USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=35 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 173 ASN : amide:sc= 1.33 K(o=3.1,f=-4.3!) USER MOD Set 1.2: A 176 THR OG1 : rot -47:sc= 1.75 USER MOD Set 2.1: A 77 SER OG : rot 125:sc= 0.782 USER MOD Set 2.2: A 166 LYS NZ :NH3+ 173:sc= 0.944 (180deg=0.000858) USER MOD Set 3.1: A 153 LYS NZ :NH3+ 161:sc= 0.181 (180deg=0.0666) USER MOD Set 3.2: A 155 MET CE :methyl -110:sc= -0.437 (180deg=-1.92) USER MOD Set 4.1: A 103 ASN : amide:sc= -3.4! C(o=-3.4!,f=-3.8!) USER MOD Set 4.2: A 145 SER OG : rot 180:sc= 0.00498 USER MOD Set 5.1: A 141 GLN : amide:sc= 0.83 K(o=0.44,f=-0.42) USER MOD Set 5.2: A 147 TYR OH : rot 99:sc= -0.39 USER MOD Set 6.1: A 112 LYS NZ :NH3+ -173:sc=-0.00782 (180deg=-0.0975) USER MOD Set 6.2: A 139 SER OG : rot 170:sc=-0.00202 USER MOD Set 7.1: A 84 GLN : amide:sc= -1.27! C(o=0.57!,f=-6.5!) USER MOD Set 7.2: A 88 LYS NZ :NH3+ 176:sc= 1.84 (180deg=1.11) USER MOD Set 8.1: A 85 THR OG1 : rot 19:sc= 1.01 USER MOD Set 8.2: A 183 MET CE :methyl -166:sc= -2.19! (180deg=-2.6!) USER MOD Set 9.1: A 80 HIS : no HE2:sc= 0.882 K(o=3.1,f=-5.5!) USER MOD Set 9.2: A 104 THR OG1 : rot 51:sc= 2.23 USER MOD Set10.1: A 76 GLN : amide:sc= -2.1! C(o=-2.2!,f=-3.9!) USER MOD Set10.2: A 111 SER OG : rot 180:sc= -0.0981 USER MOD Single : A 82 SER OG : rot -150:sc= 0 USER MOD Single : A 87 THR OG1 : rot 140:sc= -0.0233 USER MOD Single : A 90 THR OG1 : rot 84:sc= 1.4 USER MOD Single : A 92 CYS SG : rot 34:sc= 0.102 USER MOD Single : A 93 SER OG : rot 180:sc= -0.0673 USER MOD Single : A 107 LYS NZ :NH3+ 167:sc= -0.0314 (180deg=-0.226) USER MOD Single : A 109 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0735) USER MOD Single : A 110 LYS NZ :NH3+ -163:sc= -0.0395 (180deg=-0.334) USER MOD Single : A 114 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0361) USER MOD Single : A 118 HIS : no HD1:sc= -2.33! C(o=-2.3!,f=-9.5!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 1.76 K(o=1.8,f=-9.4!) 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= 0.818 K(o=0.82,f=-0.44) USER MOD Single : A 135 LYS NZ :NH3+ -172:sc=-0.00448 (180deg=-0.0956) USER MOD Single : A 140 ASN : amide:sc= -0.792 K(o=-0.79,f=0) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 106:sc= 1.63 USER MOD Single : A 152 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0342) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 LYS NZ :NH3+ -153:sc= -1.79! (180deg=-3.09!) USER MOD Single : A 160 TYR OH : rot 13:sc= 0.157 USER MOD Single : A 163 LYS NZ :NH3+ -157:sc= 1.37 (180deg=1.02) USER MOD Single : A 165 TYR OH : rot 150:sc= -1.65! USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 180 SER OG : rot -150:sc= -0.657 USER MOD Single : A 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 26.628 2.402 -3.507 1.00 3.12 N ATOM 2 CA ARG A 73 25.735 1.250 -3.250 1.00 2.69 C ATOM 3 C ARG A 73 24.480 1.691 -2.515 1.00 2.08 C ATOM 4 O ARG A 73 24.549 2.451 -1.548 1.00 2.31 O ATOM 5 CB ARG A 73 26.458 0.175 -2.435 1.00 3.05 C ATOM 6 CG ARG A 73 27.446 -0.649 -3.242 1.00 3.69 C ATOM 7 CD ARG A 73 28.183 -1.650 -2.367 1.00 4.24 C ATOM 8 NE ARG A 73 27.273 -2.593 -1.711 1.00 4.97 N ATOM 9 CZ ARG A 73 27.620 -3.365 -0.680 1.00 5.85 C ATOM 10 NH1 ARG A 73 28.849 -3.297 -0.184 1.00 6.18 N ATOM 11 NH2 ARG A 73 26.735 -4.202 -0.147 1.00 6.67 N ATOM 0 HA ARG A 73 25.449 0.831 -4.215 1.00 2.69 H new ATOM 0 HB2 ARG A 73 26.987 0.653 -1.610 1.00 3.05 H new ATOM 0 HB3 ARG A 73 25.717 -0.493 -1.995 1.00 3.05 H new ATOM 0 HG2 ARG A 73 26.918 -1.178 -4.035 1.00 3.69 H new ATOM 0 HG3 ARG A 73 28.165 0.013 -3.724 1.00 3.69 H new ATOM 0 HD2 ARG A 73 28.899 -2.203 -2.975 1.00 4.24 H new ATOM 0 HD3 ARG A 73 28.755 -1.115 -1.610 1.00 4.24 H new ATOM 0 HE ARG A 73 26.318 -2.663 -2.063 1.00 4.97 H new ATOM 0 HH11 ARG A 73 29.528 -2.654 -0.591 1.00 6.18 H new ATOM 0 HH12 ARG A 73 29.114 -3.887 0.604 1.00 6.18 H new ATOM 0 HH21 ARG A 73 25.790 -4.254 -0.526 1.00 6.67 H new ATOM 0 HH22 ARG A 73 27.001 -4.792 0.641 1.00 6.67 H new ATOM 25 N TRP A 74 23.338 1.209 -2.980 1.00 1.61 N ATOM 26 CA TRP A 74 22.057 1.528 -2.370 1.00 1.14 C ATOM 27 C TRP A 74 21.063 0.425 -2.714 1.00 0.96 C ATOM 28 O TRP A 74 20.996 -0.007 -3.864 1.00 1.19 O ATOM 29 CB TRP A 74 21.558 2.886 -2.877 1.00 1.25 C ATOM 30 CG TRP A 74 20.521 3.515 -2.001 1.00 1.15 C ATOM 31 CD1 TRP A 74 19.169 3.419 -2.136 1.00 1.14 C ATOM 32 CD2 TRP A 74 20.756 4.345 -0.859 1.00 1.26 C ATOM 33 NE1 TRP A 74 18.545 4.141 -1.145 1.00 1.26 N ATOM 34 CE2 TRP A 74 19.498 4.716 -0.350 1.00 1.34 C ATOM 35 CE3 TRP A 74 21.905 4.808 -0.216 1.00 1.43 C ATOM 36 CZ2 TRP A 74 19.358 5.529 0.770 1.00 1.61 C ATOM 37 CZ3 TRP A 74 21.766 5.615 0.896 1.00 1.66 C ATOM 38 CH2 TRP A 74 20.499 5.968 1.380 1.00 1.75 C ATOM 0 H TRP A 74 23.273 0.589 -3.787 1.00 1.61 H new ATOM 0 HA TRP A 74 22.164 1.591 -1.287 1.00 1.14 H new ATOM 0 HB2 TRP A 74 22.406 3.565 -2.964 1.00 1.25 H new ATOM 0 HB3 TRP A 74 21.146 2.760 -3.878 1.00 1.25 H new ATOM 0 HD1 TRP A 74 18.662 2.859 -2.907 1.00 1.14 H new ATOM 0 HE1 TRP A 74 17.536 4.233 -1.023 1.00 1.26 H new ATOM 0 HE3 TRP A 74 22.885 4.540 -0.582 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 18.383 5.803 1.144 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 22.648 5.980 1.401 1.00 1.66 H new ATOM 0 HH2 TRP A 74 20.423 6.600 2.253 1.00 1.75 H new ATOM 49 N ASP A 75 20.312 -0.049 -1.724 1.00 0.79 N ATOM 50 CA ASP A 75 19.417 -1.187 -1.934 1.00 0.78 C ATOM 51 C ASP A 75 18.031 -0.924 -1.349 1.00 0.67 C ATOM 52 O ASP A 75 17.106 -1.707 -1.537 1.00 0.92 O ATOM 53 CB ASP A 75 19.991 -2.462 -1.295 1.00 0.92 C ATOM 54 CG ASP A 75 21.352 -2.854 -1.839 1.00 1.37 C ATOM 55 OD1 ASP A 75 21.413 -3.515 -2.898 1.00 2.01 O ATOM 56 OD2 ASP A 75 22.372 -2.514 -1.199 1.00 1.86 O ATOM 0 H ASP A 75 20.303 0.331 -0.777 1.00 0.79 H new ATOM 0 HA ASP A 75 19.328 -1.325 -3.012 1.00 0.78 H new ATOM 0 HB2 ASP A 75 20.068 -2.315 -0.218 1.00 0.92 H new ATOM 0 HB3 ASP A 75 19.294 -3.284 -1.456 1.00 0.92 H new ATOM 61 N GLN A 76 17.888 0.171 -0.625 1.00 0.59 N ATOM 62 CA GLN A 76 16.640 0.445 0.077 1.00 0.77 C ATOM 63 C GLN A 76 15.695 1.344 -0.727 1.00 0.69 C ATOM 64 O GLN A 76 14.698 1.811 -0.193 1.00 0.94 O ATOM 65 CB GLN A 76 16.932 1.075 1.446 1.00 1.07 C ATOM 66 CG GLN A 76 17.770 2.343 1.367 1.00 1.21 C ATOM 67 CD GLN A 76 17.964 3.013 2.715 1.00 1.75 C ATOM 68 OE1 GLN A 76 17.163 3.849 3.125 1.00 2.30 O ATOM 69 NE2 GLN A 76 19.042 2.670 3.402 1.00 2.36 N ATOM 0 H GLN A 76 18.611 0.881 -0.506 1.00 0.59 H new ATOM 0 HA GLN A 76 16.133 -0.510 0.212 1.00 0.77 H new ATOM 0 HB2 GLN A 76 15.988 1.304 1.940 1.00 1.07 H new ATOM 0 HB3 GLN A 76 17.449 0.346 2.069 1.00 1.07 H new ATOM 0 HG2 GLN A 76 18.745 2.101 0.944 1.00 1.21 H new ATOM 0 HG3 GLN A 76 17.292 3.045 0.684 1.00 1.21 H new ATOM 0 HE21 GLN A 76 19.684 1.971 3.028 1.00 2.36 H new ATOM 0 HE22 GLN A 76 19.231 3.104 4.305 1.00 2.36 H new ATOM 78 N SER A 77 16.004 1.611 -1.986 1.00 0.51 N ATOM 79 CA SER A 77 15.230 2.586 -2.748 1.00 0.56 C ATOM 80 C SER A 77 14.222 1.969 -3.733 1.00 0.43 C ATOM 81 O SER A 77 13.218 2.608 -4.057 1.00 0.54 O ATOM 82 CB SER A 77 16.176 3.520 -3.501 1.00 0.80 C ATOM 83 OG SER A 77 15.474 4.590 -4.110 1.00 1.52 O ATOM 0 H SER A 77 16.772 1.176 -2.498 1.00 0.51 H new ATOM 0 HA SER A 77 14.638 3.135 -2.016 1.00 0.56 H new ATOM 0 HB2 SER A 77 16.921 3.918 -2.812 1.00 0.80 H new ATOM 0 HB3 SER A 77 16.715 2.957 -4.263 1.00 0.80 H new ATOM 0 HG SER A 77 15.856 5.442 -3.814 1.00 1.52 H new ATOM 89 N ASP A 78 14.458 0.751 -4.207 1.00 0.35 N ATOM 90 CA ASP A 78 13.742 0.275 -5.402 1.00 0.38 C ATOM 91 C ASP A 78 12.633 -0.734 -5.095 1.00 0.33 C ATOM 92 O ASP A 78 12.427 -1.688 -5.847 1.00 0.42 O ATOM 93 CB ASP A 78 14.719 -0.317 -6.426 1.00 0.51 C ATOM 94 CG ASP A 78 14.402 0.117 -7.845 1.00 0.94 C ATOM 95 OD1 ASP A 78 14.929 1.162 -8.284 1.00 1.66 O ATOM 96 OD2 ASP A 78 13.630 -0.577 -8.529 1.00 1.66 O ATOM 0 H ASP A 78 15.118 0.086 -3.802 1.00 0.35 H new ATOM 0 HA ASP A 78 13.256 1.155 -5.823 1.00 0.38 H new ATOM 0 HB2 ASP A 78 15.735 -0.012 -6.174 1.00 0.51 H new ATOM 0 HB3 ASP A 78 14.689 -1.405 -6.366 1.00 0.51 H new ATOM 101 N LEU A 79 11.923 -0.535 -3.994 1.00 0.26 N ATOM 102 CA LEU A 79 10.727 -1.331 -3.714 1.00 0.26 C ATOM 103 C LEU A 79 9.519 -0.672 -4.369 1.00 0.30 C ATOM 104 O LEU A 79 9.283 0.521 -4.185 1.00 0.51 O ATOM 105 CB LEU A 79 10.489 -1.481 -2.201 1.00 0.28 C ATOM 106 CG LEU A 79 11.282 -2.589 -1.490 1.00 0.28 C ATOM 107 CD1 LEU A 79 10.877 -3.961 -2.002 1.00 0.29 C ATOM 108 CD2 LEU A 79 12.783 -2.378 -1.645 1.00 0.30 C ATOM 0 H LEU A 79 12.147 0.162 -3.284 1.00 0.26 H new ATOM 0 HA LEU A 79 10.875 -2.329 -4.125 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.726 -0.531 -1.722 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.427 -1.664 -2.039 1.00 0.28 H new ATOM 0 HG LEU A 79 11.043 -2.538 -0.428 1.00 0.28 H new ATOM 0 HD11 LEU A 79 11.453 -4.727 -1.483 1.00 0.29 H new ATOM 0 HD12 LEU A 79 9.814 -4.119 -1.818 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.073 -4.022 -3.072 1.00 0.29 H new ATOM 0 HD21 LEU A 79 13.318 -3.177 -1.132 1.00 0.30 H new ATOM 0 HD22 LEU A 79 13.044 -2.388 -2.703 1.00 0.30 H new ATOM 0 HD23 LEU A 79 13.062 -1.418 -1.211 1.00 0.30 H new ATOM 120 N HIS A 80 8.771 -1.433 -5.156 1.00 0.21 N ATOM 121 CA HIS A 80 7.643 -0.871 -5.891 1.00 0.25 C ATOM 122 C HIS A 80 6.391 -1.716 -5.725 1.00 0.22 C ATOM 123 O HIS A 80 6.454 -2.943 -5.741 1.00 0.23 O ATOM 124 CB HIS A 80 7.984 -0.748 -7.378 1.00 0.33 C ATOM 125 CG HIS A 80 9.071 0.236 -7.664 1.00 1.03 C ATOM 126 ND1 HIS A 80 10.289 -0.117 -8.201 1.00 1.94 N ATOM 127 CD2 HIS A 80 9.117 1.577 -7.483 1.00 1.86 C ATOM 128 CE1 HIS A 80 11.035 0.960 -8.335 1.00 2.58 C ATOM 129 NE2 HIS A 80 10.349 1.999 -7.908 1.00 2.50 N ATOM 0 H HIS A 80 8.921 -2.431 -5.302 1.00 0.21 H new ATOM 0 HA HIS A 80 7.445 0.119 -5.479 1.00 0.25 H new ATOM 0 HB2 HIS A 80 8.282 -1.726 -7.756 1.00 0.33 H new ATOM 0 HB3 HIS A 80 7.088 -0.455 -7.925 1.00 0.33 H new ATOM 0 HD1 HIS A 80 10.569 -1.064 -8.455 1.00 1.94 H new ATOM 0 HD2 HIS A 80 8.330 2.197 -7.079 1.00 1.86 H new ATOM 0 HE1 HIS A 80 12.040 0.986 -8.729 1.00 2.58 H new ATOM 138 N ILE A 81 5.254 -1.047 -5.566 1.00 0.23 N ATOM 139 CA ILE A 81 3.970 -1.723 -5.465 1.00 0.23 C ATOM 140 C ILE A 81 3.578 -2.302 -6.820 1.00 0.26 C ATOM 141 O ILE A 81 3.139 -1.578 -7.718 1.00 0.36 O ATOM 142 CB ILE A 81 2.861 -0.765 -4.974 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.225 -0.184 -3.604 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.524 -1.492 -4.905 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.234 0.840 -3.097 1.00 0.27 C ATOM 0 H ILE A 81 5.198 -0.030 -5.504 1.00 0.23 H new ATOM 0 HA ILE A 81 4.075 -2.526 -4.735 1.00 0.23 H new ATOM 0 HB ILE A 81 2.772 0.056 -5.685 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.296 -0.997 -2.881 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.211 0.276 -3.664 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.753 -0.804 -4.558 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.260 -1.863 -5.895 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.601 -2.330 -4.213 1.00 0.28 H new ATOM 0 HD11 ILE A 81 2.557 1.207 -2.123 1.00 0.27 H new ATOM 0 HD12 ILE A 81 2.180 1.672 -3.799 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.251 0.379 -3.004 1.00 0.27 H new ATOM 157 N SER A 82 3.755 -3.602 -6.963 1.00 0.25 N ATOM 158 CA SER A 82 3.505 -4.275 -8.226 1.00 0.29 C ATOM 159 C SER A 82 2.066 -4.772 -8.309 1.00 0.33 C ATOM 160 O SER A 82 1.532 -4.964 -9.400 1.00 0.43 O ATOM 161 CB SER A 82 4.483 -5.439 -8.397 1.00 0.32 C ATOM 162 OG SER A 82 5.826 -4.983 -8.358 1.00 1.10 O ATOM 0 H SER A 82 4.073 -4.218 -6.215 1.00 0.25 H new ATOM 0 HA SER A 82 3.657 -3.559 -9.034 1.00 0.29 H new ATOM 0 HB2 SER A 82 4.321 -6.174 -7.608 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.293 -5.942 -9.345 1.00 0.32 H new ATOM 0 HG SER A 82 6.386 -5.568 -8.910 1.00 1.10 H new ATOM 168 N ASP A 83 1.437 -4.967 -7.157 1.00 0.33 N ATOM 169 CA ASP A 83 0.056 -5.429 -7.114 1.00 0.38 C ATOM 170 C ASP A 83 -0.571 -5.035 -5.787 1.00 0.30 C ATOM 171 O ASP A 83 0.124 -4.567 -4.884 1.00 0.27 O ATOM 172 CB ASP A 83 -0.015 -6.949 -7.317 1.00 0.46 C ATOM 173 CG ASP A 83 -1.423 -7.434 -7.616 1.00 1.27 C ATOM 174 OD1 ASP A 83 -1.706 -8.630 -7.399 1.00 2.07 O ATOM 175 OD2 ASP A 83 -2.254 -6.618 -8.077 1.00 1.90 O ATOM 0 H ASP A 83 1.860 -4.813 -6.242 1.00 0.33 H new ATOM 0 HA ASP A 83 -0.501 -4.958 -7.924 1.00 0.38 H new ATOM 0 HB2 ASP A 83 0.645 -7.233 -8.137 1.00 0.46 H new ATOM 0 HB3 ASP A 83 0.355 -7.449 -6.422 1.00 0.46 H new ATOM 180 N GLN A 84 -1.874 -5.223 -5.667 1.00 0.31 N ATOM 181 CA GLN A 84 -2.596 -4.792 -4.484 1.00 0.35 C ATOM 182 C GLN A 84 -3.819 -5.663 -4.234 1.00 0.34 C ATOM 183 O GLN A 84 -4.024 -6.664 -4.922 1.00 0.39 O ATOM 184 CB GLN A 84 -2.981 -3.309 -4.609 1.00 0.49 C ATOM 185 CG GLN A 84 -3.605 -2.936 -5.950 1.00 0.64 C ATOM 186 CD GLN A 84 -5.095 -3.204 -6.028 1.00 1.32 C ATOM 187 OE1 GLN A 84 -5.608 -3.589 -7.078 1.00 2.14 O ATOM 188 NE2 GLN A 84 -5.809 -2.949 -4.943 1.00 1.98 N ATOM 0 H GLN A 84 -2.454 -5.672 -6.376 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.940 -4.905 -3.621 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -3.682 -3.059 -3.813 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -2.091 -2.700 -4.453 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -3.425 -1.878 -6.142 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -3.103 -3.493 -6.741 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -5.347 -2.631 -4.091 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -6.822 -3.070 -4.959 1.00 1.98 H new ATOM 197 N THR A 85 -4.604 -5.277 -3.234 1.00 0.34 N ATOM 198 CA THR A 85 -5.803 -6.001 -2.825 1.00 0.39 C ATOM 199 C THR A 85 -6.636 -6.478 -4.014 1.00 0.50 C ATOM 200 O THR A 85 -6.874 -5.731 -4.967 1.00 0.54 O ATOM 201 CB THR A 85 -6.666 -5.102 -1.925 1.00 0.32 C ATOM 202 OG1 THR A 85 -5.885 -4.656 -0.811 1.00 0.43 O ATOM 203 CG2 THR A 85 -7.904 -5.834 -1.431 1.00 0.42 C ATOM 0 H THR A 85 -4.423 -4.442 -2.677 1.00 0.34 H new ATOM 0 HA THR A 85 -5.475 -6.886 -2.280 1.00 0.39 H new ATOM 0 HB THR A 85 -6.998 -4.246 -2.512 1.00 0.32 H new ATOM 0 HG1 THR A 85 -4.932 -4.758 -1.017 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.491 -5.169 -0.798 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.506 -6.148 -2.284 1.00 0.42 H new ATOM 0 HG23 THR A 85 -7.604 -6.710 -0.857 1.00 0.42 H new ATOM 211 N ASP A 86 -7.060 -7.734 -3.945 1.00 0.69 N ATOM 212 CA ASP A 86 -7.879 -8.335 -4.987 1.00 0.89 C ATOM 213 C ASP A 86 -9.216 -7.614 -5.095 1.00 0.83 C ATOM 214 