0.201 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.532 5.991 0.800 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.616 5.348 -0.857 1.00 0.21 H new ATOM 792 N GLU A 121 -11.211 9.858 0.394 1.00 0.46 N ATOM 793 CA GLU A 121 -12.546 10.430 0.329 1.00 0.57 C ATOM 794 C GLU A 121 -13.067 10.403 -1.103 1.00 0.58 C ATOM 795 O GLU A 121 -14.268 10.533 -1.344 1.00 0.69 O ATOM 796 CB GLU A 121 -12.531 11.860 0.870 1.00 0.70 C ATOM 797 CG GLU A 121 -12.010 11.964 2.296 1.00 0.80 C ATOM 798 CD GLU A 121 -12.065 13.376 2.832 1.00 1.63 C ATOM 799 OE1 GLU A 121 -11.208 14.199 2.443 1.00 2.36 O ATOM 800 OE2 GLU A 121 -12.958 13.671 3.655 1.00 2.22 O ATOM 0 H GLU A 121 -10.459 10.547 0.432 1.00 0.46 H new ATOM 0 HA GLU A 121 -13.215 9.832 0.947 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -11.913 12.480 0.220 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -13.542 12.266 0.830 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -12.597 11.311 2.942 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -10.981 11.606 2.330 1.00 0.80 H new ATOM 807 N ASN A 122 -12.152 10.235 -2.045 1.00 0.53 N ATOM 808 CA ASN A 122 -12.510 10.065 -3.444 1.00 0.60 C ATOM 809 C ASN A 122 -11.404 9.296 -4.149 1.00 0.62 C ATOM 810 O ASN A 122 -10.233 9.401 -3.780 1.00 1.22 O ATOM 811 CB ASN A 122 -12.747 11.419 -4.139 1.00 0.73 C ATOM 812 CG ASN A 122 -11.460 12.137 -4.506 1.00 1.03 C ATOM 813 OD1 ASN A 122 -10.911 11.928 -5.586 1.00 1.16 O ATOM 814 ND2 ASN A 122 -10.980 12.995 -3.621 1.00 1.87 N ATOM 0 H ASN A 122 -11.149 10.213 -1.863 1.00 0.53 H new ATOM 0 HA ASN A 122 -13.444 9.506 -3.498 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -13.336 11.258 -5.042 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -13.338 12.058 -3.483 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -10.124 13.512 -3.824 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -11.466 13.140 -2.736 1.00 1.87 H new ATOM 821 N ALA A 123 -11.777 8.510 -5.143 1.00 0.67 N ATOM 822 CA ALA A 123 -10.810 7.728 -5.898 1.00 0.66 C ATOM 823 C ALA A 123 -10.667 8.281 -7.311 1.00 0.71 C ATOM 824 O ALA A 123 -10.329 7.559 -8.250 1.00 0.90 O ATOM 825 CB ALA A 123 -11.235 6.270 -5.929 1.00 0.69 C ATOM 0 H ALA A 123 -12.744 8.395 -5.448 1.00 0.67 H new ATOM 0 HA ALA A 123 -9.838 7.796 -5.409 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -10.506 5.691 -6.496 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -11.291 5.886 -4.911 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -12.213 6.186 -6.403 1.00 0.69 H new ATOM 831 N ARG A 124 -10.918 9.573 -7.440 1.00 0.72 N ATOM 832 CA ARG A 124 -10.930 10.239 -8.736 1.00 0.83 C ATOM 833 C ARG A 124 -9.725 11.161 -8.890 1.00 0.75 C ATOM 834 O ARG A 124 -9.091 11.211 -9.947 1.00 0.86 O ATOM 835 CB ARG A 124 -12.221 11.043 -8.883 1.00 1.08 C ATOM 836 CG ARG A 124 -13.473 10.182 -8.921 1.00 1.37 C ATOM 837 CD ARG A 124 -14.727 11.009 -8.685 1.00 1.63 C ATOM 838 NE ARG A 124 -14.841 12.122 -9.624 1.00 2.28 N ATOM 839 CZ ARG A 124 -15.909 12.911 -9.719 1.00 2.84 C ATOM 840 NH1 ARG A 124 -16.977 12.690 -8.960 1.00 2.76 N ATOM 841 NH2 ARG A 124 -15.909 13.918 -10.582 1.00 3.84 N ATOM 0 H ARG A 124 -11.119 10.190 -6.653 1.00 0.72 H new ATOM 0 HA ARG A 124 -10.878 9.480 -9.516 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -12.298 11.745 -8.053 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -12.169 11.634 -9.797 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -13.542 9.682 -9.887 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -13.402 9.402 -8.163 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -15.604 10.369 -8.776 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -14.718 11.396 -7.666 1.00 1.63 H new ATOM 0 HE ARG A 124 -14.053 12.306 -10.245 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -16.982 11.912 -8.300 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -17.792 13.298 -9.037 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -15.093 14.086 -11.170 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -16.725 14.525 -10.658 1.00 3.84 H new ATOM 855 N LYS A 125 -9.432 11.895 -7.833 1.00 0.75 N ATOM 856 CA LYS A 125 -8.321 12.830 -7.809 1.00 0.68 C ATOM 857 C LYS A 125 -7.110 12.176 -7.156 1.00 0.55 C ATOM 858 O LYS A 125 -7.250 11.128 -6.522 1.00 0.53 O ATOM 859 CB LYS A 125 -8.722 14.096 -7.040 1.00 0.79 C ATOM 860 CG LYS A 125 -9.921 14.823 -7.635 1.00 0.93 C ATOM 861 CD LYS A 125 -10.269 16.074 -6.843 1.00 1.64 C ATOM 862 CE LYS A 125 -9.162 17.118 -6.915 1.00 1.90 C ATOM 863 NZ LYS A 125 -8.952 17.615 -8.301 1.00 2.26 N ATOM 0 H LYS A 125 -9.961 11.860 -6.961 1.00 0.75 H new ATOM 0 HA LYS A 125 -8.062 13.108 -8.831 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -8.948 13.827 -6.008 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -7.872 14.778 -7.013 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -9.706 15.094 -8.669 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -10.781 14.153 -7.654 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -11.196 16.501 -7.227 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -10.448 15.806 -5.802 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -9.411 17.956 -6.264 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -8.233 16.688 -6.540 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -8.343 18.458 -8.279 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -8.497 16.873 -8.870 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -9.869 17.862 -8.724 1.00 2.26 H new ATOM 877 N PRO A 126 -5.903 12.746 -7.343 1.00 0.51 N ATOM 878 CA PRO A 126 -4.693 12.272 -6.669 1.00 0.45 C ATOM 879 C PRO A 126 -4.945 12.023 -5.189 1.00 0.39 C ATOM 880 O PRO A 126 -5.476 12.886 -4.483 1.00 0.47 O ATOM 881 CB PRO A 126 -3.687 13.418 -6.859 1.00 0.51 C ATOM 882 CG PRO A 126 -4.456 14.535 -7.491 1.00 0.59 C ATOM 883 CD PRO A 126 -5.605 13.890 -8.211 1.00 0.60 C ATOM 0 HA PRO A 126 -4.340 11.324 -7.075 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -3.262 13.727 -5.904 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -2.856 13.108 -7.493 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -4.812 15.238 -6.738 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -3.829 15.098 -8.182 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -6.457 14.563 -8.306 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -5.332 13.578 -9.219 1.00 0.60 H new ATOM 891 N LEU A 127 -4.568 10.844 -4.730 1.00 0.32 N ATOM 892 CA LEU A 127 -4.912 10.399 -3.392 1.00 0.26 C ATOM 893 C LEU A 127 -4.242 11.256 -2.332 1.00 0.29 C ATOM 894 O LEU A 127 -3.122 11.737 -2.511 1.00 0.37 O ATOM 895 CB LEU A 127 -4.550 8.928 -3.218 1.00 0.24 C ATOM 896 CG LEU A 127 -5.172 7.992 -4.258 1.00 0.26 C ATOM 897 CD1 LEU A 127 -4.933 6.544 -3.881 1.00 0.26 C ATOM 898 CD2 LEU A 127 -6.662 8.268 -4.422 1.00 0.27 C ATOM 0 H LEU A 127 -4.020 10.173 -5.268 1.00 0.32 H new ATOM 0 HA LEU A 127 -5.989 10.509 -3.263 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -3.466 8.827 -3.260 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -4.862 8.605 -2.225 1.00 0.24 H new ATOM 0 HG LEU A 127 -4.689 8.183 -5.216 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.382 5.894 -4.632 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -3.861 6.353 -3.830 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.384 6.342 -2.909 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -7.078 7.589 -5.166 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -7.168 8.115 -3.469 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -6.808 9.298 -4.748 1.00 0.27 H new ATOM 910 N LYS A 128 -4.948 11.445 -1.231 1.00 0.29 N ATOM 911 CA LYS A 128 -4.531 12.379 -0.204 1.00 0.36 C ATOM 912 C LYS A 128 -4.005 11.679 1.045 1.00 0.26 C ATOM 913 O LYS A 128 -4.454 10.589 1.420 1.00 0.23 O ATOM 914 CB LYS A 128 -5.699 13.289 0.182 1.00 0.51 C ATOM 915 CG LYS A 128 -6.902 12.544 0.747 1.00 1.10 C ATOM 916 CD LYS A 128 -7.958 13.500 1.281 1.00 1.37 C ATOM 917 CE LYS A 128 -8.570 14.345 0.173 1.00 1.80 C ATOM 918 NZ LYS A 128 -9.548 15.330 0.704 1.00 2.27 N ATOM 0 H LYS A 128 -5.821 10.958 -1.026 1.00 0.29 H new ATOM 0 HA LYS A 128 -3.715 12.967 -0.623 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -5.354 14.014 0.919 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -6.013 13.853 -0.696 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -7.339 11.917 -0.030 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -6.575 11.879 1.547 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -8.743 12.932 