USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1666 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 85 LYS NZ :NH3+ 156:sc= -0.149 (180deg=-0.827) USER MOD Set 1.2: B 74 ASN : amide:sc= -0.0038 X(o=-0.15,f=-0.41) USER MOD Set 2.1: A 15 THR OG1 : rot -79:sc= 1.38 USER MOD Set 2.2: B 12 SER OG : rot -110:sc= 0.481 USER MOD Set 3.1: A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 72 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0437) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 171:sc= 0.232 (180deg=0.201) USER MOD Single : A 7 THR OG1 : rot 98:sc= 1.2 USER MOD Single : A 12 SER OG : rot 62:sc= 0.653 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 67:sc= 1.21 USER MOD Single : A 22 THR OG1 : rot 76:sc= 0.158 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 170:sc= -0.132 USER MOD Single : A 34 SER OG : rot -170:sc= -0.459 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc=-0.00163 X(o=-0.0016,f=-0.37) USER MOD Single : A 48 HIS : no HD1:sc=-0.00231 X(o=-0.0023,f=-0.29) USER MOD Single : A 51 LYS NZ :NH3+ 168:sc= -0.0259 (180deg=-0.179) USER MOD Single : A 55 SER OG : rot 15:sc= 0.835 USER MOD Single : A 59 LYS NZ :NH3+ -138:sc= 0.207 (180deg=0) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 88:sc= 0.0421 USER MOD Single : A 66 ASN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 SER OG : rot -96:sc= 0.294 USER MOD Single : A 72 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.0477) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0.17) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00915) USER MOD Single : A 94 LYS NZ :NH3+ 169:sc= -0.0043 (180deg=-0.102) USER MOD Single : A 97 LYS NZ :NH3+ -116:sc= -0.29 (180deg=-1.93!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 168:sc= 0.449 (180deg=0.271) USER MOD Single : B 7 THR OG1 : rot 83:sc= 0.841 USER MOD Single : B 15 THR OG1 : rot 74:sc= 1.14 USER MOD Single : B 18 THR OG1 : rot -140:sc= 0.753 USER MOD Single : B 19 THR OG1 : rot 66:sc= 1.29 USER MOD Single : B 22 THR OG1 : rot 180:sc=0.000125 USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 160:sc= -0.469 USER MOD Single : B 34 SER OG : rot -150:sc=-0.00655 USER MOD Single : B 36 ASN : amide:sc= -0.0823 K(o=-0.082,f=-0.9) USER MOD Single : B 39 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00224) USER MOD Single : B 43 THR OG1 : rot 77:sc= 0.58 USER MOD Single : B 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 45 GLN : amide:sc= -0.0519 K(o=-0.052,f=-3!) USER MOD Single : B 48 HIS : no HD1:sc= 0 X(o=0,f=-0.16) USER MOD Single : B 51 LYS NZ :NH3+ -178:sc= 1.15 (180deg=1.15) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 59 LYS NZ :NH3+ 153:sc= 0.404 (180deg=0.142) USER MOD Single : B 60 MET CE :methyl 176:sc= 0 (180deg=-0.0112) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 76 TYR OH : rot 180:sc= -0.0266 USER MOD Single : B 85 LYS NZ :NH3+ 171:sc= 0.0179 (180deg=-0.0377) USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ -179:sc= 0.71 (180deg=0.709) USER MOD Single : B 91 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.139) USER MOD Single : B 94 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00401) USER MOD Single : B 97 LYS NZ :NH3+ 155:sc= -0.395 (180deg=-1.37) USER MOD Single : B 98 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00955) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.040 17.248 6.368 1.00 1.04 N ATOM 2 CA MET A 1 7.556 15.844 6.285 1.00 0.91 C ATOM 3 C MET A 1 7.769 15.253 7.694 1.00 0.73 C ATOM 4 O MET A 1 8.880 15.282 8.236 1.00 0.96 O ATOM 5 CB MET A 1 8.849 15.761 5.425 1.00 1.31 C ATOM 6 CG MET A 1 9.895 16.846 5.706 1.00 1.57 C ATOM 7 SD MET A 1 11.405 16.636 4.734 1.00 2.18 S ATOM 8 CE MET A 1 12.241 18.188 5.051 1.00 2.71 C ATOM 0 H1 MET A 1 7.048 17.677 5.421 1.00 1.04 H new ATOM 0 H2 MET A 1 6.067 17.239 6.736 1.00 1.04 H new ATOM 0 H3 MET A 1 7.646 17.803 7.005 1.00 1.04 H new ATOM 0 HA MET A 1 6.801 15.239 5.783 1.00 0.91 H new ATOM 0 HB2 MET A 1 9.309 14.786 5.585 1.00 1.31 H new ATOM 0 HB3 MET A 1 8.569 15.813 4.373 1.00 1.31 H new ATOM 0 HG2 MET A 1 9.464 17.824 5.491 1.00 1.57 H new ATOM 0 HG3 MET A 1 10.147 16.835 6.766 1.00 1.57 H new ATOM 0 HE1 MET A 1 13.191 18.206 4.516 1.00 2.71 H new ATOM 0 HE2 MET A 1 11.617 19.014 4.709 1.00 2.71 H new ATOM 0 HE3 MET A 1 12.425 18.290 6.120 1.00 2.71 H new ATOM 20 N ALA A 2 6.671 14.747 8.293 1.00 0.77 N ATOM 21 CA ALA A 2 6.695 14.142 9.639 1.00 0.71 C ATOM 22 C ALA A 2 5.508 13.186 9.827 1.00 0.59 C ATOM 23 O ALA A 2 4.379 13.522 9.449 1.00 0.68 O ATOM 24 CB ALA A 2 6.671 15.223 10.718 1.00 1.02 C ATOM 0 H ALA A 2 5.748 14.747 7.859 1.00 0.77 H new ATOM 0 HA ALA A 2 7.620 13.573 9.735 1.00 0.71 H new ATOM 0 HB1 ALA A 2 6.689 14.755 11.702 1.00 1.02 H new ATOM 0 HB2 ALA A 2 7.543 15.868 10.607 1.00 1.02 H new ATOM 0 HB3 ALA A 2 5.764 15.819 10.616 1.00 1.02 H new ATOM 30 N ALA A 3 5.759 12.005 10.421 1.00 0.56 N ATOM 31 CA ALA A 3 4.706 10.997 10.648 1.00 0.54 C ATOM 32 C ALA A 3 4.129 11.086 12.075 1.00 0.55 C ATOM 33 O ALA A 3 4.874 11.014 13.059 1.00 0.70 O ATOM 34 CB ALA A 3 5.253 9.598 10.366 1.00 0.66 C ATOM 0 H ALA A 3 6.682 11.725 10.753 1.00 0.56 H new ATOM 0 HA ALA A 3 3.887 11.202 9.958 1.00 0.54 H new ATOM 0 HB1 ALA A 3 4.469 8.860 10.536 1.00 0.66 H new ATOM 0 HB2 ALA A 3 5.588 9.540 9.330 1.00 0.66 H new ATOM 0 HB3 ALA A 3 6.093 9.395 11.030 1.00 0.66 H new ATOM 40 N GLU A 4 2.790 11.259 12.166 1.00 0.52 N ATOM 41 CA GLU A 4 2.064 11.352 13.449 1.00 0.55 C ATOM 42 C GLU A 4 0.788 10.472 13.401 1.00 0.52 C ATOM 43 O GLU A 4 0.055 10.521 12.409 1.00 0.50 O ATOM 44 CB GLU A 4 1.688 12.824 13.729 1.00 0.61 C ATOM 45 CG GLU A 4 1.111 13.080 15.126 1.00 0.74 C ATOM 46 CD GLU A 4 0.512 14.468 15.281 1.00 0.86 C ATOM 47 OE1 GLU A 4 1.256 15.399 15.656 1.00 1.02 O ATOM 48 OE2 GLU A 4 -0.705 14.620 15.034 1.00 0.94 O ATOM 0 H GLU A 4 2.184 11.338 11.349 1.00 0.52 H new ATOM 0 HA GLU A 4 2.707 10.991 14.252 1.00 0.55 H new ATOM 0 HB2 GLU A 4 2.575 13.443 13.598 1.00 0.61 H new ATOM 0 HB3 GLU A 4 0.960 13.147 12.985 1.00 0.61 H new ATOM 0 HG2 GLU A 4 0.344 12.335 15.338 1.00 0.74 H new ATOM 0 HG3 GLU A 4 1.899 12.946 15.868 1.00 0.74 H new ATOM 55 N PRO A 5 0.489 9.655 14.465 1.00 0.57 N ATOM 56 CA PRO A 5 -0.709 8.786 14.485 1.00 0.59 C ATOM 57 C PRO A 5 -2.013 9.553 14.800 1.00 0.53 C ATOM 58 O PRO A 5 -1.989 10.540 15.547 1.00 0.59 O ATOM 59 CB PRO A 5 -0.378 7.778 15.594 1.00 0.74 C ATOM 60 CG PRO A 5 0.482 8.534 16.548 1.00 0.73 C ATOM 61 CD PRO A 5 1.288 9.498 15.713 1.00 0.67 C ATOM 0 HA PRO A 5 -0.902 8.332 13.513 1.00 0.59 H new ATOM 0 HB2 PRO A 5 -1.283 7.413 16.080 1.00 0.74 H new ATOM 0 HB3 PRO A 5 0.143 6.908 15.195 1.00 0.74 H new ATOM 0 HG2 PRO A 5 -0.124 9.066 17.281 1.00 0.73 H new ATOM 0 HG3 PRO A 5 1.134 7.860 17.103 1.00 0.73 H new ATOM 0 HD2 PRO A 5 1.422 10.452 16.223 1.00 0.67 H new ATOM 0 HD3 PRO A 5 2.283 9.107 15.502 1.00 0.67 H new ATOM 69 N LEU A 6 -3.145 9.092 14.223 1.00 0.58 N ATOM 70 CA LEU A 6 -4.466 9.719 14.440 1.00 0.67 C ATOM 71 C LEU A 6 -5.569 8.640 14.593 1.00 0.71 C ATOM 72 O LEU A 6 -6.030 8.389 15.710 1.00 1.19 O ATOM 73 CB LEU A 6 -4.806 10.699 13.285 1.00 0.84 C ATOM 74 CG LEU A 6 -3.927 11.972 13.171 1.00 0.91 C ATOM 75 CD1 LEU A 6 -4.186 12.692 11.847 1.00 1.14 C ATOM 76 CD2 LEU A 6 -4.166 12.927 14.348 1.00 1.03 C ATOM 0 H LEU A 6 -3.169 8.284 13.601 1.00 0.58 H new ATOM 0 HA LEU A 6 -4.423 10.291 15.367 1.00 0.67 H new ATOM 0 HB2 LEU A 6 -4.738 10.153 12.344 1.00 0.84 H new ATOM 0 HB3 LEU A 6 -5.844 11.011 13.398 1.00 0.84 H new ATOM 0 HG LEU A 6 -2.885 11.654 13.201 1.00 0.91 H new ATOM 0 HD11 LEU A 6 -3.559 13.582 11.788 1.00 1.14 H new ATOM 0 HD12 LEU A 6 -3.949 12.025 11.018 1.00 1.14 H new ATOM 0 HD13 LEU A 6 -5.235 12.983 11.790 1.00 1.14 H new ATOM 0 HD21 LEU A 6 -3.534 13.808 14.236 1.00 1.03 H new ATOM 0 HD22 LEU A 6 -5.213 13.231 14.363 1.00 1.03 H new ATOM 0 HD23 LEU A 6 -3.921 12.421 15.282 1.00 1.03 H new ATOM 88 N THR A 7 -5.976 8.005 13.469 1.00 0.52 N ATOM 89 CA THR A 7 -7.013 6.948 13.463 1.00 0.52 C ATOM 90 C THR A 7 -6.347 5.562 13.302 1.00 0.49 C ATOM 91 O THR A 7 -5.167 5.492 12.961 1.00 0.56 O ATOM 92 CB THR A 7 -8.047 7.203 12.315 1.00 0.58 C ATOM 93 OG1 THR A 7 -8.380 8.598 12.265 1.00 0.98 O ATOM 94 CG2 THR A 7 -9.339 6.402 12.497 1.00 0.94 C ATOM 0 H THR A 7 -5.596 8.210 12.545 1.00 0.52 H new ATOM 0 HA THR A 7 -7.549 6.971 14.412 1.00 0.52 H new ATOM 0 HB THR A 7 -7.575 6.878 11.388 1.00 0.58 H new ATOM 0 HG1 THR A 7 -7.845 9.037 11.571 1.00 0.98 H new ATOM 0 HG21 THR A 7 -10.020 6.617 11.673 1.00 0.94 H new ATOM 0 HG22 THR A 7 -9.108 5.337 12.508 1.00 0.94 H new ATOM 0 HG23 THR A 7 -9.810 6.681 13.439 1.00 0.94 H new ATOM 102 N GLU A 8 -7.096 4.462 13.563 1.00 0.51 N ATOM 103 CA GLU A 8 -6.557 3.083 13.443 1.00 0.50 C ATOM 104 C GLU A 8 -5.971 2.804 12.040 1.00 0.46 C ATOM 105 O GLU A 8 -4.841 2.316 11.934 1.00 0.48 O ATOM 106 CB GLU A 8 -7.642 2.036 13.775 1.00 0.55 C ATOM 107 CG GLU A 8 -7.098 0.624 14.030 1.00 0.91 C ATOM 108 CD GLU A 8 -8.191 -0.398 14.293 1.00 0.95 C ATOM 109 OE1 GLU A 8 -8.662 -0.479 15.446 1.00 1.42 O ATOM 110 OE2 GLU A 8 -8.571 -1.121 13.347 1.00 1.14 O ATOM 0 H GLU A 8 -8.072 4.502 13.857 1.00 0.51 H new ATOM 0 HA GLU A 8 -5.746 3.001 14.166 1.00 0.50 H new ATOM 0 HB2 GLU A 8 -8.191 2.366 14.657 1.00 0.55 H new ATOM 0 HB3 GLU A 8 -8.355 1.995 12.952 1.00 0.55 H new ATOM 0 HG2 GLU A 8 -6.512 0.306 13.168 1.00 0.91 H new ATOM 0 HG3 GLU A 8 -6.421 0.651 14.884 1.00 0.91 H new ATOM 117 N LEU A 9 -6.742 3.108 10.971 1.00 0.45 N ATOM 118 CA LEU A 9 -6.278 2.889 9.584 1.00 0.44 C ATOM 119 C LEU A 9 -5.103 3.818 9.229 1.00 0.42 C ATOM 120 O LEU A 9 -4.208 3.414 8.479 1.00 0.43 O ATOM 121 CB LEU A 9 -7.433 3.053 8.574 1.00 0.48 C ATOM 122 CG LEU A 9 -8.514 1.943 8.608 1.00 0.56 C ATOM 123 CD1 LEU A 9 -9.663 2.276 7.658 1.00 0.65 C ATOM 124 CD2 LEU A 9 -7.926 0.569 8.259 1.00 0.65 C ATOM 0 H LEU A 9 -7.680 3.502 11.042 1.00 0.45 H new ATOM 0 HA LEU A 9 -5.920 1.861 9.521 1.00 0.44 H new ATOM 0 HB2 LEU A 9 -7.917 4.013 8.755 1.00 0.48 H new ATOM 0 HB3 LEU A 9 -7.011 3.094 7.570 1.00 0.48 H new ATOM 0 HG LEU A 9 -8.898 1.897 9.627 1.00 0.56 H new ATOM 0 HD11 LEU A 9 -10.410 1.483 7.698 1.00 0.65 H new ATOM 0 HD12 LEU A 9 -10.119 3.220 7.956 1.00 0.65 H new ATOM 0 HD13 LEU A 9 -9.281 2.363 6.641 1.00 0.65 H new ATOM 0 HD21 LEU A 9 -8.714 -0.183 8.293 1.00 0.65 H new ATOM 0 HD22 LEU A 9 -7.498 0.600 7.257 1.00 0.65 H new ATOM 0 HD23 LEU A 9 -7.148 0.313 8.978 1.00 0.65 H new ATOM 136 N GLU A 10 -5.113 5.061 9.761 1.00 0.42 N ATOM 137 CA GLU A 10 -4.011 6.019 9.534 1.00 0.44 C ATOM 138 C GLU A 10 -2.749 5.563 10.291 1.00 0.44 C ATOM 139 O GLU A 10 -1.640 5.687 9.774 1.00 0.48 O ATOM 140 CB GLU A 10 -4.395 7.440 9.985 1.00 0.49 C ATOM 141 CG GLU A 10 -5.593 8.036 9.244 1.00 0.54 C ATOM 142 CD GLU A 10 -5.844 9.495 9.599 1.00 0.63 C ATOM 143 OE1 GLU A 10 -5.036 10.357 9.187 1.00 1.03 O ATOM 144 OE2 GLU A 10 -6.844 9.778 10.288 1.00 0.96 O ATOM 0 H GLU A 10 -5.867 5.421 10.346 1.00 0.42 H new ATOM 0 HA GLU A 10 -3.810 6.043 8.463 1.00 0.44 H new ATOM 0 HB2 GLU A 10 -4.616 7.422 11.052 1.00 0.49 H new ATOM 0 HB3 GLU A 10 -3.535 8.096 9.848 1.00 0.49 H new ATOM 0 HG2 GLU A 10 -5.428 7.952 8.170 1.00 0.54 H new ATOM 0 HG3 GLU A 10 -6.484 7.453 9.476 1.00 0.54 H new ATOM 151 N GLU A 11 -2.936 5.023 11.520 1.00 0.44 N ATOM 152 CA GLU A 11 -1.826 4.519 12.351 1.00 0.46 C ATOM 153 C GLU A 11 -1.177 3.273 11.713 1.00 0.45 C ATOM 154 O GLU A 11 0.020 3.048 11.895 1.00 0.47 O ATOM 155 CB GLU A 11 -2.304 4.206 13.784 1.00 0.52 C ATOM 156 CG GLU A 11 -1.165 4.011 14.786 1.00 0.61 C ATOM 157 CD GLU A 11 -1.652 3.847 16.215 1.00 0.69 C ATOM 158 OE1 GLU A 11 -1.846 4.877 16.894 1.00 0.79 O ATOM 159 OE2 GLU A 11 -1.831 2.693 16.655 1.00 0.81 O ATOM 0 H GLU A 11 -3.853 4.927 11.956 1.00 0.44 H new ATOM 0 HA GLU A 11 -1.072 5.305 12.407 1.00 0.46 H new ATOM 0 HB2 GLU A 11 -2.944 5.018 14.129 1.00 0.52 H new ATOM 0 HB3 GLU A 11 -2.916 3.304 13.764 1.00 0.52 H new ATOM 0 HG2 GLU A 11 -0.586 3.132 14.502 1.00 0.61 H new ATOM 0 HG3 GLU A 11 -0.492 4.867 14.734 1.00 0.61 H new ATOM 166 N SER A 12 -1.971 2.467 10.966 1.00 0.45 N ATOM 167 CA SER A 12 -1.456 1.267 10.279 1.00 0.47 C ATOM 168 C SER A 12 -0.434 1.659 9.197 1.00 0.44 C ATOM 169 O SER A 12 0.621 1.040 9.091 1.00 0.49 O ATOM 170 CB SER A 12 -2.601 0.455 9.648 1.00 0.52 C ATOM 171 OG SER A 12 -3.538 0.037 10.629 1.00 0.63 O ATOM 0 H SER A 12 -2.968 2.630 10.827 1.00 0.45 H new ATOM 0 HA SER A 12 -0.962 0.644 11.025 1.00 0.47 H new ATOM 0 HB2 SER A 12 -3.106 1.059 8.894 1.00 0.52 H new ATOM 0 HB3 SER A 12 -2.193 -0.417 9.137 1.00 0.52 H new ATOM 0 HG SER A 12 -3.939 0.823 11.055 1.00 0.63 H new ATOM 177 N ILE A 13 -0.754 2.708 8.409 1.00 0.42 N ATOM 178 CA ILE A 13 0.145 3.200 7.343 1.00 0.43 C ATOM 179 C ILE A 13 1.196 4.205 7.880 1.00 0.41 C ATOM 180 O ILE A 13 2.153 4.532 7.174 1.00 0.46 O ATOM 181 CB ILE A 13 -0.635 3.831 6.126 1.00 0.47 C ATOM 182 CG1 ILE A 13 -1.621 4.968 6.542 1.00 0.46 C ATOM 183 CG2 ILE A 13 -1.384 2.738 5.345 1.00 0.56 C ATOM 184 CD1 ILE A 13 -0.973 6.316 6.821 1.00 0.44 C ATOM 0 H ILE A 13 -1.627 3.230 8.491 1.00 0.42 H new ATOM 0 HA ILE A 13 0.669 2.317 6.978 1.00 0.43 H new ATOM 0 HB ILE A 13 0.118 4.292 5.486 1.00 0.47 H new ATOM 0 HG12 ILE A 13 -2.360 5.095 5.750 1.00 0.46 H new ATOM 0 HG13 ILE A 13 -2.161 4.651 7.434 1.00 0.46 H new ATOM 0 HG21 ILE A 13 -1.917 3.189 4.508 1.00 0.56 H new ATOM 0 HG22 ILE A 13 -0.670 2.006 4.968 1.00 0.56 H new ATOM 0 HG23 ILE A 13 -2.096 2.243 6.005 1.00 0.56 H new ATOM 0 HD11 ILE A 13 -1.740 7.037 7.102 1.00 0.44 H new ATOM 0 HD12 ILE A 13 -0.256 6.213 7.636 1.00 0.44 H new ATOM 0 HD13 ILE A 13 -0.458 6.664 5.926 1.00 0.44 H new ATOM 196 N GLU A 14 1.008 4.690 9.130 1.00 0.39 N ATOM 197 CA GLU A 14 1.928 5.646 9.771 1.00 0.40 C ATOM 198 C GLU A 14 3.055 4.903 10.518 1.00 0.41 C ATOM 199 O GLU A 14 4.214 5.320 10.448 1.00 0.44 O ATOM 200 CB GLU A 14 1.130 6.569 10.721 1.00 0.43 C ATOM 201 CG GLU A 14 1.925 7.702 11.382 1.00 0.52 C ATOM 202 CD GLU A 14 2.619 7.309 12.682 1.00 0.61 C ATOM 203 OE1 GLU A 14 2.200 6.318 13.320 1.00 0.93 O ATOM 204 OE2 GLU A 14 3.577 8.009 13.068 1.00 1.00 O ATOM 0 H GLU A 14 0.216 4.428 9.717 1.00 0.39 H new ATOM 0 HA GLU A 14 2.401 6.261 9.006 1.00 0.40 H new ATOM 0 HB2 GLU A 14 0.306 7.009 10.160 1.00 0.43 H new ATOM 0 HB3 GLU A 14 0.689 5.955 11.506 1.00 0.43 H new ATOM 0 HG2 GLU A 14 2.675 8.062 10.678 1.00 0.52 H new ATOM 0 HG3 GLU A 14 1.250 8.534 11.582 1.00 0.52 H new ATOM 211 N THR A 15 2.709 3.800 11.225 1.00 0.42 N ATOM 212 CA THR A 15 3.700 2.985 11.967 1.00 0.45 C ATOM 213 C THR A 15 4.744 2.347 11.025 1.00 0.43 C ATOM 214 O THR A 15 5.880 2.112 11.441 1.00 0.45 O ATOM 215 CB THR A 15 3.025 1.873 12.820 1.00 0.50 C ATOM 216 OG1 THR A 15 2.086 1.135 12.025 1.00 0.65 O ATOM 217 CG2 THR A 15 2.311 2.462 14.034 1.00 0.77 C ATOM 0 H THR A 15 1.752 3.455 11.297 1.00 0.42 H new ATOM 0 HA THR A 15 4.209 3.676 12.639 1.00 0.45 H new ATOM 0 HB THR A 15 3.811 1.204 13.171 1.00 0.50 H new ATOM 0 HG1 THR A 15 1.257 1.650 11.936 1.00 0.65 H new ATOM 0 HG21 THR A 15 1.850 1.660 14.610 1.00 0.77 H new ATOM 0 HG22 THR A 15 3.031 2.989 14.659 1.00 0.77 H new ATOM 0 HG23 THR A 15 1.541 3.158 13.701 1.00 0.77 H new ATOM 225 N VAL A 16 4.352 2.066 9.761 1.00 0.41 N ATOM 226 CA VAL A 16 5.276 1.497 8.749 1.00 0.42 C ATOM 227 C VAL A 16 6.392 2.521 8.418 1.00 0.42 C ATOM 228 O VAL A 16 7.507 2.131 8.056 1.00 0.46 O ATOM 229 CB VAL A 16 4.522 1.086 7.427 1.00 0.44 C ATOM 230 CG1 VAL A 16 5.476 0.509 6.362 1.00 0.50 C ATOM 231 CG2 VAL A 16 3.400 0.085 7.721 1.00 0.49 C ATOM 0 H VAL A 16 3.405 2.223 9.417 1.00 0.41 H new ATOM 0 HA VAL A 16 5.715 0.595 9.175 1.00 0.42 H new ATOM 0 HB VAL A 16 4.087 2.000 7.022 1.00 0.44 H new ATOM 0 HG11 VAL A 16 4.908 0.241 5.471 1.00 0.50 H new ATOM 