O ASP A 86 -10.157 -7.889 -4.345 1.00 1.12 O ATOM 215 CB ASP A 86 -8.100 -9.822 -4.708 1.00 1.20 C ATOM 216 CG ASP A 86 -8.939 -10.490 -5.776 1.00 1.67 C ATOM 217 OD1 ASP A 86 -8.434 -10.678 -6.902 1.00 2.32 O ATOM 218 OD2 ASP A 86 -10.105 -10.840 -5.495 1.00 2.23 O ATOM 0 H ASP A 86 -6.847 -8.361 -3.169 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.352 -8.236 -5.936 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -7.135 -10.324 -4.641 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -8.588 -9.939 -3.740 1.00 1.20 H new ATOM 223 N THR A 87 -9.272 -6.664 -6.009 1.00 0.72 N ATOM 224 CA THR A 87 -10.460 -5.860 -6.219 1.00 0.74 C ATOM 225 C THR A 87 -10.514 -5.377 -7.662 1.00 0.81 C ATOM 226 O THR A 87 -11.414 -5.754 -8.410 1.00 1.42 O ATOM 227 CB THR A 87 -10.488 -4.651 -5.258 1.00 1.14 C ATOM 228 OG1 THR A 87 -10.499 -5.109 -3.901 1.00 1.36 O ATOM 229 CG2 THR A 87 -11.702 -3.769 -5.513 1.00 1.87 C ATOM 0 H THR A 87 -8.495 -6.428 -6.627 1.00 0.72 H new ATOM 0 HA THR A 87 -11.332 -6.481 -6.013 1.00 0.74 H new ATOM 0 HB THR A 87 -9.593 -4.056 -5.438 1.00 1.14 H new ATOM 0 HG1 THR A 87 -9.918 -4.536 -3.358 1.00 1.36 H new ATOM 0 HG21 THR A 87 -11.692 -2.927 -4.820 1.00 1.87 H new ATOM 0 HG22 THR A 87 -11.673 -3.397 -6.537 1.00 1.87 H new ATOM 0 HG23 THR A 87 -12.612 -4.351 -5.364 1.00 1.87 H new ATOM 237 N LYS A 88 -9.530 -4.560 -8.046 1.00 1.18 N ATOM 238 CA LYS A 88 -9.429 -4.049 -9.412 1.00 1.58 C ATOM 239 C LYS A 88 -10.726 -3.350 -9.820 1.00 1.51 C ATOM 240 O LYS A 88 -11.382 -3.731 -10.792 1.00 1.95 O ATOM 241 CB LYS A 88 -9.098 -5.192 -10.383 1.00 1.89 C ATOM 242 CG LYS A 88 -7.888 -6.024 -9.967 1.00 2.02 C ATOM 243 CD LYS A 88 -6.639 -5.169 -9.818 1.00 2.39 C ATOM 244 CE LYS A 88 -5.451 -5.988 -9.338 1.00 2.73 C ATOM 245 NZ LYS A 88 -4.247 -5.140 -9.134 1.00 3.20 N ATOM 0 H LYS A 88 -8.788 -4.238 -7.424 1.00 1.18 H new ATOM 0 HA LYS A 88 -8.622 -3.317 -9.453 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -9.965 -5.847 -10.468 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -8.916 -4.774 -11.373 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -8.099 -6.526 -9.023 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -7.709 -6.802 -10.709 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -6.399 -4.706 -10.775 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -6.833 -4.361 -9.112 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -5.707 -6.488 -8.404 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -5.228 -6.768 -10.066 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -3.477 -5.719 -8.743 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -3.948 -4.736 -10.045 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -4.472 -4.371 -8.472 1.00 3.20 H new ATOM 259 N GLY A 89 -11.088 -2.331 -9.055 1.00 1.22 N ATOM 260 CA GLY A 89 -12.328 -1.625 -9.290 1.00 1.14 C ATOM 261 C GLY A 89 -13.177 -1.561 -8.039 1.00 0.96 C ATOM 262 O GLY A 89 -12.728 -1.065 -7.002 1.00 1.01 O ATOM 0 H GLY A 89 -10.540 -1.979 -8.270 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -12.112 -0.614 -9.636 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -12.886 -2.122 -10.084 1.00 1.14 H new ATOM 266 N THR A 90 -14.395 -2.070 -8.126 1.00 0.97 N ATOM 267 CA THR A 90 -15.293 -2.099 -6.983 1.00 0.88 C ATOM 268 C THR A 90 -15.852 -3.503 -6.771 1.00 0.82 C ATOM 269 O THR A 90 -16.547 -4.043 -7.633 1.00 1.04 O ATOM 270 CB THR A 90 -16.457 -1.108 -7.166 1.00 1.06 C ATOM 271 OG1 THR A 90 -15.947 0.152 -7.623 1.00 1.25 O ATOM 272 CG2 THR A 90 -17.214 -0.910 -5.859 1.00 1.02 C ATOM 0 H THR A 90 -14.786 -2.470 -8.979 1.00 0.97 H new ATOM 0 HA THR A 90 -14.716 -1.806 -6.106 1.00 0.88 H new ATOM 0 HB THR A 90 -17.147 -1.517 -7.904 1.00 1.06 H new ATOM 0 HG1 THR A 90 -15.838 0.127 -8.597 1.00 1.25 H new ATOM 0 HG21 THR A 90 -18.031 -0.206 -6.015 1.00 1.02 H new ATOM 0 HG22 THR A 90 -17.617 -1.866 -5.524 1.00 1.02 H new ATOM 0 HG23 THR A 90 -16.536 -0.517 -5.102 1.00 1.02 H new ATOM 280 N VAL A 91 -15.530 -4.100 -5.634 1.00 0.65 N ATOM 281 CA VAL A 91 -16.031 -5.426 -5.299 1.00 0.77 C ATOM 282 C VAL A 91 -16.681 -5.397 -3.927 1.00 0.55 C ATOM 283 O VAL A 91 -16.374 -4.528 -3.112 1.00 0.46 O ATOM 284 CB VAL A 91 -14.907 -6.492 -5.297 1.00 1.02 C ATOM 285 CG1 VAL A 91 -14.117 -6.451 -6.593 1.00 1.43 C ATOM 286 CG2 VAL A 91 -13.986 -6.322 -4.096 1.00 1.51 C ATOM 0 H VAL A 91 -14.923 -3.687 -4.926 1.00 0.65 H new ATOM 0 HA VAL A 91 -16.758 -5.699 -6.064 1.00 0.77 H new ATOM 0 HB VAL A 91 -15.380 -7.471 -5.219 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -13.334 -7.209 -6.566 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -14.784 -6.648 -7.432 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -13.665 -5.466 -6.712 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -13.208 -7.085 -4.123 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -13.527 -5.334 -4.127 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -14.563 -6.425 -3.177 1.00 1.51 H new ATOM 296 N CYS A 92 -17.578 -6.329 -3.665 1.00 0.79 N ATOM 297 CA CYS A 92 -18.137 -6.438 -2.337 1.00 0.64 C ATOM 298 C CYS A 92 -17.360 -7.490 -1.562 1.00 0.62 C ATOM 299 O CYS A 92 -17.347 -8.667 -1.931 1.00 1.20 O ATOM 300 CB CYS A 92 -19.621 -6.803 -2.419 1.00 1.10 C ATOM 301 SG CYS A 92 -19.967 -8.283 -3.399 1.00 1.91 S ATOM 0 H CYS A 92 -17.928 -7.008 -4.341 1.00 0.79 H new ATOM 0 HA CYS A 92 -18.057 -5.482 -1.820 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -20.003 -6.952 -1.409 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -20.167 -5.962 -2.846 1.00 1.10 H new ATOM 0 HG CYS A 92 -18.988 -9.128 -3.269 1.00 1.91 H new ATOM 307 N SER A 93 -16.706 -7.067 -0.494 1.00 0.69 N ATOM 308 CA SER A 93 -15.887 -7.969 0.292 1.00 1.02 C ATOM 309 C SER A 93 -15.727 -7.485 1.727 1.00 0.58 C ATOM 310 O SER A 93 -15.431 -6.314 1.960 1.00 0.73 O ATOM 311 CB SER A 93 -14.501 -8.121 -0.344 1.00 1.83 C ATOM 312 OG SER A 93 -14.582 -8.686 -1.645 1.00 2.58 O ATOM 0 H SER A 93 -16.727 -6.106 -0.153 1.00 0.69 H new ATOM 0 HA SER A 93 -16.396 -8.932 0.309 1.00 1.02 H new ATOM 0 HB2 SER A 93 -14.017 -7.146 -0.400 1.00 1.83 H new ATOM 0 HB3 SER A 93 -13.877 -8.752 0.289 1.00 1.83 H new ATOM 0 HG SER A 93 -13.681 -8.768 -2.023 1.00 2.58 H new ATOM 318 N PRO A 94 -15.939 -8.364 2.708 1.00 0.78 N ATOM 319 CA PRO A 94 -15.373 -8.193 4.030 1.00 0.67 C ATOM 320 C PRO A 94 -14.005 -8.860 4.045 1.00 0.53 C ATOM 321 O PRO A 94 -13.915 -10.088 4.068 1.00 0.59 O ATOM 322 CB PRO A 94 -16.351 -8.944 4.946 1.00 0.93 C ATOM 323 CG PRO A 94 -17.313 -9.664 4.038 1.00 1.39 C ATOM 324 CD PRO A 94 -16.767 -9.565 2.637 1.00 1.43 C ATOM 0 HA PRO A 94 -15.245 -7.154 4.335 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -15.821 -9.648 5.587 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -16.879 -8.252 5.602 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -17.416 -10.707 4.337 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -18.305 -9.216 4.096 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -16.184 -10.445 2.365 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -17.562 -9.468 1.897 1.00 1.43 H new ATOM 332 N PHE A 95 -12.941 -8.075 4.029 1.00 0.43 N ATOM 333 CA PHE A 95 -11.640 -8.626 3.686 1.00 0.40 C ATOM 334 C PHE A 95 -10.503 -7.785 4.255 1.00 0.33 C ATOM 335 O PHE A 95 -10.661 -6.586 4.487 1.00 0.32 O ATOM 336 CB PHE A 95 -11.557 -8.693 2.152 1.00 0.46 C ATOM 337 CG PHE A 95 -10.376 -9.441 1.599 1.00 0.50 C ATOM 338 CD1 PHE A 95 -10.202 -10.790 1.867 1.00 1.26 C ATOM 339 CD2 PHE A 95 -9.452 -8.799 0.790 1.00 1.35 C ATOM 340 CE1 PHE A 95 -9.128 -11.480 1.342 1.00 1.33 C ATOM 341 CE2 PHE A 95 -8.377 -9.484 0.265 1.00 1.36 C ATOM 342 CZ PHE A 95 -8.214 -10.828 0.541 1.00 0.68 C ATOM 0 H PHE A 95 -12.949 -7.078 4.244 1.00 0.43 H new ATOM 0 HA PHE A 95 -11.534 -9.620 4.121 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -12.468 -9.159 1.776 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.535 -7.675 1.762 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -10.914 -11.307 2.493 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -9.576 -7.749 0.568 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -9.003 -12.531 1.559 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -7.663 -8.970 -0.362 1.00 1.36 H new ATOM 0 HZ PHE A 95 -7.373 -11.367 0.130 1.00 0.68 H new ATOM 352 N ALA A 96 -9.375 -8.438 4.518 1.00 0.37 N ATOM 353 CA ALA A 96 -8.161 -7.747 4.918 1.00 0.38 C ATOM 354 C ALA A 96 -7.389 -7.343 3.677 1.00 0.35 C ATOM 355 O ALA A 96 -7.180 -8.152 2.779 1.00 0.51 O ATOM 356 CB ALA A 96 -7.307 -8.630 5.813 1.00 0.49 C ATOM 0 H ALA A 96 -9.280 -9.452 4.460 1.00 0.37 H new ATOM 0 HA ALA A 96 -8.427 -6.856 5.487 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.404 -8.092 6.100 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -7.871 -8.895 6.707 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -7.033 -9.537 5.275 1.00 0.49 H new ATOM 362 N LEU A 97 -6.959 -6.100 3.634 1.00 0.24 N ATOM 363 CA LEU A 97 -6.385 -5.542 2.425 1.00 0.22 C ATOM 364 C LEU A 97 -4.886 -5.758 2.398 1.00 0.22 C ATOM 365 O LEU A 97 -4.237 -5.798 3.442 1.00 0.24 O ATOM 366 CB LEU A 97 -6.715 -4.048 2.303 1.00 0.23 C ATOM 367 CG LEU A 97 -8.181 -3.717 1.986 1.00 0.46 C ATOM 368 CD1 LEU A 97 -9.098 -4.075 3.143 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.331 -2.250 1.639 1.00 1.07 C ATOM 0 H LEU A 97 -6.996 -5.455 4.423 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.824 -6.059 1.572 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -6.444 -3.557 3.237 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -6.087 -3.618 1.523 1.00 0.23 H new ATOM 0 HG LEU A 97 -8.474 -4.319 1.126 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -10.127 -3.827 2.882 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -9.024 -5.143 3.349 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -8.803 -3.513 4.029 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -9.376 -2.034 1.417 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -8.005 -1.641 2.483 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -7.720 -2.018 0.767 1.00 1.07 H new ATOM 381 N PHE A 98 -4.339 -5.904 1.205 1.00 0.23 N ATOM 382 CA PHE A 98 -2.923 -6.151 1.053 1.00 0.23 C ATOM 383 C PHE A 98 -2.359 -5.387 -0.131 1.00 0.22 C ATOM 384 O PHE A 98 -3.098 -4.919 -0.999 1.00 0.25 O ATOM 385 CB PHE A 98 -2.647 -7.655 0.894 1.00 0.24 C ATOM 386 CG PHE A 98 -3.352 -8.298 -0.273 1.00 0.26 C ATOM 387 CD1 PHE A 98 -2.816 -8.235 -1.552 1.00 1.26 C ATOM 388 CD2 PHE A 98 -4.547 -8.976 -0.087 1.00 1.18 C ATOM 389 CE1 PHE A 98 -3.459 -8.831 -2.618 1.00 1.31 C ATOM 390 CE2 PHE A 98 -5.192 -9.574 -1.152 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.648 -9.501 -2.417 1.00 0.40 C ATOM 0 H PHE A 98 -4.858 -5.855 0.328 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.426 -5.798 1.956 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.573 -7.805 0.781 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -2.946 -8.166 1.809 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -1.885 -7.713 -1.715 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -4.978 -9.037 0.901 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -3.032 -8.773 -3.608 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -6.123 -10.099 -0.994 1.00 1.17 H new ATOM 0 HZ PHE A 98 -5.152 -9.968 -3.250 1.00 0.40 H new ATOM 401 N ALA A 99 -1.049 -5.247 -0.136 1.00 0.20 N ATOM 402 CA ALA A 99 -0.327 -4.691 -1.260 1.00 0.19 C ATOM 403 C ALA A 99 0.972 -5.449 -1.437 1.00 0.17 C ATOM 404 O ALA A 99 1.566 -5.906 -0.459 1.00 0.19 O ATOM 405 CB ALA A 99 -0.066 -3.206 -1.069 1.00 0.21 C ATOM 0 H ALA A 99 -0.452 -5.518 0.646 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.934 -4.797 -2.159 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.478 -2.818 -1.930 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -1.015 -2.679 -0.972 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.527 -3.054 -0.167 1.00 0.21 H new ATOM 411 N VAL A 100 1.397 -5.609 -2.671 1.00 0.17 N ATOM 412 CA VAL A 100 2.583 -6.386 -2.963 1.00 0.18 C ATOM 413 C VAL A 100 3.679 -5.500 -3.540 1.00 0.19 C ATOM 414 O VAL A 100 3.481 -4.837 -4.557 1.00 0.22 O ATOM 415 CB VAL A 100 2.264 -7.522 -3.951 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.489 -8.378 -4.200 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.112 -8.374 -3.437 1.00 0.25 C ATOM 0 H VAL A 100 0.938 -5.211 -3.490 1.00 0.17 H new ATOM 0 HA VAL A 100 2.934 -6.821 -2.027 1.00 0.18 H new ATOM 0 HB VAL A 100 1.963 -7.073 -4.898 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.240 -9.174 -4.901 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.285 -7.762 -4.619 1.00 0.26 H new ATOM 0 HG13 VAL A 100 3.825 -8.815 -3.260 1.00 0.26 H new ATOM 0 HG21 VAL A 100 0.903 -9.171 -4.150 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.382 -8.810 -2.475 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.225 -7.752 -3.317 1.00 0.25 H new ATOM 427 N LEU A 101 4.829 -5.490 -2.882 1.00 0.19 N ATOM 428 CA LEU A 101 5.955 -4.688 -3.329 1.00 0.19 C ATOM 429 C LEU A 101 7.091 -5.587 -3.785 1.00 0.21 C ATOM 430 O LEU A 101 7.506 -6.493 -3.066 1.00 0.23 O ATOM 431 CB LEU A 101 6.459 -3.742 -2.230 1.00 0.19 C ATOM 432 CG LEU A 101 5.484 -2.640 -1.802 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.454 -3.173 -0.818 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.244 -1.464 -1.205 1.00 0.21 C ATOM 0 H LEU A 101 5.006 -6.030 -2.035 1.00 0.19 H new ATOM 0 HA LEU A 101 5.607 -4.079 -4.164 1.00 0.19 H new ATOM 0 HB2 LEU A 101 6.713 -4.337 -1.353 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.380 -3.272 -2.575 1.00 0.19 H new ATOM 0 HG LEU A 101 4.950 -2.294 -2.687 1.00 0.22 H new ATOM 0 HD11 LEU A 101 3.775 -2.370 -0.531 1.00 0.30 H new ATOM 0 HD12 LEU A 101 3.887 -3.978 -1.285 1.00 0.30 H new ATOM 0 HD13 LEU A 101 4.961 -3.554 0.069 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.538 -0.689 -0.906 1.00 0.21 H new ATOM 0 HD22 LEU A 101 6.806 -1.799 -0.333 1.00 0.21 H new ATOM 0 HD23 LEU A 101 6.932 -1.061 -1.948 1.00 0.21 H new ATOM 446 N GLU A 102 7.579 -5.341 -4.982 1.00 0.24 N ATOM 447 CA GLU A 102 8.673 -6.117 -5.529 1.00 0.29 C ATOM 448 C GLU A 102 9.966 -5.312 -5.481 1.00 0.28 C ATOM 449 O GLU A 102 9.965 -4.109 -5.755 1.00 0.26 O ATOM 450 CB GLU A 102 8.357 -6.528 -6.969 1.00 0.34 C ATOM 451 CG GLU A 102 9.450 -7.353 -7.624 1.00 0.41 C ATOM 452 CD GLU A 102 9.041 -7.904 -8.970 1.00 0.53 C ATOM 453 OE1 GLU A 102 9.039 -9.143 -9.128 1.00 1.32 O ATOM 454 OE2 GLU A 102 8.711 -7.107 -9.875 1.00 0.95 O ATOM 0 H GLU A 102 7.234 -4.606 -5.599 1.00 0.24 H new ATOM 0 HA GLU A 