USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1079 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 42 ASN : amide:sc= -5.4! C(o=-6.3!,f=-13!) USER MOD Set 1.2: A 119 TYR OH : rot 177:sc= -0.846 USER MOD Set 2.1: A 109 ASN : amide:sc= -0.311 K(o=-0.88,f=-2.5!) USER MOD Set 2.2: A 114 ASN : amide:sc= -0.571 K(o=-0.88,f=0.2) USER MOD Set 3.1: A 28 TYR OH : rot -15:sc= 0.547 USER MOD Set 3.2: A 33 HIS : no HD1:sc= -0.401 K(o=-12,f=-26!) USER MOD Set 3.3: A 70 THR OG1 : rot -130:sc= -1.17 USER MOD Set 3.4: A 105 MET CE :methyl -167:sc= -11.3! (180deg=-12.5!) USER MOD Set 4.1: A 61 TYR OH : rot 165:sc= 0.522 USER MOD Set 4.2: A 65 LYS NZ :NH3+ -153:sc= 0.617 (180deg=-0.116) USER MOD Set 5.1: A 41 TYR OH : rot 180:sc= -0.0485 USER MOD Set 5.2: A 141 SER OG : rot -108:sc= 0.0211 USER MOD Single : A 13 SER OG : rot 39:sc= 0.253 USER MOD Single : A 14 SER OG : rot -170:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -0.04 X(o=-0.04,f=-0.0016) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -1.69 K(o=-1.7,f=-10!) USER MOD Single : A 32 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot -91:sc= -2.98! USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.00873 USER MOD Single : A 51 LYS NZ :NH3+ 170:sc=-0.000607 (180deg=-0.113) USER MOD Single : A 54 TYR OH : rot 96:sc=-0.00899 USER MOD Single : A 56 THR OG1 : rot 85:sc= 1.29 USER MOD Single : A 58 THR OG1 : rot 80:sc= 0.911 USER MOD Single : A 59 THR OG1 : rot 76:sc= 1.22 USER MOD Single : A 62 ASN : amide:sc= -0.101 K(o=-0.1,f=-1.2) USER MOD Single : A 63 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0404) USER MOD Single : A 64 TYR OH : rot -142:sc= 1.28 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -0.912 K(o=-0.91,f=-0.1) USER MOD Single : A 76 SER OG : rot 72:sc= 0.676 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 162:sc= 0.953 (180deg=0.698) USER MOD Single : A 99 LYS NZ :NH3+ 165:sc= -0.0336 (180deg=-0.286) USER MOD Single : A 107 LYS NZ :NH3+ -173:sc= 1.15 (180deg=1.02) USER MOD Single : A 111 ASN : amide:sc= -2.1 K(o=-2.1,f=-6.1!) USER MOD Single : A 116 HIS : no HD1:sc= -3.48! C(o=-3.5!,f=-7.4!) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 MET CE :methyl 146:sc= -4.85! (180deg=-9.81!) USER MOD Single : A 123 LYS NZ :NH3+ -166:sc= 1.4 (180deg=1.06) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 THR OG1 : rot 95:sc= 1.26 USER MOD Single : A 126 LYS NZ :NH3+ 157:sc= -0.167 (180deg=-0.686) USER MOD Single : A 136 LYS NZ :NH3+ -139:sc= -1.54 (180deg=-3.99!) USER MOD Single : A 138 ASN : amide:sc= -1.57 X(o=-1.6,f=-1.2) USER MOD Single : A 140 THR OG1 : rot -156:sc= -2.49! USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 161 LYS NZ :NH3+ 165:sc= -0.0515 (180deg=-0.295) USER MOD Single : A 166 LYS NZ :NH3+ 139:sc= 1.25 (180deg=0.809) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 34 N SER A 13 9.576 -15.447 -0.520 1.00 0.71 N ATOM 35 CA SER A 13 10.854 -14.744 -0.558 1.00 0.72 C ATOM 36 C SER A 13 10.671 -13.249 -0.301 1.00 0.55 C ATOM 37 O SER A 13 11.381 -12.649 0.510 1.00 0.73 O ATOM 38 CB SER A 13 11.489 -14.936 -1.927 1.00 0.93 C ATOM 39 OG SER A 13 11.462 -16.302 -2.319 1.00 1.68 O ATOM 0 HA SER A 13 11.494 -15.154 0.223 1.00 0.72 H new ATOM 0 HB2 SER A 13 10.959 -14.333 -2.664 1.00 0.93 H new ATOM 0 HB3 SER A 13 12.519 -14.581 -1.906 1.00 0.93 H new ATOM 0 HG SER A 13 10.613 -16.705 -2.042 1.00 1.68 H new ATOM 45 N SER A 14 9.724 -12.659 -1.012 1.00 0.38 N ATOM 46 CA SER A 14 9.436 -11.245 -0.892 1.00 0.28 C ATOM 47 C SER A 14 8.046 -10.965 -1.450 1.00 0.26 C ATOM 48 O SER A 14 7.354 -11.896 -1.870 1.00 0.36 O ATOM 49 CB SER A 14 10.504 -10.427 -1.626 1.00 0.35 C ATOM 50 OG SER A 14 10.570 -10.777 -3.000 1.00 0.65 O ATOM 0 H SER A 14 9.136 -13.149 -1.687 1.00 0.38 H new ATOM 0 HA SER A 14 9.455 -10.952 0.158 1.00 0.28 H new ATOM 0 HB2 SER A 14 10.281 -9.364 -1.530 1.00 0.35 H new ATOM 0 HB3 SER A 14 11.475 -10.592 -1.160 1.00 0.35 H new ATOM 0 HG SER A 14 11.358 -10.359 -3.406 1.00 0.65 H new ATOM 56 N ILE A 15 7.633 -9.707 -1.460 1.00 0.22 N ATOM 57 CA ILE A 15 6.320 -9.339 -1.977 1.00 0.22 C ATOM 58 C ILE A 15 6.168 -9.715 -3.450 1.00 0.20 C ATOM 59 O ILE A 15 5.069 -10.007 -3.913 1.00 0.22 O ATOM 60 CB ILE A 15 6.040 -7.829 -1.820 1.00 0.22 C ATOM 61 CG1 ILE A 15 7.135 -6.991 -2.502 1.00 0.21 C ATOM 62 CG2 ILE A 15 5.918 -7.462 -0.348 1.00 0.25 C ATOM 63 CD1 ILE A 15 6.713 -5.567 -2.781 1.00 0.30 C ATOM 0 H ILE A 15 8.187 -8.922 -1.116 1.00 0.22 H new ATOM 0 HA ILE A 15 5.597 -9.899 -1.384 1.00 0.22 H new ATOM 0 HB ILE A 15 5.093 -7.605 -2.312 1.00 0.22 H new ATOM 0 HG12 ILE A 15 8.023 -6.982 -1.869 1.00 0.21 H new ATOM 0 HG13 ILE A 15 7.417 -7.469 -3.440 1.00 0.21 H new ATOM 0 HG21 ILE A 15 5.721 -6.394 -0.254 1.00 0.25 H new ATOM 0 HG22 ILE A 15 5.098 -8.023 0.100 1.00 0.25 H new ATOM 0 HG23 ILE A 15 6.848 -7.706 0.166 1.00 0.25 H new ATOM 0 HD11 ILE A 15 7.532 -5.033 -3.262 1.00 0.30 H new ATOM 0 HD12 ILE A 15 5.844 -5.567 -3.439 1.00 0.30 H new ATOM 0 HD13 ILE A 15 6.459 -5.073 -1.843 1.00 0.30 H new ATOM 75 N PHE A 16 7.281 -9.758 -4.169 1.00 0.20 N ATOM 76 CA PHE A 16 7.244 -9.962 -5.612 1.00 0.20 C ATOM 77 C PHE A 16 7.001 -11.419 -5.966 1.00 0.21 C ATOM 78 O PHE A 16 7.070 -11.809 -7.134 1.00 0.27 O ATOM 79 CB PHE A 16 8.537 -9.496 -6.247 1.00 0.20 C ATOM 80 CG PHE A 16 8.942 -8.128 -5.819 1.00 0.20 C ATOM 81 CD1 PHE A 16 8.335 -7.010 -6.357 1.00 0.22 C ATOM 82 CD2 PHE A 16 9.917 -7.965 -4.861 1.00 0.23 C ATOM 83 CE1 PHE A 16 8.700 -5.752 -5.942 1.00 0.24 C ATOM 84 CE2 PHE A 16 10.279 -6.713 -4.435 1.00 0.25 C ATOM 85 CZ PHE A 16 9.708 -5.586 -5.081 1.00 0.24 C ATOM 0 H PHE A 16 8.218 -9.655 -3.779 1.00 0.20 H new ATOM 0 HA PHE A 16 6.414 -9.372 -6.001 1.00 0.20 H new ATOM 0 HB2 PHE A 16 9.332 -10.198 -5.995 1.00 0.20 H new ATOM 0 HB3 PHE A 16 8.428 -9.513 -7.331 1.00 0.20 H new ATOM 0 HD1 PHE A 16 7.568 -7.125 -7.109 1.00 0.22 H new ATOM 0 HD2 PHE A 16 10.402 -8.833 -4.440 1.00 0.23 H new ATOM 0 HE1 PHE A 16 8.167 -4.890 -6.315 1.00 0.24 H new ATOM 0 HE2 PHE A 16 10.983 -6.587 -3.626 1.00 0.25 H new ATOM 0 HZ PHE A 16 10.088 -4.596 -4.877 1.00 0.24 H new ATOM 95 N ASP A 17 6.733 -12.225 -4.953 1.00 0.23 N ATOM 96 CA ASP A 17 6.361 -13.611 -5.165 1.00 0.27 C ATOM 97 C ASP A 17 4.895 -13.665 -5.573 1.00 0.24 C ATOM 98 O ASP A 17 4.374 -14.705 -5.980 1.00 0.33 O ATOM 99 CB ASP A 17 6.594 -14.422 -3.888 1.00 0.34 C ATOM 100 CG ASP A 17 6.691 -15.908 -4.155 1.00 0.99 C ATOM 101 OD1 ASP A 17 7.708 -16.355 -4.725 1.00 1.96 O ATOM 102 OD2 ASP A 17 5.732 -16.636 -3.815 1.00 1.24 O ATOM 0 H ASP A 17 6.767 -11.941 -3.974 1.00 0.23 H new ATOM 0 HA ASP A 17 6.975 -14.043 -5.955 1.00 0.27 H new ATOM 0 HB2 ASP A 17 7.511 -14.082 -3.408 1.00 0.34 H new ATOM 0 HB3 ASP A 17 5.779 -14.234 -3.188 1.00 0.34 H new ATOM 107 N PHE A 18 4.244 -12.514 -5.465 1.00 0.18 N ATOM 108 CA PHE A 18 2.844 -12.368 -5.822 1.00 0.19 C ATOM 109 C PHE A 18 2.707 -11.396 -6.980 1.00 0.24 C ATOM 110 O PHE A 18 3.513 -10.480 -7.127 1.00 0.40 O ATOM 111 CB PHE A 18 2.053 -11.865 -4.621 1.00 0.20 C ATOM 112 CG PHE A 18 2.114 -12.789 -3.443 1.00 0.18 C ATOM 113 CD1 PHE A 18 3.187 -12.753 -2.573 1.00 0.20 C ATOM 114 CD2 PHE A 18 1.096 -13.693 -3.209 1.00 0.19 C ATOM 115 CE1 PHE A 18 3.246 -13.606 -1.491 1.00 0.22 C ATOM 116 CE2 PHE A 18 1.145 -14.543 -2.130 1.00 0.20 C ATOM 117 CZ PHE A 18 2.232 -14.490 -1.256 1.00 0.20 C ATOM 0 H PHE A 18 4.676 -11.654 -5.126 1.00 0.18 H new ATOM 0 HA PHE A 18 2.449 -13.338 -6.124 1.00 0.19 H new ATOM 0 HB2 PHE A 18 2.434 -10.887 -4.327 1.00 0.20 H new ATOM 0 HB3 PHE A 18 1.012 -11.727 -4.912 1.00 0.20 H new ATOM 0 HD1 PHE A 18 3.988 -12.049 -2.742 1.00 0.20 H new ATOM 0 HD2 PHE A 18 0.252 -13.732 -3.882 1.00 0.19 H new ATOM 0 HE1 PHE A 18 4.097 -13.575 -0.827 1.00 0.22 H new ATOM 0 HE2 PHE A 18 0.346 -15.249 -1.959 1.00 0.20 H new ATOM 0 HZ PHE A 18 2.271 -15.145 -0.398 1.00 0.20 H new ATOM 127 N GLU A 19 1.690 -11.597 -7.800 1.00 0.28 N ATOM 128 CA GLU A 19 1.483 -10.756 -8.970 1.00 0.34 C ATOM 129 C GLU A 19 0.417 -9.702 -8.703 1.00 0.29 C ATOM 130 O GLU A 19 -0.540 -9.945 -7.970 1.00 0.48 O ATOM 131 CB GLU A 19 1.108 -11.613 -10.183 1.00 0.59 C ATOM 132 CG GLU A 19 0.809 -10.804 -11.434 1.00 1.16 C ATOM 133 CD GLU A 19 0.632 -11.667 -12.660 1.00 1.99 C ATOM 134 OE1 GLU A 19 -0.374 -12.408 -12.718 1.00 2.77 O ATOM 135 OE2 GLU A 19 1.486 -11.609 -13.569 1.00 2.28 O ATOM 0 H GLU A 19 0.995 -12.334 -7.679 1.00 0.28 H new ATOM 0 HA GLU A 19 2.417 -10.238 -9.188 1.00 0.34 H new ATOM 0 HB2 GLU A 19 1.924 -12.304 -10.394 1.00 0.59 H new ATOM 0 HB3 GLU A 19 0.235 -12.217 -9.934 1.00 0.59 H new ATOM 0 HG2 GLU A 19 -0.096 -10.218 -11.274 1.00 1.16 H new ATOM 0 HG3 GLU A 19 1.621 -10.097 -11.607 1.00 1.16 H new ATOM 142 N VAL A 20 0.588 -8.533 -9.307 1.00 0.24 N ATOM 143 CA VAL A 20 -0.316 -7.418 -9.097 1.00 0.27 C ATOM 144 C VAL A 20 -1.071 -7.081 -10.376 1.00 0.25 C ATOM 145 O VAL A 20 -0.551 -7.243 -11.477 1.00 0.27 O ATOM 146 CB VAL A 20 0.459 -6.168 -8.609 1.00 0.35 C ATOM 147 CG1 VAL A 20 -0.451 -4.955 -8.499 1.00 0.74 C ATOM 148 CG2 VAL A 20 1.116 -6.454 -7.278 1.00 0.49 C ATOM 0 H VAL A 20 1.353 -8.335 -9.952 1.00 0.24 H new ATOM 0 HA VAL A 20 -1.033 -7.714 -8.332 1.00 0.27 H new ATOM 0 HB VAL A 20 1.227 -5.939 -9.347 1.00 0.35 H new ATOM 0 HG11 VAL A 20 0.126 -4.097 -8.154 1.00 0.74 H new ATOM 0 HG12 VAL A 20 -0.882 -4.734 -9.475 1.00 0.74 H new ATOM 0 HG13 VAL A 20 -1.251 -5.163 -7.788 1.00 0.74 H new ATOM 0 HG21 VAL A 20 1.658 -5.570 -6.943 1.00 0.49 H new ATOM 0 HG22 VAL A 20 0.353 -6.712 -6.544 1.00 0.49 H new ATOM 0 HG23 VAL A 20 1.811 -7.287 -7.387 1.00 0.49 H new ATOM 158 N LEU A 21 -2.313 -6.652 -10.218 1.00 0.29 N ATOM 159 CA LEU A 21 -3.082 -6.099 -11.317 1.00 0.31 C ATOM 160 C LEU A 21 -3.039 -4.585 -11.240 1.00 0.27 C ATOM 161 O LEU A 21 -3.187 -4.014 -10.161 1.00 0.28 O ATOM 162 CB LEU A 21 -4.529 -6.590 -11.271 1.00 0.38 C ATOM 163 CG LEU A 21 -4.722 -8.095 -11.456 1.00 0.47 C ATOM 164 CD1 LEU A 21 -6.196 -8.452 -11.462 1.00 0.72 C ATOM 165 CD2 LEU A 21 -4.046 -8.570 -12.733 1.00 0.64 C ATOM 0 H LEU A 21 -2.812 -6.678 -9.329 1.00 0.29 H new ATOM 0 HA LEU A 21 -2.646 -6.432 -12.259 1.00 0.31 H new ATOM 0 HB2 LEU A 21 -4.961 -6.301 -10.313 1.00 0.38 H new ATOM 0 HB3 LEU A 21 -5.095 -6.071 -12.045 1.00 0.38 H new ATOM 0 HG LEU A 21 -4.254 -8.604 -10.614 1.00 0.47 H new ATOM 0 HD11 LEU A 21 -6.309 -9.528 -11.595 1.00 0.72 H new ATOM 0 HD12 LEU A 21 -6.646 -8.154 -10.515 1.00 0.72 H new ATOM 0 HD13 LEU A 21 -6.693 -7.931 -12.280 1.00 0.72 H new ATOM 0 HD21 LEU A 21 -4.195 -9.644 -12.846 1.00 0.64 H new ATOM 0 HD22 LEU A 21 -4.479 -8.052 -13.588 1.00 0.64 H new ATOM 0 HD23 LEU A 21 -2.979 -8.356 -12.681 1.00 0.64 H new ATOM 177 N ASP A 22 -2.805 -3.945 -12.378 1.00 0.28 N ATOM 178 CA ASP A 22 -2.785 -2.490 -12.455 1.00 0.29 C ATOM 179 C ASP A 22 -4.202 -1.968 -12.271 1.00 0.27 C ATOM 180 O ASP A 22 -5.121 -2.754 -12.030 1.00 0.27 O ATOM 181 CB ASP A 22 -2.203 -2.032 -13.809 1.00 0.41 C ATOM 182 CG ASP A 22 -1.868 -0.548 -13.883 1.00 0.95 C ATOM 183 OD1 ASP A 22 -2.770 0.253 -14.202 1.00 1.59 O ATOM 184 OD2 ASP A 22 -0.712 -0.173 -13.595 1.00 1.32 O ATOM 0 H ASP A 22 -2.625 -4.414 -13.266 1.00 0.28 H new ATOM 0 HA ASP A 22 -2.148 -2.088 -11.667 1.00 0.29 H new ATOM 0 HB2 ASP A 22 -1.300 -2.606 -14.015 1.00 0.41 H new ATOM 0 HB3 ASP A 22 -2.918 -2.270 -14.597 1.00 0.41 H new ATOM 189 N ALA A 23 -4.389 -0.677 -12.414 1.00 0.32 N ATOM 190 CA ALA A 23 -5.686 -0.052 -12.187 1.00 0.38 C ATOM 191 C ALA A 23 -6.780 -0.717 -13.025 1.00 0.44 C ATOM 192 O ALA A 23 -7.942 -0.782 -12.622 1.00 0.52 O ATOM 193 CB ALA A 23 -5.590 1.430 -12.504 1.00 0.48 C ATOM 0 H ALA A 23 -3.654 -0.026 -12.690 1.00 0.32 H new ATOM 0 HA ALA A 23 -5.959 -0.181 -11.140 1.00 0.38 H new ATOM 0 HB1 ALA A 23 -6.558 1.902 -12.336 1.00 0.48 H new ATOM 0 HB2 ALA A 23 -4.844 1.893 -11.858 1.00 0.48 H new ATOM 0 HB3 ALA A 23 -5.299 1.561 -13.546 1.00 0.48 H new ATOM 199 N ASP A 24 -6.392 -1.237 -14.179 1.00 0.46 N ATOM 200 CA ASP A 24 -7.336 -1.857 -15.097 1.00 0.57 C ATOM 201 C ASP A 24 -7.247 -3.379 -15.057 1.00 0.49 C ATOM 202 O ASP A 24 -7.793 -4.063 -15.924 1.00 0.55 O ATOM 203 CB ASP A 24 -7.087 -1.348 -16.516 1.00 0.76 C ATOM 204 CG ASP A 24 -7.502 0.100 -16.680 1.00 1.49 C ATOM 205 OD1 ASP A 24 -6.949 0.970 -15.973 1.00 2.22 O ATOM 206 OD2 ASP A 24 -8.394 0.371 -17.507 1.00 1.88 O ATOM 0 H ASP A 24 -5.425 -1.242 -14.504 1.00 0.46 H new ATOM 0 HA ASP A 24 -8.342 -1.581 -14.783 1.00 0.57 H new ATOM 0 HB2 ASP A 24 -6.029 -1.452 -16.758 1.00 0.76 H new ATOM 0 HB3 ASP A 24 -7.638 -1.966 -17.225 1.00 0.76 H new ATOM 211 N HIS A 25 -6.533 -3.904 -14.058 1.00 0.43 N ATOM 212 CA HIS A 25 -6.416 -5.346 -13.826 1.00 0.42 C ATOM 213 C HIS A 25 -5.593 -5.999 -14.924 1.00 0.46 C ATOM 214 O HIS A 25 -5.574 -7.220 -15.062 1.00 0.53 O ATOM 215 CB HIS A 25 -7.776 -6.047 -13.692 1.00 0.45 C ATOM 216 CG HIS A 25 -8.651 -5.515 -12.590 1.00 0.51 C ATOM 217 ND1 HIS A 25 -9.024 -6.258 -11.491 1.00 0.57 N ATOM 218 CD2 HIS A 25 -9.245 -4.309 -12.438 1.00 0.66 C ATOM 219 CE1 HIS A 25 -9.805 -5.532 -10.714 1.00 0.67 C ATOM 220 NE2 HIS A 25 -9.962 -4.342 -11.265 1.00 0.73 N ATOM 0 H HIS A 25 -6.017 -3.338 -13.384 1.00 0.43 H new ATOM 0 HA HIS A 25 -5.906 -5.464 -12.870 1.00 0.42 H new ATOM 0 HB2 HIS A 25 -8.311 -5.957 -14.638 1.00 0.45 H new ATOM 0 HB3 HIS A 25 -7.606 -7.110 -13.522 1.00 0.45 H new ATOM 0 HD2 HIS A 25 -9.170 -3.471 -13.116 1.00 0.66 H new ATOM 0 HE1 HIS A 25 -10.243 -5.857 -9.782 1.00 0.67 H new ATOM 0 HE2 HIS A 25 -10.520 -3.577 -10.885 1.00 0.73 H new ATOM 229 N LYS A 26 -4.933 -5.175 -15.717 1.00 0.49 N ATOM 230 CA LYS A 26 -3.882 -5.652 -16.588 1.00 0.53 C ATOM 231 C LYS A 26 -2.674 -5.902 -15.710 1.00 0.45 C ATOM 232 O LYS A 26 -2.494 -5.193 -14.722 1.00 0.42 O ATOM 233 CB LYS A 26 -3.562 -4.609 -17.659 1.00 0.63 C ATOM 234 CG LYS A 26 -4.763 -4.174 -18.497 1.00 0.85 C ATOM 235 CD LYS A 26 -5.230 -5.256 -19.470 1.00 1.58 C ATOM 236 CE LYS A 26 -6.018 -6.359 -18.777 1.00 2.38 C ATOM 237 NZ LYS A 26 -6.438 -7.421 -19.727 1.00 3.25 N ATOM 0 H LYS A 26 -5.109 -4.172 -15.774 1.00 0.49 H new ATOM 0 HA LYS A 26 -4.183 -6.563 -17.106 1.00 0.53 H new ATOM 0 HB2 LYS A 26 -3.134 -3.730 -17.176 1.00 0.63 H new ATOM 0 HB3 LYS A 26 -2.798 -5.012 -18.324 1.00 0.63 H new ATOM 0 HG2 LYS A 26 -5.586 -3.909 -17.834 1.00 0.85 H new ATOM 0 HG3 LYS A 26 -4.503 -3.276 -19.057 1.00 0.85 H new ATOM 0 HD2 LYS A 26 -5.849 -4.802 -20.244 1.00 1.58 H new ATOM 0 HD3 LYS A 26 -4.364 -5.691 -19.969 1.00 1.58 H new ATOM 0 HE2 LYS A 26 -5.409 -6.799 -17.987 1.00 2.38 H new ATOM 0 HE3 LYS A 26 -6.899 -5.930 -18.299 1.00 2.38 H new ATOM 0 HZ1 LYS A 26 -6.972 -8.153 -19.216 1.00 3.25 H new ATOM 0 HZ2 LYS A 26 -7.040 -7.007 -20.467 1.00 3.25 H new ATOM 0 HZ3 LYS A 26 -5.597 -7.848 -20.164 1.00 3.25 H new ATOM 251 N PRO A 27 -1.852 -6.911 -16.010 1.00 0.51 N ATOM 252 CA PRO A 27 -0.758 -7.288 -15.119 1.00 0.46 C ATOM 253 C PRO A 27 0.162 -6.113 -14.802 1.00 0.36 C ATOM 254 O PRO A 27 0.841 -5.578 -15.679 1.00 0.41 O ATOM 255 CB PRO A 27 -0.005 -8.360 -15.910 1.00 0.58 C ATOM 256 CG PRO A 27 -1.004 -8.901 -16.875 1.00 0.86 C ATOM 257 CD PRO A 27 -1.912 -7.753 -17.215 1.00 0.68 C ATOM 0 HA PRO A 27 -1.122 -7.633 -14.151 1.00 0.46 H new ATOM 0 