1.780 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -7.511 14.153 2.031 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -7.779 14.871 -0.362 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -9.065 13.695 -0.548 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -9.942 15.886 -0.082 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -10.316 14.827 1.192 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -9.071 15.967 1.373 1.00 2.27 H new ATOM 932 N ASP A 129 -3.039 12.323 1.670 1.00 0.32 N ATOM 933 CA ASP A 129 -2.540 11.918 2.970 1.00 0.39 C ATOM 934 C ASP A 129 -3.449 12.469 4.060 1.00 0.45 C ATOM 935 O ASP A 129 -4.278 13.341 3.796 1.00 0.51 O ATOM 936 CB ASP A 129 -1.109 12.425 3.182 1.00 0.59 C ATOM 937 CG ASP A 129 -1.020 13.941 3.204 1.00 1.00 C ATOM 938 OD1 ASP A 129 -0.934 14.525 4.304 1.00 1.56 O ATOM 939 OD2 ASP A 129 -1.031 14.555 2.116 1.00 1.88 O ATOM 0 H ASP A 129 -2.575 13.147 1.288 1.00 0.32 H new ATOM 0 HA ASP A 129 -2.531 10.829 3.017 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -0.723 12.029 4.122 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -0.470 12.039 2.387 1.00 0.59 H new ATOM 944 N GLY A 130 -3.324 11.938 5.266 1.00 0.51 N ATOM 945 CA GLY A 130 -4.075 12.476 6.383 1.00 0.62 C ATOM 946 C GLY A 130 -4.944 11.445 7.063 1.00 0.60 C ATOM 947 O GLY A 130 -5.059 11.430 8.287 1.00 0.75 O ATOM 0 H GLY A 130 -2.720 11.148 5.492 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -3.381 12.895 7.112 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -4.701 13.296 6.031 1.00 0.62 H new ATOM 951 N ASN A 131 -5.553 10.575 6.278 1.00 0.47 N ATOM 952 CA ASN A 131 -6.410 9.541 6.828 1.00 0.46 C ATOM 953 C ASN A 131 -5.728 8.193 6.714 1.00 0.40 C ATOM 954 O ASN A 131 -5.626 7.634 5.625 1.00 0.46 O ATOM 955 CB ASN A 131 -7.756 9.512 6.102 1.00 0.51 C ATOM 956 CG ASN A 131 -8.521 10.813 6.253 1.00 1.32 C ATOM 957 OD1 ASN A 131 -9.298 10.985 7.192 1.00 2.28 O ATOM 958 ND2 ASN A 131 -8.305 11.740 5.330 1.00 1.45 N ATOM 0 H ASN A 131 -5.471 10.564 5.261 1.00 0.47 H new ATOM 0 HA ASN A 131 -6.592 9.763 7.880 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -7.591 9.311 5.043 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -8.359 8.692 6.492 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -8.791 12.635 5.383 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -7.653 11.558 4.567 1.00 1.45 H new ATOM 965 N VAL A 132 -5.256 7.680 7.834 1.00 0.36 N ATOM 966 CA VAL A 132 -4.561 6.408 7.855 1.00 0.31 C ATOM 967 C VAL A 132 -5.257 5.434 8.799 1.00 0.28 C ATOM 968 O VAL A 132 -5.592 5.772 9.936 1.00 0.35 O ATOM 969 CB VAL A 132 -3.073 6.575 8.242 1.00 0.35 C ATOM 970 CG1 VAL A 132 -2.930 7.299 9.568 1.00 0.73 C ATOM 971 CG2 VAL A 132 -2.369 5.227 8.295 1.00 0.71 C ATOM 0 H VAL A 132 -5.342 8.128 8.746 1.00 0.36 H new ATOM 0 HA VAL A 132 -4.592 5.999 6.845 1.00 0.31 H new ATOM 0 HB VAL A 132 -2.598 7.181 7.470 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -1.873 7.402 9.814 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -3.383 8.288 9.494 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -3.431 6.728 10.350 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -1.324 5.373 8.569 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -2.854 4.592 9.037 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.424 4.749 7.317 1.00 0.71 H new ATOM 981 N ILE A 133 -5.489 4.234 8.300 1.00 0.23 N ATOM 982 CA ILE A 133 -6.220 3.218 9.034 1.00 0.26 C ATOM 983 C ILE A 133 -5.265 2.156 9.568 1.00 0.28 C ATOM 984 O ILE A 133 -5.344 1.752 10.727 1.00 0.38 O ATOM 985 CB ILE A 133 -7.267 2.545 8.122 1.00 0.31 C ATOM 986 CG1 ILE A 133 -8.127 3.602 7.413 1.00 0.34 C ATOM 987 CG2 ILE A 133 -8.141 1.590 8.918 1.00 0.38 C ATOM 988 CD1 ILE A 133 -8.897 4.509 8.351 1.00 0.35 C ATOM 0 H ILE A 133 -5.176 3.937 7.376 1.00 0.23 H new ATOM 0 HA ILE A 133 -6.725 3.702 9.870 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.737 1.969 7.363 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.483 4.214 6.782 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.833 3.097 6.754 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -8.872 1.127 8.255 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.519 0.817 9.368 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.660 2.140 9.703 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.478 5.225 7.770 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.569 3.910 8.965 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.199 5.045 8.994 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.352 1.728 8.712 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.372 0.709 9.056 1.00 0.30 C ATOM 1002 C GLU A 134 -1.997 1.212 8.651 1.00 0.23 C ATOM 1003 O GLU A 134 -1.884 1.972 7.693 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.667 -0.604 8.321 1.00 0.43 C ATOM 1005 CG GLU A 134 -5.055 -1.171 8.564 1.00 0.63 C ATOM 1006 CD GLU A 134 -5.188 -1.873 9.899 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -4.971 -3.099 9.953 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -5.520 -1.208 10.898 1.00 1.42 O ATOM 0 H GLU A 134 -4.269 2.077 7.757 1.00 0.25 H new ATOM 0 HA GLU A 134 -3.415 0.518 10.128 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -3.538 -0.442 7.251 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -2.928 -1.347 8.622 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -5.785 -0.363 8.512 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -5.298 -1.873 7.766 1.00 0.63 H new ATOM 1015 N LYS A 135 -0.963 0.805 9.363 1.00 0.28 N ATOM 1016 CA LYS A 135 0.387 1.252 9.047 1.00 0.25 C ATOM 1017 C LYS A 135 1.429 0.350 9.683 1.00 0.27 C ATOM 1018 O LYS A 135 1.155 -0.336 10.668 1.00 0.34 O ATOM 1019 CB LYS A 135 0.594 2.700 9.506 1.00 0.32 C ATOM 1020 CG LYS A 135 0.168 2.942 10.943 1.00 0.56 C ATOM 1021 CD LYS A 135 0.388 4.383 11.360 1.00 0.62 C ATOM 1022 CE LYS A 135 0.044 4.596 12.828 1.00 0.74 C ATOM 1023 NZ LYS A 135 -1.379 4.279 13.122 1.00 1.53 N ATOM 0 H LYS A 135 -1.027 0.170 10.159 1.00 0.28 H new ATOM 0 HA LYS A 135 0.509 1.202 7.965 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.647 2.961 9.398 1.00 0.32 H new ATOM 0 HB3 LYS A 135 0.032 3.365 8.851 1.00 0.32 H new ATOM 0 HG2 LYS A 135 -0.886 2.687 11.058 1.00 0.56 H new ATOM 0 HG3 LYS A 135 0.729 2.282 11.605 1.00 0.56 H new ATOM 0 HD2 LYS A 135 1.428 4.659 11.185 1.00 0.62 H new ATOM 0 HD3 LYS A 135 -0.225 5.040 10.742 1.00 0.62 H new ATOM 0 HE2 LYS A 135 0.689 3.971 13.445 1.00 0.74 H new ATOM 0 HE3 LYS A 135 0.248 5.631 13.101 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 -1.609 4.581 14.090 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 -1.993 4.780 12.448 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 -1.532 3.254 13.033 1.00 1.53 H new ATOM 1037 N GLY A 136 2.618 0.349 9.106 1.00 0.30 N ATOM 1038 CA GLY A 136 3.702 -0.446 9.634 1.00 0.38 C ATOM 1039 C GLY A 136 4.859 -0.515 8.670 1.00 0.34 C ATOM 1040 O GLY A 136 5.088 0.420 7.902 1.00 0.29 O ATOM 0 H GLY A 136 2.853 0.890 8.274 1.00 0.30 H new ATOM 0 HA2 GLY A 136 4.040 -0.020 10.579 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.345 -1.453 9.848 1.00 0.38 H new ATOM 1044 N PHE A 137 5.583 -1.619 8.701 1.00 0.38 N ATOM 1045 CA PHE A 137 6.688 -1.837 7.785 1.00 0.32 C ATOM 1046 C PHE A 137 6.383 -3.046 6.920 1.00 0.33 C ATOM 1047 O PHE A 137 5.660 -3.939 7.359 1.00 0.46 O ATOM 1048 CB PHE A 137 7.997 -2.054 8.548 1.00 0.42 C ATOM 1049 CG PHE A 137 8.349 -0.927 9.477 1.00 1.07 C ATOM 1050 CD1 PHE A 137 8.886 0.253 8.988 1.00 2.05 C ATOM 1051 CD2 PHE A 137 8.144 -1.047 10.844 1.00 1.81 C ATOM 1052 CE1 PHE A 137 9.209 1.289 9.841 1.00 2.86 C ATOM 1053 CE2 PHE A 137 8.466 -0.013 11.701 1.00 2.60 C ATOM 1054 CZ PHE A 137 8.998 1.157 11.199 1.00 2.93 C ATOM 0 H PHE A 137 5.424 -2.384 9.356 1.00 0.38 H new ATOM 0 HA PHE A 137 6.808 -0.953 7.158 1.00 0.32 H new ATOM 0 HB2 PHE A 137 7.923 -2.977 9.123 1.00 0.42 H new ATOM 0 HB3 PHE A 137 8.807 -2.189 7.831 1.00 0.42 H new ATOM 0 HD1 PHE A 137 9.054 0.363 7.927 1.00 2.05 H new ATOM 0 HD2 PHE A 137 7.728 -1.960 11.243 1.00 1.81 H new ATOM 0 HE1 PHE A 137 9.627 2.203 9.446 1.00 2.86 H new ATOM 0 HE2 PHE A 137 8.302 -0.120 12.763 1.00 2.60 H new ATOM 0 HZ PHE A 137 9.249 1.968 11.867 1.00 2.93 H new ATOM 1064 N VAL A 138 6.908 -3.069 5.701 1.00 0.27 N ATOM 1065 CA VAL A 138 6.596 -4.144 4.764 1.00 0.41 C ATOM 1066 C VAL A 138 6.923 -5.515 5.358 1.00 0.70 C ATOM 1067 O VAL A 138 6.017 -6.304 5.632 1.00 1.41 O ATOM 1068 CB VAL A 138 