102 8.801 -7.017 -4.927 1.00 0.29 H new ATOM 0 HB2 GLU A 102 7.428 -7.099 -6.979 1.00 0.34 H new ATOM 0 HB3 GLU A 102 8.186 -5.631 -7.564 1.00 0.34 H new ATOM 0 HG2 GLU A 102 10.341 -6.737 -7.744 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.720 -8.179 -6.965 1.00 0.41 H new ATOM 461 N ASN A 103 11.058 -5.969 -5.108 1.00 0.38 N ATOM 462 CA ASN A 103 12.368 -5.334 -5.145 1.00 0.44 C ATOM 463 C ASN A 103 12.942 -5.413 -6.550 1.00 0.37 C ATOM 464 O ASN A 103 13.593 -6.386 -6.925 1.00 0.51 O ATOM 465 CB ASN A 103 13.338 -5.951 -4.121 1.00 0.68 C ATOM 466 CG ASN A 103 13.331 -7.469 -4.095 1.00 0.87 C ATOM 467 OD1 ASN A 103 12.602 -8.082 -3.317 1.00 1.76 O ATOM 468 ND2 ASN A 103 14.147 -8.087 -4.931 1.00 1.64 N ATOM 0 H ASN A 103 11.062 -6.934 -4.779 1.00 0.38 H new ATOM 0 HA ASN A 103 12.241 -4.287 -4.869 1.00 0.44 H new ATOM 0 HB2 ASN A 103 14.349 -5.607 -4.341 1.00 0.68 H new ATOM 0 HB3 ASN A 103 13.085 -5.580 -3.128 1.00 0.68 H new ATOM 0 HD21 ASN A 103 14.187 -9.106 -4.945 1.00 1.64 H new ATOM 0 HD22 ASN A 103 14.737 -7.545 -5.562 1.00 1.64 H new ATOM 475 N THR A 104 12.693 -4.382 -7.331 1.00 0.34 N ATOM 476 CA THR A 104 13.102 -4.367 -8.719 1.00 0.38 C ATOM 477 C THR A 104 14.544 -3.887 -8.875 1.00 0.50 C ATOM 478 O THR A 104 14.817 -2.866 -9.504 1.00 0.70 O ATOM 479 CB THR A 104 12.140 -3.498 -9.545 1.00 0.55 C ATOM 480 OG1 THR A 104 11.796 -2.314 -8.811 1.00 0.77 O ATOM 481 CG2 THR A 104 10.877 -4.270 -9.874 1.00 0.73 C ATOM 0 H THR A 104 12.206 -3.539 -7.025 1.00 0.34 H new ATOM 0 HA THR A 104 13.060 -5.389 -9.095 1.00 0.38 H new ATOM 0 HB THR A 104 12.639 -3.220 -10.473 1.00 0.55 H new ATOM 0 HG1 THR A 104 12.613 -1.880 -8.488 1.00 0.77 H new ATOM 0 HG21 THR A 104 10.207 -3.640 -10.459 1.00 0.73 H new ATOM 0 HG22 THR A 104 11.134 -5.159 -10.450 1.00 0.73 H new ATOM 0 HG23 THR A 104 10.381 -4.567 -8.950 1.00 0.73 H new ATOM 489 N GLY A 105 15.466 -4.640 -8.294 1.00 0.52 N ATOM 490 CA GLY A 105 16.874 -4.334 -8.435 1.00 0.72 C ATOM 491 C GLY A 105 17.547 -4.065 -7.110 1.00 0.66 C ATOM 492 O GLY A 105 18.707 -4.424 -6.911 1.00 0.80 O ATOM 0 H GLY A 105 15.262 -5.461 -7.725 1.00 0.52 H new ATOM 0 HA2 GLY A 105 17.375 -5.166 -8.930 1.00 0.72 H new ATOM 0 HA3 GLY A 105 16.990 -3.463 -9.080 1.00 0.72 H new ATOM 496 N GLU A 106 16.821 -3.444 -6.200 1.00 0.60 N ATOM 497 CA GLU A 106 17.355 -3.145 -4.886 1.00 0.56 C ATOM 498 C GLU A 106 16.697 -4.025 -3.831 1.00 0.65 C ATOM 499 O GLU A 106 15.523 -3.851 -3.505 1.00 1.05 O ATOM 500 CB GLU A 106 17.157 -1.668 -4.550 1.00 0.68 C ATOM 501 CG GLU A 106 18.019 -0.724 -5.375 1.00 1.25 C ATOM 502 CD GLU A 106 17.873 0.720 -4.939 1.00 1.91 C ATOM 503 OE1 GLU A 106 17.667 1.597 -5.807 1.00 2.54 O ATOM 504 OE2 GLU A 106 17.945 0.985 -3.724 1.00 2.47 O ATOM 0 H GLU A 106 15.860 -3.137 -6.347 1.00 0.60 H new ATOM 0 HA GLU A 106 18.424 -3.355 -4.893 1.00 0.56 H new ATOM 0 HB2 GLU A 106 16.109 -1.410 -4.699 1.00 0.68 H new ATOM 0 HB3 GLU A 106 17.376 -1.514 -3.493 1.00 0.68 H new ATOM 0 HG2 GLU A 106 19.064 -1.023 -5.290 1.00 1.25 H new ATOM 0 HG3 GLU A 106 17.746 -0.813 -6.427 1.00 1.25 H new ATOM 511 N LYS A 107 17.459 -4.986 -3.327 1.00 0.61 N ATOM 512 CA LYS A 107 16.980 -5.901 -2.301 1.00 0.69 C ATOM 513 C LYS A 107 16.725 -5.170 -0.987 1.00 0.66 C ATOM 514 O LYS A 107 17.538 -4.357 -0.548 1.00 0.76 O ATOM 515 CB LYS A 107 18.004 -7.018 -2.062 1.00 0.86 C ATOM 516 CG LYS A 107 18.253 -7.921 -3.264 1.00 1.37 C ATOM 517 CD LYS A 107 17.007 -8.696 -3.660 1.00 1.80 C ATOM 518 CE LYS A 107 17.290 -9.685 -4.782 1.00 2.66 C ATOM 519 NZ LYS A 107 18.235 -10.759 -4.365 1.00 3.32 N ATOM 0 H LYS A 107 18.423 -5.153 -3.617 1.00 0.61 H new ATOM 0 HA LYS A 107 16.042 -6.330 -2.654 1.00 0.69 H new ATOM 0 HB2 LYS A 107 18.950 -6.567 -1.761 1.00 0.86 H new ATOM 0 HB3 LYS A 107 17.664 -7.632 -1.228 1.00 0.86 H new ATOM 0 HG2 LYS A 107 18.588 -7.318 -4.108 1.00 1.37 H new ATOM 0 HG3 LYS A 107 19.057 -8.620 -3.032 1.00 1.37 H new ATOM 0 HD2 LYS A 107 16.621 -9.231 -2.793 1.00 1.80 H new ATOM 0 HD3 LYS A 107 16.231 -7.999 -3.977 1.00 1.80 H new ATOM 0 HE2 LYS A 107 16.354 -10.136 -5.111 1.00 2.66 H new ATOM 0 HE3 LYS A 107 17.704 -9.152 -5.637 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 18.228 -11.521 -5.073 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 19.195 -10.366 -4.288 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 17.942 -11.140 -3.443 1.00 3.32 H new ATOM 533 N LEU A 108 15.594 -5.474 -0.362 1.00 0.59 N ATOM 534 CA LEU A 108 15.259 -4.905 0.934 1.00 0.57 C ATOM 535 C LEU A 108 16.220 -5.471 1.976 1.00 0.63 C ATOM 536 O LEU A 108 16.020 -6.569 2.496 1.00 0.74 O ATOM 537 CB LEU A 108 13.796 -5.239 1.285 1.00 0.60 C ATOM 538 CG LEU A 108 13.132 -4.391 2.383 1.00 0.58 C ATOM 539 CD1 LEU A 108 13.696 -4.705 3.760 1.00 0.61 C ATOM 540 CD2 LEU A 108 13.286 -2.915 2.075 1.00 0.56 C ATOM 0 H LEU A 108 14.892 -6.114 -0.735 1.00 0.59 H new ATOM 0 HA LEU A 108 15.358 -3.820 0.912 1.00 0.57 H new ATOM 0 HB2 LEU A 108 13.200 -5.146 0.377 1.00 0.60 H new ATOM 0 HB3 LEU A 108 13.751 -6.284 1.590 1.00 0.60 H new ATOM 0 HG LEU A 108 12.072 -4.644 2.397 1.00 0.58 H new ATOM 0 HD11 LEU A 108 13.200 -4.085 4.506 1.00 0.61 H new ATOM 0 HD12 LEU A 108 13.526 -5.757 3.992 1.00 0.61 H new ATOM 0 HD13 LEU A 108 14.766 -4.499 3.770 1.00 0.61 H new ATOM 0 HD21 LEU A 108 12.811 -2.328 2.861 1.00 0.56 H new ATOM 0 HD22 LEU A 108 14.345 -2.663 2.023 1.00 0.56 H new ATOM 0 HD23 LEU A 108 12.813 -2.692 1.119 1.00 0.56 H new ATOM 552 N LYS A 109 17.270 -4.719 2.263 1.00 0.62 N ATOM 553 CA LYS A 109 18.335 -5.196 3.126 1.00 0.73 C ATOM 554 C LYS A 109 18.865 -4.082 4.021 1.00 0.75 C ATOM 555 O LYS A 109 19.130 -4.292 5.202 1.00 1.15 O ATOM 556 CB LYS A 109 19.457 -5.766 2.252 1.00 0.92 C ATOM 557 CG LYS A 109 20.697 -6.194 3.013 1.00 1.17 C ATOM 558 CD LYS A 109 21.690 -6.877 2.088 1.00 1.66 C ATOM 559 CE LYS A 109 23.001 -7.184 2.792 1.00 2.07 C ATOM 560 NZ LYS A 109 23.783 -5.953 3.077 1.00 2.72 N ATOM 0 H LYS A 109 17.407 -3.772 1.909 1.00 0.62 H new ATOM 0 HA LYS A 109 17.943 -5.975 3.780 1.00 0.73 H new ATOM 0 HB2 LYS A 109 19.070 -6.624 1.702 1.00 0.92 H new ATOM 0 HB3 LYS A 109 19.741 -5.016 1.514 1.00 0.92 H new ATOM 0 HG2 LYS A 109 21.163 -5.324 3.476 1.00 1.17 H new ATOM 0 HG3 LYS A 109 20.418 -6.873 3.819 1.00 1.17 H new ATOM 0 HD2 LYS A 109 21.256 -7.802 1.709 1.00 1.66 H new ATOM 0 HD3 LYS A 109 21.882 -6.238 1.226 1.00 1.66 H new ATOM 0 HE2 LYS A 109 22.797 -7.708 3.726 1.00 2.07 H new ATOM 0 HE3 LYS A 109 23.596 -7.856 2.173 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 24.731 -6.215 3.416 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 23.870 -5.388 2.208 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 23.296 -5.394 3.806 1.00 2.72 H new ATOM 574 N LYS A 110 18.997 -2.888 3.458 1.00 0.62 N ATOM 575 CA LYS A 110 19.585 -1.767 4.183 1.00 0.73 C ATOM 576 C LYS A 110 18.634 -1.194 5.233 1.00 0.77 C ATOM 577 O LYS A 110 19.048 -0.899 6.353 1.00 1.53 O ATOM 578 CB LYS A 110 20.024 -0.670 3.210 1.00 0.93 C ATOM 579 CG LYS A 110 21.311 -0.995 2.471 1.00 1.14 C ATOM 580 CD LYS A 110 21.730 0.142 1.553 1.00 1.46 C ATOM 581 CE LYS A 110 23.126 -0.081 0.987 1.00 1.80 C ATOM 582 NZ LYS A 110 24.167 -0.053 2.049 1.00 1.59 N ATOM 0 H LYS A 110 18.706 -2.670 2.505 1.00 0.62 H new ATOM 0 HA LYS A 110 20.459 -2.149 4.710 1.00 0.73 H new ATOM 0 HB2 LYS A 110 19.230 -0.501 2.483 1.00 0.93 H new ATOM 0 HB3 LYS A 110 20.156 0.262 3.760 1.00 0.93 H new ATOM 0 HG2 LYS A 110 22.105 -1.194 3.191 1.00 1.14 H new ATOM 0 HG3 LYS A 110 21.176 -1.905 1.886 1.00 1.14 H new ATOM 0 HD2 LYS A 110 21.015 0.232 0.735 1.00 1.46 H new ATOM 0 HD3 LYS A 110 21.706 1.083 2.103 1.00 1.46 H new ATOM 0 HE2 LYS A 110 23.159 -1.041 0.471 1.00 1.80 H new ATOM 0 HE3 LYS A 110 23.344 0.687 0.245 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 25.102 0.081 1.615 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.974 0.731 2.704 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 24.154 -0.952 2.572 1.00 1.59 H new ATOM 596 N SER A 111 17.368 -1.038 4.877 1.00 0.51 N ATOM 597 CA SER A 111 16.388 -0.453 5.784 1.00 0.52 C ATOM 598 C SER A 111 14.989 -0.941 5.428 1.00 0.48 C ATOM 599 O SER A 111 14.789 -1.518 4.362 1.00 0.86 O ATOM 600 CB SER A 111 16.456 1.076 5.717 1.00 0.72 C ATOM 601 OG SER A 111 17.741 1.543 6.092 1.00 1.55 O ATOM 0 H SER A 111 16.994 -1.308 3.967 1.00 0.51 H new ATOM 0 HA SER A 111 16.616 -0.766 6.803 1.00 0.52 H new ATOM 0 HB2 SER A 111 16.224 1.410 4.706 1.00 0.72 H new ATOM 0 HB3 SER A 111 15.702 1.507 6.376 1.00 0.72 H new ATOM 0 HG SER A 111 17.761 2.521 6.040 1.00 1.55 H new ATOM 607 N LYS A 112 14.039 -0.711 6.324 1.00 0.39 N ATOM 608 CA LYS A 112 12.674 -1.196 6.143 1.00 0.32 C ATOM 609 C LYS A 112 11.753 -0.071 5.685 1.00 0.28 C ATOM 610 O LYS A 112 11.858 1.061 6.160 1.00 0.33 O ATOM 611 CB LYS A 112 12.148 -1.789 7.453 1.00 0.45 C ATOM 612 CG LYS A 112 13.021 -2.899 8.015 1.00 0.55 C ATOM 613 CD LYS A 112 12.491 -3.396 9.350 1.00 0.69 C ATOM 614 CE LYS A 112 13.375 -4.483 9.937 1.00 0.84 C ATOM 615 NZ LYS A 112 13.386 -5.708 9.097 1.00 1.53 N ATOM 0 H LYS A 112 14.188 -0.189 7.188 1.00 0.39 H new ATOM 0 HA LYS A 112 12.688 -1.969 5.375 1.00 0.32 H new ATOM 0 HB2 LYS A 112 12.065 -0.994 8.194 1.00 0.45 H new ATOM 0 HB3 LYS A 112 11.143 -2.177 7.288 1.00 0.45 H new ATOM 0 HG2 LYS A 112 13.062 -3.726 7.307 1.00 0.55 H new ATOM 0 HG3 LYS A 112 14.041 -2.535 8.139 1.00 0.55 H new ATOM 0 HD2 LYS A 112 12.427 -2.562 10.049 1.00 0.69 H new ATOM 0 HD3 LYS A 112 11.480 -3.781 9.219 1.00 0.69 H new ATOM 0 HE2 LYS A 112 14.392 -4.106 10.041 1.00 0.84 H new ATOM 0 HE3 LYS A 112 13.024 -4.734 10.938 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 13.903 -6.463 9.591 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 12.409 -6.016 8.920 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 13.854 -5.503 8.191 1.00 1.53 H new ATOM 629 N TRP A 113 10.845 -0.396 4.773 1.00 0.24 N ATOM 630 CA TRP A 113 9.896 0.574 4.241 1.00 0.22 C ATOM 631 C TRP A 113 8.658 0.640 5.117 1.00 0.21 C ATOM 632 O TRP A 113 8.166 -0.388 5.583 1.00 0.25 O ATOM 633 CB TRP A 113 9.489 0.204 2.812 1.00 0.22 C ATOM 634 CG TRP A 113 10.540 0.485 1.786 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.864 0.167 1.858 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.351 1.132 0.523 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.510 0.590 0.728 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.606 1.184 -0.107 1.00 0.25 C ATOM 639 CE3 TRP A 113 9.246 1.680 -0.139 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.790 1.756 -1.360 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.430 2.245 -1.386 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.695 2.281 -1.984 1.00 0.32 C ATOM 0 H TRP A 113 10.746 -1.333 4.383 1.00 0.24 H new ATOM 0 HA TRP A 113 10.382 1.550 4.231 1.00 0.22 H new ATOM 0 HB2 TRP A 113 9.239 -0.857 2.780 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.584 0.753 2.550 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.334 -0.344 2.685 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.506 0.480 0.539 1.00 0.25 H new ATOM 0 HE3 TRP A 113 8.267 1.661 0.317 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.765 1.784 -1.824 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.584 2.666 -1.908 1.00 0.32 H new ATOM 0 HH2 TRP A 113 10.807 2.733 -2.958 1.00 0.32 H new ATOM 653 N LYS A 114 8.162 1.847 5.337 1.00 0.20 N ATOM 654 CA LYS A 114 6.970 2.038 6.135 1.00 0.24 C ATOM 655 C LYS A 114 5.793 2.359 5.228 1.00 0.20 C ATOM 656 O LYS A 114 5.915 3.160 4.298 1.00 0.24 O ATOM 657 CB LYS A 114 7.173 3.166 7.142 1.00 0.37 C ATOM 658 CG LYS A 114 6.188 3.122 8.296 1.00 0.58 C ATOM 659 CD LYS A 114 6.287 4.361 9.168 1.00 1.04 C ATOM 660 CE LYS A 114 5.294 4.313 10.316 1.00 1.08 C ATOM 661 NZ LYS A 114 5.656 3.286 11.331 1.00 1.66 N ATOM 0 H LYS A 114 8.570 2.708 4.972 1.00 0.20 H new ATOM 0 HA LYS A 114 6.765 1.118 6.683 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.188 3.114 7.537 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.079 4.123 6.629 1.00 0.37 H new ATOM 0 HG2 LYS A 114 5.174 3.032 7.906 1.00 0.58 H new ATOM 0 HG3 LYS A 114 6.376 2.235 8.901 1.00 0.58 H new ATOM 0 HD2 LYS A 114 7.299 4.449 9.564 1.00 1.04 H new ATOM 0 HD3 LYS A 114 6.103 5.249 8.563 1.00 1.04 H new ATOM 0 HE2 LYS A 114 5.246 5.292 10.793 1.00 1.08 H new ATOM 0 HE3 LYS A 114 4.299 4.100 9.925 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 5.000 3.347 12.135 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 5.594 2.340 10.904 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 6.627 3.453 11.663 1.00 1.66 H new ATOM 675 N TRP A 115 4.664 1.726 5.490 1.00 0.17 N ATOM 676 CA TRP A 115 3.476 1.931 4.683 1.00 0.15 C ATOM 677 C TRP A 115 2.320 2.418 5.537 1.00 0.16 C ATOM 678 O TRP A 115 2.311 2.233 6.758 1.00 0.18 O ATOM 679 CB TRP A 115 3.080 0.636 3.968 1.00 0.15 C ATOM 680 CG TRP A 115 2.819 -0.510 4.898 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.723 -1.432 5.322 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.573 -0.860 5.516 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.121 -2.333 6.163 1.00 0.22 N ATOM 684 CE2 TRP A 115 1.804 -2.005 6.297 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.288 -0.318 5.486 1.00 0.18 C ATOM 686 CZ2 TRP A 115 0.801 -2.617 7.039 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.707 -0.926 6.224 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.445 -2.065 6.992 1.00 0.22 C ATOM 0 H TRP A 115 4.545 1.064 6.257 1.00 0.17 H new ATOM 0 HA TRP A 115 3.706 2.692 3.938 1.00 0.15 H new ATOM 0 HB2 TRP A 115 2.186 0.819 3.372 1.00 0.15 H new ATOM 0 HB3 TRP A 115 3.874 0.357 3.275 1.00 0.15 H new ATOM 0 HD1 TRP A 115 4.765 -1.452 5.038 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.584 -3.121 6.615 1.00 0.22 H new ATOM 0 HE3 TRP A 115 0.076 0.561 4.896 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 1.001 -3.498 7.631 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.706 -0.515 6.208 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.246 -2.516 7.559 1.00 0.22 H new ATOM 699 N GLU A 116 1.353 3.046 4.887 1.00 0.17 N ATOM 700 CA GLU A 116 0.148 3.506 5.552 1.00 0.20 C ATOM 701 C GLU A 116 -1.082 3.099 4.753 1.00 0.19 C ATOM 702 O GLU A 116 -1.121 3.278 3.536 1.00 0.25 O ATOM 703 CB GLU A 116 0.154 5.027 5.669 1.00 0.32 C ATOM 704 CG GLU A 116 1.454 5.628 6.161 1.00 0.50 C ATOM 705 CD GLU A 116 1.455 7.127 5.992 1.00 0.64 C ATOM 706 OE1 GLU A 116 2.497 7.692 5.613 1.00 1.40 O ATOM 707 OE2 GLU A 116 0.391 7.746 6.202 1.00 1.22 O ATOM 0 H GLU A 116 1.382 3.250 3.888 1.00 0.17 H new ATOM 