USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 141 GLN : amide:sc= 0.763 K(o=0.88,f=0.054) USER MOD Set 1.2: A 147 TYR OH : rot 90:sc= 0.119 USER MOD Set 2.1: A 84 GLN : amide:sc= 1.14 K(o=2.2,f=-2.6) USER MOD Set 2.2: A 180 SER OG : rot -143:sc= 1.08 USER MOD Set 3.1: A 80 HIS : no HE2:sc= -0.51! C(o=0.46!,f=-6.4!) USER MOD Set 3.2: A 104 THR OG1 : rot -19:sc= 0.968! USER MOD Set 4.1: A 76 GLN : amide:sc= -2.04 K(o=-1.3,f=-8.4!) USER MOD Set 4.2: A 111 SER OG : rot 86:sc= 0.744 USER MOD Single : A 77 SER OG : rot 97:sc= -0.634! USER MOD Single : A 82 SER OG : rot -160:sc= 0 USER MOD Single : A 85 THR OG1 : rot 110:sc= 0.635 USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.226 USER MOD Single : A 88 LYS NZ :NH3+ -153:sc= 0.506 (180deg=-0.629) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 CYS SG : rot 36:sc= 0.0807 USER MOD Single : A 93 SER OG : rot -0:sc= 0.569 USER MOD Single : A 103 ASN : amide:sc= -0.773 K(o=-0.77,f=-3.2) USER MOD Single : A 107 LYS NZ :NH3+ -177:sc= 1.54 (180deg=1.45) USER MOD Single : A 109 LYS NZ :NH3+ 131:sc= 0.0692 (180deg=-0.0523) USER MOD Single : A 110 LYS NZ :NH3+ -170:sc=-0.00804 (180deg=-0.13) USER MOD Single : A 112 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0683) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= -2.96! C(o=-3!,f=-10!) USER MOD Single : A 119 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0877) USER MOD Single : A 122 ASN : amide:sc= 1.59 K(o=1.6,f=-9.3!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 47:sc= -2.29! USER MOD Single : A 140 ASN : amide:sc= -0.204 K(o=-0.2,f=-2.1) 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 108:sc= 0.859 USER MOD Single : A 152 LYS NZ :NH3+ -166:sc= -0.0384 (180deg=-0.262) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 MET CE :methyl -175:sc= -2.37 (180deg=-2.41) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 TYR OH : rot -168:sc= 0.0308 USER MOD Single : A 163 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00256) USER MOD Single : A 165 TYR OH : rot 30:sc= -0.872 USER MOD Single : A 166 LYS NZ :NH3+ -112:sc= 0 (180deg=-1.11) USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 ASN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot -140:sc= -0.0715 USER MOD Single : A 183 MET CE :methyl 180:sc= -1.58 (180deg=-1.58) USER MOD Single : A 187 LYS NZ :NH3+ -129:sc= 1.11 (180deg=-0.77) USER MOD Single : A 188 CYS SG : rot 180:sc= -0.122 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 24.666 3.511 -4.643 1.00 3.12 N ATOM 2 CA ARG A 73 24.417 2.300 -3.828 1.00 2.69 C ATOM 3 C ARG A 73 23.366 2.597 -2.764 1.00 2.08 C ATOM 4 O ARG A 73 23.693 2.984 -1.641 1.00 2.31 O ATOM 5 CB ARG A 73 25.717 1.830 -3.171 1.00 3.05 C ATOM 6 CG ARG A 73 25.606 0.475 -2.493 1.00 3.69 C ATOM 7 CD ARG A 73 26.909 0.080 -1.812 1.00 4.24 C ATOM 8 NE ARG A 73 27.239 0.970 -0.698 1.00 4.97 N ATOM 9 CZ ARG A 73 28.190 0.717 0.202 1.00 5.85 C ATOM 10 NH1 ARG A 73 28.918 -0.391 0.113 1.00 6.18 N ATOM 11 NH2 ARG A 73 28.414 1.572 1.191 1.00 6.67 N ATOM 0 HA ARG A 73 24.048 1.506 -4.477 1.00 2.69 H new ATOM 0 HB2 ARG A 73 26.500 1.784 -3.928 1.00 3.05 H new ATOM 0 HB3 ARG A 73 26.029 2.570 -2.434 1.00 3.05 H new ATOM 0 HG2 ARG A 73 24.803 0.501 -1.756 1.00 3.69 H new ATOM 0 HG3 ARG A 73 25.337 -0.281 -3.231 1.00 3.69 H new ATOM 0 HD2 ARG A 73 26.831 -0.944 -1.447 1.00 4.24 H new ATOM 0 HD3 ARG A 73 27.719 0.097 -2.542 1.00 4.24 H new ATOM 0 HE ARG A 73 26.709 1.837 -0.604 1.00 4.97 H new ATOM 0 HH11 ARG A 73 28.750 -1.052 -0.646 1.00 6.18 H new ATOM 0 HH12 ARG A 73 29.644 -0.581 0.803 1.00 6.18 H new ATOM 0 HH21 ARG A 73 27.859 2.424 1.264 1.00 6.67 H new ATOM 0 HH22 ARG A 73 29.142 1.377 1.879 1.00 6.67 H new ATOM 25 N TRP A 74 22.103 2.423 -3.126 1.00 1.61 N ATOM 26 CA TRP A 74 21.002 2.716 -2.221 1.00 1.14 C ATOM 27 C TRP A 74 19.923 1.643 -2.333 1.00 0.96 C ATOM 28 O TRP A 74 19.089 1.676 -3.232 1.00 1.19 O ATOM 29 CB TRP A 74 20.419 4.100 -2.525 1.00 1.25 C ATOM 30 CG TRP A 74 19.333 4.509 -1.584 1.00 1.15 C ATOM 31 CD1 TRP A 74 17.992 4.448 -1.810 1.00 1.14 C ATOM 32 CD2 TRP A 74 19.494 5.041 -0.268 1.00 1.26 C ATOM 33 NE1 TRP A 74 17.306 4.913 -0.716 1.00 1.26 N ATOM 34 CE2 TRP A 74 18.209 5.285 0.244 1.00 1.34 C ATOM 35 CE3 TRP A 74 20.602 5.337 0.527 1.00 1.43 C ATOM 36 CZ2 TRP A 74 18.003 5.809 1.513 1.00 1.61 C ATOM 37 CZ3 TRP A 74 20.398 5.857 1.789 1.00 1.66 C ATOM 38 CH2 TRP A 74 19.105 6.090 2.272 1.00 1.75 C ATOM 0 H TRP A 74 21.815 2.080 -4.042 1.00 1.61 H new ATOM 0 HA TRP A 74 21.380 2.718 -1.199 1.00 1.14 H new ATOM 0 HB2 TRP A 74 21.219 4.839 -2.487 1.00 1.25 H new ATOM 0 HB3 TRP A 74 20.028 4.105 -3.543 1.00 1.25 H new ATOM 0 HD1 TRP A 74 17.534 4.086 -2.719 1.00 1.14 H new ATOM 0 HE1 TRP A 74 16.291 4.972 -0.632 1.00 1.26 H new ATOM 0 HE3 TRP A 74 21.603 5.162 0.161 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 17.006 5.989 1.888 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 21.249 6.088 2.413 1.00 1.66 H new ATOM 0 HH2 TRP A 74 18.975 6.499 3.263 1.00 1.75 H new ATOM 49 N ASP A 75 19.942 0.708 -1.393 1.00 0.79 N ATOM 50 CA ASP A 75 19.059 -0.460 -1.424 1.00 0.78 C ATOM 51 C ASP A 75 17.592 -0.090 -1.191 1.00 0.67 C ATOM 52 O ASP A 75 16.690 -0.873 -1.470 1.00 0.92 O ATOM 53 CB ASP A 75 19.482 -1.451 -0.337 1.00 0.92 C ATOM 54 CG ASP A 75 20.914 -1.922 -0.471 1.00 1.37 C ATOM 55 OD1 ASP A 75 21.806 -1.312 0.158 1.00 2.01 O ATOM 56 OD2 ASP A 75 21.153 -2.913 -1.184 1.00 1.86 O ATOM 0 H ASP A 75 20.567 0.733 -0.587 1.00 0.79 H new ATOM 0 HA ASP A 75 19.148 -0.900 -2.417 1.00 0.78 H new ATOM 0 HB2 ASP A 75 19.352 -0.984 0.639 1.00 0.92 H new ATOM 0 HB3 ASP A 75 18.819 -2.316 -0.368 1.00 0.92 H new ATOM 61 N GLN A 76 17.359 1.101 -0.677 1.00 0.59 N ATOM 62 CA GLN A 76 16.047 1.463 -0.153 1.00 0.77 C ATOM 63 C GLN A 76 15.150 2.148 -1.186 1.00 0.69 C ATOM 64 O GLN A 76 14.160 2.772 -0.813 1.00 0.94 O ATOM 65 CB GLN A 76 16.204 2.359 1.076 1.00 1.07 C ATOM 66 CG GLN A 76 17.222 1.834 2.078 1.00 1.21 C ATOM 67 CD GLN A 76 17.199 2.573 3.403 1.00 1.75 C ATOM 68 OE1 GLN A 76 17.548 2.012 4.437 1.00 2.30 O ATOM 69 NE2 GLN A 76 16.774 3.824 3.389 1.00 2.36 N ATOM 0 H GLN A 76 18.059 1.839 -0.609 1.00 0.59 H new ATOM 0 HA GLN A 76 15.553 0.531 0.121 1.00 0.77 H new ATOM 0 HB2 GLN A 76 16.503 3.357 0.754 1.00 1.07 H new ATOM 0 HB3 GLN A 76 15.237 2.460 1.570 1.00 1.07 H new ATOM 0 HG2 GLN A 76 17.032 0.776 2.257 1.00 1.21 H new ATOM 0 HG3 GLN A 76 18.219 1.910 1.645 1.00 1.21 H new ATOM 0 HE21 GLN A 76 16.492 4.257 2.510 1.00 2.36 H new ATOM 0 HE22 GLN A 76 16.728 4.357 4.258 1.00 2.36 H new ATOM 78 N SER A 77 15.500 2.085 -2.464 1.00 0.51 N ATOM 79 CA SER A 77 14.778 2.859 -3.471 1.00 0.56 C ATOM 80 C SER A 77 13.713 2.071 -4.246 1.00 0.43 C ATOM 81 O SER A 77 12.663 2.623 -4.571 1.00 0.54 O ATOM 82 CB SER A 77 15.765 3.464 -4.465 1.00 0.80 C ATOM 83 OG SER A 77 16.692 2.494 -4.912 1.00 1.52 O ATOM 0 H SER A 77 16.266 1.517 -2.826 1.00 0.51 H new ATOM 0 HA SER A 77 14.245 3.630 -2.914 1.00 0.56 H new ATOM 0 HB2 SER A 77 15.223 3.874 -5.317 1.00 0.80 H new ATOM 0 HB3 SER A 77 16.297 4.292 -3.997 1.00 0.80 H new ATOM 0 HG SER A 77 16.390 2.122 -5.767 1.00 1.52 H new ATOM 89 N ASP A 78 13.955 0.801 -4.552 1.00 0.35 N ATOM 90 CA ASP A 78 13.192 0.154 -5.624 1.00 0.38 C ATOM 91 C ASP A 78 12.298 -1.001 -5.175 1.00 0.33 C ATOM 92 O ASP A 78 12.191 -2.014 -5.869 1.00 0.42 O ATOM 93 CB ASP A 78 14.120 -0.286 -6.758 1.00 0.51 C ATOM 94 CG ASP A 78 14.655 0.901 -7.534 1.00 0.94 C ATOM 95 OD1 ASP A 78 13.936 1.412 -8.416 1.00 1.66 O ATOM 96 OD2 ASP A 78 15.790 1.339 -7.258 1.00 1.66 O ATOM 0 H ASP A 78 14.649 0.211 -4.093 1.00 0.35 H new ATOM 0 HA ASP A 78 12.504 0.919 -5.984 1.00 0.38 H new ATOM 0 HB2 ASP A 78 14.952 -0.857 -6.347 1.00 0.51 H new ATOM 0 HB3 ASP A 78 13.580 -0.950 -7.434 1.00 0.51 H new ATOM 101 N LEU A 79 11.666 -0.855 -4.024 1.00 0.26 N ATOM 102 CA LEU A 79 10.593 -1.766 -3.627 1.00 0.26 C ATOM 103 C LEU A 79 9.258 -1.190 -4.094 1.00 0.30 C ATOM 104 O LEU A 79 8.662 -0.362 -3.414 1.00 0.51 O ATOM 105 CB LEU A 79 10.566 -1.977 -2.104 1.00 0.28 C ATOM 106 CG LEU A 79 11.572 -2.990 -1.538 1.00 0.28 C ATOM 107 CD1 LEU A 79 11.361 -4.363 -2.152 1.00 0.29 C ATOM 108 CD2 LEU A 79 13.003 -2.522 -1.750 1.00 0.30 C ATOM 0 H LEU A 79 11.871 -0.120 -3.347 1.00 0.26 H new ATOM 0 HA LEU A 79 10.771 -2.736 -4.091 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.742 -1.015 -1.622 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.563 -2.297 -1.821 1.00 0.28 H new ATOM 0 HG LEU A 79 11.399 -3.065 -0.464 1.00 0.28 H new ATOM 0 HD11 LEU A 79 12.085 -5.063 -1.735 1.00 0.29 H new ATOM 0 HD12 LEU A 79 10.352 -4.710 -1.930 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.494 -4.303 -3.232 1.00 0.29 H new ATOM 0 HD21 LEU A 79 13.692 -3.260 -1.339 1.00 0.30 H new ATOM 0 HD22 LEU A 79 13.193 -2.403 -2.817 1.00 0.30 H new ATOM 0 HD23 LEU A 79 13.152 -1.567 -1.247 1.00 0.30 H new ATOM 120 N HIS A 80 8.795 -1.624 -5.256 1.00 0.21 N ATOM 121 CA HIS A 80 7.619 -1.014 -5.873 1.00 0.25 C ATOM 122 C HIS A 80 6.388 -1.884 -5.693 1.00 0.22 C ATOM 123 O HIS A 80 6.467 -3.109 -5.784 1.00 0.23 O ATOM 124 CB HIS A 80 7.854 -0.762 -7.364 1.00 0.33 C ATOM 125 CG HIS A 80 8.821 0.345 -7.646 1.00 1.03 C ATOM 126 ND1 HIS A 80 10.035 0.149 -8.267 1.00 1.94 N ATOM 127 CD2 HIS A 80 8.738 1.672 -7.402 1.00 1.86 C ATOM 128 CE1 HIS A 80 10.654 1.306 -8.393 1.00 2.58 C ATOM 129 NE2 HIS A 80 9.888 2.247 -7.878 1.00 2.50 N ATOM 0 H HIS A 80 9.208 -2.389 -5.790 1.00 0.21 H new ATOM 0 HA HIS A 80 7.449 -0.061 -5.373 1.00 0.25 H new ATOM 0 HB2 HIS A 80 8.222 -1.679 -7.824 1.00 0.33 H new ATOM 0 HB3 HIS A 80 6.901 -0.528 -7.838 1.00 0.33 H new ATOM 0 HD1 HIS A 80 10.398 -0.751 -8.580 1.00 1.94 H new ATOM 0 HD2 HIS A 80 7.918 2.184 -6.921 1.00 1.86 H new ATOM 0 HE1 HIS A 80 11.624 1.457 -8.842 1.00 2.58 H new ATOM 138 N ILE A 81 5.255 -1.240 -5.444 1.00 0.23 N ATOM 139 CA ILE A 81 3.993 -1.942 -5.296 1.00 0.23 C ATOM 140 C ILE A 81 3.525 -2.454 -6.654 1.00 0.26 C ATOM 141 O ILE A 81 2.928 -1.719 -7.440 1.00 0.36 O ATOM 142 CB ILE A 81 2.899 -1.036 -4.698 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.373 -0.409 -3.381 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.627 -1.839 -4.478 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.404 0.601 -2.808 1.00 0.27 C ATOM 0 H ILE A 81 5.188 -0.228 -5.340 1.00 0.23 H new ATOM 0 HA ILE A 81 4.160 -2.774 -4.612 1.00 0.23 H new ATOM 0 HB ILE A 81 2.691 -0.229 -5.400 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.535 -1.200 -2.649 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.335 0.076 -3.545 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.858 -1.193 -4.055 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.281 -2.240 -5.430 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.829 -2.660 -3.790 1.00 0.28 H new ATOM 0 HD11 ILE A 81 2.805 1.003 -1.877 1.00 0.27 H new ATOM 0 HD12 ILE A 81 2.260 1.413 -3.521 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.447 0.117 -2.612 1.00 0.27 H new ATOM 157 N SER A 82 3.808 -3.712 -6.925 1.00 0.25 N ATOM 158 CA SER A 82 3.513 -4.289 -8.223 1.00 0.29 C ATOM 159 C SER A 82 2.110 -4.883 -8.252 1.00 0.33 C ATOM 160 O SER A 82 1.449 -4.878 -9.290 1.00 0.43 O ATOM 161 CB SER A 82 4.560 -5.351 -8.566 1.00 0.32 C ATOM 162 OG SER A 82 5.863 -4.791 -8.547 1.00 1.10 O ATOM 0 H SER A 82 4.242 -4.356 -6.264 1.00 0.25 H new ATOM 0 HA SER A 82 3.551 -3.499 -8.973 1.00 0.29 H new ATOM 0 HB2 SER A 82 4.501 -6.172 -7.852 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.352 -5.770 -9.551 1.00 0.32 H new ATOM 0 HG SER A 82 6.472 -5.362 -9.060 1.00 1.10 H new ATOM 168 N ASP A 83 1.649 -5.371 -7.108 1.00 0.33 N ATOM 169 CA ASP A 83 0.334 -5.998 -7.018 1.00 0.38 C ATOM 170 C ASP A 83 -0.325 -5.613 -5.707 1.00 0.30 C ATOM 171 O ASP A 83 0.333 -5.086 -4.811 1.00 0.27 O ATOM 172 CB ASP A 83 0.434 -7.531 -7.102 1.00 0.46 C ATOM 173 CG ASP A 83 1.041 -8.030 -8.397 1.00 1.27 C ATOM 174 OD1 ASP A 83 2.278 -8.159 -8.468 1.00 2.07 O ATOM 175 OD2 ASP A 83 0.282 -8.317 -9.348 1.00 1.90 O ATOM 0 H ASP A 83 2.165 -5.345 -6.229 1.00 0.33 H new ATOM 0 HA ASP A 83 -0.264 -5.646 -7.859 1.00 0.38 H new ATOM 0 HB2 ASP A 83 1.033 -7.894 -6.267 1.00 0.46 H new ATOM 0 HB3 ASP A 83 -0.562 -7.958 -6.989 1.00 0.46 H new ATOM 180 N GLN A 84 -1.618 -5.872 -5.594 1.00 0.31 N ATOM 181 CA GLN A 84 -2.343 -5.606 -4.363 1.00 0.35 C ATOM 182 C GLN A 84 -3.620 -6.434 -4.305 1.00 0.34 C ATOM 183 O GLN A 84 -3.774 -7.393 -5.060 1.00 0.39 O ATOM 184 CB GLN A 84 -2.673 -4.113 -4.231 1.00 0.49 C ATOM 185 CG GLN A 84 -3.538 -3.569 -5.356 1.00 0.64 C ATOM 186 CD GLN A 84 -4.171 -2.245 -4.991 1.00 1.32 C ATOM 187 OE1 GLN A 84 -3.620 -1.483 -4.201 1.00 2.14 O ATOM 188 NE2 GLN A 84 -5.333 -1.964 -5.554 1.00 1.98 N ATOM 0 H GLN A 84 -2.188 -6.267 -6.342 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.703 -5.890 -3.528 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -3.182 -3.947 -3.282 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -1.742 -3.547 -4.196 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -2.932 -3.446 -6.253 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -4.319 -4.291 -5.595 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -5.757 -2.625 -6.205 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -5.806 -1.087 -5.337 1.00 1.98 H new ATOM 197 N THR A 85 -4.507 -6.078 -3.383 1.00 0.34 N ATOM 198 CA THR A 85 -5.804 -6.726 -3.238 1.00 0.39 C ATOM 199 C THR A 85 -6.519 -6.870 -4.584 1.00 0.50 C ATOM 200 O THR A 85 -6.565 -5.928 -5.381 1.00 0.54 O ATOM 201 CB THR A 85 -6.688 -5.912 -2.279 1.00 0.32 C ATOM 202 OG1 THR A 85 -5.930 -5.558 -1.117 1.00 0.43 O ATOM 203 CG2 THR A 85 -7.922 -6.696 -1.863 1.00 0.42 C ATOM 0 H THR A 85 -4.345 -5.327 -2.712 1.00 0.34 H new ATOM 0 HA THR A 85 -5.632 -7.724 -2.835 1.00 0.39 H new ATOM 0 HB THR A 85 -7.018 -5.013 -2.799 1.00 0.32 H new ATOM 0 HG1 THR A 85 -5.753 -4.594 -1.123 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.525 -6.092 -1.185 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.509 -6.946 -2.747 1.00 0.42 H new ATOM 0 HG23 THR A 85 -7.618 -7.613 -1.358 1.00 0.42 H new ATOM 211 N ASP A 86 -7.078 -8.051 -4.830 1.00 0.69 N ATOM 212 CA ASP A 86 -7.743 -8.335 -6.097 1.00 0.89 C ATOM 213 C ASP A 86 -9.169 -7.794 -6.080 1.00 0.83 C ATOM 214 O ASP A 86 -10.143 -8.548 -6.079 1.00 1.12 O ATOM 215 CB ASP A 86 -7.746 -9.842 -6.381 1.00 1.20 C ATOM 216 CG ASP A 86 -8.167 -10.170 -7.804 1.00 1.67 C ATOM 217 OD1 ASP A 86 -7.313 -10.082 -8.715 1.00 2.32 O ATOM 218 OD2 ASP A 86 -9.345 -10.529 -8.021 1.00 2.23 O ATOM 0 