0 HG12 VAL A 16 6.227 1.256 6.103 1.00 0.50 H new ATOM 0 HG13 VAL A 16 5.969 -0.379 6.758 1.00 0.50 H new ATOM 0 HG21 VAL A 16 2.897 -0.181 6.791 1.00 0.49 H new ATOM 0 HG22 VAL A 16 3.822 -0.812 8.175 1.00 0.49 H new ATOM 0 HG23 VAL A 16 2.682 0.535 8.406 1.00 0.49 H new ATOM 241 N VAL A 17 6.077 3.830 8.553 1.00 0.42 N ATOM 242 CA VAL A 17 7.035 4.912 8.284 1.00 0.47 C ATOM 243 C VAL A 17 7.970 5.131 9.500 1.00 0.55 C ATOM 244 O VAL A 17 9.164 4.875 9.406 1.00 0.95 O ATOM 245 CB VAL A 17 6.294 6.247 7.899 1.00 0.51 C ATOM 246 CG1 VAL A 17 7.270 7.385 7.564 1.00 0.60 C ATOM 247 CG2 VAL A 17 5.330 6.018 6.725 1.00 0.52 C ATOM 0 H VAL A 17 5.158 4.158 8.849 1.00 0.42 H new ATOM 0 HA VAL A 17 7.646 4.614 7.432 1.00 0.47 H new ATOM 0 HB VAL A 17 5.725 6.552 8.777 1.00 0.51 H new ATOM 0 HG11 VAL A 17 6.708 8.282 7.305 1.00 0.60 H new ATOM 0 HG12 VAL A 17 7.902 7.589 8.429 1.00 0.60 H new ATOM 0 HG13 VAL A 17 7.894 7.092 6.720 1.00 0.60 H new ATOM 0 HG21 VAL A 17 4.830 6.954 6.477 1.00 0.52 H new ATOM 0 HG22 VAL A 17 5.889 5.665 5.859 1.00 0.52 H new ATOM 0 HG23 VAL A 17 4.586 5.272 7.005 1.00 0.52 H new ATOM 257 N THR A 18 7.404 5.559 10.649 1.00 0.47 N ATOM 258 CA THR A 18 8.182 5.849 11.884 1.00 0.51 C ATOM 259 C THR A 18 9.116 4.709 12.350 1.00 0.51 C ATOM 260 O THR A 18 10.232 4.986 12.802 1.00 0.60 O ATOM 261 CB THR A 18 7.256 6.223 13.078 1.00 0.56 C ATOM 262 OG1 THR A 18 6.251 5.212 13.262 1.00 0.57 O ATOM 263 CG2 THR A 18 6.585 7.571 12.861 1.00 0.62 C ATOM 0 H THR A 18 6.401 5.714 10.752 1.00 0.47 H new ATOM 0 HA THR A 18 8.808 6.693 11.593 1.00 0.51 H new ATOM 0 HB THR A 18 7.879 6.289 13.970 1.00 0.56 H new ATOM 0 HG1 THR A 18 5.675 5.456 14.016 1.00 0.57 H new ATOM 0 HG21 THR A 18 5.946 7.801 13.714 1.00 0.62 H new ATOM 0 HG22 THR A 18 7.346 8.344 12.759 1.00 0.62 H new ATOM 0 HG23 THR A 18 5.981 7.535 11.954 1.00 0.62 H new ATOM 271 N THR A 19 8.669 3.443 12.246 1.00 0.49 N ATOM 272 CA THR A 19 9.471 2.285 12.715 1.00 0.53 C ATOM 273 C THR A 19 10.769 2.052 11.898 1.00 0.53 C ATOM 274 O THR A 19 11.779 1.637 12.477 1.00 0.62 O ATOM 275 CB THR A 19 8.618 0.976 12.748 1.00 0.55 C ATOM 276 OG1 THR A 19 7.387 1.219 13.444 1.00 0.56 O ATOM 277 CG2 THR A 19 9.349 -0.180 13.447 1.00 0.66 C ATOM 0 H THR A 19 7.765 3.192 11.846 1.00 0.49 H new ATOM 0 HA THR A 19 9.779 2.541 13.729 1.00 0.53 H new ATOM 0 HB THR A 19 8.433 0.689 11.713 1.00 0.55 H new ATOM 0 HG1 THR A 19 6.835 1.841 12.925 1.00 0.56 H new ATOM 0 HG21 THR A 19 8.715 -1.066 13.444 1.00 0.66 H new ATOM 0 HG22 THR A 19 10.277 -0.396 12.918 1.00 0.66 H new ATOM 0 HG23 THR A 19 9.574 0.101 14.476 1.00 0.66 H new ATOM 285 N PHE A 20 10.752 2.326 10.573 1.00 0.53 N ATOM 286 CA PHE A 20 11.938 2.101 9.711 1.00 0.57 C ATOM 287 C PHE A 20 12.588 3.403 9.175 1.00 0.57 C ATOM 288 O PHE A 20 13.756 3.363 8.773 1.00 0.89 O ATOM 289 CB PHE A 20 11.556 1.165 8.542 1.00 0.64 C ATOM 290 CG PHE A 20 12.734 0.709 7.694 1.00 0.71 C ATOM 291 CD1 PHE A 20 13.728 -0.105 8.231 1.00 0.83 C ATOM 292 CD2 PHE A 20 12.851 1.107 6.366 1.00 0.76 C ATOM 293 CE1 PHE A 20 14.804 -0.510 7.463 1.00 0.95 C ATOM 294 CE2 PHE A 20 13.925 0.703 5.599 1.00 0.86 C ATOM 295 CZ PHE A 20 14.902 -0.105 6.147 1.00 0.93 C ATOM 0 H PHE A 20 9.940 2.699 10.081 1.00 0.53 H new ATOM 0 HA PHE A 20 12.696 1.635 10.340 1.00 0.57 H new ATOM 0 HB2 PHE A 20 11.052 0.287 8.945 1.00 0.64 H new ATOM 0 HB3 PHE A 20 10.839 1.678 7.901 1.00 0.64 H new ATOM 0 HD1 PHE A 20 13.658 -0.424 9.260 1.00 0.83 H new ATOM 0 HD2 PHE A 20 12.092 1.740 5.930 1.00 0.76 H new ATOM 0 HE1 PHE A 20 15.567 -1.143 7.892 1.00 0.95 H new ATOM 0 HE2 PHE A 20 14.002 1.019 4.569 1.00 0.86 H new ATOM 0 HZ PHE A 20 15.742 -0.420 5.546 1.00 0.93 H new ATOM 305 N PHE A 21 11.870 4.545 9.167 1.00 0.71 N ATOM 306 CA PHE A 21 12.442 5.813 8.645 1.00 0.73 C ATOM 307 C PHE A 21 13.465 6.466 9.602 1.00 0.66 C ATOM 308 O PHE A 21 14.195 7.370 9.182 1.00 0.67 O ATOM 309 CB PHE A 21 11.333 6.805 8.230 1.00 1.04 C ATOM 310 CG PHE A 21 10.864 6.596 6.799 1.00 1.67 C ATOM 311 CD1 PHE A 21 10.116 5.474 6.445 1.00 1.97 C ATOM 312 CD2 PHE A 21 11.191 7.507 5.799 1.00 2.34 C ATOM 313 CE1 PHE A 21 9.705 5.275 5.143 1.00 2.74 C ATOM 314 CE2 PHE A 21 10.780 7.303 4.494 1.00 3.02 C ATOM 315 CZ PHE A 21 10.039 6.189 4.168 1.00 3.17 C ATOM 0 H PHE A 21 10.912 4.621 9.508 1.00 0.71 H new ATOM 0 HA PHE A 21 13.004 5.544 7.751 1.00 0.73 H new ATOM 0 HB2 PHE A 21 10.484 6.698 8.905 1.00 1.04 H new ATOM 0 HB3 PHE A 21 11.703 7.824 8.342 1.00 1.04 H new ATOM 0 HD1 PHE A 21 9.854 4.749 7.202 1.00 1.97 H new ATOM 0 HD2 PHE A 21 11.772 8.383 6.045 1.00 2.34 H new ATOM 0 HE1 PHE A 21 9.121 4.403 4.888 1.00 2.74 H new ATOM 0 HE2 PHE A 21 11.041 8.019 3.729 1.00 3.02 H new ATOM 0 HZ PHE A 21 9.720 6.032 3.148 1.00 3.17 H new ATOM 325 N THR A 22 13.534 6.012 10.875 1.00 0.75 N ATOM 326 CA THR A 22 14.530 6.538 11.834 1.00 0.89 C ATOM 327 C THR A 22 15.945 6.044 11.439 1.00 0.82 C ATOM 328 O THR A 22 16.939 6.732 11.693 1.00 0.97 O ATOM 329 CB THR A 22 14.206 6.113 13.299 1.00 1.11 C ATOM 330 OG1 THR A 22 12.828 6.398 13.606 1.00 1.25 O ATOM 331 CG2 THR A 22 15.109 6.820 14.317 1.00 1.37 C ATOM 0 H THR A 22 12.920 5.292 11.257 1.00 0.75 H new ATOM 0 HA THR A 22 14.493 7.627 11.792 1.00 0.89 H new ATOM 0 HB THR A 22 14.390 5.041 13.371 1.00 1.11 H new ATOM 0 HG1 THR A 22 12.252 5.732 13.175 1.00 1.25 H new ATOM 0 HG21 THR A 22 14.848 6.494 15.324 1.00 1.37 H new ATOM 0 HG22 THR A 22 16.151 6.571 14.114 1.00 1.37 H new ATOM 0 HG23 THR A 22 14.971 7.898 14.238 1.00 1.37 H new ATOM 339 N PHE A 23 16.015 4.844 10.812 1.00 0.69 N ATOM 340 CA PHE A 23 17.279 4.241 10.348 1.00 0.76 C ATOM 341 C PHE A 23 17.509 4.498 8.839 1.00 0.69 C ATOM 342 O PHE A 23 18.660 4.580 8.400 1.00 0.82 O ATOM 343 CB PHE A 23 17.288 2.724 10.624 1.00 0.87 C ATOM 344 CG PHE A 23 17.120 2.360 12.088 1.00 1.04 C ATOM 345 CD1 PHE A 23 18.183 2.471 12.978 1.00 1.34 C ATOM 346 CD2 PHE A 23 15.897 1.905 12.575 1.00 1.01 C ATOM 347 CE1 PHE A 23 18.033 2.137 14.310 1.00 1.55 C ATOM 348 CE2 PHE A 23 15.745 1.572 13.908 1.00 1.24 C ATOM 349 CZ PHE A 23 16.814 1.688 14.777 1.00 1.49 C ATOM 0 H PHE A 23 15.194 4.271 10.616 1.00 0.69 H new ATOM 0 HA PHE A 23 18.089 4.713 10.903 1.00 0.76 H new ATOM 0 HB2 PHE A 23 16.488 2.256 10.050 1.00 0.87 H new ATOM 0 HB3 PHE A 23 18.227 2.305 10.262 1.00 0.87 H new ATOM 0 HD1 PHE A 23 19.140 2.824 12.622 1.00 1.34 H new ATOM 0 HD2 PHE A 23 15.057 1.811 11.903 1.00 1.01 H new ATOM 0 HE1 PHE A 23 18.870 2.227 14.987 1.00 1.55 H new ATOM 0 HE2 PHE A 23 14.790 1.221 14.271 1.00 1.24 H new ATOM 0 HZ PHE A 23 16.696 1.428 15.819 1.00 1.49 H new ATOM 359 N ALA A 24 16.409 4.628 8.053 1.00 0.59 N ATOM 360 CA ALA A 24 16.491 4.870 6.592 1.00 0.67 C ATOM 361 C ALA A 24 16.964 6.299 6.244 1.00 0.62 C ATOM 362 O ALA A 24 17.545 6.512 5.176 1.00 0.83 O ATOM 363 CB ALA A 24 15.145 4.587 5.925 1.00 0.82 C ATOM 0 H ALA A 24 15.455 4.569 8.409 1.00 0.59 H new ATOM 0 HA ALA A 24 17.243 4.182 6.206 1.00 0.67 H new ATOM 0 HB1 ALA A 24 15.224 4.770 4.853 1.00 0.82 H new ATOM 0 HB2 ALA A 24 14.866 3.547 6.096 1.00 0.82 H new ATOM 0 HB3 ALA A 24 14.384 5.242 6.349 1.00 0.82 H new ATOM 369 N ARG A 25 16.703 7.272 7.147 1.00 0.61 N ATOM 370 CA ARG A 25 17.113 8.689 6.950 1.00 0.65 C ATOM 371 C ARG A 25 18.653 8.865 6.836 1.00 0.69 C ATOM 372 O ARG A 25 19.115 9.884 6.313 1.00 0.88 O ATOM 373 CB ARG A 25 16.560 9.572 8.094 1.00 0.75 C ATOM 374 CG ARG A 25 17.078 9.208 9.491 1.00 0.78 C ATOM 375 CD ARG A 25 16.509 10.114 10.579 1.00 0.97 C ATOM 376 NE ARG A 25 17.114 9.840 11.896 1.00 1.09 N ATOM 377 CZ ARG A 25 16.989 10.615 12.991 1.00 1.32 C ATOM 378 NH1 ARG A 25 16.317 11.774 12.958 1.00 1.55 N ATOM 379 NH2 ARG A 25 17.562 10.227 14.131 1.00 1.47 N ATOM 0 H ARG A 25 16.209 7.105 8.023 1.00 0.61 H new ATOM 0 HA ARG A 25 16.687 9.008 5.999 1.00 0.65 H new ATOM 0 HB2 ARG A 25 16.813 10.612 7.887 1.00 0.75 H new ATOM 0 HB3 ARG A 25 15.472 9.503 8.095 1.00 0.75 H new ATOM 0 HG2 ARG A 25 16.819 8.173 9.713 1.00 0.78 H new ATOM 0 HG3 ARG A 25 18.166 9.274 9.500 1.00 0.78 H new ATOM 0 HD2 ARG A 25 16.681 11.156 10.310 1.00 0.97 H new ATOM 0 HD3 ARG A 25 15.430 9.975 10.639 1.00 0.97 H new ATOM 0 HE ARG A 25 17.674 8.992 11.985 1.00 1.09 H new ATOM 0 HH11 ARG A 25 15.885 12.088 12.089 1.00 1.55 H new ATOM 0 HH12 ARG A 25 16.238 12.342 13.802 1.00 1.55 H new ATOM 0 HH21 ARG A 25 18.087 9.353 14.166 1.00 1.47 H new ATOM 0 HH22 ARG A 25 17.475 10.804 14.968 1.00 1.47 H new ATOM 393 N GLN A 26 19.431 7.873 7.345 1.00 0.73 N ATOM 394 CA GLN A 26 20.913 7.886 7.309 1.00 0.84 C ATOM 395 C GLN A 26 21.470 8.126 5.881 1.00 0.78 C ATOM 396 O GLN A 26 22.409 8.909 5.711 1.00 0.89 O ATOM 397 CB GLN A 26 21.456 6.555 7.886 1.00 1.01 C ATOM 398 CG GLN A 26 22.972 6.503 8.083 1.00 1.22 C ATOM 399 CD GLN A 26 23.431 5.230 8.788 1.00 1.49 C ATOM 400 OE1 GLN A 26 23.750 4.236 8.137 1.00 1.63 O ATOM 401 NE2 GLN A 26 23.456 5.246 10.124 1.00 1.80 N ATOM 0 H GLN A 26 19.044 7.042 7.792 1.00 0.73 H new ATOM 0 HA GLN A 26 21.253 8.721 7.922 1.00 0.84 H new ATOM 0 HB2 GLN A 26 20.974 6.370 8.846 1.00 1.01 H new ATOM 0 HB3 GLN A 26 21.164 5.743 7.221 1.00 1.01 H new ATOM 0 HG2 GLN A 26 23.463 6.573 7.112 1.00 1.22 H new ATOM 0 HG3 GLN A 26 23.289 7.369 8.664 1.00 1.22 H new ATOM 0 HE21 GLN A 26 23.184 6.089 10.629 1.00 1.80 H new ATOM 0 HE22 GLN A 26 23.747 4.415 10.639 1.00 1.80 H new ATOM 410 N GLU A 27 20.882 7.455 4.868 1.00 0.70 N ATOM 411 CA GLU A 27 21.320 7.596 3.461 1.00 0.76 C ATOM 412 C GLU A 27 20.649 8.813 2.777 1.00 0.93 C ATOM 413 O GLU A 27 19.877 9.538 3.415 1.00 1.59 O ATOM 414 CB GLU A 27 21.040 6.280 2.684 1.00 0.92 C ATOM 415 CG GLU A 27 22.089 5.185 2.901 1.00 1.09 C ATOM 416 CD GLU A 27 23.357 5.394 2.084 1.00 1.27 C ATOM 417 OE1 GLU A 27 23.373 4.990 0.901 1.00 1.46 O ATOM 418 OE2 GLU A 27 24.330 5.958 2.628 1.00 1.52 O ATOM 0 H GLU A 27 20.103 6.810 4.997 1.00 0.70 H new ATOM 0 HA GLU A 27 22.394 7.781 3.451 1.00 0.76 H new ATOM 0 HB2 GLU A 27 20.064 5.896 2.982 1.00 0.92 H new ATOM 0 HB3 GLU A 27 20.982 6.506 1.619 1.00 0.92 H new ATOM 0 HG2 GLU A 27 22.349 5.146 3.959 1.00 1.09 H new ATOM 0 HG3 GLU A 27 21.654 4.219 2.643 1.00 1.09 H new ATOM 425 N GLY A 28 20.972 9.033 1.473 1.00 0.79 N ATOM 426 CA GLY A 28 20.432 10.158 0.689 1.00 0.92 C ATOM 427 C GLY A 28 18.918 10.372 0.819 1.00 0.73 C ATOM 428 O GLY A 28 18.156 9.404 0.893 1.00 0.72 O ATOM 0 H GLY A 28 21.610 8.435 0.947 1.00 0.79 H new ATOM 0 HA2 GLY A 28 20.941 11.072 0.996 1.00 0.92 H new ATOM 0 HA3 GLY A 28 20.672 9.997 -0.362 1.00 0.92 H new ATOM 432 N ARG A 29 18.497 11.665 0.848 1.00 0.72 N ATOM 433 CA ARG A 29 17.077 12.088 0.974 1.00 0.71 C ATOM 434 C ARG A 29 16.485 11.725 2.357 1.00 0.68 C ATOM 435 O ARG A 29 16.823 10.687 2.933 1.00 0.76 O ATOM 436 CB ARG A 29 16.191 11.530 -0.171 1.00 0.73 C ATOM 437 CG ARG A 29 16.615 11.978 -1.577 1.00 0.92 C ATOM 438 CD ARG A 29 15.628 11.528 -2.659 1.00 1.31 C ATOM 439 NE ARG A 29 14.443 12.404 -2.740 1.00 1.46 N ATOM 440 CZ ARG A 29 14.207 13.337 -3.698 1.00 1.91 C ATOM 441 NH1 ARG A 29 15.103 13.612 -4.658 1.00 2.60 N ATOM 442 NH2 ARG A 29 13.058 14.017 -3.675 1.00 2.05 N ATOM 0 H ARG A 29 19.143 12.452 0.784 1.00 0.72 H new ATOM 0 HA ARG A 29 17.075 13.174 0.886 1.00 0.71 H new ATOM 0 HB2 ARG A 29 16.208 10.441 -0.129 1.00 0.73 H new ATOM 0 HB3 ARG A 29 15.160 11.839 0.000 1.00 0.73 H new ATOM 0 HG2 ARG A 29 16.702 13.064 -1.598 1.00 0.92 H new ATOM 0 HG3 ARG A 29 17.603 11.575 -1.801 1.00 0.92 H new ATOM 0 HD2 ARG A 29 16.133 11.515 -3.625 1.00 1.31 H new ATOM 0 HD3 ARG A 29 15.308 10.507 -2.453 1.00 1.31 H new ATOM 0 HE ARG A 29 13.738 12.299 -2.011 1.00 1.46 H new ATOM 0 HH11 ARG A 29 15.993 13.114 -4.683 1.00 2.60 H new ATOM 0 HH12 ARG A 29 14.894 14.319 -5.363 1.00 2.60 H new ATOM 0 HH21 ARG A 29 12.371 13.833 -2.944 1.00 2.05 H new ATOM 0 HH22 ARG A 29 12.868 14.721 -4.388 1.00 2.05 H new ATOM 456 N LYS A 30 15.592 12.594 2.880 1.00 0.67 N ATOM 457 CA LYS A 30 14.954 12.390 4.203 1.00 0.67 C ATOM 458 C LYS A 30 13.660 11.543 4.118 1.00 0.66 C ATOM 459 O LYS A 30 13.173 11.068 5.151 1.00 0.72 O ATOM 460 CB LYS A 30 14.656 13.759 4.867 1.00 0.76 C ATOM 461 CG LYS A 30 15.906 14.600 5.169 1.00 0.82 C ATOM 462 CD LYS A 30 16.537 14.235 6.518 1.00 0.89 C ATOM 463 CE LYS A 30 17.986 14.718 6.641 1.00 1.00 C ATOM 464 NZ LYS A 30 18.977 13.637 6.348 1.00 1.22 N ATOM 0 H LYS A 30 15.295 13.447 2.405 1.00 0.67 H new ATOM 0 HA LYS A 30 15.660 11.830 4.816 1.00 0.67 H new ATOM 0 HB2 LYS A 30 13.997 14.331 4.214 1.00 0.76 H new ATOM 0 HB3 LYS A 30 14.114 13.588 5.797 1.00 0.76 H new ATOM 0 HG2 LYS A 30 16.639 14.456 4.376 1.00 0.82 H new ATOM 0 HG3 LYS A 30 15.640 15.657 5.168 1.00 0.82 H new ATOM 0 HD2 LYS A 30 15.943 14.670 7.322 1.00 0.89 H new ATOM 0 HD3 LYS A 30 16.506 13.153 6.648 1.00 0.89 H new ATOM 0 HE2 LYS A 30 18.148 15.550 5.956 1.00 1.00 H new ATOM 0 HE3 LYS A 30 18.155 15.098 7.649 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 19.941 14.014 6.445 1.00 1.22 H new ATOM 0 HZ2 LYS A 30 18.843 12.853 7.018 1.00 1.22 H new ATOM 0 HZ3 LYS A 30 18.837 13.291 5.377 1.00 1.22 H new ATOM 478 N ASP A 31 13.113 11.349 2.896 1.00 0.66 N ATOM 479 CA ASP A 31 11.883 10.558 2.689 1.00 0.71 C ATOM 480 C ASP A 31 12.139 9.404 1.694 1.00 0.64 C ATOM 481 O ASP A 31 11.491 9.322 0.643 1.00 0.89 O ATOM 482 CB ASP A 31 10.742 11.467 2.176 1.00 0.87 C ATOM 483 CG ASP A 31 10.352 12.560 3.161 1.00 1.03 C ATOM 484 OD1 ASP A 31 9.615 12.259 4.123 1.00 1.38 O ATOM 485 OD2 ASP A 31 10.781 13.717 2.965 1.00 1.43 O ATOM 0 H ASP A 31 13.508 11.732 2.037 1.00 0.66 H new ATOM 0 HA ASP A 31 11.585 10.127 3.645 1.00 0.71 H new ATOM 0 HB2 ASP A 31 11.048 11.927 1.236 1.00 0.87 H new ATOM 0 HB3 ASP A 31 9.867 10.853 1.960 1.00 0.87 H new ATOM 490 N SER A 32 13.096 8.509 2.029 1.00 0.65 N ATOM 491 CA SER A 32 13.436 7.366 1.156 1.00 0.58 C ATOM 492 C SER A 32 14.091 6.208 1.929 1.00 0.56 C ATOM 493 O SER A 32 14.793 6.430 2.922 1.00 0.63 O ATOM 494 CB SER A 32 14.376 7.813 0.018 1.00 0.58 C ATOM 495 OG SER A 32 15.676 8.129 0.499 1.00 1.09 O ATOM 0 H SER A 32 13.641 8.556 2.890 1.00 0.65 H new ATOM 0 HA SER A 32 12.496 7.003 0.741 1.00 0.58 H new ATOM 0 HB2 SER A 32 14.447 7.020 -0.727 1.00 0.58 H new ATOM 0 HB3 SER A 32 13.952 8.684 -0.482 1.00 0.58 H new ATOM 0 HG SER A 32 16.285 8.251 -0.259 1.00 1.09 H new ATOM 501 N LEU A 33 13.854 4.975 1.445 1.00 0.54 N ATOM 502 CA LEU A 33 14.433 3.757 2.032 1.00 0.54 C ATOM 503 C LEU A 33 15.800 3.478 1.381 1.00 0.52 C ATOM 504 O LEU A 33 16.010 3.819 0.211 1.00 0.66 O ATOM 505 CB LEU A 33 13.491 2.544 1.832 1.00 0.55 C ATOM 506 CG LEU A 33 12.173 2.550 2.653 1.00 0.67 C ATOM 507 CD1 LEU A 33 11.141 3.516 2.060 1.00 0.76 C ATOM 508 CD2 LEU A 33 11.586 1.139 2.746 1.00 0.75 C ATOM 0 H LEU A 33 13.257 4.797 0.638 1.00 0.54 H new ATOM 0 HA LEU A 33 14.561 3.911 3.103 1.00 0.54 H new ATOM 0 HB2 LEU A 33 13.234 2.482 0.774 1.00 0.55 H new ATOM 0 HB3 LEU A 33 14.044 1.638 2.080 1.00 0.55 H new ATOM 0 HG LEU A 33 12.417 2.897 3.657 1.00 0.67 H new ATOM 0 HD11 LEU A 33 10.232 3.492 2.662 1.00 0.76 H new ATOM 0 HD12 LEU A 33 11.548 4.527 2.058 1.00 0.76 H new ATOM 0 HD13 LEU A 33 10.907 3.217 1.038 1.00 0.76 H new ATOM 0 HD21 LEU A 33 10.663 1.166 3.325 1.00 0.75 H new ATOM 0 HD22 LEU A 33 11.374 0.766 1.744 1.00 0.75 H new ATOM 0 HD23 LEU A 33 12.302 0.479 3.235 1.00 0.75 H new ATOM 520 N SER A 34 16.730 2.869 2.143 1.00 0.50 N ATOM 521 CA SER A 34 18.080 2.544 1.634 1.00 0.52 C ATOM 522 C SER A 34 18.089 1.204 0.872 1.00 0.47 C ATOM 523 O SER A 34 17.257 0.333 1.137 1.00 0.47 O ATOM 524 CB SER A 34 19.093 2.501 2.788 1.00 0.62 C ATOM 525 OG SER A 34 20.410 2.261 2.314 1.00 0.68 O ATOM 0 H SER A 34 16.573 2.592 3.112 1.00 0.50 H new ATOM 0 HA SER A 34 18.367 3.331 0.936 1.00 0.52 H new ATOM 0 HB2 SER A 34 19.067 3.445 3.332 1.00 0.62 H new ATOM 0 HB3 SER A 34 18.810 1.719 