0 HA GLU A 116 0.119 3.055 6.544 1.00 0.20 H new ATOM 0 HB2 GLU A 116 -0.078 5.452 4.692 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -0.646 5.327 6.346 1.00 0.32 H new ATOM 0 HG2 GLU A 116 1.600 5.377 7.212 1.00 0.50 H new ATOM 0 HG3 GLU A 116 2.290 5.196 5.611 1.00 0.50 H new ATOM 714 N LEU A 117 -2.085 2.565 5.423 1.00 0.17 N ATOM 715 CA LEU A 117 -3.363 2.324 4.777 1.00 0.16 C ATOM 716 C LEU A 117 -4.234 3.550 4.944 1.00 0.15 C ATOM 717 O LEU A 117 -4.507 3.975 6.068 1.00 0.19 O ATOM 718 CB LEU A 117 -4.088 1.112 5.358 1.00 0.19 C ATOM 719 CG LEU A 117 -5.447 0.827 4.711 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.280 0.191 3.340 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.299 -0.045 5.612 1.00 0.25 C ATOM 0 H LEU A 117 -2.042 2.292 6.405 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.171 2.119 3.724 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.453 0.234 5.245 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.232 1.266 6.427 1.00 0.19 H new ATOM 0 HG LEU A 117 -5.960 1.779 4.575 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.261 0.000 2.905 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.721 0.866 2.692 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.738 -0.749 3.439 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.259 -0.235 5.133 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -5.789 -0.992 5.790 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.462 0.464 6.562 1.00 0.25 H new ATOM 733 N HIS A 118 -4.657 4.126 3.839 1.00 0.13 N ATOM 734 CA HIS A 118 -5.452 5.333 3.887 1.00 0.14 C ATOM 735 C HIS A 118 -6.879 5.055 3.474 1.00 0.18 C ATOM 736 O HIS A 118 -7.132 4.291 2.543 1.00 0.21 O ATOM 737 CB HIS A 118 -4.853 6.422 2.997 1.00 0.18 C ATOM 738 CG HIS A 118 -3.622 7.053 3.573 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.407 8.413 3.574 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.548 6.506 4.190 1.00 0.24 C ATOM 741 CE1 HIS A 118 -2.258 8.672 4.169 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.717 7.537 4.554 1.00 0.22 N ATOM 0 H HIS A 118 -4.464 3.779 2.899 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.449 5.688 4.918 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.611 5.993 2.024 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.603 7.195 2.827 1.00 0.18 H new ATOM 0 HD2 HIS A 118 -2.377 5.454 4.364 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.832 9.654 4.316 1.00 0.45 H new ATOM 0 HE2 HIS A 118 -0.827 7.439 5.042 1.00 0.22 H new ATOM 751 N LYS A 119 -7.803 5.665 4.191 1.00 0.22 N ATOM 752 CA LYS A 119 -9.204 5.609 3.837 1.00 0.29 C ATOM 753 C LYS A 119 -9.527 6.836 2.996 1.00 0.27 C ATOM 754 O LYS A 119 -9.783 7.921 3.523 1.00 0.43 O ATOM 755 CB LYS A 119 -10.063 5.558 5.109 1.00 0.43 C ATOM 756 CG LYS A 119 -11.487 5.053 4.897 1.00 0.70 C ATOM 757 CD LYS A 119 -12.392 6.104 4.277 1.00 0.84 C ATOM 758 CE LYS A 119 -13.804 5.575 4.089 1.00 1.04 C ATOM 759 NZ LYS A 119 -14.729 6.632 3.605 1.00 1.69 N ATOM 0 H LYS A 119 -7.603 6.210 5.030 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.422 4.710 3.260 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -9.569 4.916 5.839 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -10.107 6.558 5.542 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -11.465 4.173 4.254 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -11.904 4.739 5.854 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -12.415 6.989 4.913 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -11.986 6.414 3.314 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -13.791 4.749 3.377 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -14.171 5.175 5.034 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -15.682 6.233 3.489 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -14.761 7.409 4.296 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -14.392 6.996 2.691 1.00 1.69 H new ATOM 773 N LEU A 120 -9.476 6.666 1.686 1.00 0.23 N ATOM 774 CA LEU A 120 -9.674 7.770 0.771 1.00 0.26 C ATOM 775 C LEU A 120 -11.159 8.008 0.575 1.00 0.34 C ATOM 776 O LEU A 120 -11.962 7.077 0.633 1.00 0.37 O ATOM 777 CB LEU A 120 -8.983 7.515 -0.579 1.00 0.24 C ATOM 778 CG LEU A 120 -7.444 7.500 -0.556 1.00 0.20 C ATOM 779 CD1 LEU A 120 -6.897 8.693 0.213 1.00 0.25 C ATOM 780 CD2 LEU A 120 -6.918 6.201 0.023 1.00 0.21 C ATOM 0 H LEU A 120 -9.298 5.769 1.234 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.220 8.661 1.204 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.330 6.558 -0.968 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -9.309 8.281 -1.282 1.00 0.24 H new ATOM 0 HG LEU A 120 -7.097 7.574 -1.587 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -5.808 8.657 0.213 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -7.230 9.616 -0.262 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.261 8.662 1.240 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -5.828 6.219 0.027 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.282 6.084 1.044 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.265 5.365 -0.584 1.00 0.21 H new ATOM 792 N GLU A 121 -11.522 9.256 0.369 1.00 0.46 N ATOM 793 CA GLU A 121 -12.918 9.624 0.248 1.00 0.57 C ATOM 794 C GLU A 121 -13.256 9.969 -1.198 1.00 0.58 C ATOM 795 O GLU A 121 -14.360 10.417 -1.507 1.00 0.69 O ATOM 796 CB GLU A 121 -13.219 10.777 1.205 1.00 0.70 C ATOM 797 CG GLU A 121 -12.880 10.428 2.650 1.00 0.80 C ATOM 798 CD GLU A 121 -13.037 11.588 3.602 1.00 1.63 C ATOM 799 OE1 GLU A 121 -12.030 12.269 3.887 1.00 2.36 O ATOM 800 OE2 GLU A 121 -14.160 11.812 4.094 1.00 2.22 O ATOM 0 H GLU A 121 -10.869 10.035 0.282 1.00 0.46 H new ATOM 0 HA GLU A 121 -13.550 8.781 0.525 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -12.651 11.656 0.902 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -14.274 11.040 1.134 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -13.521 9.610 2.978 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -11.853 10.066 2.697 1.00 0.80 H new ATOM 807 N ASN A 122 -12.283 9.751 -2.076 1.00 0.53 N ATOM 808 CA ASN A 122 -12.481 9.857 -3.516 1.00 0.60 C ATOM 809 C ASN A 122 -11.319 9.164 -4.214 1.00 0.62 C ATOM 810 O ASN A 122 -10.214 9.113 -3.673 1.00 1.22 O ATOM 811 CB ASN A 122 -12.585 11.326 -3.971 1.00 0.73 C ATOM 812 CG ASN A 122 -11.253 11.929 -4.383 1.00 1.03 C ATOM 813 OD1 ASN A 122 -10.878 11.880 -5.554 1.00 1.16 O ATOM 814 ND2 ASN A 122 -10.531 12.502 -3.433 1.00 1.87 N ATOM 0 H ASN A 122 -11.333 9.495 -1.808 1.00 0.53 H new ATOM 0 HA ASN A 122 -13.422 9.376 -3.781 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -13.279 11.390 -4.809 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -13.008 11.920 -3.161 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -9.630 12.923 -3.661 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -10.876 12.523 -2.473 1.00 1.87 H new ATOM 821 N ALA A 123 -11.568 8.613 -5.389 1.00 0.67 N ATOM 822 CA ALA A 123 -10.525 7.937 -6.145 1.00 0.66 C ATOM 823 C ALA A 123 -10.382 8.561 -7.528 1.00 0.71 C ATOM 824 O ALA A 123 -10.098 7.880 -8.514 1.00 0.90 O ATOM 825 CB ALA A 123 -10.824 6.451 -6.248 1.00 0.69 C ATOM 0 H ALA A 123 -12.482 8.620 -5.841 1.00 0.67 H new ATOM 0 HA ALA A 123 -9.578 8.057 -5.619 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -10.034 5.960 -6.816 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -10.874 6.020 -5.248 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -11.779 6.306 -6.753 1.00 0.69 H new ATOM 831 N ARG A 124 -10.593 9.865 -7.585 1.00 0.72 N ATOM 832 CA ARG A 124 -10.490 10.617 -8.831 1.00 0.83 C ATOM 833 C ARG A 124 -9.310 11.577 -8.771 1.00 0.75 C ATOM 834 O ARG A 124 -8.488 11.641 -9.688 1.00 0.86 O ATOM 835 CB ARG A 124 -11.783 11.393 -9.081 1.00 1.08 C ATOM 836 CG ARG A 124 -12.949 10.524 -9.524 1.00 1.37 C ATOM 837 CD ARG A 124 -14.265 11.282 -9.449 1.00 1.63 C ATOM 838 NE ARG A 124 -14.719 11.447 -8.068 1.00 2.28 N ATOM 839 CZ ARG A 124 -15.321 12.538 -7.593 1.00 2.84 C ATOM 840 NH1 ARG A 124 -15.503 13.603 -8.366 1.00 2.76 N ATOM 841 NH2 ARG A 124 -15.729 12.566 -6.332 1.00 3.84 N ATOM 0 H ARG A 124 -10.840 10.433 -6.775 1.00 0.72 H new ATOM 0 HA ARG A 124 -10.331 9.917 -9.651 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -12.061 11.919 -8.168 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -11.598 12.151 -9.842 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -12.782 10.182 -10.545 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -13.003 9.636 -8.895 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -14.147 12.262 -9.912 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -15.025 10.749 -10.020 1.00 1.63 H new ATOM 0 HE ARG A 124 -14.564 10.672 -7.423 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -15.181 13.592 -9.334 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -15.965 14.432 -7.992 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -15.582 11.756 -5.730 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -16.190 13.398 -5.963 1.00 3.84 H new ATOM 855 N LYS A 125 -9.240 12.321 -7.681 1.00 0.75 N ATOM 856 CA LYS A 125 -8.157 13.257 -7.440 1.00 0.68 C ATOM 857 C LYS A 125 -6.949 12.503 -6.907 1.00 0.55 C ATOM 858 O LYS A 125 -7.088 11.363 -6.455 1.00 0.53 O ATOM 859 CB LYS A 125 -8.609 14.311 -6.422 1.00 0.79 C ATOM 860 CG LYS A 125 -9.912 15.002 -6.792 1.00 0.93 C ATOM 861 CD LYS A 125 -10.351 15.977 -5.713 1.00 1.64 C ATOM 862 CE LYS A 125 -11.685 16.619 -6.057 1.00 1.90 C ATOM 863 NZ LYS A 125 -12.109 17.608 -5.032 1.00 2.26 N ATOM 0 H LYS A 125 -9.936 12.292 -6.936 1.00 0.75 H new ATOM 0 HA LYS A 125 -7.887 13.755 -8.371 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -8.724 13.836 -5.448 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -7.826 15.063 -6.319 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -9.788 15.534 -7.736 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -10.690 14.255 -6.947 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -10.432 15.455 -4.759 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -9.594 16.751 -5.590 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -11.611 17.111 -7.027 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -12.446 15.845 -6.150 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -13.023 18.022 -5.306 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -12.205 17.134 -4.111 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -11.396 18.361 -4.961 1.00 2.26 H new ATOM 877 N PRO A 126 -5.747 13.100 -6.978 1.00 0.51 N ATOM 878 CA PRO A 126 -4.557 12.518 -6.367 1.00 0.45 C ATOM 879 C PRO A 126 -4.820 12.178 -4.906 1.00 0.39 C ATOM 880 O PRO A 126 -5.239 13.039 -4.128 1.00 0.47 O ATOM 881 CB PRO A 126 -3.491 13.618 -6.489 1.00 0.51 C ATOM 882 CG PRO A 126 -4.227 14.847 -6.913 1.00 0.59 C ATOM 883 CD PRO A 126 -5.445 14.370 -7.651 1.00 0.60 C ATOM 0 HA PRO A 126 -4.250 11.589 -6.847 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -2.980 13.775 -5.539 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -2.729 13.346 -7.220 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -4.506 15.451 -6.050 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -3.604 15.473 -7.552 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -6.270 15.077 -7.572 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -5.247 14.229 -8.713 1.00 0.60 H new ATOM 891 N LEU A 127 -4.593 10.924 -4.548 1.00 0.32 N ATOM 892 CA LEU A 127 -4.948 10.425 -3.231 1.00 0.26 C ATOM 893 C LEU A 127 -4.232 11.207 -2.144 1.00 0.29 C ATOM 894 O LEU A 127 -3.037 11.487 -2.238 1.00 0.37 O ATOM 895 CB LEU A 127 -4.637 8.936 -3.124 1.00 0.24 C ATOM 896 CG LEU A 127 -5.276 8.060 -4.208 1.00 0.26 C ATOM 897 CD1 LEU A 127 -5.020 6.593 -3.924 1.00 0.26 C ATOM 898 CD2 LEU A 127 -6.771 8.330 -4.322 1.00 0.27 C ATOM 0 H LEU A 127 -4.161 10.229 -5.157 1.00 0.32 H new ATOM 0 HA LEU A 127 -6.020 10.562 -3.090 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -3.556 8.803 -3.161 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -4.969 8.580 -2.149 1.00 0.24 H new ATOM 0 HG LEU A 127 -4.815 8.315 -5.162 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.481 5.986 -4.703 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -3.946 6.408 -3.907 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.449 6.329 -2.957 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -7.197 7.695 -5.098 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -7.254 8.112 -3.369 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -6.933 9.377 -4.580 1.00 0.27 H new ATOM 910 N LYS A 128 -4.979 11.559 -1.115 1.00 0.29 N ATOM 911 CA LYS A 128 -4.495 12.467 -0.095 1.00 0.36 C ATOM 912 C LYS A 128 -4.057 11.743 1.168 1.00 0.26 C ATOM 913 O LYS A 128 -4.563 10.672 1.518 1.00 0.23 O ATOM 914 CB LYS A 128 -5.582 13.479 0.264 1.00 0.51 C ATOM 915 CG LYS A 128 -6.861 12.843 0.792 1.00 1.10 C ATOM 916 CD LYS A 128 -7.782 13.870 1.433 1.00 1.37 C ATOM 917 CE LYS A 128 -8.201 14.948 0.446 1.00 1.80 C ATOM 918 NZ LYS A 128 -9.117 15.940 1.068 1.00 2.27 N ATOM 0 H LYS A 128 -5.931 11.226 -0.964 1.00 0.29 H new ATOM 0 HA LYS A 128 -3.624 12.974 -0.511 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -5.192 14.167 1.015 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -5.820 14.072 -0.619 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -7.384 12.346 -0.025 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -6.609 12.075 1.523 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -8.669 13.370 1.823 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -7.277 14.331 2.282 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -7.315 15.458 0.068 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -8.693 14.486 -0.410 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -9.380 16.659 0.364 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -9.973 15.457 1.407 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -8.639 16.399 1.869 1.00 2.27 H new ATOM 932 N ASP A 129 -3.098 12.349 1.838 1.00 0.32 N ATOM 933 CA ASP A 129 -2.714 11.947 3.174 1.00 0.39 C ATOM 934 C ASP A 129 -3.660 12.581 4.185 1.00 0.45 C ATOM 935 O ASP A 129 -4.385 13.522 3.862 1.00 0.51 O ATOM 936 CB ASP A 129 -1.266 12.354 3.476 1.00 0.59 C ATOM 937 CG ASP A 129 -1.001 13.826 3.227 1.00 1.00 C ATOM 938 OD1 ASP A 129 -1.376 14.663 4.074 1.00 1.56 O ATOM 939 OD2 ASP A 129 -0.421 14.154 2.174 1.00 1.88 O ATOM 0 H ASP A 129 -2.563 13.135 1.470 1.00 0.32 H new ATOM 0 HA ASP A 129 -2.779 10.861 3.245 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -1.038 12.120 4.516 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -0.591 11.760 2.860 1.00 0.59 H new ATOM 944 