7.325 -3.953 3.416 1.00 0.53 C ATOM 1069 CG1 VAL A 138 7.055 -5.122 2.491 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.890 -2.654 2.752 1.00 0.48 C ATOM 0 H VAL A 138 7.547 -2.362 5.339 1.00 0.27 H new ATOM 0 HA VAL A 138 5.523 -4.101 4.576 1.00 0.41 H new ATOM 0 HB VAL A 138 8.396 -3.905 3.615 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.578 -4.967 1.547 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.409 -6.043 2.955 1.00 0.76 H new ATOM 0 HG13 VAL A 138 5.984 -5.198 2.304 1.00 0.76 H new ATOM 0 HG21 VAL A 138 7.414 -2.537 1.804 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.815 -2.680 2.572 1.00 0.48 H new ATOM 0 HG23 VAL A 138 7.129 -1.814 3.405 1.00 0.48 H new ATOM 1080 N SER A 139 8.216 -5.769 5.567 1.00 0.32 N ATOM 1081 CA SER A 139 8.702 -6.939 6.311 1.00 0.51 C ATOM 1082 C SER A 139 8.449 -8.277 5.598 1.00 0.39 C ATOM 1083 O SER A 139 9.398 -8.990 5.265 1.00 1.13 O ATOM 1084 CB SER A 139 8.073 -6.968 7.707 1.00 1.03 C ATOM 1085 OG SER A 139 8.194 -5.707 8.350 1.00 1.68 O ATOM 0 H SER A 139 8.963 -5.166 5.223 1.00 0.32 H new ATOM 0 HA SER A 139 9.784 -6.828 6.381 1.00 0.51 H new ATOM 0 HB2 SER A 139 7.020 -7.240 7.629 1.00 1.03 H new ATOM 0 HB3 SER A 139 8.557 -7.735 8.311 1.00 1.03 H new ATOM 0 HG SER A 139 7.783 -5.752 9.239 1.00 1.68 H new ATOM 1091 N ASN A 140 7.180 -8.605 5.369 1.00 0.51 N ATOM 1092 CA ASN A 140 6.784 -9.936 4.911 1.00 0.34 C ATOM 1093 C ASN A 140 7.426 -10.306 3.576 1.00 0.27 C ATOM 1094 O ASN A 140 7.244 -9.623 2.567 1.00 0.37 O ATOM 1095 CB ASN A 140 5.260 -10.034 4.800 1.00 0.37 C ATOM 1096 CG ASN A 140 4.780 -11.446 4.493 1.00 0.38 C ATOM 1097 OD1 ASN A 140 3.773 -11.634 3.815 1.00 0.94 O ATOM 1098 ND2 ASN A 140 5.474 -12.449 5.012 1.00 0.88 N ATOM 0 H ASN A 140 6.400 -7.960 5.495 1.00 0.51 H new ATOM 0 HA ASN A 140 7.142 -10.646 5.656 1.00 0.34 H new ATOM 0 HB2 ASN A 140 4.810 -9.697 5.734 1.00 0.37 H new ATOM 0 HB3 ASN A 140 4.913 -9.359 4.017 1.00 0.37 H new ATOM 0 HD21 ASN A 140 5.176 -13.411 4.853 1.00 0.88 H new ATOM 0 HD22 ASN A 140 6.306 -12.258 5.570 1.00 0.88 H new ATOM 1105 N GLN A 141 8.170 -11.403 3.589 1.00 0.35 N ATOM 1106 CA GLN A 141 8.852 -11.902 2.405 1.00 0.32 C ATOM 1107 C GLN A 141 8.094 -13.101 1.837 1.00 0.30 C ATOM 1108 O GLN A 141 8.282 -14.233 2.289 1.00 0.36 O ATOM 1109 CB GLN A 141 10.279 -12.326 2.770 1.00 0.39 C ATOM 1110 CG GLN A 141 11.167 -12.629 1.574 1.00 0.39 C ATOM 1111 CD GLN A 141 11.776 -11.380 0.970 1.00 0.52 C ATOM 1112 OE1 GLN A 141 12.869 -10.963 1.357 1.00 0.69 O ATOM 1113 NE2 GLN A 141 11.081 -10.770 0.024 1.00 0.63 N ATOM 0 H GLN A 141 8.317 -11.972 4.422 1.00 0.35 H new ATOM 0 HA GLN A 141 8.889 -11.111 1.656 1.00 0.32 H new ATOM 0 HB2 GLN A 141 10.741 -11.534 3.359 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.231 -13.210 3.406 1.00 0.39 H new ATOM 0 HG2 GLN A 141 11.964 -13.306 1.880 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.583 -13.148 0.814 1.00 0.39 H new ATOM 0 HE21 GLN A 141 10.179 -11.146 -0.269 1.00 0.63 H new ATOM 0 HE22 GLN A 141 11.447 -9.923 -0.412 1.00 0.63 H new ATOM 1122 N ILE A 142 7.230 -12.861 0.861 1.00 0.25 N ATOM 1123 CA ILE A 142 6.459 -13.945 0.256 1.00 0.27 C ATOM 1124 C ILE A 142 7.232 -14.606 -0.879 1.00 0.30 C ATOM 1125 O ILE A 142 6.879 -15.690 -1.337 1.00 0.37 O ATOM 1126 CB ILE A 142 5.086 -13.476 -0.269 1.00 0.27 C ATOM 1127 CG1 ILE A 142 5.238 -12.335 -1.283 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.206 -13.048 0.893 1.00 0.29 C ATOM 1129 CD1 ILE A 142 3.944 -11.965 -1.975 1.00 0.26 C ATOM 0 H ILE A 142 7.044 -11.936 0.472 1.00 0.25 H new ATOM 0 HA ILE A 142 6.287 -14.670 1.051 1.00 0.27 H new ATOM 0 HB ILE A 142 4.612 -14.312 -0.783 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.632 -11.456 -0.772 1.00 0.24 H new ATOM 0 HG13 ILE A 142 5.973 -12.623 -2.035 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.238 -12.718 0.514 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.063 -13.890 1.570 1.00 0.29 H new ATOM 0 HG23 ILE A 142 4.684 -12.228 1.429 1.00 0.29 H new ATOM 0 HD11 ILE A 142 4.127 -11.152 -2.678 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.559 -12.831 -2.514 1.00 0.26 H new ATOM 0 HD13 ILE A 142 3.213 -11.646 -1.232 1.00 0.26 H new ATOM 1141 N GLY A 143 8.285 -13.945 -1.324 1.00 0.28 N ATOM 1142 CA GLY A 143 9.141 -14.508 -2.345 1.00 0.34 C ATOM 1143 C GLY A 143 10.526 -13.924 -2.254 1.00 0.40 C ATOM 1144 O GLY A 143 10.722 -12.953 -1.534 1.00 0.53 O ATOM 0 H GLY A 143 8.565 -13.021 -0.994 1.00 0.28 H new ATOM 0 HA2 GLY A 143 9.189 -15.591 -2.231 1.00 0.34 H new ATOM 0 HA3 GLY A 143 8.720 -14.309 -3.331 1.00 0.34 H new ATOM 1148 N ASP A 144 11.474 -14.493 -2.983 1.00 0.48 N ATOM 1149 CA ASP A 144 12.872 -14.059 -2.917 1.00 0.56 C ATOM 1150 C ASP A 144 12.997 -12.558 -3.145 1.00 0.48 C ATOM 1151 O ASP A 144 13.703 -11.868 -2.410 1.00 0.56 O ATOM 1152 CB ASP A 144 13.722 -14.806 -3.949 1.00 0.70 C ATOM 1153 CG ASP A 144 13.822 -16.288 -3.666 1.00 1.63 C ATOM 1154 OD1 ASP A 144 12.896 -17.035 -4.054 1.00 2.49 O ATOM 1155 OD2 ASP A 144 14.826 -16.718 -3.064 1.00 2.30 O ATOM 0 H ASP A 144 11.305 -15.261 -3.632 1.00 0.48 H new ATOM 0 HA ASP A 144 13.237 -14.291 -1.917 1.00 0.56 H new ATOM 0 HB2 ASP A 144 13.294 -14.659 -4.940 1.00 0.70 H new ATOM 0 HB3 ASP A 144 14.724 -14.376 -3.967 1.00 0.70 H new ATOM 1160 N SER A 145 12.307 -12.057 -4.155 1.00 0.38 N ATOM 1161 CA SER A 145 12.326 -10.636 -4.454 1.00 0.35 C ATOM 1162 C SER A 145 10.925 -10.054 -4.366 1.00 0.31 C ATOM 1163 O SER A 145 10.598 -9.080 -5.044 1.00 0.36 O ATOM 1164 CB SER A 145 12.915 -10.403 -5.845 1.00 0.38 C ATOM 1165 OG SER A 145 12.316 -11.254 -6.809 1.00 1.08 O ATOM 0 H SER A 145 11.726 -12.614 -4.782 1.00 0.38 H new ATOM 0 HA SER A 145 12.952 -10.131 -3.718 1.00 0.35 H new ATOM 0 HB2 SER A 145 12.768 -9.362 -6.134 1.00 0.38 H new ATOM 0 HB3 SER A 145 13.991 -10.578 -5.821 1.00 0.38 H new ATOM 0 HG SER A 145 12.711 -11.081 -7.689 1.00 1.08 H new ATOM 1171 N LEU A 146 10.100 -10.643 -3.514 1.00 0.27 N ATOM 1172 CA LEU A 146 8.714 -10.241 -3.428 1.00 0.22 C ATOM 1173 C LEU A 146 8.303 -10.042 -1.975 1.00 0.21 C ATOM 1174 O LEU A 146 8.401 -10.958 -1.153 1.00 0.23 O ATOM 1175 CB LEU A 146 7.836 -11.295 -4.098 1.00 0.23 C ATOM 1176 CG LEU A 146 6.518 -10.781 -4.659 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.772 -9.769 -5.763 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.679 -11.937 -5.176 1.00 0.27 C ATOM 0 H LEU A 146 10.368 -11.395 -2.879 1.00 0.27 H new ATOM 0 HA LEU A 146 8.585 -9.290 -3.945 1.00 0.22 H new ATOM 0 HB2 LEU A 146 8.402 -11.755 -4.908 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.622 -12.080 -3.373 1.00 0.23 H new ATOM 0 HG LEU A 146 5.967 -10.286 -3.859 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.820 -9.411 -6.154 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.339 -8.929 -5.363 1.00 0.26 H new ATOM 0 HD13 LEU A 146 7.339 -10.241 -6.565 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.739 -11.555 -5.574 1.00 0.27 H new ATOM 0 HD22 LEU A 146 6.223 -12.457 -5.965 1.00 0.27 H new ATOM 0 HD23 LEU A 146 5.472 -12.630 -4.360 1.00 0.27 H new ATOM 1190 N TYR A 147 7.859 -8.836 -1.665 1.00 0.18 N ATOM 1191 CA TYR A 147 7.432 -8.483 -0.321 1.00 0.18 C ATOM 1192 C TYR A 147 5.939 -8.202 -0.313 1.00 0.16 C ATOM 1193 O TYR A 147 5.370 -7.855 -1.341 1.00 0.19 O ATOM 1194 CB TYR A 147 8.191 -7.252 0.176 1.00 0.19 C ATOM 1195 CG TYR A 147 9.663 -7.487 0.438 1.00 0.23 C ATOM 1196 CD1 TYR A 147 10.589 -7.421 -0.594 1.00 1.21 C ATOM 1197 CD2 TYR A 147 10.126 -7.767 1.719 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.933 -7.627 -0.360 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.470 -7.975 1.960 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.368 -7.904 0.917 1.00 0.36 C ATOM 1201 OH TYR A 147 13.707 -8.114 1.149 1.00 0.43 O ATOM 0 H TYR A 147 7.784 -8.073 -2.338 1.00 0.18 H new ATOM 0 HA TYR A 147 7.648 -9.319 0.344 1.00 0.18 H new ATOM 0 HB2 TYR A 147 8.089 -6.455 -0.561 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.723 -6.898 1.095 1.00 0.19 H new ATOM 0 HD1 TYR A 147 10.252 -7.205 -1.597 1.00 1.21 H new ATOM 0 HD2 TYR A 147 9.424 -7.823 2.538 1.00 1.10 H new ATOM 0 HE1 TYR A 147 12.640 -7.571 -1.174 1.00 1.24 H new ATOM 0 HE2 TYR A 147 11.815 -8.192 2.960 1.00 1.10 H new ATOM 0 HH TYR A 147 13.869 -9.070 1.288 1.00 0.43 H new ATOM 1211 N LYS A 148 5.305 -8.342 0.837 1.00 0.17 N ATOM 1212 CA LYS A 148 3.860 -8.189 0.912 1.00 0.18 C ATOM 1213 C LYS A 148 3.428 -7.424 2.161 1.00 0.19 C ATOM 1214 