HB2 PRO A 27 0.855 -7.937 -16.428 1.00 0.58 H new ATOM 0 HB3 PRO A 27 0.373 -9.143 -15.253 1.00 0.58 H new ATOM 0 HG2 PRO A 27 -0.514 -9.289 -17.768 1.00 0.86 H new ATOM 0 HG3 PRO A 27 -1.565 -9.726 -16.435 1.00 0.86 H new ATOM 0 HD2 PRO A 27 -1.569 -7.216 -18.099 1.00 0.68 H new ATOM 0 HD3 PRO A 27 -2.928 -8.090 -17.421 1.00 0.68 H new ATOM 265 N TYR A 28 0.167 -5.722 -13.537 1.00 0.28 N ATOM 266 CA TYR A 28 1.097 -4.724 -13.036 1.00 0.22 C ATOM 267 C TYR A 28 2.396 -5.393 -12.642 1.00 0.22 C ATOM 268 O TYR A 28 2.422 -6.231 -11.738 1.00 0.28 O ATOM 269 CB TYR A 28 0.503 -3.995 -11.824 1.00 0.20 C ATOM 270 CG TYR A 28 1.338 -2.844 -11.314 1.00 0.19 C ATOM 271 CD1 TYR A 28 1.453 -1.666 -12.043 1.00 0.21 C ATOM 272 CD2 TYR A 28 2.020 -2.937 -10.107 1.00 0.19 C ATOM 273 CE1 TYR A 28 2.213 -0.613 -11.577 1.00 0.23 C ATOM 274 CE2 TYR A 28 2.778 -1.897 -9.638 1.00 0.21 C ATOM 275 CZ TYR A 28 2.869 -0.724 -10.390 1.00 0.22 C ATOM 276 OH TYR A 28 3.627 0.303 -9.880 1.00 0.28 O ATOM 0 H TYR A 28 -0.472 -6.087 -12.831 1.00 0.28 H new ATOM 0 HA TYR A 28 1.285 -3.994 -13.824 1.00 0.22 H new ATOM 0 HB2 TYR A 28 -0.485 -3.620 -12.090 1.00 0.20 H new ATOM 0 HB3 TYR A 28 0.365 -4.713 -11.016 1.00 0.20 H new ATOM 0 HD1 TYR A 28 0.940 -1.574 -12.989 1.00 0.21 H new ATOM 0 HD2 TYR A 28 1.951 -3.846 -9.528 1.00 0.19 H new ATOM 0 HE1 TYR A 28 2.287 0.297 -12.153 1.00 0.23 H new ATOM 0 HE2 TYR A 28 3.300 -1.983 -8.696 1.00 0.21 H new ATOM 0 HH TYR A 28 3.800 0.963 -10.584 1.00 0.28 H new ATOM 286 N ASN A 29 3.467 -5.052 -13.335 1.00 0.27 N ATOM 287 CA ASN A 29 4.777 -5.532 -12.949 1.00 0.33 C ATOM 288 C ASN A 29 5.196 -4.826 -11.671 1.00 0.27 C ATOM 289 O ASN A 29 5.684 -3.695 -11.696 1.00 0.34 O ATOM 290 CB ASN A 29 5.806 -5.313 -14.069 1.00 0.49 C ATOM 291 CG ASN A 29 7.200 -5.808 -13.704 1.00 0.64 C ATOM 292 OD1 ASN A 29 7.638 -5.698 -12.565 1.00 1.65 O ATOM 293 ND2 ASN A 29 7.898 -6.388 -14.662 1.00 0.65 N ATOM 0 H ASN A 29 3.455 -4.451 -14.159 1.00 0.27 H new ATOM 0 HA ASN A 29 4.731 -6.607 -12.773 1.00 0.33 H new ATOM 0 HB2 ASN A 29 5.469 -5.826 -14.970 1.00 0.49 H new ATOM 0 HB3 ASN A 29 5.855 -4.250 -14.307 1.00 0.49 H new ATOM 0 HD21 ASN A 29 8.827 -6.759 -14.463 1.00 0.65 H new ATOM 0 HD22 ASN A 29 7.508 -6.466 -15.601 1.00 0.65 H new ATOM 300 N LEU A 30 4.959 -5.483 -10.551 1.00 0.20 N ATOM 301 CA LEU A 30 5.322 -4.931 -9.261 1.00 0.17 C ATOM 302 C LEU A 30 6.824 -5.052 -9.060 1.00 0.16 C ATOM 303 O LEU A 30 7.455 -4.232 -8.399 1.00 0.16 O ATOM 304 CB LEU A 30 4.599 -5.671 -8.124 1.00 0.19 C ATOM 305 CG LEU A 30 5.199 -7.017 -7.692 1.00 0.20 C ATOM 306 CD1 LEU A 30 4.599 -7.458 -6.367 1.00 0.25 C ATOM 307 CD2 LEU A 30 4.960 -8.083 -8.754 1.00 0.22 C ATOM 0 H LEU A 30 4.516 -6.401 -10.509 1.00 0.20 H new ATOM 0 HA LEU A 30 5.025 -3.883 -9.241 1.00 0.17 H new ATOM 0 HB2 LEU A 30 4.571 -5.015 -7.254 1.00 0.19 H new ATOM 0 HB3 LEU A 30 3.566 -5.840 -8.429 1.00 0.19 H new ATOM 0 HG LEU A 30 6.274 -6.888 -7.570 1.00 0.20 H new ATOM 0 HD11 LEU A 30 5.032 -8.413 -6.071 1.00 0.25 H new ATOM 0 HD12 LEU A 30 4.814 -6.710 -5.603 1.00 0.25 H new ATOM 0 HD13 LEU A 30 3.520 -7.567 -6.475 1.00 0.25 H new ATOM 0 HD21 LEU A 30 5.394 -9.027 -8.426 1.00 0.22 H new ATOM 0 HD22 LEU A 30 3.888 -8.210 -8.907 1.00 0.22 H new ATOM 0 HD23 LEU A 30 5.427 -7.775 -9.690 1.00 0.22 H new ATOM 319 N VAL A 31 7.380 -6.080 -9.674 1.00 0.16 N ATOM 320 CA VAL A 31 8.725 -6.534 -9.390 1.00 0.18 C ATOM 321 C VAL A 31 9.806 -5.659 -10.033 1.00 0.18 C ATOM 322 O VAL A 31 11.001 -5.890 -9.856 1.00 0.21 O ATOM 323 CB VAL A 31 8.844 -8.015 -9.785 1.00 0.22 C ATOM 324 CG1 VAL A 31 8.718 -8.218 -11.284 1.00 0.38 C ATOM 325 CG2 VAL A 31 10.108 -8.634 -9.257 1.00 0.41 C ATOM 0 H VAL A 31 6.904 -6.628 -10.391 1.00 0.16 H new ATOM 0 HA VAL A 31 8.904 -6.438 -8.319 1.00 0.18 H new ATOM 0 HB VAL A 31 8.005 -8.530 -9.317 1.00 0.22 H new ATOM 0 HG11 VAL A 31 8.808 -9.279 -11.516 1.00 0.38 H new ATOM 0 HG12 VAL A 31 7.747 -7.854 -11.620 1.00 0.38 H new ATOM 0 HG13 VAL A 31 9.508 -7.667 -11.794 1.00 0.38 H new ATOM 0 HG21 VAL A 31 10.154 -9.681 -9.558 1.00 0.41 H new ATOM 0 HG22 VAL A 31 10.970 -8.102 -9.661 1.00 0.41 H new ATOM 0 HG23 VAL A 31 10.118 -8.569 -8.169 1.00 0.41 H new ATOM 335 N GLN A 32 9.389 -4.634 -10.756 1.00 0.18 N ATOM 336 CA GLN A 32 10.322 -3.629 -11.236 1.00 0.22 C ATOM 337 C GLN A 32 10.601 -2.624 -10.123 1.00 0.21 C ATOM 338 O GLN A 32 11.416 -1.714 -10.272 1.00 0.25 O ATOM 339 CB GLN A 32 9.778 -2.916 -12.472 1.00 0.28 C ATOM 340 CG GLN A 32 8.461 -2.203 -12.232 1.00 0.29 C ATOM 341 CD GLN A 32 8.039 -1.358 -13.411 1.00 0.43 C ATOM 342 OE1 GLN A 32 7.348 -1.829 -14.310 1.00 1.24 O ATOM 343 NE2 GLN A 32 8.458 -0.104 -13.416 1.00 1.18 N ATOM 0 H GLN A 32 8.417 -4.476 -11.022 1.00 0.18 H new ATOM 0 HA GLN A 32 11.251 -4.123 -11.521 1.00 0.22 H new ATOM 0 HB2 GLN A 32 10.516 -2.192 -12.817 1.00 0.28 H new ATOM 0 HB3 GLN A 32 9.647 -3.644 -13.273 1.00 0.28 H new ATOM 0 HG2 GLN A 32 7.686 -2.940 -12.021 1.00 0.29 H new ATOM 0 HG3 GLN A 32 8.549 -1.571 -11.349 1.00 0.29 H new ATOM 0 HE21 GLN A 32 9.031 0.245 -12.648 1.00 1.18 H new ATOM 0 HE22 GLN A 32 8.209 0.514 -14.188 1.00 1.18 H new ATOM 352 N HIS A 33 9.893 -2.796 -9.010 1.00 0.19 N ATOM 353 CA HIS A 33 10.080 -1.964 -7.829 1.00 0.21 C ATOM 354 C HIS A 33 11.060 -2.659 -6.907 1.00 0.23 C ATOM 355 O HIS A 33 11.336 -2.204 -5.805 1.00 0.38 O ATOM 356 CB HIS A 33 8.742 -1.719 -7.126 1.00 0.22 C ATOM 357 CG HIS A 33 7.763 -0.981 -7.987 1.00 0.22 C ATOM 358 ND1 HIS A 33 8.042 0.253 -8.535 1.00 0.25 N ATOM 359 CD2 HIS A 33 6.523 -1.312 -8.427 1.00 0.21 C ATOM 360 CE1 HIS A 33 7.023 0.648 -9.270 1.00 0.26 C ATOM 361 NE2 HIS A 33 6.088 -0.279 -9.222 1.00 0.24 N ATOM 0 H HIS A 33 9.176 -3.514 -8.903 1.00 0.19 H new ATOM 0 HA HIS A 33 10.477 -0.991 -8.117 1.00 0.21 H new ATOM 0 HB2 HIS A 33 8.311 -2.676 -6.831 1.00 0.22 H new ATOM 0 HB3 HIS A 33 8.915 -1.152 -6.212 1.00 0.22 H new ATOM 0 HD2 HIS A 33 5.980 -2.217 -8.196 1.00 0.21 H new ATOM 0 HE1 HIS A 33 6.964 1.576 -9.820 1.00 0.26 H new ATOM 0 HE2 HIS A 33 5.187 -0.237 -9.698 1.00 0.24 H new ATOM 370 N LYS A 34 11.592 -3.774 -7.392 1.00 0.20 N ATOM 371 CA LYS A 34 12.593 -4.521 -6.662 1.00 0.21 C ATOM 372 C LYS A 34 13.956 -3.887 -6.894 1.00 0.21 C ATOM 373 O LYS A 34 14.348 -3.631 -8.033 1.00 0.28 O ATOM 374 CB LYS A 34 12.612 -5.986 -7.098 1.00 0.26 C ATOM 375 CG LYS A 34 13.383 -6.867 -6.137 1.00 0.35 C ATOM 376 CD LYS A 34 13.653 -8.249 -6.713 1.00 0.79 C ATOM 377 CE LYS A 34 12.394 -9.097 -6.759 1.00 1.03 C ATOM 378 NZ LYS A 34 12.659 -10.472 -7.259 1.00 1.73 N ATOM 0 H LYS A 34 11.341 -4.178 -8.294 1.00 0.20 H new ATOM 0 HA LYS A 34 12.349 -4.493 -5.600 1.00 0.21 H new ATOM 0 HB2 LYS A 34 11.588 -6.351 -7.179 1.00 0.26 H new ATOM 0 HB3 LYS A 34 13.056 -6.061 -8.091 1.00 0.26 H new ATOM 0 HG2 LYS A 34 14.330 -6.388 -5.888 1.00 0.35 H new ATOM 0 HG3 LYS A 34 12.822 -6.966 -5.208 1.00 0.35 H new ATOM 0 HD2 LYS A 34 14.061 -8.150 -7.719 1.00 0.79 H new ATOM 0 HD3 LYS A 34 14.409 -8.753 -6.110 1.00 0.79 H new ATOM 0 HE2 LYS A 34 11.959 -9.153 -5.761 1.00 1.03 H new ATOM 0 HE3 LYS A 34 11.657 -8.615 -7.401 1.00 1.03 H new ATOM 0 HZ1 LYS A 34 11.771 -11.013 -7.273 1.00 1.73 H new ATOM 0 HZ2 LYS A 34 13.049 -10.422 -8.222 1.00 1.73 H new ATOM 0 HZ3 LYS A 34 13.342 -10.944 -6.633 1.00 1.73 H new ATOM 392 N GLY A 35 14.674 -3.645 -5.816 1.00 0.21 N ATOM 393 CA GLY A 35 15.896 -2.880 -5.896 1.00 0.25 C ATOM 394 C GLY A 35 15.636 -1.442 -5.513 1.00 0.26 C ATOM 395 O GLY A 35 16.529 -0.599 -5.518 1.00 0.36 O ATOM 0 H GLY A 35 14.432 -3.967 -4.879 1.00 0.21 H new ATOM 0 HA2 GLY A 35 16.647 -3.310 -5.234 1.00 0.25 H new ATOM 0 HA3 GLY A 35 16.298 -2.928 -6.908 1.00 0.25 H new ATOM 399 N SER A 36 14.387 -1.175 -5.178 1.00 0.25 N ATOM 400 CA SER A 36 13.959 0.131 -4.726 1.00 0.29 C ATOM 401 C SER A 36 13.000 -0.050 -3.559 1.00 0.24 C ATOM 402 O SER A 36 12.191 -0.971 -3.561 1.00 0.31 O ATOM 403 CB SER A 36 13.258 0.876 -5.867 1.00 0.43 C ATOM 404 OG SER A 36 14.041 0.860 -7.049 1.00 1.14 O ATOM 0 H SER A 36 13.637 -1.866 -5.213 1.00 0.25 H new ATOM 0 HA SER A 36 14.823 0.715 -4.410 1.00 0.29 H new ATOM 0 HB2 SER A 36 12.289 0.416 -6.063 1.00 0.43 H new ATOM 0 HB3 SER A 36 13.067 1.907 -5.568 1.00 0.43 H new ATOM 0 HG SER A 36 13.569 1.341 -7.761 1.00 1.14 H new ATOM 410 N PRO A 37 13.103 0.782 -2.525 1.00 0.22 N ATOM 411 CA PRO A 37 12.149 0.756 -1.430 1.00 0.20 C ATOM 412 C PRO A 37 10.828 1.366 -1.864 1.00 0.19 C ATOM 413 O PRO A 37 10.793 2.235 -2.740 1.00 0.24 O ATOM 414 CB PRO A 37 12.806 1.597 -0.345 1.00 0.26 C ATOM 415 CG PRO A 37 13.751 2.496 -1.067 1.00 0.52 C ATOM 416 CD PRO A 37 14.136 1.811 -2.349 1.00 0.32 C ATOM 0 HA PRO A 37 11.922 -0.255 -1.090 1.00 0.20 H new ATOM 0 HB2 PRO A 37 12.065 2.170 0.212 1.00 0.26 H new ATOM 0 HB3 PRO A 37 13.331 0.970 0.375 1.00 0.26 H new ATOM 0 HG2 PRO A 37 13.283 3.459 -1.272 1.00 0.52 H new ATOM 0 HG3 PRO A 37 14.633 2.694 -0.458 1.00 0.52 H new ATOM 0 HD2 PRO A 37 14.151 2.509 -3.186 1.00 0.32 H new ATOM 0 HD3 PRO A 37 15.131 1.371 -2.283 1.00 0.32 H new ATOM 424 N LEU A 38 9.745 0.914 -1.272 1.00 0.18 N ATOM 425 CA LEU A 38 8.441 1.358 -1.693 1.00 0.19 C ATOM 426 C LEU A 38 7.425 1.250 -0.572 1.00 0.18 C ATOM 427 O LEU A 38 7.575 0.457 0.348 1.00 0.24 O ATOM 428 CB LEU A 38 7.965 0.561 -2.918 1.00 0.24 C ATOM 429 CG LEU A 38 7.793 -0.954 -2.735 1.00 0.40 C ATOM 430 CD1 LEU A 38 6.932 -1.521 -3.850 1.00 0.79 C ATOM 431 CD2 LEU A 38 9.138 -1.668 -2.714 1.00 1.03 C ATOM 0 H LEU A 38 9.744 0.244 -0.503 1.00 0.18 H new ATOM 0 HA LEU A 38 8.528 2.409 -1.967 1.00 0.19 H new ATOM 0 HB2 LEU A 38 7.010 0.975 -3.242 1.00 0.24 H new ATOM 0 HB3 LEU A 38 8.675 0.727 -3.728 1.00 0.24 H new ATOM 0 HG LEU A 38 7.304 -1.119 -1.775 1.00 0.40 H new ATOM 0 HD11 LEU A 38 6.817 -2.596 -3.710 1.00 0.79 H new ATOM 0 HD12 LEU A 38 5.951 -1.045 -3.830 1.00 0.79 H new ATOM 0 HD13 LEU A 38 7.409 -1.329 -4.811 1.00 0.79 H new ATOM 0 HD21 LEU A 38 8.980 -2.738 -2.583 1.00 1.03 H new ATOM 0 HD22 LEU A 38 9.659 -1.491 -3.655 1.00 1.03 H new ATOM 0 HD23 LEU A 38 9.740 -1.287 -1.889 1.00 1.03 H new ATOM 443 N LEU A 39 6.411 2.086 -0.646 1.00 0.17 N ATOM 444 CA LEU A 39 5.266 1.974 0.231 1.00 0.16 C ATOM 445 C LEU A 39 4.095 1.474 -0.569 1.00 0.19 C ATOM 446 O LEU A 39 3.997 1.745 -1.760 1.00 0.42 O ATOM 447 CB LEU A 39 4.893 3.308 0.868 1.00 0.21 C ATOM 448 CG LEU A 39 5.411 3.528 2.288 1.00 0.25 C ATOM 449 CD1 LEU A 39 6.926 3.480 2.343 1.00 0.97 C ATOM 450 CD2 LEU A 39 4.894 4.845 2.826 1.00 1.10 C ATOM 0 H LEU A 39 6.357 2.857 -1.311 1.00 0.17 H new ATOM 0 HA LEU A 39 5.524 1.283 1.034 1.00 0.16 H new ATOM 0 HB2 LEU A 39 5.270 4.111 0.234 1.00 0.21 H new ATOM 0 HB3 LEU A 39 3.806 3.394 0.879 1.00 0.21 H new ATOM 0 HG LEU A 39 5.040 2.718 2.916 1.00 0.25 H new ATOM 0 HD11 LEU A 39 7.258 3.641 3.369 1.00 0.97 H new ATOM 0 HD12 LEU A 39 7.272 2.506 1.998 1.00 0.97 H new ATOM 0 HD13 LEU A 39 7.338 4.259 1.702 1.00 0.97 H new ATOM 0 HD21 LEU A 39 5.267 4.996 3.839 1.00 1.10 H new ATOM 0 HD22 LEU A 39 5.238 5.659 2.188 1.00 1.10 H new ATOM 0 HD23 LEU A 39 3.804 4.830 2.839 1.00 1.10 H new ATOM 462 N ILE A 40 3.219 0.738 0.068 1.00 0.18 N ATOM 463 CA ILE A 40 2.045 0.227 -0.607 1.00 0.15 C ATOM 464 C ILE A 40 0.813 0.497 0.240 1.00 0.14 C ATOM 465 O ILE A 40 0.731 0.060 1.389 1.00 0.15 O ATOM 466 CB ILE A 40 2.205 -1.278 -0.918 1.00 0.16 C ATOM 467 CG1 ILE A 40 3.427 -1.479 -1.825 1.00 0.18 C ATOM 468 CG2 ILE A 40 0.952 -1.833 -1.574 1.00 0.20 C ATOM 469 CD1 ILE A 40 3.782 -2.924 -2.087 1.00 0.18 C ATOM 0 H ILE A 40 3.293 0.478 1.051 1.00 0.18 H new ATOM 0 HA ILE A 40 1.925 0.741 -1.561 1.00 0.15 H new ATOM 0 HB ILE A 40 2.355 -1.821 0.015 1.00 0.16 H new ATOM 0 HG12 ILE A 40 3.241 -0.985 -2.779 1.00 0.18 H new ATOM 0 HG13 ILE A 40 4.286 -0.984 -1.372 1.00 0.18 H new ATOM 0 HG21 ILE A 40 1.090 -2.894 -1.783 1.00 0.20 H new ATOM 0 HG22 ILE A 40 0.102 -1.703 -0.904 1.00 0.20 H new ATOM 0 HG23 ILE A 40 0.764 -1.301 -2.507 1.00 0.20 H new ATOM 0 HD11 ILE A 40 4.656 -2.972 -2.736 1.00 0.18 H new ATOM 0 HD12 ILE A 40 4.003 -3.421 -1.143 1.00 0.18 H new ATOM 0 HD13 ILE A 40 2.943 -3.423 -2.572 1.00 0.18 H new ATOM 481 N TYR A 41 -0.121 1.259 -0.319 1.00 0.13 N ATOM 482 CA TYR A 41 -1.270 1.729 0.422 1.00 0.13 C ATOM 483 C TYR A 41 -2.515 0.903 0.103 1.00 0.14 C ATOM 484 O TYR A 41 -2.841 0.670 -1.057 1.00 0.19 O ATOM 485 CB TYR A 41 -1.522 3.211 0.104 1.00 0.15 C ATOM 486 CG TYR A 41 -0.549 4.175 0.752 1.00 0.14 C ATOM 487 CD1 TYR A 41 0.776 4.225 0.336 1.00 0.17 C ATOM 488 CD2 TYR A 41 -0.945 5.024 1.774 1.00 0.18 C ATOM 489 CE1 TYR A 41 1.679 5.090 0.923 1.00 0.19 C ATOM 490 CE2 TYR A 41 -0.048 5.895 2.364 1.00 0.20 C ATOM 491 CZ TYR A 41 1.208 5.967 1.950 1.00 0.18 C ATOM 492 OH TYR A 41 2.156 6.785 2.521 1.00 0.23 O ATOM 0 H TYR A 41 -0.097 1.563 -1.292 1.00 0.13 H new ATOM 0 HA TYR A 41 -1.059 1.616 1.485 1.00 0.13 H new ATOM 0 HB2 TYR A 41 -1.482 3.348 -0.977 1.00 0.15 H new ATOM 0 HB3 TYR A 41 -2.533 3.469 0.421 1.00 0.15 H new ATOM 0 HD1 TYR A 41 1.106 3.575 -0.461 1.00 0.17 H new ATOM 0 HD2 TYR A 41 -1.970 5.005 2.114 1.00 0.18 H new ATOM 0 HE1 TYR A 41 2.714 5.104 0.614 1.00 0.19 H new ATOM 0 HE2 TYR A 41 -0.377 6.527 3.176 1.00 0.20 H new ATOM 0 HH TYR A 41 1.735 7.344 3.207 1.00 0.23 H new ATOM 502 N ASN A 42 -3.193 0.456 1.147 1.00 0.16 N ATOM 503 CA ASN A 42 -4.470 -0.237 1.017 1.00 0.18 C ATOM 504 C ASN A 42 -5.570 0.814 1.081 1.00 0.18 C ATOM 505 O ASN A 42 -6.030 1.174 2.160 1.00 0.21 O ATOM 506 CB ASN A 42 -4.687 -1.270 2.141 1.00 0.26 C ATOM 507 CG ASN A 42 -3.561 -1.374 3.175 1.00 0.46 C ATOM 508 OD1 ASN A 42 -3.821 -1.511 4.369 1.00 1.25 O ATOM 509 ND2 ASN A 42 -2.310 -1.387 2.733 1.00 1.28 N ATOM 0 H ASN A 42 -2.876 0.562 2.111 1.00 0.16 H new ATOM 0 HA ASN A 42 -4.484 -0.781 0.073 1.00 0.18 H new ATOM 0 HB2 ASN A 42 -5.612 -1.023 2.662 1.00 0.26 H new ATOM 0 HB3 ASN A 42 -4.829 -2.250 1.686 1.00 0.26 H new ATOM 0 HD21 ASN A 42 -1.539 -1.513 3.389 1.00 1.28 H new ATOM 0 HD22 ASN A 42 -2.120 -1.271 1.738 1.00 1.28 H new ATOM 516 N VAL A 43 -5.999 1.304 -0.070 1.00 0.18 N ATOM 517 CA VAL A 43 -6.777 2.536 -0.115 1.00 0.21 C ATOM 518 C VAL A 43 -8.229 2.291 -0.469 1.00 0.25 C ATOM 519 O VAL A 43 -8.554 1.429 -1.283 1.00 0.35 O ATOM 520 CB VAL A 43 -6.182 3.519 -1.152 1.00 0.27 C ATOM 521 CG1 VAL A 43 -4.682 3.606 -0.992 1.00 0.68 C ATOM 522 CG2 VAL A 43 -6.526 3.120 -2.580 1.00 0.88 C ATOM 0 H VAL A 43 -5.825 0.875 -0.979 1.00 0.18 H new ATOM 0 HA VAL A 43 -6.730 2.963 0.887 1.00 0.21 H new ATOM 0 HB VAL A 43 -6.627 4.496 -0.963 1.00 0.27 H new ATOM 0 HG11 VAL A 43 -4.277 4.301 -1.728 1.00 0.68 H new ATOM 0 HG12 VAL A 43 -4.443 3.960 0.011 1.00 0.68 H new ATOM 0 HG13 VAL A 43 -4.242 2.620 -1.144 1.00 0.68 H new ATOM 0 HG21 VAL A 43 -6.088 3.838 -3.274 1.00 0.88 H new ATOM 0 HG22 VAL A 43 -6.128 2.127 -2.786 1.00 0.88 H new ATOM 0 HG23 VAL A 43 -7.609 3.110 -2.704 1.00 0.88 H new ATOM 532 N ALA A 44 -9.103 3.068 0.140 1.00 0.32 N ATOM 533 CA ALA A 44 -10.463 3.146 -0.328 1.00 0.39 C ATOM 534 C ALA A 44 -10.433 3.932 -1.613 1.00 0.36 C ATOM 535 O ALA A 44 -9.982 5.079 -1.640 1.00 0.42 O ATOM 536 CB ALA A 44 -11.365 3.800 0.692 1.00 0.52 C ATOM 0 H ALA A 44 -8.894 3.648 0.953 1.00 0.32 H new ATOM 0 HA ALA A 44 -10.870 2.148 -0.491 1.00 