N GLY A 130 -3.663 12.058 5.396 1.00 0.51 N ATOM 945 CA GLY A 130 -4.504 12.609 6.440 1.00 0.62 C ATOM 946 C GLY A 130 -5.434 11.577 7.038 1.00 0.60 C ATOM 947 O GLY A 130 -5.655 11.563 8.247 1.00 0.75 O ATOM 0 H GLY A 130 -3.097 11.258 5.680 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -3.875 13.026 7.227 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -5.092 13.431 6.032 1.00 0.62 H new ATOM 951 N ASN A 131 -5.979 10.704 6.203 1.00 0.47 N ATOM 952 CA ASN A 131 -6.797 9.610 6.700 1.00 0.46 C ATOM 953 C ASN A 131 -5.975 8.337 6.696 1.00 0.40 C ATOM 954 O ASN A 131 -5.721 7.766 5.641 1.00 0.46 O ATOM 955 CB ASN A 131 -8.045 9.403 5.833 1.00 0.51 C ATOM 956 CG ASN A 131 -8.909 10.643 5.706 1.00 1.32 C ATOM 957 OD1 ASN A 131 -8.918 11.508 6.582 1.00 2.28 O ATOM 958 ND2 ASN A 131 -9.655 10.729 4.615 1.00 1.45 N ATOM 0 H ASN A 131 -5.871 10.731 5.189 1.00 0.47 H new ATOM 0 HA ASN A 131 -7.121 9.857 7.711 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -7.737 9.082 4.838 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -8.642 8.596 6.258 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -10.266 11.534 4.477 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -9.618 9.990 3.913 1.00 1.45 H new ATOM 965 N VAL A 132 -5.555 7.896 7.865 1.00 0.36 N ATOM 966 CA VAL A 132 -4.732 6.704 7.966 1.00 0.31 C ATOM 967 C VAL A 132 -5.293 5.749 9.008 1.00 0.28 C ATOM 968 O VAL A 132 -5.644 6.147 10.119 1.00 0.35 O ATOM 969 CB VAL A 132 -3.264 7.051 8.294 1.00 0.35 C ATOM 970 CG1 VAL A 132 -3.178 7.890 9.555 1.00 0.73 C ATOM 971 CG2 VAL A 132 -2.424 5.790 8.431 1.00 0.71 C ATOM 0 H VAL A 132 -5.768 8.343 8.757 1.00 0.36 H new ATOM 0 HA VAL A 132 -4.750 6.213 6.993 1.00 0.31 H new ATOM 0 HB VAL A 132 -2.864 7.636 7.466 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -2.134 8.123 9.767 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -3.735 8.816 9.414 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -3.603 7.335 10.391 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -1.394 6.062 8.662 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -2.825 5.171 9.234 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.450 5.232 7.495 1.00 0.71 H new ATOM 981 N ILE A 133 -5.387 4.489 8.628 1.00 0.23 N ATOM 982 CA ILE A 133 -5.985 3.480 9.478 1.00 0.26 C ATOM 983 C ILE A 133 -4.910 2.582 10.085 1.00 0.28 C ATOM 984 O ILE A 133 -4.851 2.400 11.299 1.00 0.38 O ATOM 985 CB ILE A 133 -6.978 2.613 8.677 1.00 0.31 C ATOM 986 CG1 ILE A 133 -7.936 3.493 7.858 1.00 0.34 C ATOM 987 CG2 ILE A 133 -7.760 1.699 9.607 1.00 0.38 C ATOM 988 CD1 ILE A 133 -8.786 4.431 8.692 1.00 0.35 C ATOM 0 H ILE A 133 -5.054 4.139 7.730 1.00 0.23 H new ATOM 0 HA ILE A 133 -6.519 3.992 10.278 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.406 1.995 7.984 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.354 4.082 7.149 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.593 2.849 7.273 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -8.455 1.095 9.024 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.070 1.045 10.139 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.316 2.301 10.325 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.433 5.015 8.037 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.398 3.851 9.383 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.140 5.103 9.257 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.047 2.051 9.228 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.027 1.099 9.647 1.00 0.30 C ATOM 1002 C GLU A 134 -1.671 1.507 9.085 1.00 0.23 C ATOM 1003 O GLU A 134 -1.596 2.065 7.992 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.372 -0.309 9.149 1.00 0.43 C ATOM 1005 CG GLU A 134 -4.695 -0.858 9.664 1.00 0.63 C ATOM 1006 CD GLU A 134 -4.673 -1.156 11.147 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -5.379 -0.467 11.914 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -3.945 -2.084 11.555 1.00 1.42 O ATOM 0 H GLU A 134 -4.034 2.266 8.231 1.00 0.25 H new ATOM 0 HA GLU A 134 -2.988 1.096 10.736 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -3.398 -0.298 8.059 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -2.573 -0.990 9.442 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -5.487 -0.139 9.455 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -4.941 -1.770 9.119 1.00 0.63 H new ATOM 1015 N LYS A 135 -0.611 1.239 9.831 1.00 0.28 N ATOM 1016 CA LYS A 135 0.747 1.507 9.373 1.00 0.25 C ATOM 1017 C LYS A 135 1.673 0.381 9.804 1.00 0.27 C ATOM 1018 O LYS A 135 1.440 -0.260 10.826 1.00 0.34 O ATOM 1019 CB LYS A 135 1.270 2.834 9.934 1.00 0.32 C ATOM 1020 CG LYS A 135 0.455 4.048 9.522 1.00 0.56 C ATOM 1021 CD LYS A 135 1.120 5.345 9.954 1.00 0.62 C ATOM 1022 CE LYS A 135 1.207 5.459 11.468 1.00 0.74 C ATOM 1023 NZ LYS A 135 -0.135 5.568 12.107 1.00 1.53 N ATOM 0 H LYS A 135 -0.664 0.832 10.765 1.00 0.28 H new ATOM 0 HA LYS A 135 0.726 1.573 8.285 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.287 2.774 11.022 1.00 0.32 H new ATOM 0 HB3 LYS A 135 2.300 2.973 9.606 1.00 0.32 H new ATOM 0 HG2 LYS A 135 0.325 4.049 8.440 1.00 0.56 H new ATOM 0 HG3 LYS A 135 -0.540 3.985 9.963 1.00 0.56 H new ATOM 0 HD2 LYS A 135 2.122 5.399 9.527 1.00 0.62 H new ATOM 0 HD3 LYS A 135 0.558 6.191 9.558 1.00 0.62 H new ATOM 0 HE2 LYS A 135 1.726 4.587 11.866 1.00 0.74 H new ATOM 0 HE3 LYS A 135 1.803 6.333 11.730 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 -0.022 5.779 13.119 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 -0.675 6.332 11.653 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 -0.646 4.669 11.996 1.00 1.53 H new ATOM 1037 N GLY A 136 2.718 0.141 9.030 1.00 0.30 N ATOM 1038 CA GLY A 136 3.662 -0.904 9.374 1.00 0.38 C ATOM 1039 C GLY A 136 4.849 -0.942 8.438 1.00 0.34 C ATOM 1040 O GLY A 136 5.175 0.066 7.809 1.00 0.29 O ATOM 0 H GLY A 136 2.931 0.649 8.171 1.00 0.30 H new ATOM 0 HA2 GLY A 136 4.013 -0.751 10.395 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.155 -1.869 9.352 1.00 0.38 H new ATOM 1044 N PHE A 137 5.482 -2.104 8.336 1.00 0.38 N ATOM 1045 CA PHE A 137 6.638 -2.280 7.466 1.00 0.32 C ATOM 1046 C PHE A 137 6.339 -3.295 6.367 1.00 0.33 C ATOM 1047 O PHE A 137 5.443 -4.130 6.502 1.00 0.46 O ATOM 1048 CB PHE A 137 7.857 -2.740 8.268 1.00 0.42 C ATOM 1049 CG PHE A 137 8.349 -1.730 9.268 1.00 1.07 C ATOM 1050 CD1 PHE A 137 8.874 -0.519 8.847 1.00 2.05 C ATOM 1051 CD2 PHE A 137 8.297 -1.996 10.627 1.00 1.81 C ATOM 1052 CE1 PHE A 137 9.337 0.405 9.762 1.00 2.86 C ATOM 1053 CE2 PHE A 137 8.756 -1.073 11.545 1.00 2.60 C ATOM 1054 CZ PHE A 137 9.277 0.128 11.112 1.00 2.93 C ATOM 0 H PHE A 137 5.212 -2.944 8.849 1.00 0.38 H new ATOM 0 HA PHE A 137 6.858 -1.315 7.009 1.00 0.32 H new ATOM 0 HB2 PHE A 137 7.607 -3.663 8.792 1.00 0.42 H new ATOM 0 HB3 PHE A 137 8.666 -2.975 7.577 1.00 0.42 H new ATOM 0 HD1 PHE A 137 8.922 -0.295 7.791 1.00 2.05 H new ATOM 0 HD2 PHE A 137 7.893 -2.936 10.972 1.00 1.81 H new ATOM 0 HE1 PHE A 137 9.746 1.345 9.421 1.00 2.86 H new ATOM 0 HE2 PHE A 137 8.707 -1.291 12.602 1.00 2.60 H new ATOM 0 HZ PHE A 137 9.638 0.851 11.829 1.00 2.93 H new ATOM 1064 N VAL A 138 7.103 -3.212 5.285 1.00 0.27 N ATOM 1065 CA VAL A 138 6.911 -4.073 4.120 1.00 0.41 C ATOM 1066 C VAL A 138 7.674 -5.394 4.272 1.00 0.70 C ATOM 1067 O VAL A 138 7.608 -6.269 3.408 1.00 1.41 O ATOM 1068 CB VAL A 138 7.340 -3.346 2.817 1.00 0.53 C ATOM 1069 CG1 VAL A 138 7.022 -4.178 1.585 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.663 -1.987 2.714 1.00 0.48 C ATOM 0 H VAL A 138 7.872 -2.549 5.188 1.00 0.27 H new ATOM 0 HA VAL A 138 5.848 -4.303 4.053 1.00 0.41 H new ATOM 0 HB VAL A 138 8.420 -3.204 2.862 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.336 -3.639 0.691 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.553 -5.128 1.641 1.00 0.76 H new ATOM 0 HG13 VAL A 138 5.949 -4.364 1.539 1.00 0.76 H new ATOM 0 HG21 VAL A 138 6.976 -1.493 1.794 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.581 -2.119 2.704 1.00 0.48 H new ATOM 0 HG23 VAL A 138 6.946 -1.374 3.570 1.00 0.48 H new ATOM 1080 N SER A 139 8.407 -5.527 5.370 1.00 0.32 N ATOM 1081 CA SER A 139 9.237 -6.704 5.618 1.00 0.51 C ATOM 1082 C SER A 139 8.406 -7.982 5.804 1.00 0.39 C ATOM 1083 O SER A 139 8.213 -8.461 6.921 1.00 1.13 O ATOM 1084 CB SER A 139 10.113 -6.460 6.844 1.00 1.03 C ATOM 1085 OG SER A 139 10.942 -5.326 6.648 1.00 1.68 O ATOM 0 H SER A 139 8.445 -4.828 6.111 1.00 0.32 H new ATOM 0 HA SER A 139 9.861 -6.859 4.738 1.00 0.51 H new ATOM 0 HB2 SER A 139 9.485 -6.311 7.722 1.00 1.03 H new ATOM 0 HB3 SER A 139 10.729 -7.338 7.038 1.00 1.03 H new ATOM 0 HG SER A 139 11.376 -5.088 7.494 1.00 1.68 H new ATOM 1091 N ASN A 140 7.915 -8.511 4.695 1.00 0.51 N ATOM 1092 CA ASN A 140 7.226 -9.792 4.670 1.00 0.34 C ATOM 1093 C ASN A 140 7.488 -10.468 3.328 1.00 0.27 C ATOM 1094 O ASN A 140 6.811 -10.196 2.335 1.00 0.37 O ATOM 1095 CB ASN A 140 5.722 -9.599 4.890 1.00 0.37 C ATOM 1096 CG ASN A 140 4.944 -10.904 4.923 1.00 0.38 C ATOM 1097 OD1 ASN A 140 3.794 -10.960 4.484 1.00 0.94 O ATOM 1098 ND2 ASN A 140 5.545 -11.953 5.465 1.00 0.88 N ATOM 0 H ASN A 140 7.983 -8.062 3.782 1.00 0.51 H new ATOM 0 HA ASN A 140 7.602 -10.423 5.475 1.00 0.34 H new ATOM 0 HB2 ASN A 140 5.565 -9.067 5.828 1.00 0.37 H new ATOM 0 HB3 ASN A 140 5.324 -8.968 4.096 1.00 0.37 H new ATOM 0 HD21 ASN A 140 5.054 -12.845 5.529 1.00 0.88 H new ATOM 0 HD22 ASN A 140 6.498 -11.869 5.818 1.00 0.88 H new ATOM 1105 N GLN A 141 8.500 -11.319 3.301 1.00 0.35 N ATOM 1106 CA GLN A 141 8.929 -11.973 2.073 1.00 0.32 C ATOM 1107 C GLN A 141 7.982 -13.118 1.716 1.00 0.30 C ATOM 1108 O GLN A 141 8.020 -14.178 2.340 1.00 0.36 O ATOM 1109 CB GLN A 141 10.348 -12.516 2.247 1.00 0.39 C ATOM 1110 CG GLN A 141 10.993 -12.993 0.957 1.00 0.39 C ATOM 1111 CD GLN A 141 11.614 -11.867 0.155 1.00 0.52 C ATOM 1112 OE1 GLN A 141 12.793 -11.561 0.312 1.00 0.69 O ATOM 1113 NE2 GLN A 141 10.829 -11.238 -0.706 1.00 0.63 N ATOM 0 H GLN A 141 9.045 -11.576 4.124 1.00 0.35 H new ATOM 0 HA GLN A 141 8.914 -11.242 1.265 1.00 0.32 H new ATOM 0 HB2 GLN A 141 10.972 -11.738 2.686 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.324 -13.343 2.956 1.00 0.39 H new ATOM 0 HG2 GLN A 141 11.760 -13.731 1.192 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.243 -13.496 0.347 1.00 0.39 H new ATOM 0 HE21 GLN A 141 9.854 -11.521 -0.808 1.00 0.63 H new ATOM 0 HE22 GLN A 141 11.199 -10.470 -1.267 1.00 0.63 H new ATOM 1122 N ILE A 142 7.126 -12.899 0.728 1.00 0.25 N ATOM 1123 CA ILE A 142 6.208 -13.942 0.276 1.00 0.27 C ATOM 1124 C ILE A 142 6.778 -14.696 -0.918 1.00 0.30 C ATOM 1125 O ILE A 142 6.323 -15.793 -1.249 1.00 0.37 O ATOM 1126 CB ILE A 142 4.824 -13.381 -0.105 1.00 0.27 C ATOM 1127 CG1 ILE A 142 4.951 -12.319 -1.206 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.140 -12.808 1.127 1.00 0.29 C ATOM 1129 CD1 ILE A 142 3.636 -11.960 -1.863 1.00 0.26 C ATOM 0 H ILE A 142 7.046 -12.015 0.225 1.00 0.25 H new ATOM 0 HA ILE A 142 6.086 -14.622 1.119 1.00 0.27 H new ATOM 0 HB ILE A 142 4.212 -14.193 -0.497 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.391 -11.418 -0.779 1.00 0.24 H new ATOM 0 HG13 ILE A 142 5.641 -12.680 -1.969 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.162 -12.413 0.850 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.016 -13.593 1.873 1.00 0.29 H new ATOM 0 HG23 ILE A 142 4.751 -12.006 1.542 1.00 0.29 H new ATOM 0 HD11 ILE A 142 3.807 -11.204 -2.630 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.203 -12.850 -2.320 1.00 0.26 H new ATOM 0 HD13 ILE A 142 2.950 -11.567 -1.113 1.00 0.26 H new ATOM 1141 N GLY A 143 7.768 -14.105 -1.566 1.00 0.28 N ATOM 1142 CA GLY A 143 8.384 -14.746 -2.710 1.00 0.34 C ATOM 1143 C GLY A 143 9.884 -14.602 -2.692 1.00 0.40 C ATOM 1144 O GLY A 143 10.471 -14.363 -1.641 1.00 0.53 O ATOM 0 H GLY A 143 8.157 -13.194 -1.322 1.00 0.28 H new ATOM 0 HA2 GLY A 143 8.121 -15.804 -2.720 1.00 0.34 H new ATOM 0 HA3 GLY A 143 7.988 -14.311 -3.627 1.00 0.34 H new ATOM 1148 N ASP A 144 10.507 -14.732 -3.850 1.00 0.48 N ATOM 1149 CA ASP A 144 11.957 -14.621 -3.944 1.00 0.56 C ATOM 1150 C ASP A 144 12.365 -13.154 -3.959 1.00 0.48 C ATOM 1151 O ASP A 144 13.319 -12.754 -3.299 1.00 0.56 O ATOM 1152 CB ASP A 144 12.477 -15.334 -5.197 1.00 0.70 C ATOM 1153 CG ASP A 144 12.074 -16.795 -5.243 1.00 1.63 C ATOM 1154 OD1 ASP A 144 11.055 -17.110 -5.895 1.00 2.49 O ATOM 1155 OD2 ASP A 144 12.765 -17.634 -4.627 1.00 2.30 O ATOM 0 H ASP A 144 10.036 -14.914 -4.737 1.00 0.48 H new ATOM 0 HA ASP A 144 12.400 -15.103 -3.072 1.00 0.56 H new ATOM 0 HB2 ASP A 144 12.096 -14.827 -6.084 1.00 0.70 H new ATOM 0 HB3 ASP A 144 13.564 -15.259 -5.229 1.00 0.70 H new ATOM 1160 N SER A 145 11.623 -12.355 -4.709 1.00 0.38 N ATOM 1161 CA SER A 145 11.841 -10.917 -4.749 1.00 0.35 C ATOM 1162 C SER A 145 10.526 -10.181 -4.546 1.00 0.31 C ATOM 1163 O SER A 145 10.319 -9.091 -5.078 1.00 0.36 O ATOM 1164 CB SER A 145 12.460 -10.506 -6.085 1.00 0.38 C ATOM 1165 OG SER A 145 13.765 -11.040 -6.236 1.00 1.08 O ATOM 0 H SER A 145 10.860 -12.680 -5.302 1.00 0.38 H new ATOM 0 HA SER A 145 12.528 -10.652 -3.946 1.00 0.35 H new ATOM 0 HB2 SER A 145 11.827 -10.851 -6.903 1.00 0.38 H new ATOM 0 HB3 SER A 145 12.500 -9.419 -6.150 1.00 0.38 H new ATOM 0 HG SER A 145 14.134 -10.762 -7.100 1.00 1.08 H new ATOM 1171 N LEU A 146 9.641 -10.771 -3.760 1.00 0.27 N ATOM 1172 CA LEU A 146 8.308 -10.230 -3.607 1.00 0.22 C ATOM 1173 C LEU A 146 7.949 -10.076 -2.133 1.00 0.21 C ATOM 1174 O LEU A 146 8.087 -11.019 -1.345 1.00 0.23 O ATOM 1175 CB LEU A 146 7.310 -11.145 -4.308 1.00 0.23 C ATOM 1176 CG LEU A 146 6.045 -10.467 -4.810 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.386 -9.424 -5.862 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.081 -11.498 -5.370 1.00 0.27 C ATOM 0 H LEU A 146 9.823 -11.619 -3.223 1.00 0.27 H new ATOM 0 HA LEU A 146 8.272 -9.240 -4.062 1.00 0.22 H new ATOM 0 HB2 LEU A 146 7.809 -11.618 -5.154 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.027 -11.941 -3.619 1.00 0.23 H new ATOM 0 HG LEU A 146 5.562 -9.964 -3.972 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.470 -8.947 -6.212 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.044 -8.671 -5.428 1.00 0.26 H new ATOM 0 HD13 LEU A 146 6.888 -9.905 -6.701 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.180 -10.998 -5.726 1.00 0.27 H new ATOM 0 HD22 LEU A 146 5.554 -12.026 -6.198 1.00 0.27 H new ATOM 0 HD23 LEU A 146 4.816 -12.211 -4.589 1.00 0.27 H new ATOM 1190 N TYR A 147 7.507 -8.881 -1.772 1.00 0.18 N ATOM 1191 CA TYR A 147 7.103 -8.572 -0.408 1.00 0.18 C ATOM 1192 C TYR A 147 5.617 -8.254 -0.366 