3.493 1.00 0.62 H new ATOM 0 HG SER A 34 21.003 2.082 3.073 1.00 0.68 H new ATOM 531 N VAL A 35 19.051 1.049 -0.066 1.00 0.50 N ATOM 532 CA VAL A 35 19.182 -0.184 -0.882 1.00 0.49 C ATOM 533 C VAL A 35 19.788 -1.362 -0.079 1.00 0.45 C ATOM 534 O VAL A 35 19.445 -2.522 -0.335 1.00 0.46 O ATOM 535 CB VAL A 35 20.011 0.071 -2.195 1.00 0.59 C ATOM 536 CG1 VAL A 35 21.496 0.365 -1.915 1.00 0.63 C ATOM 537 CG2 VAL A 35 19.860 -1.093 -3.186 1.00 0.64 C ATOM 0 H VAL A 35 19.749 1.762 -0.278 1.00 0.50 H new ATOM 0 HA VAL A 35 18.169 -0.468 -1.167 1.00 0.49 H new ATOM 0 HB VAL A 35 19.593 0.968 -2.652 1.00 0.59 H new ATOM 0 HG11 VAL A 35 22.018 0.533 -2.857 1.00 0.63 H new ATOM 0 HG12 VAL A 35 21.579 1.255 -1.291 1.00 0.63 H new ATOM 0 HG13 VAL A 35 21.944 -0.484 -1.398 1.00 0.63 H new ATOM 0 HG21 VAL A 35 20.445 -0.886 -4.082 1.00 0.64 H new ATOM 0 HG22 VAL A 35 20.218 -2.013 -2.724 1.00 0.64 H new ATOM 0 HG23 VAL A 35 18.810 -1.207 -3.456 1.00 0.64 H new ATOM 547 N ASN A 36 20.694 -1.059 0.872 1.00 0.45 N ATOM 548 CA ASN A 36 21.342 -2.091 1.706 1.00 0.46 C ATOM 549 C ASN A 36 20.451 -2.484 2.907 1.00 0.44 C ATOM 550 O ASN A 36 20.316 -3.673 3.210 1.00 0.55 O ATOM 551 CB ASN A 36 22.722 -1.595 2.185 1.00 0.55 C ATOM 552 CG ASN A 36 23.551 -2.684 2.864 1.00 0.64 C ATOM 553 OD1 ASN A 36 24.212 -3.476 2.192 1.00 0.82 O ATOM 554 ND2 ASN A 36 23.518 -2.736 4.197 1.00 0.77 N ATOM 0 H ASN A 36 20.994 -0.107 1.082 1.00 0.45 H new ATOM 0 HA ASN A 36 21.482 -2.984 1.097 1.00 0.46 H new ATOM 0 HB2 ASN A 36 23.277 -1.204 1.332 1.00 0.55 H new ATOM 0 HB3 ASN A 36 22.582 -0.767 2.880 1.00 0.55 H new ATOM 0 HD21 ASN A 36 24.052 -3.449 4.693 1.00 0.77 H new ATOM 0 HD22 ASN A 36 22.958 -2.062 4.720 1.00 0.77 H new ATOM 561 N GLU A 37 19.846 -1.478 3.582 1.00 0.44 N ATOM 562 CA GLU A 37 18.963 -1.722 4.750 1.00 0.46 C ATOM 563 C GLU A 37 17.658 -2.445 4.347 1.00 0.41 C ATOM 564 O GLU A 37 17.060 -3.140 5.171 1.00 0.43 O ATOM 565 CB GLU A 37 18.631 -0.404 5.477 1.00 0.55 C ATOM 566 CG GLU A 37 19.851 0.295 6.083 1.00 0.70 C ATOM 567 CD GLU A 37 19.492 1.517 6.916 1.00 0.83 C ATOM 568 OE1 GLU A 37 19.082 2.539 6.326 1.00 1.25 O ATOM 569 OE2 GLU A 37 19.629 1.451 8.155 1.00 1.54 O ATOM 0 H GLU A 37 19.952 -0.493 3.340 1.00 0.44 H new ATOM 0 HA GLU A 37 19.512 -2.373 5.430 1.00 0.46 H new ATOM 0 HB2 GLU A 37 18.147 0.275 4.775 1.00 0.55 H new ATOM 0 HB3 GLU A 37 17.911 -0.609 6.269 1.00 0.55 H new ATOM 0 HG2 GLU A 37 20.395 -0.414 6.707 1.00 0.70 H new ATOM 0 HG3 GLU A 37 20.525 0.596 5.281 1.00 0.70 H new ATOM 576 N PHE A 38 17.219 -2.262 3.080 1.00 0.40 N ATOM 577 CA PHE A 38 16.006 -2.921 2.551 1.00 0.39 C ATOM 578 C PHE A 38 16.225 -4.447 2.426 1.00 0.37 C ATOM 579 O PHE A 38 15.335 -5.229 2.766 1.00 0.40 O ATOM 580 CB PHE A 38 15.608 -2.280 1.191 1.00 0.43 C ATOM 581 CG PHE A 38 14.620 -3.064 0.332 1.00 0.41 C ATOM 582 CD1 PHE A 38 13.484 -3.655 0.885 1.00 0.50 C ATOM 583 CD2 PHE A 38 14.839 -3.209 -1.032 1.00 0.49 C ATOM 584 CE1 PHE A 38 12.604 -4.367 0.095 1.00 0.61 C ATOM 585 CE2 PHE A 38 13.958 -3.921 -1.821 1.00 0.61 C ATOM 586 CZ PHE A 38 12.839 -4.501 -1.258 1.00 0.65 C ATOM 0 H PHE A 38 17.690 -1.661 2.404 1.00 0.40 H new ATOM 0 HA PHE A 38 15.182 -2.771 3.248 1.00 0.39 H new ATOM 0 HB2 PHE A 38 15.182 -1.296 1.389 1.00 0.43 H new ATOM 0 HB3 PHE A 38 16.516 -2.123 0.609 1.00 0.43 H new ATOM 0 HD1 PHE A 38 13.291 -3.554 1.943 1.00 0.50 H new ATOM 0 HD2 PHE A 38 15.711 -2.758 -1.482 1.00 0.49 H new ATOM 0 HE1 PHE A 38 11.729 -4.820 0.537 1.00 0.61 H new ATOM 0 HE2 PHE A 38 14.144 -4.024 -2.880 1.00 0.61 H new ATOM 0 HZ PHE A 38 12.149 -5.058 -1.875 1.00 0.65 H new ATOM 596 N LYS A 39 17.415 -4.854 1.941 1.00 0.37 N ATOM 597 CA LYS A 39 17.768 -6.282 1.787 1.00 0.40 C ATOM 598 C LYS A 39 17.847 -7.003 3.158 1.00 0.38 C ATOM 599 O LYS A 39 17.551 -8.200 3.247 1.00 0.42 O ATOM 600 CB LYS A 39 19.108 -6.407 1.026 1.00 0.46 C ATOM 601 CG LYS A 39 19.539 -7.844 0.712 1.00 0.55 C ATOM 602 CD LYS A 39 20.806 -7.893 -0.153 1.00 0.64 C ATOM 603 CE LYS A 39 21.438 -9.288 -0.179 1.00 0.76 C ATOM 604 NZ LYS A 39 20.579 -10.305 -0.861 1.00 0.87 N ATOM 0 H LYS A 39 18.151 -4.212 1.648 1.00 0.37 H new ATOM 0 HA LYS A 39 16.980 -6.769 1.212 1.00 0.40 H new ATOM 0 HB2 LYS A 39 19.031 -5.853 0.090 1.00 0.46 H new ATOM 0 HB3 LYS A 39 19.890 -5.929 1.616 1.00 0.46 H new ATOM 0 HG2 LYS A 39 19.717 -8.380 1.644 1.00 0.55 H new ATOM 0 HG3 LYS A 39 18.729 -8.360 0.197 1.00 0.55 H new ATOM 0 HD2 LYS A 39 20.561 -7.589 -1.170 1.00 0.64 H new ATOM 0 HD3 LYS A 39 21.532 -7.175 0.228 1.00 0.64 H new ATOM 0 HE2 LYS A 39 22.401 -9.235 -0.686 1.00 0.76 H new ATOM 0 HE3 LYS A 39 21.633 -9.612 0.843 1.00 0.76 H new ATOM 0 HZ1 LYS A 39 21.057 -11.228 -0.848 1.00 0.87 H new ATOM 0 HZ2 LYS A 39 19.668 -10.380 -0.364 1.00 0.87 H new ATOM 0 HZ3 LYS A 39 20.413 -10.015 -1.846 1.00 0.87 H new ATOM 618 N GLU A 40 18.243 -6.266 4.217 1.00 0.38 N ATOM 619 CA GLU A 40 18.358 -6.821 5.578 1.00 0.40 C ATOM 620 C GLU A 40 17.007 -6.800 6.314 1.00 0.40 C ATOM 621 O GLU A 40 16.732 -7.700 7.111 1.00 0.44 O ATOM 622 CB GLU A 40 19.417 -6.049 6.391 1.00 0.45 C ATOM 623 CG GLU A 40 20.831 -6.171 5.826 1.00 0.49 C ATOM 624 CD GLU A 40 21.861 -5.407 6.638 1.00 0.59 C ATOM 625 OE1 GLU A 40 22.066 -4.209 6.360 1.00 0.64 O ATOM 626 OE2 GLU A 40 22.463 -6.010 7.553 1.00 0.73 O ATOM 0 H GLU A 40 18.490 -5.278 4.152 1.00 0.38 H new ATOM 0 HA GLU A 40 18.672 -7.860 5.482 1.00 0.40 H new ATOM 0 HB2 GLU A 40 19.139 -4.996 6.427 1.00 0.45 H new ATOM 0 HB3 GLU A 40 19.412 -6.415 7.418 1.00 0.45 H new ATOM 0 HG2 GLU A 40 21.113 -7.223 5.790 1.00 0.49 H new ATOM 0 HG3 GLU A 40 20.840 -5.803 4.800 1.00 0.49 H new ATOM 633 N LEU A 41 16.164 -5.778 6.049 1.00 0.39 N ATOM 634 CA LEU A 41 14.837 -5.668 6.693 1.00 0.41 C ATOM 635 C LEU A 41 13.914 -6.836 6.282 1.00 0.40 C ATOM 636 O LEU A 41 13.158 -7.350 7.111 1.00 0.44 O ATOM 637 CB LEU A 41 14.173 -4.316 6.349 1.00 0.44 C ATOM 638 CG LEU A 41 12.904 -3.950 7.165 1.00 0.55 C ATOM 639 CD1 LEU A 41 13.263 -3.568 8.607 1.00 0.65 C ATOM 640 CD2 LEU A 41 12.115 -2.828 6.484 1.00 0.58 C ATOM 0 H LEU A 41 16.377 -5.022 5.398 1.00 0.39 H new ATOM 0 HA LEU A 41 14.989 -5.720 7.771 1.00 0.41 H new ATOM 0 HB2 LEU A 41 14.911 -3.526 6.490 1.00 0.44 H new ATOM 0 HB3 LEU A 41 13.910 -4.322 5.291 1.00 0.44 H new ATOM 0 HG LEU A 41 12.268 -4.835 7.201 1.00 0.55 H new ATOM 0 HD11 LEU A 41 12.354 -3.317 9.154 1.00 0.65 H new ATOM 0 HD12 LEU A 41 13.759 -4.408 9.093 1.00 0.65 H new ATOM 0 HD13 LEU A 41 13.932 -2.707 8.600 1.00 0.65 H new ATOM 0 HD21 LEU A 41 11.232 -2.592 7.077 1.00 0.58 H new ATOM 0 HD22 LEU A 41 12.743 -1.941 6.400 1.00 0.58 H new ATOM 0 HD23 LEU A 41 11.808 -3.151 5.489 1.00 0.58 H new ATOM 652 N VAL A 42 13.989 -7.244 4.999 1.00 0.36 N ATOM 653 CA VAL A 42 13.171 -8.353 4.468 1.00 0.37 C ATOM 654 C VAL A 42 13.652 -9.725 5.005 1.00 0.38 C ATOM 655 O VAL A 42 12.839 -10.641 5.152 1.00 0.41 O ATOM 656 CB VAL A 42 13.154 -8.340 2.894 1.00 0.40 C ATOM 657 CG1 VAL A 42 12.415 -9.555 2.303 1.00 0.45 C ATOM 658 CG2 VAL A 42 12.528 -7.034 2.381 1.00 0.41 C ATOM 0 H VAL A 42 14.610 -6.820 4.310 1.00 0.36 H new ATOM 0 HA VAL A 42 12.150 -8.202 4.819 1.00 0.37 H new ATOM 0 HB VAL A 42 14.190 -8.402 2.560 1.00 0.40 H new ATOM 0 HG11 VAL A 42 12.432 -9.497 1.215 1.00 0.45 H new ATOM 0 HG12 VAL A 42 12.907 -10.472 2.626 1.00 0.45 H new ATOM 0 HG13 VAL A 42 11.382 -9.556 2.650 1.00 0.45 H new ATOM 0 HG21 VAL A 42 12.522 -7.037 1.291 1.00 0.41 H new ATOM 0 HG22 VAL A 42 11.505 -6.951 2.749 1.00 0.41 H new ATOM 0 HG23 VAL A 42 13.112 -6.186 2.738 1.00 0.41 H new ATOM 668 N THR A 43 14.964 -9.858 5.309 1.00 0.39 N ATOM 669 CA THR A 43 15.525 -11.122 5.822 1.00 0.42 C ATOM 670 C THR A 43 15.956 -11.000 7.308 1.00 0.49 C ATOM 671 O THR A 43 17.066 -11.397 7.685 1.00 0.80 O ATOM 672 CB THR A 43 16.715 -11.593 4.929 1.00 0.45 C ATOM 673 OG1 THR A 43 16.399 -11.393 3.538 1.00 0.46 O ATOM 674 CG2 THR A 43 17.054 -13.071 5.155 1.00 0.50 C ATOM 0 H THR A 43 15.648 -9.108 5.207 1.00 0.39 H new ATOM 0 HA THR A 43 14.739 -11.876 5.777 1.00 0.42 H new ATOM 0 HB THR A 43 17.583 -10.996 5.210 1.00 0.45 H new ATOM 0 HG1 THR A 43 17.152 -11.690 2.986 1.00 0.46 H new ATOM 0 HG21 THR A 43 17.888 -13.355 4.513 1.00 0.50 H new ATOM 0 HG22 THR A 43 17.330 -13.226 6.198 1.00 0.50 H new ATOM 0 HG23 THR A 43 16.186 -13.684 4.915 1.00 0.50 H new ATOM 682 N GLN A 44 15.060 -10.444 8.149 1.00 0.41 N ATOM 683 CA GLN A 44 15.312 -10.282 9.600 1.00 0.44 C ATOM 684 C GLN A 44 14.008 -9.942 10.347 1.00 0.44 C ATOM 685 O GLN A 44 13.659 -10.612 11.325 1.00 0.50 O ATOM 686 CB GLN A 44 16.387 -9.196 9.879 1.00 0.48 C ATOM 687 CG GLN A 44 17.157 -9.404 11.186 1.00 0.65 C ATOM 688 CD GLN A 44 18.113 -8.260 11.505 1.00 0.77 C ATOM 689 OE1 GLN A 44 19.259 -8.257 11.054 1.00 1.02 O ATOM 690 NE2 GLN A 44 17.659 -7.289 12.299 1.00 1.10 N ATOM 0 H GLN A 44 14.149 -10.097 7.848 1.00 0.41 H new ATOM 0 HA GLN A 44 15.693 -11.234 9.970 1.00 0.44 H new ATOM 0 HB2 GLN A 44 17.095 -9.179 9.051 1.00 0.48 H new ATOM 0 HB3 GLN A 44 15.904 -8.219 9.905 1.00 0.48 H new ATOM 0 HG2 GLN A 44 16.447 -9.515 12.005 1.00 0.65 H new ATOM 0 HG3 GLN A 44 17.721 -10.335 11.124 1.00 0.65 H new ATOM 0 HE21 GLN A 44 16.703 -7.325 12.654 1.00 1.10 H new ATOM 0 HE22 GLN A 44 18.267 -6.510 12.551 1.00 1.10 H new ATOM 699 N GLN A 45 13.291 -8.900 9.871 1.00 0.41 N ATOM 700 CA GLN A 45 12.028 -8.449 10.489 1.00 0.43 C ATOM 701 C GLN A 45 10.796 -8.683 9.574 1.00 0.41 C ATOM 702 O GLN A 45 9.666 -8.412 9.993 1.00 0.45 O ATOM 703 CB GLN A 45 12.153 -6.960 10.871 1.00 0.47 C ATOM 704 CG GLN A 45 11.178 -6.502 11.958 1.00 0.59 C ATOM 705 CD GLN A 45 11.544 -5.149 12.571 1.00 0.64 C ATOM 706 OE1 GLN A 45 12.159 -4.300 11.921 1.00 0.65 O ATOM 707 NE2 GLN A 45 11.160 -4.936 13.831 1.00 0.84 N ATOM 0 H GLN A 45 13.569 -8.354 9.056 1.00 0.41 H new ATOM 0 HA GLN A 45 11.860 -9.048 11.384 1.00 0.43 H new ATOM 0 HB2 GLN A 45 13.171 -6.769 11.209 1.00 0.47 H new ATOM 0 HB3 GLN A 45 11.994 -6.354 9.979 1.00 0.47 H new ATOM 0 HG2 GLN A 45 10.175 -6.441 11.534 1.00 0.59 H new ATOM 0 HG3 GLN A 45 11.146 -7.253 12.747 1.00 0.59 H new ATOM 0 HE21 GLN A 45 10.653 -5.661 14.339 1.00 0.84 H new ATOM 0 HE22 GLN A 45 11.374 -4.049 14.286 1.00 0.84 H new ATOM 716 N LEU A 46 11.010 -9.189 8.334 1.00 0.40 N ATOM 717 CA LEU A 46 9.908 -9.458 7.389 1.00 0.40 C ATOM 718 C LEU A 46 10.129 -10.786 6.589 1.00 0.40 C ATOM 719 O LEU A 46 9.819 -10.833 5.390 1.00 0.42 O ATOM 720 CB LEU A 46 9.778 -8.248 6.420 1.00 0.41 C ATOM 721 CG LEU A 46 8.346 -7.719 6.168 1.00 0.40 C ATOM 722 CD1 LEU A 46 7.859 -6.857 7.335 1.00 0.59 C ATOM 723 CD2 LEU A 46 8.288 -6.929 4.854 1.00 0.67 C ATOM 0 H LEU A 46 11.935 -9.417 7.970 1.00 0.40 H new ATOM 0 HA LEU A 46 8.986 -9.587 7.955 1.00 0.40 H new ATOM 0 HB2 LEU A 46 10.380 -7.429 6.813 1.00 0.41 H new ATOM 0 HB3 LEU A 46 10.212 -8.530 5.461 1.00 0.41 H new ATOM 0 HG LEU A 46 7.681 -8.579 6.087 1.00 0.40 H new ATOM 0 HD11 LEU A 46 6.850 -6.500 7.128 1.00 0.59 H new ATOM 0 HD12 LEU A 46 7.853 -7.451 8.249 1.00 0.59 H new ATOM 0 HD13 LEU A 46 8.526 -6.004 7.461 1.00 0.59 H new ATOM 0 HD21 LEU A 46 7.273 -6.565 4.693 1.00 0.67 H new ATOM 0 HD22 LEU A 46 8.973 -6.083 4.908 1.00 0.67 H new ATOM 0 HD23 LEU A 46 8.576 -7.577 4.027 1.00 0.67 H new ATOM 735 N PRO A 47 10.638 -11.905 7.222 1.00 0.42 N ATOM 736 CA PRO A 47 10.886 -13.170 6.495 1.00 0.45 C ATOM 737 C PRO A 47 9.626 -14.041 6.274 1.00 0.47 C ATOM 738 O PRO A 47 9.459 -14.611 5.190 1.00 0.52 O ATOM 739 CB PRO A 47 11.910 -13.876 7.393 1.00 0.49 C ATOM 740 CG PRO A 47 11.564 -13.442 8.775 1.00 0.49 C ATOM 741 CD PRO A 47 11.007 -12.043 8.659 1.00 0.46 C ATOM 0 HA PRO A 47 11.229 -12.987 5.477 1.00 0.45 H new ATOM 0 HB2 PRO A 47 11.846 -14.959 7.291 1.00 0.49 H new ATOM 0 HB3 PRO A 47 12.929 -13.591 7.132 1.00 0.49 H new ATOM 0 HG2 PRO A 47 10.832 -14.115 9.221 1.00 0.49 H new ATOM 0 HG3 PRO A 47 12.444 -13.457 9.418 1.00 0.49 H new ATOM 0 HD2 PRO A 47 10.141 -11.906 9.306 1.00 0.46 H new ATOM 0 HD3 PRO A 47 11.745 -11.297 8.953 1.00 0.46 H new ATOM 749 N HIS A 48 8.738 -14.133 7.291 1.00 0.47 N ATOM 750 CA HIS A 48 7.509 -14.954 7.193 1.00 0.52 C ATOM 751 C HIS A 48 6.463 -14.316 6.252 1.00 0.50 C ATOM 752 O HIS A 48 5.781 -15.032 5.509 1.00 0.57 O ATOM 753 CB HIS A 48 6.888 -15.189 8.587 1.00 0.57 C ATOM 754 CG HIS A 48 7.783 -15.914 9.552 1.00 0.65 C ATOM 755 ND1 HIS A 48 8.683 -15.268 10.378 1.00 0.69 N ATOM 756 CD2 HIS A 48 7.902 -17.232 9.832 1.00 0.79 C ATOM 757 CE1 HIS A 48 9.316 -16.160 11.117 1.00 0.80 C ATOM 758 NE2 HIS A 48 8.859 -17.357 10.806 1.00 0.85 N ATOM 0 H HIS A 48 8.849 -13.652 8.184 1.00 0.47 H new ATOM 0 HA HIS A 48 7.803 -15.914 6.769 1.00 0.52 H new ATOM 0 HB2 HIS A 48 6.616 -14.225 9.017 1.00 0.57 H new ATOM 0 HB3 HIS A 48 5.965 -15.757 8.469 1.00 0.57 H new ATOM 0 HD2 HIS A 48 7.346 -18.037 9.373 1.00 0.79 H new ATOM 0 HE1 HIS A 48 10.078 -15.946 11.851 1.00 0.80 H new ATOM 0 HE2 HIS A 48 9.168 -18.235 11.223 1.00 0.85 H new ATOM 767 N LEU A 49 6.344 -12.965 6.287 1.00 0.46 N ATOM 768 CA LEU A 49 5.396 -12.219 5.425 1.00 0.46 C ATOM 769 C LEU A 49 5.734 -12.432 3.939 1.00 0.45 C ATOM 770 O LEU A 49 4.900 -12.927 3.176 1.00 0.53 O ATOM 771 CB LEU A 49 5.399 -10.707 5.786 1.00 0.47 C ATOM 772 CG LEU A 49 4.601 -9.758 4.855 1.00 0.50 C ATOM 773 CD1 LEU A 49 3.140 -10.190 4.759 1.00 0.87 C ATOM 774 CD2 LEU A 49 4.711 -8.307 5.333 1.00 0.53 C ATOM 0 H LEU A 49 6.895 -12.370 6.905 1.00 0.46 H new ATOM 0 HA LEU A 49 4.392 -12.605 5.602 1.00 0.46 H new ATOM 0 HB2 LEU A 49 5.005 -10.600 6.797 1.00 0.47 H new ATOM 0 HB3 LEU A 49 6.434 -10.367 5.809 1.00 0.47 H new ATOM 0 HG LEU A 49 5.036 -9.819 3.857 1.00 0.50 H new ATOM 0 HD11 LEU A 49 2.602 -9.509 4.100 1.00 0.87 H new ATOM 0 HD12 LEU A 49 3.085 -11.202 4.357 1.00 0.87 H new ATOM 0 HD13 LEU A 49 2.688 -10.169 5.751 1.00 0.87 H new ATOM 0 HD21 LEU A 49 4.143 -7.660 4.665 1.00 0.53 H new ATOM 0 HD22 LEU A 49 4.311 -8.225 6.344 1.00 0.53 H new ATOM 0 HD23 LEU A 49 5.757 -8.002 5.332 1.00 0.53 H new ATOM 786 N LEU A 50 6.962 -12.049 3.548 1.00 0.43 N ATOM 787 CA LEU A 50 7.442 -12.216 2.172 1.00 0.45 C ATOM 788 C LEU A 50 8.319 -13.475 2.111 1.00 0.48 C ATOM 789 O LEU A 50 9.490 -13.439 2.513 1.00 0.54 O ATOM 790 CB LEU A 50 8.236 -10.956 1.713 1.00 0.48 C ATOM 791 CG LEU A 50 7.698 -10.219 0.461 1.00 0.57 C ATOM 792 CD1 LEU A 50 8.331 -8.829 0.336 1.00 0.66 C ATOM 793 CD2 LEU A 50 7.949 -11.037 -0.813 1.00 0.73 C ATOM 0 H LEU A 50 7.642 -11.619 4.174 1.00 0.43 H new ATOM 0 HA LEU A 50 6.596 -12.331 1.494 1.00 0.45 H new ATOM 0 HB2 LEU A 50 8.261 -10.248 2.541 1.00 0.48 H new ATOM 0 HB3 LEU A 50 9.266 -11.254 1.517 1.00 0.48 H new ATOM 0 HG LEU A 50 6.621 -10.100 0.582 1.00 0.57 H new ATOM 0 HD11 LEU A 50 7.939 -8.329 -0.550 1.00 0.66 H new ATOM 0 HD12 LEU A 50 8.092 -8.239 1.221 1.00 0.66 H new ATOM 0 HD13 LEU A 50 9.413 -8.928 0.248 1.00 0.66 H new ATOM 0 HD21 LEU A 50 7.561 -10.495 -1.676 1.00 0.73 H new ATOM 0 HD22 LEU A 50 9.020 -11.198 -0.937 1.00 0.73 H new ATOM 0 HD23 LEU A 50 7.445 -12.000 -0.732 1.00 0.73 H new ATOM 805 N LYS A 51 7.735 -14.602 1.643 1.00 0.55 N ATOM 806 CA LYS A 51 8.468 -15.887 1.525 1.00 0.66 C ATOM 807 C LYS A 51 9.724 -15.756 0.627 1.00 0.63 C ATOM 808 O LYS A 51 10.702 -16.486 0.818 1.00 0.76 O ATOM 809 CB LYS A 51 7.545 -17.016 0.991 1.00 0.78 C ATOM 810 CG LYS A 51 6.927 -16.750 -0.393 1.00 0.78 C ATOM 811 CD LYS A 51 6.592 -18.047 -1.139 1.00 1.18 C ATOM 812 CE LYS A 51 6.123 -17.788 -2.577 1.00 1.16 C ATOM 813 NZ LYS A 51 7.169 -17.134 -3.427 1.00 1.32 N ATOM 0 H LYS A 51 6.762 -14.649 1.341 1.00 0.55 H new ATOM 0 HA LYS A 51 8.798 -16.153 2.529 1.00 0.66 H new ATOM 0 HB2 LYS A 51 8.118 -17.942 0.945 1.00 0.78 H new ATOM 0 HB3 LYS A 51 6.739 -17.176 1.708 1.00 0.78 H new ATOM 0 HG2 LYS A 51 6.020 -16.156 -0.276 1.00 0.78 H new ATOM 0 HG3 LYS A 51 7.620 -16.158 -0.991 1.00 