H ASP A 86 -7.084 -8.827 -4.168 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.191 -7.838 -6.894 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -6.749 -10.244 -6.200 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -8.421 -10.338 -5.683 1.00 1.20 H new ATOM 223 N THR A 87 -9.275 -6.477 -6.035 1.00 0.72 N ATOM 224 CA THR A 87 -10.559 -5.799 -6.048 1.00 0.74 C ATOM 225 C THR A 87 -10.518 -4.627 -7.021 1.00 0.81 C ATOM 226 O THR A 87 -10.515 -3.462 -6.619 1.00 1.42 O ATOM 227 CB THR A 87 -10.938 -5.301 -4.637 1.00 1.14 C ATOM 228 OG1 THR A 87 -9.791 -4.716 -4.008 1.00 1.36 O ATOM 229 CG2 THR A 87 -11.471 -6.439 -3.776 1.00 1.87 C ATOM 0 H THR A 87 -8.473 -5.848 -5.988 1.00 0.72 H new ATOM 0 HA THR A 87 -11.318 -6.511 -6.372 1.00 0.74 H new ATOM 0 HB THR A 87 -11.725 -4.553 -4.739 1.00 1.14 H new ATOM 0 HG1 THR A 87 -10.035 -4.399 -3.113 1.00 1.36 H new ATOM 0 HG21 THR A 87 -11.729 -6.058 -2.788 1.00 1.87 H new ATOM 0 HG22 THR A 87 -12.358 -6.865 -4.244 1.00 1.87 H new ATOM 0 HG23 THR A 87 -10.707 -7.210 -3.679 1.00 1.87 H new ATOM 237 N LYS A 88 -10.458 -4.953 -8.307 1.00 1.18 N ATOM 238 CA LYS A 88 -10.352 -3.952 -9.359 1.00 1.58 C ATOM 239 C LYS A 88 -11.700 -3.282 -9.620 1.00 1.51 C ATOM 240 O LYS A 88 -12.395 -3.604 -10.588 1.00 1.95 O ATOM 241 CB LYS A 88 -9.833 -4.602 -10.645 1.00 1.89 C ATOM 242 CG LYS A 88 -8.426 -5.176 -10.532 1.00 2.02 C ATOM 243 CD LYS A 88 -7.356 -4.101 -10.662 1.00 2.39 C ATOM 244 CE LYS A 88 -5.960 -4.703 -10.613 1.00 2.73 C ATOM 245 NZ LYS A 88 -4.921 -3.762 -11.113 1.00 3.20 N ATOM 0 H LYS A 88 -10.481 -5.914 -8.648 1.00 1.18 H new ATOM 0 HA LYS A 88 -9.650 -3.185 -9.031 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -10.516 -5.400 -10.937 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -9.848 -3.861 -11.445 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -8.317 -5.681 -9.572 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -8.279 -5.929 -11.307 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -7.490 -3.563 -11.601 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -7.469 -3.373 -9.859 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -5.726 -4.988 -9.587 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -5.939 -5.615 -11.210 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -4.117 -4.302 -11.491 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -5.324 -3.168 -11.866 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -4.596 -3.157 -10.332 1.00 3.20 H new ATOM 259 N GLY A 89 -12.073 -2.360 -8.747 1.00 1.22 N ATOM 260 CA GLY A 89 -13.291 -1.605 -8.945 1.00 1.14 C ATOM 261 C GLY A 89 -14.139 -1.536 -7.693 1.00 0.96 C ATOM 262 O GLY A 89 -13.615 -1.416 -6.584 1.00 1.01 O ATOM 0 H GLY A 89 -11.553 -2.121 -7.903 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -13.040 -0.594 -9.266 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -13.871 -2.060 -9.748 1.00 1.14 H new ATOM 266 N THR A 90 -15.451 -1.610 -7.871 1.00 0.97 N ATOM 267 CA THR A 90 -16.383 -1.538 -6.759 1.00 0.88 C ATOM 268 C THR A 90 -16.798 -2.937 -6.313 1.00 0.82 C ATOM 269 O THR A 90 -17.583 -3.604 -6.988 1.00 1.04 O ATOM 270 CB THR A 90 -17.636 -0.731 -7.150 1.00 1.06 C ATOM 271 OG1 THR A 90 -17.243 0.525 -7.722 1.00 1.25 O ATOM 272 CG2 THR A 90 -18.530 -0.484 -5.942 1.00 1.02 C ATOM 0 H THR A 90 -15.894 -1.721 -8.783 1.00 0.97 H new ATOM 0 HA THR A 90 -15.879 -1.035 -5.933 1.00 0.88 H new ATOM 0 HB THR A 90 -18.200 -1.310 -7.881 1.00 1.06 H new ATOM 0 HG1 THR A 90 -18.042 1.035 -7.971 1.00 1.25 H new ATOM 0 HG21 THR A 90 -19.406 0.088 -6.248 1.00 1.02 H new ATOM 0 HG22 THR A 90 -18.848 -1.439 -5.523 1.00 1.02 H new ATOM 0 HG23 THR A 90 -17.977 0.076 -5.188 1.00 1.02 H new ATOM 280 N VAL A 91 -16.255 -3.383 -5.192 1.00 0.65 N ATOM 281 CA VAL A 91 -16.568 -4.699 -4.654 1.00 0.77 C ATOM 282 C VAL A 91 -16.979 -4.581 -3.195 1.00 0.55 C ATOM 283 O VAL A 91 -16.312 -3.900 -2.421 1.00 0.46 O ATOM 284 CB VAL A 91 -15.351 -5.645 -4.747 1.00 1.02 C ATOM 285 CG1 VAL A 91 -15.705 -7.036 -4.246 1.00 1.43 C ATOM 286 CG2 VAL A 91 -14.814 -5.707 -6.169 1.00 1.51 C ATOM 0 H VAL A 91 -15.590 -2.849 -4.632 1.00 0.65 H new ATOM 0 HA VAL A 91 -17.386 -5.111 -5.245 1.00 0.77 H new ATOM 0 HB VAL A 91 -14.566 -5.242 -4.107 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -14.831 -7.683 -4.322 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -16.024 -6.978 -3.205 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -16.514 -7.446 -4.851 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -13.958 -6.380 -6.205 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -15.593 -6.075 -6.836 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -14.506 -4.710 -6.485 1.00 1.51 H new ATOM 296 N CYS A 92 -18.067 -5.226 -2.806 1.00 0.79 N ATOM 297 CA CYS A 92 -18.437 -5.233 -1.407 1.00 0.64 C ATOM 298 C CYS A 92 -17.900 -6.492 -0.750 1.00 0.62 C ATOM 299 O CYS A 92 -18.250 -7.612 -1.132 1.00 1.20 O ATOM 300 CB CYS A 92 -19.959 -5.148 -1.250 1.00 1.10 C ATOM 301 SG CYS A 92 -20.885 -6.428 -2.134 1.00 1.91 S ATOM 0 H CYS A 92 -18.694 -5.739 -3.425 1.00 0.79 H new ATOM 0 HA CYS A 92 -18.002 -4.361 -0.918 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -20.205 -5.208 -0.190 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -20.292 -4.171 -1.600 1.00 1.10 H new ATOM 0 HG CYS A 92 -20.215 -7.542 -2.112 1.00 1.91 H new ATOM 307 N SER A 93 -17.019 -6.307 0.215 1.00 0.69 N ATOM 308 CA SER A 93 -16.456 -7.419 0.951 1.00 1.02 C ATOM 309 C SER A 93 -15.986 -6.981 2.329 1.00 0.58 C ATOM 310 O SER A 93 -15.446 -5.882 2.483 1.00 0.73 O ATOM 311 CB SER A 93 -15.276 -8.020 0.184 1.00 1.83 C ATOM 312 OG SER A 93 -15.686 -8.545 -1.068 1.00 2.58 O ATOM 0 H SER A 93 -16.677 -5.391 0.507 1.00 0.69 H new ATOM 0 HA SER A 93 -17.238 -8.169 1.068 1.00 1.02 H new ATOM 0 HB2 SER A 93 -14.514 -7.256 0.028 1.00 1.83 H new ATOM 0 HB3 SER A 93 -14.818 -8.810 0.779 1.00 1.83 H new ATOM 0 HG SER A 93 -16.651 -8.415 -1.177 1.00 2.58 H new ATOM 318 N PRO A 94 -16.215 -7.797 3.357 1.00 0.78 N ATOM 319 CA PRO A 94 -15.436 -7.724 4.577 1.00 0.67 C ATOM 320 C PRO A 94 -14.161 -8.527 4.375 1.00 0.53 C ATOM 321 O PRO A 94 -14.192 -9.756 4.368 1.00 0.59 O ATOM 322 CB PRO A 94 -16.332 -8.390 5.633 1.00 0.93 C ATOM 323 CG PRO A 94 -17.587 -8.800 4.916 1.00 1.39 C ATOM 324 CD PRO A 94 -17.261 -8.814 3.447 1.00 1.43 C ATOM 0 HA PRO A 94 -15.154 -6.711 4.865 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -15.836 -9.254 6.076 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -16.556 -7.699 6.446 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -17.919 -9.784 5.248 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -18.398 -8.103 5.126 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -16.909 -9.791 3.117 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -18.127 -8.563 2.835 1.00 1.43 H new ATOM 332 N PHE A 95 -13.042 -7.847 4.205 1.00 0.43 N ATOM 333 CA PHE A 95 -11.837 -8.519 3.754 1.00 0.40 C ATOM 334 C PHE A 95 -10.597 -7.742 4.169 1.00 0.33 C ATOM 335 O PHE A 95 -10.636 -6.515 4.291 1.00 0.32 O ATOM 336 CB PHE A 95 -11.904 -8.658 2.223 1.00 0.46 C ATOM 337 CG PHE A 95 -10.879 -9.585 1.622 1.00 0.50 C ATOM 338 CD1 PHE A 95 -10.899 -10.943 1.903 1.00 1.26 C ATOM 339 CD2 PHE A 95 -9.905 -9.100 0.760 1.00 1.35 C ATOM 340 CE1 PHE A 95 -9.971 -11.795 1.338 1.00 1.33 C ATOM 341 CE2 PHE A 95 -8.974 -9.950 0.195 1.00 1.36 C ATOM 342 CZ PHE A 95 -9.007 -11.298 0.485 1.00 0.68 C ATOM 0 H PHE A 95 -12.942 -6.845 4.369 1.00 0.43 H new ATOM 0 HA PHE A 95 -11.772 -9.505 4.213 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -12.898 -9.012 1.949 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.784 -7.670 1.778 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -11.649 -11.339 2.572 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -9.875 -8.046 0.528 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -10.000 -12.851 1.564 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -8.221 -9.559 -0.473 1.00 1.36 H new ATOM 0 HZ PHE A 95 -8.279 -11.964 0.045 1.00 0.68 H new ATOM 352 N ALA A 96 -9.518 -8.469 4.424 1.00 0.37 N ATOM 353 CA ALA A 96 -8.237 -7.859 4.731 1.00 0.38 C ATOM 354 C ALA A 96 -7.488 -7.557 3.442 1.00 0.35 C ATOM 355 O ALA A 96 -7.385 -8.408 2.558 1.00 0.51 O ATOM 356 CB ALA A 96 -7.412 -8.765 5.630 1.00 0.49 C ATOM 0 H ALA A 96 -9.508 -9.489 4.424 1.00 0.37 H new ATOM 0 HA ALA A 96 -8.412 -6.925 5.265 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.456 -8.289 5.848 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -7.950 -8.941 6.561 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -7.237 -9.716 5.127 1.00 0.49 H new ATOM 362 N LEU A 97 -6.966 -6.351 3.344 1.00 0.24 N ATOM 363 CA LEU A 97 -6.344 -5.880 2.118 1.00 0.22 C ATOM 364 C LEU A 97 -4.838 -6.052 2.173 1.00 0.22 C ATOM 365 O LEU A 97 -4.240 -6.039 3.249 1.00 0.24 O ATOM 366 CB LEU A 97 -6.718 -4.413 1.867 1.00 0.23 C ATOM 367 CG LEU A 97 -7.987 -4.198 1.029 1.00 0.46 C ATOM 368 CD1 LEU A 97 -9.114 -5.107 1.488 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.431 -2.747 1.105 1.00 1.07 C ATOM 0 H LEU A 97 -6.959 -5.672 4.105 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.716 -6.481 1.288 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -6.849 -3.918 2.829 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -5.883 -3.922 1.367 1.00 0.23 H new ATOM 0 HG LEU A 97 -7.748 -4.447 -0.005 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -9.997 -4.930 0.874 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -8.806 -6.148 1.388 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -9.349 -4.897 2.531 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -9.331 -2.610 0.506 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -8.641 -2.485 2.142 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -7.639 -2.104 0.722 1.00 1.07 H new ATOM 381 N PHE A 98 -4.230 -6.224 1.011 1.00 0.23 N ATOM 382 CA PHE A 98 -2.804 -6.456 0.932 1.00 0.23 C ATOM 383 C PHE A 98 -2.197 -5.753 -0.268 1.00 0.22 C ATOM 384 O PHE A 98 -2.889 -5.422 -1.228 1.00 0.25 O ATOM 385 CB PHE A 98 -2.512 -7.961 0.870 1.00 0.24 C ATOM 386 CG PHE A 98 -3.315 -8.705 -0.168 1.00 0.26 C ATOM 387 CD1 PHE A 98 -4.507 -9.324 0.178 1.00 1.26 C ATOM 388 CD2 PHE A 98 -2.880 -8.791 -1.484 1.00 1.18 C ATOM 389 CE1 PHE A 98 -5.249 -10.011 -0.765 1.00 1.31 C ATOM 390 CE2 PHE A 98 -3.619 -9.477 -2.429 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.804 -10.087 -2.069 1.00 0.40 C ATOM 0 H PHE A 98 -4.706 -6.207 0.109 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.347 -6.043 1.831 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.451 -8.106 0.665 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -2.710 -8.399 1.848 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -4.860 -9.269 1.197 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -1.954 -8.316 -1.772 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -6.176 -10.488 -0.481 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -3.270 -9.536 -3.449 1.00 1.17 H new ATOM 0 HZ PHE A 98 -5.382 -10.623 -2.807 1.00 0.40 H new ATOM 401 N ALA A 99 -0.903 -5.512 -0.186 1.00 0.20 N ATOM 402 CA ALA A 99 -0.143 -4.967 -1.294 1.00 0.19 C ATOM 403 C ALA A 99 1.173 -5.709 -1.413 1.00 0.17 C ATOM 404 O ALA A 99 1.765 -6.101 -0.408 1.00 0.19 O ATOM 405 CB ALA A 99 0.093 -3.477 -1.122 1.00 0.21 C ATOM 0 H ALA A 99 -0.348 -5.689 0.652 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.717 -5.100 -2.211 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.665 -3.099 -1.969 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -0.865 -2.960 -1.072 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.649 -3.301 -0.201 1.00 0.21 H new ATOM 411 N VAL A 100 1.612 -5.926 -2.632 1.00 0.17 N ATOM 412 CA VAL A 100 2.825 -6.676 -2.882 1.00 0.18 C ATOM 413 C VAL A 100 3.889 -5.786 -3.512 1.00 0.19 C ATOM 414 O VAL A 100 3.679 -5.212 -4.583 1.00 0.22 O ATOM 415 CB VAL A 100 2.542 -7.878 -3.801 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.811 -8.659 -4.075 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.477 -8.780 -3.194 1.00 0.25 C ATOM 0 H VAL A 100 1.143 -5.591 -3.474 1.00 0.17 H new ATOM 0 HA VAL A 100 3.194 -7.043 -1.924 1.00 0.18 H new ATOM 0 HB VAL A 100 2.167 -7.497 -4.751 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.585 -9.503 -4.726 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.540 -8.010 -4.561 1.00 0.26 H new ATOM 0 HG13 VAL A 100 4.222 -9.026 -3.135 1.00 0.26 H new ATOM 0 HG21 VAL A 100 1.292 -9.623 -3.859 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.820 -9.149 -2.228 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.555 -8.215 -3.060 1.00 0.25 H new ATOM 427 N LEU A 101 5.025 -5.678 -2.844 1.00 0.19 N ATOM 428 CA LEU A 101 6.123 -4.857 -3.324 1.00 0.19 C ATOM 429 C LEU A 101 7.238 -5.740 -3.850 1.00 0.21 C ATOM 430 O LEU A 101 7.754 -6.601 -3.136 1.00 0.23 O ATOM 431 CB LEU A 101 6.667 -3.935 -2.223 1.00 0.19 C ATOM 432 CG LEU A 101 5.719 -2.828 -1.749 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.671 -3.380 -0.793 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.506 -1.702 -1.096 1.00 0.21 C ATOM 0 H LEU A 101 5.211 -6.153 -1.961 1.00 0.19 H new ATOM 0 HA LEU A 101 5.740 -4.229 -4.128 1.00 0.19 H new ATOM 0 HB2 LEU A 101 6.937 -4.548 -1.363 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.584 -3.471 -2.585 1.00 0.19 H new ATOM 0 HG LEU A 101 5.199 -2.427 -2.619 1.00 0.22 H new ATOM 0 HD11 LEU A 101 4.011 -2.574 -0.472 1.00 0.30 H new ATOM 0 HD12 LEU A 101 4.086 -4.148 -1.299 1.00 0.30 H new ATOM 0 HD13 LEU A 101 5.164 -3.814 0.077 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.819 -0.923 -0.764 1.00 0.21 H new ATOM 0 HD22 LEU A 101 7.055 -2.091 -0.238 1.00 0.21 H new ATOM 0 HD23 LEU A 101 7.209 -1.284 -1.817 1.00 0.21 H new ATOM 446 N GLU A 102 7.607 -5.529 -5.097 1.00 0.24 N ATOM 447 CA GLU A 102 8.627 -6.341 -5.726 1.00 0.29 C ATOM 448 C GLU A 102 9.963 -5.615 -5.733 1.00 0.28 C ATOM 449 O GLU A 102 10.030 -4.408 -5.992 1.00 0.26 O ATOM 450 CB GLU A 102 8.215 -6.708 -7.156 1.00 0.34 C ATOM 451 CG GLU A 102 9.190 -7.651 -7.843 1.00 0.41 C ATOM 452 CD GLU A 102 8.681 -8.163 -9.174 1.00 0.53 C ATOM 453 OE1 GLU A 102 8.046 -9.239 -9.198 1.00 1.32 O ATOM 454 OE2 GLU A 102 8.919 -7.500 -10.203 1.00 0.95 O ATOM 0 H GLU A 102 7.215 -4.801 -5.695 1.00 0.24 H new ATOM 0 HA GLU A 102 8.736 -7.259 -5.148 1.00 0.29 H new ATOM 0 HB2 GLU A 102 7.228 -7.170 -7.134 1.00 0.34 H new ATOM 0 HB3 GLU A 102 8.127 -5.796 -7.746 1.00 0.34 H new ATOM 0 HG2 GLU A 102 10.138 -7.135 -7.997 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.391 -8.498 -7.187 1.00 0.41 H new ATOM 461 N ASN A 103 11.015 -6.355 -5.415 1.00 0.38 N ATOM 462 CA ASN A 103 12.373 -5.840 -5.491 1.00 0.44 C ATOM 463 C ASN A 103 12.766 -5.635 -6.946 1.00 0.37 C ATOM 464 O ASN A 103 13.182 -6.570 -7.630 1.00 0.51 O ATOM 465 CB ASN A 103 13.352 -6.799 -4.797 1.00 0.68 C ATOM 466 CG ASN A 103 14.805 -6.453 -5.064 1.00 0.87 C ATOM 467 OD1 ASN A 103 15.143 -5.304 -5.334 1.00 1.76 O ATOM 468 ND2 ASN A 103 15.675 -7.447 -4.992 1.00 1.64 N ATOM 0 H ASN A 103 10.952 -7.323 -5.099 1.00 0.38 H new ATOM 0 HA ASN A 103 12.416 -4.880 -4.976 1.00 0.44 H new ATOM 0 HB2 ASN A 103 13.171 -6.781 -3.722 1.00 0.68 H new ATOM 0 HB3 ASN A 103 13.158 -7.817 -5.136 1.00 0.68 H new ATOM 0 HD21 ASN A 103 16.665 -7.272 -5.164 1.00 1.64 H new ATOM 0 HD22 ASN A 103 15.356 -8.389 -4.765 1.00 1.64 H new ATOM 475 N THR A 104 12.619 -4.410 -7.414 1.00 0.34 N ATOM 476 CA THR A 104 12.932 -4.081 -8.789 1.00 0.38 C ATOM 477 C THR A 104 14.342 -3.508 -8.913 1.00 0.50 C ATOM 478 O THR A 104 14.555 -2.451 -9.513 1.00 0.70 O ATOM 479 CB THR A 104 11.891 -3.109 -9.383 1.00 0.55 C ATOM 480 OG1 THR A 104 11.647 -2.017 -8.483 1.00 0.77 O ATOM 481 CG2 THR A 104 10.585 -3.836 -9.664 1.00 0.73 C ATOM 0 H THR A 104 12.283 -3.624 -6.858 1.00 0.34 H new ATOM 0 HA THR A 104 12.893 -5.006 -9.364 1.00 0.38 H new ATOM 0 HB THR A 104 12.291 -2.716 -10.318 1.00 0.55 H new ATOM 0 HG1 THR A 104 11.948 -2.261 -7.583 1.00 0.77 H new ATOM 0 HG21 THR A 104 9.862 -3.136 -10.083 1.00 0.73 H new ATOM 0 HG22 THR A 104 10.763 -4.642 -10.375 1.00 0.73 H new ATOM 0 HG23 THR A 104 10.193 -4.251 -8.736 1.00 0.73 H new ATOM 489 N GLY A 105 15.300 -4.214 -8.327 1.00 0.52 N ATOM 490 CA GLY A 105 16.697 -3.875 -8.509 1.00 0.72 C ATOM 491 C GLY A 105 17.418 -3.559 -7.218 1.00 0.66 C ATOM 492 O GLY A 105 18.556 -3.987 -7.021 1.00 0.80 O ATOM 0 H GLY A 105 15.132 -5.020 -7.725 1.00 0.52 H new ATOM 0 HA2 GLY A 105 17.202 -4.705 -9.003 1.00 0.72 H new ATOM 0 HA3 GLY A 105 16.770 -3.015 -9.175 1.00 0.72 H new ATOM 496 N GLU A 106 16.766 -2.840 -6.326 1.00 0.60 N ATOM 497 CA GLU A 106 17.389 -2.479 -5.068 1.00 0.56 C ATOM 498 C GLU A 106 16.799 -3.284 -3.931 1.00 0.65 C ATOM 499 O GLU A 106 15.786 -2.916 -3.338 1.00 1.05 O ATOM 500 CB GLU A 106 17.278 -0.982 -4.812 1.00 0.68 C ATOM 501 CG GLU A 106 18.107 -0.157 -5.783 1.00 1.25 C ATOM 502 CD GLU A 106 19.607 -0.330 -5.590 1.00 1.91 C ATOM 503 OE1 GLU A 106 20.349 0.657 -5.796 1.00 2.54 O ATOM 504 OE2 GLU A 106 20.059 -1.447 -5.246 1.00 2.47 O ATOM 0 H GLU A 106 15.813 -2.497 -6.447 1.00 0.60 H new ATOM 0 HA GLU A 106 18.450 -2.719 -5.130 1.00 0.56 H new ATOM 0 HB2 GLU A 106 16.233 -0.681 -4.887 1.00 0.68 H new ATOM 0 HB3 GLU A 106 17.599 -0.767 -3.793 1.00 0.68 H new ATOM 0 HG2 GLU A 106 17.844 -0.436 -6.803 1.00 1.25 H new ATOM 0 HG3 GLU A 106 17.851 0.896 -5.665 1.00 1.25 H new ATOM 511 N LYS A 107 17.432 -4.418 -3.704 1.00 0.61 N ATOM 512 CA LYS A 107 17.106 -5.330 -2.620 1.00 0.69 C ATOM 513 C LYS A 107 16.988 -4.607 -1.286 1.00 0.66 C ATOM 514 O LYS A 107 17.772 -3.713 -0.983 1.00 0.76 O ATOM 515 CB LYS A 107 18.195 -6.408 -2.518 1.00 0.86 C ATOM 516 CG LYS A 107 19.618 -5.848 -2.517 1.00 1.37 C ATOM 517 CD LYS A 107 20.207 -5.790 -3.922 1.00 1.80 C ATOM 518 CE LYS A 107 21.524 -5.028 -3.964 1.00 2.66 C ATOM 519 NZ LYS A 107 21.352 -3.574 -3.679 1.00 3.32 N ATOM 0 H LYS A 107 18.208 -4.741 -4.282 1.00 0.61 H new ATOM 0 HA LYS A 107 16.140 -5.782 -2.843 1.00 0.69 H new ATOM 0 HB2 LYS A 107 18.040 -6.983 -1.605 1.00 0.86 H new ATOM 0 HB3 LYS A 107 18.087 -7.100 -3.353 1.00 0.86 H new ATOM 0 HG2 LYS A 107 19.614 -4.848 -2.083 1.00 1.37 H new ATOM 0 HG3 LYS A 107 20.252 -6.468 -1.883 1.00 1.37 H new ATOM 0 HD2 LYS A 107 20.364 -6.804 -4.290 1.00 1.80 H new ATOM 0 HD3 LYS A 107 19.493 -5.314 -4.594 1.00 1.80 H new ATOM 0 HE2 LYS A 107 22.212 -5.459 -3.237 1.00 2.66 H new ATOM 0 HE3 LYS A 107 21.980 -5.151 -4.946 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 22.269 -3.092 -3.770 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 20.677 -3.165 -4.356 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 20.990 -3.450 -2.712 1.00 3.32 H new ATOM 533 N LEU A 108 16.013 -5.008 -0.489 1.00 0.59 N ATOM 534 CA LEU A 108 15.850 -4.450 0.842 1.00 0.57 C ATOM 535 C LEU A 108 16.945 -5.014 1.741 1.00 0.63 C ATOM 536 O LEU A 108 16.825 -6.119 2.270 1.00 0.74 O ATOM 537 CB LEU A 108 14.451 -4.791 1.393 1.00 0.60 C ATOM 538 CG LEU A 108 13.953 -3.943 2.576 1.00 0.58 C ATOM 539 CD1 LEU A 108 14.679 -4.288 3.868 1.00 0.61 C ATOM 540 CD2 LEU A 108 14.105 -2.464 2.262 1.00 0.56 C ATOM 0 H LEU A 108 15.323 -5.717 -0.740 1.00 0.59 H new ATOM 0 HA LEU A 108 15.936 -3.364 0.808 1.00 0.57 H new ATOM 0 HB2 LEU A 108 13.732 -4.697 0.579 1.00 0.60 H new ATOM 0 HB3 LEU A 108 14.451 -5.837 1.699 1.00 0.60 H new ATOM 0 HG LEU A 108 12.898 -4.172 2.724 1.00 0.58 H new ATOM 0 HD11 LEU A 108 14.297 -3.666 4.677 1.00 0.61 H new ATOM 0 HD12 LEU A 108 14.514 -5.338 4.109 1.00 0.61 H new ATOM 0 HD13 LEU A 108 15.747 -4.107 3.745 1.00 0.61 H new ATOM 0 HD21 LEU A 108 13.749 -1.874 3.107 1.00 0.56 H new ATOM 0 HD22 LEU A 108 15.155 -2.237 2.078 1.00 0.56 H new ATOM 0 HD23 LEU A 108 13.520 -2.218 1.376 1.00 0.56 H new ATOM 552 N LYS A 109 18.017 -4.253 1.895 1.00 0.62 N ATOM 553 CA LYS A 109 19.185 -4.725 2.622 1.00 0.73 C ATOM 554 C LYS A 109 19.631 -3.700 3.670 1.00 0.75 C ATOM 555 O LYS A 109 20.758 -3.740 4.164 1.00 1.15 O ATOM 556 CB LYS A 109 20.309 -5.013 1.612 1.00 0.92 C ATOM 557 CG LYS A 109 21.540 -5.688 2.202 1.00 1.17 C ATOM 558 CD LYS A 109 22.530 -6.106 1.124 1.00 1.66 C ATOM 559 CE LYS A 109 22.961 -4.936 0.250 1.00 2.07 C ATOM 560 NZ LYS A 109 23.587 -3.839 1.036 1.00 2.72 N ATOM 0 H LYS A 109 18.103 -3.306 1.526 1.00 0.62 H new ATOM 0 HA LYS A 109 18.937 -5.641 3.159 1.00 0.73 H new ATOM 0 HB2 LYS A 109 19.911 -5.644 0.817 1.00 0.92 H new ATOM 0 HB3 LYS A 109 20.613 -4.074 1.150 1.00 0.92 H new ATOM 0 HG2 LYS A 109 22.028 -5.007 2.899 1.00 1.17 H new ATOM 0 HG3 LYS A 109 21.235 -6.564 2.774 1.00 1.17 H new ATOM 0 HD2 LYS A 109 23.409 -6.549 1.593 1.00 1.66 H new ATOM 0 HD3 LYS A 109 22.079 -6.877 0.499 1.00 1.66 H new ATOM 0 HE2 LYS A 109 23.667 -5.289 -0.502 1.00 2.07 H new ATOM 0 HE3 LYS A 109 22.094 -4.547 -0.284 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 24.482 -3.558 0.587 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 22.943 -3.023 1.066 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 23.774 -4.169 2.004 1.00 2.72 H new ATOM 574 N LYS A 110 18.738 -2.784 4.021 1.00 0.62 N ATOM 575 CA LYS A 110 19.056 -1.757 5.009 1.00 0.73 C ATOM 576 C LYS A 110 17.905 -1.557 5.992 1.00 0.77 C ATOM 577 O LYS A 110 17.822 -2.234 7.019 1.00 1.53 O ATOM 578 CB LYS A 110 19.397 -0.422 4.333 1.00 0.93 C ATOM 579 CG LYS A 110 20.698 -0.428 3.549 1.00 1.14 C ATOM 580 CD LYS A 110 21.013 0.954 2.999 1.00 1.46 C ATOM 581 CE LYS A 110 22.274 0.951 2.147 1.00 1.80 C ATOM 582 NZ LYS A 110 23.468 0.477 2.900 1.00 1.59 N ATOM 0 H LYS A 110 17.793 -2.729 3.640 1.00 0.62 H new ATOM 0 HA LYS A 110 19.930 -2.104 5.561 1.00 0.73 H new ATOM 0 HB2 LYS A 110 18.583 -0.151 3.660 1.00 0.93 H new ATOM 0 HB3 LYS A 110 19.451 0.354 5.096 1.00 0.93 H new ATOM 0 HG2 LYS A 110 21.512 -0.761 4.193 1.00 1.14 H new ATOM 0 HG3 LYS A 110 20.628 -1.142 2.728 1.00 1.14 H new ATOM 0 HD2 LYS A 110 20.172 1.308 2.402 1.00 1.46 H new ATOM 0 HD3 LYS A 110 21.135 1.655 3.825 1.00 1.46 H new ATOM 0 HE2 LYS A 110 22.120 0.313 1.277 1.00 1.80 H new ATOM 0 HE3 LYS A 110 22.460 1.958 1.774 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 24.325 0.651 2.337 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.536 0.990 3.802 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 23.378 -0.542 3.087 1.00 1.59 H new ATOM 596 N SER A 111 17.006 -0.640 5.662 1.00 0.51 N ATOM 597 CA SER A 111 15.894 -0.310 6.537 1.00 0.52 C ATOM 598 C SER A 111 14.576 -0.679 5.874 1.00 0.48 C ATOM 599 O SER A 111 14.423 -0.545 4.661 1.00 0.86 O ATOM 600 CB SER A 111 15.915 1.181 6.864 1.00 0.72 C ATOM 601 OG SER A 111 17.230 1.615 7.175 1.00 1.55 O ATOM 0 H SER A 111 17.027 -0.110 4.790 1.00 0.51 H new ATOM 0 HA SER A 111 15.992 -0.879 7.462 1.00 0.52 H new ATOM 0 HB2 SER A 111 15.532 1.748 6.016 1.00 0.72 H new ATOM 0 HB3 SER A 111 15.253 1.382 7.707 1.00 0.72 H new ATOM 0 HG SER A 111 17.701 1.849 6.348 1.00 1.55 H new ATOM 607 N LYS A 112 13.636 -1.141 6.679 1.00 0.39 N ATOM 608 CA LYS A 112 12.345 -1.599 6.183 1.00 0.32 C ATOM 609 C LYS A 112 11.470 -0.415 5.777 1.00 0.28 C ATOM 610 O LYS A 112 11.434 0.607 6.465 1.00 0.33 O ATOM 611 CB LYS A 112 11.647 -2.429 7.264 1.00 0.45 C ATOM 612 CG LYS A 112 12.512 -3.561 7.796 1.00 0.55 C ATOM 613 CD LYS A 112 11.847 -4.285 8.953 1.00 0.69 C ATOM 614 CE LYS A 112 12.690 -5.452 9.444 1.00 0.84 C ATOM 615 NZ LYS A 112 13.976 -5.006 10.038 1.00 1.53 N ATOM 0 H LYS A 112 13.742 -1.210 7.691 1.00 0.39 H new ATOM 0 HA LYS A 112 12.506 -2.218 5.301 1.00 0.32 H new ATOM 0 HB2 LYS A 112 11.365 -1.776 8.090 1.00 0.45 H new ATOM 0 HB3 LYS A 112 10.725 -2.844 6.857 1.00 0.45 H new ATOM 0 HG2 LYS A 112 12.717 -4.270 6.994 1.00 0.55 H new ATOM 0 HG3 LYS A 112 13.473 -3.162 8.121 1.00 0.55 H new ATOM 0 HD2 LYS A 112 11.680 -3.586 9.773 1.00 0.69 H new ATOM 0 HD3 LYS A 112 10.868 -4.649 8.641 1.00 0.69 H new ATOM 0 HE2 LYS A 112 12.126 -6.018 10.186 1.00 0.84 H new ATOM 0 HE3 LYS A 112 12.891 -6.128 8.613 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 14.462 -5.820 10.464 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 14.577 -4.594 9.296 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 13.791 -4.291 10.770 1.00 1.53 H new ATOM 629 N TRP A 113 10.764 -0.567 4.662 1.00 0.24 N ATOM 630 CA TRP A 113 9.906 0.494 4.137 1.00 0.22 C ATOM 631 C TRP A 113 8.684 0.691 5.016 1.00 0.21 C ATOM 632 O TRP A 113 8.166 -0.264 5.594 1.00 0.25 O ATOM 633 CB TRP A 113 9.441 0.164 2.716 1.00 0.22 C ATOM 634 CG TRP A 113 10.473 0.373 1.652 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.797 0.046 1.704 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.251 0.940 0.355 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.413 0.390 0.528 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.484 0.936 -0.316 1.00 0.25 C ATOM 639 CE3 TRP A 113 9.127 1.454 -0.304 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.629 1.421 -1.611 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.273 1.935 -1.591 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.516 1.915 -2.231 1.00 0.32 C ATOM 0 H TRP A 113 10.768 -1.418 4.100 1.00 0.24 H new ATOM 0 HA TRP A 113 10.495 1.411 4.126 1.00 0.22 H new ATOM 0 HB2 TRP A 113 9.116 -0.876 2.688 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.570 0.776 2.483 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.288 -0.416 2.548 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.402 0.260 0.317 1.00 0.25 H new ATOM 0 HE3 TRP A 113 8.164 1.474 0.185 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.587 1.408 -2.109 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.414 2.333 -2.111 1.00 0.32 H new ATOM 0 HH2 TRP A 113 10.598 2.298 -3.237 1.00 0.32 H new ATOM 653 N LYS A 114 8.232 1.932 5.101 1.00 0.20 N ATOM 654 CA LYS A 114 7.066 2.277 5.893 1.00 0.24 C ATOM 655 C LYS A 114 5.856 2.445 4.982 1.00 0.20 C ATOM 656 O LYS A 114 5.942 3.105 3.942 1.00 0.24 O ATOM 657 CB LYS A 114 7.324 3.576 6.654 1.00 0.37 C ATOM 658 CG LYS A 114 6.291 3.880 7.727 1.00 0.58 C ATOM 659 CD LYS A 114 6.505 3.037 8.971 1.00 1.04 C ATOM 660 CE LYS A 114 5.491 3.378 10.052 1.00 1.08 C ATOM 661 NZ LYS A 114 5.768 2.652 11.319 1.00 1.66 N ATOM 0 H LYS A 114 8.662 2.725 4.624 1.00 0.20 H new ATOM 0 HA LYS A 114 6.869 1.477 6.607 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.309 3.524 7.117 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.349 4.402 5.944 1.00 0.37 H new ATOM 0 HG2 LYS A 114 6.341 4.936 7.991 1.00 0.58 H new ATOM 0 HG3 LYS A 114 5.292 3.697 7.332 1.00 0.58 H new ATOM 0 HD2 LYS A 114 6.425 1.981 8.715 1.00 1.04 H new ATOM 0 HD3 LYS A 114 7.514 3.197 9.352 1.00 1.04 H new ATOM 0 HE2 LYS A 114 5.506 4.452 10.238 1.00 1.08 H new ATOM 0 HE3 LYS A 114 4.489 3.129 9.702 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 5.055 2.911 12.031 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 5.729 1.627 11.147 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 6.714 2.909 11.667 1.00 1.66 H new ATOM 675 N TRP A 115 4.742 1.846 5.365 1.00 0.17 N ATOM 676 CA TRP A 115 3.524 1.933 4.572 1.00 0.15 C ATOM 677 C TRP A 115 2.342 2.336 5.437 1.00 0.16 C ATOM 678 O TRP A 115 2.331 2.083 6.642 1.00 0.18 O ATOM 679 CB TRP A 115 3.224 0.592 3.896 1.00 0.15 C ATOM 680 CG TRP A 115 2.973 -0.526 4.863 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.904 -1.363 5.393 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.713 -0.930 5.415 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.307 -2.260 6.241 1.00 0.22 N ATOM 684 CE2 TRP A 115 1.964 -2.016 6.272 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.400 -0.479 5.273 1.00 0.18 C ATOM 686 CZ2 TRP A 115 0.955 -2.659 6.979 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.603 -1.118 5.975 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.320 -2.197 6.820 1.00 0.22 C ATOM 0 H TRP A 115 4.654 1.295 6.218 1.00 0.17 H new ATOM 0 HA TRP A 115 3.680 2.694 3.808 1.00 0.15 H new ATOM 0 HB2 TRP A 115 2.352 0.707 3.252 1.00 0.15 H new ATOM 0 HB3 TRP A 115 4.062 0.323 3.253 1.00 0.15 H new ATOM 0 HD1 TRP A 115 4.962 -1.327 5.177 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.788 -2.991 6.764 1.00 0.22 H new ATOM 0 HE3 TRP A 115 0.172 0.355 4.626 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 1.171 -3.493 7.630 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.623 -0.779 5.870 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.126 -2.674 7.357 1.00 0.22 H new ATOM 699 N GLU A 116 1.357 2.965 4.815 1.00 0.17 N ATOM 700 CA GLU A 116 0.108 3.299 5.483 1.00 0.20 C ATOM 701 C GLU A 116 -1.074 2.937 4.597 1.00 0.19 C ATOM 702 O GLU A 116 -1.024 3.123 3.380 1.00 0.25 O ATOM 703 CB GLU A 116 0.031 4.792 5.797 1.00 0.32 C ATOM 704 CG GLU A 116 1.216 5.348 6.556 1.00 0.50 C ATOM 705 CD GLU A 116 1.042 6.819 6.850 1.00 0.64 C ATOM 706 OE1 GLU A 116 1.507 7.276 7.913 1.00 1.40 O ATOM 707 OE2 GLU A 116 0.413 7.521 6.023 1.00 1.22 O ATOM 0 H GLU A 116 1.400 3.257 3.839 1.00 0.17 H new ATOM 0 HA GLU A 116 0.074 2.732 6.413 1.00 0.20 H new ATOM 0 HB2 GLU A 116 -0.071 5.340 4.860 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -0.873 4.980 6.376 1.00 0.32 H new ATOM 0 HG2 GLU