1.00 0.16 C ATOM 1193 O TYR A 147 5.030 -7.873 -1.378 1.00 0.19 O ATOM 1194 CB TYR A 147 7.903 -7.385 0.136 1.00 0.19 C ATOM 1195 CG TYR A 147 9.349 -7.703 0.451 1.00 0.23 C ATOM 1196 CD1 TYR A 147 9.756 -7.958 1.756 1.00 1.21 C ATOM 1197 CD2 TYR A 147 10.306 -7.747 -0.553 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.073 -8.246 2.050 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.624 -8.036 -0.268 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.004 -8.284 1.034 1.00 0.36 C ATOM 1201 OH TYR A 147 13.319 -8.570 1.322 1.00 0.43 O ATOM 0 H TYR A 147 7.418 -8.096 -2.418 1.00 0.18 H new ATOM 0 HA TYR A 147 7.303 -9.442 0.217 1.00 0.18 H new ATOM 0 HB2 TYR A 147 7.871 -6.575 -0.593 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.418 -7.018 1.041 1.00 0.19 H new ATOM 0 HD1 TYR A 147 9.028 -7.930 2.554 1.00 1.21 H new ATOM 0 HD2 TYR A 147 10.014 -7.552 -1.574 1.00 1.10 H new ATOM 0 HE1 TYR A 147 11.372 -8.440 3.069 1.00 1.24 H new ATOM 0 HE2 TYR A 147 12.356 -8.068 -1.062 1.00 1.10 H new ATOM 0 HH TYR A 147 13.497 -9.516 1.135 1.00 0.43 H new ATOM 1211 N LYS A 148 5.014 -8.403 0.799 1.00 0.17 N ATOM 1212 CA LYS A 148 3.580 -8.212 0.936 1.00 0.18 C ATOM 1213 C LYS A 148 3.245 -7.489 2.234 1.00 0.19 C ATOM 1214 O LYS A 148 3.849 -7.743 3.275 1.00 0.28 O ATOM 1215 CB LYS A 148 2.891 -9.576 0.893 1.00 0.26 C ATOM 1216 CG LYS A 148 1.372 -9.533 0.837 1.00 0.34 C ATOM 1217 CD LYS A 148 0.816 -10.927 0.589 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.701 -10.952 0.530 1.00 0.62 C ATOM 1219 NZ LYS A 148 -1.202 -12.291 0.119 1.00 0.84 N ATOM 0 H LYS A 148 5.493 -8.655 1.663 1.00 0.17 H new ATOM 0 HA LYS A 148 3.223 -7.593 0.113 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.255 -10.122 0.023 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.190 -10.144 1.774 1.00 0.26 H new ATOM 0 HG2 LYS A 148 0.977 -9.137 1.773 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.049 -8.858 0.044 1.00 0.34 H new ATOM 0 HD2 LYS A 148 1.218 -11.312 -0.348 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.156 -11.595 1.380 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -1.110 -10.692 1.506 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -1.053 -10.198 -0.174 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -2.241 -12.278 0.087 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -0.830 -12.527 -0.823 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.885 -13.006 0.805 1.00 0.84 H new ATOM 1233 N ILE A 149 2.297 -6.574 2.156 1.00 0.15 N ATOM 1234 CA ILE A 149 1.814 -5.864 3.326 1.00 0.18 C ATOM 1235 C ILE A 149 0.314 -6.047 3.462 1.00 0.22 C ATOM 1236 O ILE A 149 -0.411 -5.963 2.476 1.00 0.35 O ATOM 1237 CB ILE A 149 2.166 -4.364 3.271 1.00 0.18 C ATOM 1238 CG1 ILE A 149 1.733 -3.733 1.943 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.655 -4.185 3.476 1.00 0.19 C ATOM 1240 CD1 ILE A 149 2.029 -2.251 1.849 1.00 0.20 C ATOM 0 H ILE A 149 1.842 -6.303 1.284 1.00 0.15 H new ATOM 0 HA ILE A 149 2.311 -6.286 4.200 1.00 0.18 H new ATOM 0 HB ILE A 149 1.624 -3.856 4.068 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.237 -4.248 1.125 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.663 -3.890 1.808 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.903 -3.124 3.437 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.940 -4.589 4.448 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.196 -4.713 2.691 1.00 0.19 H new ATOM 0 HD11 ILE A 149 1.695 -1.874 0.882 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.504 -1.724 2.645 1.00 0.20 H new ATOM 0 HD13 ILE A 149 3.102 -2.087 1.952 1.00 0.20 H new ATOM 1252 N GLU A 150 -0.140 -6.319 4.673 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.539 -6.648 4.909 1.00 0.27 C ATOM 1254 C GLU A 150 -2.088 -5.874 6.092 1.00 0.24 C ATOM 1255 O GLU A 150 -1.360 -5.552 7.033 1.00 0.31 O ATOM 1256 CB GLU A 150 -1.681 -8.143 5.185 1.00 0.40 C ATOM 1257 CG GLU A 150 -1.169 -9.030 4.066 1.00 1.08 C ATOM 1258 CD GLU A 150 -1.105 -10.480 4.474 1.00 1.55 C ATOM 1259 OE1 GLU A 150 -2.065 -11.225 4.196 1.00 2.03 O ATOM 1260 OE2 GLU A 150 -0.091 -10.883 5.081 1.00 2.30 O ATOM 0 H GLU A 150 0.440 -6.319 5.512 1.00 0.24 H new ATOM 0 HA GLU A 150 -2.104 -6.377 4.017 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -1.143 -8.385 6.101 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -2.732 -8.371 5.363 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -1.819 -8.927 3.197 1.00 1.08 H new ATOM 0 HG3 GLU A 150 -0.177 -8.695 3.764 1.00 1.08 H new ATOM 1267 N THR A 151 -3.377 -5.582 6.041 1.00 0.21 N ATOM 1268 CA THR A 151 -4.053 -4.931 7.142 1.00 0.23 C ATOM 1269 C THR A 151 -4.354 -5.947 8.238 1.00 0.24 C ATOM 1270 O THR A 151 -4.810 -7.060 7.969 1.00 0.27 O ATOM 1271 CB THR A 151 -5.359 -4.252 6.677 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.288 -5.225 6.182 1.00 0.25 O ATOM 1273 CG2 THR A 151 -5.071 -3.236 5.585 1.00 0.29 C ATOM 0 H THR A 151 -3.976 -5.789 5.242 1.00 0.21 H new ATOM 0 HA THR A 151 -3.394 -4.157 7.535 1.00 0.23 H new ATOM 0 HB THR A 151 -5.796 -3.745 7.537 1.00 0.25 H new ATOM 0 HG1 THR A 151 -7.001 -5.361 6.840 1.00 0.25 H new ATOM 0 HG21 THR A 151 -6.003 -2.767 5.269 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.393 -2.473 5.967 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.611 -3.737 4.734 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.078 -5.549 9.475 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.220 -6.423 10.635 1.00 0.38 C ATOM 1283 C LYS A 152 -5.665 -6.882 10.821 1.00 0.39 C ATOM 1284 O LYS A 152 -5.923 -7.909 11.450 1.00 0.51 O ATOM 1285 CB LYS A 152 -3.721 -5.684 11.884 1.00 0.48 C ATOM 1286 CG LYS A 152 -3.772 -6.499 13.166 1.00 0.80 C ATOM 1287 CD LYS A 152 -2.978 -5.829 14.279 1.00 1.02 C ATOM 1288 CE LYS A 152 -3.538 -4.460 14.637 1.00 1.99 C ATOM 1289 NZ LYS A 152 -4.886 -4.552 15.258 1.00 2.42 N ATOM 0 H LYS A 152 -3.749 -4.611 9.703 1.00 0.31 H new ATOM 0 HA LYS A 152 -3.619 -7.318 10.473 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -2.693 -5.364 11.714 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.318 -4.782 12.019 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -4.808 -6.623 13.480 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -3.373 -7.497 12.982 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -2.986 -6.466 15.163 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -1.938 -5.725 13.970 1.00 1.02 H new ATOM 0 HE2 LYS A 152 -2.856 -3.958 15.324 1.00 1.99 H new ATOM 0 HE3 LYS A 152 -3.594 -3.846 13.738 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 -5.179 -3.612 15.593 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 -5.570 -4.897 14.554 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 -4.854 -5.211 16.062 1.00 2.42 H new ATOM 1303 N LYS A 153 -6.599 -6.128 10.258 1.00 0.37 N ATOM 1304 CA LYS A 153 -8.011 -6.453 10.376 1.00 0.43 C ATOM 1305 C LYS A 153 -8.737 -6.211 9.057 1.00 0.40 C ATOM 1306 O LYS A 153 -8.251 -5.475 8.193 1.00 0.40 O ATOM 1307 CB LYS A 153 -8.644 -5.632 11.505 1.00 0.51 C ATOM 1308 CG LYS A 153 -8.517 -4.124 11.336 1.00 0.57 C ATOM 1309 CD LYS A 153 -8.919 -3.395 12.609 1.00 0.66 C ATOM 1310 CE LYS A 153 -8.825 -1.886 12.455 1.00 0.69 C ATOM 1311 NZ LYS A 153 -9.851 -1.351 11.519 1.00 1.29 N ATOM 0 H LYS A 153 -6.403 -5.287 9.715 1.00 0.37 H new ATOM 0 HA LYS A 153 -8.106 -7.512 10.618 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -9.701 -5.889 11.576 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.182 -5.919 12.449 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -7.490 -3.869 11.076 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -9.146 -3.793 10.510 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -9.939 -3.669 12.877 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -8.277 -3.716 13.429 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -8.945 -1.415 13.431 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -7.832 -1.621 12.093 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -9.970 -0.331 11.681 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -9.544 -1.512 10.538 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -10.757 -1.836 11.683 1.00 1.29 H new ATOM 1325 N LYS A 154 -9.888 -6.862 8.905 1.00 0.43 N ATOM 1326 CA LYS A 154 -10.719 -6.708 7.718 1.00 0.44 C ATOM 1327 C LYS A 154 -11.431 -5.363 7.766 1.00 0.53 C ATOM 1328 O LYS A 154 -12.003 -4.998 8.795 1.00 0.67 O ATOM 1329 CB LYS A 154 -11.754 -7.838 7.634 1.00 0.44 C ATOM 1330 CG LYS A 154 -11.156 -9.239 7.612 1.00 0.47 C ATOM 1331 CD LYS A 154 -12.246 -10.302 7.643 1.00 0.54 C ATOM 1332 CE LYS A 154 -11.675 -11.699 7.863 1.00 0.66 C ATOM 1333 NZ LYS A 154 -10.882 -12.184 6.702 1.00 1.41 N ATOM 0 H LYS A 154 -10.267 -7.507 9.598 1.00 0.43 H new ATOM 0 HA LYS A 154 -10.081 -6.754 6.835 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.431 -7.758 8.485 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.354 -7.698 6.735 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -10.548 -9.364 6.716 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -10.493 -9.368 8.468 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -12.955 -10.071 8.438 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -12.800 -10.280 6.705 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -11.044 -11.693 8.752 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -12.492 -12.395 8.056 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -10.518 -13.137 6.904 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -11.488 -12.217 5.857 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -10.085 -11.538 6.531 1.00 1.41 H new ATOM 1347 N MET A 155 -11.403 -4.631 6.664 1.00 0.61 N ATOM 1348 CA MET A 155 -11.963 -3.288 6.634 1.00 0.76 C ATOM 1349 C MET A 155 -13.400 -3.299 6.137 1.00 0.62 C ATOM 1350 O MET A 155 -13.908 -4.328 5.686 1.00 0.57 O ATOM 1351 CB MET A 155 -11.107 -2.373 5.758 1.00 1.01 C ATOM 1352 CG MET A 155 -9.685 -2.221 6.268 1.00 1.22 C ATOM 1353 SD MET A 155 -9.617 -1.597 7.959 1.00 0.95 S ATOM 1354 CE MET A 155 -7.874 -1.784 8.300 1.00 0.80 C ATOM 0 H MET A 155 -11.000 -4.942 5.780 1.00 0.61 H new ATOM 0 HA MET A 155 -11.963 -2.903 7.654 1.00 0.76 H new ATOM 0 HB2 MET A 155 -11.082 -2.770 4.743 1.00 1.01 H new ATOM 0 HB3 MET A 155 -11.575 -1.390 5.704 1.00 1.01 H new ATOM 0 HG2 MET A 155 -9.181 -3.186 6.220 1.00 1.22 H new ATOM 0 HG3 MET A 155 -9.138 -1.543 5.612 1.00 1.22 H new ATOM 0 HE1 MET A 155 -7.729 -2.583 9.027 1.00 0.80 H new ATOM 0 HE2 MET A 155 -7.348 -2.032 7.378 1.00 0.80 H new ATOM 0 HE3 MET A 155 -7.480 -0.851 8.703 1.00 0.80 H new ATOM 1364 N LYS A 156 -14.045 -2.146 6.229 1.00 0.65 N ATOM 1365 CA LYS A 156 -15.441 -2.008 5.850 1.00 0.59 C ATOM 1366 C LYS A 156 -15.556 -1.211 4.551 1.00 0.44 C ATOM 1367 O LYS A 156 -14.622 -0.497 4.190 1.00 0.42 O ATOM 1368 CB LYS A 156 -16.223 -1.332 6.985 1.00 0.72 C ATOM 1369 CG LYS A 156 -15.660 0.014 7.413 1.00 1.28 C ATOM 1370 CD LYS A 156 -16.428 0.604 8.592 1.00 1.79 C ATOM 1371 CE LYS A 156 -15.980 0.029 9.934 1.00 2.54 C ATOM 1372 NZ LYS A 156 -16.230 -1.434 10.061 1.00 3.40 N ATOM 0 H LYS A 156 -13.617 -1.284 6.567 1.00 0.65 H new ATOM 0 HA LYS A 156 -15.869 -2.996 5.679 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -17.257 -1.197 6.668 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -16.238 -1.998 7.848 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -14.611 -0.101 7.685 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -15.697 0.707 6.572 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -16.295 1.686 8.602 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -17.493 0.415 8.458 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -14.915 0.222 10.067 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -16.501 0.551 10.737 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -16.349 -1.680 11.064 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -17.093 -1.685 9.538 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -15.423 -1.959 9.669 1.00 3.40 H new ATOM 1386 N PRO A 157 -16.693 -1.334 3.834 1.00 0.46 N ATOM 1387 CA PRO A 157 -16.918 -0.682 2.538 1.00 0.41 C ATOM 1388 C PRO A 157 -16.428 0.764 2.482 1.00 0.37 C ATOM 1389 O PRO A 157 -16.769 1.589 3.333 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.443 -0.737 2.354 1.00 0.52 C ATOM 1391 CG PRO A 157 -18.988 -1.346 3.606 1.00 0.63 C ATOM 1392 CD PRO A 157 -17.861 -2.126 4.214 1.00 0.63 C ATOM 0 HA PRO A 157 -16.357 -1.187 1.752 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.853 0.260 2.195 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -18.709 -1.334 1.482 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -19.343 -0.576 4.291 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -19.837 -1.994 3.387 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -17.961 -2.209 5.296 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -17.810 -3.141 3.820 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.629 1.054 1.469 1.00 0.32 N ATOM 1401 CA GLY A 158 -15.069 2.373 1.292 1.00 0.33 C ATOM 1402 C GLY A 158 -13.897 2.344 0.337 1.00 0.27 C ATOM 1403 O GLY A 158 -13.576 1.290 -0.217 1.00 0.27 O ATOM 0 H GLY A 158 -15.354 0.382 0.752 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.835 3.049 0.912 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.747 2.767 2.256 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.256 3.483 0.140 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.109 3.565 -0.751 1.00 0.26 C ATOM 1409 C ILE A 159 -10.826 3.491 0.059 1.00 0.21 C ATOM 1410 O ILE A 159 -10.632 4.265 0.995 1.00 0.24 O ATOM 1411 CB ILE A 159 -12.111 4.872 -1.572 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.483 5.097 -2.218 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -11.017 4.830 -2.634 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.604 6.415 -2.952 1.00 0.44 C ATOM 0 H ILE A 159 -13.510 4.365 0.585 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.171 2.727 -1.445 1.00 0.26 H new ATOM 0 HB ILE A 159 -11.909 5.706 -0.900 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.684 4.284 -2.915 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.250 5.051 -1.445 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -11.029 5.758 -3.206 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -10.046 4.714 -2.152 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -11.192 3.988 -3.304 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.602 6.502 -3.382 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.436 7.236 -2.255 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -12.861 6.457 -3.748 1.00 