0.78 H new ATOM 0 HD2 LYS A 51 7.471 -18.691 -1.157 1.00 1.18 H new ATOM 0 HD3 LYS A 51 5.814 -18.585 -0.597 1.00 1.18 H new ATOM 0 HE2 LYS A 51 5.831 -18.734 -3.034 1.00 1.16 H new ATOM 0 HE3 LYS A 51 5.234 -17.157 -2.555 1.00 1.16 H new ATOM 0 HZ1 LYS A 51 6.877 -17.168 -4.425 1.00 1.32 H new ATOM 0 HZ2 LYS A 51 7.285 -16.143 -3.134 1.00 1.32 H new ATOM 0 HZ3 LYS A 51 8.073 -17.636 -3.313 1.00 1.32 H new ATOM 827 N ASP A 52 9.683 -14.818 -0.345 1.00 0.64 N ATOM 828 CA ASP A 52 10.800 -14.579 -1.270 1.00 0.71 C ATOM 829 C ASP A 52 11.912 -13.752 -0.576 1.00 0.59 C ATOM 830 O ASP A 52 12.001 -12.530 -0.755 1.00 0.73 O ATOM 831 CB ASP A 52 10.272 -13.878 -2.548 1.00 0.99 C ATOM 832 CG ASP A 52 11.227 -13.961 -3.728 1.00 1.46 C ATOM 833 OD1 ASP A 52 11.855 -15.026 -3.915 1.00 2.02 O ATOM 834 OD2 ASP A 52 11.330 -12.967 -4.476 1.00 2.08 O ATOM 0 H ASP A 52 8.878 -14.212 -0.505 1.00 0.64 H new ATOM 0 HA ASP A 52 11.243 -15.531 -1.562 1.00 0.71 H new ATOM 0 HB2 ASP A 52 9.319 -14.326 -2.830 1.00 0.99 H new ATOM 0 HB3 ASP A 52 10.077 -12.830 -2.323 1.00 0.99 H new ATOM 839 N VAL A 53 12.746 -14.439 0.228 1.00 0.51 N ATOM 840 CA VAL A 53 13.858 -13.799 0.975 1.00 0.52 C ATOM 841 C VAL A 53 15.204 -13.912 0.231 1.00 0.56 C ATOM 842 O VAL A 53 16.020 -12.986 0.291 1.00 0.71 O ATOM 843 CB VAL A 53 14.018 -14.372 2.428 1.00 0.59 C ATOM 844 CG1 VAL A 53 12.916 -13.847 3.355 1.00 0.65 C ATOM 845 CG2 VAL A 53 14.053 -15.910 2.449 1.00 0.64 C ATOM 0 H VAL A 53 12.673 -15.445 0.381 1.00 0.51 H new ATOM 0 HA VAL A 53 13.585 -12.746 1.048 1.00 0.52 H new ATOM 0 HB VAL A 53 14.981 -14.020 2.798 1.00 0.59 H new ATOM 0 HG11 VAL A 53 13.053 -14.261 4.354 1.00 0.65 H new ATOM 0 HG12 VAL A 53 12.968 -12.759 3.403 1.00 0.65 H new ATOM 0 HG13 VAL A 53 11.942 -14.147 2.968 1.00 0.65 H new ATOM 0 HG21 VAL A 53 14.165 -16.257 3.476 1.00 0.64 H new ATOM 0 HG22 VAL A 53 13.124 -16.301 2.033 1.00 0.64 H new ATOM 0 HG23 VAL A 53 14.895 -16.263 1.853 1.00 0.64 H new ATOM 855 N GLY A 54 15.435 -15.046 -0.463 1.00 0.53 N ATOM 856 CA GLY A 54 16.681 -15.254 -1.203 1.00 0.64 C ATOM 857 C GLY A 54 16.737 -14.482 -2.521 1.00 0.61 C ATOM 858 O GLY A 54 17.718 -13.780 -2.778 1.00 0.83 O ATOM 0 H GLY A 54 14.776 -15.822 -0.522 1.00 0.53 H new ATOM 0 HA2 GLY A 54 17.522 -14.953 -0.578 1.00 0.64 H new ATOM 0 HA3 GLY A 54 16.801 -16.318 -1.408 1.00 0.64 H new ATOM 862 N SER A 55 15.684 -14.609 -3.356 1.00 0.57 N ATOM 863 CA SER A 55 15.622 -13.915 -4.657 1.00 0.58 C ATOM 864 C SER A 55 15.084 -12.480 -4.482 1.00 0.51 C ATOM 865 O SER A 55 13.877 -12.243 -4.575 1.00 0.62 O ATOM 866 CB SER A 55 14.754 -14.709 -5.655 1.00 0.74 C ATOM 867 OG SER A 55 14.817 -14.149 -6.959 1.00 0.85 O ATOM 0 H SER A 55 14.867 -15.185 -3.152 1.00 0.57 H new ATOM 0 HA SER A 55 16.632 -13.852 -5.061 1.00 0.58 H new ATOM 0 HB2 SER A 55 15.090 -15.746 -5.686 1.00 0.74 H new ATOM 0 HB3 SER A 55 13.720 -14.719 -5.312 1.00 0.74 H new ATOM 0 HG SER A 55 15.576 -13.531 -7.013 1.00 0.85 H new ATOM 873 N LEU A 56 16.001 -11.526 -4.221 1.00 0.49 N ATOM 874 CA LEU A 56 15.640 -10.104 -4.027 1.00 0.53 C ATOM 875 C LEU A 56 16.025 -9.274 -5.279 1.00 0.58 C ATOM 876 O LEU A 56 16.575 -8.172 -5.163 1.00 1.03 O ATOM 877 CB LEU A 56 16.330 -9.563 -2.733 1.00 0.67 C ATOM 878 CG LEU A 56 15.501 -8.602 -1.839 1.00 0.83 C ATOM 879 CD1 LEU A 56 15.076 -7.343 -2.598 1.00 1.22 C ATOM 880 CD2 LEU A 56 14.284 -9.317 -1.232 1.00 1.21 C ATOM 0 H LEU A 56 17.000 -11.714 -4.139 1.00 0.49 H new ATOM 0 HA LEU A 56 14.561 -10.012 -3.899 1.00 0.53 H new ATOM 0 HB2 LEU A 56 16.628 -10.418 -2.126 1.00 0.67 H new ATOM 0 HB3 LEU A 56 17.244 -9.047 -3.027 1.00 0.67 H new ATOM 0 HG LEU A 56 16.148 -8.286 -1.021 1.00 0.83 H new ATOM 0 HD11 LEU A 56 14.498 -6.697 -1.937 1.00 1.22 H new ATOM 0 HD12 LEU A 56 15.962 -6.810 -2.943 1.00 1.22 H new ATOM 0 HD13 LEU A 56 14.465 -7.624 -3.456 1.00 1.22 H new ATOM 0 HD21 LEU A 56 13.724 -8.618 -0.611 1.00 1.21 H new ATOM 0 HD22 LEU A 56 13.643 -9.686 -2.032 1.00 1.21 H new ATOM 0 HD23 LEU A 56 14.621 -10.155 -0.621 1.00 1.21 H new ATOM 892 N ASP A 57 15.701 -9.814 -6.478 1.00 0.49 N ATOM 893 CA ASP A 57 16.007 -9.153 -7.764 1.00 0.53 C ATOM 894 C ASP A 57 14.723 -8.755 -8.519 1.00 0.47 C ATOM 895 O ASP A 57 14.652 -7.646 -9.057 1.00 0.50 O ATOM 896 CB ASP A 57 16.918 -10.047 -8.639 1.00 0.67 C ATOM 897 CG ASP A 57 16.303 -11.391 -9.013 1.00 0.70 C ATOM 898 OD1 ASP A 57 16.429 -12.347 -8.220 1.00 0.77 O ATOM 899 OD2 ASP A 57 15.699 -11.486 -10.103 1.00 0.77 O ATOM 0 H ASP A 57 15.225 -10.711 -6.578 1.00 0.49 H new ATOM 0 HA ASP A 57 16.548 -8.233 -7.542 1.00 0.53 H new ATOM 0 HB2 ASP A 57 17.168 -9.508 -9.553 1.00 0.67 H new ATOM 0 HB3 ASP A 57 17.853 -10.224 -8.108 1.00 0.67 H new ATOM 904 N GLU A 58 13.706 -9.654 -8.558 1.00 0.46 N ATOM 905 CA GLU A 58 12.425 -9.358 -9.239 1.00 0.51 C ATOM 906 C GLU A 58 11.689 -8.203 -8.530 1.00 0.47 C ATOM 907 O GLU A 58 11.056 -7.371 -9.189 1.00 0.56 O ATOM 908 CB GLU A 58 11.525 -10.611 -9.311 1.00 0.60 C ATOM 909 CG GLU A 58 10.311 -10.451 -10.229 1.00 0.79 C ATOM 910 CD GLU A 58 9.524 -11.736 -10.411 1.00 0.92 C ATOM 911 OE1 GLU A 58 9.929 -12.564 -11.254 1.00 1.09 O ATOM 912 OE2 GLU A 58 8.507 -11.915 -9.711 1.00 1.02 O ATOM 0 H GLU A 58 13.750 -10.579 -8.130 1.00 0.46 H new ATOM 0 HA GLU A 58 12.653 -9.051 -10.260 1.00 0.51 H new ATOM 0 HB2 GLU A 58 12.121 -11.455 -9.657 1.00 0.60 H new ATOM 0 HB3 GLU A 58 11.179 -10.856 -8.307 1.00 0.60 H new ATOM 0 HG2 GLU A 58 9.653 -9.685 -9.820 1.00 0.79 H new ATOM 0 HG3 GLU A 58 10.645 -10.096 -11.204 1.00 0.79 H new ATOM 919 N LYS A 59 11.778 -8.164 -7.182 1.00 0.42 N ATOM 920 CA LYS A 59 11.165 -7.093 -6.379 1.00 0.47 C ATOM 921 C LYS A 59 11.983 -5.788 -6.521 1.00 0.53 C ATOM 922 O LYS A 59 11.417 -4.728 -6.784 1.00 0.91 O ATOM 923 CB LYS A 59 11.068 -7.503 -4.883 1.00 0.52 C ATOM 924 CG LYS A 59 9.830 -8.338 -4.512 1.00 0.60 C ATOM 925 CD LYS A 59 9.853 -9.772 -5.077 1.00 0.81 C ATOM 926 CE LYS A 59 8.825 -9.977 -6.192 1.00 1.17 C ATOM 927 NZ LYS A 59 8.682 -11.416 -6.567 1.00 1.55 N ATOM 0 H LYS A 59 12.271 -8.866 -6.630 1.00 0.42 H new ATOM 0 HA LYS A 59 10.155 -6.924 -6.751 1.00 0.47 H new ATOM 0 HB2 LYS A 59 11.961 -8.070 -4.619 1.00 0.52 H new ATOM 0 HB3 LYS A 59 11.073 -6.599 -4.274 1.00 0.52 H new ATOM 0 HG2 LYS A 59 9.749 -8.387 -3.426 1.00 0.60 H new ATOM 0 HG3 LYS A 59 8.938 -7.829 -4.876 1.00 0.60 H new ATOM 0 HD2 LYS A 59 10.849 -9.993 -5.460 1.00 0.81 H new ATOM 0 HD3 LYS A 59 9.657 -10.480 -4.272 1.00 0.81 H new ATOM 0 HE2 LYS A 59 7.859 -9.589 -5.869 1.00 1.17 H new ATOM 0 HE3 LYS A 59 9.123 -9.402 -7.069 1.00 1.17 H new ATOM 0 HZ1 LYS A 59 8.622 -11.501 -7.602 1.00 1.55 H new ATOM 0 HZ2 LYS A 59 9.507 -11.948 -6.223 1.00 1.55 H new ATOM 0 HZ3 LYS A 59 7.817 -11.802 -6.137 1.00 1.55 H new ATOM 941 N MET A 60 13.325 -5.900 -6.383 1.00 0.39 N ATOM 942 CA MET A 60 14.258 -4.749 -6.473 1.00 0.41 C ATOM 943 C MET A 60 14.190 -4.017 -7.838 1.00 0.42 C ATOM 944 O MET A 60 14.272 -2.787 -7.874 1.00 0.46 O ATOM 945 CB MET A 60 15.696 -5.237 -6.187 1.00 0.45 C ATOM 946 CG MET A 60 16.736 -4.129 -6.015 1.00 0.53 C ATOM 947 SD MET A 60 18.349 -4.767 -5.498 1.00 0.66 S ATOM 948 CE MET A 60 19.459 -3.544 -6.191 1.00 0.84 C ATOM 0 H MET A 60 13.792 -6.789 -6.206 1.00 0.39 H new ATOM 0 HA MET A 60 13.953 -4.018 -5.724 1.00 0.41 H new ATOM 0 HB2 MET A 60 15.683 -5.845 -5.283 1.00 0.45 H new ATOM 0 HB3 MET A 60 16.012 -5.886 -7.004 1.00 0.45 H new ATOM 0 HG2 MET A 60 16.847 -3.590 -6.956 1.00 0.53 H new ATOM 0 HG3 MET A 60 16.379 -3.411 -5.276 1.00 0.53 H new ATOM 0 HE1 MET A 60 20.489 -3.809 -5.951 1.00 0.84 H new ATOM 0 HE2 MET A 60 19.336 -3.513 -7.274 1.00 0.84 H new ATOM 0 HE3 MET A 60 19.229 -2.565 -5.771 1.00 0.84 H new ATOM 958 N LYS A 61 14.046 -4.773 -8.949 1.00 0.44 N ATOM 959 CA LYS A 61 13.974 -4.178 -10.308 1.00 0.49 C ATOM 960 C LYS A 61 12.684 -3.358 -10.511 1.00 0.46 C ATOM 961 O LYS A 61 12.733 -2.257 -11.069 1.00 0.49 O ATOM 962 CB LYS A 61 14.085 -5.268 -11.403 1.00 0.59 C ATOM 963 CG LYS A 61 15.515 -5.775 -11.667 1.00 0.70 C ATOM 964 CD LYS A 61 16.402 -4.759 -12.409 1.00 1.11 C ATOM 965 CE LYS A 61 15.937 -4.487 -13.842 1.00 1.90 C ATOM 966 NZ LYS A 61 16.916 -3.657 -14.609 1.00 2.56 N ATOM 0 H LYS A 61 13.977 -5.791 -8.935 1.00 0.44 H new ATOM 0 HA LYS A 61 14.823 -3.500 -10.399 1.00 0.49 H new ATOM 0 HB2 LYS A 61 13.461 -6.115 -11.117 1.00 0.59 H new ATOM 0 HB3 LYS A 61 13.678 -4.872 -12.333 1.00 0.59 H new ATOM 0 HG2 LYS A 61 15.984 -6.027 -10.716 1.00 0.70 H new ATOM 0 HG3 LYS A 61 15.464 -6.694 -12.251 1.00 0.70 H new ATOM 0 HD2 LYS A 61 16.413 -3.821 -11.853 1.00 1.11 H new ATOM 0 HD3 LYS A 61 17.427 -5.129 -12.430 1.00 1.11 H new ATOM 0 HE2 LYS A 61 15.785 -5.435 -14.358 1.00 1.90 H new ATOM 0 HE3 LYS A 61 14.973 -3.979 -13.818 1.00 1.90 H new ATOM 0 HZ1 LYS A 61 16.558 -3.500 -15.573 1.00 2.56 H new ATOM 0 HZ2 LYS A 61 17.043 -2.741 -14.133 1.00 2.56 H new ATOM 0 HZ3 LYS A 61 17.829 -4.152 -14.656 1.00 2.56 H new ATOM 980 N SER A 62 11.531 -3.898 -10.059 1.00 0.44 N ATOM 981 CA SER A 62 10.227 -3.203 -10.179 1.00 0.46 C ATOM 982 C SER A 62 10.184 -1.902 -9.345 1.00 0.43 C ATOM 983 O SER A 62 9.500 -0.949 -9.729 1.00 0.47 O ATOM 984 CB SER A 62 9.077 -4.131 -9.753 1.00 0.53 C ATOM 985 OG SER A 62 9.003 -5.269 -10.594 1.00 0.61 O ATOM 0 H SER A 62 11.475 -4.811 -9.608 1.00 0.44 H new ATOM 0 HA SER A 62 10.105 -2.933 -11.228 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.224 -4.447 -8.720 1.00 0.53 H new ATOM 0 HB3 SER A 62 8.134 -3.586 -9.789 1.00 0.53 H new ATOM 0 HG SER A 62 9.585 -5.975 -10.242 1.00 0.61 H new ATOM 991 N LEU A 63 10.921 -1.865 -8.210 1.00 0.40 N ATOM 992 CA LEU A 63 10.966 -0.677 -7.334 1.00 0.43 C ATOM 993 C LEU A 63 11.818 0.437 -7.961 1.00 0.45 C ATOM 994 O LEU A 63 11.319 1.537 -8.205 1.00 0.53 O ATOM 995 CB LEU A 63 11.515 -1.029 -5.930 1.00 0.45 C ATOM 996 CG LEU A 63 10.747 -2.127 -5.158 1.00 0.42 C ATOM 997 CD1 LEU A 63 11.581 -2.650 -3.983 1.00 0.48 C ATOM 998 CD2 LEU A 63 9.382 -1.626 -4.678 1.00 0.68 C ATOM 0 H LEU A 63 11.491 -2.645 -7.882 1.00 0.40 H new ATOM 0 HA LEU A 63 9.942 -0.320 -7.224 1.00 0.43 H new ATOM 0 HB2 LEU A 63 12.553 -1.345 -6.036 1.00 0.45 H new ATOM 0 HB3 LEU A 63 11.519 -0.122 -5.325 1.00 0.45 H new ATOM 0 HG LEU A 63 10.570 -2.953 -5.847 1.00 0.42 H new ATOM 0 HD11 LEU A 63 11.021 -3.421 -3.454 1.00 0.48 H new ATOM 0 HD12 LEU A 63 12.514 -3.071 -4.358 1.00 0.48 H new ATOM 0 HD13 LEU A 63 11.802 -1.830 -3.300 1.00 0.48 H new ATOM 0 HD21 LEU A 63 8.870 -2.424 -4.140 1.00 0.68 H new ATOM 0 HD22 LEU A 63 9.520 -0.772 -4.015 1.00 0.68 H new ATOM 0 HD23 LEU A 63 8.782 -1.325 -5.537 1.00 0.68 H new ATOM 1010 N ASP A 64 13.102 0.130 -8.241 1.00 0.45 N ATOM 1011 CA ASP A 64 14.030 1.105 -8.837 1.00 0.51 C ATOM 1012 C ASP A 64 13.864 1.147 -10.365 1.00 0.50 C ATOM 1013 O ASP A 64 14.600 0.480 -11.103 1.00 0.54 O ATOM 1014 CB ASP A 64 15.491 0.781 -8.454 1.00 0.60 C ATOM 1015 CG ASP A 64 15.751 0.888 -6.960 1.00 0.83 C ATOM 1016 OD1 ASP A 64 16.027 2.010 -6.483 1.00 1.28 O ATOM 1017 OD2 ASP A 64 15.677 -0.151 -6.269 1.00 1.39 O ATOM 0 H ASP A 64 13.516 -0.785 -8.063 1.00 0.45 H new ATOM 0 HA ASP A 64 13.788 2.091 -8.439 1.00 0.51 H new ATOM 0 HB2 ASP A 64 15.733 -0.228 -8.788 1.00 0.60 H new ATOM 0 HB3 ASP A 64 16.159 1.461 -8.983 1.00 0.60 H new ATOM 1022 N VAL A 65 12.864 1.926 -10.826 1.00 0.51 N ATOM 1023 CA VAL A 65 12.583 2.090 -12.266 1.00 0.55 C ATOM 1024 C VAL A 65 13.373 3.288 -12.836 1.00 0.55 C ATOM 1025 O VAL A 65 13.901 3.206 -13.949 1.00 0.60 O ATOM 1026 CB VAL A 65 11.040 2.220 -12.548 1.00 0.64 C ATOM 1027 CG1 VAL A 65 10.429 3.488 -11.938 1.00 0.67 C ATOM 1028 CG2 VAL A 65 10.732 2.132 -14.047 1.00 0.73 C ATOM 0 H VAL A 65 12.236 2.453 -10.219 1.00 0.51 H new ATOM 0 HA VAL A 65 12.918 1.190 -12.781 1.00 0.55 H new ATOM 0 HB VAL A 65 10.569 1.371 -12.052 1.00 0.64 H new ATOM 0 HG11 VAL A 65 9.363 3.524 -12.165 1.00 0.67 H new ATOM 0 HG12 VAL A 65 10.570 3.476 -10.857 1.00 0.67 H new ATOM 0 HG13 VAL A 65 10.919 4.366 -12.358 1.00 0.67 H new ATOM 0 HG21 VAL A 65 9.657 2.226 -14.204 1.00 0.73 H new ATOM 0 HG22 VAL A 65 11.247 2.937 -14.572 1.00 0.73 H new ATOM 0 HG23 VAL A 65 11.073 1.171 -14.433 1.00 0.73 H new ATOM 1038 N ASN A 66 13.455 4.391 -12.057 1.00 0.56 N ATOM 1039 CA ASN A 66 14.209 5.595 -12.459 1.00 0.60 C ATOM 1040 C ASN A 66 15.735 5.371 -12.308 1.00 0.59 C ATOM 1041 O ASN A 66 16.523 6.027 -12.999 1.00 0.66 O ATOM 1042 CB ASN A 66 13.759 6.821 -11.628 1.00 0.67 C ATOM 1043 CG ASN A 66 14.245 8.161 -12.194 1.00 0.94 C ATOM 1044 OD1 ASN A 66 14.379 8.323 -13.408 1.00 1.29 O ATOM 1045 ND2 ASN A 66 14.510 9.134 -11.316 1.00 1.44 N ATOM 0 H ASN A 66 13.006 4.469 -11.144 1.00 0.56 H new ATOM 0 HA ASN A 66 13.996 5.790 -13.510 1.00 0.60 H new ATOM 0 HB2 ASN A 66 12.670 6.833 -11.574 1.00 0.67 H new ATOM 0 HB3 ASN A 66 14.127 6.712 -10.608 1.00 0.67 H new ATOM 0 HD21 ASN A 66 14.834 10.044 -11.645 1.00 1.44 H new ATOM 0 HD22 ASN A 66 14.388 8.967 -10.317 1.00 1.44 H new ATOM 1052 N GLN A 67 16.140 4.447 -11.392 1.00 0.55 N ATOM 1053 CA GLN A 67 17.558 4.104 -11.136 1.00 0.60 C ATOM 1054 C GLN A 67 18.348 5.313 -10.591 1.00 0.63 C ATOM 1055 O GLN A 67 19.060 5.996 -11.338 1.00 0.78 O ATOM 1056 CB GLN A 67 18.233 3.512 -12.402 1.00 0.70 C ATOM 1057 CG GLN A 67 17.614 2.192 -12.876 1.00 0.88 C ATOM 1058 CD GLN A 67 17.932 1.864 -14.333 1.00 1.20 C ATOM 1059 OE1 GLN A 67 18.943 1.226 -14.626 1.00 1.96 O ATOM 1060 NE2 GLN A 67 17.067 2.296 -15.257 1.00 1.86 N ATOM 0 H GLN A 67 15.486 3.921 -10.812 1.00 0.55 H new ATOM 0 HA GLN A 67 17.571 3.335 -10.364 1.00 0.60 H new ATOM 0 HB2 GLN A 67 18.171 4.242 -13.210 1.00 0.70 H new ATOM 0 HB3 GLN A 67 19.292 3.353 -12.197 1.00 0.70 H new ATOM 0 HG2 GLN A 67 17.974 1.382 -12.242 1.00 0.88 H new ATOM 0 HG3 GLN A 67 16.532 2.240 -12.749 1.00 0.88 H new ATOM 0 HE21 GLN A 67 16.240 2.822 -14.975 1.00 1.86 H new ATOM 0 HE22 GLN A 67 17.234 2.099 -16.244 1.00 1.86 H new ATOM 1069 N ASP A 68 18.187 5.571 -9.278 1.00 0.62 N ATOM 1070 CA ASP A 68 18.871 6.681 -8.585 1.00 0.71 C ATOM 1071 C ASP A 68 19.536 6.192 -7.266 1.00 0.77 C ATOM 1072 O ASP A 68 19.754 6.991 -6.353 1.00 1.32 O ATOM 1073 CB ASP A 68 17.847 7.812 -8.304 1.00 0.78 C ATOM 1074 CG ASP A 68 18.493 9.148 -7.959 1.00 1.08 C ATOM 1075 OD1 ASP A 68 19.077 9.782 -8.865 1.00 1.41 O ATOM 1076 OD2 ASP A 68 18.408 9.560 -6.782 1.00 1.37 O ATOM 0 H ASP A 68 17.582 5.019 -8.670 1.00 0.62 H new ATOM 0 HA ASP A 68 19.666 7.066 -9.224 1.00 0.71 H new ATOM 0 HB2 ASP A 68 17.211 7.941 -9.180 1.00 0.78 H new ATOM 0 HB3 ASP A 68 17.199 7.508 -7.482 1.00 0.78 H new ATOM 1081 N SER A 69 19.877 4.876 -7.192 1.00 0.62 N ATOM 1082 CA SER A 69 20.506 4.245 -6.004 1.00 0.67 C ATOM 1083 C SER A 69 19.518 4.124 -4.821 1.00 0.68 C ATOM 1084 O SER A 69 19.125 3.009 -4.464 1.00 1.24 O ATOM 1085 CB SER A 69 21.816 4.958 -5.580 1.00 0.82 C ATOM 1086 OG SER A 69 22.465 4.254 -4.526 1.00 1.31 O ATOM 0 H SER A 69 19.721 4.223 -7.960 1.00 0.62 H new ATOM 0 HA SER A 69 20.779 3.233 -6.303 1.00 0.67 H new ATOM 0 HB2 SER A 69 22.486 5.035 -6.437 1.00 0.82 H new ATOM 0 HB3 SER A 69 21.592 5.975 -5.258 1.00 0.82 H new ATOM 0 HG SER A 69 22.213 4.649 -3.665 1.00 1.31 H new ATOM 1092 N GLU A 70 19.115 5.266 -4.215 1.00 0.66 N ATOM 1093 CA GLU A 70 18.165 5.269 -3.079 1.00 0.77 C ATOM 1094 C GLU A 70 16.747 4.902 -3.541 1.00 0.64 C ATOM 1095 O GLU A 70 16.372 5.179 -4.684 1.00 0.75 O ATOM 1096 CB GLU A 70 18.142 6.650 -2.380 1.00 1.13 C ATOM 1097 CG GLU A 70 19.292 6.898 -1.401 1.00 1.41 C ATOM 1098 CD GLU A 70 20.650 7.036 -2.074 1.00 1.90 C ATOM 1099 OE1 GLU A 70 21.291 5.994 -2.336 1.00 2.41 O ATOM 1100 OE2 GLU A 70 21.067 8.182 -2.340 1.00 2.42 O ATOM 0 H GLU A 70 19.433 6.194 -4.494 1.00 0.66 H new ATOM 0 HA GLU A 70 18.507 4.517 -2.368 1.00 0.77 H new ATOM 0 HB2 GLU A 70 18.161 7.427 -3.144 1.00 1.13 H new ATOM 0 HB3 GLU A 70 