0.39 H new ATOM 0 HB1 ALA A 44 -12.383 3.841 0.304 1.00 0.52 H new ATOM 0 HB2 ALA A 44 -11.352 3.220 1.615 1.00 0.52 H new ATOM 0 HB3 ALA A 44 -11.012 4.811 0.894 1.00 0.52 H new ATOM 542 N SER A 45 -10.872 3.306 -2.675 1.00 0.39 N ATOM 543 CA SER A 45 -10.618 3.807 -4.000 1.00 0.45 C ATOM 544 C SER A 45 -11.475 5.034 -4.332 1.00 0.47 C ATOM 545 O SER A 45 -12.563 4.921 -4.890 1.00 0.60 O ATOM 546 CB SER A 45 -10.811 2.660 -4.991 1.00 0.62 C ATOM 547 OG SER A 45 -11.920 1.859 -4.647 1.00 1.84 O ATOM 0 H SER A 45 -11.412 2.441 -2.646 1.00 0.39 H new ATOM 0 HA SER A 45 -9.590 4.163 -4.066 1.00 0.45 H new ATOM 0 HB2 SER A 45 -10.950 3.064 -5.994 1.00 0.62 H new ATOM 0 HB3 SER A 45 -9.911 2.045 -5.017 1.00 0.62 H new ATOM 0 HG SER A 45 -11.628 1.130 -4.061 1.00 1.84 H new ATOM 553 N LYS A 46 -10.963 6.207 -3.947 1.00 0.56 N ATOM 554 CA LYS A 46 -11.579 7.492 -4.278 1.00 0.65 C ATOM 555 C LYS A 46 -12.931 7.630 -3.579 1.00 0.63 C ATOM 556 O LYS A 46 -13.922 8.056 -4.176 1.00 0.83 O ATOM 557 CB LYS A 46 -11.721 7.627 -5.802 1.00 0.77 C ATOM 558 CG LYS A 46 -11.916 9.051 -6.296 1.00 1.12 C ATOM 559 CD LYS A 46 -11.860 9.106 -7.813 1.00 1.59 C ATOM 560 CE LYS A 46 -12.063 10.517 -8.334 1.00 2.01 C ATOM 561 NZ LYS A 46 -11.921 10.582 -9.811 1.00 2.43 N ATOM 0 H LYS A 46 -10.108 6.290 -3.396 1.00 0.56 H new ATOM 0 HA LYS A 46 -10.938 8.299 -3.923 1.00 0.65 H new ATOM 0 HB2 LYS A 46 -10.831 7.211 -6.275 1.00 0.77 H new ATOM 0 HB3 LYS A 46 -12.568 7.024 -6.130 1.00 0.77 H new ATOM 0 HG2 LYS A 46 -12.876 9.433 -5.949 1.00 1.12 H new ATOM 0 HG3 LYS A 46 -11.145 9.696 -5.875 1.00 1.12 H new ATOM 0 HD2 LYS A 46 -10.897 8.727 -8.155 1.00 1.59 H new ATOM 0 HD3 LYS A 46 -12.626 8.451 -8.229 1.00 1.59 H new ATOM 0 HE2 LYS A 46 -13.053 10.872 -8.047 1.00 2.01 H new ATOM 0 HE3 LYS A 46 -11.338 11.185 -7.869 1.00 2.01 H new ATOM 0 HZ1 LYS A 46 -12.066 11.561 -10.131 1.00 2.43 H new ATOM 0 HZ2 LYS A 46 -10.968 10.267 -10.082 1.00 2.43 H new ATOM 0 HZ3 LYS A 46 -12.630 9.964 -10.255 1.00 2.43 H new ATOM 575 N CYS A 47 -12.956 7.265 -2.301 1.00 0.61 N ATOM 576 CA CYS A 47 -14.184 7.282 -1.522 1.00 0.63 C ATOM 577 C CYS A 47 -13.879 7.206 -0.025 1.00 0.75 C ATOM 578 O CYS A 47 -13.048 6.407 0.401 1.00 0.96 O ATOM 579 CB CYS A 47 -15.060 6.096 -1.933 1.00 0.70 C ATOM 580 SG CYS A 47 -14.187 4.495 -1.886 1.00 0.99 S ATOM 0 H CYS A 47 -12.134 6.953 -1.783 1.00 0.61 H new ATOM 0 HA CYS A 47 -14.711 8.216 -1.717 1.00 0.63 H new ATOM 0 HB2 CYS A 47 -15.926 6.048 -1.273 1.00 0.70 H new ATOM 0 HB3 CYS A 47 -15.437 6.266 -2.941 1.00 0.70 H new ATOM 585 N GLY A 48 -14.525 8.058 0.761 1.00 0.82 N ATOM 586 CA GLY A 48 -14.449 7.931 2.206 1.00 1.09 C ATOM 587 C GLY A 48 -13.483 8.908 2.860 1.00 0.83 C ATOM 588 O GLY A 48 -13.291 10.028 2.381 1.00 0.95 O ATOM 0 H GLY A 48 -15.099 8.832 0.427 1.00 0.82 H new ATOM 0 HA2 GLY A 48 -15.443 8.081 2.627 1.00 1.09 H new ATOM 0 HA3 GLY A 48 -14.147 6.914 2.456 1.00 1.09 H new ATOM 592 N TYR A 49 -12.891 8.476 3.971 1.00 0.84 N ATOM 593 CA TYR A 49 -11.981 9.307 4.754 1.00 0.81 C ATOM 594 C TYR A 49 -10.528 9.028 4.392 1.00 0.74 C ATOM 595 O TYR A 49 -10.000 7.968 4.721 1.00 1.08 O ATOM 596 CB TYR A 49 -12.184 9.030 6.241 1.00 1.17 C ATOM 597 CG TYR A 49 -13.452 9.621 6.793 1.00 1.46 C ATOM 598 CD1 TYR A 49 -13.547 10.984 7.033 1.00 2.18 C ATOM 599 CD2 TYR A 49 -14.558 8.825 7.063 1.00 1.79 C ATOM 600 CE1 TYR A 49 -14.704 11.538 7.529 1.00 2.70 C ATOM 601 CE2 TYR A 49 -15.722 9.373 7.555 1.00 2.24 C ATOM 602 CZ TYR A 49 -15.788 10.729 7.787 1.00 2.55 C ATOM 603 OH TYR A 49 -16.944 11.285 8.266 1.00 3.16 O ATOM 0 H TYR A 49 -13.029 7.540 4.353 1.00 0.84 H new ATOM 0 HA TYR A 49 -12.202 10.351 4.530 1.00 0.81 H new ATOM 0 HB2 TYR A 49 -12.194 7.952 6.404 1.00 1.17 H new ATOM 0 HB3 TYR A 49 -11.335 9.429 6.796 1.00 1.17 H new ATOM 0 HD1 TYR A 49 -12.699 11.620 6.827 1.00 2.18 H new ATOM 0 HD2 TYR A 49 -14.504 7.761 6.885 1.00 1.79 H new ATOM 0 HE1 TYR A 49 -14.762 12.600 7.715 1.00 2.70 H new ATOM 0 HE2 TYR A 49 -16.576 8.744 7.757 1.00 2.24 H new ATOM 0 HH TYR A 49 -17.615 10.583 8.396 1.00 3.16 H new ATOM 613 N THR A 50 -9.876 9.993 3.760 1.00 0.66 N ATOM 614 CA THR A 50 -8.499 9.824 3.329 1.00 0.68 C ATOM 615 C THR A 50 -7.545 9.704 4.518 1.00 0.89 C ATOM 616 O THR A 50 -6.542 8.986 4.450 1.00 1.94 O ATOM 617 CB THR A 50 -8.056 10.986 2.420 1.00 0.71 C ATOM 618 OG1 THR A 50 -8.463 12.236 2.991 1.00 1.00 O ATOM 619 CG2 THR A 50 -8.653 10.842 1.029 1.00 0.83 C ATOM 0 H THR A 50 -10.280 10.902 3.535 1.00 0.66 H new ATOM 0 HA THR A 50 -8.456 8.895 2.761 1.00 0.68 H new ATOM 0 HB THR A 50 -6.969 10.960 2.337 1.00 0.71 H new ATOM 0 HG1 THR A 50 -8.177 12.970 2.409 1.00 1.00 H new ATOM 0 HG21 THR A 50 -8.326 11.674 0.405 1.00 0.83 H new ATOM 0 HG22 THR A 50 -8.320 9.903 0.586 1.00 0.83 H new ATOM 0 HG23 THR A 50 -9.741 10.845 1.098 1.00 0.83 H new ATOM 627 N LYS A 51 -7.865 10.430 5.597 1.00 0.51 N ATOM 628 CA LYS A 51 -7.124 10.366 6.866 1.00 0.44 C ATOM 629 C LYS A 51 -5.699 10.904 6.740 1.00 0.45 C ATOM 630 O LYS A 51 -4.982 11.006 7.734 1.00 0.59 O ATOM 631 CB LYS A 51 -7.101 8.935 7.416 1.00 0.55 C ATOM 632 CG LYS A 51 -8.471 8.410 7.819 1.00 1.23 C ATOM 633 CD LYS A 51 -8.389 6.997 8.385 1.00 1.45 C ATOM 634 CE LYS A 51 -7.603 6.949 9.689 1.00 1.44 C ATOM 635 NZ LYS A 51 -8.289 7.686 10.784 1.00 2.03 N ATOM 0 H LYS A 51 -8.649 11.082 5.615 1.00 0.51 H new ATOM 0 HA LYS A 51 -7.655 11.009 7.568 1.00 0.44 H new ATOM 0 HB2 LYS A 51 -6.676 8.273 6.662 1.00 0.55 H new ATOM 0 HB3 LYS A 51 -6.439 8.899 8.281 1.00 0.55 H new ATOM 0 HG2 LYS A 51 -8.911 9.075 8.562 1.00 1.23 H new ATOM 0 HG3 LYS A 51 -9.133 8.417 6.953 1.00 1.23 H new ATOM 0 HD2 LYS A 51 -9.396 6.615 8.554 1.00 1.45 H new ATOM 0 HD3 LYS A 51 -7.918 6.340 7.654 1.00 1.45 H new ATOM 0 HE2 LYS A 51 -7.459 5.910 9.987 1.00 1.44 H new ATOM 0 HE3 LYS A 51 -6.613 7.376 9.531 1.00 1.44 H new ATOM 0 HZ1 LYS A 51 -7.813 7.488 11.687 1.00 2.03 H new ATOM 0 HZ2 LYS A 51 -8.254 8.707 10.590 1.00 2.03 H new ATOM 0 HZ3 LYS A 51 -9.281 7.378 10.841 1.00 2.03 H new ATOM 649 N GLY A 52 -5.307 11.280 5.529 1.00 0.43 N ATOM 650 CA GLY A 52 -3.962 11.770 5.301 1.00 0.47 C ATOM 651 C GLY A 52 -3.117 10.794 4.509 1.00 0.39 C ATOM 652 O GLY A 52 -1.939 11.039 4.261 1.00 0.45 O ATOM 0 H GLY A 52 -5.899 11.254 4.699 1.00 0.43 H new ATOM 0 HA2 GLY A 52 -4.010 12.720 4.768 1.00 0.47 H new ATOM 0 HA3 GLY A 52 -3.483 11.966 6.260 1.00 0.47 H new ATOM 656 N GLY A 53 -3.729 9.696 4.084 1.00 0.34 N ATOM 657 CA GLY A 53 -3.004 8.654 3.392 1.00 0.30 C ATOM 658 C GLY A 53 -2.624 9.069 1.996 1.00 0.27 C ATOM 659 O GLY A 53 -1.525 8.783 1.535 1.00 0.26 O ATOM 0 H GLY A 53 -4.724 9.510 4.209 1.00 0.34 H new ATOM 0 HA2 GLY A 53 -2.104 8.403 3.954 1.00 0.30 H new ATOM 0 HA3 GLY A 53 -3.615 7.753 3.349 1.00 0.30 H new ATOM 663 N TYR A 54 -3.531 9.763 1.328 1.00 0.30 N ATOM 664 CA TYR A 54 -3.308 10.191 -0.030 1.00 0.29 C ATOM 665 C TYR A 54 -2.224 11.268 -0.072 1.00 0.26 C ATOM 666 O TYR A 54 -1.258 11.150 -0.824 1.00 0.25 O ATOM 667 CB TYR A 54 -4.626 10.697 -0.626 1.00 0.32 C ATOM 668 CG TYR A 54 -4.555 11.011 -2.097 1.00 0.32 C ATOM 669 CD1 TYR A 54 -3.465 10.619 -2.850 1.00 0.32 C ATOM 670 CD2 TYR A 54 -5.585 11.686 -2.729 1.00 0.49 C ATOM 671 CE1 TYR A 54 -3.403 10.892 -4.203 1.00 0.33 C ATOM 672 CE2 TYR A 54 -5.543 11.951 -4.079 1.00 0.57 C ATOM 673 CZ TYR A 54 -4.401 11.626 -4.794 1.00 0.43 C ATOM 674 OH TYR A 54 -4.416 11.779 -6.161 1.00 0.52 O ATOM 0 H TYR A 54 -4.433 10.040 1.714 1.00 0.30 H new ATOM 0 HA TYR A 54 -2.960 9.350 -0.629 1.00 0.29 H new ATOM 0 HB2 TYR A 54 -5.398 9.945 -0.463 1.00 0.32 H new ATOM 0 HB3 TYR A 54 -4.935 11.594 -0.089 1.00 0.32 H new ATOM 0 HD1 TYR A 54 -2.651 10.092 -2.375 1.00 0.32 H new ATOM 0 HD2 TYR A 54 -6.438 12.011 -2.152 1.00 0.49 H new ATOM 0 HE1 TYR A 54 -2.574 10.530 -4.792 1.00 0.33 H new ATOM 0 HE2 TYR A 54 -6.388 12.406 -4.574 1.00 0.57 H new ATOM 0 HH TYR A 54 -5.016 11.114 -6.558 1.00 0.52 H new ATOM 684 N GLU A 55 -2.384 12.303 0.747 1.00 0.26 N ATOM 685 CA GLU A 55 -1.401 13.382 0.847 1.00 0.26 C ATOM 686 C GLU A 55 -0.018 12.824 1.088 1.00 0.22 C ATOM 687 O GLU A 55 0.937 13.143 0.374 1.00 0.24 O ATOM 688 CB GLU A 55 -1.740 14.328 2.002 1.00 0.33 C ATOM 689 CG GLU A 55 -3.066 15.030 1.849 1.00 1.15 C ATOM 690 CD GLU A 55 -4.248 14.170 2.250 1.00 1.78 C ATOM 691 OE1 GLU A 55 -4.774 13.433 1.390 1.00 2.23 O ATOM 692 OE2 GLU A 55 -4.658 14.228 3.426 1.00 2.46 O ATOM 0 H GLU A 55 -3.193 12.419 1.358 1.00 0.26 H new ATOM 0 HA GLU A 55 -1.426 13.927 -0.096 1.00 0.26 H new ATOM 0 HB2 GLU A 55 -1.746 13.761 2.933 1.00 0.33 H new ATOM 0 HB3 GLU A 55 -0.952 15.076 2.089 1.00 0.33 H new ATOM 0 HG2 GLU A 55 -3.062 15.936 2.455 1.00 1.15 H new ATOM 0 HG3 GLU A 55 -3.187 15.341 0.811 1.00 1.15 H new ATOM 699 N THR A 56 0.072 11.983 2.095 1.00 0.21 N ATOM 700 CA THR A 56 1.326 11.433 2.513 1.00 0.21 C ATOM 701 C THR A 56 1.928 10.552 1.416 1.00 0.19 C ATOM 702 O THR A 56 3.102 10.693 1.072 1.00 0.21 O ATOM 703 CB THR A 56 1.140 10.640 3.819 1.00 0.26 C ATOM 704 OG1 THR A 56 0.608 11.506 4.830 1.00 0.33 O ATOM 705 CG2 THR A 56 2.440 10.039 4.306 1.00 0.27 C ATOM 0 H THR A 56 -0.728 11.666 2.643 1.00 0.21 H new ATOM 0 HA THR A 56 2.023 12.250 2.698 1.00 0.21 H new ATOM 0 HB THR A 56 0.449 9.821 3.616 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.367 11.548 4.745 1.00 0.33 H new ATOM 0 HG21 THR A 56 2.263 9.488 5.230 1.00 0.27 H new ATOM 0 HG22 THR A 56 2.833 9.361 3.549 1.00 0.27 H new ATOM 0 HG23 THR A 56 3.162 10.834 4.491 1.00 0.27 H new ATOM 713 N ALA A 57 1.100 9.679 0.844 1.00 0.18 N ATOM 714 CA ALA A 57 1.530 8.790 -0.234 1.00 0.17 C ATOM 715 C ALA A 57 2.047 9.579 -1.426 1.00 0.17 C ATOM 716 O ALA A 57 3.118 9.283 -1.964 1.00 0.18 O ATOM 717 CB ALA A 57 0.380 7.900 -0.674 1.00 0.19 C ATOM 0 H ALA A 57 0.122 9.568 1.111 1.00 0.18 H new ATOM 0 HA ALA A 57 2.342 8.172 0.150 1.00 0.17 H new ATOM 0 HB1 ALA A 57 0.715 7.243 -1.477 1.00 0.19 H new ATOM 0 HB2 ALA A 57 0.042 7.298 0.170 1.00 0.19 H new ATOM 0 HB3 ALA A 57 -0.443 8.519 -1.031 1.00 0.19 H new ATOM 723 N THR A 58 1.275 10.579 -1.833 1.00 0.18 N ATOM 724 CA THR A 58 1.631 11.408 -2.967 1.00 0.20 C ATOM 725 C THR A 58 2.983 12.077 -2.734 1.00 0.19 C ATOM 726 O THR A 58 3.883 12.009 -3.573 1.00 0.21 O ATOM 727 CB THR A 58 0.574 12.506 -3.209 1.00 0.23 C ATOM 728 OG1 THR A 58 -0.730 11.925 -3.284 1.00 0.27 O ATOM 729 CG2 THR A 58 0.862 13.267 -4.494 1.00 0.30 C ATOM 0 H THR A 58 0.393 10.833 -1.388 1.00 0.18 H new ATOM 0 HA THR A 58 1.681 10.759 -3.841 1.00 0.20 H new ATOM 0 HB THR A 58 0.617 13.204 -2.373 1.00 0.23 H new ATOM 0 HG1 THR A 58 -1.065 11.754 -2.379 1.00 0.27 H new ATOM 0 HG21 THR A 58 0.102 14.035 -4.640 1.00 0.30 H new ATOM 0 HG22 THR A 58 1.844 13.736 -4.427 1.00 0.30 H new ATOM 0 HG23 THR A 58 0.847 12.576 -5.337 1.00 0.30 H new ATOM 737 N THR A 59 3.113 12.703 -1.568 1.00 0.18 N ATOM 738 CA THR A 59 4.307 13.453 -1.219 1.00 0.19 C ATOM 739 C THR A 59 5.539 12.550 -1.151 1.00 0.18 C ATOM 740 O THR A 59 6.598 12.907 -1.658 1.00 0.22 O ATOM 741 CB THR A 59 4.116 14.187 0.124 1.00 0.23 C ATOM 742 OG1 THR A 59 2.929 14.993 0.064 1.00 0.97 O ATOM 743 CG2 THR A 59 5.313 15.072 0.445 1.00 1.08 C ATOM 0 H THR A 59 2.395 12.703 -0.844 1.00 0.18 H new ATOM 0 HA THR A 59 4.470 14.189 -2.006 1.00 0.19 H new ATOM 0 HB THR A 59 4.023 13.439 0.911 1.00 0.23 H new ATOM 0 HG1 THR A 59 2.139 14.419 0.148 1.00 0.97 H new ATOM 0 HG21 THR A 59 5.148 15.576 1.397 1.00 1.08 H new ATOM 0 HG22 THR A 59 6.212 14.459 0.510 1.00 1.08 H new ATOM 0 HG23 THR A 59 5.437 15.816 -0.342 1.00 1.08 H new ATOM 751 N LEU A 60 5.394 11.377 -0.545 1.00 0.16 N ATOM 752 CA LEU A 60 6.505 10.434 -0.422 1.00 0.15 C ATOM 753 C LEU A 60 7.009 9.993 -1.783 1.00 0.14 C ATOM 754 O LEU A 60 8.213 10.040 -2.043 1.00 0.16 O ATOM 755 CB LEU A 60 6.082 9.217 0.377 1.00 0.15 C ATOM 756 CG LEU A 60 5.819 9.480 1.843 1.00 0.18 C ATOM 757 CD1 LEU A 60 5.104 8.293 2.430 1.00 0.81 C ATOM 758 CD2 LEU A 60 7.130 9.746 2.572 1.00 0.70 C ATOM 0 H LEU A 60 4.520 11.054 -0.131 1.00 0.16 H new ATOM 0 HA LEU A 60 7.314 10.948 0.098 1.00 0.15 H new ATOM 0 HB2 LEU A 60 5.179 8.802 -0.071 1.00 0.15 H new ATOM 0 HB3 LEU A 60 6.858 8.457 0.292 1.00 0.15 H new ATOM 0 HG LEU A 60 5.192 10.364 1.956 1.00 0.18 H new ATOM 0 HD11 LEU A 60 4.909 8.472 3.487 1.00 0.81 H new ATOM 0 HD12 LEU A 60 4.159 8.142 1.907 1.00 0.81 H new ATOM 0 HD13 LEU A 60 5.725 7.404 2.321 1.00 0.81 H new ATOM 0 HD21 LEU A 60 6.928 9.934 3.627 1.00 0.70 H new ATOM 0 HD22 LEU A 60 7.782 8.878 2.476 1.00 0.70 H new ATOM 0 HD23 LEU A 60 7.619 10.617 2.135 1.00 0.70 H new ATOM 770 N TYR A 61 6.088 9.563 -2.644 1.00 0.14 N ATOM 771 CA TYR A 61 6.448 9.136 -3.987 1.00 0.16 C ATOM 772 C TYR A 61 7.243 10.230 -4.680 1.00 0.18 C ATOM 773 O TYR A 61 8.330 9.995 -5.194 1.00 0.22 O ATOM 774 CB TYR A 61 5.204 8.811 -4.809 1.00 0.21 C ATOM 775 CG TYR A 61 5.528 8.250 -6.176 1.00 0.20 C ATOM 776 CD1 TYR A 61 5.877 6.916 -6.330 1.00 0.23 C ATOM 777 CD2 TYR A 61 5.489 9.052 -7.309 1.00 0.26 C ATOM 778 CE1 TYR A 61 6.180 6.393 -7.570 1.00 0.24 C ATOM 779 CE2 TYR A 61 5.788 8.537 -8.556 1.00 0.30 C ATOM 780 CZ TYR A 61 6.135 7.209 -8.683 1.00 0.27 C ATOM 781 OH TYR A 61 6.446 6.699 -9.924 1.00 0.33 O ATOM 0 H TYR A 61 5.092 9.503 -2.433 1.00 0.14 H new ATOM 0 HA TYR A 61 7.056 8.235 -3.907 1.00 0.16 H new ATOM 0 HB2 TYR A 61 4.592 8.093 -4.263 1.00 0.21 H new ATOM 0 HB3 TYR A 61 4.606 9.715 -4.926 1.00 0.21 H new ATOM 0 HD1 TYR A 61 5.912 6.274 -5.462 1.00 0.23 H new ATOM 0 HD2 TYR A 61 5.221 10.094 -7.214 1.00 0.26 H new ATOM 0 HE1 TYR A 61 6.451 5.352 -7.670 1.00 0.24 H new ATOM 0 HE2 TYR A 61 5.750 9.173 -9.428 1.00 0.30 H new ATOM 0 HH TYR A 61 6.146 7.322 -10.618 1.00 0.33 H new ATOM 791 N ASN A 62 6.715 11.437 -4.630 1.00 0.22 N ATOM 792 CA ASN A 62 7.291 12.550 -5.383 1.00 0.29 C ATOM 793 C ASN A 62 8.600 13.034 -4.769 1.00 0.28 C ATOM 794 O ASN A 62 9.497 13.503 -5.475 1.00 0.36 O ATOM 795 CB ASN A 62 6.300 13.714 -5.472 1.00 0.38 C ATOM 796 CG ASN A 62 5.136 13.424 -6.402 1.00 1.04 C ATOM 797 OD1 ASN A 62 5.272 12.690 -7.380 1.00 1.76 O ATOM 798 ND2 ASN A 62 3.984 14.000 -6.105 1.00 1.29 N ATOM 0 H ASN A 62 5.891 11.679 -4.080 1.00 0.22 H new ATOM 0 HA ASN A 62 7.504 12.181 -6.386 1.00 0.29 H new ATOM 0 HB2 ASN A 62 5.917 13.936 -4.476 1.00 0.38 H new ATOM 0 HB3 ASN A 62 6.823 14.605 -5.819 1.00 0.38 H new ATOM 0 HD21 ASN A 62 3.168 13.842 -6.696 1.00 1.29 H new ATOM 0 HD22 ASN A 62 3.911 14.602 -5.285 1.00 1.29 H new ATOM 805 N LYS A 63 8.709 12.915 -3.457 1.00 0.24 N ATOM 806 CA LYS A 63 9.876 13.398 -2.739 1.00 0.28 C ATOM 807 C LYS A 63 11.042 12.420 -2.856 1.00 0.27 C ATOM 808 O LYS A 63 12.175 12.821 -3.121 1.00 0.42 O ATOM 809 CB LYS A 63 9.525 13.614 -1.266 1.00 0.33 C ATOM 810 CG LYS A 63 10.640 14.234 -0.437 1.00 0.43 C ATOM 811 CD LYS A 63 10.891 15.684 -0.823 1.00 0.98 C ATOM 812 CE LYS A 63 11.903 16.337 0.105 1.00 1.16 C ATOM 813 NZ LYS A 63 13.252 15.727 -0.025 1.00 1.79 N ATOM 0 H LYS A 63 7.999 12.485 -2.864 1.00 0.24 H new ATOM 0 HA LYS A 63 10.182 14.344 -3.185 1.00 0.28 H new ATOM 0 HB2 LYS A 63 8.645 14.254 -1.205 1.00 0.33 H new ATOM 0 HB3 LYS A 63 9.252 12.655 -0.826 1.00 0.33 H new ATOM 0 HG2 LYS A 63 10.381 14.179 0.620 1.00 0.43 H new ATOM 0 HG3 