O LYS A 148 4.026 -7.560 3.229 1.00 0.28 O ATOM 1215 CB LYS A 148 3.207 -9.568 0.890 1.00 0.26 C ATOM 1216 CG LYS A 148 1.692 -9.549 0.997 1.00 0.34 C ATOM 1217 CD LYS A 148 1.146 -10.959 1.050 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.360 -10.980 1.235 1.00 0.62 C ATOM 1219 NZ LYS A 148 -0.863 -12.360 1.448 1.00 0.84 N ATOM 0 H LYS A 148 5.760 -8.559 1.724 1.00 0.17 H new ATOM 0 HA LYS A 148 3.536 -7.606 0.049 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.487 -10.074 -0.034 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.609 -10.160 1.712 1.00 0.26 H new ATOM 0 HG2 LYS A 148 1.392 -9.003 1.891 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.268 -9.021 0.143 1.00 0.34 H new ATOM 0 HD2 LYS A 148 1.405 -11.483 0.130 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.619 -11.500 1.869 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -0.632 -10.357 2.087 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -0.841 -10.548 0.358 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -1.895 -12.338 1.571 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -0.625 -12.947 0.624 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.422 -12.763 2.299 1.00 0.84 H new ATOM 1233 N ILE A 149 2.387 -6.618 2.004 1.00 0.15 N ATOM 1234 CA ILE A 149 1.772 -5.908 3.114 1.00 0.18 C ATOM 1235 C ILE A 149 0.267 -6.124 3.100 1.00 0.22 C ATOM 1236 O ILE A 149 -0.348 -6.154 2.036 1.00 0.35 O ATOM 1237 CB ILE A 149 2.070 -4.395 3.072 1.00 0.18 C ATOM 1238 CG1 ILE A 149 1.795 -3.818 1.679 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.502 -4.138 3.485 1.00 0.19 C ATOM 1240 CD1 ILE A 149 2.009 -2.324 1.587 1.00 0.20 C ATOM 0 H ILE A 149 1.946 -6.439 1.102 1.00 0.15 H new ATOM 0 HA ILE A 149 2.201 -6.310 4.032 1.00 0.18 H new ATOM 0 HB ILE A 149 1.406 -3.893 3.776 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.442 -4.314 0.956 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.767 -4.047 1.397 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.704 -3.067 3.452 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.660 -4.506 4.499 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.176 -4.655 2.802 1.00 0.19 H new ATOM 0 HD11 ILE A 149 1.795 -1.988 0.572 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.343 -1.817 2.285 1.00 0.20 H new ATOM 0 HD13 ILE A 149 3.043 -2.089 1.837 1.00 0.20 H new ATOM 1252 N GLU A 150 -0.315 -6.293 4.272 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.739 -6.541 4.390 1.00 0.27 C ATOM 1254 C GLU A 150 -2.301 -5.832 5.612 1.00 0.24 C ATOM 1255 O GLU A 150 -1.553 -5.394 6.485 1.00 0.31 O ATOM 1256 CB GLU A 150 -2.023 -8.048 4.473 1.00 0.40 C ATOM 1257 CG GLU A 150 -1.491 -8.726 5.732 1.00 1.08 C ATOM 1258 CD GLU A 150 0.024 -8.767 5.798 1.00 1.55 C ATOM 1259 OE1 GLU A 150 0.632 -9.562 5.057 1.00 2.03 O ATOM 1260 OE2 GLU A 150 0.612 -8.011 6.601 1.00 2.30 O ATOM 0 H GLU A 150 0.181 -6.263 5.163 1.00 0.24 H new ATOM 0 HA GLU A 150 -2.229 -6.147 3.500 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -3.100 -8.205 4.419 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -1.586 -8.535 3.601 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -1.872 -8.200 6.608 1.00 1.08 H new ATOM 0 HG3 GLU A 150 -1.877 -9.744 5.779 1.00 1.08 H new ATOM 1267 N THR A 151 -3.614 -5.703 5.658 1.00 0.21 N ATOM 1268 CA THR A 151 -4.277 -5.084 6.789 1.00 0.23 C ATOM 1269 C THR A 151 -4.514 -6.110 7.893 1.00 0.24 C ATOM 1270 O THR A 151 -4.764 -7.288 7.624 1.00 0.27 O ATOM 1271 CB THR A 151 -5.615 -4.446 6.357 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.527 -5.449 5.895 1.00 0.25 O ATOM 1273 CG2 THR A 151 -5.383 -3.433 5.250 1.00 0.29 C ATOM 0 H THR A 151 -4.244 -6.020 4.921 1.00 0.21 H new ATOM 0 HA THR A 151 -3.629 -4.297 7.175 1.00 0.23 H new ATOM 0 HB THR A 151 -6.045 -3.945 7.224 1.00 0.25 H new ATOM 0 HG1 THR A 151 -7.272 -5.529 6.526 1.00 0.25 H new ATOM 0 HG21 THR A 151 -6.335 -2.991 4.956 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.715 -2.650 5.608 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.932 -3.930 4.391 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.417 -5.658 9.138 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.559 -6.538 10.290 1.00 0.38 C ATOM 1283 C LYS A 152 -6.032 -6.817 10.565 1.00 0.39 C ATOM 1284 O LYS A 152 -6.390 -7.851 11.135 1.00 0.51 O ATOM 1285 CB LYS A 152 -3.892 -5.908 11.518 1.00 0.48 C ATOM 1286 CG LYS A 152 -3.938 -6.774 12.768 1.00 0.80 C ATOM 1287 CD LYS A 152 -3.233 -6.099 13.934 1.00 1.02 C ATOM 1288 CE LYS A 152 -3.328 -6.933 15.202 1.00 1.99 C ATOM 1289 NZ LYS A 152 -4.734 -7.101 15.654 1.00 2.42 N ATOM 0 H LYS A 152 -4.240 -4.682 9.375 1.00 0.31 H new ATOM 0 HA LYS A 152 -4.065 -7.485 10.073 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -2.851 -5.689 11.280 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.377 -4.955 11.732 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -4.975 -6.976 13.035 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -3.468 -7.736 12.564 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -2.185 -5.937 13.682 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -3.675 -5.118 14.109 1.00 1.02 H new ATOM 0 HE2 LYS A 152 -2.884 -7.913 15.025 1.00 1.99 H new ATOM 0 HE3 LYS A 152 -2.747 -6.458 15.993 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 -4.744 -7.462 16.629 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 -5.222 -6.183 15.620 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 -5.221 -7.775 15.030 1.00 2.42 H new ATOM 1303 N LYS A 153 -6.886 -5.896 10.148 1.00 0.37 N ATOM 1304 CA LYS A 153 -8.320 -6.061 10.316 1.00 0.43 C ATOM 1305 C LYS A 153 -9.034 -5.932 8.977 1.00 0.40 C ATOM 1306 O LYS A 153 -8.514 -5.318 8.040 1.00 0.40 O ATOM 1307 CB LYS A 153 -8.873 -5.041 11.324 1.00 0.51 C ATOM 1308 CG LYS A 153 -8.667 -3.577 10.943 1.00 0.57 C ATOM 1309 CD LYS A 153 -9.399 -2.662 11.914 1.00 0.66 C ATOM 1310 CE LYS A 153 -9.206 -1.187 11.586 1.00 0.69 C ATOM 1311 NZ LYS A 153 -7.858 -0.689 11.971 1.00 1.29 N ATOM 0 H LYS A 153 -6.611 -5.027 9.691 1.00 0.37 H new ATOM 0 HA LYS A 153 -8.503 -7.061 10.709 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -9.941 -5.221 11.450 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.403 -5.218 12.291 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -7.603 -3.341 10.945 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -9.029 -3.405 9.930 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -10.463 -2.898 11.898 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -9.045 -2.855 12.927 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -9.355 -1.033 10.517 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -9.967 -0.601 12.101 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -7.863 0.351 11.984 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -7.613 -1.046 12.916 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -7.155 -1.023 11.282 1.00 1.29 H new ATOM 1325 N LYS A 154 -10.212 -6.539 8.888 1.00 0.43 N ATOM 1326 CA LYS A 154 -11.033 -6.449 7.690 1.00 0.44 C ATOM 1327 C LYS A 154 -11.732 -5.100 7.663 1.00 0.53 C ATOM 1328 O LYS A 154 -12.115 -4.571 8.708 1.00 0.67 O ATOM 1329 CB LYS A 154 -12.061 -7.580 7.660 1.00 0.44 C ATOM 1330 CG LYS A 154 -11.445 -8.968 7.622 1.00 0.47 C ATOM 1331 CD LYS A 154 -12.511 -10.047 7.692 1.00 0.54 C ATOM 1332 CE LYS A 154 -11.894 -11.433 7.787 1.00 0.66 C ATOM 1333 NZ LYS A 154 -11.059 -11.589 9.008 1.00 1.41 N ATOM 0 H LYS A 154 -10.620 -7.101 9.635 1.00 0.43 H new ATOM 0 HA LYS A 154 -10.397 -6.545 6.810 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.700 -7.500 8.539 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.702 -7.453 6.787 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -10.865 -9.086 6.707 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -10.752 -9.084 8.456 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -13.151 -9.872 8.557 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -13.147 -9.990 6.808 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -12.685 -12.183 7.791 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -11.283 -11.619 6.904 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -10.910 -12.600 9.200 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -10.140 -11.125 8.862 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -11.543 -11.151 9.818 1.00 1.41 H new ATOM 1347 N MET A 155 -11.900 -4.541 6.479 1.00 0.61 N ATOM 1348 CA MET A 155 -12.377 -3.175 6.363 1.00 0.76 C ATOM 1349 C MET A 155 -13.865 -3.089 6.077 1.00 0.62 C ATOM 1350 O MET A 155 -14.430 -3.892 5.333 1.00 0.57 O ATOM 1351 CB MET A 155 -11.594 -2.434 5.286 1.00 1.01 C ATOM 1352 CG MET A 155 -10.131 -2.276 5.639 1.00 1.22 C ATOM 1353 SD MET A 155 -9.900 -1.485 7.242 1.00 0.95 S ATOM 1354 CE MET A 155 -8.173 -1.844 7.519 1.00 0.80 C ATOM 0 H MET A 155 -11.715 -5.007 5.591 1.00 0.61 H new ATOM 0 HA MET A 155 -12.213 -2.702 7.331 1.00 0.76 H new ATOM 0 HB2 MET A 155 -11.681 -2.973 4.343 1.00 1.01 H new ATOM 0 HB3 MET A 155 -12.036 -1.449 5.132 1.00 1.01 H new ATOM 0 HG2 MET A 155 -9.653 -3.256 5.647 1.00 1.22 H new ATOM 0 HG3 MET A 155 -9.635 -1.685 4.869 1.00 1.22 H new ATOM 0 HE1 MET A 155 -8.038 -2.221 8.533 1.00 0.80 H new ATOM 0 HE2 MET A 155 -7.838 -2.596 6.804 1.00 0.80 H new ATOM 0 HE3 MET A 155 -7.587 -0.934 7.389 1.00 0.80 H new ATOM 1364 N LYS A 156 -14.486 -2.108 6.716 1.00 0.65 N ATOM 1365 CA LYS A 156 -15.859 -1.725 6.433 1.00 0.59 C ATOM 1366 C LYS A 156 -15.893 -0.932 5.126 1.00 0.44 C ATOM 1367 O LYS A 156 -14.842 -0.478 4.671 1.00 0.42 O ATOM 1368 CB LYS A 156 -16.399 -0.889 7.603 1.00 0.72 C ATOM 1369 CG LYS A 156 -15.520 0.300 7.957 1.00 1.28 C ATOM 1370 CD LYS A 156 -15.955 0.947 9.262 1.00 1.79 C ATOM 1371 CE LYS A 156 -15.024 2.081 9.654 1.00 2.54 C ATOM 1372 NZ LYS A 156 -15.362 2.645 10.985 1.00 3.40 N ATOM 0 H LYS A 156 -14.047 -1.552 7.450 1.00 0.65 H new ATOM 0 HA LYS A 156 -16.489 -2.607 6.321 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -17.397 -0.530 7.352 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -16.501 -1.529 8.480 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -14.483 -0.025 8.039 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -15.561 1.036 7.154 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -16.972 1.327 9.161 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -15.972 0.198 10.054 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -13.996 1.719 9.665 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -15.076 2.869 8.903 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -14.702 3.416 11.213 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -16.334 3.015 10.969 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -15.287 1.900 11.707 1.00 3.40 H new ATOM 1386 N PRO A 157 -17.075 -0.766 4.499 1.00 0.46 N ATOM 1387 CA PRO A 157 -17.214 -0.046 3.226 1.00 0.41 C ATOM 1388 C PRO A 157 -16.447 1.273 3.195 1.00 0.37 C ATOM 1389 O PRO A 157 -16.474 2.045 4.157 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.724 0.224 3.115 1.00 0.52 C ATOM 1391 CG PRO A 157 -19.323 -0.248 4.400 1.00 0.63 C ATOM 1392 CD PRO A 157 -18.373 -1.266 4.955 1.00 0.63 C ATOM 0 HA PRO A 157 -16.805 -0.631 2.402 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.920 1.285 2.960 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -19.154 -0.307 2.266 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -19.455 0.581 5.095 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -20.308 -0.685 4.233 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -18.428 -1.322 6.042 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -18.580 -2.266 4.573 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.754 1.517 2.095 1.00 0.32 N ATOM 1401 CA GLY A 158 -15.015 2.749 1.937 1.00 0.33 C ATOM 1402 C GLY A 158 -13.978 2.649 0.841 1.00 0.27 C ATOM 1403 O GLY A 158 -13.848 1.603 0.201 1.00 0.27 O ATOM 0 H GLY A 158 -15.690 0.878 1.303 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.706 3.560 1.709 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.526 3.002 2.878 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.236 3.723 0.628 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.193 3.738 -0.383 1.00 0.26 C ATOM 1409 C ILE A 159 -10.837 3.622 0.290 1.00 0.21 C ATOM 1410 O ILE A 159 -10.505 4.419 1.165 1.00 0.24 O ATOM 1411 CB ILE A 159 -12.230 5.030 -1.228 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.646 5.275 -1.764 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -11.227 4.943 -2.371 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.782 6.549 -2.568 1.00 0.44 C ATOM 0 H ILE A 159 -13.337 4.597 1.143 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.363 2.893 -1.050 1.00 0.26 H new ATOM 0 HB ILE A 159 -11.954 5.872 -0.594 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.940 4.430 -2.387 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.341 5.310 -0.925 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -11.264 5.861 -2.958 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -10.224 4.812 -1.966 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -11.474 4.094 -3.008 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.811 6.653 -2.913 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.520 7.403 -1.943 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -13.113 6.510 -3.428 1.00 0.44 H new ATOM 1426 N TYR A 160 -10.063 2.626 -0.098 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.786 2.379 0.547 1.00 0.17 C ATOM 1428 C TYR A 160 -7.667 2.291 -0.476 1.00 0.16 C ATOM 1429 O TYR A 160 -7.891 1.909 -1.623 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.835 1.086 1.367 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.893 1.084 2.454 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -9.603 1.523 3.742 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -11.183 0.644 2.189 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -10.570 1.520 4.729 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -12.153 0.640 3.172 1.00 1.24 C ATOM 1436 CZ TYR A 160 -11.842 1.078 4.438 1.00 0.35 C ATOM 1437 OH TYR A 160 -12.812 1.081 5.416 1.00 0.43 O ATOM 0 H TYR A 160 -10.293 1.978 -0.852 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.586 3.217 1.214 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -9.018 0.248 0.694 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.859 0.920 1.824 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -8.607 1.871 3.974 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -11.432 0.299 1.196 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -10.330 1.863 5.725 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -13.151 0.294 2.948 1.00 1.24 H new ATOM 0 HH TYR A 160 -13.550 0.495 5.146 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.473 2.664 -0.054 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.283 2.539 -0.875 1.00 0.14 C ATOM 1449 C ALA A 161 -4.056 2.461 0.013 1.00 0.14 C ATOM 1450 O ALA A 161 -4.069 2.950 1.145 1.00 0.14 O ATOM 1451 CB ALA A 161 -5.160 3.712 -1.835 1.00 0.14 C ATOM 0 H ALA A 161 -6.301 3.063 0.869 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.362 1.625 -1.464 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.260 3.595 -2.439 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -6.033 3.742 -2.487 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -5.098 4.641 -1.268 1.00 0.14 H new ATOM 1457 N PHE A 162 -3.003 1.851 -0.496 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.765 1.719 0.255 1.00 0.15 C ATOM 1459 C PHE A 162 -0.776 2.792 -0.164 1.00 0.15 C ATOM 1460 O PHE A 162 -0.451 2.922 -1.343 1.00 0.15 O ATOM 1461 CB PHE A 162 -1.135 0.338 0.048 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.903 -0.790 0.682 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -1.669 -1.146 2.002 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -2.850 -1.501 -0.039 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -2.362 -2.185 2.589 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -3.548 -2.540 0.544 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.304 -2.884 1.859 1.00 0.24 C ATOM 0 H PHE A 162 -2.978 1.438 -1.428 1.00 0.14 H new ATOM 0 HA PHE A 162 -2.006 1.837 1.312 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -1.047 0.147 -1.022 1.00 0.17 H new ATOM 0 HB3 PHE A 162 -0.123 0.348 0.454 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -0.935 -0.603 2.578 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -3.044 -1.239 -1.069 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -2.168 -2.451 3.618 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -4.285 -3.084 -0.029 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.848 -3.697 2.316 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.317 3.566 0.802 1.00 0.16 N ATOM 1478 CA LYS A 163 0.698 4.570 0.552 1.00 0.18 C ATOM 1479 C LYS A 163 2.019 4.088 1.117 1.00 0.20 C ATOM 1480 O LYS A 163 2.268 4.212 2.318 1.00 0.23 O ATOM 1481 CB LYS A 163 0.336 5.908 1.206 1.00 0.23 C ATOM 1482 CG LYS A 163 1.173 