17.199 6.753 -1.843 1.00 1.13 H new ATOM 0 HG2 GLU A 70 19.084 7.805 -0.833 1.00 1.41 H new ATOM 0 HG3 GLU A 70 19.333 6.076 -0.686 1.00 1.41 H new ATOM 1107 N LEU A 71 15.961 4.288 -2.631 1.00 0.57 N ATOM 1108 CA LEU A 71 14.584 3.860 -2.928 1.00 0.51 C ATOM 1109 C LEU A 71 13.546 4.793 -2.270 1.00 0.51 C ATOM 1110 O LEU A 71 13.165 4.584 -1.118 1.00 0.53 O ATOM 1111 CB LEU A 71 14.356 2.398 -2.449 1.00 0.53 C ATOM 1112 CG LEU A 71 14.974 1.271 -3.314 1.00 0.66 C ATOM 1113 CD1 LEU A 71 16.508 1.294 -3.290 1.00 0.95 C ATOM 1114 CD2 LEU A 71 14.457 -0.095 -2.852 1.00 0.74 C ATOM 0 H LEU A 71 16.263 4.078 -1.679 1.00 0.57 H new ATOM 0 HA LEU A 71 14.450 3.912 -4.009 1.00 0.51 H new ATOM 0 HB2 LEU A 71 14.754 2.306 -1.438 1.00 0.53 H new ATOM 0 HB3 LEU A 71 13.282 2.226 -2.385 1.00 0.53 H new ATOM 0 HG LEU A 71 14.664 1.447 -4.344 1.00 0.66 H new ATOM 0 HD11 LEU A 71 16.894 0.485 -3.911 1.00 0.95 H new ATOM 0 HD12 LEU A 71 16.864 2.249 -3.676 1.00 0.95 H new ATOM 0 HD13 LEU A 71 16.858 1.164 -2.266 1.00 0.95 H new ATOM 0 HD21 LEU A 71 14.899 -0.878 -3.468 1.00 0.74 H new ATOM 0 HD22 LEU A 71 14.732 -0.255 -1.809 1.00 0.74 H new ATOM 0 HD23 LEU A 71 13.372 -0.125 -2.950 1.00 0.74 H new ATOM 1126 N LYS A 72 13.084 5.826 -3.011 1.00 0.53 N ATOM 1127 CA LYS A 72 12.059 6.767 -2.498 1.00 0.56 C ATOM 1128 C LYS A 72 10.708 6.032 -2.366 1.00 0.50 C ATOM 1129 O LYS A 72 10.533 4.977 -2.976 1.00 0.48 O ATOM 1130 CB LYS A 72 11.938 7.995 -3.435 1.00 0.63 C ATOM 1131 CG LYS A 72 11.051 9.127 -2.905 1.00 0.86 C ATOM 1132 CD LYS A 72 10.966 10.310 -3.871 1.00 1.00 C ATOM 1133 CE LYS A 72 9.896 11.315 -3.439 1.00 1.43 C ATOM 1134 NZ LYS A 72 8.510 10.800 -3.667 1.00 1.89 N ATOM 0 H LYS A 72 13.401 6.029 -3.959 1.00 0.53 H new ATOM 0 HA LYS A 72 12.357 7.129 -1.514 1.00 0.56 H new ATOM 0 HB2 LYS A 72 12.936 8.392 -3.620 1.00 0.63 H new ATOM 0 HB3 LYS A 72 11.543 7.663 -4.395 1.00 0.63 H new ATOM 0 HG2 LYS A 72 10.048 8.741 -2.720 1.00 0.86 H new ATOM 0 HG3 LYS A 72 11.442 9.472 -1.948 1.00 0.86 H new ATOM 0 HD2 LYS A 72 11.934 10.808 -3.923 1.00 1.00 H new ATOM 0 HD3 LYS A 72 10.741 9.946 -4.874 1.00 1.00 H new ATOM 0 HE2 LYS A 72 10.025 11.549 -2.382 1.00 1.43 H new ATOM 0 HE3 LYS A 72 10.031 12.246 -3.990 1.00 1.43 H new ATOM 0 HZ1 LYS A 72 7.990 11.462 -4.278 1.00 1.89 H new ATOM 0 HZ2 LYS A 72 8.557 9.868 -4.127 1.00 1.89 H new ATOM 0 HZ3 LYS A 72 8.018 10.712 -2.755 1.00 1.89 H new ATOM 1148 N PHE A 73 9.757 6.574 -1.570 1.00 0.53 N ATOM 1149 CA PHE A 73 8.438 5.921 -1.385 1.00 0.50 C ATOM 1150 C PHE A 73 7.654 5.774 -2.714 1.00 0.47 C ATOM 1151 O PHE A 73 6.832 4.863 -2.837 1.00 0.47 O ATOM 1152 CB PHE A 73 7.585 6.646 -0.319 1.00 0.56 C ATOM 1153 CG PHE A 73 6.694 5.704 0.473 1.00 0.69 C ATOM 1154 CD1 PHE A 73 5.434 5.357 0.008 1.00 0.89 C ATOM 1155 CD2 PHE A 73 7.131 5.155 1.674 1.00 0.87 C ATOM 1156 CE1 PHE A 73 4.633 4.488 0.722 1.00 1.12 C ATOM 1157 CE2 PHE A 73 6.330 4.289 2.390 1.00 1.11 C ATOM 1158 CZ PHE A 73 5.082 3.955 1.913 1.00 1.20 C ATOM 0 H PHE A 73 9.873 7.446 -1.054 1.00 0.53 H new ATOM 0 HA PHE A 73 8.646 4.914 -1.023 1.00 0.50 H new ATOM 0 HB2 PHE A 73 8.246 7.175 0.368 1.00 0.56 H new ATOM 0 HB3 PHE A 73 6.965 7.398 -0.808 1.00 0.56 H new ATOM 0 HD1 PHE A 73 5.076 5.771 -0.923 1.00 0.89 H new ATOM 0 HD2 PHE A 73 8.110 5.410 2.051 1.00 0.87 H new ATOM 0 HE1 PHE A 73 3.654 4.225 0.348 1.00 1.12 H new ATOM 0 HE2 PHE A 73 6.681 3.874 3.323 1.00 1.11 H new ATOM 0 HZ PHE A 73 4.455 3.276 2.471 1.00 1.20 H new ATOM 1168 N ASN A 74 7.910 6.668 -3.700 1.00 0.49 N ATOM 1169 CA ASN A 74 7.261 6.578 -5.027 1.00 0.51 C ATOM 1170 C ASN A 74 7.812 5.352 -5.800 1.00 0.49 C ATOM 1171 O ASN A 74 7.095 4.748 -6.603 1.00 0.53 O ATOM 1172 CB ASN A 74 7.470 7.884 -5.833 1.00 0.57 C ATOM 1173 CG ASN A 74 6.776 7.877 -7.198 1.00 0.65 C ATOM 1174 OD1 ASN A 74 7.378 7.500 -8.204 1.00 0.98 O ATOM 1175 ND2 ASN A 74 5.508 8.293 -7.238 1.00 0.91 N ATOM 0 H ASN A 74 8.555 7.452 -3.601 1.00 0.49 H new ATOM 0 HA ASN A 74 6.188 6.447 -4.886 1.00 0.51 H new ATOM 0 HB2 ASN A 74 7.097 8.726 -5.249 1.00 0.57 H new ATOM 0 HB3 ASN A 74 8.538 8.045 -5.978 1.00 0.57 H new ATOM 0 HD21 ASN A 74 5.003 8.306 -8.124 1.00 0.91 H new ATOM 0 HD22 ASN A 74 5.044 8.598 -6.382 1.00 0.91 H new ATOM 1182 N GLU A 75 9.099 5.011 -5.556 1.00 0.46 N ATOM 1183 CA GLU A 75 9.744 3.837 -6.174 1.00 0.47 C ATOM 1184 C GLU A 75 9.438 2.568 -5.353 1.00 0.43 C ATOM 1185 O GLU A 75 9.165 1.514 -5.926 1.00 0.44 O ATOM 1186 CB GLU A 75 11.267 4.051 -6.313 1.00 0.53 C ATOM 1187 CG GLU A 75 11.660 4.973 -7.469 1.00 0.61 C ATOM 1188 CD GLU A 75 11.486 6.453 -7.152 1.00 0.78 C ATOM 1189 OE1 GLU A 75 12.445 7.071 -6.648 1.00 0.98 O ATOM 1190 OE2 GLU A 75 10.388 6.990 -7.411 1.00 1.03 O ATOM 0 H GLU A 75 9.710 5.537 -4.932 1.00 0.46 H new ATOM 0 HA GLU A 75 9.336 3.707 -7.176 1.00 0.47 H new ATOM 0 HB2 GLU A 75 11.652 4.467 -5.382 1.00 0.53 H new ATOM 0 HB3 GLU A 75 11.749 3.083 -6.453 1.00 0.53 H new ATOM 0 HG2 GLU A 75 12.701 4.786 -7.735 1.00 0.61 H new ATOM 0 HG3 GLU A 75 11.058 4.724 -8.343 1.00 0.61 H new ATOM 1197 N TYR A 76 9.472 2.689 -4.000 1.00 0.42 N ATOM 1198 CA TYR A 76 9.151 1.572 -3.076 1.00 0.41 C ATOM 1199 C TYR A 76 7.641 1.206 -3.144 1.00 0.39 C ATOM 1200 O TYR A 76 7.233 0.142 -2.671 1.00 0.52 O ATOM 1201 CB TYR A 76 9.551 1.950 -1.629 1.00 0.44 C ATOM 1202 CG TYR A 76 9.497 0.803 -0.621 1.00 0.45 C ATOM 1203 CD1 TYR A 76 10.320 -0.314 -0.756 1.00 0.52 C ATOM 1204 CD2 TYR A 76 8.632 0.843 0.471 1.00 0.51 C ATOM 1205 CE1 TYR A 76 10.280 -1.347 0.159 1.00 0.59 C ATOM 1206 CE2 TYR A 76 8.592 -0.187 1.392 1.00 0.57 C ATOM 1207 CZ TYR A 76 9.417 -1.282 1.231 1.00 0.59 C ATOM 1208 OH TYR A 76 9.388 -2.312 2.148 1.00 0.69 O ATOM 0 H TYR A 76 9.721 3.556 -3.524 1.00 0.42 H new ATOM 0 HA TYR A 76 9.722 0.696 -3.385 1.00 0.41 H new ATOM 0 HB2 TYR A 76 10.563 2.354 -1.642 1.00 0.44 H new ATOM 0 HB3 TYR A 76 8.894 2.748 -1.284 1.00 0.44 H new ATOM 0 HD1 TYR A 76 11.001 -0.372 -1.592 1.00 0.52 H new ATOM 0 HD2 TYR A 76 7.981 1.695 0.600 1.00 0.51 H new ATOM 0 HE1 TYR A 76 10.924 -2.205 0.035 1.00 0.59 H new ATOM 0 HE2 TYR A 76 7.918 -0.135 2.234 1.00 0.57 H new ATOM 0 HH TYR A 76 8.727 -2.112 2.843 1.00 0.69 H new ATOM 1218 N TRP A 77 6.837 2.135 -3.716 1.00 0.40 N ATOM 1219 CA TRP A 77 5.376 2.005 -3.932 1.00 0.42 C ATOM 1220 C TRP A 77 4.939 0.591 -4.394 1.00 0.37 C ATOM 1221 O TRP A 77 3.917 0.082 -3.923 1.00 0.39 O ATOM 1222 CB TRP A 77 4.995 3.069 -4.995 1.00 0.58 C ATOM 1223 CG TRP A 77 3.537 3.246 -5.357 1.00 0.49 C ATOM 1224 CD1 TRP A 77 2.426 2.788 -4.700 1.00 0.53 C ATOM 1225 CD2 TRP A 77 3.053 3.982 -6.490 1.00 0.78 C ATOM 1226 NE1 TRP A 77 1.287 3.189 -5.364 1.00 0.77 N ATOM 1227 CE2 TRP A 77 1.651 3.924 -6.466 1.00 0.97 C ATOM 1228 CE3 TRP A 77 3.681 4.682 -7.530 1.00 1.04 C ATOM 1229 CZ2 TRP A 77 0.865 4.546 -7.439 1.00 1.40 C ATOM 1230 CZ3 TRP A 77 2.902 5.297 -8.491 1.00 1.45 C ATOM 1231 CH2 TRP A 77 1.506 5.223 -8.439 1.00 1.62 C ATOM 0 H TRP A 77 7.201 3.027 -4.051 1.00 0.40 H new ATOM 0 HA TRP A 77 4.858 2.162 -2.986 1.00 0.42 H new ATOM 0 HB2 TRP A 77 5.368 4.032 -4.647 1.00 0.58 H new ATOM 0 HB3 TRP A 77 5.536 2.830 -5.911 1.00 0.58 H new ATOM 0 HD1 TRP A 77 2.440 2.199 -3.795 1.00 0.53 H new ATOM 0 HE1 TRP A 77 0.330 2.975 -5.083 1.00 0.77 H new ATOM 0 HE3 TRP A 77 4.758 4.740 -7.579 1.00 1.04 H new ATOM 0 HZ2 TRP A 77 -0.213 4.494 -7.403 1.00 1.40 H new ATOM 0 HZ3 TRP A 77 3.377 5.842 -9.293 1.00 1.45 H new ATOM 0 HH2 TRP A 77 0.922 5.711 -9.205 1.00 1.62 H new ATOM 1242 N ARG A 78 5.719 -0.034 -5.302 1.00 0.39 N ATOM 1243 CA ARG A 78 5.394 -1.376 -5.846 1.00 0.42 C ATOM 1244 C ARG A 78 5.382 -2.480 -4.772 1.00 0.40 C ATOM 1245 O ARG A 78 4.584 -3.416 -4.873 1.00 0.45 O ATOM 1246 CB ARG A 78 6.371 -1.760 -6.980 1.00 0.49 C ATOM 1247 CG ARG A 78 6.193 -0.938 -8.264 1.00 0.64 C ATOM 1248 CD ARG A 78 4.998 -1.407 -9.103 1.00 0.82 C ATOM 1249 NE ARG A 78 5.310 -2.611 -9.894 1.00 1.11 N ATOM 1250 CZ ARG A 78 5.488 -2.661 -11.234 1.00 1.57 C ATOM 1251 NH1 ARG A 78 5.400 -1.571 -12.012 1.00 1.96 N ATOM 1252 NH2 ARG A 78 5.770 -3.834 -11.803 1.00 1.93 N ATOM 0 H ARG A 78 6.579 0.367 -5.676 1.00 0.39 H new ATOM 0 HA ARG A 78 4.381 -1.303 -6.242 1.00 0.42 H new ATOM 0 HB2 ARG A 78 7.393 -1.638 -6.622 1.00 0.49 H new ATOM 0 HB3 ARG A 78 6.240 -2.816 -7.216 1.00 0.49 H new ATOM 0 HG2 ARG A 78 6.060 0.112 -8.003 1.00 0.64 H new ATOM 0 HG3 ARG A 78 7.101 -1.005 -8.863 1.00 0.64 H new ATOM 0 HD2 ARG A 78 4.154 -1.615 -8.445 1.00 0.82 H new ATOM 0 HD3 ARG A 78 4.689 -0.604 -9.773 1.00 0.82 H new ATOM 0 HE ARG A 78 5.400 -3.489 -9.383 1.00 1.11 H new ATOM 0 HH11 ARG A 78 5.192 -0.663 -11.596 1.00 1.96 H new ATOM 0 HH12 ARG A 78 5.541 -1.651 -13.019 1.00 1.96 H new ATOM 0 HH21 ARG A 78 5.848 -4.674 -11.229 1.00 1.93 H new ATOM 0 HH22 ARG A 78 5.908 -3.891 -12.812 1.00 1.93 H new ATOM 1266 N LEU A 79 6.251 -2.373 -3.745 1.00 0.37 N ATOM 1267 CA LEU A 79 6.309 -3.385 -2.672 1.00 0.37 C ATOM 1268 C LEU A 79 5.182 -3.191 -1.647 1.00 0.36 C ATOM 1269 O LEU A 79 4.760 -4.161 -1.017 1.00 0.39 O ATOM 1270 CB LEU A 79 7.672 -3.384 -1.953 1.00 0.40 C ATOM 1271 CG LEU A 79 8.162 -4.780 -1.503 1.00 0.44 C ATOM 1272 CD1 LEU A 79 8.834 -5.524 -2.662 1.00 0.49 C ATOM 1273 CD2 LEU A 79 9.101 -4.667 -0.304 1.00 0.53 C ATOM 0 H LEU A 79 6.914 -1.606 -3.637 1.00 0.37 H new ATOM 0 HA LEU A 79 6.176 -4.352 -3.157 1.00 0.37 H new ATOM 0 HB2 LEU A 79 8.418 -2.948 -2.617 1.00 0.40 H new ATOM 0 HB3 LEU A 79 7.606 -2.737 -1.078 1.00 0.40 H new ATOM 0 HG LEU A 79 7.293 -5.360 -1.194 1.00 0.44 H new ATOM 0 HD11 LEU A 79 9.170 -6.503 -2.320 1.00 0.49 H new ATOM 0 HD12 LEU A 79 8.120 -5.649 -3.476 1.00 0.49 H new ATOM 0 HD13 LEU A 79 9.690 -4.950 -3.015 1.00 0.49 H new ATOM 0 HD21 LEU A 79 9.432 -5.662 -0.006 1.00 0.53 H new ATOM 0 HD22 LEU A 79 9.967 -4.063 -0.575 1.00 0.53 H new ATOM 0 HD23 LEU A 79 8.575 -4.196 0.527 1.00 0.53 H new ATOM 1285 N ILE A 80 4.704 -1.934 -1.475 1.00 0.38 N ATOM 1286 CA ILE A 80 3.601 -1.628 -0.535 1.00 0.41 C ATOM 1287 C ILE A 80 2.361 -2.498 -0.857 1.00 0.40 C ATOM 1288 O ILE A 80 1.696 -2.992 0.057 1.00 0.43 O ATOM 1289 CB ILE A 80 3.226 -0.099 -0.547 1.00 0.49 C ATOM 1290 CG1 ILE A 80 4.461 0.796 -0.240 1.00 0.53 C ATOM 1291 CG2 ILE A 80 2.082 0.216 0.432 1.00 0.59 C ATOM 1292 CD1 ILE A 80 5.112 0.566 1.119 1.00 0.61 C ATOM 0 H ILE A 80 5.064 -1.120 -1.973 1.00 0.38 H new ATOM 0 HA ILE A 80 3.949 -1.868 0.470 1.00 0.41 H new ATOM 0 HB ILE A 80 2.881 0.130 -1.555 1.00 0.49 H new ATOM 0 HG12 ILE A 80 5.209 0.632 -1.015 1.00 0.53 H new ATOM 0 HG13 ILE A 80 4.157 1.841 -0.307 1.00 0.53 H new ATOM 0 HG21 ILE A 80 1.853 1.281 0.394 1.00 0.59 H new ATOM 0 HG22 ILE A 80 1.197 -0.355 0.153 1.00 0.59 H new ATOM 0 HG23 ILE A 80 2.384 -0.054 1.444 1.00 0.59 H new ATOM 0 HD11 ILE A 80 5.962 1.239 1.234 1.00 0.61 H new ATOM 0 HD12 ILE A 80 4.386 0.761 1.908 1.00 0.61 H new ATOM 0 HD13 ILE A 80 5.454 -0.467 1.188 1.00 0.61 H new ATOM 1304 N GLY A 81 2.066 -2.679 -2.166 1.00 0.40 N ATOM 1305 CA GLY A 81 0.948 -3.523 -2.596 1.00 0.44 C ATOM 1306 C GLY A 81 1.270 -5.018 -2.486 1.00 0.41 C ATOM 1307 O GLY A 81 0.380 -5.822 -2.189 1.00 0.47 O ATOM 0 H GLY A 81 2.588 -2.251 -2.931 1.00 0.40 H new ATOM 0 HA2 GLY A 81 0.071 -3.297 -1.989 1.00 0.44 H new ATOM 0 HA3 GLY A 81 0.692 -3.284 -3.628 1.00 0.44 H new ATOM 1311 N GLU A 82 2.552 -5.385 -2.726 1.00 0.38 N ATOM 1312 CA GLU A 82 3.024 -6.788 -2.638 1.00 0.38 C ATOM 1313 C GLU A 82 3.066 -7.290 -1.176 1.00 0.36 C ATOM 1314 O GLU A 82 2.940 -8.494 -0.936 1.00 0.42 O ATOM 1315 CB GLU A 82 4.429 -6.934 -3.268 1.00 0.43 C ATOM 1316 CG GLU A 82 4.501 -6.633 -4.771 1.00 0.51 C ATOM 1317 CD GLU A 82 4.129 -7.822 -5.642 1.00 0.62 C ATOM 1318 OE1 GLU A 82 5.028 -8.631 -5.953 1.00 0.83 O ATOM 1319 OE2 GLU A 82 2.942 -7.936 -6.017 1.00 0.86 O ATOM 0 H GLU A 82 3.283 -4.722 -2.984 1.00 0.38 H new ATOM 0 HA GLU A 82 2.310 -7.398 -3.192 1.00 0.38 H new ATOM 0 HB2 GLU A 82 5.116 -6.267 -2.746 1.00 0.43 H new ATOM 0 HB3 GLU A 82 4.782 -7.951 -3.099 1.00 0.43 H new ATOM 0 HG2 GLU A 82 3.835 -5.801 -5.000 1.00 0.51 H new ATOM 0 HG3 GLU A 82 5.511 -6.310 -5.022 1.00 0.51 H new ATOM 1326 N LEU A 83 3.241 -6.360 -0.205 1.00 0.36 N ATOM 1327 CA LEU A 83 3.292 -6.706 1.235 1.00 0.39 C ATOM 1328 C LEU A 83 1.918 -7.192 1.734 1.00 0.40 C ATOM 1329 O LEU A 83 1.828 -8.231 2.389 1.00 0.49 O ATOM 1330 CB LEU A 83 3.777 -5.493 2.075 1.00 0.44 C ATOM 1331 CG LEU A 83 5.253 -5.532 2.541 1.00 0.49 C ATOM 1332 CD1 LEU A 83 6.224 -5.573 1.355 1.00 0.67 C ATOM 1333 CD2 LEU A 83 5.556 -4.332 3.441 1.00 0.61 C ATOM 0 H LEU A 83 3.349 -5.364 -0.395 1.00 0.36 H new ATOM 0 HA LEU A 83 4.007 -7.520 1.360 1.00 0.39 H new ATOM 0 HB2 LEU A 83 3.627 -4.587 1.488 1.00 0.44 H new ATOM 0 HB3 LEU A 83 3.141 -5.410 2.957 1.00 0.44 H new ATOM 0 HG LEU A 83 5.396 -6.450 3.111 1.00 0.49 H new ATOM 0 HD11 LEU A 83 7.249 -5.600 1.725 1.00 0.67 H new ATOM 0 HD12 LEU A 83 6.031 -6.464 0.757 1.00 0.67 H new ATOM 0 HD13 LEU A 83 6.083 -4.685 0.739 1.00 0.67 H new ATOM 0 HD21 LEU A 83 6.597 -4.371 3.762 1.00 0.61 H new ATOM 0 HD22 LEU A 83 5.381 -3.409 2.888 1.00 0.61 H new ATOM 0 HD23 LEU A 83 4.906 -4.360 4.315 1.00 0.61 H new ATOM 1345 N ALA A 84 0.853 -6.431 1.406 1.00 0.39 N ATOM 1346 CA ALA A 84 -0.525 -6.791 1.788 1.00 0.45 C ATOM 1347 C ALA A 84 -1.085 -7.947 0.917 1.00 0.45 C ATOM 1348 O ALA A 84 -2.137 -8.504 1.236 1.00 0.55 O ATOM 1349 CB ALA A 84 -1.434 -5.563 1.707 1.00 0.54 C ATOM 0 H ALA A 84 0.923 -5.562 0.876 1.00 0.39 H new ATOM 0 HA ALA A 84 -0.501 -7.147 2.818 1.00 0.45 H new ATOM 0 HB1 ALA A 84 -2.449 -5.842 1.991 1.00 0.54 H new ATOM 0 HB2 ALA A 84 -1.066 -4.793 2.385 1.00 0.54 H new ATOM 0 HB3 ALA A 84 -1.436 -5.178 0.687 1.00 0.54 H new ATOM 1355 N LYS A 85 -0.377 -8.288 -0.188 1.00 0.42 N ATOM 1356 CA LYS A 85 -0.768 -9.384 -1.095 1.00 0.46 C ATOM 1357 C LYS A 85 -0.245 -10.743 -0.569 1.00 0.47 C ATOM 1358 O LYS A 85 -0.965 -11.742 -0.615 1.00 0.55 O ATOM 1359 CB LYS A 85 -0.216 -9.102 -2.515 1.00 0.49 C ATOM 1360 CG LYS A 85 -0.619 -10.126 -3.595 1.00 0.59 C ATOM 1361 CD LYS A 85 0.345 -10.137 -4.791 1.00 0.64 C ATOM 1362 CE LYS A 85 -0.008 -9.096 -5.859 1.00 0.69 C ATOM 1363 NZ LYS A 85 0.061 -7.688 -5.358 1.00 0.96 N ATOM 0 H LYS A 85 0.478 -7.809 -0.471 1.00 0.42 H new ATOM 0 HA LYS A 85 -1.856 -9.437 -1.138 1.00 0.46 H new ATOM 0 HB2 LYS A 85 -0.555 -8.115 -2.829 1.00 0.49 H new ATOM 0 HB3 LYS A 85 0.872 -9.063 -2.463 1.00 0.49 H new ATOM 0 HG2 LYS A 85 -0.653 -11.121 -3.152 1.00 0.59 H new ATOM 0 HG3 LYS A 85 -1.625 -9.900 -3.947 1.00 0.59 H new ATOM 0 HD2 LYS A 85 1.359 -9.953 -4.434 1.00 0.64 H new ATOM 0 HD3 LYS A 85 0.341 -11.129 -5.244 1.00 0.64 H new ATOM 0 HE2 LYS A 85 0.672 -9.207 -6.704 1.00 0.69 H new ATOM 0 HE3 LYS A 85 -1.014 -9.293 -6.231 1.00 0.69 H new ATOM 0 HZ1 LYS A 85 0.218 -7.042 -6.158 1.00 0.96 H new ATOM 0 HZ2 LYS A 85 -0.833 -7.443 -4.886 1.00 0.96 H new ATOM 0 HZ3 LYS A 85 0.846 -7.598 -4.681 1.00 0.96 H new ATOM 1377 N GLU A 86 1.010 -10.761 -0.065 1.00 0.42 N ATOM 1378 CA GLU A 86 1.651 -11.991 0.456 1.00 0.46 C ATOM 1379 C GLU A 86 1.184 -12.345 1.894 1.00 0.52 C ATOM 1380 O GLU A 86 1.321 -13.496 2.314 1.00 0.92 O ATOM 1381 CB GLU A 86 3.192 -11.849 0.427 1.00 0.49 C ATOM 1382 CG GLU A 86 3.792 -11.586 -0.963 1.00 0.55 C ATOM 1383 CD GLU A 86 4.107 -12.856 -1.739 1.00 1.03 C ATOM 1384 OE1 GLU A 86 5.226 -13.390 -1.578 1.00 1.52 O ATOM 1385 OE2 GLU A 86 3.241 -13.310 -2.518 1.00 1.65 O ATOM 0 H GLU A 86 1.602 -9.932 -0.008 1.00 0.42 H new ATOM 0 HA GLU A 86 1.343 -12.807 -0.197 1.00 0.46 H new ATOM 0 HB2 GLU A 86 3.480 -11.034 1.091 1.00 0.49 H new ATOM 0 HB3 GLU A 86 3.634 -12.760 0.831 1.00 0.49 H new ATOM 0 HG2 GLU A 86 3.095 -10.980 -1.542 1.00 0.55 H new ATOM 0 HG3 GLU A 86 4.706 -11.002 -0.851 1.00 0.55 H new ATOM 1392 N ILE A 87 0.632 -11.360 2.641 1.00 0.44 N ATOM 1393 CA ILE A 87 0.160 -11.579 4.032 1.00 0.47 