LYS A 63 11.556 13.658 -0.571 1.00 0.43 H new ATOM 0 HD2 LYS A 63 11.253 15.731 -1.850 1.00 0.98 H new ATOM 0 HD3 LYS A 63 9.953 16.239 -0.790 1.00 0.98 H new ATOM 0 HE2 LYS A 63 11.964 17.402 -0.117 1.00 1.16 H new ATOM 0 HE3 LYS A 63 11.561 16.245 1.136 1.00 1.16 H new ATOM 0 HZ1 LYS A 63 13.930 16.255 0.561 1.00 1.79 H new ATOM 0 HZ2 LYS A 63 13.218 14.737 0.293 1.00 1.79 H new ATOM 0 HZ3 LYS A 63 13.554 15.761 -1.020 1.00 1.79 H new ATOM 827 N TYR A 64 10.764 11.137 -2.668 1.00 0.18 N ATOM 828 CA TYR A 64 11.830 10.155 -2.558 1.00 0.19 C ATOM 829 C TYR A 64 12.009 9.307 -3.810 1.00 0.22 C ATOM 830 O TYR A 64 12.798 8.364 -3.811 1.00 0.28 O ATOM 831 CB TYR A 64 11.629 9.289 -1.317 1.00 0.21 C ATOM 832 CG TYR A 64 11.973 10.037 -0.052 1.00 0.24 C ATOM 833 CD1 TYR A 64 13.275 10.054 0.425 1.00 0.30 C ATOM 834 CD2 TYR A 64 11.011 10.756 0.644 1.00 0.27 C ATOM 835 CE1 TYR A 64 13.609 10.759 1.560 1.00 0.35 C ATOM 836 CE2 TYR A 64 11.341 11.473 1.780 1.00 0.33 C ATOM 837 CZ TYR A 64 12.642 11.470 2.232 1.00 0.34 C ATOM 838 OH TYR A 64 12.982 12.182 3.358 1.00 0.43 O ATOM 0 H TYR A 64 9.821 10.757 -2.589 1.00 0.18 H new ATOM 0 HA TYR A 64 12.760 10.713 -2.452 1.00 0.19 H new ATOM 0 HB2 TYR A 64 10.593 8.954 -1.271 1.00 0.21 H new ATOM 0 HB3 TYR A 64 12.250 8.396 -1.392 1.00 0.21 H new ATOM 0 HD1 TYR A 64 14.041 9.505 -0.103 1.00 0.30 H new ATOM 0 HD2 TYR A 64 9.990 10.756 0.293 1.00 0.27 H new ATOM 0 HE1 TYR A 64 14.627 10.754 1.921 1.00 0.35 H new ATOM 0 HE2 TYR A 64 10.583 12.032 2.309 1.00 0.33 H new ATOM 0 HH TYR A 64 12.261 12.113 4.018 1.00 0.43 H new ATOM 848 N LYS A 65 11.313 9.653 -4.890 1.00 0.22 N ATOM 849 CA LYS A 65 11.571 9.024 -6.187 1.00 0.29 C ATOM 850 C LYS A 65 13.014 9.275 -6.615 1.00 0.32 C ATOM 851 O LYS A 65 13.591 8.505 -7.382 1.00 0.39 O ATOM 852 CB LYS A 65 10.608 9.551 -7.255 1.00 0.36 C ATOM 853 CG LYS A 65 9.431 8.629 -7.523 1.00 0.38 C ATOM 854 CD LYS A 65 9.847 7.389 -8.298 1.00 0.92 C ATOM 855 CE LYS A 65 10.213 7.724 -9.732 1.00 1.37 C ATOM 856 NZ LYS A 65 9.025 8.113 -10.542 1.00 2.11 N ATOM 0 H LYS A 65 10.574 10.356 -4.896 1.00 0.22 H new ATOM 0 HA LYS A 65 11.410 7.951 -6.082 1.00 0.29 H new ATOM 0 HB2 LYS A 65 10.232 10.525 -6.943 1.00 0.36 H new ATOM 0 HB3 LYS A 65 11.158 9.704 -8.184 1.00 0.36 H new ATOM 0 HG2 LYS A 65 8.980 8.331 -6.576 1.00 0.38 H new ATOM 0 HG3 LYS A 65 8.668 9.168 -8.084 1.00 0.38 H new ATOM 0 HD2 LYS A 65 10.698 6.919 -7.805 1.00 0.92 H new ATOM 0 HD3 LYS A 65 9.033 6.664 -8.289 1.00 0.92 H new ATOM 0 HE2 LYS A 65 10.937 8.538 -9.739 1.00 1.37 H new ATOM 0 HE3 LYS A 65 10.697 6.863 -10.192 1.00 1.37 H new ATOM 0 HZ1 LYS A 65 9.200 7.893 -11.543 1.00 2.11 H new ATOM 0 HZ2 LYS A 65 8.192 7.585 -10.212 1.00 2.11 H new ATOM 0 HZ3 LYS A 65 8.852 9.133 -10.437 1.00 2.11 H new ATOM 870 N SER A 66 13.584 10.357 -6.097 1.00 0.33 N ATOM 871 CA SER A 66 14.981 10.694 -6.328 1.00 0.43 C ATOM 872 C SER A 66 15.898 9.574 -5.830 1.00 0.50 C ATOM 873 O SER A 66 16.885 9.229 -6.483 1.00 0.61 O ATOM 874 CB SER A 66 15.316 12.011 -5.620 1.00 0.52 C ATOM 875 OG SER A 66 16.638 12.431 -5.901 1.00 1.20 O ATOM 0 H SER A 66 13.089 11.024 -5.505 1.00 0.33 H new ATOM 0 HA SER A 66 15.142 10.811 -7.400 1.00 0.43 H new ATOM 0 HB2 SER A 66 14.614 12.783 -5.935 1.00 0.52 H new ATOM 0 HB3 SER A 66 15.194 11.888 -4.544 1.00 0.52 H new ATOM 0 HG SER A 66 16.819 13.274 -5.436 1.00 1.20 H new ATOM 881 N GLN A 67 15.559 8.996 -4.679 1.00 0.49 N ATOM 882 CA GLN A 67 16.362 7.927 -4.098 1.00 0.61 C ATOM 883 C GLN A 67 15.810 6.553 -4.474 1.00 0.63 C ATOM 884 O GLN A 67 16.186 5.537 -3.888 1.00 0.80 O ATOM 885 CB GLN A 67 16.431 8.086 -2.578 1.00 0.75 C ATOM 886 CG GLN A 67 17.213 9.318 -2.153 1.00 0.97 C ATOM 887 CD GLN A 67 17.224 9.528 -0.655 1.00 1.23 C ATOM 888 OE1 GLN A 67 18.092 9.020 0.053 1.00 1.90 O ATOM 889 NE2 GLN A 67 16.267 10.293 -0.162 1.00 1.36 N ATOM 0 H GLN A 67 14.736 9.251 -4.133 1.00 0.49 H new ATOM 0 HA GLN A 67 17.371 7.999 -4.504 1.00 0.61 H new ATOM 0 HB2 GLN A 67 15.419 8.146 -2.177 1.00 0.75 H new ATOM 0 HB3 GLN A 67 16.894 7.199 -2.144 1.00 0.75 H new ATOM 0 HG2 GLN A 67 18.240 9.230 -2.509 1.00 0.97 H new ATOM 0 HG3 GLN A 67 16.784 10.197 -2.634 1.00 0.97 H new ATOM 0 HE21 GLN A 67 15.565 10.696 -0.783 1.00 1.36 H new ATOM 0 HE22 GLN A 67 16.230 10.481 0.840 1.00 1.36 H new ATOM 898 N GLY A 68 14.925 6.534 -5.465 1.00 0.54 N ATOM 899 CA GLY A 68 14.379 5.285 -5.961 1.00 0.63 C ATOM 900 C GLY A 68 13.281 4.736 -5.075 1.00 0.72 C ATOM 901 O GLY A 68 13.389 3.631 -4.561 1.00 1.32 O ATOM 0 H GLY A 68 14.574 7.368 -5.936 1.00 0.54 H new ATOM 0 HA2 GLY A 68 13.987 5.438 -6.966 1.00 0.63 H new ATOM 0 HA3 GLY A 68 15.179 4.549 -6.040 1.00 0.63 H new ATOM 905 N PHE A 69 12.225 5.510 -4.899 1.00 0.26 N ATOM 906 CA PHE A 69 11.118 5.113 -4.043 1.00 0.24 C ATOM 907 C PHE A 69 9.799 5.131 -4.807 1.00 0.23 C ATOM 908 O PHE A 69 9.552 6.032 -5.600 1.00 0.26 O ATOM 909 CB PHE A 69 11.049 6.065 -2.855 1.00 0.22 C ATOM 910 CG PHE A 69 9.863 5.863 -1.966 1.00 0.19 C ATOM 911 CD1 PHE A 69 9.751 4.729 -1.184 1.00 0.18 C ATOM 912 CD2 PHE A 69 8.860 6.811 -1.914 1.00 0.24 C ATOM 913 CE1 PHE A 69 8.658 4.545 -0.368 1.00 0.19 C ATOM 914 CE2 PHE A 69 7.765 6.633 -1.099 1.00 0.24 C ATOM 915 CZ PHE A 69 7.662 5.498 -0.324 1.00 0.19 C ATOM 0 H PHE A 69 12.109 6.423 -5.340 1.00 0.26 H new ATOM 0 HA PHE A 69 11.286 4.094 -3.695 1.00 0.24 H new ATOM 0 HB2 PHE A 69 11.956 5.951 -2.261 1.00 0.22 H new ATOM 0 HB3 PHE A 69 11.038 7.090 -3.227 1.00 0.22 H new ATOM 0 HD1 PHE A 69 10.529 3.980 -1.213 1.00 0.18 H new ATOM 0 HD2 PHE A 69 8.936 7.702 -2.520 1.00 0.24 H new ATOM 0 HE1 PHE A 69 8.580 3.654 0.238 1.00 0.19 H new ATOM 0 HE2 PHE A 69 6.988 7.382 -1.067 1.00 0.24 H new ATOM 0 HZ PHE A 69 6.804 5.355 0.316 1.00 0.19 H new ATOM 925 N THR A 70 8.957 4.138 -4.573 1.00 0.22 N ATOM 926 CA THR A 70 7.667 4.098 -5.207 1.00 0.22 C ATOM 927 C THR A 70 6.567 3.911 -4.159 1.00 0.21 C ATOM 928 O THR A 70 6.778 3.274 -3.135 1.00 0.25 O ATOM 929 CB THR A 70 7.630 2.970 -6.264 1.00 0.27 C ATOM 930 OG1 THR A 70 7.081 3.451 -7.498 1.00 0.51 O ATOM 931 CG2 THR A 70 6.829 1.770 -5.795 1.00 0.33 C ATOM 0 H THR A 70 9.151 3.355 -3.949 1.00 0.22 H new ATOM 0 HA THR A 70 7.489 5.046 -5.715 1.00 0.22 H new ATOM 0 HB THR A 70 8.661 2.651 -6.417 1.00 0.27 H new ATOM 0 HG1 THR A 70 6.379 2.840 -7.804 1.00 0.51 H new ATOM 0 HG21 THR A 70 6.832 1.005 -6.571 1.00 0.33 H new ATOM 0 HG22 THR A 70 7.276 1.367 -4.886 1.00 0.33 H new ATOM 0 HG23 THR A 70 5.803 2.075 -5.590 1.00 0.33 H new ATOM 939 N VAL A 71 5.427 4.530 -4.378 1.00 0.20 N ATOM 940 CA VAL A 71 4.246 4.246 -3.588 1.00 0.19 C ATOM 941 C VAL A 71 3.180 3.605 -4.461 1.00 0.18 C ATOM 942 O VAL A 71 2.742 4.193 -5.443 1.00 0.24 O ATOM 943 CB VAL A 71 3.687 5.524 -2.942 1.00 0.22 C ATOM 944 CG1 VAL A 71 2.263 5.313 -2.433 1.00 0.23 C ATOM 945 CG2 VAL A 71 4.581 5.986 -1.808 1.00 0.24 C ATOM 0 H VAL A 71 5.292 5.237 -5.100 1.00 0.20 H new ATOM 0 HA VAL A 71 4.530 3.557 -2.792 1.00 0.19 H new ATOM 0 HB VAL A 71 3.663 6.297 -3.710 1.00 0.22 H new ATOM 0 HG11 VAL A 71 1.897 6.236 -1.982 1.00 0.23 H new ATOM 0 HG12 VAL A 71 1.617 5.035 -3.265 1.00 0.23 H new ATOM 0 HG13 VAL A 71 2.257 4.518 -1.688 1.00 0.23 H new ATOM 0 HG21 VAL A 71 4.167 6.892 -1.365 1.00 0.24 H new ATOM 0 HG22 VAL A 71 4.640 5.205 -1.050 1.00 0.24 H new ATOM 0 HG23 VAL A 71 5.579 6.194 -2.193 1.00 0.24 H new ATOM 955 N LEU A 72 2.788 2.396 -4.114 1.00 0.16 N ATOM 956 CA LEU A 72 1.749 1.693 -4.840 1.00 0.17 C ATOM 957 C LEU A 72 0.462 1.747 -4.044 1.00 0.18 C ATOM 958 O LEU A 72 0.426 1.290 -2.916 1.00 0.32 O ATOM 959 CB LEU A 72 2.139 0.226 -5.047 1.00 0.20 C ATOM 960 CG LEU A 72 3.578 -0.016 -5.506 1.00 0.20 C ATOM 961 CD1 LEU A 72 3.833 -1.503 -5.692 1.00 0.48 C ATOM 962 CD2 LEU A 72 3.858 0.732 -6.798 1.00 0.51 C ATOM 0 H LEU A 72 3.177 1.876 -3.327 1.00 0.16 H new ATOM 0 HA LEU A 72 1.617 2.169 -5.812 1.00 0.17 H new ATOM 0 HB2 LEU A 72 1.980 -0.309 -4.111 1.00 0.20 H new ATOM 0 HB3 LEU A 72 1.463 -0.211 -5.783 1.00 0.20 H new ATOM 0 HG LEU A 72 4.252 0.359 -4.736 1.00 0.20 H new ATOM 0 HD11 LEU A 72 4.861 -1.658 -6.019 1.00 0.48 H new ATOM 0 HD12 LEU A 72 3.671 -2.021 -4.747 1.00 0.48 H new ATOM 0 HD13 LEU A 72 3.150 -1.898 -6.444 1.00 0.48 H new ATOM 0 HD21 LEU A 72 4.886 0.548 -7.109 1.00 0.51 H new ATOM 0 HD22 LEU A 72 3.176 0.385 -7.574 1.00 0.51 H new ATOM 0 HD23 LEU A 72 3.713 1.800 -6.639 1.00 0.51 H new ATOM 974 N ALA A 73 -0.592 2.291 -4.615 1.00 0.15 N ATOM 975 CA ALA A 73 -1.867 2.327 -3.920 1.00 0.16 C ATOM 976 C ALA A 73 -2.837 1.351 -4.546 1.00 0.19 C ATOM 977 O ALA A 73 -2.990 1.306 -5.761 1.00 0.28 O ATOM 978 CB ALA A 73 -2.445 3.725 -3.916 1.00 0.17 C ATOM 0 H ALA A 73 -0.596 2.710 -5.545 1.00 0.15 H new ATOM 0 HA ALA A 73 -1.697 2.032 -2.885 1.00 0.16 H new ATOM 0 HB1 ALA A 73 -3.399 3.723 -3.389 1.00 0.17 H new ATOM 0 HB2 ALA A 73 -1.755 4.403 -3.413 1.00 0.17 H new ATOM 0 HB3 ALA A 73 -2.598 4.058 -4.942 1.00 0.17 H new ATOM 984 N PHE A 74 -3.484 0.564 -3.717 1.00 0.20 N ATOM 985 CA PHE A 74 -4.379 -0.465 -4.193 1.00 0.21 C ATOM 986 C PHE A 74 -5.822 -0.134 -3.831 1.00 0.25 C ATOM 987 O PHE A 74 -6.207 -0.150 -2.660 1.00 0.29 O ATOM 988 CB PHE A 74 -3.956 -1.824 -3.616 1.00 0.23 C ATOM 989 CG PHE A 74 -2.724 -2.454 -4.243 1.00 0.22 C ATOM 990 CD1 PHE A 74 -1.526 -1.758 -4.260 1.00 0.24 C ATOM 991 CD2 PHE A 74 -2.760 -3.714 -4.840 1.00 0.32 C ATOM 992 CE1 PHE A 74 -0.400 -2.292 -4.854 1.00 0.26 C ATOM 993 CE2 PHE A 74 -1.634 -4.250 -5.430 1.00 0.34 C ATOM 994 CZ PHE A 74 -0.476 -3.676 -5.344 1.00 0.26 C ATOM 0 H PHE A 74 -3.406 0.618 -2.701 1.00 0.20 H new ATOM 0 HA PHE A 74 -4.319 -0.517 -5.280 1.00 0.21 H new ATOM 0 HB2 PHE A 74 -3.776 -1.704 -2.548 1.00 0.23 H new ATOM 0 HB3 PHE A 74 -4.790 -2.518 -3.722 1.00 0.23 H new ATOM 0 HD1 PHE A 74 -1.472 -0.782 -3.801 1.00 0.24 H new ATOM 0 HD2 PHE A 74 -3.681 -4.277 -4.840 1.00 0.32 H new ATOM 0 HE1 PHE A 74 0.506 -1.713 -4.955 1.00 0.26 H new ATOM 0 HE2 PHE A 74 -1.721 -5.176 -5.980 1.00 0.34 H new ATOM 0 HZ PHE A 74 0.421 -4.206 -5.628 1.00 0.26 H new ATOM 1004 N PRO A 75 -6.604 0.233 -4.864 1.00 0.26 N ATOM 1005 CA PRO A 75 -8.050 0.496 -4.771 1.00 0.32 C ATOM 1006 C PRO A 75 -8.782 -0.598 -4.022 1.00 0.38 C ATOM 1007 O PRO A 75 -8.483 -1.778 -4.201 1.00 0.73 O ATOM 1008 CB PRO A 75 -8.471 0.489 -6.244 1.00 0.37 C ATOM 1009 CG PRO A 75 -7.289 1.024 -6.943 1.00 0.31 C ATOM 1010 CD PRO A 75 -6.115 0.420 -6.236 1.00 0.26 C ATOM 0 HA PRO A 75 -8.277 1.416 -4.232 1.00 0.32 H new ATOM 0 HB2 PRO A 75 -8.718 -0.516 -6.586 1.00 0.37 H new ATOM 0 HB3 PRO A 75 -9.352 1.109 -6.413 1.00 0.37 H new ATOM 0 HG2 PRO A 75 -7.297 0.751 -7.998 1.00 0.31 H new ATOM 0 HG3 PRO A 75 -7.261 2.113 -6.895 1.00 0.31 H new ATOM 0 HD2 PRO A 75 -5.816 -0.526 -6.689 1.00 0.26 H new ATOM 0 HD3 PRO A 75 -5.246 1.077 -6.267 1.00 0.26 H new ATOM 1018 N SER A 76 -9.738 -0.236 -3.184 1.00 0.29 N ATOM 1019 CA SER A 76 -10.431 -1.259 -2.444 1.00 0.30 C ATOM 1020 C SER A 76 -11.928 -1.274 -2.657 1.00 0.44 C ATOM 1021 O SER A 76 -12.544 -0.280 -3.041 1.00 0.57 O ATOM 1022 CB SER A 76 -10.088 -1.191 -0.951 1.00 0.53 C ATOM 1023 OG SER A 76 -8.686 -1.182 -0.763 1.00 1.54 O ATOM 0 H SER A 76 -10.039 0.722 -3.007 1.00 0.29 H new ATOM 0 HA SER A 76 -10.069 -2.204 -2.849 1.00 0.30 H new ATOM 0 HB2 SER A 76 -10.525 -0.294 -0.512 1.00 0.53 H new ATOM 0 HB3 SER A 76 -10.525 -2.045 -0.433 1.00 0.53 H new ATOM 0 HG SER A 76 -8.324 -0.316 -1.043 1.00 1.54 H new ATOM 1298 N CYS A 95 -16.396 3.379 -5.654 1.00 0.75 N ATOM 1299 CA CYS A 95 -14.969 3.329 -5.468 1.00 0.59 C ATOM 1300 C CYS A 95 -14.279 2.748 -6.679 1.00 0.59 C ATOM 1301 O CYS A 95 -14.536 1.617 -7.101 1.00 0.91 O ATOM 1302 CB CYS A 95 -14.588 2.581 -4.193 1.00 0.59 C ATOM 1303 SG CYS A 95 -15.481 3.170 -2.718 1.00 0.88 S ATOM 0 HA CYS A 95 -14.621 4.355 -5.351 1.00 0.59 H new ATOM 0 HB2 CYS A 95 -14.788 1.518 -4.330 1.00 0.59 H new ATOM 0 HB3 CYS A 95 -13.516 2.685 -4.026 1.00 0.59 H new ATOM 1308 N THR A 96 -13.403 3.556 -7.231 1.00 0.66 N ATOM 1309 CA THR A 96 -12.597 3.188 -8.359 1.00 0.69 C ATOM 1310 C THR A 96 -11.205 3.742 -8.127 1.00 0.65 C ATOM 1311 O THR A 96 -11.047 4.668 -7.334 1.00 1.18 O ATOM 1312 CB THR A 96 -13.185 3.730 -9.683 1.00 1.20 C ATOM 1313 OG1 THR A 96 -12.431 3.245 -10.801 1.00 1.81 O ATOM 1314 CG2 THR A 96 -13.197 5.252 -9.696 1.00 1.92 C ATOM 0 H THR A 96 -13.232 4.505 -6.898 1.00 0.66 H new ATOM 0 HA THR A 96 -12.570 2.102 -8.452 1.00 0.69 H new ATOM 0 HB THR A 96 -14.212 3.374 -9.760 1.00 1.20 H new ATOM 0 HG1 THR A 96 -12.816 3.595 -11.632 1.00 1.81 H new ATOM 0 HG21 THR A 96 -13.615 5.605 -10.639 1.00 1.92 H new ATOM 0 HG22 THR A 96 -13.806 5.618 -8.869 1.00 1.92 H new ATOM 0 HG23 THR A 96 -12.178 5.625 -9.589 1.00 1.92 H new ATOM 1322 N LYS A 97 -10.212 3.146 -8.774 1.00 0.67 N ATOM 1323 CA LYS A 97 -8.820 3.556 -8.656 1.00 1.00 C ATOM 1324 C LYS A 97 -8.693 5.075 -8.595 1.00 0.96 C ATOM 1325 O LYS A 97 -8.829 5.771 -9.607 1.00 1.76 O ATOM 1326 CB LYS A 97 -8.042 3.002 -9.851 1.00 1.50 C ATOM 1327 CG LYS A 97 -8.663 3.402 -11.172 1.00 1.65 C ATOM 1328 CD LYS A 97 -8.734 2.242 -12.149 1.00 2.34 C ATOM 1329 CE LYS A 97 -9.304 2.672 -13.491 1.00 2.79 C ATOM 1330 NZ LYS A 97 -9.214 1.587 -14.506 1.00 3.18 N ATOM 0 H LYS A 97 -10.353 2.355 -9.403 1.00 0.67 H new ATOM 0 HA LYS A 97 -8.409 3.159 -7.728 1.00 1.00 H new ATOM 0 HB2 LYS A 97 -7.014 3.361 -9.811 1.00 1.50 H new ATOM 0 HB3 LYS A 97 -8.003 1.915 -9.784 1.00 1.50 H new ATOM 0 HG2 LYS A 97 -9.667 3.789 -10.997 1.00 1.65 H new ATOM 0 HG3 LYS A 97 -8.082 4.212 -11.614 1.00 1.65 H new ATOM 0 HD2 LYS A 97 -7.737 1.826 -12.293 1.00 2.34 H new ATOM 0 HD3 LYS A 97 -9.352 1.449 -11.728 1.00 2.34 H new ATOM 0 HE2 LYS A 97 -10.346 2.966 -13.365 1.00 2.79 H new ATOM 0 HE3 LYS A 97 -8.766 3.550 -13.849 1.00 2.79 H new ATOM 0 HZ1 LYS A 97 -9.866 1.791 -15.291 1.00 3.18 H new ATOM 0 HZ2 LYS A 97 -8.241 1.531 -14.869 1.00 3.18 H new ATOM 0 HZ3 LYS A 97 -9.472 0.680 -14.068 1.00 3.18 H new ATOM 1344 N PHE A 98 -8.494 5.588 -7.393 1.00 0.70 N ATOM 1345 CA PHE A 98 -8.266 7.001 -7.224 1.00 0.66 C ATOM 1346 C PHE A 98 -6.987 7.342 -7.976 1.00 0.83 C ATOM 1347 O PHE A 98 -6.014 6.586 -7.922 1.00 1.74 O ATOM 1348 CB PHE A 98 -8.157 7.365 -5.737 1.00 0.82 C ATOM 1349 CG PHE A 98 -6.780 7.206 -5.191 1.00 0.52 C ATOM 1350 CD1 PHE A 98 -6.359 5.969 -4.750 1.00 0.44 C ATOM 1351 CD2 PHE A 98 -5.928 8.288 -5.075 1.00 0.62 C ATOM 1352 CE1 PHE A 98 -5.116 5.806 -4.198 1.00 0.36 C ATOM 1353 CE2 PHE A 98 -4.668 8.125 -4.528 1.00 0.55 C ATOM 1354 CZ PHE A 98 -4.187 6.942 -4.270 1.00 0.32 C ATOM 0 H PHE A 98 -8.487 5.046 -6.529 1.00 0.70 H new ATOM 0 HA PHE A 98 -9.102 7.577 -7.621 1.00 0.66 H new ATOM 0 HB2 PHE A 98 -8.478 8.397 -5.598 1.00 0.82 H new ATOM 0 HB3 PHE A 98 -8.842 6.738 -5.165 1.00 0.82 H new ATOM 0 HD1 PHE A 98 -7.018 5.118 -4.841 1.00 0.44 H new ATOM 0 HD2 PHE A 98 -6.247 9.263 -5.412 1.00 0.62 H new ATOM 0 HE1 PHE A 98 -4.830 4.877 -3.727 1.00 0.36 H new ATOM 0 HE2 PHE A 98 -4.070 8.997 -4.310 1.00 0.55 H new ATOM 0 HZ PHE A 98 -3.128 6.799 -4.112 1.00 0.32 H new ATOM 1364 N LYS A 99 -6.989 8.424 -8.716 1.00 0.73 N ATOM 1365 CA LYS A 99 -5.818 8.761 -9.496 1.00 0.68 C ATOM 1366 C LYS A 99 -4.930 9.709 -8.731 1.00 0.58 C ATOM 1367 O LYS A 99 -5.418 10.591 -8.034 1.00 0.77 O ATOM 1368 CB LYS A 99 -6.202 9.385 -10.828 1.00 0.87 C ATOM 1369 CG LYS A 99 -5.869 8.519 -12.031 1.00 1.19 C ATOM 1370 CD LYS A 99 -6.561 7.166 -11.964 1.00 1.64 C ATOM 1371 CE LYS A 99 -6.195 6.297 -13.155 1.00 2.13 C ATOM 1372 NZ LYS A 99 -4.737 6.016 -13.208 1.00 3.08 N ATOM 0 H LYS A 99 -7.769 9.076 -8.796 1.00 0.73 H new ATOM 0 HA LYS A 99 -5.276 7.836 -9.691 1.00 0.68 H new ATOM 0 HB2 LYS A 99 -7.272 9.592 -10.826 1.00 0.87 H new ATOM 0 HB3 LYS A 99 -5.692 10.343 -10.930 1.00 0.87 H new ATOM 0 HG2 LYS A 99 -6.168 9.035 -12.944 1.00 1.19 H new ATOM 0 HG3 LYS A 99 -4.790 8.373 -12.086 1.00 1.19 H new ATOM 0 HD2 LYS A 99 -6.281 6.658 -11.041 1.00 1.64 H new ATOM 0 HD3 LYS A 99 -7.641 7.309 -11.934 1.00 1.64 H new ATOM 0 HE2 LYS A 99 -6.744 5.357 -13.101 1.00 2.13 H new ATOM 0 HE3 LYS A 99 -6.503 6.794 -14.075 1.00 2.13 H new ATOM 0 HZ1 LYS A 99 -4.559 5.231 -13.866 1.00 3.08 H new ATOM 0 HZ2 LYS A 99 -4.232 6.864 -13.536 1.00 3.08 H new ATOM 0 HZ3 LYS A 99 -4.399 5.757 -12.259 1.00 3.08 H new ATOM 1386 N ALA A 100 -3.634 9.532 -8.898 1.00 0.43 N ATOM 1387 CA ALA A 100 -2.653 10.292 -8.147 1.00 0.36 C ATOM 1388 C ALA A 100 -1.410 10.569 -8.978 1.00 0.34 C ATOM 1389 O ALA A 100 -1.437 10.475 -10.205 1.00 0.41 O ATOM 1390 CB ALA A 100 -2.273 9.533 -6.894 1.00 0.31 C ATOM 0 H ALA A 100 -3.233 8.862 -9.554 1.00 0.43 H new ATOM 0 HA ALA A 100 -3.098 11.250 -7.879 1.00 0.36 H new ATOM 0 HB1 ALA A 100 -1.536 10.106 -6.331 1.00 0.31 H new ATOM 0 HB2 ALA A 100 -3.160 9.379 -6.279 1.00 0.31 H new ATOM 0 HB3 ALA A 100 -1.849 8.567 -7.168 1.00 0.31 H new ATOM 1396 N GLU A 101 -0.325 10.919 -8.297 1.00 0.32 N ATOM 1397 CA GLU A 101 0.954 11.150 -8.956 1.00 0.34 C ATOM 1398 C GLU A 101 1.807 9.887 -8.899 1.00 0.35 C ATOM 1399 O GLU A 101 2.877 9.811 -9.497 1.00 0.64 O ATOM 1400 CB GLU A 101 1.689 12.312 -8.289 1.00 0.45 C ATOM 1401 CG GLU A 101 0.898 13.609 -8.284 1.00 0.73 C ATOM 1402 CD GLU A 101 0.594 14.113 -9.680 1.00 1.37 C ATOM 1403 OE1 GLU A 101 1.456 14.790 -10.279 1.00 1.63 O ATOM 1404 OE2 GLU A 101 -0.506 13.826 -10.193 1.00 2.19 O ATOM 0 H GLU A 101 -0.306 11.049 -7.286 1.00 0.32 H new ATOM 0 HA GLU A 101 0.771 11.405 -10.000 1.00 0.34 H new ATOM 0 HB2 GLU A 101 1.928 12.038 -7.261 1.00 0.45 H new ATOM 0 HB3 GLU A 101 2.636 12.476 -8.804 1.00 0.45 H new ATOM 0 HG2 GLU A 101 -0.037 13.457 -7.745 1.00 0.73 H new ATOM 0 HG3 GLU A 101 1.459 14.370 -7.741 1.00 0.73 H new ATOM 1411 N PHE A 102 1.300 8.891 -8.192 1.00 0.23 N ATOM 1412 CA PHE A 102 1.999 7.644 -7.991 1.00 0.19 C ATOM 1413 C PHE A 102 1.166 6.505 -8.591 1.00 0.18 C ATOM 1414 O PHE A 102 0.038 6.738 -9.029 1.00 0.22 O ATOM 1415 CB PHE A 102 2.286 7.438 -6.494 1.00 0.20 C ATOM 1416 CG PHE A 102 1.099 7.483 -5.583 1.00 0.16 C ATOM 1417 CD1 PHE A 102 0.623 8.689 -5.109 1.00 0.20 C ATOM 1418 CD2 PHE A 102 0.433 6.321 -5.238 1.00 0.18 C ATOM 1419 CE1 PHE A 102 -0.490 8.736 -4.301 1.00 0.24 C ATOM 1420 CE2 PHE A 102 -0.685 6.362 -4.433 1.00 0.22 C ATOM 1421 CZ PHE A 102 -1.049 7.559 -3.834 1.00 0.22 C ATOM 0 H PHE A 102 0.386 8.930 -7.741 1.00 0.23 H new ATOM 0 HA PHE A 102 2.963 7.659 -8.499 1.00 0.19 H new ATOM 0 HB2 PHE A 102 2.778 6.474 -6.369 1.00 0.20 H new ATOM 0 HB3 PHE A 102 2.994 8.201 -6.172 1.00 0.20 H new ATOM 0 HD1 PHE A 102 1.129 9.605 -5.375 1.00 0.20 H new ATOM 0 HD2 PHE A 102 0.793 5.371 -5.604 1.00 0.18 H new ATOM 0 HE1 PHE A 102 -0.925 9.687 -4.032 1.00 0.24 H new ATOM 0 HE2 PHE A 102 -1.272 5.470 -4.270 1.00 0.22 H new ATOM 0 HZ PHE A 102 -1.756 7.572 -3.018 1.00 0.22 H new ATOM 1431 N PRO A 103 1.720 5.288 -8.680 1.00 0.18 N ATOM 1432 CA PRO A 103 1.027 4.113 -9.252 1.00 0.21 C ATOM 1433 C PRO A 103 -0.102 3.581 -8.360 1.00 0.19 C ATOM 1434 O PRO A 103 0.103 3.285 -7.181 1.00 0.27 O ATOM 1435 CB PRO A 103 2.157 3.080 -9.379 1.00 0.27 C ATOM 1436 CG PRO A 103 3.411 3.875 -9.262 1.00 0.31 C ATOM 1437 CD PRO A 103 3.086 4.941 -8.278 1.00 0.21 C ATOM 0 HA PRO A 103 0.530 4.352 -10.192 1.00 0.21 H new ATOM 0 HB2 PRO A 103 2.093 2.324 -8.596 1.00 0.27 H new ATOM 0 HB3 PRO A 103 2.108 2.555 -10.333 1.00 0.27 H new ATOM 0 HG2 PRO A 103 4.241 3.258 -8.919 1.00 0.31 H new ATOM 0 HG3 PRO A 103 3.704 4.298 -10.223 1.00 0.31 H new ATOM 0 HD2 PRO A 103 3.134 4.582 -7.250 1.00 0.21 H new ATOM 0 HD3 PRO A 103 3.765 5.790 -8.351 1.00 0.21 H new ATOM 1445 N ILE A 104 -1.294 3.467 -8.939 1.00 0.24 N ATOM 1446 CA ILE A 104 -2.454 2.894 -8.256 1.00 0.24 C ATOM 1447 C ILE A 104 -2.961 1.674 -9.048 1.00 0.26 C ATOM 1448 O ILE A 104 -2.978 1.693 -10.280 1.00 0.36 O ATOM 1449 CB ILE A 104 -3.584 3.943 -8.067 1.00 0.27 C ATOM 1450 CG1 ILE A 104 -3.223 4.962 -6.974 1.00 0.25 C ATOM 1451 CG2 ILE A 104 -4.910 3.282 -7.737 1.00 0.37 C ATOM 1452 CD1 ILE A 104 -2.378 6.107 -7.467 1.00 0.31 C ATOM 0 H ILE A 104 -1.485 3.769 -9.895 1.00 0.24 H new ATOM 0 HA ILE A 104 -2.148 2.575 -7.260 1.00 0.24 H new ATOM 0 HB ILE A 104 -3.688 4.470 -9.016 1.00 0.27 H new ATOM 0 HG12 ILE A 104 -4.142 5.360 -6.543 1.00 0.25 H new ATOM 0 HG13 ILE A 104 -2.691 4.449 -6.173 1.00 0.25 H new ATOM 0 HG21 ILE A 104 -5.677 4.047 -7.612 1.00 0.37 H new ATOM 0 HG22 ILE A 104 -5.195 2.612 -8.549 1.00 0.37 H new ATOM 0 HG23 ILE A 104 -4.812 2.712 -6.813 1.00 0.37 H new ATOM 0 HD11 ILE A 104 -2.164 6.784 -6.640 1.00 0.31 H new ATOM 0 HD12 ILE A 104 -1.442 5.721 -7.871 1.00 0.31 H new ATOM 0 HD13 ILE A 104 -2.915 6.646 -8.247 1.00 0.31 H new ATOM 1464 N MET A 105 -3.368 0.625 -8.333 1.00 0.23 N ATOM 1465 CA MET A 105 -3.527 -0.708 -8.926 1.00 0.27 C ATOM 1466 C MET A 105 -4.982 -1.168 -9.024 1.00 0.26 C ATOM 1467 O MET A 105 -5.899 -0.363 -9.174 1.00 0.28 O ATOM 1468 CB MET A 105 -2.745 -1.714 -8.085 1.00 0.34 C ATOM 1469 CG MET A 105 -1.405 -1.177 -7.645 1.00 0.53 C ATOM 1470 SD MET A 105 -0.395 -0.640 -9.022 1.00 0.74 S ATOM 1471 CE MET A 105 0.791 0.334 -8.126 1.00 1.47 C ATOM 0 H MET A 105 -3.595 0.670 -7.340 1.00 0.23 H new ATOM 0 HA MET A 105 -3.148 -0.649 -9.946 1.00 0.27 H new ATOM 0 HB2 MET A 105 -3.332 -1.983 -7.207 1.00 0.34 H new ATOM 0 HB3 MET A 105 -2.596 -2.627 -8.661 1.00 0.34 H new ATOM 0 HG2 MET A 105 -1.559 -0.340 -6.963 1.00 0.53 H new ATOM 0 HG3 MET A 105 -0.873 -1.948 -7.088 1.00 0.53 H new ATOM 0 HE1 MET A 105 1.368 0.939 -8.826 1.00 1.47 H new ATOM 0 HE2 MET A 105 0.271 0.987 -7.425 1.00 1.47 H new ATOM 0 HE3 MET A 105 1.463 -0.326 -7.577 1.00 1.47 H new ATOM 1481 N ALA A 106 -5.166 -2.487 -8.971 1.00 0.29 N ATOM 1482 CA ALA A 106 -6.480 -3.108 -9.057 1.00 0.32 C ATOM 1483 C ALA A 106 -7.276 -2.916 -7.768 1.00 0.32 C ATOM 1484 O ALA A 106 -6.712 -2.585 -6.726 1.00 0.39 O ATOM 1485 CB ALA A 106 -6.334 -4.592 -9.341 1.00 0.36 C ATOM 0 H ALA A 106 -4.402 -3.155 -8.867 1.00 0.29 H new ATOM 0 HA ALA A 106 -7.022 -2.625 -9.870 1.00 0.32 H new ATOM 0 HB1 ALA A 106 -7.321 -5.049 -9.404 1.00 0.36 H new ATOM 0 HB2 ALA A 106 -5.809 -4.732 -10.286 1.00 0.36 H new ATOM 0 HB3 ALA A 106 -5.767 -5.062 -8.538 1.00 0.36 H new ATOM 1491 N LYS A 107 -8.585 -3.138 -7.843 1.00 0.39 N ATOM 1492 CA LYS A 107 -9.440 -3.074 -6.667 1.00 0.42 C ATOM 1493 C LYS A 107 -9.476 -4.427 -5.982 1.00 0.35 C ATOM 1494 O LYS A 107 -10.016 -5.392 -6.527 1.00 0.43 O ATOM 1495 CB LYS A 107 -10.870 -2.687 -7.037 1.00 0.59 C ATOM 1496 CG LYS A 107 -10.995 -1.477 -7.941 1.00 0.59 C ATOM 1497 CD LYS A 107 -12.457 -1.173 -8.208 1.00 0.89 C ATOM 1498 CE LYS A 107 -12.632 -0.083 -9.245 1.00 1.15 C ATOM 1499 NZ LYS A 107 -14.070 0.226 -9.473 1.00 1.66 N ATOM 0 H LYS A 107 -9.075 -3.364 -8.708 1.00 0.39 H new ATOM 0 HA LYS A 107 -9.026 -2.316 -6.002 1.00 0.42 H new ATOM 0 HB2 LYS A 107 -11.345 -3.537 -7.526 1.00 0.59 H new ATOM 0 HB3 LYS A 107 -11.427 -2.495 -6.120 1.00 0.59 H new ATOM 0 HG2 LYS A 107 -10.516 -0.615 -7.476 1.00 0.59 H new ATOM 0 HG3 LYS A 107 -10.476 -1.661 -8.882 1.00 0.59 H new ATOM 0 HD2 LYS A 107 -12.959 -2.079 -8.547 1.00 0.89 H new ATOM 0 HD3 LYS A 107 -12.939 -0.870 -7.279 1.00 0.89 H new ATOM 0 HE2 LYS A 107 -12.112 0.818 -8.919 1.00 1.15 H new ATOM 0 HE3 LYS A 107 -12.172 -0.394 -10.183 1.00 1.15 H new ATOM 0 HZ1 LYS A 107 -14.161 0.888 -10.270 1.00 1.66 H new ATOM 0 HZ2 LYS A 107 -14.583 -0.652 -9.692 1.00 1.66 H new ATOM 0 HZ3 LYS A 107 -14.472 0.658 -8.617 1.00 1.66 H new ATOM 1513 N ILE A 108 -8.907 -4.490 -4.799 1.00 0.33 N ATOM 1514 CA ILE A 108 -8.904 -5.696 -4.008 1.00 0.32 C ATOM 1515 C ILE A 108 -9.556 -5.415 -2.666 1.00 0.35 C ATOM 1516 O ILE A 108 -9.739 -4.259 -2.286 1.00 0.43 O ATOM 1517 CB ILE A 108 -7.465 -6.200 -3.790 1.00 0.35 C ATOM 1518 CG1 ILE A 108 -6.603 -5.075 -3.214 1.00 0.46 C ATOM 1519 CG2 ILE A 108 -6.882 -6.720 -5.098 1.00 0.47 C ATOM 1520 CD1 ILE A 108 -5.156 -5.451 -3.022 1.00 0.45 C ATOM 0 H ILE A 108 -8.432 -3.702 -4.359 1.00 0.33 H new ATOM 0 HA ILE A 108 -9.463 -6.467 -4.538 1.00 0.32 H new ATOM 0 HB ILE A 108 -7.479 -7.025 -3.077 1.00 0.35 H new ATOM 0 HG12 ILE A 108 -6.659 -4.212 -3.877 1.00 0.46 H new ATOM 0 HG13 ILE A 108 -7.019 -4.767 -2.255 1.00 0.46 H new ATOM 0 HG21 ILE A 108 -5.865 -7.073 -4.928 1.00 0.47 H new ATOM 0 HG22 ILE A 108 -7.494 -7.543 -5.468 1.00 0.47 H new ATOM 0 HG23 ILE A 108 -6.869 -5.917 -5.835 1.00 0.47 H new ATOM 0 HD11 ILE A 108 -4.611 -4.602 -2.611 1.00 0.45 H new ATOM 0 HD12 ILE A 108 -5.087 -6.294 -2.334 1.00 0.45 H new ATOM 0 HD13 ILE A 108 -4.722 -5.730 -3.982 1.00 0.45 H new ATOM 1532 N ASN A 109 -9.924 -6.457 -1.960 1.00 0.39 N ATOM 1533 CA ASN A 109 -10.510 -6.295 -0.643 1.00 0.48 C ATOM 1534 C ASN A 109 -9.423 -6.462 0.395 1.00 0.48 C ATOM 1535 O ASN A 109 -9.274 -7.541 0.958 1.00 0.92 O ATOM 1536 CB ASN A 109 -11.616 -7.330 -0.402 1.00 0.68 C ATOM 1537 CG ASN A 109 -12.402 -7.084 0.878 1.00 1.12 C ATOM 1538 OD1 ASN A 109 -11.915 -6.476 1.828 1.00 2.16 O ATOM 1539 ND2 ASN A 109 -13.624 -7.585 0.926 1.00 1.05 N ATOM 0 H ASN A 109 -9.830 -7.424 -2.270 1.00 0.39 H new ATOM 0 HA ASN A 109 -10.955 -5.302 -0.572 1.00 0.48 H new ATOM 0 HB2 ASN A 109 -12.302 -7.322 -1.249 1.00 0.68 H new ATOM 0 HB3 ASN A 109 -11.171 -8.324 -0.362 1.00 0.68 H new ATOM 0 HD21 ASN A 109 -14.189 -7.471 1.768 1.00 1.05 H new ATOM 0 HD22 ASN A 109 -14.002 -8.085 0.121 1.00 1.05 H new ATOM 1546 N VAL A 110 -8.635 -5.415 0.624 1.00 0.28 N ATOM 1547 CA VAL A 110 -7.572 -5.504 1.611 1.00 0.26 C ATOM 1548 C VAL A 110 -8.157 -5.671 3.001 1.00 0.30 C ATOM 1549 O VAL A 110 -8.389 -4.697 3.683 1.00 0.38 O ATOM 1550 CB VAL A 110 -6.742 -4.207 1.622 1.00 0.28 C ATOM 1551 CG1 VAL A 110 -5.701 -4.239 0.544 1.00 0.29 C ATOM 1552 CG2 VAL A 110 -7.631 -2.989 1.436 1.00 0.36 C ATOM 0 H VAL A 110 -8.711 -4.515 0.150 1.00 0.28 H new ATOM 0 HA VAL A 110 -6.949 -6.359 1.348 1.00 0.26 H new ATOM 0 HB VAL A 110 -6.251 -4.136 2.592 1.00 0.28 H new ATOM 0 HG11 VAL A 110 -5.125 -3.314 0.567 1.00 0.29 H new ATOM 0 HG12 VAL A 110 -5.035 -5.086 0.707 1.00 0.29 H new ATOM 0 HG13 VAL A 110 -6.186 -4.340 -0.427 1.00 0.29 H new ATOM 0 HG21 VAL A 110 -7.019 -2.087 1.448 1.00 0.36 H new ATOM 0 HG22 VAL A 110 -8.152 -3.061 0.482 1.00 0.36 H new ATOM 0 HG23 VAL A 110 -8.360 -2.944 2.245 1.00 0.36 H new ATOM 1562 N ASN A 111 -8.339 -6.903 3.436 1.00 0.33 N ATOM 1563 CA ASN A 111 -8.741 -7.178 4.805 1.00 0.44 C ATOM 1564 C ASN A 111 -9.009 -8.657 4.980 1.00 0.48 C ATOM 1565 O ASN A 111 -9.048 -9.404 4.000 1.00 0.54 O ATOM 1566 CB ASN A 111 -9.999 -6.407 5.201 1.00 0.54 C ATOM 1567 CG ASN A 111 -9.784 -5.523 6.411 1.00 1.15 C ATOM 1568 OD1 ASN A 111 -9.450 -4.354 6.287 1.00 1.98 O ATOM 1569 ND2 ASN A 111 -9.985 -6.076 7.595 1.00 1.31 N ATOM 0 H ASN A 111 -8.214 -7.735 2.859 1.00 0.33 H new ATOM 0 HA ASN A 111 -7.921 -6.857 5.448 1.00 0.44 H new ATOM 0 HB2 ASN A 111 -10.324 -5.793 4.361 1.00 0.54 H new ATOM 0 HB3 ASN A 111 -10.803 -7.113 5.410 1.00 0.54 H new ATOM 0 HD21 ASN A 111 -9.862 -5.523 8.443 1.00 1.31 H new ATOM 0 HD22 ASN A 111 -10.263 -7.055 7.660 1.00 1.31 H new ATOM 1576 N GLY A 112 -9.230 -9.056 6.223 1.00 0.61 N ATOM 1577 CA GLY A 112 -9.886 -10.315 6.505 1.00 0.67 C ATOM 1578 C GLY A 112 -9.297 -11.512 5.797 1.00 0.71 C ATOM 1579 O GLY A 112 -8.083 -11.717 5.777 1.00 0.78 O ATOM 0 H GLY A 112 -8.963 -8.523 7.051 1.00 0.61 H new ATOM 0 HA2 GLY A 112 -9.851 -10.493 7.580 1.00 0.67 H new ATOM 0 HA3 GLY A 112 -10.937 -10.230 6.230 1.00 0.67 H new ATOM 1583 N GLU A 113 -10.191 -12.301 5.233 1.00 0.73 N ATOM 1584 CA GLU A 113 -9.836 -13.509 4.503 1.00 0.81 C ATOM 1585 C GLU A 113 -9.991 -13.276 3.002 1.00 0.73 C ATOM 1586 O GLU A 113 -9.833 -14.186 2.189 1.00 0.81 O ATOM 1587 CB GLU A 113 -10.729 -14.661 4.967 1.00 0.98 C ATOM 1588 CG GLU A 113 -12.212 -14.318 4.957 1.00 1.18 C ATOM 1589 CD GLU A 113 -13.071 -15.426 5.522 1.00 1.49 C ATOM 1590 OE1 GLU A 113 -13.073 -15.612 6.755 1.00 1.67 O ATOM 1591 OE2 GLU A 113 -13.754 -16.118 4.735 1.00 1.98 O ATOM 0 H GLU A 113 -11.195 -12.122 5.267 1.00 0.73 H new ATOM 0 HA GLU A 113 -8.796 -13.766 4.702 1.00 0.81 H new ATOM 0 HB2 GLU A 113 -10.559 -15.524 4.324 1.00 0.98 H new ATOM 0 HB3 GLU A 113 -10.438 -14.953 5.976 1.00 0.98 H new ATOM 0 HG2 GLU A 113 -12.374 -13.408 5.534 1.00 1.18 H new ATOM 0 HG3 GLU A 113 -12.525 -14.107 3.934 1.00 1.18 H new ATOM 1598 N ASN A 114 -10.324 -12.042 2.660 1.00 0.63 N ATOM 1599 CA ASN A 114 -10.741 -11.690 1.307 1.00 0.60 C ATOM 1600 C ASN A 114 -9.638 -10.909 0.578 1.00 0.48 C ATOM 1601 O ASN A 114 -9.738 -10.619 -0.614 1.00 0.53 O ATOM 1602 CB ASN A 114 -12.027 -10.861 1.423 1.00 0.67 C ATOM 1603 CG ASN A 114 -12.819 -10.730 0.126 1.00 1.15 C ATOM 1604 OD1 ASN A 114 -12.272 -10.737 -0.974 1.00 2.04 O ATOM 1605 ND2 ASN A 114 -14.129 -10.611 0.253 1.00 1.62 N ATOM 0 H ASN A 114 -10.314 -11.255 3.309 1.00 0.63 H new ATOM 0 HA ASN A 114 -10.926 -12.589 0.719 1.00 0.60 H new ATOM 0 HB2 ASN A 114 -12.668 -11.313 2.180 1.00 0.67 H new ATOM 0 HB3 ASN A 114 -11.769 -9.863 1.778 1.00 0.67 H new ATOM 0 HD21 ASN A 114 -14.716 -10.522 -0.577 1.00 1.62 H new ATOM 0 HD22 ASN A 114 -14.553 -10.609 1.181 1.00 1.62 H new ATOM 1612 N ALA A 115 -8.576 -10.590 1.304 1.00 0.43 N ATOM 1613 CA ALA A 115 -7.482 -9.785 0.766 1.00 0.37 C ATOM 1614 C ALA A 115 -6.771 -10.474 -0.395 1.00 0.33 C ATOM 1615 O ALA A 115 -6.698 -11.701 -0.454 1.00 0.37 O ATOM 1616 CB ALA A 115 -6.485 -9.464 1.870 1.00 0.48 C ATOM 0 H ALA A 115 -8.446 -10.877 2.274 1.00 0.43 H new ATOM 0 HA ALA A 115 -7.916 -8.863 0.378 1.00 0.37 H new ATOM 0 HB1 ALA A 115 -5.672 -8.864 1.462 1.00 0.48 H new ATOM 0 HB2 ALA A 115 -6.986 -8.907 2.662 1.00 0.48 H new ATOM 0 HB3 ALA A 115 -6.082 -10.391 2.278 1.00 0.48 H new ATOM 1622 N HIS A 116 -6.287 -9.665 -1.343 1.00 0.29 N ATOM 1623 CA HIS A 116 -5.373 -10.148 -2.378 1.00 0.26 C ATOM 1624 C HIS A 116 -4.227 -10.914 -1.725 1.00 0.23 C ATOM 1625 O HIS A 116 -3.676 -10.456 -0.732 1.00 0.23 O ATOM 1626 CB HIS A 116 -4.793 -8.953 -3.142 1.00 0.27 C ATOM 1627 CG HIS A 116 -4.044 -9.313 -4.393 1.00 0.30 C ATOM 1628 ND1 HIS A 116 -2.670 -9.348 -4.459 1.00 0.41 N ATOM 1629 CD2 HIS A 116 -4.484 -9.648 -5.630 1.00 0.28 C ATOM 1630 CE1 HIS A 116 -2.297 -9.695 -5.675 1.00 0.42 C ATOM 1631 NE2 HIS A 116 -3.373 -9.884 -6.407 1.00 0.34 N ATOM 0 H HIS A 116 -6.514 -8.673 -1.413 1.00 0.29 H new ATOM 0 HA HIS A 116 -5.915 -10.801 -3.062 1.00 0.26 H new ATOM 0 HB2 HIS A 116 -5.607 -8.277 -3.404 1.00 0.27 H new ATOM 0 HB3 HIS A 116 -4.124 -8.405 -2.479 1.00 0.27 H new ATOM 0 HD2 HIS A 116 -5.514 -9.717 -5.947 1.00 0.28 H new ATOM 0 HE1 HIS A 116 -1.277 -9.806 -6.014 1.00 0.42 H new ATOM 0 HE2 HIS A 116 -3.383 -10.160 -7.389 1.00 0.34 H new ATOM 1640 N PRO A 117 -3.850 -12.080 -2.289 1.00 0.26 N ATOM 1641 CA PRO A 117 -2.777 -12.937 -1.755 1.00 0.26 C ATOM 1642 C PRO A 117 -1.484 -12.176 -1.452 1.00 0.21 C ATOM 1643 O PRO A 117 -0.748 -12.532 -0.539 1.00 0.23 O ATOM 1644 CB PRO A 117 -2.538 -13.969 -2.868 1.00 0.35 C ATOM 1645 CG PRO A 117 -3.340 -13.503 -4.039 1.00 0.36 C ATOM 1646 CD PRO A 117 -4.460 -12.685 -3.476 1.00 0.32 C ATOM 0 HA PRO A 117 -3.069 -13.374 -0.800 1.00 0.26 H new ATOM 0 HB2 PRO A 117 -1.480 -14.033 -3.120 1.00 0.35 H new ATOM 0 HB3 PRO A 117 -2.851 -14.964 -2.552 1.00 0.35 H new ATOM 0 HG2 PRO A 117 -2.728 -12.910 -4.719 1.00 0.36 H new ATOM 0 HG3 PRO A 117 -3.724 -14.349 -4.610 1.00 0.36 H new ATOM 0 HD2 PRO A 117 -4.806 -11.931 -4.183 1.00 0.32 H new ATOM 0 HD3 PRO A 117 -5.322 -13.301 -3.219 1.00 0.32 H new ATOM 1654 N LEU A 118 -1.203 -11.138 -2.232 1.00 0.21 N ATOM 1655 CA LEU A 118 -0.048 -10.277 -1.974 1.00 0.19 C ATOM 1656 C LEU A 118 -0.224 -9.505 -0.663 1.00 0.18 C ATOM 1657 O LEU A 118 0.722 -9.342 0.106 1.00 0.18 O ATOM 1658 CB LEU A 118 0.161 -9.313 -3.142 1.00 0.23 C ATOM 1659 CG LEU A 118 1.123 -8.162 -2.871 1.00 0.28 C ATOM 1660 CD1 LEU A 118 2.546 -8.674 -2.766 1.00 1.10 C ATOM 1661 CD2 LEU A 118 1.009 -7.106 -3.953 1.00 1.05 C ATOM 0 H LEU A 118 -1.756 -10.870 -3.047 1.00 0.21 H new ATOM 0 HA LEU A 118 0.836 -10.907 -1.877 1.00 0.19 H new ATOM 0 HB2 LEU A 118 0.529 -9.879 -3.998 1.00 0.23 H new ATOM 0 HB3 LEU A 118 -0.806 -8.898 -3.427 1.00 0.23 H new ATOM 0 HG LEU A 118 0.854 -7.703 -1.920 1.00 0.28 H new ATOM 0 HD11 LEU A 118 3.220 -7.839 -2.572 1.00 1.10 H new ATOM 0 HD12 LEU A 118 2.615 -9.393 -1.949 1.00 1.10 H new ATOM 0 HD13 LEU A 118 2.828 -9.159 -3.701 1.00 1.10 H new ATOM 0 HD21 LEU A 118 1.703 -6.293 -3.742 1.00 1.05 H new ATOM 0 HD22 LEU A 118 1.251 -7.548 -4.920 1.00 1.05 H new ATOM 0 HD23 LEU A 118 -0.009 -6.717 -3.976 1.00 1.05 H new ATOM 1673 N TYR A 119 -1.443 -9.045 -0.407 1.00 0.19 N ATOM 1674 CA TYR A 119 -1.765 -8.388 0.854 1.00 0.20 C ATOM 1675 C TYR A 119 -1.852 -9.398 1.959 1.00 0.20 C ATOM 1676 O TYR A 119 -1.529 -9.094 3.097 1.00 0.21 O ATOM 1677 CB TYR A 119 -3.046 -7.583 0.751 1.00 0.24 C ATOM 1678 CG TYR A 119 -2.761 -6.136 0.467 1.00 0.35 C ATOM 1679 CD1 TYR A 119 -2.567 -5.224 1.493 1.00 0.69 C ATOM 1680 CD2 TYR A 119 -2.715 -5.678 -0.837 1.00 0.44 C ATOM 1681 CE1 TYR A 119 -2.325 -3.891 1.222 1.00 1.06 C ATOM 1682 CE2 TYR A 119 -2.479 -4.354 -1.114 1.00 0.79 C ATOM 1683 CZ TYR A 119 -2.186 -3.471 -0.032 1.00 1.10 C ATOM 1684 OH TYR A 119 -2.042 -2.141 -0.372 1.00 1.49 O ATOM 0 H TYR A 119 -2.226 -9.115 -1.057 1.00 0.19 H new ATOM 0 HA TYR A 119 -0.961 -7.689 1.085 1.00 0.20 H new ATOM 0 HB2 TYR A 119 -3.674 -7.994 -0.040 1.00 0.24 H new ATOM 0 HB3 TYR A 119 -3.608 -7.669 1.681 1.00 0.24 H new ATOM 0 HD1 TYR A 119 -2.606 -5.560 2.519 1.00 0.69 H new ATOM 0 HD2 TYR A 119 -2.867 -6.372 -1.650 1.00 0.44 H new ATOM 0 HE1 TYR A 119 -2.248 -3.184 2.035 1.00 1.06 H new ATOM 0 HE2 TYR A 119 -2.514 -3.989 -2.130 1.00 0.79 H new ATOM 0 HH TYR A 119 -1.907 -2.063 -1.340 1.00 1.49 H new ATOM 1694 N GLU A 120 -2.265 -10.603 1.620 1.00 0.21 N ATOM 1695 CA GLU A 120 -2.146 -11.703 2.547 1.00 0.22 C ATOM 1696 C GLU A 120 -0.697 -11.841 2.969 1.00 0.21 C ATOM 1697 O GLU A 120 -0.422 -11.978 4.146 1.00 0.26 O ATOM 1698 CB GLU A 120 -2.658 -13.008 1.936 1.00 0.28 C ATOM 1699 CG GLU A 120 -4.167 -13.149 1.988 1.00 0.40 C ATOM 1700 CD GLU A 120 -4.684 -13.093 3.411 1.00 1.38 C ATOM 1701 OE1 GLU A 120 -4.502 -14.080 4.153 1.00 1.57 O ATOM 1702 OE2 GLU A 120 -5.300 -12.068 3.786 1.00 2.37 O ATOM 0 H GLU A 120 -2.681 -10.841 0.720 1.00 0.21 H new ATOM 0 HA GLU A 120 -2.763 -11.494 3.421 1.00 0.22 H new ATOM 0 HB2 GLU A 120 -2.331 -13.067 0.898 1.00 0.28 H new ATOM 0 HB3 GLU A 120 -2.204 -13.848 2.461 1.00 0.28 H new ATOM 0 HG2 GLU A 120 -4.628 -12.354 1.401 1.00 0.40 H new ATOM 0 HG3 GLU A 120 -4.461 -14.094 1.531 1.00 0.40 H new ATOM 1709 N TYR A 121 0.225 -11.723 2.013 1.00 0.19 N ATOM 1710 CA TYR A 121 1.650 -11.870 2.318 1.00 0.18 C ATOM 1711 C TYR A 121 2.143 -10.760 3.238 1.00 0.17 C ATOM 1712 O TYR A 121 2.750 -11.020 4.273 1.00 0.21 O ATOM 1713 CB TYR A 121 2.511 -11.904 1.049 1.00 0.20 C ATOM 1714 CG TYR A 121 4.001 -12.005 1.338 1.00 0.26 C ATOM 1715 CD1 TYR A 121 4.597 -13.230 1.621 1.00 0.40 C ATOM 1716 CD2 TYR A 121 4.810 -10.875 1.318 1.00 0.32 C ATOM 1717 CE1 TYR A 121 5.954 -13.322 1.874 1.00 0.48 C ATOM 1718 CE2 TYR A 121 6.168 -10.963 1.567 1.00 0.41 C ATOM 1719 CZ TYR A 121 6.724 -12.192 1.892 1.00 0.47 C ATOM 1720 OH TYR A 121 8.089 -12.279 2.081 1.00 0.58 O ATOM 0 H TYR A 121 0.016 -11.529 1.034 1.00 0.19 H new ATOM 0 HA TYR A 121 1.754 -12.827 2.830 1.00 0.18 H new ATOM 0 HB2 TYR A 121 2.208 -12.752 0.435 1.00 0.20 H new ATOM 0 HB3 TYR A 121 2.321 -11.004 0.465 1.00 0.20 H new ATOM 0 HD1 TYR A 121 3.991 -14.123 1.644 1.00 0.40 H new ATOM 0 HD2 TYR A 121 4.371 -9.912 1.104 1.00 0.32 H new ATOM 0 HE1 TYR A 121 6.405 -14.286 2.057 1.00 0.48 H new ATOM 0 HE2 TYR A 121 6.790 -10.082 1.509 1.00 0.41 H new ATOM 0 HH TYR A 121 8.479 -11.380 2.064 1.00 0.58 H new ATOM 1730 N MET A 122 1.893 -9.525 2.863 1.00 0.16 N ATOM 1731 CA MET A 122 2.366 -8.393 3.645 1.00 0.18 C ATOM 1732 C MET A 122 1.708 -8.371 5.024 1.00 0.18 C ATOM 1733 O MET A 122 2.378 -8.255 6.061 1.00 0.21 O ATOM 1734 CB MET A 122 2.053 -7.093 2.916 1.00 0.20 C ATOM 1735 CG MET A 122 2.599 -7.023 1.507 1.00 0.22 C ATOM 1736 SD MET A 122 2.102 -5.510 0.667 1.00 0.34 S ATOM 1737 CE MET A 122 2.791 -5.795 -0.955 1.00 0.28 C ATOM 0 H MET A 122 1.367 -9.275 2.026 1.00 0.16 H new ATOM 0 HA MET A 122 3.444 -8.494 3.773 1.00 0.18 H new ATOM 0 HB2 MET A 122 0.972 -6.961 2.881 1.00 0.20 H new ATOM 0 HB3 MET A 122 2.458 -6.261 3.492 1.00 0.20 H new ATOM 0 HG2 MET A 122 3.687 -7.081 1.536 1.00 0.22 H new ATOM 0 HG3 MET A 122 2.249 -7.885 0.939 1.00 0.22 H new ATOM 0 HE1 MET A 122 2.141 -5.351 -1.709 1.00 0.28 H new ATOM 0 HE2 MET A 122 3.780 -5.341 -1.015 1.00 0.28 H new ATOM 0 HE3 MET A 122 2.873 -6.867 -1.132 1.00 0.28 H new ATOM 1747 N LYS A 123 0.392 -8.502 5.013 1.00 0.18 N ATOM 1748 CA LYS A 123 -0.427 -8.399 6.209 1.00 0.22 C ATOM 1749 C LYS A 123 -0.237 -9.604 7.145 1.00 0.23 C ATOM 1750 O LYS A 123 -0.421 -9.483 8.352 1.00 0.31 O ATOM 1751 CB LYS A 123 -1.886 -8.167 5.767 1.00 0.32 C ATOM 1752 CG LYS A 123 -2.976 -8.724 6.655 1.00 0.60 C ATOM 1753 CD LYS A 123 -3.446 -10.090 6.173 1.00 0.78 C ATOM 1754 CE LYS A 123 -4.729 -10.511 6.879 1.00 0.74 C ATOM 1755 NZ LYS A 123 -5.267 -11.796 6.360 1.00 0.94 N ATOM 0 H LYS A 123 -0.143 -8.685 4.164 1.00 0.18 H new ATOM 0 HA LYS A 123 -0.114 -7.548 6.814 1.00 0.22 H new ATOM 0 HB2 LYS A 123 -2.043 -7.093 5.673 1.00 0.32 H new ATOM 0 HB3 LYS A 123 -2.009 -8.595 4.772 1.00 0.32 H new ATOM 0 HG2 LYS A 123 -2.608 -8.805 7.678 1.00 0.60 H new ATOM 0 HG3 LYS A 123 -3.819 -8.034 6.674 1.00 0.60 H new ATOM 0 HD2 LYS A 123 -3.613 -10.061 5.096 1.00 0.78 H new ATOM 0 HD3 LYS A 123 -2.667 -10.831 6.355 1.00 0.78 H new ATOM 0 HE2 LYS A 123 -4.538 -10.606 7.948 1.00 0.74 H new ATOM 0 HE3 LYS A 123 -5.480 -9.730 6.758 1.00 0.74 H new ATOM 0 HZ1 LYS A 123 -6.245 -11.922 6.692 1.00 0.94 H new ATOM 0 HZ2 LYS A 123 -5.253 -11.783 5.320 1.00 0.94 H new ATOM 0 HZ3 LYS A 123 -4.680 -12.582 6.705 1.00 0.94 H new ATOM 1769 N LYS A 124 0.141 -10.757 6.597 1.00 0.21 N ATOM 1770 CA LYS A 124 0.517 -11.904 7.430 1.00 0.24 C ATOM 1771 C LYS A 124 1.909 -11.694 8.020 1.00 0.25 C ATOM 1772 O LYS A 124 2.230 -12.223 9.085 1.00 0.30 O ATOM 1773 CB LYS A 124 0.501 -13.211 6.623 1.00 0.27 C ATOM 1774 CG LYS A 124 1.642 -13.318 5.619 1.00 0.26 C ATOM 1775 CD LYS A 124 1.432 -14.458 4.629 1.00 1.05 C ATOM 1776 CE LYS A 124 1.449 -15.820 5.300 1.00 1.37 C ATOM 1777 NZ LYS A 124 1.157 -16.911 4.331 1.00 2.13 N ATOM 0 H LYS A 124 0.196 -10.924 5.592 1.00 0.21 H new ATOM 0 HA LYS A 124 -0.216 -11.982 8.233 1.00 0.24 H new ATOM 0 HB2 LYS A 124 0.553 -14.055 7.311 1.00 0.27 H new ATOM 0 HB3 LYS A 124 -0.448 -13.290 6.093 1.00 0.27 H new ATOM 0 HG2 LYS A 124 1.734 -12.378 5.074 1.00 0.26 H new ATOM 0 HG3 LYS A 124 2.580 -13.470 6.152 1.00 0.26 H new ATOM 0 HD2 LYS A 124 0.479 -14.320 4.118 1.00 1.05 H new ATOM 0 HD3 LYS A 124 2.211 -14.422 3.867 1.00 1.05 H new ATOM 0 HE2 LYS A 124 2.424 -15.989 5.757 1.00 1.37 H new ATOM 0 HE3 LYS A 124 0.713 -15.840 6.104 1.00 1.37 H new ATOM 0 HZ1 LYS A 124 1.177 -17.827 4.823 1.00 2.13 H new ATOM 0 HZ2 LYS A 124 0.216 -16.762 3.914 1.00 2.13 H new ATOM 0 HZ3 LYS A 124 1.874 -16.907 3.578 1.00 2.13 H new ATOM 1791 N THR A 125 2.729 -10.925 7.313 1.00 0.23 N ATOM 1792 CA THR A 125 4.127 -10.748 7.680 1.00 0.28 C ATOM 1793 C THR A 125 4.301 -9.962 8.981 1.00 0.34 C ATOM 1794 O THR A 125 4.860 -10.484 9.945 1.00 0.47 O ATOM 1795 CB THR A 125 4.929 -10.072 6.544 1.00 0.31 C ATOM 1796 OG1 THR A 125 5.045 -10.974 5.434 1.00 0.35 O ATOM 1797 CG2 THR A 125 6.321 -9.663 7.003 1.00 0.37 C ATOM 0 H THR A 125 2.447 -10.412 6.478 1.00 0.23 H new ATOM 0 HA THR A 125 4.523 -11.750 7.845 1.00 0.28 H new ATOM 0 HB THR A 125 4.390 -9.172 6.247 1.00 0.31 H new ATOM 0 HG1 THR A 125 4.330 -10.793 4.789 1.00 0.35 H new ATOM 0 HG21 THR A 125 6.853 -9.192 6.176 1.00 0.37 H new ATOM 0 HG22 THR A 125 6.239 -8.958 7.830 1.00 0.37 H new ATOM 0 HG23 THR A 125 6.870 -10.546 7.331 1.00 0.37 H new ATOM 1805 N LYS A 126 3.827 -8.725 9.029 1.00 0.34 N ATOM 1806 CA LYS A 126 4.127 -7.891 10.193 1.00 0.50 C ATOM 1807 C LYS A 126 2.877 -7.370 10.915 1.00 0.54 C ATOM 1808 O LYS A 126 2.724 -7.579 12.117 1.00 0.88 O ATOM 1809 CB LYS A 126 5.056 -6.735 9.811 1.00 0.70 C ATOM 1810 CG LYS A 126 5.930 -6.279 10.963 1.00 1.17 C ATOM 1811 CD LYS A 126 6.935 -5.241 10.514 1.00 0.75 C ATOM 1812 CE LYS A 126 8.058 -5.069 11.524 1.00 0.91 C ATOM 1813 NZ LYS A 126 8.824 -6.329 11.721 1.00 1.75 N ATOM 0 H LYS A 126 3.255 -8.286 8.308 1.00 0.34 H new ATOM 0 HA LYS A 126 4.638 -8.540 10.904 1.00 0.50 H new ATOM 0 HB2 LYS A 126 5.690 -7.044 8.980 1.00 0.70 H new ATOM 0 HB3 LYS A 126 4.457 -5.894 9.460 1.00 0.70 H new ATOM 0 HG2 LYS A 126 5.305 -5.865 11.754 1.00 1.17 H new ATOM 0 HG3 LYS A 126 6.454 -7.136 11.386 1.00 1.17 H new ATOM 0 HD2 LYS A 126 7.354 -5.533 9.551 1.00 0.75 H new ATOM 0 HD3 LYS A 126 6.430 -4.286 10.366 1.00 0.75 H new ATOM 0 HE2 LYS A 126 8.733 -4.283 11.186 1.00 0.91 H new ATOM 0 HE3 LYS A 126 7.642 -4.744 12.478 1.00 0.91 H new ATOM 0 HZ1 LYS A 126 9.773 -6.105 12.083 1.00 1.75 H new ATOM 0 HZ2 LYS A 126 8.327 -6.934 12.405 1.00 1.75 H new ATOM 0 HZ3 LYS A 126 8.909 -6.829 10.813 1.00 1.75 H new ATOM 1932 N ALA A 134 -4.451 -5.303 11.067 1.00 0.68 N ATOM 1933 CA ALA A 134 -5.073 -6.363 10.269 1.00 0.59 C ATOM 1934 C ALA A 134 -5.937 -5.753 9.181 1.00 0.46 C ATOM 1935 O ALA A 134 -6.858 -6.390 8.672 1.00 0.72 O ATOM 1936 CB ALA A 134 -5.911 -7.290 11.136 1.00 0.93 C ATOM 0 HA ALA A 134 -4.277 -6.953 9.814 1.00 0.59 H new ATOM 0 HB1 ALA A 134 -6.358 -8.065 10.513 1.00 0.93 H new ATOM 0 HB2 ALA A 134 -5.277 -7.753 11.892 1.00 0.93 H new ATOM 0 HB3 ALA A 134 -6.699 -6.717 11.625 1.00 0.93 H new ATOM 1942 N ILE A 135 -5.596 -4.514 8.828 1.00 0.49 N ATOM 1943 CA ILE A 135 -6.334 -3.701 7.866 1.00 0.38 C ATOM 1944 C ILE A 135 -7.739 -3.362 8.421 1.00 0.51 C ATOM 1945 O ILE A 135 -8.385 -4.201 9.054 1.00 1.05 O ATOM 1946 CB ILE A 135 -6.428 -4.352 6.463 1.00 0.40 C ATOM 1947 CG1 ILE A 135 -5.253 -5.310 6.210 1.00 0.39 C ATOM 1948 CG2 ILE A 135 -6.413 -3.248 5.414 1.00 0.58 C ATOM 1949 CD1 ILE A 135 -5.301 -6.012 4.870 1.00 0.87 C ATOM 0 H ILE A 135 -4.780 -4.038 9.213 1.00 0.49 H new ATOM 0 HA ILE A 135 -5.771 -2.778 7.730 1.00 0.38 H new ATOM 0 HB ILE A 135 -7.351 -4.929 6.405 1.00 0.40 H new ATOM 0 HG12 ILE A 135 -4.321 -4.750 6.281 1.00 0.39 H new ATOM 0 HG13 ILE A 135 -5.234 -6.061 7.000 1.00 0.39 H new ATOM 0 HG21 ILE A 135 -6.479 -3.690 4.420 1.00 0.58 H new ATOM 0 HG22 ILE A 135 -7.263 -2.584 5.573 1.00 0.58 H new ATOM 0 HG23 ILE A 135 -5.487 -2.679 5.498 1.00 0.58 H new ATOM 0 HD11 ILE A 135 -4.436 -6.668 4.772 1.00 0.87 H new ATOM 0 HD12 ILE A 135 -6.215 -6.602 4.801 1.00 0.87 H new ATOM 0 HD13 ILE A 135 -5.287 -5.271 4.070 1.00 0.87 H new ATOM 1961 N LYS A 136 -8.191 -2.120 8.222 1.00 0.47 N ATOM 1962 CA LYS A 136 -9.472 -1.650 8.783 1.00 0.51 C ATOM 1963 C LYS A 136 -9.751 -0.203 8.367 1.00 0.52 C ATOM 1964 O LYS A 136 -10.891 0.188 8.120 1.00 0.84 O ATOM 1965 CB LYS A 136 -9.474 -1.749 10.314 1.00 0.60 C ATOM 1966 CG LYS A 136 -8.242 -1.156 10.976 1.00 0.67 C ATOM 1967 CD LYS A 136 -8.390 -1.073 12.488 1.00 0.90 C ATOM 1968 CE LYS A 136 -8.351 -2.443 13.152 1.00 1.05 C ATOM 1969 NZ LYS A 136 -9.593 -3.234 12.927 1.00 1.50 N ATOM 0 H LYS A 136 -7.692 -1.417 7.677 1.00 0.47 H new ATOM 0 HA LYS A 136 -10.257 -2.294 8.386 1.00 0.51 H new ATOM 0 HB2 LYS A 136 -10.359 -1.243 10.699 1.00 0.60 H new ATOM 0 HB3 LYS A 136 -9.557 -2.798 10.599 1.00 0.60 H new ATOM 0 HG2 LYS A 136 -7.371 -1.763 10.730 1.00 0.67 H new ATOM 0 HG3 LYS A 136 -8.059 -0.159 10.575 1.00 0.67 H new ATOM 0 HD2 LYS A 136 -7.592 -0.452 12.895 1.00 0.90 H new ATOM 0 HD3 LYS A 136 -9.332 -0.581 12.732 1.00 0.90 H new ATOM 0 HE2 LYS A 136 -7.497 -3.002 12.770 1.00 1.05 H new ATOM 0 HE3 LYS A 136 -8.196 -2.317 14.224 1.00 1.05 H new ATOM 0 HZ1 LYS A 136 -9.857 -3.723 13.806 1.00 1.50 H new ATOM 0 HZ2 LYS A 136 -10.363 -2.597 12.641 1.00 1.50 H new ATOM 0 HZ3 LYS A 136 -9.427 -3.935 12.177 1.00 1.50 H new ATOM 1983 N TRP A 137 -8.690 0.578 8.317 1.00 0.38 N ATOM 1984 CA TRP A 137 -8.723 1.967 7.871 1.00 0.37 C ATOM 1985 C TRP A 137 -8.316 2.098 6.408 1.00 0.32 C ATOM 1986 O TRP A 137 -7.836 1.153 5.804 1.00 0.33 O ATOM 1987 CB TRP A 137 -7.788 2.861 8.711 1.00 0.42 C ATOM 1988 CG TRP A 137 -6.683 2.158 9.436 1.00 0.30 C ATOM 1989 CD1 TRP A 137 -6.151 2.540 10.633 1.00 0.37 C ATOM 1990 CD2 TRP A 137 -5.969 0.978 9.046 1.00 0.35 C ATOM 1991 NE1 TRP A 137 -5.182 1.666 11.015 1.00 0.32 N ATOM 1992 CE2 TRP A 137 -5.048 0.711 10.065 1.00 0.41 C ATOM 1993 CE3 TRP A 137 -6.019 0.115 7.943 1.00 0.54 C ATOM 1994 CZ2 TRP A 137 -4.195 -0.355 10.028 1.00 0.66 C ATOM 1995 CZ3 TRP A 137 -5.158 -0.951 7.912 1.00 0.81 C ATOM 1996 CH2 TRP A 137 -4.251 -1.181 8.951 1.00 0.87 C ATOM 0 H TRP A 137 -7.759 0.263 8.590 1.00 0.38 H new ATOM 0 HA TRP A 137 -9.754 2.297 7.997 1.00 0.37 H new ATOM 0 HB2 TRP A 137 -7.346 3.609 8.053 1.00 0.42 H new ATOM 0 HB3 TRP A 137 -8.392 3.398 9.443 1.00 0.42 H new ATOM 0 HD1 TRP A 137 -6.455 3.410 11.195 1.00 0.37 H new ATOM 0 HE1 TRP A 137 -4.643 1.721 11.879 1.00 0.32 H new ATOM 0 HE3 TRP A 137 -6.718 0.286 7.138 1.00 0.54 H new ATOM 0 HZ2 TRP A 137 -3.496 -0.536 10.831 1.00 0.66 H new ATOM 0 HZ3 TRP A 137 -5.181 -1.626 7.069 1.00 0.81 H new ATOM 0 HH2 TRP A 137 -3.584 -2.029 8.896 1.00 0.87 H new ATOM 2007 N ASN A 138 -8.519 3.293 5.879 1.00 0.33 N ATOM 2008 CA ASN A 138 -8.128 3.692 4.518 1.00 0.33 C ATOM 2009 C ASN A 138 -6.664 3.430 4.168 1.00 0.27 C ATOM 2010 O ASN A 138 -6.035 2.526 4.688 1.00 0.26 O ATOM 2011 CB ASN A 138 -8.445 5.150 4.257 1.00 0.40 C ATOM 2012 CG ASN A 138 -9.709 5.303 3.435 1.00 1.09 C ATOM 2013 OD1 ASN A 138 -9.813 6.188 2.591 1.00 1.80 O ATOM 2014 ND2 ASN A 138 -10.681 4.433 3.678 1.00 1.17 N ATOM 0 H ASN A 138 -8.976 4.045 6.395 1.00 0.33 H new ATOM 0 HA ASN A 138 -8.725 3.050 3.871 1.00 0.33 H new ATOM 0 HB2 ASN A 138 -8.561 5.674 5.206 1.00 0.40 H new ATOM 0 HB3 ASN A 138 -7.610 5.617 3.734 1.00 0.40 H new ATOM 0 HD21 ASN A 138 -11.555 4.485 3.154 1.00 1.17 H new ATOM 0 HD22 ASN A 138 -10.554 3.712 4.388 1.00 1.17 H new ATOM 2021 N PHE A 139 -6.184 4.261 3.236 1.00 0.27 N ATOM 2022 CA PHE A 139 -4.919 4.126 2.491 1.00 0.26 C ATOM 2023 C PHE A 139 -3.794 3.380 3.213 1.00 0.22 C ATOM 2024 O PHE A 139 -3.035 2.712 2.547 1.00 0.30 O ATOM 2025 CB PHE A 139 -4.424 5.547 2.216 1.00 0.29 C ATOM 2026 CG PHE A 139 -5.272 6.329 1.245 1.00 0.59 C ATOM 2027 CD1 PHE A 139 -6.559 6.709 1.584 1.00 0.75 C ATOM 2028 CD2 PHE A 139 -4.785 6.674 -0.006 1.00 0.89 C ATOM 2029 CE1 PHE A 139 -7.343 7.422 0.698 1.00 1.12 C ATOM 2030 CE2 PHE A 139 -5.565 7.385 -0.895 1.00 1.28 C ATOM 2031 CZ PHE A 139 -6.823 7.780 -0.547 1.00 1.37 C ATOM 0 H PHE A 139 -6.697 5.099 2.962 1.00 0.27 H new ATOM 0 HA PHE A 139 -5.142 3.533 1.604 1.00 0.26 H new ATOM 0 HB2 PHE A 139 -4.379 6.091 3.159 1.00 0.29 H new ATOM 0 HB3 PHE A 139 -3.406 5.495 1.829 1.00 0.29 H new ATOM 0 HD1 PHE A 139 -6.955 6.445 2.553 1.00 0.75 H new ATOM 0 HD2 PHE A 139 -3.784 6.383 -0.288 1.00 0.89 H new ATOM 0 HE1 PHE A 139 -8.351 7.701 0.967 1.00 1.12 H new ATOM 0 HE2 PHE A 139 -5.177 7.630 -1.873 1.00 1.28 H new ATOM 0 HZ PHE A 139 -7.415 8.368 -1.233 1.00 1.37 H new ATOM 2041 N THR A 140 -3.695 3.520 4.532 1.00 0.22 N ATOM 2042 CA THR A 140 -2.727 2.798 5.379 1.00 0.21 C ATOM 2043 C THR A 140 -1.600 2.092 4.618 1.00 0.19 C ATOM 2044 O THR A 140 -1.799 1.021 4.044 1.00 0.22 O ATOM 2045 CB THR A 140 -3.443 1.745 6.216 1.00 0.23 C ATOM 2046 OG1 THR A 140 -4.607 2.320 6.796 1.00 0.30 O ATOM 2047 CG2 THR A 140 -2.534 1.211 7.306 1.00 0.28 C ATOM 0 H THR A 140 -4.296 4.151 5.062 1.00 0.22 H new ATOM 0 HA THR A 140 -2.269 3.575 5.991 1.00 0.21 H new ATOM 0 HB THR A 140 -3.724 0.913 5.570 1.00 0.23 H new ATOM 0 HG1 THR A 140 -4.853 1.819 7.601 1.00 0.30 H new ATOM 0 HG21 THR A 140 -3.068 0.461 7.890 1.00 0.28 H new ATOM 0 HG22 THR A 140 -1.651 0.759 6.854 1.00 0.28 H new ATOM 0 HG23 THR A 140 -2.229 2.029 7.959 1.00 0.28 H new ATOM 2055 N SER A 141 -0.418 2.647 4.672 1.00 0.18 N ATOM 2056 CA SER A 141 0.691 2.121 3.901 1.00 0.17 C ATOM 2057 C SER A 141 1.393 0.975 4.620 1.00 0.17 C ATOM 2058 O SER A 141 1.291 0.814 5.838 1.00 0.22 O ATOM 2059 CB SER A 141 1.697 3.234 3.641 1.00 0.21 C ATOM 2060 OG SER A 141 1.964 3.973 4.824 1.00 0.80 O ATOM 0 H SER A 141 -0.193 3.464 5.240 1.00 0.18 H new ATOM 0 HA SER A 141 0.290 1.736 2.963 1.00 0.17 H new ATOM 0 HB2 SER A 141 2.624 2.807 3.259 1.00 0.21 H new ATOM 0 HB3 SER A 141 1.312 3.902 2.871 1.00 0.21 H new ATOM 0 HG SER A 141 1.557 4.862 4.754 1.00 0.80 H new ATOM 2066 N PHE A 142 2.097 0.174 3.848 1.00 0.17 N ATOM 2067 CA PHE A 142 3.103 -0.713 4.393 1.00 0.17 C ATOM 2068 C PHE A 142 4.453 -0.089 4.109 1.00 0.23 C ATOM 2069 O PHE A 142 4.549 0.885 3.371 1.00 0.53 O ATOM 2070 CB PHE A 142 3.085 -2.107 3.756 1.00 0.17 C ATOM 2071 CG PHE A 142 1.955 -3.016 4.157 1.00 0.16 C ATOM 2072 CD1 PHE A 142 0.646 -2.714 3.831 1.00 0.23 C ATOM 2073 CD2 PHE A 142 2.219 -4.202 4.832 1.00 0.20 C ATOM 2074 CE1 PHE A 142 -0.378 -3.569 4.177 1.00 0.29 C ATOM 2075 CE2 PHE A 142 1.194 -5.065 5.180 1.00 0.26 C ATOM 2076 CZ PHE A 142 -0.106 -4.744 4.850 1.00 0.28 C ATOM 0 H PHE A 142 1.990 0.119 2.835 1.00 0.17 H new ATOM 0 HA PHE A 142 2.902 -0.838 5.457 1.00 0.17 H new ATOM 0 HB2 PHE A 142 3.057 -1.986 2.673 1.00 0.17 H new ATOM 0 HB3 PHE A 142 4.024 -2.604 3.998 1.00 0.17 H new ATOM 0 HD1 PHE A 142 0.424 -1.800 3.300 1.00 0.23 H new ATOM 0 HD2 PHE A 142 3.237 -4.454 5.088 1.00 0.20 H new ATOM 0 HE1 PHE A 142 -1.397 -3.319 3.921 1.00 0.29 H new ATOM 0 HE2 PHE A 142 1.411 -5.983 5.706 1.00 0.26 H new ATOM 0 HZ PHE A 142 -0.912 -5.412 5.118 1.00 0.28 H new ATOM 2086 N LEU A 143 5.478 -0.625 4.706 1.00 0.14 N ATOM 2087 CA LEU A 143 6.819 -0.170 4.455 1.00 0.14 C ATOM 2088 C LEU A 143 7.607 -1.300 3.830 1.00 0.13 C ATOM 2089 O LEU A 143 7.962 -2.264 4.500 1.00 0.13 O ATOM 2090 CB LEU A 143 7.438 0.288 5.766 1.00 0.16 C ATOM 2091 CG LEU A 143 8.880 0.781 5.691 1.00 0.19 C ATOM 2092 CD1 LEU A 143 8.961 2.100 4.938 1.00 0.37 C ATOM 2093 CD2 LEU A 143 9.458 0.922 7.090 1.00 0.51 C ATOM 0 H LEU A 143 5.411 -1.388 5.379 1.00 0.14 H new ATOM 0 HA LEU A 143 6.824 0.674 3.765 1.00 0.14 H new ATOM 0 HB2 LEU A 143 6.822 1.089 6.175 1.00 0.16 H new ATOM 0 HB3 LEU A 143 7.395 -0.540 6.474 1.00 0.16 H new ATOM 0 HG LEU A 143 9.470 0.046 5.144 1.00 0.19 H new ATOM 0 HD11 LEU A 143 9.998 2.432 4.897 1.00 0.37 H new ATOM 0 HD12 LEU A 143 8.583 1.964 3.925 1.00 0.37 H new ATOM 0 HD13 LEU A 143 8.360 2.850 5.452 1.00 0.37 H new ATOM 0 HD21 LEU A 143 10.487 1.274 7.025 1.00 0.51 H new ATOM 0 HD22 LEU A 143 8.865 1.638 7.658 1.00 0.51 H new ATOM 0 HD23 LEU A 143 9.437 -0.045 7.592 1.00 0.51 H new ATOM 2105 N ILE A 144 7.858 -1.189 2.542 1.00 0.14 N ATOM 2106 CA ILE A 144 8.458 -2.273 1.795 1.00 0.14 C ATOM 2107 C ILE A 144 9.894 -1.912 1.441 1.00 0.15 C ATOM 2108 O ILE A 144 10.147 -0.881 0.818 1.00 0.19 O ATOM 2109 CB ILE A 144 7.660 -2.578 0.499 1.00 0.16 C ATOM 2110 CG1 ILE A 144 6.147 -2.561 0.763 1.00 0.16 C ATOM 2111 CG2 ILE A 144 8.081 -3.924 -0.062 1.00 0.20 C ATOM 2112 CD1 ILE A 144 5.680 -3.538 1.821 1.00 0.16 C ATOM 0 H ILE A 144 7.655 -0.356 1.990 1.00 0.14 H new ATOM 0 HA ILE A 144 8.442 -3.167 2.419 1.00 0.14 H new ATOM 0 HB ILE A 144 7.882 -1.800 -0.231 1.00 0.16 H new ATOM 0 HG12 ILE A 144 5.855 -1.554 1.063 1.00 0.16 H new ATOM 0 HG13 ILE A 144 5.626 -2.779 -0.169 1.00 0.16 H new ATOM 0 HG21 ILE A 144 7.517 -4.132 -0.971 1.00 0.20 H new ATOM 0 HG22 ILE A 144 9.146 -3.905 -0.292 1.00 0.20 H new ATOM 0 HG23 ILE A 144 7.882 -4.703 0.674 1.00 0.20 H new ATOM 0 HD11 ILE A 144 4.600 -3.456 1.940 1.00 0.16 H new ATOM 0 HD12 ILE A 144 5.936 -4.553 1.517 1.00 0.16 H new ATOM 0 HD13 ILE A 144 6.168 -3.309 2.768 1.00 0.16 H new ATOM 2124 N ASP A 145 10.836 -2.738 1.868 1.00 0.15 N ATOM 2125 CA ASP A 145 12.244 -2.471 1.599 1.00 0.17 C ATOM 2126 C ASP A 145 12.581 -2.784 0.138 1.00 0.18 C ATOM 2127 O ASP A 145 11.721 -3.215 -0.627 1.00 0.21 O ATOM 2128 CB ASP A 145 13.144 -3.277 2.545 1.00 0.22 C ATOM 2129 CG ASP A 145 13.605 -4.591 1.952 1.00 0.68 C ATOM 2130 OD1 ASP A 145 12.777 -5.514 1.816 1.00 1.02 O ATOM 2131 OD2 ASP A 145 14.799 -4.696 1.600 1.00 1.30 O ATOM 0 H ASP A 145 10.656 -3.591 2.397 1.00 0.15 H new ATOM 0 HA ASP A 145 12.429 -1.412 1.776 1.00 0.17 H new ATOM 0 HB2 ASP A 145 14.016 -2.677 2.806 1.00 0.22 H new ATOM 0 HB3 ASP A 145 12.604 -3.473 3.471 1.00 0.22 H new ATOM 2136 N ARG A 146 13.849 -2.600 -0.225 1.00 0.21 N ATOM 2137 CA ARG A 146 14.298 -2.733 -1.614 1.00 0.25 C ATOM 2138 C ARG A 146 14.218 -4.176 -2.110 1.00 0.27 C ATOM 2139 O ARG A 146 14.453 -4.448 -3.286 1.00 0.43 O ATOM 2140 CB ARG A 146 15.743 -2.250 -1.748 1.00 0.29 C ATOM 2141 CG ARG A 146 15.977 -0.854 -1.209 1.00 0.46 C ATOM 2142 CD ARG A 146 17.395 -0.378 -1.480 1.00 0.90 C ATOM 2143 NE ARG A 146 17.632 -0.096 -2.899 1.00 1.87 N ATOM 2144 CZ ARG A 146 18.844 0.094 -3.432 1.00 2.72 C ATOM 2145 NH1 ARG A 146 19.933 -0.149 -2.717 1.00 2.90 N ATOM 2146 NH2 ARG A 146 18.963 0.460 -4.702 1.00 3.78 N ATOM 0 H ARG A 146 14.592 -2.356 0.430 1.00 0.21 H new ATOM 0 HA ARG A 146 13.632 -2.122 -2.223 1.00 0.25 H new ATOM 0 HB2 ARG A 146 16.398 -2.946 -1.224 1.00 0.29 H new ATOM 0 HB3 ARG A 146 16.028 -2.275 -2.800 1.00 0.29 H new ATOM 0 HG2 ARG A 146 15.268 -0.164 -1.666 1.00 0.46 H new ATOM 0 HG3 ARG A 146 15.788 -0.842 -0.136 1.00 0.46 H new ATOM 0 HD2 ARG A 146 17.590 0.522 -0.897 1.00 0.90 H new ATOM 0 HD3 ARG A 146 18.100 -1.137 -1.141 1.00 0.90 H new ATOM 0 HE ARG A 146 16.823 -0.041 -3.518 1.00 1.87 H new ATOM 0 HH11 ARG A 146 19.849 -0.482 -1.757 1.00 2.90 H new ATOM 0 HH12 ARG A 146 20.855 -0.003 -3.127 1.00 2.90 H new ATOM 0 HH21 ARG A 146 18.129 0.597 -5.274 1.00 3.78 H new ATOM 0 HH22 ARG A 146 19.888 0.604 -5.107 1.00 3.78 H new ATOM 2160 N ASP A 147 13.902 -5.094 -1.220 1.00 0.19 N ATOM 2161 CA ASP A 147 13.904 -6.504 -1.552 1.00 0.26 C ATOM 2162 C ASP A 147 12.476 -7.009 -1.610 1.00 0.20 C ATOM 2163 O ASP A 147 12.174 -8.005 -2.261 1.00 0.27 O ATOM 2164 CB ASP A 147 14.718 -7.275 -0.515 1.00 0.39 C ATOM 2165 CG ASP A 147 14.889 -8.743 -0.863 1.00 0.66 C ATOM 2166 OD1 ASP A 147 15.203 -9.060 -2.031 1.00 1.18 O ATOM 2167 OD2 ASP A 147 14.731 -9.587 0.044 1.00 0.85 O ATOM 0 H ASP A 147 13.639 -4.887 -0.256 1.00 0.19 H new ATOM 0 HA ASP A 147 14.365 -6.656 -2.528 1.00 0.26 H new ATOM 0 HB2 ASP A 147 15.701 -6.814 -0.418 1.00 0.39 H new ATOM 0 HB3 ASP A 147 14.230 -7.192 0.456 1.00 0.39 H new ATOM 2172 N GLY A 148 11.600 -6.282 -0.933 1.00 0.18 N ATOM 2173 CA GLY A 148 10.194 -6.598 -0.939 1.00 0.16 C ATOM 2174 C GLY A 148 9.738 -7.250 0.346 1.00 0.16 C ATOM 2175 O GLY A 148 8.867 -8.115 0.328 1.00 0.23 O ATOM 0 H GLY A 148 11.847 -5.467 -0.372 1.00 0.18 H new ATOM 0 HA2 GLY A 148 9.621 -5.685 -1.102 1.00 0.16 H new ATOM 0 HA3 GLY A 148 9.979 -7.263 -1.775 1.00 0.16 H new ATOM 2179 N VAL A 149 10.330 -6.856 1.460 1.00 0.19 N ATOM 2180 CA VAL A 149 9.906 -7.356 2.756 1.00 0.20 C ATOM 2181 C VAL A 149 9.231 -6.251 3.562 1.00 0.18 C ATOM 2182 O VAL A 149 9.752 -5.139 3.667 1.00 0.22 O ATOM 2183 CB VAL A 149 11.092 -7.950 3.551 1.00 0.27 C ATOM 2184 CG1 VAL A 149 10.688 -8.284 4.980 1.00 0.61 C ATOM 2185 CG2 VAL A 149 11.619 -9.192 2.850 1.00 0.62 C ATOM 0 H VAL A 149 11.104 -6.193 1.493 1.00 0.19 H new ATOM 0 HA VAL A 149 9.186 -8.156 2.581 1.00 0.20 H new ATOM 0 HB VAL A 149 11.881 -7.199 3.593 1.00 0.27 H new ATOM 0 HG11 VAL A 149 11.544 -8.700 5.512 1.00 0.61 H new ATOM 0 HG12 VAL A 149 10.352 -7.378 5.484 1.00 0.61 H new ATOM 0 HG13 VAL A 149 9.879 -9.014 4.968 1.00 0.61 H new ATOM 0 HG21 VAL A 149 12.454 -9.603 3.417 1.00 0.62 H new ATOM 0 HG22 VAL A 149 10.825 -9.936 2.782 1.00 0.62 H new ATOM 0 HG23 VAL A 149 11.956 -8.929 1.847 1.00 0.62 H new ATOM 2195 N PRO A 150 8.032 -6.538 4.095 1.00 0.18 N ATOM 2196 CA PRO A 150 7.289 -5.604 4.948 1.00 0.19 C ATOM 2197 C PRO A 150 8.015 -5.328 6.267 1.00 0.19 C ATOM 2198 O PRO A 150 8.072 -6.185 7.151 1.00 0.30 O ATOM 2199 CB PRO A 150 5.966 -6.331 5.227 1.00 0.24 C ATOM 2200 CG PRO A 150 5.883 -7.415 4.209 1.00 0.26 C ATOM 2201 CD PRO A 150 7.297 -7.797 3.895 1.00 0.23 C ATOM 0 HA PRO A 150 7.165 -4.634 4.466 1.00 0.19 H new ATOM 0 HB2 PRO A 150 5.949 -6.740 6.237 1.00 0.24 H new ATOM 0 HB3 PRO A 150 5.119 -5.650 5.144 1.00 0.24 H new ATOM 0 HG2 PRO A 150 5.324 -8.269 4.593 1.00 0.26 H new ATOM 0 HG3 PRO A 150 5.364 -7.071 3.314 1.00 0.26 H new ATOM 0 HD2 PRO A 150 7.659 -8.585 4.556 1.00 0.23 H new ATOM 0 HD3 PRO A 150 7.398 -8.166 2.874 1.00 0.23 H new ATOM 2209 N VAL A 151 8.562 -4.128 6.392 1.00 0.15 N ATOM 2210 CA VAL A 151 9.304 -3.731 7.581 1.00 0.17 C ATOM 2211 C VAL A 151 8.401 -2.989 8.564 1.00 0.18 C ATOM 2212 O VAL A 151 8.774 -2.779 9.716 1.00 0.27 O ATOM 2213 CB VAL A 151 10.501 -2.824 7.211 1.00 0.21 C ATOM 2214 CG1 VAL A 151 11.466 -2.676 8.379 1.00 0.27 C ATOM 2215 CG2 VAL A 151 11.227 -3.359 5.986 1.00 0.23 C ATOM 0 H VAL A 151 8.505 -3.404 5.676 1.00 0.15 H new ATOM 0 HA VAL A 151 9.676 -4.642 8.050 1.00 0.17 H new ATOM 0 HB VAL A 151 10.105 -1.836 6.975 1.00 0.21 H new ATOM 0 HG11 VAL A 151 12.296 -2.033 8.086 1.00 0.27 H new ATOM 0 HG12 VAL A 151 10.945 -2.232 9.227 1.00 0.27 H new ATOM 0 HG13 VAL A 151 11.849 -3.657 8.661 1.00 0.27 H new ATOM 0 HG21 VAL A 151 12.065 -2.705 5.745 1.00 0.23 H new ATOM 0 HG22 VAL A 151 11.598 -4.363 6.193 1.00 0.23 H new ATOM 0 HG23 VAL A 151 10.539 -3.393 5.141 1.00 0.23 H new ATOM 2225 N GLU A 152 7.207 -2.605 8.108 1.00 0.17 N ATOM 2226 CA GLU A 152 6.256 -1.873 8.954 1.00 0.18 C ATOM 2227 C GLU A 152 4.944 -1.601 8.227 1.00 0.16 C ATOM 2228 O GLU A 152 4.824 -1.830 7.027 1.00 0.17 O ATOM 2229 CB GLU A 152 6.844 -0.546 9.452 1.00 0.26 C ATOM 2230 CG GLU A 152 7.032 -0.494 10.966 1.00 0.48 C ATOM 2231 CD GLU A 152 5.723 -0.452 11.743 1.00 0.66 C ATOM 2232 OE1 GLU A 152 4.836 -1.285 11.461 1.00 1.05 O ATOM 2233 OE2 GLU A 152 5.562 0.421 12.624 1.00 1.22 O ATOM 0 H GLU A 152 6.874 -2.787 7.161 1.00 0.17 H new ATOM 0 HA GLU A 152 6.056 -2.515 9.812 1.00 0.18 H new ATOM 0 HB2 GLU A 152 7.807 -0.380 8.968 1.00 0.26 H new ATOM 0 HB3 GLU A 152 6.189 0.270 9.147 1.00 0.26 H new ATOM 0 HG2 GLU A 152 7.605 -1.366 11.283 1.00 0.48 H new ATOM 0 HG3 GLU A 152 7.624 0.385 11.220 1.00 0.48 H new ATOM 2240 N ARG A 153 3.953 -1.183 8.997 1.00 0.20 N ATOM 2241 CA ARG A 153 2.678 -0.715 8.478 1.00 0.22 C ATOM 2242 C ARG A 153 2.274 0.585 9.187 1.00 0.22 C ATOM 2243 O ARG A 153 2.052 0.589 10.398 1.00 0.29 O ATOM 2244 CB ARG A 153 1.586 -1.768 8.691 1.00 0.28 C ATOM 2245 CG ARG A 153 0.193 -1.231 8.413 1.00 0.32 C ATOM 2246 CD ARG A 153 -0.902 -2.121 8.979 1.00 0.47 C ATOM 2247 NE ARG A 153 -1.343 -3.161 8.050 1.00 0.73 N ATOM 2248 CZ ARG A 153 -2.074 -2.927 6.957 1.00 1.34 C ATOM 2249 NH1 ARG A 153 -2.254 -1.691 6.519 1.00 1.72 N ATOM 2250 NH2 ARG A 153 -2.589 -3.935 6.276 1.00 1.75 N ATOM 0 H ARG A 153 4.012 -1.159 10.015 1.00 0.20 H new ATOM 0 HA ARG A 153 2.789 -0.534 7.409 1.00 0.22 H new ATOM 0 HB2 ARG A 153 1.778 -2.622 8.041 1.00 0.28 H new ATOM 0 HB3 ARG A 153 1.633 -2.132 9.717 1.00 0.28 H new ATOM 0 HG2 ARG A 153 0.101 -0.232 8.840 1.00 0.32 H new ATOM 0 HG3 ARG A 153 0.054 -1.131 7.336 1.00 0.32 H new ATOM 0 HD2 ARG A 153 -0.541 -2.591 9.894 1.00 0.47 H new ATOM 0 HD3 ARG A 153 -1.757 -1.503 9.253 1.00 0.47 H new ATOM 0 HE ARG A 153 -1.076 -4.125 8.249 1.00 0.73 H new ATOM 0 HH11 ARG A 153 -1.833 -0.907 7.017 1.00 1.72 H new ATOM 0 HH12 ARG A 153 -2.814 -1.523 5.683 1.00 1.72 H new ATOM 0 HH21 ARG A 153 -2.429 -4.894 6.585 1.00 1.75 H new ATOM 0 HH22 ARG A 153 -3.147 -3.754 5.442 1.00 1.75 H new ATOM 2264 N PHE A 154 2.185 1.673 8.430 1.00 0.21 N ATOM 2265 CA PHE A 154 1.731 2.961 8.960 1.00 0.22 C ATOM 2266 C PHE A 154 0.298 3.196 8.492 1.00 0.26 C ATOM 2267 O PHE A 154 0.010 2.989 7.324 1.00 0.38 O ATOM 2268 CB PHE A 154 2.591 4.120 8.429 1.00 0.24 C ATOM 2269 CG PHE A 154 4.088 3.931 8.470 1.00 0.20 C ATOM 2270 CD1 PHE A 154 4.737 3.197 7.486 1.00 0.24 C ATOM 2271 CD2 PHE A 154 4.853 4.535 9.460 1.00 0.20 C ATOM 2272 CE1 PHE A 154 6.114 3.069 7.491 1.00 0.25 C ATOM 2273 CE2 PHE A 154 6.232 4.401 9.470 1.00 0.22 C ATOM 2274 CZ PHE A 154 6.860 3.670 8.481 1.00 0.23 C ATOM 0 H PHE A 154 2.423 1.692 7.438 1.00 0.21 H new ATOM 0 HA PHE A 154 1.806 2.930 10.047 1.00 0.22 H new ATOM 0 HB2 PHE A 154 2.301 4.313 7.396 1.00 0.24 H new ATOM 0 HB3 PHE A 154 2.346 5.015 9.001 1.00 0.24 H new ATOM 0 HD1 PHE A 154 4.160 2.720 6.708 1.00 0.24 H new ATOM 0 HD2 PHE A 154 4.367 5.115 10.230 1.00 0.20 H new ATOM 0 HE1 PHE A 154 6.605 2.497 6.718 1.00 0.25 H new ATOM 0 HE2 PHE A 154 6.815 4.868 10.250 1.00 0.22 H new ATOM 0 HZ PHE A 154 7.935 3.570 8.484 1.00 0.23 H new ATOM 2284 N SER A 155 -0.607 3.622 9.368 1.00 0.26 N ATOM 2285 CA SER A 155 -1.971 3.892 8.943 1.00 0.28 C ATOM 2286 C SER A 155 -2.025 5.231 8.187 1.00 0.29 C ATOM 2287 O SER A 155 -1.009 5.918 8.104 1.00 0.34 O ATOM 2288 CB SER A 155 -2.905 3.872 10.154 1.00 0.37 C ATOM 2289 OG SER A 155 -2.758 