A 116 1.340 4.801 7.491 1.00 0.50 H new ATOM 0 HG3 GLU A 116 2.126 5.197 5.975 1.00 0.50 H new ATOM 714 N LEU A 117 -2.134 2.429 5.199 1.00 0.17 N ATOM 715 CA LEU A 117 -3.371 2.202 4.478 1.00 0.16 C ATOM 716 C LEU A 117 -4.300 3.379 4.696 1.00 0.15 C ATOM 717 O LEU A 117 -4.633 3.716 5.836 1.00 0.19 O ATOM 718 CB LEU A 117 -4.063 0.924 4.934 1.00 0.19 C ATOM 719 CG LEU A 117 -5.362 0.618 4.188 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.082 -0.005 2.829 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.258 -0.276 5.016 1.00 0.25 C ATOM 0 H LEU A 117 -2.162 2.166 6.184 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.130 2.096 3.420 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.377 0.087 4.806 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.278 1.000 6.000 1.00 0.19 H new ATOM 0 HG LEU A 117 -5.882 1.561 4.021 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.025 -0.211 2.322 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.490 0.685 2.227 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.530 -0.936 2.962 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.176 -0.481 4.466 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -5.743 -1.214 5.225 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.501 0.221 5.955 1.00 0.25 H new ATOM 733 N HIS A 118 -4.710 4.007 3.613 1.00 0.13 N ATOM 734 CA HIS A 118 -5.544 5.188 3.703 1.00 0.14 C ATOM 735 C HIS A 118 -6.946 4.903 3.208 1.00 0.18 C ATOM 736 O HIS A 118 -7.133 4.159 2.246 1.00 0.21 O ATOM 737 CB HIS A 118 -4.946 6.342 2.897 1.00 0.18 C ATOM 738 CG HIS A 118 -3.692 6.916 3.487 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.443 8.270 3.546 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.609 6.314 4.037 1.00 0.24 C ATOM 741 CE1 HIS A 118 -2.264 8.473 4.109 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.737 7.308 4.418 1.00 0.22 N ATOM 0 H HIS A 118 -4.480 3.720 2.662 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.591 5.474 4.754 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.733 5.993 1.887 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.690 7.134 2.810 1.00 0.18 H new ATOM 0 HD2 HIS A 118 -2.458 5.251 4.154 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.809 9.436 4.286 1.00 0.45 H new ATOM 0 HE2 HIS A 118 -0.832 7.165 4.866 1.00 0.22 H new ATOM 751 N LYS A 119 -7.921 5.479 3.886 1.00 0.22 N ATOM 752 CA LYS A 119 -9.293 5.448 3.422 1.00 0.29 C ATOM 753 C LYS A 119 -9.560 6.697 2.596 1.00 0.27 C ATOM 754 O LYS A 119 -9.832 7.768 3.136 1.00 0.43 O ATOM 755 CB LYS A 119 -10.270 5.362 4.598 1.00 0.43 C ATOM 756 CG LYS A 119 -11.722 5.221 4.169 1.00 0.70 C ATOM 757 CD LYS A 119 -12.638 4.993 5.359 1.00 0.84 C ATOM 758 CE LYS A 119 -14.087 4.825 4.926 1.00 1.04 C ATOM 759 NZ LYS A 119 -14.641 6.071 4.332 1.00 1.69 N ATOM 0 H LYS A 119 -7.785 5.977 4.766 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.444 4.561 2.807 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -10.000 4.511 5.224 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -10.166 6.256 5.213 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -12.033 6.120 3.637 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -11.817 4.389 3.472 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -12.315 4.105 5.903 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -12.558 5.835 6.047 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -14.156 4.015 4.199 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -14.691 4.534 5.786 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -15.666 5.963 4.192 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -14.462 6.870 4.972 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -14.183 6.252 3.416 1.00 1.69 H new ATOM 773 N LEU A 120 -9.454 6.558 1.288 1.00 0.23 N ATOM 774 CA LEU A 120 -9.593 7.690 0.396 1.00 0.26 C ATOM 775 C LEU A 120 -11.062 8.009 0.204 1.00 0.34 C ATOM 776 O LEU A 120 -11.884 7.117 0.004 1.00 0.37 O ATOM 777 CB LEU A 120 -8.900 7.424 -0.948 1.00 0.24 C ATOM 778 CG LEU A 120 -7.370 7.297 -0.885 1.00 0.20 C ATOM 779 CD1 LEU A 120 -6.773 8.388 -0.009 1.00 0.25 C ATOM 780 CD2 LEU A 120 -6.953 5.926 -0.389 1.00 0.21 C ATOM 0 H LEU A 120 -9.272 5.670 0.820 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.103 8.554 0.844 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.307 6.506 -1.372 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -9.153 8.232 -1.634 1.00 0.24 H new ATOM 0 HG LEU A 120 -6.984 7.419 -1.897 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -5.689 8.278 0.021 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -7.028 9.365 -0.420 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.174 8.304 1.001 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -5.865 5.867 -0.355 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.356 5.762 0.610 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.337 5.162 -1.065 1.00 0.21 H new ATOM 792 N GLU A 121 -11.390 9.283 0.281 1.00 0.46 N ATOM 793 CA GLU A 121 -12.778 9.702 0.329 1.00 0.57 C ATOM 794 C GLU A 121 -13.370 9.871 -1.068 1.00 0.58 C ATOM 795 O GLU A 121 -14.589 9.913 -1.224 1.00 0.69 O ATOM 796 CB GLU A 121 -12.904 10.991 1.144 1.00 0.70 C ATOM 797 CG GLU A 121 -12.425 10.838 2.584 1.00 0.80 C ATOM 798 CD GLU A 121 -12.588 12.104 3.395 1.00 1.63 C ATOM 799 OE1 GLU A 121 -13.660 12.287 4.010 1.00 2.36 O ATOM 800 OE2 GLU A 121 -11.648 12.922 3.429 1.00 2.22 O ATOM 0 H GLU A 121 -10.715 10.047 0.312 1.00 0.46 H new ATOM 0 HA GLU A 121 -13.353 8.917 0.820 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -12.329 11.779 0.658 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -13.946 11.312 1.146 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -12.980 10.032 3.063 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -11.375 10.545 2.583 1.00 0.80 H new ATOM 807 N ASN A 122 -12.515 9.947 -2.084 1.00 0.53 N ATOM 808 CA ASN A 122 -13.003 10.040 -3.459 1.00 0.60 C ATOM 809 C ASN A 122 -12.139 9.224 -4.414 1.00 0.62 C ATOM 810 O ASN A 122 -12.653 8.603 -5.345 1.00 1.22 O ATOM 811 CB ASN A 122 -13.099 11.503 -3.939 1.00 0.73 C ATOM 812 CG ASN A 122 -11.753 12.202 -4.054 1.00 1.03 C ATOM 813 OD1 ASN A 122 -11.085 12.124 -5.085 1.00 1.16 O ATOM 814 ND2 ASN A 122 -11.358 12.911 -3.013 1.00 1.87 N ATOM 0 H ASN A 122 -11.500 9.946 -1.987 1.00 0.53 H new ATOM 0 HA ASN A 122 -14.009 9.621 -3.463 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -13.593 11.525 -4.910 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -13.730 12.062 -3.248 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -10.473 13.417 -3.047 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -11.938 12.953 -2.175 1.00 1.87 H new ATOM 821 N ALA A 123 -10.824 9.234 -4.171 1.00 0.67 N ATOM 822 CA ALA A 123 -9.857 8.468 -4.967 1.00 0.66 C ATOM 823 C ALA A 123 -9.823 8.911 -6.429 1.00 0.71 C ATOM 824 O ALA A 123 -9.221 8.249 -7.275 1.00 0.90 O ATOM 825 CB ALA A 123 -10.145 6.979 -4.873 1.00 0.69 C ATOM 0 H ALA A 123 -10.399 9.773 -3.417 1.00 0.67 H new ATOM 0 HA ALA A 123 -8.872 8.669 -4.546 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -9.417 6.429 -5.470 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -10.076 6.660 -3.833 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -11.148 6.778 -5.249 1.00 0.69 H new ATOM 831 N ARG A 124 -10.460 10.033 -6.712 1.00 0.72 N ATOM 832 CA ARG A 124 -10.504 10.588 -8.056 1.00 0.83 C ATOM 833 C ARG A 124 -9.345 11.555 -8.239 1.00 0.75 C ATOM 834 O ARG A 124 -8.662 11.553 -9.265 1.00 0.86 O ATOM 835 CB ARG A 124 -11.834 11.308 -8.280 1.00 1.08 C ATOM 836 CG ARG A 124 -13.049 10.415 -8.084 1.00 1.37 C ATOM 837 CD ARG A 124 -14.344 11.209 -8.116 1.00 1.63 C ATOM 838 NE ARG A 124 -15.493 10.379 -7.761 1.00 2.28 N ATOM 839 CZ ARG A 124 -16.644 10.854 -7.290 1.00 2.84 C ATOM 840 NH1 ARG A 124 -16.814 12.162 -7.141 1.00 2.76 N ATOM 841 NH2 ARG A 124 -17.623 10.020 -6.961 1.00 3.84 N ATOM 0 H ARG A 124 -10.962 10.586 -6.018 1.00 0.72 H new ATOM 0 HA ARG A 124 -10.418 9.783 -8.785 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -11.900 12.153 -7.595 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -11.852 11.715 -9.291 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -13.070 9.654 -8.864 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -12.966 9.893 -7.131 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -14.274 12.049 -7.425 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -14.490 11.627 -9.112 1.00 1.63 H new ATOM 0 HE ARG A 124 -15.408 9.370 -7.882 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -16.062 12.805 -7.388 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -17.697 12.524 -6.780 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -17.494 9.014 -7.069 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -18.504 10.385 -6.600 1.00 3.84 H new ATOM 855 N LYS A 125 -9.141 12.383 -7.228 1.00 0.75 N ATOM 856 CA LYS A 125 -7.998 13.277 -7.168 1.00 0.68 C ATOM 857 C LYS A 125 -6.795 12.504 -6.652 1.00 0.55 C ATOM 858 O LYS A 125 -6.968 11.420 -6.090 1.00 0.53 O ATOM 859 CB LYS A 125 -8.300 14.450 -6.229 1.00 0.79 C ATOM 860 CG LYS A 125 -9.577 15.199 -6.567 1.00 0.93 C ATOM 861 CD LYS A 125 -9.820 16.335 -5.588 1.00 1.64 C ATOM 862 CE LYS A 125 -11.121 17.060 -5.884 1.00 1.90 C ATOM 863 NZ LYS A 125 -11.345 18.189 -4.949 1.00 2.26 N ATOM 0 H LYS A 125 -9.765 12.454 -6.424 1.00 0.75 H new ATOM 0 HA LYS A 125 -7.787 13.669 -8.163 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -8.370 14.076 -5.208 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -7.463 15.148 -6.256 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -9.512 15.596 -7.580 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -10.422 14.511 -6.547 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -9.845 15.941 -4.572 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -8.991 17.041 -5.636 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -11.105 17.433 -6.908 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -11.953 16.359 -5.814 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -12.243 18.660 -5.182 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -11.386 17.829 -3.974 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -10.564 18.871 -5.034 1.00 2.26 H new ATOM 877 N PRO A 126 -5.565 13.020 -6.855 1.00 0.51 N ATOM 878 CA PRO A 126 -4.363 12.421 -6.280 1.00 0.45 C ATOM 879 C PRO A 126 -4.588 12.087 -4.813 1.00 0.39 C ATOM 880 O PRO A 126 -4.988 12.949 -4.028 1.00 0.47 O ATOM 881 CB PRO A 126 -3.287 13.506 -6.439 1.00 0.51 C ATOM 882 CG PRO A 126 -4.000 14.717 -6.951 1.00 0.59 C ATOM 883 CD PRO A 126 -5.239 14.215 -7.637 1.00 0.60 C ATOM 0 HA PRO A 126 -4.081 11.487 -6.767 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -2.798 13.714 -5.487 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -2.510 13.187 -7.134 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -4.254 15.393 -6.135 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -3.371 15.276 -7.644 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -6.044 14.950 -7.612 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -5.056 13.978 -8.685 1.00 0.60 H new ATOM 891 N LEU A 127 -4.347 10.834 -4.462 1.00 0.32 N ATOM 892 CA LEU A 127 -4.761 10.299 -3.175 1.00 0.26 C ATOM 893 C LEU A 127 -4.173 11.089 -2.017 1.00 0.29 C ATOM 894 O LEU A 127 -3.029 11.548 -2.065 1.00 0.37 O ATOM 895 CB LEU A 127 -4.398 8.823 -3.073 1.00 0.24 C ATOM 896 CG LEU A 127 -4.933 7.950 -4.214 1.00 0.26 C ATOM 897 CD1 LEU A 127 -4.750 6.481 -3.891 1.00 0.26 C ATOM 898 CD2 LEU A 127 -6.397 8.256 -4.500 1.00 0.27 C ATOM 0 H LEU A 127 -3.862 10.163 -5.057 1.00 0.32 H new ATOM 0 HA LEU A 127 -5.845 10.396 -3.108 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -3.312 8.731 -3.042 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -4.777 8.434 -2.128 1.00 0.24 H new ATOM 0 HG LEU A 127 -4.360 8.182 -5.111 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.136 5.877 -4.712 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -3.690 6.269 -3.751 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.292 6.239 -2.977 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -6.749 7.622 -5.314 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -6.990 8.063 -3.606 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -6.501 9.303 -4.785 1.00 0.27 H new ATOM 910 N LYS A 128 -4.974 11.231 -0.978 1.00 0.29 N ATOM 911 CA LYS A 128 -4.690 12.166 0.093 1.00 0.36 C ATOM 912 C LYS A 128 -4.332 11.475 1.401 1.00 0.26 C ATOM 913 O LYS A 128 -4.776 10.360 1.696 1.00 0.23 O ATOM 914 CB LYS A 128 -5.907 13.061 0.319 1.00 0.51 C ATOM 915 CG LYS A 128 -6.306 13.871 -0.904 1.00 1.10 C ATOM 916 CD LYS A 128 -5.241 14.886 -1.283 1.00 1.37 C ATOM 917 CE LYS A 128 -5.652 15.687 -2.508 1.00 1.80 C ATOM 918 NZ LYS A 128 -4.653 16.731 -2.852 1.00 2.27 N ATOM 0 H LYS A 128 -5.838 10.703 -0.853 1.00 0.29 H new ATOM 0 HA LYS A 128 -3.824 12.752 -0.214 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -6.750 12.442 0.625 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -5.697 13.743 1.143 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -6.482 13.198 -1.744 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -7.246 14.387 -0.707 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -5.066 15.562 -0.446 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -4.300 14.372 -1.481 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -5.779 15.013 -3.356 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -6.619 16.156 -2.326 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -4.972 17.253 -3.693 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -4.550 17.389 -2.054 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -3.736 16.282 -3.051 1.00 2.27 H new ATOM 932 N ASP A 129 -3.511 12.161 2.171 1.00 0.32 N ATOM 933 CA ASP A 129 -3.194 11.770 3.531 1.00 0.39 C ATOM 934 C ASP A 129 -4.276 12.277 4.475 1.00 0.45 C ATOM 935 O ASP A 129 -5.084 13.128 4.103 1.00 0.51 O ATOM 936 CB ASP A 129 -1.833 12.338 3.956 1.00 0.59 C ATOM 937 CG ASP A 129 -1.825 13.854 4.023 1.00 1.00 C ATOM 938 OD1 ASP A 129 -1.658 14.502 2.967 1.00 1.56 O ATOM 939 OD2 ASP A 129 -1.973 14.411 5.133 1.00 1.88 O ATOM 0 H ASP A 129 -3.040 13.014 1.868 1.00 0.32 H new ATOM 0 HA ASP A 129 -3.147 10.682 3.577 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -1.564 11.934 4.932 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -1.070 12.006 3.252 1.00 0.59 H new ATOM 944 N GLY A 130 -4.309 11.736 5.679 1.00 0.51 N ATOM 945 CA GLY A 130 -5.253 12.210 6.672 1.00 0.62 C ATOM 946 C GLY A 130 -6.149 11.110 7.186 1.00 