7.079 0.696 1.00 0.31 C ATOM 1483 CD LYS A 163 1.160 8.252 1.668 1.00 0.45 C ATOM 1484 CE LYS A 163 2.128 8.025 2.819 1.00 0.74 C ATOM 1485 NZ LYS A 163 2.128 9.152 3.791 1.00 1.28 N ATOM 0 H LYS A 163 -0.633 3.517 1.771 1.00 0.16 H new ATOM 0 HA LYS A 163 0.770 4.723 -0.525 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.718 6.119 1.025 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.464 5.823 2.285 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.200 6.750 0.538 1.00 0.31 H new ATOM 0 HG3 LYS A 163 0.790 7.405 -0.271 1.00 0.31 H new ATOM 0 HD2 LYS A 163 1.427 9.168 1.140 1.00 0.45 H new ATOM 0 HD3 LYS A 163 0.152 8.392 2.059 1.00 0.45 H new ATOM 0 HE2 LYS A 163 1.863 7.103 3.336 1.00 0.74 H new ATOM 0 HE3 LYS A 163 3.134 7.891 2.423 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 3.085 9.276 4.178 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 1.833 10.025 3.310 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 1.466 8.943 4.565 1.00 1.28 H new ATOM 1499 N VAL A 164 2.851 3.523 0.269 1.00 0.22 N ATOM 1500 CA VAL A 164 4.163 3.088 0.695 1.00 0.26 C ATOM 1501 C VAL A 164 5.164 4.163 0.328 1.00 0.33 C ATOM 1502 O VAL A 164 5.014 4.827 -0.698 1.00 0.34 O ATOM 1503 CB VAL A 164 4.571 1.729 0.065 1.00 0.28 C ATOM 1504 CG1 VAL A 164 3.449 0.711 0.209 1.00 0.27 C ATOM 1505 CG2 VAL A 164 4.976 1.882 -1.395 1.00 0.29 C ATOM 0 H VAL A 164 2.643 3.355 -0.715 1.00 0.22 H new ATOM 0 HA VAL A 164 4.144 2.933 1.774 1.00 0.26 H new ATOM 0 HB VAL A 164 5.442 1.365 0.609 1.00 0.28 H new ATOM 0 HG11 VAL A 164 3.756 -0.234 -0.239 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.230 0.558 1.266 1.00 0.27 H new ATOM 0 HG13 VAL A 164 2.556 1.079 -0.296 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.254 0.909 -1.799 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.139 2.285 -1.964 1.00 0.29 H new ATOM 0 HG23 VAL A 164 5.825 2.561 -1.468 1.00 0.29 H new ATOM 1515 N TYR A 165 6.147 4.387 1.173 1.00 0.45 N ATOM 1516 CA TYR A 165 7.165 5.358 0.851 1.00 0.57 C ATOM 1517 C TYR A 165 8.507 4.938 1.408 1.00 0.70 C ATOM 1518 O TYR A 165 8.620 3.892 2.051 1.00 1.67 O ATOM 1519 CB TYR A 165 6.770 6.771 1.310 1.00 0.62 C ATOM 1520 CG TYR A 165 6.572 6.952 2.800 1.00 0.63 C ATOM 1521 CD1 TYR A 165 5.368 6.621 3.412 1.00 1.30 C ATOM 1522 CD2 TYR A 165 7.579 7.496 3.584 1.00 1.38 C ATOM 1523 CE1 TYR A 165 5.177 6.828 4.766 1.00 1.31 C ATOM 1524 CE2 TYR A 165 7.398 7.699 4.936 1.00 1.45 C ATOM 1525 CZ TYR A 165 6.197 7.368 5.521 1.00 0.79 C ATOM 1526 OH TYR A 165 6.014 7.585 6.869 1.00 0.93 O ATOM 0 H TYR A 165 6.261 3.919 2.072 1.00 0.45 H new ATOM 0 HA TYR A 165 7.257 5.396 -0.234 1.00 0.57 H new ATOM 0 HB2 TYR A 165 7.540 7.468 0.978 1.00 0.62 H new ATOM 0 HB3 TYR A 165 5.846 7.051 0.804 1.00 0.62 H new ATOM 0 HD1 TYR A 165 4.570 6.196 2.821 1.00 1.30 H new ATOM 0 HD2 TYR A 165 8.520 7.765 3.128 1.00 1.38 H new ATOM 0 HE1 TYR A 165 4.236 6.569 5.229 1.00 1.31 H new ATOM 0 HE2 TYR A 165 8.195 8.116 5.533 1.00 1.45 H new ATOM 0 HH TYR A 165 6.830 7.969 7.252 1.00 0.93 H new ATOM 1536 N LYS A 166 9.511 5.754 1.150 1.00 0.48 N ATOM 1537 CA LYS A 166 10.889 5.405 1.448 1.00 0.49 C ATOM 1538 C LYS A 166 11.076 5.066 2.932 1.00 0.46 C ATOM 1539 O LYS A 166 10.372 5.603 3.793 1.00 0.55 O ATOM 1540 CB LYS A 166 11.806 6.552 1.001 1.00 0.57 C ATOM 1541 CG LYS A 166 11.590 6.953 -0.456 1.00 0.71 C ATOM 1542 CD LYS A 166 11.664 5.753 -1.392 1.00 0.94 C ATOM 1543 CE LYS A 166 11.224 6.108 -2.804 1.00 1.35 C ATOM 1544 NZ LYS A 166 12.175 7.029 -3.478 1.00 1.53 N ATOM 0 H LYS A 166 9.396 6.676 0.729 1.00 0.48 H new ATOM 0 HA LYS A 166 11.158 4.505 0.895 1.00 0.49 H new ATOM 0 HB2 LYS A 166 11.634 7.418 1.640 1.00 0.57 H new ATOM 0 HB3 LYS A 166 12.845 6.255 1.140 1.00 0.57 H new ATOM 0 HG2 LYS A 166 10.618 7.435 -0.560 1.00 0.71 H new ATOM 0 HG3 LYS A 166 12.342 7.687 -0.746 1.00 0.71 H new ATOM 0 HD2 LYS A 166 12.685 5.373 -1.415 1.00 0.94 H new ATOM 0 HD3 LYS A 166 11.034 4.952 -1.006 1.00 0.94 H new ATOM 0 HE2 LYS A 166 11.128 5.195 -3.392 1.00 1.35 H new ATOM 0 HE3 LYS A 166 10.238 6.570 -2.769 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 11.662 7.865 -3.824 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 12.907 7.327 -2.802 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 12.622 6.540 -4.280 1.00 1.53 H new ATOM 1558 N PRO A 167 12.033 4.159 3.233 1.00 0.44 N ATOM 1559 CA PRO A 167 12.235 3.588 4.576 1.00 0.47 C ATOM 1560 C PRO A 167 12.172 4.616 5.695 1.00 0.47 C ATOM 1561 O PRO A 167 12.675 5.731 5.558 1.00 0.50 O ATOM 1562 CB PRO A 167 13.641 3.001 4.486 1.00 0.58 C ATOM 1563 CG PRO A 167 13.780 2.602 3.063 1.00 0.60 C ATOM 1564 CD PRO A 167 13.022 3.630 2.272 1.00 0.49 C ATOM 0 HA PRO A 167 11.452 2.872 4.824 1.00 0.47 H new ATOM 0 HB2 PRO A 167 14.397 3.733 4.770 1.00 0.58 H new ATOM 0 HB3 PRO A 167 13.759 2.147 5.152 1.00 0.58 H new ATOM 0 HG2 PRO A 167 14.828 2.575 2.765 1.00 0.60 H new ATOM 0 HG3 PRO A 167 13.375 1.604 2.896 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.681 4.416 1.903 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.537 3.187 1.402 1.00 0.49 H new ATOM 1572 N ALA A 168 11.550 4.220 6.803 1.00 0.53 N ATOM 1573 CA ALA A 168 11.404 5.092 7.959 1.00 0.64 C ATOM 1574 C ALA A 168 12.760 5.626 8.401 1.00 0.71 C ATOM 1575 O ALA A 168 13.698 4.859 8.627 1.00 0.76 O ATOM 1576 CB ALA A 168 10.721 4.355 9.097 1.00 0.72 C ATOM 0 H ALA A 168 11.138 3.295 6.922 1.00 0.53 H new ATOM 0 HA ALA A 168 10.780 5.939 7.676 1.00 0.64 H new ATOM 0 HB1 ALA A 168 10.620 5.022 9.953 1.00 0.72 H new ATOM 0 HB2 ALA A 168 9.733 4.025 8.776 1.00 0.72 H new ATOM 0 HB3 ALA A 168 11.319 3.489 9.380 1.00 0.72 H new ATOM 1582 N GLY A 169 12.856 6.940 8.516 1.00 0.82 N ATOM 1583 CA GLY A 169 14.129 7.574 8.779 1.00 0.95 C ATOM 1584 C GLY A 169 14.590 8.382 7.584 1.00 0.96 C ATOM 1585 O GLY A 169 15.284 9.390 7.732 1.00 1.14 O ATOM 0 H GLY A 169 12.069 7.583 8.431 1.00 0.82 H new ATOM 0 HA2 GLY A 169 14.043 8.223 9.650 1.00 0.95 H new ATOM 0 HA3 GLY A 169 14.874 6.816 9.019 1.00 0.95 H new ATOM 1589 N TYR A 170 14.191 7.943 6.396 1.00 0.80 N ATOM 1590 CA TYR A 170 14.508 8.652 5.165 1.00 0.82 C ATOM 1591 C TYR A 170 13.568 9.849 5.023 1.00 0.86 C ATOM 1592 O TYR A 170 12.346 9.680 5.030 1.00 0.89 O ATOM 1593 CB TYR A 170 14.348 7.706 3.967 1.00 0.83 C ATOM 1594 CG TYR A 170 15.034 8.164 2.693 1.00 0.91 C ATOM 1595 CD1 TYR A 170 14.482 9.159 1.889 1.00 1.15 C ATOM 1596 CD2 TYR A 170 16.229 7.580 2.282 1.00 1.74 C ATOM 1597 CE1 TYR A 170 15.104 9.556 0.719 1.00 1.21 C ATOM 1598 CE2 TYR A 170 16.855 7.977 1.116 1.00 1.82 C ATOM 1599 CZ TYR A 170 16.289 8.962 0.338 1.00 1.11 C ATOM 1600 OH TYR A 170 16.910 9.354 -0.827 1.00 1.24 O ATOM 0 H TYR A 170 13.644 7.093 6.260 1.00 0.80 H new ATOM 0 HA TYR A 170 15.539 9.005 5.195 1.00 0.82 H new ATOM 0 HB2 TYR A 170 14.740 6.727 4.241 1.00 0.83 H new ATOM 0 HB3 TYR A 170 13.285 7.578 3.764 1.00 0.83 H new ATOM 0 HD1 TYR A 170 13.555 9.627 2.184 1.00 1.15 H new ATOM 0 HD2 TYR A 170 16.675 6.803 2.885 1.00 1.74 H new ATOM 0 HE1 TYR A 170 14.663 10.328 0.106 1.00 1.21 H new ATOM 0 HE2 TYR A 170 17.785 7.516 0.816 1.00 1.82 H new ATOM 0 HH TYR A 170 17.734 8.838 -0.948 1.00 1.24 H new ATOM 1610 N PRO A 171 14.111 11.074 4.928 1.00 0.97 N ATOM 1611 CA PRO A 171 13.293 12.288 4.822 1.00 1.10 C ATOM 1612 C PRO A 171 12.486 12.332 3.526 1.00 1.07 C ATOM 1613 O PRO A 171 13.041 12.222 2.432 1.00 1.05 O ATOM 1614 CB PRO A 171 14.321 13.427 4.857 1.00 1.25 C ATOM 1615 CG PRO A 171 15.604 12.802 4.434 1.00 1.31 C ATOM 1616 CD PRO A 171 15.554 11.379 4.918 1.00 1.07 C ATOM 0 HA PRO A 171 12.553 12.347 5.620 1.00 1.10 H new ATOM 0 HB2 PRO A 171 14.036 14.236 4.185 1.00 1.25 H new ATOM 0 HB3 PRO A 171 14.401 13.855 5.856 1.00 1.25 H new ATOM 0 HG2 PRO A 171 15.718 12.841 3.351 1.00 1.31 H new ATOM 0 HG3 PRO A 171 16.455 13.330 4.864 1.00 1.31 H new ATOM 0 HD2 PRO A 171 16.102 10.709 4.255 1.00 1.07 H new ATOM 0 HD3 PRO A 171 15.994 11.276 5.910 1.00 1.07 H new ATOM 1624 N ALA A 172 11.175 12.485 3.653 1.00 1.22 N ATOM 1625 CA ALA A 172 10.303 12.566 2.492 1.00 1.31 C ATOM 1626 C ALA A 172 10.219 14.005 1.998 1.00 1.40 C ATOM 1627 O ALA A 172 10.071 14.933 2.794 1.00 1.67 O ATOM 1628 CB ALA A 172 8.919 12.028 2.829 1.00 1.60 C ATOM 0 H ALA A 172 10.693 12.555 4.549 1.00 1.22 H new ATOM 0 HA ALA A 172 10.721 11.952 1.694 1.00 1.31 H new ATOM 0 HB1 ALA A 172 8.278 12.096 1.950 1.00 1.60 H new ATOM 0 HB2 ALA A 172 8.999 10.986 3.140 1.00 1.60 H new ATOM 0 HB3 ALA A 172 8.487 12.616 3.639 1.00 