5.042 10.940 1.00 0.99 O ATOM 0 H SER A 155 -0.423 3.785 10.358 1.00 0.26 H new ATOM 0 HA SER A 155 -2.309 3.115 8.257 1.00 0.28 H new ATOM 0 HB2 SER A 155 -3.938 3.786 9.817 1.00 0.37 H new ATOM 0 HB3 SER A 155 -2.694 2.993 10.764 1.00 0.37 H new ATOM 0 HG SER A 155 -3.369 5.001 11.705 1.00 0.99 H new ATOM 2295 N PRO A 156 -3.185 5.655 7.631 1.00 0.33 N ATOM 2296 CA PRO A 156 -3.244 6.880 6.833 1.00 0.42 C ATOM 2297 C PRO A 156 -3.039 8.103 7.709 1.00 0.47 C ATOM 2298 O PRO A 156 -2.727 9.191 7.232 1.00 0.66 O ATOM 2299 CB PRO A 156 -4.657 6.880 6.235 1.00 0.48 C ATOM 2300 CG PRO A 156 -5.247 5.550 6.565 1.00 0.48 C ATOM 2301 CD PRO A 156 -4.508 5.035 7.764 1.00 0.34 C ATOM 0 HA PRO A 156 -2.467 6.913 6.069 1.00 0.42 H new ATOM 0 HB2 PRO A 156 -5.257 7.687 6.654 1.00 0.48 H new ATOM 0 HB3 PRO A 156 -4.624 7.035 5.157 1.00 0.48 H new ATOM 0 HG2 PRO A 156 -6.312 5.641 6.777 1.00 0.48 H new ATOM 0 HG3 PRO A 156 -5.147 4.863 5.725 1.00 0.48 H new ATOM 0 HD2 PRO A 156 -4.997 5.325 8.694 1.00 0.34 H new ATOM 0 HD3 PRO A 156 -4.445 3.947 7.762 1.00 0.34 H new ATOM 2309 N GLY A 157 -3.195 7.885 9.004 1.00 0.40 N ATOM 2310 CA GLY A 157 -3.049 8.951 9.972 1.00 0.48 C ATOM 2311 C GLY A 157 -1.602 9.170 10.356 1.00 0.42 C ATOM 2312 O GLY A 157 -1.291 10.017 11.194 1.00 0.52 O ATOM 0 H GLY A 157 -3.423 6.976 9.407 1.00 0.40 H new ATOM 0 HA2 GLY A 157 -3.459 9.873 9.561 1.00 0.48 H new ATOM 0 HA3 GLY A 157 -3.629 8.714 10.864 1.00 0.48 H new ATOM 2316 N ALA A 158 -0.716 8.385 9.757 1.00 0.37 N ATOM 2317 CA ALA A 158 0.711 8.543 9.967 1.00 0.33 C ATOM 2318 C ALA A 158 1.228 9.687 9.110 1.00 0.30 C ATOM 2319 O ALA A 158 0.893 9.795 7.928 1.00 0.43 O ATOM 2320 CB ALA A 158 1.454 7.257 9.643 1.00 0.40 C ATOM 0 H ALA A 158 -0.966 7.629 9.119 1.00 0.37 H new ATOM 0 HA ALA A 158 0.887 8.774 11.018 1.00 0.33 H new ATOM 0 HB1 ALA A 158 2.522 7.402 9.809 1.00 0.40 H new ATOM 0 HB2 ALA A 158 1.092 6.456 10.287 1.00 0.40 H new ATOM 0 HB3 ALA A 158 1.282 6.990 8.600 1.00 0.40 H new ATOM 2326 N SER A 159 2.021 10.547 9.717 1.00 0.28 N ATOM 2327 CA SER A 159 2.563 11.700 9.024 1.00 0.36 C ATOM 2328 C SER A 159 3.742 11.295 8.147 1.00 0.28 C ATOM 2329 O SER A 159 4.337 10.236 8.366 1.00 0.25 O ATOM 2330 CB SER A 159 2.994 12.753 10.043 1.00 0.50 C ATOM 2331 OG SER A 159 1.955 13.002 10.978 1.00 1.25 O ATOM 0 H SER A 159 2.306 10.469 10.693 1.00 0.28 H new ATOM 0 HA SER A 159 1.791 12.120 8.379 1.00 0.36 H new ATOM 0 HB2 SER A 159 3.888 12.415 10.567 1.00 0.50 H new ATOM 0 HB3 SER A 159 3.257 13.678 9.529 1.00 0.50 H new ATOM 0 HG SER A 159 2.251 13.678 11.623 1.00 1.25 H new ATOM 2337 N VAL A 160 4.075 12.126 7.164 1.00 0.29 N ATOM 2338 CA VAL A 160 5.172 11.836 6.243 1.00 0.28 C ATOM 2339 C VAL A 160 6.433 11.452 7.017 1.00 0.26 C ATOM 2340 O VAL A 160 7.024 10.401 6.774 1.00 0.25 O ATOM 2341 CB VAL A 160 5.480 13.050 5.336 1.00 0.34 C ATOM 2342 CG1 VAL A 160 6.593 12.726 4.350 1.00 0.41 C ATOM 2343 CG2 VAL A 160 4.229 13.498 4.593 1.00 0.38 C ATOM 0 H VAL A 160 3.599 13.010 6.983 1.00 0.29 H new ATOM 0 HA VAL A 160 4.860 11.001 5.616 1.00 0.28 H new ATOM 0 HB VAL A 160 5.816 13.867 5.974 1.00 0.34 H new ATOM 0 HG11 VAL A 160 6.790 13.597 3.724 1.00 0.41 H new ATOM 0 HG12 VAL A 160 7.498 12.460 4.897 1.00 0.41 H new ATOM 0 HG13 VAL A 160 6.290 11.889 3.721 1.00 0.41 H new ATOM 0 HG21 VAL A 160 4.468 14.353 3.961 1.00 0.38 H new ATOM 0 HG22 VAL A 160 3.861 12.680 3.973 1.00 0.38 H new ATOM 0 HG23 VAL A 160 3.461 13.782 5.312 1.00 0.38 H new ATOM 2353 N LYS A 161 6.792 12.288 7.989 1.00 0.29 N ATOM 2354 CA LYS A 161 8.010 12.105 8.780 1.00 0.33 C ATOM 2355 C LYS A 161 7.972 10.808 9.588 1.00 0.29 C ATOM 2356 O LYS A 161 9.007 10.176 9.813 1.00 0.29 O ATOM 2357 CB LYS A 161 8.201 13.299 9.718 1.00 0.44 C ATOM 2358 CG LYS A 161 9.546 13.318 10.430 1.00 1.11 C ATOM 2359 CD LYS A 161 10.703 13.463 9.451 1.00 1.81 C ATOM 2360 CE LYS A 161 10.686 14.809 8.743 1.00 2.69 C ATOM 2361 NZ LYS A 161 10.785 15.945 9.701 1.00 3.44 N ATOM 0 H LYS A 161 6.249 13.110 8.251 1.00 0.29 H new ATOM 0 HA LYS A 161 8.851 12.040 8.090 1.00 0.33 H new ATOM 0 HB2 LYS A 161 8.092 14.220 9.144 1.00 0.44 H new ATOM 0 HB3 LYS A 161 7.407 13.292 10.464 1.00 0.44 H new ATOM 0 HG2 LYS A 161 9.568 14.142 11.143 1.00 1.11 H new ATOM 0 HG3 LYS A 161 9.667 12.398 11.002 1.00 1.11 H new ATOM 0 HD2 LYS A 161 11.646 13.346 9.985 1.00 1.81 H new ATOM 0 HD3 LYS A 161 10.654 12.664 8.711 1.00 1.81 H new ATOM 0 HE2 LYS A 161 11.515 14.857 8.036 1.00 2.69 H new ATOM 0 HE3 LYS A 161 9.767 14.902 8.164 1.00 2.69 H new ATOM 0 HZ1 LYS A 161 11.024 16.815 9.184 1.00 3.44 H new ATOM 0 HZ2 LYS A 161 9.874 16.070 10.187 1.00 3.44 H new ATOM 0 HZ3 LYS A 161 11.526 15.744 10.402 1.00 3.44 H new ATOM 2375 N ASP A 162 6.778 10.413 10.007 1.00 0.28 N ATOM 2376 CA ASP A 162 6.591 9.189 10.782 1.00 0.28 C ATOM 2377 C ASP A 162 6.937 7.983 9.927 1.00 0.22 C ATOM 2378 O ASP A 162 7.419 6.965 10.420 1.00 0.23 O ATOM 2379 CB ASP A 162 5.147 9.106 11.277 1.00 0.34 C ATOM 2380 CG ASP A 162 4.857 7.904 12.163 1.00 1.02 C ATOM 2381 OD1 ASP A 162 5.795 7.343 12.765 1.00 1.30 O ATOM 2382 OD2 ASP A 162 3.672 7.526 12.276 1.00 1.86 O ATOM 0 H ASP A 162 5.916 10.926 9.822 1.00 0.28 H new ATOM 0 HA ASP A 162 7.253 9.201 11.648 1.00 0.28 H new ATOM 0 HB2 ASP A 162 4.912 10.015 11.830 1.00 0.34 H new ATOM 0 HB3 ASP A 162 4.481 9.076 10.415 1.00 0.34 H new ATOM 2387 N ILE A 163 6.697 8.114 8.633 1.00 0.19 N ATOM 2388 CA ILE A 163 7.094 7.092 7.687 1.00 0.17 C ATOM 2389 C ILE A 163 8.568 7.244 7.337 1.00 0.17 C ATOM 2390 O ILE A 163 9.302 6.260 7.276 1.00 0.18 O ATOM 2391 CB ILE A 163 6.244 7.141 6.400 1.00 0.17 C ATOM 2392 CG1 ILE A 163 4.759 7.021 6.760 1.00 0.18 C ATOM 2393 CG2 ILE A 163 6.667 6.028 5.452 1.00 0.20 C ATOM 2394 CD1 ILE A 163 3.832 7.059 5.568 1.00 0.21 C ATOM 0 H ILE A 163 6.229 8.919 8.216 1.00 0.19 H new ATOM 0 HA ILE A 163 6.929 6.125 8.161 1.00 0.17 H new ATOM 0 HB ILE A 163 6.403 8.094 5.895 1.00 0.17 H new ATOM 0 HG12 ILE A 163 4.601 6.088 7.300 1.00 0.18 H new ATOM 0 HG13 ILE A 163 4.494 7.831 7.439 1.00 0.18 H new ATOM 0 HG21 ILE A 163 6.061 6.071 4.547 1.00 0.20 H new ATOM 0 HG22 ILE A 163 7.718 6.152 5.191 1.00 0.20 H new ATOM 0 HG23 ILE A 163 6.525 5.063 5.938 1.00 0.20 H new ATOM 0 HD11 ILE A 163 2.800 6.969 5.907 1.00 0.21 H new ATOM 0 HD12 ILE A 163 3.959 8.003 5.039 1.00 0.21 H new ATOM 0 HD13 ILE A 163 4.068 6.233 4.897 1.00 0.21 H new ATOM 2406 N GLU A 164 8.995 8.489 7.147 1.00 0.19 N ATOM 2407 CA GLU A 164 10.366 8.791 6.742 1.00 0.22 C ATOM 2408 C GLU A 164 11.391 8.198 7.696 1.00 0.23 C ATOM 2409 O GLU A 164 12.411 7.672 7.257 1.00 0.24 O ATOM 2410 CB GLU A 164 10.594 10.303 6.648 1.00 0.27 C ATOM 2411 CG GLU A 164 9.824 10.989 5.534 1.00 0.33 C ATOM 2412 CD GLU A 164 10.050 12.489 5.518 1.00 0.44 C ATOM 2413 OE1 GLU A 164 11.035 12.944 4.901 1.00 0.73 O ATOM 2414 OE2 GLU A 164 9.243 13.221 6.122 1.00 0.88 O ATOM 0 H GLU A 164 8.406 9.313 7.268 1.00 0.19 H new ATOM 0 HA GLU A 164 10.500 8.337 5.760 1.00 0.22 H new ATOM 0 HB2 GLU A 164 10.316 10.759 7.598 1.00 0.27 H new ATOM 0 HB3 GLU A 164 11.658 10.489 6.504 1.00 0.27 H new ATOM 0 HG2 GLU A 164 10.125 10.568 4.575 1.00 0.33 H new ATOM 0 HG3 GLU A 164 8.760 10.785 5.652 1.00 0.33 H new ATOM 2421 N GLU A 165 11.120 8.267 8.996 1.00 0.24 N ATOM 2422 CA GLU A 165 12.066 7.773 9.995 1.00 0.27 C ATOM 2423 C GLU A 165 12.383 6.294 9.786 1.00 0.27 C ATOM 2424 O GLU A 165 13.463 5.824 10.143 1.00 0.35 O ATOM 2425 CB GLU A 165 11.528 7.978 11.407 1.00 0.33 C ATOM 2426 CG GLU A 165 10.111 7.490 11.603 1.00 0.41 C ATOM 2427 CD GLU A 165 9.764 7.335 13.064 1.00 0.58 C ATOM 2428 OE1 GLU A 165 9.440 8.345 13.716 1.00 0.75 O ATOM 2429 OE2 GLU A 165 9.832 6.198 13.571 1.00 0.71 O ATOM 0 H GLU A 165 10.260 8.657 9.382 1.00 0.24 H new ATOM 0 HA GLU A 165 12.984 8.348 9.873 1.00 0.27 H new ATOM 0 HB2 GLU A 165 12.180 7.461 12.111 1.00 0.33 H new ATOM 0 HB3 GLU A 165 11.573 9.039 11.651 1.00 0.33 H new ATOM 0 HG2 GLU A 165 9.418 8.192 11.138 1.00 0.41 H new ATOM 0 HG3 GLU A 165 9.984 6.533 11.096 1.00 0.41 H new ATOM 2436 N LYS A 166 11.437 5.573 9.205 1.00 0.22 N ATOM 2437 CA LYS A 166 11.595 4.147 8.970 1.00 0.23 C ATOM 2438 C LYS A 166 11.891 3.874 7.499 1.00 0.20 C ATOM 2439 O LYS A 166 12.305 2.780 7.124 1.00 0.25 O ATOM 2440 CB LYS A 166 10.332 3.423 9.398 1.00 0.27 C ATOM 2441 CG LYS A 166 9.982 3.658 10.854 1.00 0.46 C ATOM 2442 CD LYS A 166 8.992 2.630 11.338 1.00 0.77 C ATOM 2443 CE LYS A 166 8.652 2.818 12.808 1.00 1.05 C ATOM 2444 NZ LYS A 166 8.106 4.175 13.085 1.00 1.58 N ATOM 0 H LYS A 166 10.547 5.955 8.886 1.00 0.22 H new ATOM 0 HA LYS A 166 12.437 3.781 9.557 1.00 0.23 H new ATOM 0 HB2 LYS A 166 9.502 3.751 8.773 1.00 0.27 H new ATOM 0 HB3 LYS A 166 10.457 2.354 9.228 1.00 0.27 H new ATOM 0 HG2 LYS A 166 10.886 3.614 11.462 1.00 0.46 H new ATOM 0 HG3 LYS A 166 9.564 4.657 10.976 1.00 0.46 H new ATOM 0 HD2 LYS A 166 8.081 2.695 10.743 1.00 0.77 H new ATOM 0 HD3 LYS A 166 9.401 1.631 11.185 1.00 0.77 H new ATOM 0 HE2 LYS A 166 7.924 2.066 13.111 1.00 1.05 H new ATOM 0 HE3 LYS A 166 9.546 2.657 13.410 1.00 1.05 H new ATOM 0 HZ1 LYS A 166 7.315 4.101 13.756 1.00 1.58 H new ATOM 0 HZ2 LYS A 166 8.852 4.772 13.495 1.00 1.58 H new ATOM 0 HZ3 LYS A 166 7.769 4.601 12.198 1.00 1.58 H new ATOM 2458 N LEU A 167 11.689 4.892 6.676 1.00 0.18 N ATOM 2459 CA LEU A 167 11.817 4.757 5.233 1.00 0.18 C ATOM 2460 C LEU A 167 13.217 5.130 4.758 1.00 0.18 C ATOM 2461 O LEU A 167 13.785 4.457 3.902 1.00 0.19 O ATOM 2462 CB LEU A 167 10.778 5.641 4.540 1.00 0.19 C ATOM 2463 CG LEU A 167 10.799 5.608 3.013 1.00 0.20 C ATOM 2464 CD1 LEU A 167 10.518 4.202 2.507 1.00 0.23 C ATOM 2465 CD2 LEU A 167 9.791 6.599 2.452 1.00 0.24 C ATOM 0 H LEU A 167 11.433 5.829 6.987 1.00 0.18 H new ATOM 0 HA LEU A 167 11.644 3.712 4.974 1.00 0.18 H new ATOM 0 HB2 LEU A 167 9.787 5.340 4.879 1.00 0.19 H new ATOM 0 HB3 LEU A 167 10.927 6.670 4.866 1.00 0.19 H new ATOM 0 HG LEU A 167 11.792 5.898 2.669 1.00 0.20 H new ATOM 0 HD11 LEU A 167 10.537 4.197 1.417 1.00 0.23 H new ATOM 0 HD12 LEU A 167 11.279 3.520 2.886 1.00 0.23 H new ATOM 0 HD13 LEU A 167 9.536 3.880 2.854 1.00 0.23 H new ATOM 0 HD21 LEU A 167 9.816 6.566 1.363 1.00 0.24 H new ATOM 0 HD22 LEU A 167 8.792 6.338 2.800 1.00 0.24 H new ATOM 0 HD23 LEU A 167 10.042 7.604 2.790 1.00 0.24 H new ATOM 2477 N ILE A 168 13.765 6.205 5.317 1.00 0.21 N ATOM 2478 CA ILE A 168 15.078 6.713 4.913 1.00 0.25 C ATOM 2479 C ILE A 168 16.169 5.630 4.964 1.00 0.26 C ATOM 2480 O ILE A 168 16.920 5.472 3.996 1.00 0.28 O ATOM 2481 CB ILE A 168 15.501 7.938 5.761 1.00 0.32 C ATOM 2482 CG1 ILE A 168 14.517 9.094 5.539 1.00 0.35 C ATOM 2483 CG2 ILE A 168 16.921 8.374 5.417 1.00 0.39 C ATOM 2484 CD1 ILE A 168 14.812 10.316 6.384 1.00 0.44 C ATOM 0 H ILE A 168 13.318 6.747 6.057 1.00 0.21 H new ATOM 0 HA ILE A 168 14.974 7.028 3.875 1.00 0.25 H new ATOM 0 HB ILE A 168 15.482 7.653 6.813 1.00 0.32 H new ATOM 0 HG12 ILE A 168 14.535 9.378 4.487 1.00 0.35 H new ATOM 0 HG13 ILE A 168 13.507 8.747 5.758 1.00 0.35 H new ATOM 0 HG21 ILE A 168 17.195 9.236 6.026 1.00 0.39 H new ATOM 0 HG22 ILE A 168 17.612 7.555 5.617 1.00 0.39 H new ATOM 0 HG23 ILE A 168 16.973 8.644 4.362 1.00 0.39 H new ATOM 0 HD11 ILE A 168 14.075 11.091 6.173 1.00 0.44 H new ATOM 0 HD12 ILE A 168 14.765 10.048 7.440 1.00 0.44 H new ATOM 0 HD13 ILE A 168 15.809 10.689 6.149 1.00 0.44 H new ATOM 2496 N PRO A 169 16.285 4.868 6.076 1.00 0.29 N ATOM 2497 CA PRO A 169 17.252 3.765 6.171 1.00 0.34 C ATOM 2498 C PRO A 169 17.044 2.691 5.098 1.00 0.35 C ATOM 2499 O PRO A 169 17.968 1.949 4.772 1.00 0.48 O ATOM 2500 CB PRO A 169 16.999 3.172 7.557 1.00 0.39 C ATOM 2501 CG PRO A 169 16.344 4.261 8.330 1.00 0.49 C ATOM 2502 CD PRO A 169 15.532 5.035 7.336 1.00 0.31 C ATOM 0 HA PRO A 169 18.270 4.124 6.020 1.00 0.34 H new ATOM 0 HB2 PRO A 169 16.360 2.291 7.498 1.00 0.39 H new ATOM 0 HB3 PRO A 169 17.931 2.859 8.028 1.00 0.39 H new ATOM 0 HG2 PRO A 169 15.712 3.855 9.120 1.00 0.49 H new ATOM 0 HG3 PRO A 169 17.085 4.899 8.811 1.00 0.49 H new ATOM 0 HD2 PRO A 169 14.518 4.643 7.253 1.00 0.31 H new ATOM 0 HD3 PRO A 169 15.446 6.085 7.617 1.00 0.31 H new ATOM 2510 N LEU A 170 15.833 2.608 4.552 1.00 0.27 N ATOM 2511 CA LEU A 170 15.530 1.614 3.525 1.00 0.29 C ATOM 2512 C LEU A 170 15.845 2.159 2.137 1.00 0.29 C ATOM 2513 O LEU A 170 16.335 1.428 1.273 1.00 0.37 O ATOM 2514 CB LEU A 170 14.062 1.189 3.585 1.00 0.29 C ATOM 2515 CG LEU A 170 13.606 0.577 4.909 1.00 0.38 C ATOM 2516 CD1 LEU A 170 12.160 0.128 4.808 1.00 0.60 C ATOM 2517 CD2 LEU A 170 14.496 -0.591 5.303 1.00 0.71 C ATOM 0 H LEU A 170 15.050 3.213 4.801 1.00 0.27 H new ATOM 0 HA LEU A 170 16.156 0.743 3.718 1.00 0.29 H new ATOM 0 HB2 LEU A 170 13.441 2.060 3.375 1.00 0.29 H new ATOM 0 HB3 LEU A 170 13.878 0.467 2.789 1.00 0.29 H new ATOM 0 HG LEU A 170 13.685 1.340 5.683 1.00 0.38 H new ATOM 0 HD11 LEU A 170 11.847 -0.306 5.757 1.00 0.60 H new ATOM 0 HD12 LEU A 170 11.528 0.985 4.575 1.00 0.60 H new ATOM 0 HD13 LEU A 170 12.065 -0.618 4.019 1.00 0.60 H new ATOM 0 HD21 LEU A 170 14.150 -1.009 6.249 1.00 0.71 H new ATOM 0 HD22 LEU A 170 14.453 -1.358 4.530 1.00 0.71 H new ATOM 0 HD23 LEU A 170 15.524 -0.244 5.413 1.00 0.71 H new ATOM 2529 N LEU A 171 15.542 3.440 1.927 1.00 0.25 N ATOM 2530 CA LEU A 171 15.852 4.113 0.666 1.00 0.28 C ATOM 2531 C LEU A 171 17.336 4.008 0.396 1.00 0.34 C ATOM 2532 O LEU A 171 17.767 3.548 -0.664 1.00 0.46 O ATOM 2533 CB LEU A 171 15.446 5.586 0.729 1.00 0.29 C ATOM 2534 CG LEU A 171 14.035 5.835 1.245 1.00 0.30 C ATOM 2535 CD1 LEU A 171 13.857 7.285 1.632 1.00 0.45 C ATOM 2536 CD2 LEU A 171 13.011 5.453 0.197 1.00 0.40 C ATOM 0 H LEU A 171 15.081 4.034 2.616 1.00 0.25 H new ATOM 0 HA LEU A 171 15.293 3.632 -0.137 1.00 0.28 H new ATOM 0 HB2 LEU A 171 16.151 6.116 1.369 1.00 0.29 H new ATOM 0 HB3 LEU A 171 15.535 6.016 -0.268 1.00 0.29 H new ATOM 0 HG LEU A 171 13.884 5.215 2.129 1.00 0.30 H new ATOM 0 HD11 LEU A 171 12.842 7.442 1.998 1.00 0.45 H new ATOM 0 HD12 LEU A 171 14.569 7.542 2.416 1.00 0.45 H new ATOM 0 HD13 LEU A 171 14.031 7.918 0.762 1.00 0.45 H new ATOM 0 HD21 LEU A 171 12.009 5.638 0.583 1.00 0.40 H new ATOM 0 HD22 LEU A 171 13.169 6.050 -0.701 1.00 0.40 H new ATOM 0 HD23 LEU A 171 13.117 4.396 -0.047 1.00 0.40 H new ATOM 2548 N GLY A 172 18.104 4.430 1.382 1.00 0.32 N ATOM 2549 CA GLY A 172 19.544 4.297 1.329 1.00 0.44 C ATOM 2550 C GLY A 172 20.039 2.869 1.558 1.00 0.71 C ATOM 2551 O GLY A 172 20.906 2.645 2.401 1.00 1.52 O ATOM 0 H GLY A 172 17.751 4.869 2.232 1.00 0.32 H new ATOM 0 HA2 GLY A 172 19.896 4.643 0.357 1.00 0.44 H new ATOM 0 HA3 GLY A 172 19.988 4.951 2.080 1.00 0.44 H new ATOM 2555 N SER A 173 19.480 1.912 0.798 1.00 0.74 N ATOM 2556 CA SER A 173 19.911 0.503 0.815 1.00 0.92 C ATOM 2557 C SER A 173 19.552 -0.209 2.128 1.00 1.29 C ATOM 2558 O SER A 173 20.121 0.082 3.182 1.00 1.88 O ATOM 2559 CB SER A 173 21.419 0.406 0.557 1.00 1.67 C ATOM 2560 OG SER A 173 21.782 1.138 -0.605 1.00 2.52 O ATOM 0 H SER A 173 18.713 2.095 0.151 1.00 0.74 H new ATOM 0 HA SER A 173 19.370 -0.005 0.017 1.00 0.92 H new ATOM 0 HB2 SER A 173 21.965 0.790 1.419 1.00 1.67 H new ATOM 0 HB3 SER A 173 21.705 -0.639 0.438 1.00 1.67 H new ATOM 0 HG SER A 173 22.748 1.064 -0.750 1.00 2.52 H new