0.60 C ATOM 947 O GLY A 130 -6.463 11.056 8.374 1.00 0.75 O ATOM 0 H GLY A 130 -3.701 10.978 5.990 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -4.708 12.650 7.507 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -5.865 13.001 6.239 1.00 0.62 H new ATOM 951 N ASN A 131 -6.566 10.230 6.293 1.00 0.47 N ATOM 952 CA ASN A 131 -7.350 9.077 6.685 1.00 0.46 C ATOM 953 C ASN A 131 -6.467 7.847 6.634 1.00 0.40 C ATOM 954 O ASN A 131 -6.134 7.366 5.556 1.00 0.46 O ATOM 955 CB ASN A 131 -8.551 8.883 5.756 1.00 0.51 C ATOM 956 CG ASN A 131 -9.448 10.104 5.671 1.00 1.32 C ATOM 957 OD1 ASN A 131 -10.377 10.268 6.463 1.00 2.28 O ATOM 958 ND2 ASN A 131 -9.192 10.959 4.691 1.00 1.45 N ATOM 0 H ASN A 131 -6.374 10.293 5.293 1.00 0.47 H new ATOM 0 HA ASN A 131 -7.727 9.235 7.696 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -8.192 8.634 4.757 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -9.138 8.033 6.105 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -9.774 11.788 4.573 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -8.413 10.788 4.055 1.00 1.45 H new ATOM 965 N VAL A 132 -6.081 7.348 7.789 1.00 0.36 N ATOM 966 CA VAL A 132 -5.213 6.191 7.861 1.00 0.31 C ATOM 967 C VAL A 132 -5.735 5.207 8.894 1.00 0.28 C ATOM 968 O VAL A 132 -6.144 5.588 9.990 1.00 0.35 O ATOM 969 CB VAL A 132 -3.752 6.587 8.187 1.00 0.35 C ATOM 970 CG1 VAL A 132 -3.673 7.374 9.482 1.00 0.73 C ATOM 971 CG2 VAL A 132 -2.857 5.355 8.256 1.00 0.71 C ATOM 0 H VAL A 132 -6.356 7.727 8.695 1.00 0.36 H new ATOM 0 HA VAL A 132 -5.214 5.716 6.880 1.00 0.31 H new ATOM 0 HB VAL A 132 -3.395 7.227 7.380 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -2.635 7.638 9.685 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -4.268 8.283 9.392 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -4.059 6.767 10.301 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -1.836 5.659 8.486 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -3.220 4.685 9.035 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.874 4.839 7.296 1.00 0.71 H new ATOM 981 N ILE A 133 -5.749 3.944 8.521 1.00 0.23 N ATOM 982 CA ILE A 133 -6.255 2.905 9.394 1.00 0.26 C ATOM 983 C ILE A 133 -5.099 2.091 9.958 1.00 0.28 C ATOM 984 O ILE A 133 -4.913 2.004 11.171 1.00 0.38 O ATOM 985 CB ILE A 133 -7.219 1.964 8.640 1.00 0.31 C ATOM 986 CG1 ILE A 133 -8.244 2.764 7.825 1.00 0.34 C ATOM 987 CG2 ILE A 133 -7.927 1.034 9.613 1.00 0.38 C ATOM 988 CD1 ILE A 133 -9.107 3.699 8.649 1.00 0.35 C ATOM 0 H ILE A 133 -5.415 3.611 7.616 1.00 0.23 H new ATOM 0 HA ILE A 133 -6.801 3.386 10.206 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.629 1.362 7.948 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.715 3.347 7.071 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.891 2.067 7.293 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -8.602 0.378 9.063 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.189 0.433 10.144 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.498 1.624 10.330 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.802 4.224 7.994 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.667 3.123 9.386 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.473 4.423 9.160 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.298 1.541 9.058 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.206 0.659 9.427 1.00 0.30 C ATOM 1002 C GLU A 134 -1.909 1.191 8.843 1.00 0.23 C ATOM 1003 O GLU A 134 -1.921 1.848 7.803 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.455 -0.753 8.891 1.00 0.43 C ATOM 1005 CG GLU A 134 -4.758 -1.382 9.359 1.00 0.63 C ATOM 1006 CD GLU A 134 -4.751 -1.724 10.833 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -4.247 -2.807 11.187 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -5.254 -0.921 11.641 1.00 1.42 O ATOM 0 H GLU A 134 -4.388 1.694 8.054 1.00 0.25 H new ATOM 0 HA GLU A 134 -3.139 0.620 10.514 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -3.452 -0.721 7.801 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -2.627 -1.394 9.193 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -5.580 -0.697 9.154 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -4.946 -2.287 8.782 1.00 0.63 H new ATOM 1015 N LYS A 135 -0.802 0.917 9.510 1.00 0.28 N ATOM 1016 CA LYS A 135 0.507 1.310 9.012 1.00 0.25 C ATOM 1017 C LYS A 135 1.610 0.533 9.707 1.00 0.27 C ATOM 1018 O LYS A 135 1.485 0.170 10.878 1.00 0.34 O ATOM 1019 CB LYS A 135 0.733 2.821 9.161 1.00 0.32 C ATOM 1020 CG LYS A 135 0.256 3.411 10.478 1.00 0.56 C ATOM 1021 CD LYS A 135 0.518 4.907 10.518 1.00 0.62 C ATOM 1022 CE LYS A 135 -0.127 5.573 11.721 1.00 0.74 C ATOM 1023 NZ LYS A 135 0.079 7.045 11.708 1.00 1.53 N ATOM 0 H LYS A 135 -0.782 0.422 10.402 1.00 0.28 H new ATOM 0 HA LYS A 135 0.538 1.071 7.949 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.798 3.027 9.051 1.00 0.32 H new ATOM 0 HB3 LYS A 135 0.223 3.332 8.344 1.00 0.32 H new ATOM 0 HG2 LYS A 135 -0.810 3.219 10.604 1.00 0.56 H new ATOM 0 HG3 LYS A 135 0.768 2.924 11.308 1.00 0.56 H new ATOM 0 HD2 LYS A 135 1.593 5.085 10.540 1.00 0.62 H new ATOM 0 HD3 LYS A 135 0.138 5.365 9.605 1.00 0.62 H new ATOM 0 HE2 LYS A 135 -1.195 5.355 11.729 1.00 0.74 H new ATOM 0 HE3 LYS A 135 0.291 5.155 12.637 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 -0.375 7.466 12.544 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 1.098 7.253 11.725 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 -0.342 7.447 10.846 1.00 1.53 H new ATOM 1037 N GLY A 136 2.683 0.280 8.975 1.00 0.30 N ATOM 1038 CA GLY A 136 3.777 -0.506 9.504 1.00 0.38 C ATOM 1039 C GLY A 136 4.928 -0.610 8.528 1.00 0.34 C ATOM 1040 O GLY A 136 5.238 0.354 7.828 1.00 0.29 O ATOM 0 H GLY A 136 2.816 0.607 8.018 1.00 0.30 H new ATOM 0 HA2 GLY A 136 4.129 -0.057 10.433 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.419 -1.506 9.749 1.00 0.38 H new ATOM 1044 N PHE A 137 5.550 -1.780 8.464 1.00 0.38 N ATOM 1045 CA PHE A 137 6.686 -1.990 7.577 1.00 0.32 C ATOM 1046 C PHE A 137 6.435 -3.147 6.602 1.00 0.33 C ATOM 1047 O PHE A 137 5.600 -4.020 6.846 1.00 0.46 O ATOM 1048 CB PHE A 137 7.978 -2.208 8.383 1.00 0.42 C ATOM 1049 CG PHE A 137 7.821 -3.045 9.628 1.00 1.07 C ATOM 1050 CD1 PHE A 137 7.291 -4.325 9.573 1.00 2.05 C ATOM 1051 CD2 PHE A 137 8.222 -2.546 10.858 1.00 1.81 C ATOM 1052 CE1 PHE A 137 7.162 -5.086 10.719 1.00 2.86 C ATOM 1053 CE2 PHE A 137 8.093 -3.303 12.005 1.00 2.60 C ATOM 1054 CZ PHE A 137 7.564 -4.574 11.936 1.00 2.93 C ATOM 0 H PHE A 137 5.287 -2.597 9.015 1.00 0.38 H new ATOM 0 HA PHE A 137 6.811 -1.087 6.980 1.00 0.32 H new ATOM 0 HB2 PHE A 137 8.716 -2.682 7.736 1.00 0.42 H new ATOM 0 HB3 PHE A 137 8.380 -1.235 8.666 1.00 0.42 H new ATOM 0 HD1 PHE A 137 6.975 -4.732 8.624 1.00 2.05 H new ATOM 0 HD2 PHE A 137 8.641 -1.552 10.919 1.00 1.81 H new ATOM 0 HE1 PHE A 137 6.747 -6.081 10.662 1.00 2.86 H new ATOM 0 HE2 PHE A 137 8.407 -2.899 12.956 1.00 2.60 H new ATOM 0 HZ PHE A 137 7.464 -5.168 12.832 1.00 2.93 H new ATOM 1064 N VAL A 138 7.160 -3.124 5.487 1.00 0.27 N ATOM 1065 CA VAL A 138 6.917 -4.031 4.362 1.00 0.41 C ATOM 1066 C VAL A 138 7.600 -5.397 4.538 1.00 0.70 C ATOM 1067 O VAL A 138 7.439 -6.288 3.707 1.00 1.41 O ATOM 1068 CB VAL A 138 7.359 -3.373 3.025 1.00 0.53 C ATOM 1069 CG1 VAL A 138 7.045 -4.257 1.828 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.693 -2.015 2.850 1.00 0.48 C ATOM 0 H VAL A 138 7.934 -2.477 5.335 1.00 0.27 H new ATOM 0 HA VAL A 138 5.843 -4.216 4.336 1.00 0.41 H new ATOM 0 HB VAL A 138 8.440 -3.242 3.074 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.370 -3.760 0.914 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.569 -5.207 1.930 1.00 0.76 H new ATOM 0 HG13 VAL A 138 5.971 -4.438 1.781 1.00 0.76 H new ATOM 0 HG21 VAL A 138 7.015 -1.570 1.908 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.610 -2.139 2.841 1.00 0.48 H new ATOM 0 HG23 VAL A 138 6.976 -1.362 3.675 1.00 0.48 H new ATOM 1080 N SER A 139 8.355 -5.561 5.615 1.00 0.32 N ATOM 1081 CA SER A 139 9.126 -6.786 5.837 1.00 0.51 C ATOM 1082 C SER A 139 8.242 -8.039 5.964 1.00 0.39 C ATOM 1083 O SER A 139 7.869 -8.456 7.064 1.00 1.13 O ATOM 1084 CB SER A 139 9.994 -6.616 7.078 1.00 1.03 C ATOM 1085 OG SER A 139 9.303 -5.882 8.070 1.00 1.68 O ATOM 0 H SER A 139 8.453 -4.863 6.352 1.00 0.32 H new ATOM 0 HA SER A 139 9.752 -6.944 4.959 1.00 0.51 H new ATOM 0 HB2 SER A 139 10.274 -7.594 7.470 1.00 1.03 H new ATOM 0 HB3 SER A 139 10.918 -6.102 6.815 1.00 1.03 H new ATOM 0 HG SER A 139 8.398 -6.244 8.174 1.00 1.68 H new ATOM 1091 N ASN A 140 7.903 -8.613 4.816 1.00 0.51 N ATOM 1092 CA ASN A 140 7.213 -9.892 4.734 1.00 0.34 C ATOM 1093 C ASN A 140 7.563 -10.544 3.402 1.00 0.27 C ATOM 1094 O ASN A 140 7.038 -10.169 2.355 1.00 0.37 O ATOM 1095 CB ASN A 140 5.698 -9.710 4.863 1.00 0.37 C ATOM 1096 CG ASN A 140 4.944 -11.028 4.833 1.00 0.38 C ATOM 1097 OD1 ASN A 140 4.529 -11.500 3.776 1.00 0.94 O ATOM 1098 ND2 ASN A 140 4.762 -11.633 5.994 1.00 0.88 N ATOM 0 H ASN A 140 8.102 -8.198 3.906 1.00 0.51 H new ATOM 0 HA ASN A 140 7.533 -10.531 5.557 1.00 0.34 H new ATOM 0 HB2 ASN A 140 5.477 -9.191 5.796 1.00 0.37 H new ATOM 0 HB3 ASN A 140 5.342 -9.074 4.052 1.00 0.37 H new ATOM 0 HD21 ASN A 140 4.263 -12.522 6.033 1.00 0.88 H new ATOM 0 HD22 ASN A 140 5.121 -11.211 6.851 1.00 0.88 H new ATOM 1105 N GLN A 141 8.472 -11.502 3.449 1.00 0.35 N ATOM 1106 CA GLN A 141 9.038 -12.089 2.244 1.00 0.32 C ATOM 1107 C GLN A 141 8.176 -13.238 1.731 1.00 0.30 C ATOM 1108 O GLN A 141 8.329 -14.380 2.170 1.00 0.36 O ATOM 1109 CB GLN A 141 10.447 -12.604 2.534 1.00 0.39 C ATOM 1110 CG GLN A 141 11.272 -12.870 1.288 1.00 0.39 C ATOM 1111 CD GLN A 141 11.855 -11.601 0.704 1.00 0.52 C ATOM 1112 OE1 GLN A 141 12.964 -11.198 1.052 1.00 0.69 O ATOM 1113 NE2 GLN A 141 11.115 -10.954 -0.183 1.00 0.63 N ATOM 0 H GLN A 141 8.838 -11.894 4.317 1.00 0.35 H new ATOM 0 HA GLN A 141 9.074 -11.316 1.477 1.00 0.32 H new ATOM 0 HB2 GLN A 141 10.969 -11.876 3.155 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.375 -13.524 3.114 1.00 0.39 H new ATOM 0 HG2 GLN A 141 12.080 -13.561 1.530 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.648 -13.359 0.539 1.00 0.39 H new ATOM 0 HE21 GLN A 141 10.200 -11.319 -0.447 1.00 0.63 H new ATOM 0 HE22 GLN A 141 11.460 -10.091 -0.602 1.00 0.63 H new ATOM 1122 N ILE A 142 7.275 -12.942 0.803 1.00 0.25 N ATOM 1123 CA ILE A 142 6.433 -13.980 0.216 1.00 0.27 C ATOM 1124 C ILE A 142 7.130 -14.647 -0.967 1.00 0.30 C ATOM 1125 O ILE A 142 6.739 -15.731 -1.400 1.00 0.37 O ATOM 1126 CB ILE A 142 5.057 -13.443 -0.237 1.00 0.27 C ATOM 1127 CG1 ILE A 142 5.210 -12.319 -1.268 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.266 -12.960 0.967 1.00 0.29 C ATOM 1129 CD1 ILE A 142 3.907 -11.936 -1.939 1.00 0.26 C ATOM 0 H ILE A 142 7.108 -12.002 0.443 1.00 0.25 H new ATOM 0 HA ILE A 142 6.264 -14.715 1.003 1.00 0.27 H new ATOM 0 HB ILE A 142 4.513 -14.258 -0.715 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.629 -11.441 -0.777 1.00 0.24 H new ATOM 0 HG13 ILE A 142 5.925 -12.630 -2.030 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.297 -12.583 0.639 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.117 -13.788 1.660 1.00 0.29 H new ATOM 0 HG23 ILE A 142 4.815 -12.162 1.467 1.00 0.29 H new ATOM 0 HD11 ILE A 142 4.089 -11.135 -2.656 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.497 -12.802 -2.458 1.00 0.26 H new ATOM 0 HD13 ILE A 142 3.197 -11.594 -1.186 1.00 0.26 H new ATOM 1141 N GLY A 143 8.161 -13.996 -1.479 1.00 0.28 N ATOM 1142 CA GLY A 143 8.944 -14.561 -2.561 1.00 0.34 C ATOM 1143 C GLY A 143 10.376 -14.095 -2.491 1.00 0.40 C ATOM 1144 O GLY A 143 10.685 -13.201 -1.710 1.00 0.53 O ATOM 0 H GLY A 143 8.473 -13.078 -1.163 1.00 0.28 H new ATOM 0 HA2 GLY A 143 8.909 -15.649 -2.510 1.00 0.34 H new ATOM 0 HA3 GLY A 143 8.510 -14.272 -3.518 1.00 0.34 H new ATOM 1148 N ASP A 144 11.240 -14.673 -3.315 1.00 0.48 N ATOM 1149 CA ASP A 144 12.674 -14.378 -3.269 1.00 0.56 C ATOM 1150 C ASP A 144 12.950 -12.892 -3.481 1.00 0.48 C ATOM 1151 O ASP A 144 13.866 -12.326 -2.879 1.00 0.56 O ATOM 1152 CB ASP A 144 13.418 -15.202 -4.321 1.00 0.70 C ATOM 1153 CG ASP A 144 14.914 -14.960 -4.300 1.00 1.63 C ATOM 1154 OD1 ASP A 144 15.393 -14.088 -5.051 1.00 2.49 O ATOM 1155 OD2 ASP A 144 15.621 -15.651 -3.538 1.00 2.30 O ATOM 0 H ASP A 144 10.975 -15.353 -4.028 1.00 0.48 H new ATOM 0 HA ASP A 144 13.035 -14.648 -2.276 1.00 0.56 H new ATOM 0 HB2 ASP A 144 13.223 -16.261 -4.153 1.00 0.70 H new ATOM 0 HB3 ASP A 144 13.028 -14.959 -5.310 1.00 0.70 H new ATOM 1160 N SER A 145 12.156 -12.265 -4.330 1.00 0.38 N ATOM 1161 CA SER A 145 12.285 -10.840 -4.590 1.00 0.35 C ATOM 1162 C SER A 145 10.941 -10.146 -4.422 1.00 0.31 C ATOM 1163 O SER A 145 10.667 -9.133 -5.064 1.00 0.36 O ATOM 1164 CB SER A 145 12.825 -10.620 -6.004 1.00 0.38 C ATOM 1165 OG SER A 145 12.078 -11.361 -6.958 1.00 1.08 O ATOM 0 H SER A 145 11.410 -12.722 -4.855 1.00 0.38 H new ATOM 0 HA SER A 145 12.984 -10.411 -3.872 1.00 0.35 H new ATOM 0 HB2 SER A 145 12.785 -9.559 -6.251 1.00 0.38 H new ATOM 0 HB3 SER A 145 13.873 -10.918 -6.047 1.00 0.38 H new ATOM 0 HG SER A 145 12.442 -11.202 -7.854 1.00 1.08 H new ATOM 1171 N LEU A 146 10.109 -10.683 -3.542 1.00 0.27 N ATOM 1172 CA LEU A 146 8.742 -10.216 -3.429 1.00 0.22 C ATOM 1173 C LEU A 146 8.336 -10.054 -1.967 1.00 0.21 C ATOM 1174 O LEU A 146 8.455 -10.990 -1.170 1.00 0.23 O ATOM 1175 CB LEU A 146 7.819 -11.209 -4.130 1.00 0.23 C ATOM 1176 CG LEU A 146 6.492 -10.644 -4.614 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.720 -9.582 -5.676 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.616 -11.757 -5.156 1.00 0.27 C ATOM 0 H LEU A 146 10.357 -11.437 -2.901 1.00 0.27 H new ATOM 0 HA LEU A 146 8.660 -9.238 -3.904 1.00 0.22 H new ATOM 0 HB2 LEU A 146 8.349 -11.628 -4.985 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.615 -12.033 -3.446 1.00 0.23 H new ATOM 0 HG LEU A 146 5.983 -10.179 -3.769 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.760 -9.189 -6.010 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.318 -8.772 -5.258 1.00 0.26 H new ATOM 0 HD13 LEU A 146 7.247 -10.022 -6.523 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.669 -11.340 -5.499 1.00 0.27 H new ATOM 0 HD22 LEU A 146 6.121 -12.245 -5.990 1.00 0.27 H new ATOM 0 HD23 LEU A 146 5.427 -12.487 -4.369 1.00 0.27 H new ATOM 1190 N TYR A 147 7.872 -8.862 -1.622 1.00 0.18 N ATOM 1191 CA TYR A 147 7.420 -8.562 -0.270 1.00 0.18 C ATOM 1192 C TYR A 147 5.922 -8.290 -0.273 1.00 0.16 C ATOM 1193 O TYR A 147 5.352 -7.962 -1.308 1.00 0.19 O ATOM 1194 CB TYR A 147 8.158 -7.345 0.295 1.00 0.19 C ATOM 1195 CG TYR A 147 9.609 -7.598 0.653 1.00 0.23 C ATOM 1196 CD1 TYR A 147 9.984 -7.889 1.959 1.00 1.21 C ATOM 1197 CD2 TYR A 147 10.603 -7.534 -0.314 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.309 -8.107 2.291 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.926 -7.754 0.008 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.276 -8.040 1.312 1.00 0.36 C ATOM 1201 OH TYR A 147 13.597 -8.256 1.633 1.00 0.43 O ATOM 0 H TYR A 147 7.798 -8.077 -2.269 1.00 0.18 H new ATOM 0 HA TYR A 147 7.635 -9.425 0.361 1.00 0.18 H new ATOM 0 HB2 TYR A 147 8.113 -6.538 -0.436 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.633 -6.999 1.185 1.00 0.19 H new ATOM 0 HD1 TYR A 147 9.228 -7.946 2.728 1.00 1.21 H new ATOM 0 HD2 TYR A 147 10.336 -7.308 -1.336 1.00 1.10 H new ATOM 0 HE1 TYR A 147 11.584 -8.328 3.312 1.00 1.24 H new ATOM 0 HE2 TYR A 147 12.686 -7.703 -0.758 1.00 1.10 H new ATOM 0 HH TYR A 147 13.805 -9.209 1.539 1.00 0.43 H new ATOM 1211 N LYS A 148 5.291 -8.419 0.881 1.00 0.17 N ATOM 1212 CA LYS A 148 3.854 -8.224 0.982 1.00 0.18 C ATOM 1213 C LYS A 148 3.490 -7.471 2.257 1.00 0.19 C ATOM 1214 O LYS A 148 4.128 -7.635 3.296 1.00 0.28 O ATOM 1215 CB LYS A 148 3.152 -9.584 0.946 1.00 0.26 C ATOM 1216 CG LYS A 148 1.632 -9.520 0.958 1.00 0.34 C ATOM 1217 CD LYS A 148 1.034 -10.910 0.801 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.481 -10.902 0.945 1.00 0.62 C ATOM 1219 NZ LYS A 148 -1.066 -12.251 0.727 1.00 0.84 N ATOM 0 H LYS A 148 5.750 -8.658 1.760 1.00 0.17 H new ATOM 0 HA LYS A 148 3.522 -7.622 0.136 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.472 -10.118 0.051 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.483 -10.171 1.803 1.00 0.26 H new ATOM 0 HG2 LYS A 148 1.289 -9.075 1.892 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.284 -8.876 0.151 1.00 0.34 H new ATOM 0 HD2 LYS A 148 1.303 -11.311 -0.176 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.465 -11.576 1.548 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -0.749 -10.547 1.940 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -0.910 -10.200 0.230 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -2.099 -12.203 0.834 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -0.832 -12.580 -0.231 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.676 -12.915 1.426 1.00 0.84 H new ATOM 1233 N ILE A 149 2.476 -6.628 2.161 1.00 0.15 N ATOM 1234 CA ILE A 149 1.948 -5.920 3.314 1.00 0.18 C ATOM 1235 C ILE A 149 0.452 -6.151 3.427 1.00 0.22 C ATOM 1236 O ILE A 149 -0.272 -6.063 2.439 1.00 0.35 O ATOM 1237 CB ILE A 149 2.247 -4.408 3.256 1.00 0.18 C ATOM 1238 CG1 ILE A 149 1.885 -3.816 1.889 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.704 -4.164 3.568 1.00 0.19 C ATOM 1240 CD1 ILE A 149 2.162 -2.332 1.775 1.00 0.20 C ATOM 0 H ILE A 149 1.998 -6.416 1.286 1.00 0.15 H new ATOM 0 HA ILE A 149 2.448 -6.318 4.197 1.00 0.18 H new ATOM 0 HB ILE A 149 1.630 -3.909 4.003 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.445 -4.341 1.116 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.828 -3.995 1.694 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.911 -3.095 3.526 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.930 -4.538 4.566 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.324 -4.683 2.837 1.00 0.19 H new ATOM 0 HD11 ILE A 149 1.881 -1.985 0.781 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.581 -1.795 2.525 1.00 0.20 H new ATOM 0 HD13 ILE A 149 3.224 -2.147 1.937 1.00 0.20 H new ATOM 1252 N GLU A 150 0.003 -6.471 4.627 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.387 -6.827 4.855 1.00 0.27 C ATOM 1254 C GLU A 150 -1.992 -5.986 5.962 1.00 0.24 C ATOM 1255 O GLU A 150 -1.301 -5.565 6.891 1.00 0.31 O ATOM 1256 CB GLU A 150 -1.492 -8.301 5.233 1.00 0.40 C ATOM 1257 CG GLU A 150 -0.988 -9.248 4.164 1.00 1.08 C ATOM 1258 CD GLU A 150 -1.015 -10.687 4.614 1.00 1.55 C ATOM 1259 OE1 GLU A 150 0.031 -11.192 5.071 1.00 2.03 O ATOM 1260 OE2 GLU A 150 -2.079 -11.330 4.512 1.00 2.30 O ATOM 0 H GLU A 150 0.585 -6.492 5.465 1.00 0.24 H new ATOM 0 HA GLU A 150 -1.936 -6.640 3.932 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -0.928 -8.471 6.150 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -2.534 -8.536 5.451 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -1.599 -9.139 3.268 1.00 1.08 H new ATOM 0 HG3 GLU A 150 0.031 -8.974 3.891 1.00 1.08 H new ATOM 1267 N THR A 151 -3.283 -5.739 5.850 1.00 0.21 N ATOM 1268 CA THR A 151 -4.023 -5.069 6.895 1.00 0.23 C ATOM 1269 C THR A 151 -4.370 -6.067 7.996 1.00 0.24 C ATOM 1270 O THR A 151 -4.833 -7.175 7.714 1.00 0.27 O ATOM 1271 CB THR A 151 -5.310 -4.445 6.333 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.154 -5.467 5.796 1.00 0.25 O ATOM 1273 CG2 THR A 151 -4.984 -3.435 5.246 1.00 0.29 C ATOM 0 H THR A 151 -3.843 -5.996 5.037 1.00 0.21 H new ATOM 0 HA THR A 151 -3.404 -4.272 7.306 1.00 0.23 H new ATOM 0 HB THR A 151 -5.827 -3.934 7.145 1.00 0.25 H new ATOM 0 HG1 THR A 151 -6.927 -5.596 6.385 1.00 0.25 H new ATOM 0 HG21 THR A 151 -5.908 -3.004 4.861 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.360 -2.643 5.660 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.450 -3.932 4.436 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.141 -5.669 9.242 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.301 -6.566 10.383 1.00 0.38 C ATOM 1283 C LYS A 152 -5.769 -6.940 10.608 1.00 0.39 C ATOM 1284 O LYS A 152 -6.071 -7.944 11.253 1.00 0.51 O ATOM 1285 CB LYS A 152 -3.716 -5.912 11.640 1.00 0.48 C ATOM 1286 CG LYS A 152 -3.786 -6.786 12.882 1.00 0.80 C ATOM 1287 CD LYS A 152 -3.148 -6.110 14.081 1.00 1.02 C ATOM 1288 CE LYS A 152 -3.266 -6.966 15.330 1.00 1.99 C ATOM 1289 NZ LYS A 152 -4.685 -7.195 15.715 1.00 2.42 N ATOM 0 H LYS A 152 -3.842 -4.726 9.490 1.00 0.31 H new ATOM 0 HA LYS A 152 -3.760 -7.488 10.168 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -2.675 -5.651 11.450 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.248 -4.980 11.833 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -4.827 -7.017 13.106 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -3.284 -7.734 12.689 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -2.097 -5.912 13.872 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -3.626 -5.145 14.253 1.00 1.02 H new ATOM 0 HE2 LYS A 152 -2.777 -7.925 15.160 1.00 1.99 H new ATOM 0 HE3 LYS A 152 -2.740 -6.482 16.153 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 -4.725 -7.572 16.683 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 -5.206 -6.296 15.671 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 -5.117 -7.877 15.060 1.00 2.42 H new ATOM 1303 N LYS A 153 -6.674 -6.144 10.067 1.00 0.37 N ATOM 1304 CA LYS A 153 -8.101 -6.397 10.221 1.00 0.43 C ATOM 1305 C LYS A 153 -8.837 -6.149 8.909 1.00 0.40 C ATOM 1306 O LYS A 153 -8.319 -5.473 8.017 1.00 0.40 O ATOM 1307 CB LYS A 153 -8.680 -5.510 11.330 1.00 0.51 C ATOM 1308 CG LYS A 153 -8.496 -4.018 11.092 1.00 0.57 C ATOM 1309 CD LYS A 153 -9.147 -3.201 12.193 1.00 0.66 C ATOM 1310 CE LYS A 153 -8.966 -1.710 11.963 1.00 0.69 C ATOM 1311 NZ LYS A 153 -9.747 -0.901 12.934 1.00 1.29 N ATOM 0 H LYS A 153 -6.449 -5.316 9.516 1.00 0.37 H new ATOM 0 HA LYS A 153 -8.237 -7.442 10.499 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -9.744 -5.722 11.432 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.210 -5.777 12.277 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -7.433 -3.784 11.042 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -8.928 -3.745 10.129 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -10.210 -3.436 12.241 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -8.716 -3.477 13.155 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -7.909 -1.456 12.045 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -9.276 -1.459 10.949 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -9.597 0.110 12.744 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -10.758 -1.125 12.838 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -9.434 -1.121 13.901 1.00 1.29 H new ATOM 1325 N LYS A 154 -10.038 -6.709 8.798 1.00 0.43 N ATOM 1326 CA LYS A 154 -10.863 -6.538 7.607 1.00 0.44 C ATOM 1327 C LYS A 154 -11.377 -5.107 7.526 1.00 0.53 C ATOM 1328 O LYS A 154 -11.765 -4.517 8.536 1.00 0.67 O ATOM 1329 CB LYS A 154 -12.034 -7.524 7.625 1.00 0.44 C ATOM 1330 CG LYS A 154 -11.599 -8.981 7.615 1.00 0.47 C ATOM 1331 CD LYS A 154 -12.790 -9.922 7.650 1.00 0.54 C ATOM 1332 CE LYS A 154 -12.345 -11.371 7.748 1.00 0.66 C ATOM 1333 NZ LYS A 154 -13.494 -12.308 7.856 1.00 1.41 N ATOM 0 H LYS A 154 -10.463 -7.288 9.522 1.00 0.43 H new ATOM 0 HA LYS A 154 -10.253 -6.741 6.727 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.640 -7.340 8.512 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.670 -7.337 6.760 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -11.006 -9.178 6.722 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -10.956 -9.175 8.474 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -13.426 -9.676 8.501 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -13.392 -9.784 6.752 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -11.752 -11.627 6.870 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -11.698 -11.492 8.616 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -13.141 -13.284 7.920 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -14.047 -12.083 8.708 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -14.099 -12.213 7.016 1.00 1.41 H new ATOM 1347 N MET A 155 -11.378 -4.549 6.328 1.00 0.61 N ATOM 1348 CA MET A 155 -11.696 -3.142 6.150 1.00 0.76 C ATOM 1349 C MET A 155 -13.183 -2.895 5.954 1.00 0.62 C ATOM 1350 O MET A 155 -13.911 -3.716 5.387 1.00 0.57 O ATOM 1351 CB MET A 155 -10.892 -2.566 4.990 1.00 1.01 C ATOM 1352 CG MET A 155 -9.423 -2.434 5.330 1.00 1.22 C ATOM 1353 SD MET A 155 -9.165 -1.398 6.784 1.00 0.95 S ATOM 1354 CE MET A 155 -7.710 -2.157 7.491 1.00 0.80 C ATOM 0 H MET A 155 -11.163 -5.047 5.465 1.00 0.61 H new ATOM 0 HA MET A 155 -11.418 -2.629 7.071 1.00 0.76 H new ATOM 0 HB2 MET A 155 -11.006 -3.207 4.116 1.00 1.01 H new ATOM 0 HB3 MET A 155 -11.292 -1.588 4.722 1.00 1.01 H new ATOM 0 HG2 MET A 155 -9.000 -3.423 5.508 1.00 1.22 H new ATOM 0 HG3 MET A 155 -8.890 -2.008 4.480 1.00 1.22 H new ATOM 0 HE1 MET A 155 -7.479 -1.683 8.445 1.00 0.80 H new ATOM 0 HE2 MET A 155 -7.894 -3.220 7.649 1.00 0.80 H new ATOM 0 HE3 MET A 155 -6.868 -2.032 6.811 1.00 0.80 H new ATOM 1364 N LYS A 156 -13.612 -1.748 6.460 1.00 0.65 N ATOM 1365 CA LYS A 156 -14.995 -1.309 6.395 1.00 0.59 C ATOM 1366 C LYS A 156 -15.298 -0.723 5.019 1.00 0.44 C ATOM 1367 O LYS A 156 -14.380 -0.441 4.254 1.00 0.42 O ATOM 1368 CB LYS A 156 -15.234 -0.256 7.484 1.00 0.72 C ATOM 1369 CG LYS A 156 -15.008 -0.775 8.895 1.00 1.28 C ATOM 1370 CD LYS A 156 -16.029 -1.838 9.270 1.00 1.79 C ATOM 1371 CE LYS A 156 -15.747 -2.417 10.647 1.00 2.54 C ATOM 1372 NZ LYS A 156 -16.763 -3.423 11.051 1.00 3.40 N ATOM 0 H LYS A 156 -12.997 -1.087 6.935 1.00 0.65 H new ATOM 0 HA LYS A 156 -15.657 -2.160 6.558 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -14.573 0.593 7.308 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -16.256 0.114 7.402 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -14.003 -1.190 8.974 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -15.067 0.053 9.602 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -17.029 -1.406 9.253 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -16.014 -2.636 8.528 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -14.760 -2.879 10.650 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -15.724 -1.611 11.381 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -16.531 -3.791 11.996 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -17.703 -2.978 11.074 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -16.768 -4.206 10.366 1.00 3.40 H new ATOM 1386 N PRO A 157 -16.589 -0.564 4.675 1.00 0.46 N ATOM 1387 CA PRO A 157 -17.006 0.046 3.407 1.00 0.41 C ATOM 1388 C PRO A 157 -16.313 1.380 3.126 1.00 0.37 C ATOM 1389 O PRO A 157 -16.423 2.328 3.908 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.515 0.272 3.577 1.00 0.52 C ATOM 1391 CG PRO A 157 -18.826 -0.056 5.001 1.00 0.63 C ATOM 1392 CD PRO A 157 -17.746 -0.984 5.471 1.00 0.63 C ATOM 0 HA PRO A 157 -16.745 -0.596 2.566 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.783 1.303 3.347 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -19.083 -0.364 2.898 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -18.853 0.848 5.610 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -19.806 -0.527 5.085 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -17.561 -0.881 6.540 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -18.003 -2.028 5.292 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.603 1.441 2.010 1.00 0.32 N ATOM 1401 CA GLY A 158 -14.944 2.661 1.611 1.00 0.33 C ATOM 1402 C GLY A 158 -13.845 2.412 0.606 1.00 0.27 C ATOM 1403 O GLY A 158 -13.670 1.289 0.132 1.00 0.27 O ATOM 0 H GLY A 158 -15.472 0.658 1.370 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.677 3.345 1.183 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.526 3.151 2.490 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.096 3.453 0.292 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.017 3.357 -0.673 1.00 0.26 C ATOM 1409 C ILE A 159 -10.693 3.283 0.063 1.00 0.21 C ATOM 1410 O ILE A 159 -10.459 4.049 0.992 1.00 0.24 O ATOM 1411 CB ILE A 159 -11.990 4.568 -1.626 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.384 4.831 -2.206 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -10.976 4.342 -2.739 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.451 6.051 -3.099 1.00 0.44 C ATOM 0 H ILE A 159 -13.217 4.382 0.695 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.181 2.459 -1.268 1.00 0.26 H new ATOM 0 HB ILE A 159 -11.688 5.449 -1.059 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.702 3.957 -2.775 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.092 4.952 -1.386 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -10.968 5.205 -3.404 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -9.985 4.208 -2.306 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -11.249 3.451 -3.304 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.468 6.173 -3.472 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.165 6.935 -2.529 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -12.769 5.925 -3.940 1.00 0.44 H new ATOM 1426 N TYR A 160 -9.839 2.361 -0.331 