0.44 H new ATOM 1426 N TYR A 160 -9.960 2.554 -0.280 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.703 2.407 0.433 1.00 0.17 C ATOM 1428 C TYR A 160 -7.535 2.359 -0.534 1.00 0.16 C ATOM 1429 O TYR A 160 -7.693 1.997 -1.700 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.705 1.141 1.292 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.694 1.159 2.440 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -11.007 0.740 2.262 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -9.309 1.582 3.708 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -11.906 0.742 3.311 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -10.203 1.587 4.760 1.00 1.24 C ATOM 1436 CZ TYR A 160 -11.499 1.166 4.558 1.00 0.35 C ATOM 1437 OH TYR A 160 -12.389 1.166 5.609 1.00 0.43 O ATOM 0 H TYR A 160 -10.101 1.887 -1.039 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.592 3.275 1.082 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -8.925 0.285 0.654 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.704 0.989 1.695 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -11.330 0.407 1.287 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -8.294 1.912 3.872 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -12.923 0.413 3.155 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -9.887 1.920 5.738 1.00 1.24 H new ATOM 0 HH TYR A 160 -13.187 0.653 5.362 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.370 2.735 -0.037 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.141 2.661 -0.799 1.00 0.14 C ATOM 1449 C ALA A 161 -3.954 2.626 0.146 1.00 0.14 C ATOM 1450 O ALA A 161 -4.037 3.109 1.278 1.00 0.14 O ATOM 1451 CB ALA A 161 -5.023 3.842 -1.748 1.00 0.14 C ATOM 0 H ALA A 161 -6.252 3.100 0.908 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.153 1.748 -1.394 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.092 3.766 -2.310 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -5.866 3.839 -2.439 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -5.026 4.770 -1.176 1.00 0.14 H new ATOM 1457 N PHE A 162 -2.860 2.051 -0.317 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.649 1.969 0.478 1.00 0.15 C ATOM 1459 C PHE A 162 -0.678 3.064 0.078 1.00 0.15 C ATOM 1460 O PHE A 162 -0.358 3.226 -1.101 1.00 0.15 O ATOM 1461 CB PHE A 162 -0.982 0.599 0.324 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.731 -0.516 1.000 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -1.463 -0.841 2.321 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -2.695 -1.241 0.320 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -2.143 -1.866 2.950 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -3.378 -2.266 0.944 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.101 -2.580 2.260 1.00 0.24 C ATOM 0 H PHE A 162 -2.785 1.632 -1.244 1.00 0.14 H new ATOM 0 HA PHE A 162 -1.925 2.102 1.524 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -0.885 0.369 -0.737 1.00 0.17 H new ATOM 0 HB3 PHE A 162 0.027 0.648 0.733 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -0.713 -0.286 2.865 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -2.915 -1.002 -0.710 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -1.925 -2.108 3.980 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -4.129 -2.822 0.403 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.633 -3.383 2.748 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.238 3.820 1.064 1.00 0.16 N ATOM 1478 CA LYS A 163 0.725 4.883 0.853 1.00 0.18 C ATOM 1479 C LYS A 163 2.098 4.428 1.320 1.00 0.20 C ATOM 1480 O LYS A 163 2.403 4.472 2.512 1.00 0.23 O ATOM 1481 CB LYS A 163 0.303 6.146 1.622 1.00 0.23 C ATOM 1482 CG LYS A 163 1.313 7.291 1.556 1.00 0.31 C ATOM 1483 CD LYS A 163 0.845 8.489 2.382 1.00 0.45 C ATOM 1484 CE LYS A 163 1.953 9.517 2.583 1.00 0.74 C ATOM 1485 NZ LYS A 163 3.080 8.971 3.387 1.00 1.28 N ATOM 0 H LYS A 163 -0.537 3.715 2.033 1.00 0.16 H new ATOM 0 HA LYS A 163 0.764 5.119 -0.210 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.651 6.496 1.227 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.138 5.883 2.667 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.280 6.948 1.924 1.00 0.31 H new ATOM 0 HG3 LYS A 163 1.456 7.594 0.519 1.00 0.31 H new ATOM 0 HD2 LYS A 163 -0.002 8.962 1.885 1.00 0.45 H new ATOM 0 HD3 LYS A 163 0.492 8.143 3.353 1.00 0.45 H new ATOM 0 HE2 LYS A 163 2.325 9.844 1.612 1.00 0.74 H new ATOM 0 HE3 LYS A 163 1.545 10.397 3.081 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 3.604 9.754 3.827 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 2.706 8.345 4.128 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 3.719 8.432 2.768 1.00 1.28 H new ATOM 1499 N VAL A 164 2.908 3.967 0.389 1.00 0.22 N ATOM 1500 CA VAL A 164 4.275 3.602 0.705 1.00 0.26 C ATOM 1501 C VAL A 164 5.184 4.686 0.158 1.00 0.33 C ATOM 1502 O VAL A 164 4.906 5.262 -0.892 1.00 0.34 O ATOM 1503 CB VAL A 164 4.666 2.212 0.124 1.00 0.28 C ATOM 1504 CG1 VAL A 164 3.560 1.195 0.366 1.00 0.27 C ATOM 1505 CG2 VAL A 164 5.008 2.290 -1.356 1.00 0.29 C ATOM 0 H VAL A 164 2.646 3.836 -0.588 1.00 0.22 H new ATOM 0 HA VAL A 164 4.380 3.519 1.787 1.00 0.26 H new ATOM 0 HB VAL A 164 5.563 1.883 0.649 1.00 0.28 H new ATOM 0 HG11 VAL A 164 3.855 0.231 -0.048 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.388 1.092 1.437 1.00 0.27 H new ATOM 0 HG13 VAL A 164 2.643 1.532 -0.118 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.275 1.298 -1.721 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.145 2.660 -1.910 1.00 0.29 H new ATOM 0 HG23 VAL A 164 5.849 2.968 -1.500 1.00 0.29 H new ATOM 1515 N TYR A 165 6.230 5.022 0.880 1.00 0.45 N ATOM 1516 CA TYR A 165 7.122 6.063 0.417 1.00 0.57 C ATOM 1517 C TYR A 165 8.549 5.560 0.318 1.00 0.70 C ATOM 1518 O TYR A 165 8.970 5.110 -0.741 1.00 1.67 O ATOM 1519 CB TYR A 165 7.014 7.333 1.284 1.00 0.62 C ATOM 1520 CG TYR A 165 6.844 7.098 2.777 1.00 0.63 C ATOM 1521 CD1 TYR A 165 7.927 7.188 3.647 1.00 1.30 C ATOM 1522 CD2 TYR A 165 5.597 6.806 3.319 1.00 1.38 C ATOM 1523 CE1 TYR A 165 7.772 6.994 5.006 1.00 1.31 C ATOM 1524 CE2 TYR A 165 5.435 6.608 4.678 1.00 1.45 C ATOM 1525 CZ TYR A 165 6.526 6.704 5.515 1.00 0.79 C ATOM 1526 OH TYR A 165 6.369 6.517 6.869 1.00 0.93 O ATOM 0 H TYR A 165 6.482 4.599 1.774 1.00 0.45 H new ATOM 0 HA TYR A 165 6.809 6.343 -0.589 1.00 0.57 H new ATOM 0 HB2 TYR A 165 7.910 7.934 1.129 1.00 0.62 H new ATOM 0 HB3 TYR A 165 6.169 7.923 0.929 1.00 0.62 H new ATOM 0 HD1 TYR A 165 8.907 7.414 3.252 1.00 1.30 H new ATOM 0 HD2 TYR A 165 4.739 6.733 2.667 1.00 1.38 H new ATOM 0 HE1 TYR A 165 8.624 7.069 5.666 1.00 1.31 H new ATOM 0 HE2 TYR A 165 4.459 6.380 5.081 1.00 1.45 H new ATOM 0 HH TYR A 165 5.467 6.793 7.135 1.00 0.93 H new ATOM 1536 N LYS A 166 9.272 5.611 1.416 1.00 0.48 N ATOM 1537 CA LYS A 166 10.668 5.218 1.446 1.00 0.49 C ATOM 1538 C LYS A 166 10.926 4.519 2.780 1.00 0.46 C ATOM 1539 O LYS A 166 10.000 4.419 3.590 1.00 0.55 O ATOM 1540 CB LYS A 166 11.564 6.464 1.286 1.00 0.57 C ATOM 1541 CG LYS A 166 11.320 7.267 0.010 1.00 0.71 C ATOM 1542 CD LYS A 166 11.568 6.457 -1.263 1.00 0.94 C ATOM 1543 CE LYS A 166 13.017 6.017 -1.405 1.00 1.35 C ATOM 1544 NZ LYS A 166 13.279 5.435 -2.749 1.00 1.53 N ATOM 0 H LYS A 166 8.909 5.926 2.316 1.00 0.48 H new ATOM 0 HA LYS A 166 10.901 4.538 0.626 1.00 0.49 H new ATOM 0 HB2 LYS A 166 11.411 7.117 2.145 1.00 0.57 H new ATOM 0 HB3 LYS A 166 12.607 6.149 1.307 1.00 0.57 H new ATOM 0 HG2 LYS A 166 10.293 7.631 0.008 1.00 0.71 H new ATOM 0 HG3 LYS A 166 11.969 8.143 0.009 1.00 0.71 H new ATOM 0 HD2 LYS A 166 10.924 5.578 -1.261 1.00 0.94 H new ATOM 0 HD3 LYS A 166 11.287 7.055 -2.130 1.00 0.94 H new ATOM 0 HE2 LYS A 166 13.675 6.870 -1.242 1.00 1.35 H new ATOM 0 HE3 LYS A 166 13.252 5.281 -0.636 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 14.298 5.255 -2.857 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 12.757 4.541 -2.848 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 12.966 6.102 -3.483 1.00 1.53 H new ATOM 1558 N PRO A 167 12.142 3.994 3.037 1.00 0.44 N ATOM 1559 CA PRO A 167 12.471 3.423 4.350 1.00 0.47 C ATOM 1560 C PRO A 167 12.140 4.381 5.491 1.00 0.47 C ATOM 1561 O PRO A 167 12.322 5.594 5.371 1.00 0.50 O ATOM 1562 CB PRO A 167 13.977 3.188 4.253 1.00 0.58 C ATOM 1563 CG PRO A 167 14.202 2.933 2.807 1.00 0.60 C ATOM 1564 CD PRO A 167 13.274 3.870 2.091 1.00 0.49 C ATOM 0 HA PRO A 167 11.901 2.520 4.569 1.00 0.47 H new ATOM 0 HB2 PRO A 167 14.540 4.055 4.599 1.00 0.58 H new ATOM 0 HB3 PRO A 167 14.290 2.340 4.862 1.00 0.58 H new ATOM 0 HG2 PRO A 167 15.240 3.120 2.531 1.00 0.60 H new ATOM 0 HG3 PRO A 167 13.987 1.895 2.552 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.744 4.833 1.894 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.956 3.468 1.129 1.00 0.49 H new ATOM 1572 N ALA A 168 11.629 3.826 6.586 1.00 0.53 N ATOM 1573 CA ALA A 168 11.230 4.622 7.740 1.00 0.64 C ATOM 1574 C ALA A 168 12.378 5.506 8.214 1.00 0.71 C ATOM 1575 O ALA A 168 13.483 5.020 8.456 1.00 0.76 O ATOM 1576 CB ALA A 168 10.762 3.717 8.867 1.00 0.72 C ATOM 0 H ALA A 168 11.481 2.823 6.697 1.00 0.53 H new ATOM 0 HA ALA A 168 10.404 5.267 7.440 1.00 0.64 H new ATOM 0 HB1 ALA A 168 10.467 4.324 9.723 1.00 0.72 H new ATOM 0 HB2 ALA A 168 9.910 3.127 8.530 1.00 0.72 H new ATOM 0 HB3 ALA A 168 11.573 3.050 9.158 1.00 0.72 H new ATOM 1582 N GLY A 169 12.117 6.799 8.337 1.00 0.82 N ATOM 1583 CA GLY A 169 13.159 7.727 8.720 1.00 0.95 C ATOM 1584 C GLY A 169 13.617 8.584 7.557 1.00 0.96 C ATOM 1585 O GLY A 169 14.179 9.662 7.754 1.00 1.14 O ATOM 0 H GLY A 169 11.202 7.221 8.178 1.00 0.82 H new ATOM 0 HA2 GLY A 169 12.794 8.370 9.521 1.00 0.95 H new ATOM 0 HA3 GLY A 169 14.009 7.173 9.118 1.00 0.95 H new ATOM 1589 N TYR A 170 13.377 8.104 6.343 1.00 0.80 N ATOM 1590 CA TYR A 170 13.743 8.838 5.141 1.00 0.82 C ATOM 1591 C TYR A 170 12.661 9.874 4.824 1.00 0.86 C ATOM 1592 O TYR A 170 11.511 9.514 4.564 1.00 0.89 O ATOM 1593 CB TYR A 170 13.905 7.860 3.969 1.00 0.83 C ATOM 1594 CG TYR A 170 14.705 8.400 2.798 1.00 0.91 C ATOM 1595 CD1 TYR A 170 14.182 9.370 1.945 1.00 1.15 C ATOM 1596 CD2 TYR A 170 15.988 7.924 2.538 1.00 1.74 C ATOM 1597 CE1 TYR A 170 14.915 9.848 0.874 1.00 1.21 C ATOM 1598 CE2 TYR A 170 16.723 8.401 1.469 1.00 1.82 C ATOM 1599 CZ TYR A 170 16.183 9.360 0.643 1.00 1.11 C ATOM 1600 OH TYR A 170 16.915 9.834 -0.420 1.00 1.24 O ATOM 0 H TYR A 170 12.928 7.205 6.166 1.00 0.80 H new ATOM 0 HA TYR A 170 14.690 9.354 5.301 1.00 0.82 H new ATOM 0 HB2 TYR A 170 14.388 6.954 4.334 1.00 0.83 H new ATOM 0 HB3 TYR A 170 12.915 7.573 3.614 1.00 0.83 H new ATOM 0 HD1 TYR A 170 13.189 9.755 2.123 1.00 1.15 H new ATOM 0 HD2 TYR A 170 16.415 7.170 3.182 1.00 1.74 H new ATOM 0 HE1 TYR A 170 14.496 10.600 0.222 1.00 1.21 H new ATOM 0 HE2 TYR A 170 17.717 8.023 1.283 1.00 1.82 H new ATOM 0 HH TYR A 170 17.787 9.388 -0.441 1.00 1.24 H new ATOM 1610 N PRO A 171 13.003 11.174 4.868 1.00 0.97 N ATOM 1611 CA PRO A 171 12.040 12.247 4.598 1.00 1.10 C ATOM 1612 C PRO A 171 11.665 12.338 3.120 1.00 1.07 C ATOM 1613 O PRO A 171 12.492 12.097 2.238 1.00 1.05 O ATOM 1614 CB PRO A 171 12.783 13.512 5.040 1.00 1.25 C ATOM 1615 CG PRO A 171 14.224 13.174 4.891 1.00 1.31 C ATOM 1616 CD PRO A 171 14.342 11.704 5.196 1.00 1.07 C ATOM 0 HA PRO A 171 11.097 12.085 5.119 1.00 1.10 H new ATOM 0 HB2 PRO A 171 12.511 14.368 4.422 1.00 1.25 H new ATOM 0 HB3 PRO A 171 12.542 13.773 6.070 1.00 1.25 H new ATOM 0 HG2 PRO A 171 14.573 13.392 3.882 1.00 1.31 H new ATOM 0 HG3 PRO A 171 14.835 13.764 5.574 1.00 1.31 H new ATOM 0 HD2 PRO A 171 15.119 11.231 4.595 1.00 1.07 H new ATOM 0 HD3 PRO A 171 14.597 11.530 6.241 1.00 1.07 H new ATOM 1624 N ALA A 172 10.415 12.694 2.857 1.00 1.22 N ATOM 1625 CA ALA A 172 9.928 12.842 1.494 1.00 1.31 C ATOM 1626 C ALA A 172 10.030 14.298 1.043 1.00 1.40 C ATOM 1627 O ALA A 172 9.943 15.215 1.862 1.00 1.67 O ATOM 1628 CB ALA A 172 8.490 12.349 1.393 1.00 1.60 C ATOM 0 H ALA A 172 9.717 12.886 3.575 1.00 1.22 H new ATOM 0 HA ALA A 172 10.550 12.237 0.834 1.00 1.31 H new ATOM 0 HB1 ALA A 172 8.137 12.465 0.368 1.00 1.60 H new ATOM 0 HB2 ALA A 172 8.445 11.297 1.675 1.00 1.60 H new ATOM 0 HB3 ALA A 172 7.858 12.932 2.063 1.00 1.60 H new ATOM 1634 N ASN A 173 10.229 14.509 -0.252 1.00 1.38 N ATOM 1635 CA ASN A 173 10.354 15.861 -0.799 1.00 1.53 C ATOM 1636 C ASN A 173 9.023 16.336 -1.368 1.00 1.91 C ATOM 1637 O ASN A 173 8.917 17.440 -1.903 1.00 2.60 O ATOM 1638 CB ASN A 173 11.429 15.915 -1.895 1.00 1.89 C ATOM 1639 CG ASN A 173 10.996 15.266 -3.207 1.00 2.51 C ATOM 1640 OD1 ASN A 173 10.191 14.337 -3.230 1.00 2.97 O ATOM 1641 ND2 ASN A 173 11.531 15.758 -4.310 1.00 3.18 N ATOM 0 H ASN A 173 10.308 13.765 -0.945 1.00 1.38 H new ATOM 0 HA ASN A 173 10.650 16.520 0.017 1.00 1.53 H new ATOM 0 HB2 ASN A 173 11.692 16.956 -2.083 1.00 1.89 H new ATOM 0 HB3 ASN A 173 12.330 15.419 -1.534 1.00 1.89 H new ATOM 0 HD21 ASN A 173 11.279 15.366 -5.218 1.00 3.18 H new ATOM 0 HD22 ASN A 173 12.196 16.529 -4.254 1.00 3.18 H new ATOM 1648 N GLY A 174 8.013 15.492 -1.252 1.00 2.02 N ATOM 1649 CA GLY A 174 6.711 15.811 -1.797 1.00 2.69 C ATOM 1650 C GLY A 174 6.347 14.909 -2.953 1.00 2.26 C ATOM 1651 O GLY A 174 5.174 14.726 -3.263 1.00 2.93 O ATOM 0 H GLY A 174 8.071 14.586 -0.787 1.00 2.02 H new ATOM 0 HA2 GLY A 174 5.958 15.720 -1.014 1.00 2.69 H new ATOM 0 HA3 GLY A 174 6.701 16.849 -2.130 1.00 2.69 H new ATOM 1655 N SER A 175 7.352 14.341 -3.596 1.00 1.44 N ATOM 1656 CA SER A 175 7.127 13.428 -4.703 1.00 1.23 C ATOM 1657 C SER A 175 7.920 12.146 -4.484 1.00 0.94 C ATOM 1658 O SER A 175 8.550 11.619 -5.400 1.00 1.36 O ATOM 1659 CB SER A 175 7.531 14.091 -6.023 1.00 1.79 C ATOM 1660 OG SER A 175 6.863 15.334 -6.194 1.00 2.26 O ATOM 0 H SER A 175 8.334 14.496 -3.370 1.00 1.44 H new ATOM 0 HA SER A 175 6.067 13.180 -4.753 1.00 1.23 H new ATOM 0 HB2 SER A 175 8.609 14.248 -6.040 1.00 1.79 H new ATOM 0 HB3 SER A 175 7.292 13.428 -6.855 1.00 1.79 H new ATOM 0 HG SER A 175 7.138 15.739 -7.043 1.00 2.26 H new ATOM 1666 N THR A 176 7.893 11.655 -3.254 1.00 0.64 N ATOM 1667 CA THR A 176 8.659 10.477 -2.889 1.00 0.90 C ATOM 1668 C THR A 176 7.742 9.340 -2.444 1.00 0.80 C ATOM 1669 O THR A 176 8.203 8.321 -1.929 1.00 1.05 O ATOM 1670 CB THR A 176 9.641 10.808 -1.751 1.00 1.30 C ATOM 1671 OG1 THR A 176 9.890 12.218 -1.729 1.00 1.49 O ATOM 1672 CG2 THR A 176 10.960 10.077 -1.933 1.00 1.76 C ATOM 0 H THR A 176 7.347 12.056 -2.492 1.00 0.64 H new ATOM 0 HA THR A 176 9.214 10.158 -3.771 1.00 0.90 H new ATOM 0 HB THR A 176 9.191 10.487 -0.812 1.00 1.30 H new ATOM 0 HG1 THR A 176 10.082 12.530 -2.638 1.00 1.49 H new ATOM 0 HG21 THR A 176 11.633 