C ATOM 1394 C ILE A 87 -0.983 -12.624 4.115 1.00 0.51 C ATOM 1395 O ILE A 87 -0.990 -13.458 5.024 1.00 0.61 O ATOM 1396 CB ILE A 87 -0.266 -10.210 4.702 1.00 0.51 C ATOM 1397 CG1 ILE A 87 -0.112 -10.228 6.254 1.00 0.59 C ATOM 1398 CG2 ILE A 87 -1.676 -9.744 4.288 1.00 0.55 C ATOM 1399 CD1 ILE A 87 -1.035 -11.165 7.018 1.00 0.66 C ATOM 0 H ILE A 87 0.502 -10.406 2.305 1.00 0.44 H new ATOM 0 HA ILE A 87 0.999 -11.992 4.592 1.00 0.47 H new ATOM 0 HB ILE A 87 0.436 -9.473 4.313 1.00 0.51 H new ATOM 0 HG12 ILE A 87 0.918 -10.495 6.491 1.00 0.59 H new ATOM 0 HG13 ILE A 87 -0.272 -9.215 6.624 1.00 0.59 H new ATOM 0 HG21 ILE A 87 -1.907 -8.800 4.782 1.00 0.55 H new ATOM 0 HG22 ILE A 87 -1.711 -9.606 3.207 1.00 0.55 H new ATOM 0 HG23 ILE A 87 -2.409 -10.496 4.582 1.00 0.55 H new ATOM 0 HD11 ILE A 87 -0.831 -11.086 8.086 1.00 0.66 H new ATOM 0 HD12 ILE A 87 -2.072 -10.891 6.826 1.00 0.66 H new ATOM 0 HD13 ILE A 87 -0.864 -12.191 6.691 1.00 0.66 H new ATOM 1411 N ARG A 88 -1.913 -12.590 3.140 1.00 0.54 N ATOM 1412 CA ARG A 88 -3.071 -13.500 3.126 1.00 0.68 C ATOM 1413 C ARG A 88 -2.894 -14.658 2.128 1.00 0.68 C ATOM 1414 O ARG A 88 -3.206 -15.802 2.465 1.00 0.87 O ATOM 1415 CB ARG A 88 -4.397 -12.710 2.882 1.00 0.83 C ATOM 1416 CG ARG A 88 -4.675 -12.208 1.449 1.00 0.91 C ATOM 1417 CD ARG A 88 -3.965 -10.894 1.120 1.00 1.05 C ATOM 1418 NE ARG A 88 -4.113 -10.527 -0.298 1.00 1.18 N ATOM 1419 CZ ARG A 88 -4.937 -9.577 -0.799 1.00 1.39 C ATOM 1420 NH1 ARG A 88 -5.760 -8.866 -0.012 1.00 1.74 N ATOM 1421 NH2 ARG A 88 -4.937 -9.345 -2.112 1.00 1.73 N ATOM 0 H ARG A 88 -1.883 -11.942 2.353 1.00 0.54 H new ATOM 0 HA ARG A 88 -3.136 -13.960 4.112 1.00 0.68 H new ATOM 0 HB2 ARG A 88 -5.228 -13.348 3.182 1.00 0.83 H new ATOM 0 HB3 ARG A 88 -4.401 -11.847 3.547 1.00 0.83 H new ATOM 0 HG2 ARG A 88 -4.361 -12.971 0.737 1.00 0.91 H new ATOM 0 HG3 ARG A 88 -5.749 -12.075 1.320 1.00 0.91 H new ATOM 0 HD2 ARG A 88 -4.369 -10.097 1.745 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -2.906 -10.983 1.363 1.00 1.05 H new ATOM 0 HE ARG A 88 -3.539 -11.038 -0.968 1.00 1.18 H new ATOM 0 HH11 ARG A 88 -5.776 -9.035 0.994 1.00 1.74 H new ATOM 0 HH12 ARG A 88 -6.369 -8.157 -0.420 1.00 1.74 H new ATOM 0 HH21 ARG A 88 -4.322 -9.880 -2.724 1.00 1.73 H new ATOM 0 HH22 ARG A 88 -5.552 -8.632 -2.504 1.00 1.73 H new ATOM 1435 N LYS A 89 -2.370 -14.374 0.915 1.00 0.58 N ATOM 1436 CA LYS A 89 -2.179 -15.412 -0.113 1.00 0.64 C ATOM 1437 C LYS A 89 -0.827 -15.269 -0.856 1.00 0.58 C ATOM 1438 O LYS A 89 -0.764 -14.744 -1.974 1.00 0.69 O ATOM 1439 CB LYS A 89 -3.381 -15.403 -1.094 1.00 0.76 C ATOM 1440 CG LYS A 89 -3.583 -14.082 -1.847 1.00 0.77 C ATOM 1441 CD LYS A 89 -4.873 -14.058 -2.659 1.00 1.00 C ATOM 1442 CE LYS A 89 -4.997 -12.760 -3.454 1.00 1.22 C ATOM 1443 NZ LYS A 89 -6.299 -12.645 -4.169 1.00 1.52 N ATOM 0 H LYS A 89 -2.075 -13.441 0.629 1.00 0.58 H new ATOM 0 HA LYS A 89 -2.141 -16.380 0.386 1.00 0.64 H new ATOM 0 HB2 LYS A 89 -3.245 -16.203 -1.822 1.00 0.76 H new ATOM 0 HB3 LYS A 89 -4.290 -15.630 -0.536 1.00 0.76 H new ATOM 0 HG2 LYS A 89 -3.593 -13.259 -1.132 1.00 0.77 H new ATOM 0 HG3 LYS A 89 -2.736 -13.915 -2.513 1.00 0.77 H new ATOM 0 HD2 LYS A 89 -4.894 -14.909 -3.340 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -5.729 -14.163 -1.992 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -4.882 -11.913 -2.778 1.00 1.22 H new ATOM 0 HE3 LYS A 89 -4.184 -12.703 -4.177 1.00 1.22 H new ATOM 0 HZ1 LYS A 89 -6.330 -11.746 -4.692 1.00 1.52 H new ATOM 0 HZ2 LYS A 89 -6.400 -13.437 -4.835 1.00 1.52 H new ATOM 0 HZ3 LYS A 89 -7.077 -12.671 -3.480 1.00 1.52 H new ATOM 1457 N LYS A 90 0.265 -15.726 -0.213 1.00 0.56 N ATOM 1458 CA LYS A 90 1.606 -15.689 -0.837 1.00 0.55 C ATOM 1459 C LYS A 90 1.764 -16.880 -1.800 1.00 0.55 C ATOM 1460 O LYS A 90 2.448 -16.773 -2.822 1.00 0.60 O ATOM 1461 CB LYS A 90 2.734 -15.662 0.222 1.00 0.61 C ATOM 1462 CG LYS A 90 2.916 -16.949 1.039 1.00 0.71 C ATOM 1463 CD LYS A 90 3.792 -16.729 2.278 1.00 0.97 C ATOM 1464 CE LYS A 90 4.309 -18.043 2.867 1.00 1.39 C ATOM 1465 NZ LYS A 90 3.218 -18.888 3.440 1.00 1.87 N ATOM 0 H LYS A 90 0.249 -16.121 0.727 1.00 0.56 H new ATOM 0 HA LYS A 90 1.695 -14.764 -1.406 1.00 0.55 H new ATOM 0 HB2 LYS A 90 3.674 -15.438 -0.282 1.00 0.61 H new ATOM 0 HB3 LYS A 90 2.539 -14.841 0.912 1.00 0.61 H new ATOM 0 HG2 LYS A 90 1.940 -17.322 1.348 1.00 0.71 H new ATOM 0 HG3 LYS A 90 3.366 -17.717 0.409 1.00 0.71 H new ATOM 0 HD2 LYS A 90 4.638 -16.095 2.014 1.00 0.97 H new ATOM 0 HD3 LYS A 90 3.218 -16.195 3.035 1.00 0.97 H new ATOM 0 HE2 LYS A 90 4.828 -18.605 2.091 1.00 1.39 H new ATOM 0 HE3 LYS A 90 5.040 -17.825 3.645 1.00 1.39 H new ATOM 0 HZ1 LYS A 90 3.624 -19.765 3.825 1.00 1.87 H new ATOM 0 HZ2 LYS A 90 2.738 -18.366 4.200 1.00 1.87 H new ATOM 0 HZ3 LYS A 90 2.532 -19.122 2.694 1.00 1.87 H new ATOM 1479 N LYS A 91 1.121 -18.013 -1.441 1.00 0.57 N ATOM 1480 CA LYS A 91 1.106 -19.230 -2.255 1.00 0.64 C ATOM 1481 C LYS A 91 -0.345 -19.512 -2.688 1.00 0.69 C ATOM 1482 O LYS A 91 -0.970 -20.477 -2.227 1.00 0.71 O ATOM 1483 CB LYS A 91 1.686 -20.422 -1.458 1.00 0.72 C ATOM 1484 CG LYS A 91 3.203 -20.382 -1.282 1.00 0.85 C ATOM 1485 CD LYS A 91 3.713 -21.595 -0.497 1.00 0.97 C ATOM 1486 CE LYS A 91 5.233 -21.589 -0.333 1.00 1.29 C ATOM 1487 NZ LYS A 91 5.956 -21.805 -1.626 1.00 1.53 N ATOM 0 H LYS A 91 0.597 -18.100 -0.570 1.00 0.57 H new ATOM 0 HA LYS A 91 1.729 -19.093 -3.139 1.00 0.64 H new ATOM 0 HB2 LYS A 91 1.218 -20.448 -0.474 1.00 0.72 H new ATOM 0 HB3 LYS A 91 1.415 -21.349 -1.964 1.00 0.72 H new ATOM 0 HG2 LYS A 91 3.683 -20.354 -2.260 1.00 0.85 H new ATOM 0 HG3 LYS A 91 3.485 -19.467 -0.762 1.00 0.85 H new ATOM 0 HD2 LYS A 91 3.245 -21.610 0.487 1.00 0.97 H new ATOM 0 HD3 LYS A 91 3.410 -22.509 -1.008 1.00 0.97 H new ATOM 0 HE2 LYS A 91 5.544 -20.637 0.097 1.00 1.29 H new ATOM 0 HE3 LYS A 91 5.521 -22.367 0.374 1.00 1.29 H new ATOM 0 HZ1 LYS A 91 6.980 -21.842 -1.449 1.00 1.53 H new ATOM 0 HZ2 LYS A 91 5.645 -22.701 -2.052 1.00 1.53 H new ATOM 0 HZ3 LYS A 91 5.746 -21.021 -2.277 1.00 1.53 H new ATOM 1501 N ASP A 92 -0.891 -18.640 -3.567 1.00 0.78 N ATOM 1502 CA ASP A 92 -2.283 -18.775 -4.062 1.00 0.87 C ATOM 1503 C ASP A 92 -2.395 -19.884 -5.133 1.00 1.03 C ATOM 1504 O ASP A 92 -2.672 -19.620 -6.311 1.00 1.81 O ATOM 1505 CB ASP A 92 -2.835 -17.415 -4.575 1.00 0.89 C ATOM 1506 CG ASP A 92 -1.988 -16.755 -5.661 1.00 0.98 C ATOM 1507 OD1 ASP A 92 -0.948 -16.152 -5.319 1.00 1.01 O ATOM 1508 OD2 ASP A 92 -2.376 -16.832 -6.846 1.00 1.18 O ATOM 0 H ASP A 92 -0.391 -17.837 -3.948 1.00 0.78 H new ATOM 0 HA ASP A 92 -2.906 -19.078 -3.221 1.00 0.87 H new ATOM 0 HB2 ASP A 92 -3.842 -17.569 -4.962 1.00 0.89 H new ATOM 0 HB3 ASP A 92 -2.919 -16.730 -3.731 1.00 0.89 H new ATOM 1513 N LEU A 93 -2.182 -21.142 -4.687 1.00 0.67 N ATOM 1514 CA LEU A 93 -2.230 -22.337 -5.558 1.00 0.70 C ATOM 1515 C LEU A 93 -2.066 -23.633 -4.727 1.00 0.70 C ATOM 1516 O LEU A 93 -2.810 -24.599 -4.926 1.00 0.79 O ATOM 1517 CB LEU A 93 -1.125 -22.281 -6.646 1.00 0.77 C ATOM 1518 CG LEU A 93 -1.331 -23.225 -7.856 1.00 0.97 C ATOM 1519 CD1 LEU A 93 -2.342 -22.644 -8.848 1.00 1.24 C ATOM 1520 CD2 LEU A 93 -0.002 -23.519 -8.558 1.00 1.15 C ATOM 0 H LEU A 93 -1.972 -21.357 -3.712 1.00 0.67 H new ATOM 0 HA LEU A 93 -3.205 -22.345 -6.045 1.00 0.70 H new ATOM 0 HB2 LEU A 93 -1.054 -21.258 -7.014 1.00 0.77 H new ATOM 0 HB3 LEU A 93 -0.169 -22.519 -6.180 1.00 0.77 H new ATOM 0 HG LEU A 93 -1.732 -24.164 -7.473 1.00 0.97 H new ATOM 0 HD11 LEU A 93 -2.465 -23.330 -9.686 1.00 1.24 H new ATOM 0 HD12 LEU A 93 -3.301 -22.504 -8.350 1.00 1.24 H new ATOM 0 HD13 LEU A 93 -1.981 -21.683 -9.215 1.00 1.24 H new ATOM 0 HD21 LEU A 93 -0.177 -24.184 -9.404 1.00 1.15 H new ATOM 0 HD22 LEU A 93 0.435 -22.586 -8.914 1.00 1.15 H new ATOM 0 HD23 LEU A 93 0.682 -23.996 -7.856 1.00 1.15 H new ATOM 1532 N LYS A 94 -1.083 -23.629 -3.793 1.00 0.70 N ATOM 1533 CA LYS A 94 -0.779 -24.787 -2.929 1.00 0.77 C ATOM 1534 C LYS A 94 -1.559 -24.716 -1.599 1.00 0.71 C ATOM 1535 O LYS A 94 -2.283 -25.656 -1.259 1.00 0.77 O ATOM 1536 CB LYS A 94 0.748 -24.842 -2.670 1.00 0.92 C ATOM 1537 CG LYS A 94 1.255 -26.142 -2.038 1.00 1.09 C ATOM 1538 CD LYS A 94 1.267 -27.309 -3.030 1.00 1.23 C ATOM 1539 CE LYS A 94 1.588 -28.640 -2.352 1.00 1.57 C ATOM 1540 NZ LYS A 94 0.501 -29.089 -1.429 1.00 1.73 N ATOM 0 H LYS A 94 -0.482 -22.823 -3.621 1.00 0.70 H new ATOM 0 HA LYS A 94 -1.093 -25.698 -3.438 1.00 0.77 H new ATOM 0 HB2 LYS A 94 1.267 -24.690 -3.617 1.00 0.92 H new ATOM 0 HB3 LYS A 94 1.021 -24.010 -2.020 1.00 0.92 H new ATOM 0 HG2 LYS A 94 2.263 -25.986 -1.653 1.00 1.09 H new ATOM 0 HG3 LYS A 94 0.624 -26.399 -1.187 1.00 1.09 H new ATOM 0 HD2 LYS A 94 0.295 -27.378 -3.519 1.00 1.23 H new ATOM 0 HD3 LYS A 94 2.003 -27.113 -3.809 1.00 1.23 H new ATOM 0 HE2 LYS A 94 1.751 -29.402 -3.114 1.00 1.57 H new ATOM 0 HE3 LYS A 94 2.519 -28.544 -1.793 1.00 1.57 H new ATOM 0 HZ1 LYS A 94 0.676 -30.073 -1.140 1.00 1.73 H new ATOM 0 HZ2 LYS A 94 0.486 -28.478 -0.587 1.00 1.73 H new ATOM 0 HZ3 LYS A 94 -0.415 -29.029 -1.917 1.00 1.73 H new ATOM 1554 N ILE A 95 -1.399 -23.602 -0.853 1.00 0.68 N ATOM 1555 CA ILE A 95 -2.084 -23.402 0.444 1.00 0.67 C ATOM 1556 C ILE A 95 -2.979 -22.149 0.406 1.00 0.67 C ATOM 1557 O ILE A 95 -2.521 -21.065 0.027 1.00 0.77 O ATOM 1558 CB ILE A 95 -1.075 -23.301 1.646 1.00 0.75 C ATOM 1559 CG1 ILE A 95 0.051 -22.264 1.369 1.00 0.87 C ATOM 1560 CG2 ILE A 95 -0.480 -24.682 1.955 1.00 0.85 C ATOM 1561 CD1 ILE A 95 0.875 -21.883 2.587 1.00 1.06 C ATOM 0 H ILE A 95 -0.799 -22.824 -1.128 1.00 0.68 H new ATOM 0 HA ILE A 95 -2.705 -24.283 0.606 1.00 0.67 H new ATOM 0 HB ILE A 95 -1.628 -22.951 2.518 1.00 0.75 H new ATOM 0 HG12 ILE A 95 0.718 -22.667 0.607 1.00 0.87 H new ATOM 0 HG13 ILE A 95 -0.398 -21.362 0.954 1.00 0.87 H new ATOM 0 HG21 ILE A 95 0.217 -24.600 2.789 1.00 0.85 H new ATOM 0 HG22 ILE A 95 -1.281 -25.373 2.219 1.00 0.85 H new ATOM 0 HG23 ILE A 95 0.047 -25.056 1.077 1.00 0.85 H new ATOM 0 HD11 ILE A 95 1.635 -21.156 2.299 1.00 1.06 H new ATOM 0 HD12 ILE A 95 0.224 -21.447 3.345 1.00 1.06 H new ATOM 0 HD13 ILE A 95 1.358 -22.772 2.992 1.00 1.06 H new ATOM 1573 N ARG A 96 -4.260 -22.307 0.798 1.00 0.71 N ATOM 1574 CA ARG A 96 -5.218 -21.184 0.821 1.00 0.77 C ATOM 1575 C ARG A 96 -6.056 -21.172 2.123 1.00 0.77 C ATOM 1576 O ARG A 96 -7.290 -21.086 2.084 1.00 0.93 O ATOM 1577 CB ARG A 96 -6.117 -21.205 -0.442 1.00 0.93 C ATOM 1578 CG ARG A 96 -6.940 -22.486 -0.634 1.00 1.05 C ATOM 1579 CD ARG A 96 -7.847 -22.421 -1.865 1.00 1.26 C ATOM 1580 NE ARG A 96 -8.938 -21.436 -1.730 1.00 1.40 N ATOM 1581 CZ ARG A 96 -10.042 -21.382 -2.509 1.00 1.83 C ATOM 1582 NH1 ARG A 96 -10.277 -22.301 -3.462 1.00 2.26 N ATOM 1583 NH2 ARG A 96 -10.927 -20.403 -2.319 1.00 2.18 N ATOM 0 H ARG A 96 -4.653 -23.198 1.102 1.00 0.71 H new ATOM 0 HA ARG A 96 -4.646 -20.256 0.808 1.00 0.77 H new ATOM 0 HB2 ARG A 96 -6.800 -20.356 -0.397 1.00 0.93 H new ATOM 0 HB3 ARG A 96 -5.487 -21.061 -1.320 1.00 0.93 H new ATOM 0 HG2 ARG A 96 -6.265 -23.337 -0.728 1.00 1.05 H new ATOM 0 HG3 ARG A 96 -7.549 -22.659 0.253 1.00 1.05 H new ATOM 0 HD2 ARG A 96 -7.246 -22.170 -2.739 1.00 1.26 H new ATOM 0 HD3 ARG A 96 -8.276 -23.407 -2.045 1.00 1.26 H new ATOM 0 HE ARG A 96 -8.852 -20.740 -0.989 1.00 1.40 H new ATOM 0 HH11 ARG A 96 -9.614 -23.062 -3.611 1.00 2.26 H new ATOM 0 HH12 ARG A 96 -11.118 -22.237 -4.036 1.00 2.26 H new ATOM 0 HH21 ARG A 96 -10.767 -19.705 -1.592 1.00 2.18 H new ATOM 0 HH22 ARG A 96 -11.764 -20.352 -2.900 1.00 2.18 H new ATOM 1597 N LYS A 97 -5.367 -21.277 3.277 1.00 0.72 N ATOM 1598 CA LYS A 97 -6.014 -21.244 4.606 1.00 0.75 C ATOM 1599 C LYS A 97 -4.973 -20.973 5.714 1.00 0.74 C ATOM 1600 O LYS A 97 -4.453 -21.900 6.345 1.00 0.95 O ATOM 1601 CB LYS A 97 -6.832 -22.532 4.893 1.00 0.87 C ATOM 1602 CG LYS A 97 -6.072 -23.854 4.707 1.00 0.94 C ATOM 1603 CD LYS A 97 -6.962 -25.083 4.936 1.00 1.10 C ATOM 1604 CE LYS A 97 -7.263 -25.336 6.422 1.00 1.36 C ATOM 1605 NZ LYS A 97 -8.381 -24.491 6.953 1.00 1.74 N ATOM 0 H LYS A 97 -4.354 -21.386 3.316 1.00 0.72 H new ATOM 0 HA LYS A 97 -6.727 -20.419 4.602 1.00 0.75 H new ATOM 0 HB2 LYS A 97 -7.201 -22.486 5.918 1.00 0.87 H new ATOM 0 HB3 LYS A 97 -7.705 -22.540 4.240 1.00 0.87 H new ATOM 0 HG2 LYS A 97 -5.658 -23.892 3.699 1.00 0.94 H new ATOM 0 HG3 LYS A 97 -5.230 -23.885 5.399 1.00 0.94 H new ATOM 0 HD2 LYS A 97 -7.901 -24.951 4.398 1.00 1.10 H new ATOM 0 HD3 LYS A 97 -6.474 -25.962 4.515 1.00 1.10 H new ATOM 0 HE2 LYS A 97 -7.514 -26.388 6.561 1.00 1.36 H new ATOM 0 HE3 LYS A 97 -6.363 -25.144 7.006 1.00 1.36 H new ATOM 0 HZ1 LYS A 97 -8.014 -23.851 7.686 1.00 1.74 H new ATOM 0 HZ2 LYS A 97 -8.791 -23.931 6.178 1.00 1.74 H new ATOM 0 HZ3 LYS A 97 -9.115 -25.104 7.363 1.00 1.74 H new ATOM 1619 N LYS A 98 -4.663 -19.679 5.920 1.00 0.69 N ATOM 1620 CA LYS A 98 -3.681 -19.237 6.926 1.00 0.72 C ATOM 1621 C LYS A 98 -4.352 -18.322 7.956 1.00 0.76 C ATOM 1622 O LYS A 98 -4.979 -18.797 8.904 1.00 0.98 O ATOM 1623 CB LYS A 98 -2.504 -18.517 6.219 1.00 0.88 C ATOM 1624 CG LYS A 98 -1.382 -18.026 7.146 1.00 1.04 C ATOM 1625 CD LYS A 98 -0.213 -17.414 6.361 1.00 1.35 C ATOM 1626 CE LYS A 98 0.801 -16.704 7.265 1.00 1.61 C ATOM 1627 NZ LYS A 98 1.513 -17.636 8.191 1.00 1.71 N ATOM 0 H LYS A 98 -5.085 -18.913 5.395 1.00 0.69 H new ATOM 0 HA LYS A 98 -3.288 -20.104 7.457 1.00 0.72 H new ATOM 0 HB2 LYS A 98 -2.074 -19.196 5.483 1.00 0.88 H new ATOM 0 HB3 LYS A 98 -2.900 -17.662 5.670 1.00 0.88 H new ATOM 0 HG2 LYS A 98 -1.782 -17.284 7.838 1.00 1.04 H new ATOM 0 HG3 LYS A 98 -1.018 -18.859 7.747 1.00 1.04 H new ATOM 0 HD2 LYS A 98 0.294 -18.200 5.801 1.00 1.35 H new ATOM 0 HD3 LYS A 98 -0.603 -16.704 5.632 1.00 1.35 H new ATOM 0 HE2 LYS A 98 1.533 -16.188 6.644 1.00 1.61 H new ATOM 0 HE3 LYS A 98 0.286 -15.942 7.851 1.00 1.61 H new ATOM 0 HZ1 LYS A 98 2.184 -17.099 8.776 1.00 1.71 H new ATOM 0 HZ2 LYS A 98 0.821 -18.111 8.806 1.00 1.71 H new ATOM 0 HZ3 LYS A 98 2.030 -18.348 7.637 1.00 1.71 H new ATOM 1642 N MET B 1 -5.170 -17.844 2.754 1.00 0.85 N ATOM 1643 CA MET B 1 -6.046 -16.827 2.166 1.00 0.86 C ATOM 1644 C MET B 1 -6.558 -15.793 3.201 1.00 0.76 C ATOM 1645 O MET B 1 -7.264 -14.851 2.820 1.00 0.93 O ATOM 1646 CB MET B 1 -7.220 -17.504 1.419 1.00 1.04 C ATOM 1647 CG MET B 1 -8.274 -18.163 2.317 1.00 1.09 C ATOM 1648 SD MET B 1 -9.621 -18.919 1.382 1.00 1.44 S ATOM 1649 CE MET B 1 -10.599 -19.635 2.701 1.00 1.75 C ATOM 0 H1 MET B 1 -5.025 -18.614 2.070 1.00 0.85 H new ATOM 0 H2 MET B 1 -4.253 -17.416 2.993 1.00 0.85 H new ATOM 0 H3 MET B 1 -5.610 -18.225 3.616 1.00 0.85 H new ATOM 0 HA MET B 1 -5.448 -16.261 1.452 1.00 0.86 H new ATOM 0 HB2 MET B 1 -7.712 -16.757 0.797 1.00 1.04 H new ATOM 0 HB3 MET B 1 -6.814 -18.261 0.748 1.00 1.04 H new ATOM 0 HG2 MET B 1 -7.795 -18.924 2.933 1.00 1.09 H new ATOM 0 HG3 MET B 1 -8.685 -17.415 2.996 1.00 1.09 H new ATOM 0 HE1 MET B 1 -11.468 -20.138 2.278 1.00 1.75 H new ATOM 0 HE2 MET B 1 -9.995 -20.356 3.252 1.00 1.75 H new ATOM 0 HE3 MET B 1 -10.930 -18.847 3.378 1.00 1.75 H new ATOM 1659 N ALA B 2 -6.205 -15.960 4.499 1.00 0.73 N ATOM 1660 CA ALA B 2 -6.641 -15.039 5.566 1.00 0.67 C ATOM 1661 C ALA B 2 -5.449 -14.273 6.158 1.00 0.60 C ATOM 1662 O ALA B 2 -4.384 -14.858 6.387 1.00 0.68 O ATOM 1663 CB ALA B 2 -7.380 -15.813 6.658 1.00 0.78 C ATOM 0 H ALA B 2 -5.618 -16.727 4.828 1.00 0.73 H new ATOM 0 HA ALA B 2 -7.322 -14.308 5.130 1.00 0.67 H new ATOM 0 HB1 ALA B 2 -7.698 -15.124 7.441 1.00 0.78 H new ATOM 0 HB2 ALA B 2 -8.254 -16.303 6.229 1.00 0.78 H new ATOM 0 HB3 ALA B 2 -6.716 -16.565 7.084 1.00 0.78 H new ATOM 1669 N ALA B 3 -5.639 -12.964 6.424 1.00 0.57 N ATOM 1670 CA ALA B 3 -4.572 -12.119 6.986 1.00 0.57 C ATOM 1671 C ALA B 3 -4.463 -12.322 8.513 1.00 0.58 C ATOM 1672 O ALA B 3 -5.259 -11.768 9.280 1.00 0.69 O ATOM 1673 CB ALA B 3 -4.797 -10.652 6.616 1.00 0.64 C ATOM 0 H ALA B 3 -6.518 -12.474 6.259 1.00 0.57 H new ATOM 0 HA ALA B 3 -3.619 -12.421 6.552 1.00 0.57 H new ATOM 0 HB1 ALA B 3 -3.999 -10.043 7.040 1.00 0.64 H new ATOM 0 HB2 ALA B 3 -4.797 -10.546 5.531 1.00 0.64 H new ATOM 0 HB3 ALA B 3 -5.756 -10.320 7.013 1.00 0.64 H new ATOM 1679 N GLU B 4 -3.461 -13.127 8.933 1.00 0.56 N ATOM 1680 CA GLU B 4 -3.226 -13.471 10.351 1.00 0.59 C ATOM 1681 C GLU B 4 -2.221 -12.497 11.012 1.00 0.56 C ATOM 1682 O GLU B 4 -1.280 -12.057 10.344 1.00 0.54 O ATOM 1683 CB GLU B 4 -2.705 -14.928 10.432 1.00 0.66 C ATOM 1684 CG GLU B 4 -2.710 -15.539 11.832 1.00 0.79 C ATOM 1685 CD GLU B 4 -2.391 -17.026 11.831 1.00 0.91 C ATOM 1686 OE1 GLU B 4 -3.331 -17.835 11.675 1.00 1.10 O ATOM 1687 OE2 GLU B 4 -1.203 -17.381 11.987 1.00 1.00 O ATOM 0 H GLU B 4 -2.791 -13.557 8.295 1.00 0.56 H new ATOM 0 HA GLU B 4 -4.165 -13.382 10.897 1.00 0.59 H new ATOM 0 HB2 GLU B 4 -3.313 -15.552 9.777 1.00 0.66 H new ATOM 0 HB3 GLU B 4 -1.687 -14.956 10.043 1.00 0.66 H new ATOM 0 HG2 GLU B 4 -1.982 -15.017 12.453 1.00 0.79 H new ATOM 0 HG3 GLU B 4 -3.688 -15.383 12.287 1.00 0.79 H new ATOM 1694 N PRO B 5 -2.381 -12.150 12.336 1.00 0.62 N ATOM 1695 CA PRO B 5 -1.459 -11.221 13.031 1.00 0.65 C ATOM 1696 C PRO B 5 -0.035 -11.791 13.191 1.00 0.59 C ATOM 1697 O PRO B 5 0.138 -12.899 13.711 1.00 0.68 O ATOM 1698 CB PRO B 5 -2.121 -10.994 14.408 1.00 0.83 C ATOM 1699 CG PRO B 5 -3.514 -11.514 14.276 1.00 0.80 C ATOM 1700 CD PRO B 5 -3.452 -12.606 13.254 1.00 0.73 C ATOM 0 HA PRO B 5 -1.321 -10.302 12.462 1.00 0.65 H new ATOM 0 HB2 PRO B 5 -1.579 -11.520 15.194 1.00 0.83 H new ATOM 0 HB3 PRO B 5 -2.121 -9.937 14.673 1.00 0.83 H new ATOM 0 HG2 PRO B 5 -3.881 -11.893 15.230 1.00 0.80 H new ATOM 0 HG3 PRO B 5 -4.197 -10.725 13.962 1.00 0.80 H new ATOM 0 HD2 PRO B 5 -3.212 -13.568 13.707 1.00 0.73 H new ATOM 0 HD3 PRO B 5 -4.403 -12.726 12.735 1.00 0.73 H new ATOM 1708 N LEU B 6 0.978 -11.020 12.734 1.00 0.61 N ATOM 1709 CA LEU B 6 2.398 -11.426 12.807 1.00 0.70 C ATOM 1710 C LEU B 6 3.228 -10.372 13.609 1.00 0.73 C ATOM 1711 O LEU B 6 2.755 -9.912 14.655 1.00 1.24 O ATOM 1712 CB LEU B 6 2.932 -11.654 11.369 1.00 0.87 C ATOM 1713 CG LEU B 6 2.173 -12.702 10.514 1.00 0.95 C ATOM 1714 CD1 LEU B 6 2.581 -12.606 9.042 1.00 1.18 C ATOM 1715 CD2 LEU B 6 2.400 -14.123 11.048 1.00 1.08 C ATOM 0 H LEU B 6 0.834 -10.105 12.307 1.00 0.61 H new ATOM 0 HA LEU B 6 2.498 -12.366 13.350 1.00 0.70 H new ATOM 0 HB2 LEU B 6 2.911 -10.701 10.841 1.00 0.87 H new ATOM 0 HB3 LEU B 6 3.977 -11.958 11.436 1.00 0.87 H new ATOM 0 HG LEU B 6 1.108 -12.481 10.588 1.00 0.95 H new ATOM 0 HD11 LEU B 6 2.035 -13.351 8.464 1.00 1.18 H new ATOM 0 HD12 LEU B 6 2.348 -11.611 8.664 1.00 1.18 H new ATOM 0 HD13 LEU B 6 3.652 -12.788 8.949 1.00 1.18 H new ATOM 0 HD21 LEU B 6 1.856 -14.836 10.429 1.00 1.08 H new ATOM 0 HD22 LEU B 6 3.464 -14.357 11.020 1.00 1.08 H new ATOM 0 HD23 LEU B 6 2.041 -14.187 12.075 1.00 1.08 H new ATOM 1727 N THR B 7 4.456 -9.991 13.144 1.00 0.52 N ATOM 1728 CA THR B 7 5.309 -9.003 13.857 1.00 0.50 C ATOM 1729 C THR B 7 4.829 -7.554 13.587 1.00 0.48 C ATOM 1730 O THR B 7 4.084 -7.327 12.639 1.00 0.53 O ATOM 1731 CB THR B 7 6.813 -9.161 13.447 1.00 0.53 C ATOM 1732 OG1 THR B 7 7.133 -10.553 13.304 1.00 0.92 O ATOM 1733 CG2 THR B 7 7.772 -8.544 14.470 1.00 1.06 C ATOM 0 H THR B 7 4.870 -10.353 12.285 1.00 0.52 H new ATOM 0 HA THR B 7 5.219 -9.201 14.925 1.00 0.50 H new ATOM 0 HB THR B 7 6.939 -8.631 12.503 1.00 0.53 H new ATOM 0 HG1 THR B 7 6.865 -10.860 12.413 1.00 0.92 H new ATOM 0 HG21 THR B 7 8.800 -8.683 14.135 1.00 1.06 H new ATOM 0 HG22 THR B 7 7.563 -7.479 14.568 1.00 1.06 H new ATOM 0 HG23 THR B 7 7.636 -9.031 15.436 1.00 1.06 H new ATOM 1741 N GLU B 8 5.270 -6.588 14.435 1.00 0.49 N ATOM 1742 CA GLU B 8 4.895 -5.143 14.338 1.00 0.49 C ATOM 1743 C GLU B 8 4.745 -4.613 12.884 1.00 0.44 C ATOM 1744 O GLU B 8 3.696 -4.056 12.543 1.00 0.47 O ATOM 1745 CB GLU B 8 5.917 -4.278 15.115 1.00 0.54 C ATOM 1746 CG GLU B 8 5.376 -2.920 15.572 1.00 0.95 C ATOM 1747 CD GLU B 8 6.341 -2.169 16.479 1.00 1.01 C ATOM 1748 OE1 GLU B 8 6.396 -2.490 17.686 1.00 1.51 O ATOM 1749 OE2 GLU B 8 7.039 -1.259 15.982 1.00 1.29 O ATOM 0 H GLU B 8 5.900 -6.786 15.212 1.00 0.49 H new ATOM 0 HA GLU B 8 3.905 -5.062 14.786 1.00 0.49 H new ATOM 0 HB2 GLU B 8 6.255 -4.834 15.989 1.00 0.54 H new ATOM 0 HB3 GLU B 8 6.791 -4.114 14.484 1.00 0.54 H new ATOM 0 HG2 GLU B 8 5.159 -2.308 14.696 1.00 0.95 H new ATOM 0 HG3 GLU B 8 4.433 -3.069 16.098 1.00 0.95 H new ATOM 1756 N LEU B 9 5.789 -4.784 12.036 1.00 0.42 N ATOM 1757 CA LEU B 9 5.751 -4.307 10.625 1.00 0.39 C ATOM 1758 C LEU B 9 4.792 -5.142 9.757 1.00 0.38 C ATOM 1759 O LEU B 9 4.066 -4.585 8.927 1.00 0.39 O ATOM 1760 CB LEU B 9 7.160 -4.318 9.984 1.00 0.41 C ATOM 1761 CG LEU B 9 8.211 -3.377 10.617 1.00 0.50 C ATOM 1762 CD1 LEU B 9 9.609 -3.677 10.063 1.00 0.63 C ATOM 1763 CD2 LEU B 9 7.849 -1.901 10.393 1.00 0.65 C ATOM 0 H LEU B 9 6.661 -5.244 12.298 1.00 0.42 H new ATOM 0 HA LEU B 9 5.382 -3.282 10.661 1.00 0.39 H new ATOM 0 HB2 LEU B 9 7.546 -5.337 10.024 1.00 0.41 H new ATOM 0 HB3 LEU B 9 7.058 -4.057 8.931 1.00 0.41 H new ATOM 0 HG LEU B 9 8.215 -3.561 11.691 1.00 0.50 H new ATOM 0 HD11 LEU B 9 10.334 -3.004 10.521 1.00 0.63 H new ATOM 0 HD12 LEU B 9 9.877 -4.709 10.291 1.00 0.63 H new ATOM 0 HD13 LEU B 9 9.611 -3.532 8.983 1.00 0.63 H new ATOM 0 HD21 LEU B 9 8.608 -1.267 10.850 1.00 0.65 H new ATOM 0 HD22 LEU B 9 7.801 -1.696 9.323 1.00 0.65 H new ATOM 0 HD23 LEU B 9 6.880 -1.691 10.846 1.00 0.65 H new ATOM 1775 N GLU B 10 4.793 -6.479 9.953 1.00 0.39 N ATOM 1776 CA GLU B 10 3.915 -7.396 9.187 1.00 0.41 C ATOM 1777 C GLU B 10 2.432 -7.239 9.596 1.00 0.42 C ATOM 1778 O GLU B 10 1.534 -7.527 8.801 1.00 0.47 O ATOM 1779 CB GLU B 10 4.344 -8.869 9.381 1.00 0.46 C ATOM 1780 CG GLU B 10 5.804 -9.162 9.037 1.00 0.50 C ATOM 1781 CD GLU B 10 6.236 -10.563 9.440 1.00 0.56 C ATOM 1782 OE1 GLU B 10 6.180 -10.878 10.648 1.00 0.95 O ATOM 1783 OE2 GLU B 10 6.638 -11.340 8.553 1.00 0.95 O ATOM 0 H GLU B 10 5.390 -6.948 10.634 1.00 0.39 H new ATOM 0 HA GLU B 10 4.019 -7.126 8.136 1.00 0.41 H new ATOM 0 HB2 GLU B 10 4.166 -9.151 10.419 1.00 0.46 H new ATOM 0 HB3 GLU B 10 3.706 -9.503 8.765 1.00 0.46 H new ATOM 0 HG2 GLU B 10 5.952 -9.036 7.964 1.00 0.50 H new ATOM 0 HG3 GLU B 10 6.443 -8.433 9.535 1.00 0.50 H new ATOM 1790 N GLU B 11 2.195 -6.784 10.849 1.00 0.42 N ATOM 1791 CA GLU B 11 0.843 -6.575 11.394 1.00 0.45 C ATOM 1792 C GLU B 11 0.206 -5.284 10.836 1.00 0.43 C ATOM 1793 O GLU B 11 -1.016 -5.216 10.696 1.00 0.45 O ATOM 1794 CB GLU B 11 0.905 -6.526 12.937 1.00 0.51 C ATOM 1795 CG GLU B 11 -0.449 -6.587 13.639 1.00 0.62 C ATOM 1796 CD GLU B 11 -0.348 -6.290 15.126 1.00 0.70 C ATOM 1797 OE1 GLU B 11 0.050 -7.199 15.887 1.00 0.82 O ATOM 1798 OE2 GLU B 11 -0.657 -5.149 15.525 1.00 0.85 O ATOM 0 H GLU B 11 2.940 -6.553 11.507 1.00 0.42 H new ATOM 0 HA GLU B 11 0.215 -7.411 11.086 1.00 0.45 H new ATOM 0 HB2 GLU B 11 1.517 -7.357 13.288 1.00 0.51 H new ATOM 0 HB3 GLU B 11 1.412 -5.609 13.236 1.00 0.51 H new ATOM 0 HG2 GLU B 11 -1.128 -5.872 13.174 1.00 0.62 H new ATOM 0 HG3 GLU B 11 -0.883 -7.577 13.498 1.00 0.62 H new ATOM 1805 N SER B 12 1.042 -4.264 10.525 1.00 0.43 N ATOM 1806 CA SER B 12 0.565 -2.977 9.970 1.00 0.44 C ATOM 1807 C SER B 12 -0.213 -3.182 8.655 1.00 0.42 C ATOM 1808 O SER B 12 -1.361 -2.737 8.542 1.00 0.47 O ATOM 1809 CB SER B 12 1.744 -2.019 9.743 1.00 0.48 C ATOM 1810 OG SER B 12 2.328 -1.625 10.975 1.00 0.56 O ATOM 0 H SER B 12 2.053 -4.310 10.650 1.00 0.43 H new ATOM 0 HA SER B 12 -0.116 -2.536 10.698 1.00 0.44 H new ATOM 0 HB2 SER B 12 2.495 -2.504 9.120 1.00 0.48 H new ATOM 0 HB3 SER B 12 1.401 -1.137 9.201 1.00 0.48 H new ATOM 0 HG SER B 12 2.135 -0.678 11.140 1.00 0.56 H new ATOM 1816 N ILE B 13 0.420 -3.852 7.668 1.00 0.40 N ATOM 1817 CA ILE B 13 -0.235 -4.149 6.368 1.00 0.41 C ATOM 1818 C ILE B 13 -1.367 -5.195 6.524 1.00 0.41 C ATOM 1819 O ILE B 13 -2.244 -5.292 5.659 1.00 0.48 O ATOM 1820 CB ILE B 13 0.776 -4.583 5.237 1.00 0.46 C ATOM 1821 CG1 ILE B 13 1.770 -5.699 5.683 1.00 0.45 C ATOM 1822 CG2 ILE B 13 1.546 -3.365 4.724 1.00 0.53 C ATOM 1823 CD1 ILE B 13 1.222 -7.107 5.594 1.00 0.45 C ATOM 0 H ILE B 13 1.377 -4.197 7.742 1.00 0.40 H new ATOM 0 HA ILE B 13 -0.676 -3.207 6.043 1.00 0.41 H new ATOM 0 HB ILE B 13 0.175 -5.011 4.435 1.00 0.46 H new ATOM 0 HG12 ILE B 13 2.668 -5.634 5.068 1.00 0.45 H new ATOM 0 HG13 ILE B 13 2.073 -5.506 6.712 1.00 0.45 H new ATOM 0 HG21 ILE B 13 2.241 -3.676 3.944 1.00 0.53 H new ATOM 0 HG22 ILE B 13 0.845 -2.637 4.316 1.00 0.53 H new ATOM 0 HG23 ILE B 13 2.102 -2.913 5.546 1.00 0.53 H new ATOM 0 HD11 ILE B 13 1.982 -7.815 5.924 1.00 0.45 H new ATOM 0 HD12 ILE B 13 0.342 -7.196 6.232 1.00 0.45 H new ATOM 0 HD13 ILE B 13 0.946 -7.325 4.562 1.00 0.45 H new ATOM 1835 N GLU B 14 -1.338 -5.974 7.632 1.00 0.40 N ATOM 1836 CA GLU B 14 -2.372 -6.984 7.938 1.00 0.43 C ATOM 1837 C GLU B 14 -3.645 -6.313 8.501 1.00 0.45 C ATOM 1838 O GLU B 14 -4.756 -6.758 8.207 1.00 0.48 O ATOM 1839 CB GLU B 14 -1.813 -8.026 8.940 1.00 0.46 C ATOM 1840 CG GLU B 14 -2.842 -9.009 9.530 1.00 0.57 C ATOM 1841 CD GLU B 14 -3.446 -8.527 10.845 1.00 0.64 C ATOM 1842 OE1 GLU B 14 -2.692 -8.382 11.829 1.00 0.92 O ATOM 1843 OE2 GLU B 14 -4.670 -8.284 10.886 1.00 1.00 O ATOM 0 H GLU B 14 -0.600 -5.918 8.334 1.00 0.40 H new ATOM 0 HA GLU B 14 -2.644 -7.496 7.015 1.00 0.43 H new ATOM 0 HB2 GLU B 14 -1.034 -8.602 8.440 1.00 0.46 H new ATOM 0 HB3 GLU B 14 -1.336 -7.492 9.762 1.00 0.46 H new ATOM 0 HG2 GLU B 14 -3.642 -9.166 8.806 1.00 0.57 H new ATOM 0 HG3 GLU B 14 -2.362 -9.975 9.690 1.00 0.57 H new ATOM 1850 N THR B 15 -3.466 -5.245 9.315 1.00 0.45 N ATOM 1851 CA THR B 15 -4.591 -4.512 9.931 1.00 0.49 C ATOM 1852 C THR B 15 -5.546 -3.928 8.868 1.00 0.47 C ATOM 1853 O THR B 15 -6.759 -3.938 9.064 1.00 0.50 O ATOM 1854 CB THR B 15 -4.086 -3.375 10.874 1.00 0.54 C ATOM 1855 OG1 THR B 15 -3.080 -3.885 11.760 1.00 0.75 O ATOM 1856 CG2 THR B 15 -5.213 -2.776 11.714 1.00 0.88 C ATOM 0 H THR B 15 -2.548 -4.873 9.559 1.00 0.45 H new ATOM 0 HA THR B 15 -5.145 -5.237 10.527 1.00 0.49 H new ATOM 0 HB THR B 15 -3.678 -2.591 10.236 1.00 0.54 H new ATOM 0 HG1 THR B 15 -2.247 -4.027 11.263 1.00 0.75 H new ATOM 0 HG21 THR B 15 -4.812 -1.990 12.353 1.00 0.88 H new ATOM 0 HG22 THR B 15 -5.973 -2.356 11.056 1.00 0.88 H new ATOM 0 HG23 THR B 15 -5.659 -3.555 12.333 1.00 0.88 H new ATOM 1864 N VAL B 16 -4.989 -3.438 7.738 1.00 0.45 N ATOM 1865 CA VAL B 16 -5.802 -2.862 6.642 1.00 0.47 C ATOM 1866 C VAL B 16 -6.667 -3.947 5.941 1.00 0.47 C ATOM 1867 O VAL B 16 -7.799 -3.664 5.539 1.00 0.52 O ATOM 1868 CB VAL B 16 -4.912 -2.112 5.584 1.00 0.49 C ATOM 1869 CG1 VAL B 16 -5.755 -1.504 4.451 1.00 0.56 C ATOM 1870 CG2 VAL B 16 -4.069 -1.019 6.252 1.00 0.53 C ATOM 0 H VAL B 16 -3.985 -3.429 7.561 1.00 0.45 H new ATOM 0 HA VAL B 16 -6.470 -2.133 7.101 1.00 0.47 H new ATOM 0 HB VAL B 16 -4.247 -2.856 5.146 1.00 0.49 H new ATOM 0 HG11 VAL B 16 -5.100 -0.996 3.743 1.00 0.56 H new ATOM 0 HG12 VAL B 16 -6.300 -2.296 3.937 1.00 0.56 H new ATOM 0 HG13 VAL B 16 -6.463 -0.788 4.868 1.00 0.56 H new ATOM 0 HG21 VAL B 16 -3.463 -0.516 5.499 1.00 0.53 H new ATOM 0 HG22 VAL B 16 -4.727 -0.294 6.732 1.00 0.53 H new ATOM 0 HG23 VAL B 16 -3.417 -1.469 7.001 1.00 0.53 H new ATOM 1880 N VAL B 17 -6.131 -5.182 5.810 1.00 0.46 N ATOM 1881 CA VAL B 17 -6.854 -6.302 5.159 1.00 0.50 C ATOM 1882 C VAL B 17 -7.859 -6.994 6.120 1.00 0.57 C ATOM 1883 O VAL B 17 -8.701 -7.770 5.661 1.00 0.97 O ATOM 1884 CB VAL B 17 -5.852 -7.366 4.576 1.00 0.53 C ATOM 1885 CG1 VAL B 17 -6.576 -8.499 3.827 1.00 0.63 C ATOM 1886 CG2 VAL B 17 -4.820 -6.700 3.657 1.00 0.55 C ATOM 0 H VAL B 17 -5.200 -5.430 6.146 1.00 0.46 H new ATOM 0 HA VAL B 17 -7.423 -5.864 4.339 1.00 0.50 H new ATOM 0 HB VAL B 17 -5.335 -7.811 5.426 1.00 0.53 H new ATOM 0 HG11 VAL B 17 -5.843 -9.208 3.443 1.00 0.63 H new ATOM 0 HG12 VAL B 17 -7.254 -9.012 4.510 1.00 0.63 H new ATOM 0 HG13 VAL B 17 -7.145 -8.081 2.997 1.00 0.63 H new ATOM 0 HG21 VAL B 17 -4.139 -7.456 3.267 1.00 0.55 H new ATOM 0 HG22 VAL B 17 -5.332 -6.211 2.829 1.00 0.55 H new ATOM 0 HG23 VAL B 17 -4.254 -5.959 4.222 1.00 0.55 H new ATOM 1896 N THR B 18 -7.783 -6.710 7.439 1.00 0.50 N ATOM 1897 CA THR B 18 -8.694 -7.326 8.429 1.00 0.52 C ATOM 1898 C THR B 18 -9.767 -6.347 8.945 1.00 0.54 C ATOM 1899 O THR B 18 -10.893 -6.768 9.229 1.00 0.67 O ATOM 1900 CB THR B 18 -7.908 -7.907 9.638 1.00 0.56 C ATOM 1901 OG1 THR B 18 -7.120 -6.881 10.258 1.00 0.58 O ATOM 1902 CG2 THR B 18 -6.998 -9.058 9.211 1.00 0.62 C ATOM 0 H THR B 18 -7.105 -6.063 7.841 1.00 0.50 H new ATOM 0 HA THR B 18 -9.201 -8.134 7.901 1.00 0.52 H new ATOM 0 HB THR B 18 -8.638 -8.290 10.351 1.00 0.56 H new ATOM 0 HG1 THR B 18 -6.250 -7.249 10.519 1.00 0.58 H new ATOM 0 HG21 THR B 18 -6.463 -9.441 10.080 1.00 0.62 H new ATOM 0 HG22 THR B 18 -7.600 -9.855 8.775 1.00 0.62 H new ATOM 0 HG23 THR B 18 -6.281 -8.700 8.473 1.00 0.62 H new ATOM 1910 N THR B 19 -9.425 -5.045 9.061 1.00 0.53 N ATOM 1911 CA THR B 19 -10.366 -4.018 9.559 1.00 0.57 C ATOM 1912 C THR B 19 -11.499 -3.720 8.549 1.00 0.57 C ATOM 1913 O THR B 19 -12.643 -3.506 8.965 1.00 0.66 O ATOM 1914 CB THR B 19 -9.623 -2.699 9.935 1.00 0.60 C ATOM 1915 OG1 THR B 19 -8.534 -2.994 10.817 1.00 0.61 O ATOM 1916 CG2 THR B 19 -10.541 -1.680 10.620 1.00 0.69 C ATOM 0 H THR B 19 -8.504 -4.681 8.816 1.00 0.53 H new ATOM 0 HA THR B 19 -10.823 -4.431 10.458 1.00 0.57 H new ATOM 0 HB THR B 19 -9.266 -2.260 9.003 1.00 0.60 H new ATOM 0 HG1 THR B 19 -7.866 -3.532 10.343 1.00 0.61 H new ATOM 0 HG21 THR B 19 -9.972 -0.781 10.860 1.00 0.69 H new ATOM 0 HG22 THR B 19 -11.362 -1.422 9.951 1.00 0.69 H new ATOM 0 HG23 THR B 19 -10.942 -2.111 11.537 1.00 0.69 H new ATOM 1924 N PHE B 20 -11.182 -3.711 7.233 1.00 0.56 N ATOM 1925 CA PHE B 20 -12.190 -3.432 6.189 1.00 0.60 C ATOM 1926 C PHE B 20 -12.531 -4.689 5.346 1.00 0.60 C ATOM 1927 O PHE B 20 -12.957 -4.567 4.190 1.00 0.94 O ATOM 1928 CB PHE B 20 -11.711 -2.270 5.286 1.00 0.68 C ATOM 1929 CG PHE B 20 -12.839 -1.521 4.590 1.00 0.75 C ATOM 1930 CD1 PHE B 20 -13.753 -0.769 5.324 1.00 0.91 C ATOM 1931 CD2 PHE B 20 -12.988 -1.569 3.205 1.00 0.80 C ATOM 1932 CE1 PHE B 20 -14.779 -0.088 4.696 1.00 1.02 C ATOM 1933 CE2 PHE B 20 -14.015 -0.886 2.579 1.00 0.90 C ATOM 1934 CZ PHE B 20 -14.910 -0.146 3.324 1.00 0.97 C ATOM 0 H PHE B 20 -10.245 -3.892 6.874 1.00 0.56 H new ATOM 0 HA PHE B 20 -13.111 -3.136 6.691 1.00 0.60 H new ATOM 0 HB2 PHE B 20 -11.140 -1.566 5.890 1.00 0.68 H new ATOM 0 HB3 PHE B 20 -11.032 -2.666 4.531 1.00 0.68 H new ATOM 0 HD1 PHE B 20 -13.659 -0.717 6.399 1.00 0.91 H new ATOM 0 HD2 PHE B 20 -12.293 -2.147 2.613 1.00 0.80 H new ATOM 0 HE1 PHE B 20 -15.479 0.490 5.280 1.00 1.02 H new ATOM 0 HE2 PHE B 20 -14.117 -0.932 1.505 1.00 0.90 H new ATOM 0 HZ PHE B 20 -15.712 0.387 2.834 1.00 0.97 H new ATOM 1944 N PHE B 21 -12.361 -5.895 5.935 1.00 0.71 N ATOM 1945 CA PHE B 21 -12.683 -7.161 5.246 1.00 0.72 C ATOM 1946 C PHE B 21 -14.208 -7.396 5.232 1.00 0.68 C ATOM 1947 O PHE B 21 -14.739 -7.923 4.255 1.00 0.71 O ATOM 1948 CB PHE B 21 -11.964 -8.353 5.919 1.00 1.01 C ATOM 1949 CG PHE B 21 -12.265 -9.708 5.297 1.00 1.63 C ATOM 1950 CD1 PHE B 21 -11.745 -10.060 4.055 1.00 1.93 C ATOM 1951 CD2 PHE B 21 -13.086 -10.621 5.951 1.00 2.26 C ATOM 1952 CE1 PHE B 21 -12.036 -11.287 3.485 1.00 2.67 C ATOM 1953 CE2 PHE B 21 -13.379 -11.844 5.383 1.00 2.92 C ATOM 1954 CZ PHE B 21 -12.855 -12.180 4.151 1.00 3.08 C ATOM 0 H PHE B 21 -12.004 -6.015 6.883 1.00 0.71 H new ATOM 0 HA PHE B 21 -12.331 -7.085 4.217 1.00 0.72 H new ATOM 0 HB2 PHE B 21 -10.888 -8.181 5.879 1.00 1.01 H new ATOM 0 HB3 PHE B 21 -12.244 -8.381 6.972 1.00 1.01 H new ATOM 0 HD1 PHE B 21 -11.106 -9.366 3.529 1.00 1.93 H new ATOM 0 HD2 PHE B 21 -13.500 -10.369 6.916 1.00 2.26 H new ATOM 0 HE1 PHE B 21 -11.624 -11.547 2.521 1.00 2.67 H new