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.564 2.199 0.339 1.00 0.17 C ATOM 1428 C TYR A 160 -7.426 2.109 -0.660 1.00 0.16 C ATOM 1429 O TYR A 160 -7.616 1.690 -1.799 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.580 0.956 1.234 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.531 1.071 2.407 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -9.110 1.620 3.613 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -10.848 0.639 2.311 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -9.972 1.733 4.683 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -11.715 0.751 3.380 1.00 1.24 C ATOM 1436 CZ TYR A 160 -11.272 1.299 4.564 1.00 0.35 C ATOM 1437 OH TYR A 160 -12.130 1.414 5.636 1.00 0.43 O ATOM 0 H TYR A 160 -10.002 1.717 -1.105 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.402 3.079 0.961 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -8.858 0.089 0.634 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.573 0.774 1.609 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -8.091 1.964 3.713 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -11.200 0.208 1.385 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -9.627 2.161 5.613 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -12.736 0.411 3.288 1.00 1.24 H new ATOM 0 HH TYR A 160 -12.943 0.896 5.461 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.254 2.532 -0.221 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.040 2.434 -1.010 1.00 0.14 C ATOM 1449 C ALA A 161 -3.837 2.424 -0.086 1.00 0.14 C ATOM 1450 O ALA A 161 -3.915 2.896 1.054 1.00 0.14 O ATOM 1451 CB ALA A 161 -4.939 3.586 -1.996 1.00 0.14 C ATOM 0 H ALA A 161 -6.117 2.955 0.697 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.066 1.506 -1.581 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.021 3.490 -2.575 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -5.796 3.565 -2.669 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -4.928 4.531 -1.452 1.00 0.14 H new ATOM 1457 N PHE A 162 -2.733 1.884 -0.568 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.523 1.802 0.230 1.00 0.15 C ATOM 1459 C PHE A 162 -0.562 2.926 -0.129 1.00 0.15 C ATOM 1460 O PHE A 162 -0.256 3.148 -1.302 1.00 0.15 O ATOM 1461 CB PHE A 162 -0.840 0.444 0.045 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.608 -0.702 0.647 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -1.392 -1.078 1.964 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -2.539 -1.408 -0.101 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -2.089 -2.131 2.524 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -3.238 -2.462 0.456 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.013 -2.824 1.769 1.00 0.24 C ATOM 0 H PHE A 162 -2.649 1.496 -1.507 1.00 0.14 H new ATOM 0 HA PHE A 162 -1.805 1.908 1.278 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -0.701 0.258 -1.020 1.00 0.17 H new ATOM 0 HB3 PHE A 162 0.153 0.481 0.494 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -0.669 -0.540 2.560 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -2.719 -1.131 -1.129 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -1.911 -2.412 3.552 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -3.961 -3.003 -0.136 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.559 -3.648 2.204 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.110 3.635 0.894 1.00 0.16 N ATOM 1478 CA LYS A 163 0.836 4.726 0.728 1.00 0.18 C ATOM 1479 C LYS A 163 2.196 4.313 1.270 1.00 0.20 C ATOM 1480 O LYS A 163 2.413 4.318 2.481 1.00 0.23 O ATOM 1481 CB LYS A 163 0.350 5.979 1.477 1.00 0.23 C ATOM 1482 CG LYS A 163 1.310 7.166 1.392 1.00 0.31 C ATOM 1483 CD LYS A 163 0.880 8.299 2.323 1.00 0.45 C ATOM 1484 CE LYS A 163 1.905 9.426 2.362 1.00 0.74 C ATOM 1485 NZ LYS A 163 1.993 10.147 1.065 1.00 1.28 N ATOM 0 H LYS A 163 -0.389 3.470 1.861 1.00 0.16 H new ATOM 0 HA LYS A 163 0.917 4.956 -0.334 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.618 6.278 1.074 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.194 5.725 2.526 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.317 6.841 1.653 1.00 0.31 H new ATOM 0 HG3 LYS A 163 1.349 7.531 0.366 1.00 0.31 H new ATOM 0 HD2 LYS A 163 -0.081 8.694 1.993 1.00 0.45 H new ATOM 0 HD3 LYS A 163 0.735 7.906 3.329 1.00 0.45 H new ATOM 0 HE2 LYS A 163 1.639 10.130 3.150 1.00 0.74 H new ATOM 0 HE3 LYS A 163 2.883 9.017 2.616 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 2.689 10.916 1.142 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 2.288 9.485 0.319 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 1.063 10.545 0.825 1.00 1.28 H new ATOM 1499 N VAL A 164 3.097 3.935 0.384 1.00 0.22 N ATOM 1500 CA VAL A 164 4.455 3.624 0.792 1.00 0.26 C ATOM 1501 C VAL A 164 5.346 4.822 0.483 1.00 0.33 C ATOM 1502 O VAL A 164 5.252 5.410 -0.594 1.00 0.34 O ATOM 1503 CB VAL A 164 4.990 2.336 0.109 1.00 0.28 C ATOM 1504 CG1 VAL A 164 4.053 1.168 0.373 1.00 0.27 C ATOM 1505 CG2 VAL A 164 5.186 2.530 -1.384 1.00 0.29 C ATOM 0 H VAL A 164 2.917 3.836 -0.615 1.00 0.22 H new ATOM 0 HA VAL A 164 4.463 3.426 1.864 1.00 0.26 H new ATOM 0 HB VAL A 164 5.965 2.114 0.543 1.00 0.28 H new ATOM 0 HG11 VAL A 164 4.442 0.273 -0.112 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.980 0.996 1.447 1.00 0.27 H new ATOM 0 HG13 VAL A 164 3.065 1.397 -0.026 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.561 1.606 -1.825 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.234 2.791 -1.845 1.00 0.29 H new ATOM 0 HG23 VAL A 164 5.904 3.332 -1.556 1.00 0.29 H new ATOM 1515 N TYR A 165 6.165 5.227 1.438 1.00 0.45 N ATOM 1516 CA TYR A 165 6.996 6.406 1.249 1.00 0.57 C ATOM 1517 C TYR A 165 8.428 6.144 1.682 1.00 0.70 C ATOM 1518 O TYR A 165 9.048 6.973 2.351 1.00 1.67 O ATOM 1519 CB TYR A 165 6.404 7.620 1.988 1.00 0.62 C ATOM 1520 CG TYR A 165 6.091 7.392 3.456 1.00 0.63 C ATOM 1521 CD1 TYR A 165 4.802 7.078 3.874 1.00 1.30 C ATOM 1522 CD2 TYR A 165 7.081 7.513 4.426 1.00 1.38 C ATOM 1523 CE1 TYR A 165 4.513 6.891 5.214 1.00 1.31 C ATOM 1524 CE2 TYR A 165 6.799 7.323 5.762 1.00 1.45 C ATOM 1525 CZ TYR A 165 5.515 7.014 6.151 1.00 0.79 C ATOM 1526 OH TYR A 165 5.236 6.834 7.484 1.00 0.93 O ATOM 0 H TYR A 165 6.273 4.765 2.341 1.00 0.45 H new ATOM 0 HA TYR A 165 7.011 6.637 0.184 1.00 0.57 H new ATOM 0 HB2 TYR A 165 7.104 8.452 1.907 1.00 0.62 H new ATOM 0 HB3 TYR A 165 5.488 7.923 1.480 1.00 0.62 H new ATOM 0 HD1 TYR A 165 4.015 6.979 3.141 1.00 1.30 H new ATOM 0 HD2 TYR A 165 8.089 7.760 4.127 1.00 1.38 H new ATOM 0 HE1 TYR A 165 3.507 6.650 5.524 1.00 1.31 H new ATOM 0 HE2 TYR A 165 7.582 7.416 6.500 1.00 1.45 H new ATOM 0 HH TYR A 165 4.496 6.198 7.580 1.00 0.93 H new ATOM 1536 N LYS A 166 8.946 4.983 1.276 1.00 0.48 N ATOM 1537 CA LYS A 166 10.325 4.599 1.567 1.00 0.49 C ATOM 1538 C LYS A 166 10.469 4.261 3.065 1.00 0.46 C ATOM 1539 O LYS A 166 9.486 4.340 3.806 1.00 0.55 O ATOM 1540 CB LYS A 166 11.282 5.730 1.123 1.00 0.57 C ATOM 1541 CG LYS A 166 11.140 6.116 -0.347 1.00 0.71 C ATOM 1542 CD LYS A 166 11.443 4.951 -1.275 1.00 0.94 C ATOM 1543 CE LYS A 166 11.072 5.270 -2.719 1.00 1.35 C ATOM 1544 NZ LYS A 166 11.834 6.427 -3.254 1.00 1.53 N ATOM 0 H LYS A 166 8.425 4.289 0.741 1.00 0.48 H new ATOM 0 HA LYS A 166 10.593 3.703 1.007 1.00 0.49 H new ATOM 0 HB2 LYS A 166 11.100 6.610 1.739 1.00 0.57 H new ATOM 0 HB3 LYS A 166 12.310 5.418 1.309 1.00 0.57 H new ATOM 0 HG2 LYS A 166 10.127 6.472 -0.532 1.00 0.71 H new ATOM 0 HG3 LYS A 166 11.814 6.943 -0.571 1.00 0.71 H new ATOM 0 HD2 LYS A 166 12.504 4.706 -1.217 1.00 0.94 H new ATOM 0 HD3 LYS A 166 10.894 4.070 -0.944 1.00 0.94 H new ATOM 0 HE2 LYS A 166 11.259 4.395 -3.342 1.00 1.35 H new ATOM 0 HE3 LYS A 166 10.004 5.482 -2.779 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 11.187 7.227 -3.409 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 12.569 6.703 -2.573 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 12.279 6.162 -4.156 1.00 1.53 H new ATOM 1558 N PRO A 167 11.656 3.817 3.537 1.00 0.44 N ATOM 1559 CA PRO A 167 11.866 3.529 4.967 1.00 0.47 C ATOM 1560 C PRO A 167 11.607 4.746 5.856 1.00 0.47 C ATOM 1561 O PRO A 167 11.908 5.884 5.483 1.00 0.50 O ATOM 1562 CB PRO A 167 13.341 3.117 5.032 1.00 0.58 C ATOM 1563 CG PRO A 167 13.641 2.619 3.665 1.00 0.60 C ATOM 1564 CD PRO A 167 12.868 3.518 2.746 1.00 0.49 C ATOM 0 HA PRO A 167 11.179 2.766 5.333 1.00 0.47 H new ATOM 0 HB2 PRO A 167 13.979 3.960 5.297 1.00 0.58 H new ATOM 0 HB3 PRO A 167 13.506 2.344 5.783 1.00 0.58 H new ATOM 0 HG2 PRO A 167 14.710 2.664 3.454 1.00 0.60 H new ATOM 0 HG3 PRO A 167 13.336 1.579 3.548 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.425 4.422 2.499 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.627 3.025 1.804 1.00 0.49 H new ATOM 1572 N ALA A 168 11.039 4.491 7.032 1.00 0.53 N ATOM 1573 CA ALA A 168 10.703 5.550 7.976 1.00 0.64 C ATOM 1574 C ALA A 168 11.941 6.352 8.367 1.00 0.71 C ATOM 1575 O ALA A 168 12.951 5.787 8.794 1.00 0.76 O ATOM 1576 CB ALA A 168 10.044 4.960 9.215 1.00 0.72 C ATOM 0 H ALA A 168 10.801 3.553 7.354 1.00 0.53 H new ATOM 0 HA ALA A 168 10.002 6.228 7.489 1.00 0.64 H new ATOM 0 HB1 ALA A 168 9.798 5.761 9.912 1.00 0.72 H new ATOM 0 HB2 ALA A 168 9.132 4.436 8.928 1.00 0.72 H new ATOM 0 HB3 ALA A 168 10.729 4.260 9.693 1.00 0.72 H new ATOM 1582 N GLY A 169 11.857 7.665 8.230 1.00 0.82 N ATOM 1583 CA GLY A 169 13.002 8.511 8.489 1.00 0.95 C ATOM 1584 C GLY A 169 13.517 9.158 7.220 1.00 0.96 C ATOM 1585 O GLY A 169 14.295 10.111 7.271 1.00 1.14 O ATOM 0 H GLY A 169 11.014 8.162 7.943 1.00 0.82 H new ATOM 0 HA2 GLY A 169 12.729 9.284 9.207 1.00 0.95 H new ATOM 0 HA3 GLY A 169 13.796 7.920 8.945 1.00 0.95 H new ATOM 1589 N TYR A 170 13.082 8.639 6.080 1.00 0.80 N ATOM 1590 CA TYR A 170 13.448 9.204 4.789 1.00 0.82 C ATOM 1591 C TYR A 170 12.529 10.384 4.460 1.00 0.86 C ATOM 1592 O TYR A 170 11.318 10.205 4.329 1.00 0.89 O ATOM 1593 CB TYR A 170 13.332 8.127 3.705 1.00 0.83 C ATOM 1594 CG TYR A 170 13.985 8.488 2.384 1.00 0.91 C ATOM 1595 CD1 TYR A 170 15.213 7.944 2.029 1.00 1.15 C ATOM 1596 CD2 TYR A 170 13.372 9.358 1.487 1.00 1.74 C ATOM 1597 CE1 TYR A 170 15.809 8.253 0.822 1.00 1.21 C ATOM 1598 CE2 TYR A 170 13.968 9.673 0.280 1.00 1.82 C ATOM 1599 CZ TYR A 170 15.184 9.117 -0.047 1.00 1.11 C ATOM 1600 OH TYR A 170 15.772 9.417 -1.256 1.00 1.24 O ATOM 0 H TYR A 170 12.472 7.823 6.024 1.00 0.80 H new ATOM 0 HA TYR A 170 14.478 9.560 4.828 1.00 0.82 H new ATOM 0 HB2 TYR A 170 13.780 7.206 4.077 1.00 0.83 H new ATOM 0 HB3 TYR A 170 12.277 7.919 3.529 1.00 0.83 H new ATOM 0 HD1 TYR A 170 15.710 7.268 2.709 1.00 1.15 H new ATOM 0 HD2 TYR A 170 12.416 9.794 1.738 1.00 1.74 H new ATOM 0 HE1 TYR A 170 16.762 7.818 0.561 1.00 1.21 H new ATOM 0 HE2 TYR A 170 13.481 10.353 -0.404 1.00 1.82 H new ATOM 0 HH TYR A 170 15.201 10.041 -1.752 1.00 1.24 H new ATOM 1610 N PRO A 171 13.076 11.608 4.346 1.00 0.97 N ATOM 1611 CA PRO A 171 12.275 12.796 4.025 1.00 1.10 C ATOM 1612 C PRO A 171 11.657 12.719 2.629 1.00 1.07 C ATOM 1613 O PRO A 171 12.366 12.562 1.630 1.00 1.05 O ATOM 1614 CB PRO A 171 13.278 13.952 4.104 1.00 1.25 C ATOM 1615 CG PRO A 171 14.615 13.316 3.933 1.00 1.31 C ATOM 1616 CD PRO A 171 14.501 11.940 4.529 1.00 1.07 C ATOM 0 HA PRO A 171 11.432 12.907 4.707 1.00 1.10 H new ATOM 0 HB2 PRO A 171 13.090 14.691 3.325 1.00 1.25 H new ATOM 0 HB3 PRO A 171 13.207 14.471 5.060 1.00 1.25 H new ATOM 0 HG2 PRO A 171 14.890 13.263 2.879 1.00 1.31 H new ATOM 0 HG3 PRO A 171 15.389 13.896 4.435 1.00 1.31 H new ATOM 0 HD2 PRO A 171 15.149 11.226 4.020 1.00 1.07 H new ATOM 0 HD3 PRO A 171 14.784 11.933 5.582 1.00 1.07 H new ATOM 1624 N ALA A 172 10.337 12.831 2.564 1.00 1.22 N ATOM 1625 CA ALA A 172 9.625 12.751 1.297 1.00 1.31 C ATOM 1626 C ALA A 172 9.699 14.078 0.547 1.00 1.40 C ATOM 1627 O ALA A 172 8.887 14.980 0.768 1.00 1.67 O ATOM 1628 CB ALA A 172 8.178 12.338 1.526 1.00 1.60 C ATOM 0 H ALA A 172 9.737 12.978 3.376 1.00 1.22 H new ATOM 0 HA ALA A 172 10.106 11.991 0.681 1.00 1.31 H new ATOM 0 HB1 ALA A 172 7.660 12.283 0.569 1.00 1.60 H new ATOM 0 HB2 ALA A 172 8.151 11.362 2.010 1.00 1.60 H new ATOM 0 HB3 ALA A 172 7.686 13.073 2.163 1.00 1.60 H new ATOM 1634 N ASN A 173 10.677 14.187 -0.338 1.00 1.38 N ATOM 1635 CA ASN A 173 10.878 15.390 -1.133 1.00 1.53 C ATOM 1636 C ASN A 173 10.816 15.048 -2.613 1.00 1.91 C ATOM 1637 O ASN A 173 11.514 14.144 -3.074 1.00 2.60 O ATOM 1638 CB ASN A 173 12.231 16.035 -0.815 1.00 1.89 C ATOM 1639 CG ASN A 173 12.287 16.651 0.569 1.00 2.51 C ATOM 1640 OD1 ASN A 173 11.278 17.118 1.100 1.00 2.97 O ATOM 1641 ND2 ASN A 173 13.469 16.660 1.162 1.00 3.18 N ATOM 0 H ASN A 173 11.353 13.447 -0.526 1.00 1.38 H new ATOM 0 HA ASN A 173 10.087 16.098 -0.886 1.00 1.53 H new ATOM 0 HB2 ASN A 173 13.015 15.283 -0.903 1.00 1.89 H new ATOM 0 HB3 ASN A 173 12.443 16.805 -1.557 1.00 1.89 H new ATOM 0 HD21 ASN A 173 13.569 17.064 2.093 1.00 3.18 H new ATOM 0 HD22 ASN A 173 14.280 16.263 0.688 1.00 3.18 H new ATOM 1648 N GLY A 174 9.977 15.759 -3.352 1.00 2.02 N ATOM 1649 CA GLY A 174 9.846 15.500 -4.771 1.00 2.69 C ATOM 1650 C GLY A 174 8.914 14.342 -5.048 1.00 2.26 C ATOM 1651 O GLY A 174 9.120 13.587 -5.999 1.00 2.93 O ATOM 0 H GLY A 174 9.385 16.509 -2.995 1.00 2.02 H new ATOM 0 HA2 GLY A 174 9.473 16.394 -5.270 1.00 2.69 H new ATOM 0 HA3 GLY A 174 10.828 15.285 -5.193 1.00 2.69 H new ATOM 1655 N SER A 175 7.895 14.207 -4.202 1.00 1.44 N ATOM 1656 CA SER A 175 6.938 13.109 -4.292 1.00 1.23 C ATOM 1657 C SER A 175 7.655 11.765 -4.170 1.00 0.94 C ATOM 1658 O SER A 175 7.761 11.009 -5.135 1.00 1.36 O ATOM 1659 CB SER A 175 6.143 13.189 -5.600 1.00 1.79 C ATOM 1660 OG SER A 175 5.514 14.455 -5.733 1.00 2.26 O ATOM 0 H SER A 175 7.711 14.855 -3.436 1.00 1.44 H new ATOM 0 HA SER A 175 6.233 13.196 -3.465 1.00 1.23 H new ATOM 0 HB2 SER A 175 6.809 13.018 -6.446 1.00 1.79 H new ATOM 0 HB3 SER A 175 5.391 12.400 -5.622 1.00 1.79 H new ATOM 0 HG SER A 175 5.014 14.485 -6.575 1.00 2.26 H new ATOM 1666 N THR A 176 8.157 11.483 -2.975 1.00 0.64 N ATOM 1667 CA THR A 176 8.881 10.244 -2.721 1.00 0.90 C ATOM 1668 C THR A 176 7.922 9.135 -2.281 1.00 0.80 C ATOM 1669 O THR A 176 8.339 8.062 -1.844 1.00 1.05 O ATOM 1670 CB THR A 176 9.953 10.458 -1.637 1.00 1.30 C ATOM 1671 OG1 THR A 176 10.549 11.749 -1.801 1.00 1.49 O ATOM 1672 CG2 THR A 176 11.039 9.400 -1.724 1.00 1.76 C ATOM 0 H THR A 176 8.076 12.097 -2.164 1.00 0.64 H new ATOM 0 HA THR A 176 9.366 9.943 -3.650 1.00 0.90 H new ATOM 0 HB THR A 176 9.469 10.384 -0.663 1.00 1.30 H new ATOM 0 HG1 THR A 176 11.513 11.687 -1.639 1.00 1.49 H new ATOM 0 HG21 THR A 176 11.782 9.577 -0.946 