1.60 H new ATOM 1634 N ASN A 173 10.323 14.198 0.690 1.00 1.38 N ATOM 1635 CA ASN A 173 10.315 15.546 0.125 1.00 1.53 C ATOM 1636 C ASN A 173 9.075 15.805 -0.721 1.00 1.91 C ATOM 1637 O ASN A 173 8.962 16.850 -1.358 1.00 2.60 O ATOM 1638 CB ASN A 173 11.578 15.809 -0.702 1.00 1.89 C ATOM 1639 CG ASN A 173 12.698 16.422 0.120 1.00 2.51 C ATOM 1640 OD1 ASN A 173 12.782 17.643 0.258 1.00 2.97 O ATOM 1641 ND2 ASN A 173 13.574 15.586 0.656 1.00 3.18 N ATOM 0 H ASN A 173 10.413 13.449 0.004 1.00 1.38 H new ATOM 0 HA ASN A 173 10.296 16.237 0.968 1.00 1.53 H new ATOM 0 HB2 ASN A 173 11.924 14.872 -1.138 1.00 1.89 H new ATOM 0 HB3 ASN A 173 11.334 16.475 -1.530 1.00 1.89 H new ATOM 0 HD21 ASN A 173 14.353 15.947 1.206 1.00 3.18 H new ATOM 0 HD22 ASN A 173 13.470 14.581 0.519 1.00 3.18 H new ATOM 1648 N GLY A 174 8.140 14.864 -0.721 1.00 2.02 N ATOM 1649 CA GLY A 174 6.891 15.077 -1.431 1.00 2.69 C ATOM 1650 C GLY A 174 6.709 14.159 -2.622 1.00 2.26 C ATOM 1651 O GLY A 174 5.582 13.888 -3.030 1.00 2.93 O ATOM 0 H GLY A 174 8.221 13.964 -0.247 1.00 2.02 H new ATOM 0 HA2 GLY A 174 6.060 14.932 -0.740 1.00 2.69 H new ATOM 0 HA3 GLY A 174 6.847 16.112 -1.770 1.00 2.69 H new ATOM 1655 N SER A 175 7.806 13.681 -3.189 1.00 1.44 N ATOM 1656 CA SER A 175 7.739 12.762 -4.317 1.00 1.23 C ATOM 1657 C SER A 175 8.437 11.456 -3.950 1.00 0.94 C ATOM 1658 O SER A 175 9.045 10.789 -4.789 1.00 1.36 O ATOM 1659 CB SER A 175 8.382 13.395 -5.558 1.00 1.79 C ATOM 1660 OG SER A 175 8.128 12.631 -6.726 1.00 2.26 O ATOM 0 H SER A 175 8.752 13.913 -2.888 1.00 1.44 H new ATOM 0 HA SER A 175 6.696 12.550 -4.550 1.00 1.23 H new ATOM 0 HB2 SER A 175 7.996 14.406 -5.693 1.00 1.79 H new ATOM 0 HB3 SER A 175 9.458 13.482 -5.406 1.00 1.79 H new ATOM 0 HG SER A 175 8.410 11.704 -6.579 1.00 2.26 H new ATOM 1666 N THR A 176 8.338 11.097 -2.681 1.00 0.64 N ATOM 1667 CA THR A 176 9.008 9.917 -2.168 1.00 0.90 C ATOM 1668 C THR A 176 8.016 8.812 -1.803 1.00 0.80 C ATOM 1669 O THR A 176 8.390 7.824 -1.170 1.00 1.05 O ATOM 1670 CB THR A 176 9.870 10.273 -0.942 1.00 1.30 C ATOM 1671 OG1 THR A 176 9.383 11.481 -0.338 1.00 1.49 O ATOM 1672 CG2 THR A 176 11.328 10.455 -1.334 1.00 1.76 C ATOM 0 H THR A 176 7.797 11.610 -1.985 1.00 0.64 H new ATOM 0 HA THR A 176 9.652 9.541 -2.963 1.00 0.90 H new ATOM 0 HB THR A 176 9.802 9.451 -0.229 1.00 1.30 H new ATOM 0 HG1 THR A 176 8.448 11.359 -0.070 1.00 1.49 H new ATOM 0 HG21 THR A 176 11.914 10.706 -0.450 1.00 1.76 H new ATOM 0 HG22 THR A 176 11.706 9.530 -1.769 1.00 1.76 H new ATOM 0 HG23 THR A 176 11.411 11.260 -2.064 1.00 1.76 H new ATOM 1680 N PHE A 177 6.757 8.981 -2.205 1.00 0.52 N ATOM 1681 CA PHE A 177 5.722 7.996 -1.898 1.00 0.45 C ATOM 1682 C PHE A 177 5.229 7.293 -3.162 1.00 0.41 C ATOM 1683 O PHE A 177 5.453 7.769 -4.277 1.00 0.50 O ATOM 1684 CB PHE A 177 4.534 8.650 -1.157 1.00 0.49 C ATOM 1685 CG PHE A 177 3.890 9.817 -1.876 1.00 0.55 C ATOM 1686 CD1 PHE A 177 3.343 9.672 -3.145 1.00 1.37 C ATOM 1687 CD2 PHE A 177 3.815 11.060 -1.268 1.00 1.31 C ATOM 1688 CE1 PHE A 177 2.746 10.736 -3.788 1.00 1.46 C ATOM 1689 CE2 PHE A 177 3.220 12.128 -1.909 1.00 1.38 C ATOM 1690 CZ PHE A 177 2.685 11.967 -3.170 1.00 0.86 C ATOM 0 H PHE A 177 6.431 9.785 -2.741 1.00 0.52 H new ATOM 0 HA PHE A 177 6.171 7.249 -1.244 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.774 7.889 -0.979 1.00 0.49 H new ATOM 0 HB3 PHE A 177 4.878 8.991 -0.181 1.00 0.49 H new ATOM 0 HD1 PHE A 177 3.386 8.711 -3.636 1.00 1.37 H new ATOM 0 HD2 PHE A 177 4.228 11.195 -0.279 1.00 1.31 H new ATOM 0 HE1 PHE A 177 2.327 10.605 -4.775 1.00 1.46 H new ATOM 0 HE2 PHE A 177 3.173 13.091 -1.422 1.00 1.38 H new ATOM 0 HZ PHE A 177 2.220 12.803 -3.672 1.00 0.86 H new ATOM 1700 N GLU A 178 4.559 6.163 -2.979 1.00 0.34 N ATOM 1701 CA GLU A 178 3.936 5.446 -4.076 1.00 0.32 C ATOM 1702 C GLU A 178 2.577 4.910 -3.635 1.00 0.28 C ATOM 1703 O GLU A 178 2.477 4.197 -2.635 1.00 0.28 O ATOM 1704 CB GLU A 178 4.829 4.296 -4.538 1.00 0.37 C ATOM 1705 CG GLU A 178 4.304 3.582 -5.771 1.00 0.40 C ATOM 1706 CD GLU A 178 5.218 2.470 -6.232 1.00 1.20 C ATOM 1707 OE1 GLU A 178 6.430 2.720 -6.392 1.00 1.91 O ATOM 1708 OE2 GLU A 178 4.723 1.348 -6.457 1.00 1.96 O ATOM 0 H GLU A 178 4.434 5.721 -2.068 1.00 0.34 H new ATOM 0 HA GLU A 178 3.797 6.132 -4.911 1.00 0.32 H new ATOM 0 HB2 GLU A 178 5.826 4.682 -4.748 1.00 0.37 H new ATOM 0 HB3 GLU A 178 4.931 3.576 -3.726 1.00 0.37 H new ATOM 0 HG2 GLU A 178 3.318 3.171 -5.556 1.00 0.40 H new ATOM 0 HG3 GLU A 178 4.179 4.303 -6.579 1.00 0.40 H new ATOM 1715 N TRP A 179 1.533 5.270 -4.367 1.00 0.28 N ATOM 1716 CA TRP A 179 0.186 4.831 -4.034 1.00 0.26 C ATOM 1717 C TRP A 179 -0.187 3.549 -4.767 1.00 0.27 C ATOM 1718 O TRP A 179 0.278 3.290 -5.879 1.00 0.38 O ATOM 1719 CB TRP A 179 -0.846 5.905 -4.391 1.00 0.27 C ATOM 1720 CG TRP A 179 -0.836 7.109 -3.501 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -0.233 8.307 -3.747 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.480 7.241 -2.226 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -0.472 9.176 -2.714 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.228 8.546 -1.767 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.248 6.385 -1.431 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -1.713 9.019 -0.553 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -2.727 6.855 -0.224 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.459 8.162 0.204 1.00 0.24 C ATOM 0 H TRP A 179 1.592 5.864 -5.194 1.00 0.28 H new ATOM 0 HA TRP A 179 0.178 4.647 -2.960 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -0.672 6.228 -5.417 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -1.840 5.458 -4.362 1.00 0.27 H new ATOM 0 HD1 TRP A 179 0.348 8.538 -4.628 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -0.139 10.139 -2.661 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.462 5.377 -1.754 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -1.507 10.026 -0.221 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.319 6.203 0.401 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -2.851 8.499 1.153 1.00 0.24 H new ATOM 1739 N SER A 180 -1.015 2.750 -4.118 1.00 0.23 N ATOM 1740 CA SER A 180 -1.710 1.653 -4.767 1.00 0.28 C ATOM 1741 C SER A 180 -3.012 2.211 -5.339 1.00 0.28 C ATOM 1742 O SER A 180 -3.482 3.256 -4.880 1.00 0.36 O ATOM 1743 CB SER A 180 -1.996 0.544 -3.745 1.00 0.33 C ATOM 1744 OG SER A 180 -2.558 -0.608 -4.344 1.00 1.06 O ATOM 0 H SER A 180 -1.225 2.844 -3.124 1.00 0.23 H new ATOM 0 HA SER A 180 -1.105 1.222 -5.565 1.00 0.28 H new ATOM 0 HB2 SER A 180 -1.070 0.272 -3.239 1.00 0.33 H new ATOM 0 HB3 SER A 180 -2.677 0.923 -2.982 1.00 0.33 H new ATOM 0 HG SER A 180 -2.518 -0.522 -5.319 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.584 1.553 -6.338 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.822 2.044 -6.933 1.00 0.38 C ATOM 1752 C GLU A 181 -5.968 1.897 -5.945 1.00 0.34 C ATOM 1753 O GLU A 181 -6.157 0.833 -5.361 1.00 0.49 O ATOM 1754 CB GLU A 181 -5.149 1.317 -8.237 1.00 0.56 C ATOM 1755 CG GLU A 181 -4.126 1.553 -9.338 1.00 0.74 C ATOM 1756 CD GLU A 181 -4.612 1.081 -10.689 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -4.540 -0.135 -10.961 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -5.077 1.927 -11.486 1.00 1.91 O ATOM 0 H GLU A 181 -3.220 0.693 -6.748 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.684 3.099 -7.170 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -5.218 0.247 -8.040 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -6.129 1.640 -8.588 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -3.892 2.616 -9.391 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -3.200 1.035 -9.087 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.747 2.969 -5.757 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.771 3.029 -4.713 1.00 0.26 C ATOM 1767 C PRO A 182 -8.938 2.084 -4.976 1.00 0.28 C ATOM 1768 O PRO A 182 -9.709 2.271 -5.919 1.00 0.32 O ATOM 1769 CB PRO A 182 -8.240 4.487 -4.756 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.930 4.950 -6.140 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.704 4.195 -6.569 1.00 0.39 C ATOM 0 HA PRO A 182 -7.377 2.721 -3.745 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.306 4.565 -4.543 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -7.721 5.091 -4.012 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -8.764 4.752 -6.813 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -7.752 6.025 -6.160 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -6.725 