10.331 -1.114 1.00 1.76 H new ATOM 0 HG22 THR A 176 10.782 9.002 -1.937 1.00 1.76 H new ATOM 0 HG23 THR A 176 11.413 10.373 -2.879 1.00 1.76 H new ATOM 1680 N PHE A 177 6.441 9.507 -2.649 1.00 0.52 N ATOM 1681 CA PHE A 177 5.478 8.516 -2.189 1.00 0.45 C ATOM 1682 C PHE A 177 4.795 7.819 -3.362 1.00 0.41 C ATOM 1683 O PHE A 177 4.596 8.413 -4.424 1.00 0.50 O ATOM 1684 CB PHE A 177 4.434 9.146 -1.249 1.00 0.49 C ATOM 1685 CG PHE A 177 3.736 10.368 -1.795 1.00 0.55 C ATOM 1686 CD1 PHE A 177 4.062 11.635 -1.331 1.00 1.37 C ATOM 1687 CD2 PHE A 177 2.744 10.249 -2.758 1.00 1.31 C ATOM 1688 CE1 PHE A 177 3.415 12.753 -1.819 1.00 1.46 C ATOM 1689 CE2 PHE A 177 2.097 11.366 -3.249 1.00 1.38 C ATOM 1690 CZ PHE A 177 2.432 12.618 -2.778 1.00 0.86 C ATOM 0 H PHE A 177 6.032 10.311 -3.126 1.00 0.52 H new ATOM 0 HA PHE A 177 6.030 7.764 -1.626 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.682 8.394 -1.010 1.00 0.49 H new ATOM 0 HB3 PHE A 177 4.925 9.415 -0.314 1.00 0.49 H new ATOM 0 HD1 PHE A 177 4.830 11.748 -0.580 1.00 1.37 H new ATOM 0 HD2 PHE A 177 2.475 9.271 -3.128 1.00 1.31 H new ATOM 0 HE1 PHE A 177 3.678 13.733 -1.450 1.00 1.46 H new ATOM 0 HE2 PHE A 177 1.329 11.259 -4.001 1.00 1.38 H new ATOM 0 HZ PHE A 177 1.925 13.492 -3.159 1.00 0.86 H new ATOM 1700 N GLU A 178 4.439 6.561 -3.156 1.00 0.34 N ATOM 1701 CA GLU A 178 3.800 5.755 -4.178 1.00 0.32 C ATOM 1702 C GLU A 178 2.452 5.266 -3.670 1.00 0.28 C ATOM 1703 O GLU A 178 2.379 4.539 -2.675 1.00 0.28 O ATOM 1704 CB GLU A 178 4.687 4.554 -4.530 1.00 0.37 C ATOM 1705 CG GLU A 178 4.128 3.675 -5.639 1.00 0.40 C ATOM 1706 CD GLU A 178 4.276 4.292 -7.014 1.00 1.20 C ATOM 1707 OE1 GLU A 178 3.610 5.308 -7.296 1.00 1.91 O ATOM 1708 OE2 GLU A 178 5.060 3.757 -7.827 1.00 1.96 O ATOM 0 H GLU A 178 4.586 6.071 -2.273 1.00 0.34 H new ATOM 0 HA GLU A 178 3.653 6.361 -5.072 1.00 0.32 H new ATOM 0 HB2 GLU A 178 5.670 4.917 -4.829 1.00 0.37 H new ATOM 0 HB3 GLU A 178 4.830 3.947 -3.636 1.00 0.37 H new ATOM 0 HG2 GLU A 178 4.637 2.711 -5.623 1.00 0.40 H new ATOM 0 HG3 GLU A 178 3.073 3.482 -5.445 1.00 0.40 H new ATOM 1715 N TRP A 179 1.386 5.677 -4.335 1.00 0.28 N ATOM 1716 CA TRP A 179 0.055 5.226 -3.969 1.00 0.26 C ATOM 1717 C TRP A 179 -0.297 3.936 -4.690 1.00 0.27 C ATOM 1718 O TRP A 179 -0.038 3.784 -5.886 1.00 0.38 O ATOM 1719 CB TRP A 179 -1.001 6.282 -4.302 1.00 0.27 C ATOM 1720 CG TRP A 179 -1.038 7.434 -3.348 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -0.538 8.687 -3.550 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.627 7.443 -2.042 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -0.783 9.474 -2.452 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.448 8.736 -1.516 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.290 6.488 -1.266 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -1.905 9.099 -0.256 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -2.745 6.851 -0.014 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.551 8.148 0.479 1.00 0.24 C ATOM 0 H TRP A 179 1.416 6.319 -5.127 1.00 0.28 H new ATOM 0 HA TRP A 179 0.061 5.053 -2.893 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -0.814 6.662 -5.306 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -1.982 5.807 -4.318 1.00 0.27 H new ATOM 0 HD1 TRP A 179 -0.025 9.012 -4.443 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -0.512 10.452 -2.352 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.443 5.486 -1.638 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -1.755 10.097 0.128 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.259 6.123 0.596 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -2.921 8.401 1.462 1.00 0.24 H new ATOM 1739 N SER A 180 -0.872 3.005 -3.952 1.00 0.23 N ATOM 1740 CA SER A 180 -1.444 1.814 -4.549 1.00 0.28 C ATOM 1741 C SER A 180 -2.732 2.201 -5.262 1.00 0.28 C ATOM 1742 O SER A 180 -3.324 3.238 -4.953 1.00 0.36 O ATOM 1743 CB SER A 180 -1.732 0.765 -3.470 1.00 0.33 C ATOM 1744 OG SER A 180 -2.201 -0.441 -4.039 1.00 1.06 O ATOM 0 H SER A 180 -0.955 3.051 -2.936 1.00 0.23 H new ATOM 0 HA SER A 180 -0.740 1.384 -5.262 1.00 0.28 H new ATOM 0 HB2 SER A 180 -0.825 0.571 -2.897 1.00 0.33 H new ATOM 0 HB3 SER A 180 -2.474 1.153 -2.771 1.00 0.33 H new ATOM 0 HG SER A 180 -2.801 -0.890 -3.407 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.154 1.392 -6.221 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.407 1.649 -6.911 1.00 0.38 C ATOM 1752 C GLU A 181 -5.561 1.548 -5.930 1.00 0.34 C ATOM 1753 O GLU A 181 -5.716 0.532 -5.255 1.00 0.49 O ATOM 1754 CB GLU A 181 -4.606 0.675 -8.073 1.00 0.56 C ATOM 1755 CG GLU A 181 -3.604 0.874 -9.200 1.00 0.74 C ATOM 1756 CD GLU A 181 -3.488 2.328 -9.610 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -2.496 2.981 -9.218 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -4.394 2.828 -10.307 1.00 1.91 O ATOM 0 H GLU A 181 -2.654 0.561 -6.536 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.375 2.657 -7.325 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -4.526 -0.346 -7.700 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -5.615 0.792 -8.468 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -2.627 0.508 -8.885 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -3.905 0.278 -10.061 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.370 2.612 -5.828 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.445 2.687 -4.843 1.00 0.26 C ATOM 1767 C PRO A 182 -8.518 1.637 -5.092 1.00 0.28 C ATOM 1768 O PRO A 182 -9.220 1.668 -6.105 1.00 0.32 O ATOM 1769 CB PRO A 182 -8.017 4.098 -5.021 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.601 4.522 -6.388 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.305 3.813 -6.677 1.00 0.39 C ATOM 0 HA PRO A 182 -7.083 2.497 -3.833 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.103 4.098 -4.923 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -7.629 4.778 -4.263 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -8.360 4.258 -7.124 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -7.471 5.603 -6.437 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -6.217 3.554 -7.732 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.444 4.434 -6.428 1.00 0.39 H new ATOM 1779 N MET A 183 -8.629 0.704 -4.168 1.00 0.28 N ATOM 1780 CA MET A 183 -9.643 -0.327 -4.248 1.00 0.30 C ATOM 1781 C MET A 183 -10.863 0.096 -3.456 1.00 0.26 C ATOM 1782 O MET A 183 -10.753 0.516 -2.301 1.00 0.25 O ATOM 1783 CB MET A 183 -9.119 -1.682 -3.742 1.00 0.34 C ATOM 1784 CG MET A 183 -8.399 -1.626 -2.400 1.00 0.29 C ATOM 1785 SD MET A 183 -6.713 -0.994 -2.545 1.00 0.31 S ATOM 1786 CE MET A 183 -6.189 -1.013 -0.836 1.00 0.27 C ATOM 0 H MET A 183 -8.025 0.639 -3.348 1.00 0.28 H new ATOM 0 HA MET A 183 -9.915 -0.454 -5.296 1.00 0.30 H new ATOM 0 HB2 MET A 183 -9.958 -2.373 -3.660 1.00 0.34 H new ATOM 0 HB3 MET A 183 -8.438 -2.094 -4.487 1.00 0.34 H new ATOM 0 HG2 MET A 183 -8.963 -0.993 -1.715 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.373 -2.624 -1.963 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.276 -0.427 -0.729 1.00 0.27 H new ATOM 0 HE2 MET A 183 -6.972 -0.583 -0.211 1.00 0.27 H new ATOM 0 HE3 MET A 183 -5.999 -2.040 -0.525 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.021 0.016 -4.086 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.256 0.378 -3.424 1.00 0.29 C ATOM 1798 C ARG A 184 -13.979 -0.877 -2.984 1.00 0.31 C ATOM 1799 O ARG A 184 -14.465 -1.652 -3.811 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.164 1.209 -4.336 1.00 0.35 C ATOM 1801 CG ARG A 184 -13.491 2.431 -4.941 1.00 1.17 C ATOM 1802 CD ARG A 184 -14.508 3.376 -5.569 1.00 1.16 C ATOM 1803 NE ARG A 184 -15.341 2.715 -6.572 1.00 1.88 N ATOM 1804 CZ ARG A 184 -16.290 3.331 -7.272 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -16.516 4.627 -7.105 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -17.013 2.646 -8.145 1.00 3.32 N ATOM 0 H ARG A 184 -12.130 -0.295 -5.051 1.00 0.28 H new ATOM 0 HA ARG A 184 -13.009 0.989 -2.556 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -14.530 0.573 -5.142 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -15.034 1.533 -3.766 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -12.931 2.959 -4.169 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -12.772 2.115 -5.697 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -15.145 3.790 -4.788 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -13.985 4.213 -6.031 1.00 1.16 H new ATOM 0 HE ARG A 184 -15.185 1.722 -6.746 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -15.960 5.160 -6.436 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -17.246 5.091 -7.646 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -16.841 1.649 -8.279 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -17.741 3.115 -8.683 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.025 -1.087 -1.685 1.00 0.28 N ATOM 1821 CA LEU A 185 -14.729 -2.225 -1.139 1.00 0.32 C ATOM 1822 C LEU A 185 -16.169 -1.834 -0.881 1.00 0.36 C ATOM 1823 O LEU A 185 -16.447 -0.731 -0.417 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.073 -2.716 0.156 1.00 0.36 C ATOM 1825 CG LEU A 185 -12.586 -3.066 0.050 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.110 -3.732 1.327 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.314 -3.962 -1.147 1.00 0.74 C ATOM 0 H LEU A 185 -13.584 -0.485 -0.990 1.00 0.28 H new ATOM 0 HA LEU A 185 -14.689 -3.043 -1.858 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.194 -1.946 0.918 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -14.612 -3.597 0.504 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.032 -2.139 -0.093 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -11.051 -3.975 1.238 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.257 -3.054 2.168 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -12.679 -4.646 1.495 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.250 -4.192 -1.195 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -12.881 -4.887 -1.045 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -12.616 -3.450 -2.061 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.080 -2.713 -1.221 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.488 -2.459 -1.016 1.00 0.77 C ATOM 1841 C ALA A 186 -19.144 -3.624 -0.284 1.00 1.02 C ATOM 1842 O ALA A 186 -18.532 -4.677 -0.103 1.00 1.53 O ATOM 1843 CB ALA A 186 -19.166 -2.213 -2.356 1.00 1.00 C ATOM 0 H ALA A 186 -16.871 -3.617 -1.644 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.600 -1.569 -0.396 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -20.227 -2.022 -2.197 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -18.711 -1.350 -2.841 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -19.046 -3.091 -2.991 1.00 1.00 H new ATOM 1849 N LYS A 187 -20.370 -3.417 0.164 1.00 0.89 N ATOM 1850 CA LYS A 187 -21.178 -4.484 0.740 1.00 1.11 C ATOM 1851 C LYS A 187 -22.613 -4.347 0.261 1.00 1.49 C ATOM 1852 O LYS A 187 -23.309 -3.399 0.624 1.00 1.61 O ATOM 1853 CB LYS A 187 -21.133 -4.463 2.272 1.00 1.11 C ATOM 1854 CG LYS A 187 -19.866 -5.062 2.859 1.00 1.17 C ATOM 1855 CD LYS A 187 -19.946 -5.146 4.373 1.00 1.45 C ATOM 1856 CE LYS A 187 -18.712 -5.809 4.962 1.00 1.82 C ATOM 1857 NZ LYS A 187 -18.778 -5.895 6.445 1.00 2.78 N ATOM 0 H LYS A 187 -20.834 -2.509 0.140 1.00 0.89 H new ATOM 0 HA LYS A 187 -20.766 -5.438 0.410 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -21.228 -3.433 2.614 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -21.994 -5.008 2.659 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -19.706 -6.058 2.445 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -19.007 -4.456 2.571 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -20.055 -4.144 4.788 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -20.834 -5.709 4.660 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -18.605 -6.811 4.546 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -17.825 -5.247 4.671 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -17.917 -6.354 6.805 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -18.854 -4.938 6.845 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -19.610 -6.454 6.724 1.00 2.78 H new ATOM 1871 N CYS A 188 -23.050 -5.284 -0.564 1.00 1.82 N ATOM 1872 CA CYS A 188 -24.378 -5.217 -1.142 1.00 2.29 C ATOM 1873 C CYS A 188 -25.368 -5.992 -0.285 1.00 2.51 C ATOM 1874 O CYS A 188 -25.205 -7.194 -0.065 1.00 2.68 O ATOM 1875 CB CYS A 188 -24.358 -5.780 -2.563 1.00 2.71 C ATOM 1876 SG CYS A 188 -23.052 -5.083 -3.602 1.00 3.14 S ATOM 0 H CYS A 188 -22.504 -6.098 -0.847 1.00 1.82 H new ATOM 0 HA CYS A 188 -24.692 -4.174 -1.178 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -24.233 -6.862 -2.514 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -25.323 -5.592 -3.033 1.00 2.71 H new ATOM 0 HG CYS A 188 -23.108 -5.617 -4.786 1.00 3.14 H new ATOM 1882 N ASP A 189 -26.382 -5.301 0.213 1.00 2.70 N ATOM 1883 CA ASP A 189 -27.419 -5.948 1.005 1.00 3.08 C ATOM 1884 C ASP A 189 -28.486 -6.513 0.084 1.00 3.61 C ATOM 1885 O ASP A 189 -29.496 -5.866 -0.185 1.00 3.87 O ATOM 1886 CB ASP A 189 -28.049 -4.959 1.991 1.00 3.12 C ATOM 1887 CG ASP A 189 -28.981 -5.635 2.976 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -28.503 -6.068 4.047 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -30.195 -5.726 2.695 1.00 4.05 O ATOM 0 H ASP A 189 -26.510 -4.297 0.084 1.00 2.70 H new ATOM 0 HA ASP A 189 -26.966 -6.758 1.577 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -27.259 -4.444 2.538 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -28.600 -4.200 1.436 1.00 3.12 H new ATOM 1894 N GLU A 190 -28.249 -7.712 -0.414 1.00 3.97 N ATOM 1895 CA GLU A 190 -29.175 -8.350 -1.327 1.00 4.63 C ATOM 1896 C GLU A 190 -29.159 -9.853 -1.102 1.00 5.25 C ATOM 1897 O GLU A 190 -30.029 -10.352 -0.359 1.00 5.64 O ATOM 1898 CB GLU A 190 -28.798 -8.024 -2.776 1.00 4.83 C ATOM 1899 CG GLU A 190 -29.938 -8.218 -3.761 1.00 5.57 C ATOM 1900 CD GLU A 190 -31.072 -7.245 -3.523 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -30.969 -6.084 -3.970 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -32.068 -7.629 -2.878 1.00 6.43 O ATOM 1903 OXT GLU A 190 -28.251 -10.525 -1.636 1.00 5.62 O ATOM 0 H GLU A 190 -27.419 -8.265 -0.200 1.00 3.97 H new ATOM 0 HA GLU A 190 -30.180 -7.973 -1.139 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -28.455 -6.991 -2.829 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -27.960 -8.654 -3.075 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -29.563 -8.094 -4.777 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -30.314 -9.238 -3.682 1.00 5.57 H new TER 1910 GLU A 190