1.00 1.76 H new ATOM 0 HG22 THR A 176 10.597 8.413 -1.586 1.00 1.76 H new ATOM 0 HG23 THR A 176 11.518 9.450 -2.702 1.00 1.76 H new ATOM 1680 N PHE A 177 6.632 9.405 -2.407 1.00 0.52 N ATOM 1681 CA PHE A 177 5.609 8.458 -1.996 1.00 0.45 C ATOM 1682 C PHE A 177 5.061 7.710 -3.203 1.00 0.41 C ATOM 1683 O PHE A 177 5.095 8.219 -4.325 1.00 0.50 O ATOM 1684 CB PHE A 177 4.468 9.181 -1.263 1.00 0.49 C ATOM 1685 CG PHE A 177 3.817 10.280 -2.067 1.00 0.55 C ATOM 1686 CD1 PHE A 177 4.248 11.593 -1.952 1.00 1.37 C ATOM 1687 CD2 PHE A 177 2.768 10.002 -2.933 1.00 1.31 C ATOM 1688 CE1 PHE A 177 3.649 12.600 -2.683 1.00 1.46 C ATOM 1689 CE2 PHE A 177 2.168 11.007 -3.666 1.00 1.38 C ATOM 1690 CZ PHE A 177 2.609 12.307 -3.540 1.00 0.86 C ATOM 0 H PHE A 177 6.268 10.276 -2.792 1.00 0.52 H new ATOM 0 HA PHE A 177 6.063 7.739 -1.314 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.708 8.450 -0.985 1.00 0.49 H new ATOM 0 HB3 PHE A 177 4.857 9.605 -0.337 1.00 0.49 H new ATOM 0 HD1 PHE A 177 5.062 11.831 -1.283 1.00 1.37 H new ATOM 0 HD2 PHE A 177 2.416 8.986 -3.035 1.00 1.31 H new ATOM 0 HE1 PHE A 177 3.995 13.618 -2.583 1.00 1.46 H new ATOM 0 HE2 PHE A 177 1.354 10.775 -4.337 1.00 1.38 H new ATOM 0 HZ PHE A 177 2.141 13.095 -4.112 1.00 0.86 H new ATOM 1700 N GLU A 178 4.562 6.508 -2.974 1.00 0.34 N ATOM 1701 CA GLU A 178 3.944 5.730 -4.027 1.00 0.32 C ATOM 1702 C GLU A 178 2.588 5.218 -3.568 1.00 0.28 C ATOM 1703 O GLU A 178 2.490 4.479 -2.586 1.00 0.28 O ATOM 1704 CB GLU A 178 4.845 4.562 -4.436 1.00 0.37 C ATOM 1705 CG GLU A 178 4.268 3.704 -5.550 1.00 0.40 C ATOM 1706 CD GLU A 178 5.276 2.721 -6.103 1.00 1.20 C ATOM 1707 OE1 GLU A 178 6.237 3.171 -6.763 1.00 1.91 O ATOM 1708 OE2 GLU A 178 5.102 1.499 -5.908 1.00 1.96 O ATOM 0 H GLU A 178 4.574 6.050 -2.063 1.00 0.34 H new ATOM 0 HA GLU A 178 3.803 6.372 -4.897 1.00 0.32 H new ATOM 0 HB2 GLU A 178 5.811 4.954 -4.755 1.00 0.37 H new ATOM 0 HB3 GLU A 178 5.029 3.934 -3.564 1.00 0.37 H new ATOM 0 HG2 GLU A 178 3.402 3.159 -5.174 1.00 0.40 H new ATOM 0 HG3 GLU A 178 3.914 4.348 -6.355 1.00 0.40 H new ATOM 1715 N TRP A 179 1.544 5.647 -4.258 1.00 0.28 N ATOM 1716 CA TRP A 179 0.207 5.155 -3.995 1.00 0.26 C ATOM 1717 C TRP A 179 -0.091 3.961 -4.883 1.00 0.27 C ATOM 1718 O TRP A 179 0.252 3.953 -6.069 1.00 0.38 O ATOM 1719 CB TRP A 179 -0.850 6.227 -4.268 1.00 0.27 C ATOM 1720 CG TRP A 179 -0.894 7.343 -3.270 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -0.365 8.592 -3.411 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.530 7.320 -1.986 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -0.641 9.348 -2.300 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.350 8.593 -1.413 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.237 6.352 -1.265 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -1.851 8.925 -0.161 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -2.733 6.685 -0.020 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.537 7.964 0.519 1.00 0.24 C ATOM 0 H TRP A 179 1.600 6.338 -5.007 1.00 0.28 H new ATOM 0 HA TRP A 179 0.167 4.873 -2.943 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -0.669 6.650 -5.256 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -1.830 5.750 -4.300 1.00 0.27 H new ATOM 0 HD1 TRP A 179 0.190 8.936 -4.271 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -0.361 10.319 -2.160 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.392 5.364 -1.674 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -1.702 9.909 0.258 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.281 5.948 0.548 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -2.939 8.193 1.495 1.00 0.24 H new ATOM 1739 N SER A 180 -0.725 2.957 -4.315 1.00 0.23 N ATOM 1740 CA SER A 180 -1.207 1.843 -5.103 1.00 0.28 C ATOM 1741 C SER A 180 -2.589 2.189 -5.646 1.00 0.28 C ATOM 1742 O SER A 180 -3.136 3.247 -5.319 1.00 0.36 O ATOM 1743 CB SER A 180 -1.262 0.568 -4.263 1.00 0.33 C ATOM 1744 OG SER A 180 -1.321 -0.580 -5.087 1.00 1.06 O ATOM 0 H SER A 180 -0.918 2.889 -3.316 1.00 0.23 H new ATOM 0 HA SER A 180 -0.523 1.661 -5.932 1.00 0.28 H new ATOM 0 HB2 SER A 180 -0.383 0.514 -3.620 1.00 0.33 H new ATOM 0 HB3 SER A 180 -2.134 0.596 -3.610 1.00 0.33 H new ATOM 0 HG SER A 180 -1.907 -1.249 -4.675 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.150 1.316 -6.467 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.473 1.555 -7.028 1.00 0.38 C ATOM 1752 C GLU A 181 -5.511 1.615 -5.915 1.00 0.34 C ATOM 1753 O GLU A 181 -5.470 0.811 -4.987 1.00 0.49 O ATOM 1754 CB GLU A 181 -4.851 0.459 -8.023 1.00 0.56 C ATOM 1755 CG GLU A 181 -4.041 0.488 -9.306 1.00 0.74 C ATOM 1756 CD GLU A 181 -4.385 -0.661 -10.226 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -3.554 -1.577 -10.370 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -5.493 -0.658 -10.804 1.00 1.91 O ATOM 0 H GLU A 181 -2.715 0.441 -6.759 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.449 2.509 -7.554 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -4.722 -0.512 -7.545 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -5.908 0.555 -8.270 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -4.218 1.431 -9.824 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -2.979 0.452 -9.064 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.452 2.564 -5.976 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.472 2.683 -4.957 1.00 0.26 C ATOM 1767 C PRO A 182 -8.590 1.676 -5.183 1.00 0.28 C ATOM 1768 O PRO A 182 -9.335 1.762 -6.165 1.00 0.32 O ATOM 1769 CB PRO A 182 -7.993 4.120 -5.111 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.323 4.695 -6.326 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.621 3.565 -7.033 1.00 0.39 C ATOM 0 HA PRO A 182 -7.085 2.482 -3.958 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.077 4.128 -5.227 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -7.762 4.712 -4.225 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -8.056 5.162 -6.983 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -6.611 5.470 -6.041 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -7.213 3.179 -7.863 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.663 3.881 -7.445 1.00 0.39 H new ATOM 1779 N MET A 183 -8.697 0.718 -4.282 1.00 0.28 N ATOM 1780 CA MET A 183 -9.754 -0.270 -4.346 1.00 0.30 C ATOM 1781 C MET A 183 -10.899 0.163 -3.459 1.00 0.26 C ATOM 1782 O MET A 183 -10.687 0.758 -2.403 1.00 0.25 O ATOM 1783 CB MET A 183 -9.259 -1.666 -3.940 1.00 0.34 C ATOM 1784 CG MET A 183 -8.487 -1.715 -2.629 1.00 0.29 C ATOM 1785 SD MET A 183 -6.792 -1.129 -2.813 1.00 0.31 S ATOM 1786 CE MET A 183 -6.186 -1.256 -1.138 1.00 0.27 C ATOM 0 H MET A 183 -8.060 0.604 -3.493 1.00 0.28 H new ATOM 0 HA MET A 183 -10.094 -0.339 -5.379 1.00 0.30 H new ATOM 0 HB2 MET A 183 -10.118 -2.333 -3.864 1.00 0.34 H new ATOM 0 HB3 MET A 183 -8.623 -2.055 -4.735 1.00 0.34 H new ATOM 0 HG2 MET A 183 -9.001 -1.107 -1.884 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.477 -2.738 -2.254 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.148 -0.926 -1.101 1.00 0.27 H new ATOM 0 HE2 MET A 183 -6.790 -0.627 -0.484 1.00 0.27 H new ATOM 0 HE3 MET A 183 -6.250 -2.292 -0.806 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.112 -0.123 -3.887 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.277 0.345 -3.170 1.00 0.29 C ATOM 1798 C ARG A 184 -14.077 -0.828 -2.647 1.00 0.31 C ATOM 1799 O ARG A 184 -14.738 -1.530 -3.417 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.172 1.205 -4.071 1.00 0.35 C ATOM 1801 CG ARG A 184 -13.429 2.269 -4.867 1.00 1.17 C ATOM 1802 CD ARG A 184 -14.392 3.113 -5.689 1.00 1.16 C ATOM 1803 NE ARG A 184 -13.707 4.151 -6.461 1.00 1.88 N ATOM 1804 CZ ARG A 184 -14.312 5.233 -6.952 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -15.599 5.445 -6.709 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -13.625 6.111 -7.672 1.00 3.32 N ATOM 0 H ARG A 184 -12.314 -0.673 -4.722 1.00 0.28 H new ATOM 0 HA ARG A 184 -12.930 0.954 -2.335 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -14.701 0.552 -4.766 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -14.927 1.692 -3.454 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -12.868 2.910 -4.187 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -12.704 1.793 -5.527 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -14.948 2.467 -6.368 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -15.120 3.579 -5.025 1.00 1.16 H new ATOM 0 HE ARG A 184 -12.708 4.040 -6.634 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -16.128 4.779 -6.145 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -16.059 6.274 -7.086 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -12.632 5.959 -7.851 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -14.090 6.938 -8.047 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.010 -1.048 -1.346 1.00 0.28 N ATOM 1821 CA LEU A 185 -14.859 -2.040 -0.729 1.00 0.32 C ATOM 1822 C LEU A 185 -16.156 -1.349 -0.385 1.00 0.36 C ATOM 1823 O LEU A 185 -16.303 -0.786 0.692 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.229 -2.615 0.543 1.00 0.36 C ATOM 1825 CG LEU A 185 -12.766 -3.043 0.434 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.325 -3.708 1.727 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.550 -3.976 -0.749 1.00 0.74 C ATOM 0 H LEU A 185 -13.384 -0.558 -0.707 1.00 0.28 H new ATOM 0 HA LEU A 185 -15.011 -2.874 -1.414 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.310 -1.869 1.334 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -14.816 -3.478 0.857 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.159 -2.153 0.266 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -11.281 -4.011 1.643 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.433 -3.005 2.553 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -12.943 -4.586 1.914 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.500 -4.262 -0.799 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -13.164 -4.868 -0.626 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -12.832 -3.466 -1.670 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.105 -1.415 -1.287 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.292 -0.601 -1.171 1.00 0.77 C ATOM 1841 C ALA A 186 -19.487 -1.432 -0.769 1.00 1.02 C ATOM 1842 O ALA A 186 -20.029 -2.192 -1.567 1.00 1.53 O ATOM 1843 CB ALA A 186 -18.555 0.125 -2.477 1.00 1.00 C ATOM 0 H ALA A 186 -17.080 -2.021 -2.107 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.126 0.138 -0.387 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -19.452 0.736 -2.379 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -17.705 0.764 -2.716 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -18.697 -0.603 -3.276 1.00 1.00 H new ATOM 1849 N LYS A 187 -19.898 -1.278 0.474 1.00 0.89 N ATOM 1850 CA LYS A 187 -21.072 -1.965 0.969 1.00 1.11 C ATOM 1851 C LYS A 187 -22.251 -1.015 0.895 1.00 1.49 C ATOM 1852 O LYS A 187 -22.497 -0.234 1.814 1.00 1.61 O ATOM 1853 CB LYS A 187 -20.856 -2.452 2.405 1.00 1.11 C ATOM 1854 CG LYS A 187 -19.668 -3.389 2.551 1.00 1.17 C ATOM 1855 CD LYS A 187 -19.572 -3.951 3.959 1.00 1.45 C ATOM 1856 CE LYS A 187 -18.392 -4.902 4.105 1.00 1.82 C ATOM 1857 NZ LYS A 187 -17.081 -4.198 4.027 1.00 2.78 N ATOM 0 H LYS A 187 -19.435 -0.682 1.160 1.00 0.89 H new ATOM 0 HA LYS A 187 -21.268 -2.844 0.355 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -20.711 -1.590 3.056 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -21.756 -2.962 2.747 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -19.759 -4.207 1.837 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -18.750 -2.854 2.308 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -19.470 -3.133 4.672 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -20.495 -4.476 4.205 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -18.465 -5.423 5.060 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -18.441 -5.660 3.323 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -16.472 -4.674 3.331 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -17.234 -3.211 3.736 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -16.621 -4.216 4.960 1.00 2.78 H new ATOM 1871 N CYS A 188 -22.958 -1.067 -0.217 1.00 1.82 N ATOM 1872 CA CYS A 188 -24.041 -0.139 -0.473 1.00 2.29 C ATOM 1873 C CYS A 188 -25.365 -0.878 -0.558 1.00 2.51 C ATOM 1874 O CYS A 188 -25.533 -1.764 -1.397 1.00 2.68 O ATOM 1875 CB CYS A 188 -23.781 0.616 -1.780 1.00 2.71 C ATOM 1876 SG CYS A 188 -22.175 1.443 -1.848 1.00 3.14 S ATOM 0 H CYS A 188 -22.800 -1.746 -0.961 1.00 1.82 H new ATOM 0 HA CYS A 188 -24.092 0.574 0.350 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -23.852 -0.085 -2.612 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -24.566 1.359 -1.920 1.00 2.71 H new ATOM 0 HG CYS A 188 -22.048 2.051 -2.990 1.00 3.14 H new ATOM 1882 N ASP A 189 -26.295 -0.526 0.315 1.00 2.70 N ATOM 1883 CA ASP A 189 -27.632 -1.096 0.262 1.00 3.08 C ATOM 1884 C ASP A 189 -28.478 -0.324 -0.745 1.00 3.61 C ATOM 1885 O ASP A 189 -29.216 0.598 -0.400 1.00 3.87 O ATOM 1886 CB ASP A 189 -28.282 -1.096 1.655 1.00 3.12 C ATOM 1887 CG ASP A 189 -28.340 0.279 2.299 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -27.272 0.847 2.601 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -29.459 0.791 2.524 1.00 4.05 O ATOM 0 H ASP A 189 -26.150 0.149 1.066 1.00 2.70 H new ATOM 0 HA ASP A 189 -27.565 -2.134 -0.064 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -29.294 -1.493 1.575 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -27.726 -1.770 2.306 1.00 3.12 H new ATOM 1894 N GLU A 190 -28.357 -0.710 -2.002 1.00 3.97 N ATOM 1895 CA GLU A 190 -29.047 -0.034 -3.083 1.00 4.63 C ATOM 1896 C GLU A 190 -29.151 -0.961 -4.286 1.00 5.25 C ATOM 1897 O GLU A 190 -28.175 -1.043 -5.064 1.00 5.64 O ATOM 1898 CB GLU A 190 -28.305 1.248 -3.466 1.00 4.83 C ATOM 1899 CG GLU A 190 -29.028 2.083 -4.510 1.00 5.57 C ATOM 1900 CD GLU A 190 -28.167 3.207 -5.044 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -27.385 2.962 -5.989 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -28.263 4.338 -4.528 1.00 6.43 O ATOM 1903 OXT GLU A 190 -30.203 -1.609 -4.442 1.00 5.62 O ATOM 0 H GLU A 190 -27.781 -1.497 -2.300 1.00 3.97 H new ATOM 0 HA GLU A 190 -30.050 0.233 -2.751 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -28.155 1.852 -2.571 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -27.317 0.986 -3.844 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -29.336 1.441 -5.335 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -29.936 2.500 -4.074 1.00 5.57 H new TER 1910 GLU A 190