3.970 -7.635 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.795 4.767 -6.382 1.00 0.39 H new ATOM 1779 N MET A 183 -9.066 1.079 -4.126 1.00 0.28 N ATOM 1780 CA MET A 183 -10.158 0.127 -4.222 1.00 0.30 C ATOM 1781 C MET A 183 -11.303 0.556 -3.322 1.00 0.26 C ATOM 1782 O MET A 183 -11.084 1.139 -2.257 1.00 0.25 O ATOM 1783 CB MET A 183 -9.701 -1.295 -3.860 1.00 0.34 C ATOM 1784 CG MET A 183 -8.823 -1.392 -2.618 1.00 0.29 C ATOM 1785 SD MET A 183 -7.118 -0.892 -2.939 1.00 0.31 S ATOM 1786 CE MET A 183 -6.384 -1.072 -1.319 1.00 0.27 C ATOM 0 H MET A 183 -8.421 0.901 -3.356 1.00 0.28 H new ATOM 0 HA MET A 183 -10.500 0.112 -5.257 1.00 0.30 H new ATOM 0 HB2 MET A 183 -10.583 -1.918 -3.712 1.00 0.34 H new ATOM 0 HB3 MET A 183 -9.155 -1.712 -4.706 1.00 0.34 H new ATOM 0 HG2 MET A 183 -9.241 -0.764 -1.831 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.834 -2.417 -2.248 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.386 -0.633 -1.321 1.00 0.27 H new ATOM 0 HE2 MET A 183 -7.003 -0.563 -0.580 1.00 0.27 H new ATOM 0 HE3 MET A 183 -6.314 -2.130 -1.067 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.520 0.273 -3.752 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.697 0.685 -3.011 1.00 0.29 C ATOM 1798 C ARG A 184 -14.442 -0.539 -2.516 1.00 0.31 C ATOM 1799 O ARG A 184 -15.090 -1.241 -3.293 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.621 1.540 -3.882 1.00 0.35 C ATOM 1801 CG ARG A 184 -13.910 2.667 -4.617 1.00 1.17 C ATOM 1802 CD ARG A 184 -14.882 3.492 -5.448 1.00 1.16 C ATOM 1803 NE ARG A 184 -15.620 2.671 -6.407 1.00 1.88 N ATOM 1804 CZ ARG A 184 -15.706 2.934 -7.710 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -15.080 3.979 -8.234 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -16.425 2.144 -8.492 1.00 3.32 N ATOM 0 H ARG A 184 -12.718 -0.241 -4.611 1.00 0.28 H new ATOM 0 HA ARG A 184 -13.377 1.287 -2.160 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -15.113 0.897 -4.612 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -15.404 1.966 -3.254 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -13.407 3.312 -3.897 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -13.139 2.251 -5.265 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -15.586 3.997 -4.786 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -14.334 4.268 -5.982 1.00 1.16 H new ATOM 0 HE ARG A 184 -16.100 1.843 -6.055 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -14.525 4.592 -7.638 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -15.154 4.169 -9.233 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -16.910 1.339 -8.096 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -16.494 2.341 -9.490 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.342 -0.796 -1.228 1.00 0.28 N ATOM 1821 CA LEU A 185 -14.986 -1.954 -0.647 1.00 0.32 C ATOM 1822 C LEU A 185 -16.361 -1.580 -0.141 1.00 0.36 C ATOM 1823 O LEU A 185 -16.589 -0.453 0.299 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.159 -2.541 0.498 1.00 0.36 C ATOM 1825 CG LEU A 185 -12.723 -2.928 0.143 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.095 -3.710 1.280 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.675 -3.735 -1.145 1.00 0.74 C ATOM 0 H LEU A 185 -13.822 -0.220 -0.566 1.00 0.28 H new ATOM 0 HA LEU A 185 -15.073 -2.712 -1.425 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.131 -1.816 1.311 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -14.672 -3.425 0.877 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.153 -2.012 -0.013 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -11.073 -3.980 1.015 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.087 -3.098 2.182 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -12.674 -4.616 1.462 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.641 -3.996 -1.372 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -13.262 -4.646 -1.026 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -13.088 -3.142 -1.961 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.273 -2.517 -0.233 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.613 -2.327 0.269 1.00 0.77 C ATOM 1841 C ALA A 186 -19.033 -3.530 1.103 1.00 1.02 C ATOM 1842 O ALA A 186 -18.357 -4.558 1.097 1.00 1.53 O ATOM 1843 CB ALA A 186 -19.572 -2.106 -0.888 1.00 1.00 C ATOM 0 H ALA A 186 -17.109 -3.430 -0.657 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.637 -1.444 0.908 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -20.581 -1.963 -0.502 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -19.269 -1.221 -1.448 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -19.555 -2.975 -1.546 1.00 1.00 H new ATOM 1849 N LYS A 187 -20.128 -3.398 1.831 1.00 0.89 N ATOM 1850 CA LYS A 187 -20.673 -4.508 2.595 1.00 1.11 C ATOM 1851 C LYS A 187 -22.173 -4.600 2.388 1.00 1.49 C ATOM 1852 O LYS A 187 -22.954 -3.934 3.071 1.00 1.61 O ATOM 1853 CB LYS A 187 -20.353 -4.377 4.085 1.00 1.11 C ATOM 1854 CG LYS A 187 -18.951 -4.829 4.457 1.00 1.17 C ATOM 1855 CD LYS A 187 -18.731 -4.739 5.956 1.00 1.45 C ATOM 1856 CE LYS A 187 -17.340 -5.201 6.357 1.00 1.82 C ATOM 1857 NZ LYS A 187 -17.123 -5.098 7.825 1.00 2.78 N ATOM 0 H LYS A 187 -20.659 -2.531 1.910 1.00 0.89 H new ATOM 0 HA LYS A 187 -20.204 -5.423 2.233 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -20.479 -3.336 4.383 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -21.075 -4.962 4.654 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -18.795 -5.855 4.124 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -18.217 -4.211 3.940 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -18.879 -3.710 6.283 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -19.477 -5.347 6.469 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -17.195 -6.234 6.040 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -16.594 -4.600 5.837 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -16.163 -5.422 8.058 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -17.236 -4.108 8.124 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -17.818 -5.691 8.321 1.00 2.78 H new ATOM 1871 N CYS A 188 -22.564 -5.404 1.418 1.00 1.82 N ATOM 1872 CA CYS A 188 -23.964 -5.638 1.126 1.00 2.29 C ATOM 1873 C CYS A 188 -24.174 -7.116 0.851 1.00 2.51 C ATOM 1874 O CYS A 188 -23.554 -7.682 -0.055 1.00 2.68 O ATOM 1875 CB CYS A 188 -24.405 -4.798 -0.077 1.00 2.71 C ATOM 1876 SG CYS A 188 -24.166 -3.019 0.148 1.00 3.14 S ATOM 0 H CYS A 188 -21.921 -5.912 0.811 1.00 1.82 H new ATOM 0 HA CYS A 188 -24.569 -5.342 1.983 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -23.849 -5.121 -0.957 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -25.459 -4.991 -0.276 1.00 2.71 H new ATOM 0 HG CYS A 188 -24.564 -2.390 -0.918 1.00 3.14 H new ATOM 1882 N ASP A 189 -25.024 -7.745 1.646 1.00 2.70 N ATOM 1883 CA ASP A 189 -25.286 -9.168 1.493 1.00 3.08 C ATOM 1884 C ASP A 189 -26.281 -9.391 0.370 1.00 3.61 C ATOM 1885 O ASP A 189 -27.482 -9.533 0.598 1.00 3.87 O ATOM 1886 CB ASP A 189 -25.814 -9.774 2.796 1.00 3.12 C ATOM 1887 CG ASP A 189 -24.794 -9.723 3.912 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -24.846 -8.783 4.737 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -23.928 -10.619 3.972 1.00 4.05 O ATOM 0 H ASP A 189 -25.543 -7.296 2.401 1.00 2.70 H new ATOM 0 HA ASP A 189 -24.348 -9.665 1.246 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -26.712 -9.239 3.104 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -26.104 -10.810 2.620 1.00 3.12 H new ATOM 1894 N GLU A 190 -25.763 -9.432 -0.843 1.00 3.97 N ATOM 1895 CA GLU A 190 -26.584 -9.581 -2.027 1.00 4.63 C ATOM 1896 C GLU A 190 -26.360 -10.952 -2.644 1.00 5.25 C ATOM 1897 O GLU A 190 -25.381 -11.112 -3.403 1.00 5.64 O ATOM 1898 CB GLU A 190 -26.257 -8.476 -3.035 1.00 4.83 C ATOM 1899 CG GLU A 190 -26.533 -7.069 -2.518 1.00 5.57 C ATOM 1900 CD GLU A 190 -28.006 -6.811 -2.280 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -28.724 -6.498 -3.254 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -28.458 -6.916 -1.122 1.00 6.43 O ATOM 1903 OXT GLU A 190 -27.149 -11.872 -2.347 1.00 5.62 O ATOM 0 H GLU A 190 -24.763 -9.363 -1.034 1.00 3.97 H new ATOM 0 HA GLU A 190 -27.634 -9.493 -1.748 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -25.206 -8.551 -3.313 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -26.839 -8.640 -3.942 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -25.987 -6.915 -1.588 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -26.152 -6.342 -3.235 1.00 5.57 H new TER 1910 GLU A 190