ATOM 0 HE2 PHE B 21 -14.020 -12.540 5.904 1.00 2.92 H new ATOM 0 HZ PHE B 21 -13.084 -13.138 3.708 1.00 3.08 H new ATOM 1964 N THR B 22 -14.895 -7.000 6.332 1.00 0.76 N ATOM 1965 CA THR B 22 -16.363 -7.141 6.464 1.00 0.91 C ATOM 1966 C THR B 22 -17.118 -6.387 5.339 1.00 0.84 C ATOM 1967 O THR B 22 -18.179 -6.838 4.898 1.00 1.01 O ATOM 1968 CB THR B 22 -16.848 -6.626 7.857 1.00 1.10 C ATOM 1969 OG1 THR B 22 -15.990 -7.127 8.900 1.00 1.23 O ATOM 1970 CG2 THR B 22 -18.295 -7.038 8.151 1.00 1.37 C ATOM 0 H THR B 22 -14.449 -6.577 7.146 1.00 0.76 H new ATOM 0 HA THR B 22 -16.589 -8.203 6.374 1.00 0.91 H new ATOM 0 HB THR B 22 -16.804 -5.537 7.829 1.00 1.10 H new ATOM 0 HG1 THR B 22 -16.303 -6.796 9.768 1.00 1.23 H new ATOM 0 HG21 THR B 22 -18.590 -6.659 9.129 1.00 1.37 H new ATOM 0 HG22 THR B 22 -18.954 -6.624 7.388 1.00 1.37 H new ATOM 0 HG23 THR B 22 -18.372 -8.125 8.145 1.00 1.37 H new ATOM 1978 N PHE B 23 -16.556 -5.243 4.890 1.00 0.69 N ATOM 1979 CA PHE B 23 -17.157 -4.419 3.820 1.00 0.75 C ATOM 1980 C PHE B 23 -16.690 -4.882 2.421 1.00 0.70 C ATOM 1981 O PHE B 23 -17.491 -4.912 1.483 1.00 0.83 O ATOM 1982 CB PHE B 23 -16.800 -2.931 4.027 1.00 0.84 C ATOM 1983 CG PHE B 23 -17.374 -2.322 5.296 1.00 1.00 C ATOM 1984 CD1 PHE B 23 -16.701 -2.444 6.508 1.00 1.03 C ATOM 1985 CD2 PHE B 23 -18.581 -1.631 5.277 1.00 1.32 C ATOM 1986 CE1 PHE B 23 -17.219 -1.892 7.665 1.00 1.27 C ATOM 1987 CE2 PHE B 23 -19.100 -1.078 6.435 1.00 1.54 C ATOM 1988 CZ PHE B 23 -18.417 -1.209 7.629 1.00 1.48 C ATOM 0 H PHE B 23 -15.681 -4.868 5.256 1.00 0.69 H new ATOM 0 HA PHE B 23 -18.239 -4.542 3.874 1.00 0.75 H new ATOM 0 HB2 PHE B 23 -15.715 -2.829 4.047 1.00 0.84 H new ATOM 0 HB3 PHE B 23 -17.158 -2.361 3.170 1.00 0.84 H new ATOM 0 HD1 PHE B 23 -15.762 -2.977 6.545 1.00 1.03 H new ATOM 0 HD2 PHE B 23 -19.120 -1.525 4.347 1.00 1.32 H new ATOM 0 HE1 PHE B 23 -16.685 -1.996 8.598 1.00 1.27 H new ATOM 0 HE2 PHE B 23 -20.038 -0.544 6.405 1.00 1.54 H new ATOM 0 HZ PHE B 23 -18.821 -0.777 8.533 1.00 1.48 H new ATOM 1998 N ALA B 24 -15.392 -5.247 2.299 1.00 0.61 N ATOM 1999 CA ALA B 24 -14.797 -5.706 1.019 1.00 0.67 C ATOM 2000 C ALA B 24 -15.441 -6.999 0.469 1.00 0.65 C ATOM 2001 O ALA B 24 -15.606 -7.134 -0.748 1.00 0.85 O ATOM 2002 CB ALA B 24 -13.287 -5.906 1.189 1.00 0.77 C ATOM 0 H ALA B 24 -14.732 -5.232 3.077 1.00 0.61 H new ATOM 0 HA ALA B 24 -14.996 -4.925 0.286 1.00 0.67 H new ATOM 0 HB1 ALA B 24 -12.856 -6.243 0.246 1.00 0.77 H new ATOM 0 HB2 ALA B 24 -12.826 -4.963 1.482 1.00 0.77 H new ATOM 0 HB3 ALA B 24 -13.104 -6.655 1.960 1.00 0.77 H new ATOM 2008 N ARG B 25 -15.802 -7.942 1.362 1.00 0.62 N ATOM 2009 CA ARG B 25 -16.423 -9.229 0.953 1.00 0.68 C ATOM 2010 C ARG B 25 -17.899 -9.082 0.496 1.00 0.70 C ATOM 2011 O ARG B 25 -18.413 -9.958 -0.207 1.00 0.87 O ATOM 2012 CB ARG B 25 -16.330 -10.260 2.101 1.00 0.77 C ATOM 2013 CG ARG B 25 -17.153 -9.903 3.348 1.00 0.80 C ATOM 2014 CD ARG B 25 -17.097 -10.991 4.416 1.00 1.01 C ATOM 2015 NE ARG B 25 -17.937 -10.666 5.582 1.00 1.10 N ATOM 2016 CZ ARG B 25 -18.167 -11.487 6.625 1.00 1.38 C ATOM 2017 NH1 ARG B 25 -17.693 -12.741 6.648 1.00 1.73 N ATOM 2018 NH2 ARG B 25 -18.907 -11.057 7.647 1.00 1.48 N ATOM 0 H ARG B 25 -15.677 -7.842 2.369 1.00 0.62 H new ATOM 0 HA ARG B 25 -15.858 -9.580 0.089 1.00 0.68 H new ATOM 0 HB2 ARG B 25 -16.661 -11.230 1.729 1.00 0.77 H new ATOM 0 HB3 ARG B 25 -15.285 -10.369 2.390 1.00 0.77 H new ATOM 0 HG2 ARG B 25 -16.784 -8.967 3.768 1.00 0.80 H new ATOM 0 HG3 ARG B 25 -18.190 -9.735 3.059 1.00 0.80 H new ATOM 0 HD2 ARG B 25 -17.425 -11.938 3.986 1.00 1.01 H new ATOM 0 HD3 ARG B 25 -16.065 -11.128 4.740 1.00 1.01 H new ATOM 0 HE ARG B 25 -18.379 -9.747 5.601 1.00 1.10 H new ATOM 0 HH11 ARG B 25 -17.144 -13.093 5.864 1.00 1.73 H new ATOM 0 HH12 ARG B 25 -17.881 -13.343 7.450 1.00 1.73 H new ATOM 0 HH21 ARG B 25 -19.294 -10.113 7.635 1.00 1.48 H new ATOM 0 HH22 ARG B 25 -19.086 -11.672 8.441 1.00 1.48 H new ATOM 2032 N GLN B 26 -18.567 -7.977 0.905 1.00 0.71 N ATOM 2033 CA GLN B 26 -19.989 -7.705 0.571 1.00 0.79 C ATOM 2034 C GLN B 26 -20.282 -7.804 -0.948 1.00 0.73 C ATOM 2035 O GLN B 26 -21.259 -8.450 -1.344 1.00 0.84 O ATOM 2036 CB GLN B 26 -20.381 -6.314 1.111 1.00 0.90 C ATOM 2037 CG GLN B 26 -21.878 -5.989 1.076 1.00 1.09 C ATOM 2038 CD GLN B 26 -22.203 -4.622 1.679 1.00 1.31 C ATOM 2039 OE1 GLN B 26 -21.398 -3.689 1.602 1.00 1.46 O ATOM 2040 NE2 GLN B 26 -23.384 -4.487 2.285 1.00 1.68 N ATOM 0 H GLN B 26 -18.137 -7.249 1.475 1.00 0.71 H new ATOM 0 HA GLN B 26 -20.594 -8.476 1.048 1.00 0.79 H new ATOM 0 HB2 GLN B 26 -20.034 -6.233 2.141 1.00 0.90 H new ATOM 0 HB3 GLN B 26 -19.849 -5.557 0.534 1.00 0.90 H new ATOM 0 HG2 GLN B 26 -22.227 -6.018 0.044 1.00 1.09 H new ATOM 0 HG3 GLN B 26 -22.425 -6.760 1.619 1.00 1.09 H new ATOM 0 HE21 GLN B 26 -24.027 -5.278 2.331 1.00 1.68 H new ATOM 0 HE22 GLN B 26 -23.644 -3.593 2.702 1.00 1.68 H new ATOM 2049 N GLU B 27 -19.437 -7.167 -1.781 1.00 0.66 N ATOM 2050 CA GLU B 27 -19.607 -7.179 -3.252 1.00 0.71 C ATOM 2051 C GLU B 27 -18.697 -8.262 -3.900 1.00 0.88 C ATOM 2052 O GLU B 27 -18.123 -9.088 -3.181 1.00 1.45 O ATOM 2053 CB GLU B 27 -19.323 -5.764 -3.823 1.00 0.83 C ATOM 2054 CG GLU B 27 -20.235 -4.654 -3.276 1.00 0.93 C ATOM 2055 CD GLU B 27 -21.690 -4.786 -3.707 1.00 1.04 C ATOM 2056 OE1 GLU B 27 -22.016 -4.370 -4.839 1.00 1.23 O ATOM 2057 OE2 GLU B 27 -22.502 -5.304 -2.911 1.00 1.16 O ATOM 0 H GLU B 27 -18.627 -6.636 -1.462 1.00 0.66 H new ATOM 0 HA GLU B 27 -20.637 -7.440 -3.496 1.00 0.71 H new ATOM 0 HB2 GLU B 27 -18.287 -5.502 -3.609 1.00 0.83 H new ATOM 0 HB3 GLU B 27 -19.426 -5.798 -4.908 1.00 0.83 H new ATOM 0 HG2 GLU B 27 -20.186 -4.660 -2.187 1.00 0.93 H new ATOM 0 HG3 GLU B 27 -19.854 -3.688 -3.607 1.00 0.93 H new ATOM 2064 N GLY B 28 -18.575 -8.258 -5.256 1.00 0.73 N ATOM 2065 CA GLY B 28 -17.755 -9.248 -5.986 1.00 0.86 C ATOM 2066 C GLY B 28 -16.320 -9.392 -5.471 1.00 0.69 C ATOM 2067 O GLY B 28 -15.679 -8.391 -5.135 1.00 0.66 O ATOM 0 H GLY B 28 -19.037 -7.578 -5.860 1.00 0.73 H new ATOM 0 HA2 GLY B 28 -18.246 -10.219 -5.930 1.00 0.86 H new ATOM 0 HA3 GLY B 28 -17.723 -8.968 -7.039 1.00 0.86 H new ATOM 2071 N ARG B 29 -15.820 -10.658 -5.422 1.00 0.68 N ATOM 2072 CA ARG B 29 -14.458 -10.998 -4.935 1.00 0.65 C ATOM 2073 C ARG B 29 -14.275 -10.640 -3.439 1.00 0.62 C ATOM 2074 O ARG B 29 -14.735 -9.591 -2.982 1.00 0.69 O ATOM 2075 CB ARG B 29 -13.354 -10.340 -5.811 1.00 0.66 C ATOM 2076 CG ARG B 29 -12.859 -11.195 -6.985 1.00 0.84 C ATOM 2077 CD ARG B 29 -13.955 -11.497 -8.013 1.00 1.28 C ATOM 2078 NE ARG B 29 -13.409 -12.044 -9.271 1.00 1.44 N ATOM 2079 CZ ARG B 29 -14.063 -12.086 -10.454 1.00 1.93 C ATOM 2080 NH1 ARG B 29 -15.320 -11.629 -10.577 1.00 2.62 N ATOM 2081 NH2 ARG B 29 -13.450 -12.601 -11.521 1.00 2.09 N ATOM 0 H ARG B 29 -16.355 -11.473 -5.721 1.00 0.68 H new ATOM 0 HA ARG B 29 -14.349 -12.079 -5.027 1.00 0.65 H new ATOM 0 HB2 ARG B 29 -13.737 -9.398 -6.204 1.00 0.66 H new ATOM 0 HB3 ARG B 29 -12.503 -10.097 -5.174 1.00 0.66 H new ATOM 0 HG2 ARG B 29 -12.036 -10.680 -7.481 1.00 0.84 H new ATOM 0 HG3 ARG B 29 -12.461 -12.134 -6.600 1.00 0.84 H new ATOM 0 HD2 ARG B 29 -14.663 -12.208 -7.587 1.00 1.28 H new ATOM 0 HD3 ARG B 29 -14.510 -10.584 -8.227 1.00 1.28 H new ATOM 0 HE ARG B 29 -12.462 -12.421 -9.246 1.00 1.44 H new ATOM 0 HH11 ARG B 29 -15.802 -11.239 -9.767 1.00 2.62 H new ATOM 0 HH12 ARG B 29 -15.792 -11.672 -11.480 1.00 2.62 H new ATOM 0 HH21 ARG B 29 -12.498 -12.958 -11.439 1.00 2.09 H new ATOM 0 HH22 ARG B 29 -13.933 -12.638 -12.418 1.00 2.09 H new ATOM 2095 N LYS B 30 -13.595 -11.527 -2.684 1.00 0.64 N ATOM 2096 CA LYS B 30 -13.360 -11.324 -1.238 1.00 0.65 C ATOM 2097 C LYS B 30 -12.256 -10.283 -0.981 1.00 0.63 C ATOM 2098 O LYS B 30 -12.441 -9.382 -0.156 1.00 0.67 O ATOM 2099 CB LYS B 30 -13.005 -12.664 -0.551 1.00 0.73 C ATOM 2100 CG LYS B 30 -14.096 -13.739 -0.644 1.00 0.79 C ATOM 2101 CD LYS B 30 -15.343 -13.389 0.181 1.00 0.87 C ATOM 2102 CE LYS B 30 -16.441 -14.446 0.053 1.00 1.01 C ATOM 2103 NZ LYS B 30 -17.121 -14.418 -1.279 1.00 1.11 N ATOM 0 H LYS B 30 -13.198 -12.392 -3.051 1.00 0.64 H new ATOM 0 HA LYS B 30 -14.285 -10.940 -0.808 1.00 0.65 H new ATOM 0 HB2 LYS B 30 -12.090 -13.054 -0.997 1.00 0.73 H new ATOM 0 HB3 LYS B 30 -12.791 -12.472 0.500 1.00 0.73 H new ATOM 0 HG2 LYS B 30 -14.381 -13.872 -1.688 1.00 0.79 H new ATOM 0 HG3 LYS B 30 -13.693 -14.691 -0.300 1.00 0.79 H new ATOM 0 HD2 LYS B 30 -15.064 -13.284 1.229 1.00 0.87 H new ATOM 0 HD3 LYS B 30 -15.732 -12.424 -0.144 1.00 0.87 H new ATOM 0 HE2 LYS B 30 -16.009 -15.434 0.214 1.00 1.01 H new ATOM 0 HE3 LYS B 30 -17.182 -14.290 0.837 1.00 1.01 H new ATOM 0 HZ1 LYS B 30 -17.855 -15.154 -1.310 1.00 1.11 H new ATOM 0 HZ2 LYS B 30 -17.559 -13.486 -1.426 1.00 1.11 H new ATOM 0 HZ3 LYS B 30 -16.422 -14.594 -2.029 1.00 1.11 H new ATOM 2117 N ASP B 31 -11.110 -10.407 -1.687 1.00 0.65 N ATOM 2118 CA ASP B 31 -9.989 -9.457 -1.537 1.00 0.69 C ATOM 2119 C ASP B 31 -10.042 -8.380 -2.645 1.00 0.64 C ATOM 2120 O ASP B 31 -9.054 -8.146 -3.351 1.00 0.88 O ATOM 2121 CB ASP B 31 -8.638 -10.206 -1.558 1.00 0.83 C ATOM 2122 CG ASP B 31 -8.446 -11.134 -0.366 1.00 0.94 C ATOM 2123 OD1 ASP B 31 -8.857 -12.309 -0.456 1.00 1.24 O ATOM 2124 OD2 ASP B 31 -7.882 -10.683 0.655 1.00 1.36 O ATOM 0 H ASP B 31 -10.939 -11.152 -2.362 1.00 0.65 H new ATOM 0 HA ASP B 31 -10.083 -8.957 -0.573 1.00 0.69 H new ATOM 0 HB2 ASP B 31 -8.567 -10.787 -2.477 1.00 0.83 H new ATOM 0 HB3 ASP B 31 -7.827 -9.478 -1.577 1.00 0.83 H new ATOM 2129 N SER B 32 -11.212 -7.720 -2.781 1.00 0.65 N ATOM 2130 CA SER B 32 -11.424 -6.674 -3.794 1.00 0.59 C ATOM 2131 C SER B 32 -12.506 -5.678 -3.329 1.00 0.57 C ATOM 2132 O SER B 32 -13.674 -6.052 -3.177 1.00 0.64 O ATOM 2133 CB SER B 32 -11.831 -7.314 -5.132 1.00 0.59 C ATOM 2134 OG SER B 32 -12.010 -6.337 -6.141 1.00 1.13 O ATOM 0 H SER B 32 -12.028 -7.898 -2.195 1.00 0.65 H new ATOM 0 HA SER B 32 -10.491 -6.128 -3.930 1.00 0.59 H new ATOM 0 HB2 SER B 32 -11.066 -8.025 -5.444 1.00 0.59 H new ATOM 0 HB3 SER B 32 -12.755 -7.877 -5.001 1.00 0.59 H new ATOM 0 HG SER B 32 -11.949 -6.762 -7.022 1.00 1.13 H new ATOM 2140 N LEU B 33 -12.110 -4.409 -3.112 1.00 0.55 N ATOM 2141 CA LEU B 33 -13.044 -3.358 -2.657 1.00 0.56 C ATOM 2142 C LEU B 33 -13.929 -2.870 -3.816 1.00 0.55 C ATOM 2143 O LEU B 33 -13.489 -2.842 -4.968 1.00 0.72 O ATOM 2144 CB LEU B 33 -12.281 -2.167 -2.032 1.00 0.59 C ATOM 2145 CG LEU B 33 -11.597 -2.435 -0.663 1.00 0.69 C ATOM 2146 CD1 LEU B 33 -10.318 -3.267 -0.817 1.00 0.79 C ATOM 2147 CD2 LEU B 33 -11.295 -1.117 0.060 1.00 0.75 C ATOM 0 H LEU B 33 -11.152 -4.086 -3.244 1.00 0.55 H new ATOM 0 HA LEU B 33 -13.684 -3.796 -1.891 1.00 0.56 H new ATOM 0 HB2 LEU B 33 -11.518 -1.840 -2.738 1.00 0.59 H new ATOM 0 HB3 LEU B 33 -12.979 -1.339 -1.910 1.00 0.59 H new ATOM 0 HG LEU B 33 -12.296 -3.014 -0.060 1.00 0.69 H new ATOM 0 HD11 LEU B 33 -9.871 -3.432 0.163 1.00 0.79 H new ATOM 0 HD12 LEU B 33 -10.561 -4.228 -1.271 1.00 0.79 H new ATOM 0 HD13 LEU B 33 -9.611 -2.734 -1.453 1.00 0.79 H new ATOM 0 HD21 LEU B 33 -10.816 -1.328 1.016 1.00 0.75 H new ATOM 0 HD22 LEU B 33 -10.629 -0.510 -0.553 1.00 0.75 H new ATOM 0 HD23 LEU B 33 -12.225 -0.575 0.232 1.00 0.75 H new ATOM 2159 N SER B 34 -15.180 -2.485 -3.498 1.00 0.52 N ATOM 2160 CA SER B 34 -16.143 -2.004 -4.505 1.00 0.53 C ATOM 2161 C SER B 34 -15.913 -0.517 -4.842 1.00 0.50 C ATOM 2162 O SER B 34 -15.144 0.163 -4.155 1.00 0.52 O ATOM 2163 CB SER B 34 -17.583 -2.218 -4.005 1.00 0.62 C ATOM 2164 OG SER B 34 -18.525 -2.061 -5.054 1.00 0.69 O ATOM 0 H SER B 34 -15.548 -2.498 -2.547 1.00 0.52 H new ATOM 0 HA SER B 34 -15.989 -2.581 -5.417 1.00 0.53 H new ATOM 0 HB2 SER B 34 -17.676 -3.216 -3.577 1.00 0.62 H new ATOM 0 HB3 SER B 34 -17.802 -1.507 -3.208 1.00 0.62 H new ATOM 0 HG SER B 34 -19.371 -1.730 -4.687 1.00 0.69 H new ATOM 2170 N VAL B 35 -16.587 -0.018 -5.902 1.00 0.52 N ATOM 2171 CA VAL B 35 -16.456 1.392 -6.336 1.00 0.53 C ATOM 2172 C VAL B 35 -17.040 2.390 -5.298 1.00 0.48 C ATOM 2173 O VAL B 35 -16.490 3.484 -5.128 1.00 0.52 O ATOM 2174 CB VAL B 35 -17.090 1.624 -7.757 1.00 0.64 C ATOM 2175 CG1 VAL B 35 -18.621 1.490 -7.752 1.00 0.67 C ATOM 2176 CG2 VAL B 35 -16.658 2.974 -8.351 1.00 0.71 C ATOM 0 H VAL B 35 -17.227 -0.570 -6.473 1.00 0.52 H new ATOM 0 HA VAL B 35 -15.387 1.592 -6.407 1.00 0.53 H new ATOM 0 HB VAL B 35 -16.705 0.831 -8.398 1.00 0.64 H new ATOM 0 HG11 VAL B 35 -19.004 1.660 -8.758 1.00 0.67 H new ATOM 0 HG12 VAL B 35 -18.897 0.488 -7.423 1.00 0.67 H new ATOM 0 HG13 VAL B 35 -19.048 2.227 -7.072 1.00 0.67 H new ATOM 0 HG21 VAL B 35 -17.114 3.102 -9.333 1.00 0.71 H new ATOM 0 HG22 VAL B 35 -16.981 3.781 -7.693 1.00 0.71 H new ATOM 0 HG23 VAL B 35 -15.573 2.998 -8.449 1.00 0.71 H new ATOM 2186 N ASN B 36 -18.143 2.006 -4.611 1.00 0.47 N ATOM 2187 CA ASN B 36 -18.787 2.871 -3.597 1.00 0.48 C ATOM 2188 C ASN B 36 -18.526 2.344 -2.164 1.00 0.46 C ATOM 2189 O ASN B 36 -19.418 2.379 -1.304 1.00 0.66 O ATOM 2190 CB ASN B 36 -20.306 2.982 -3.884 1.00 0.55 C ATOM 2191 CG ASN B 36 -20.977 4.162 -3.172 1.00 0.64 C ATOM 2192 OD1 ASN B 36 -20.371 5.221 -2.989 1.00 0.83 O ATOM 2193 ND2 ASN B 36 -22.234 3.989 -2.761 1.00 0.79 N ATOM 0 H ASN B 36 -18.603 1.105 -4.741 1.00 0.47 H new ATOM 0 HA ASN B 36 -18.348 3.866 -3.661 1.00 0.48 H new ATOM 0 HB2 ASN B 36 -20.459 3.082 -4.959 1.00 0.55 H new ATOM 0 HB3 ASN B 36 -20.794 2.057 -3.577 1.00 0.55 H new ATOM 0 HD21 ASN B 36 -22.722 4.745 -2.280 1.00 0.79 H new ATOM 0 HD22 ASN B 36 -22.707 3.101 -2.928 1.00 0.79 H new ATOM 2200 N GLU B 37 -17.293 1.861 -1.915 1.00 0.46 N ATOM 2201 CA GLU B 37 -16.898 1.342 -0.592 1.00 0.50 C ATOM 2202 C GLU B 37 -15.675 2.097 -0.061 1.00 0.45 C ATOM 2203 O GLU B 37 -15.678 2.530 1.094 1.00 0.46 O ATOM 2204 CB GLU B 37 -16.623 -0.172 -0.653 1.00 0.62 C ATOM 2205 CG GLU B 37 -17.872 -1.032 -0.446 1.00 0.69 C ATOM 2206 CD GLU B 37 -17.603 -2.527 -0.569 1.00 0.88 C ATOM 2207 OE1 GLU B 37 -16.506 -2.975 -0.171 1.00 1.61 O ATOM 2208 OE2 GLU B 37 -18.492 -3.250 -1.064 1.00 1.28 O ATOM 0 H GLU B 37 -16.552 1.820 -2.615 1.00 0.46 H new ATOM 0 HA GLU B 37 -17.727 1.504 0.097 1.00 0.50 H new ATOM 0 HB2 GLU B 37 -16.182 -0.414 -1.620 1.00 0.62 H new ATOM 0 HB3 GLU B 37 -15.885 -0.429 0.107 1.00 0.62 H new ATOM 0 HG2 GLU B 37 -18.288 -0.825 0.540 1.00 0.69 H new ATOM 0 HG3 GLU B 37 -18.628 -0.745 -1.177 1.00 0.69 H new ATOM 2215 N PHE B 38 -14.629 2.258 -0.906 1.00 0.43 N ATOM 2216 CA PHE B 38 -13.410 2.987 -0.503 1.00 0.43 C ATOM 2217 C PHE B 38 -13.705 4.486 -0.278 1.00 0.39 C ATOM 2218 O PHE B 38 -13.106 5.103 0.599 1.00 0.42 O ATOM 2219 CB PHE B 38 -12.261 2.790 -1.528 1.00 0.48 C ATOM 2220 CG PHE B 38 -12.488 3.410 -2.901 1.00 0.46 C ATOM 2221 CD1 PHE B 38 -12.179 4.746 -3.138 1.00 0.55 C ATOM 2222 CD2 PHE B 38 -13.003 2.655 -3.949 1.00 0.52 C ATOM 2223 CE1 PHE B 38 -12.382 5.310 -4.382 1.00 0.65 C ATOM 2224 CE2 PHE B 38 -13.207 3.220 -5.194 1.00 0.61 C ATOM 2225 CZ PHE B 38 -12.897 4.549 -5.410 1.00 0.66 C ATOM 0 H PHE B 38 -14.607 1.896 -1.859 1.00 0.43 H new ATOM 0 HA PHE B 38 -13.077 2.565 0.445 1.00 0.43 H new ATOM 0 HB2 PHE B 38 -11.347 3.209 -1.107 1.00 0.48 H new ATOM 0 HB3 PHE B 38 -12.092 1.721 -1.656 1.00 0.48 H new ATOM 0 HD1 PHE B 38 -11.775 5.350 -2.339 1.00 0.55 H new ATOM 0 HD2 PHE B 38 -13.246 1.615 -3.788 1.00 0.52 H new ATOM 0 HE1 PHE B 38 -12.137 6.348 -4.550 1.00 0.65 H new ATOM 0 HE2 PHE B 38 -13.609 2.622 -5.999 1.00 0.61 H new ATOM 0 HZ PHE B 38 -13.058 4.991 -6.382 1.00 0.66 H new ATOM 2235 N LYS B 39 -14.642 5.056 -1.074 1.00 0.37 N ATOM 2236 CA LYS B 39 -15.026 6.479 -0.955 1.00 0.38 C ATOM 2237 C LYS B 39 -15.711 6.758 0.397 1.00 0.36 C ATOM 2238 O LYS B 39 -15.464 7.799 1.014 1.00 0.39 O ATOM 2239 CB LYS B 39 -15.950 6.893 -2.115 1.00 0.43 C ATOM 2240 CG LYS B 39 -16.068 8.406 -2.316 1.00 0.50 C ATOM 2241 CD LYS B 39 -17.029 8.751 -3.456 1.00 0.60 C ATOM 2242 CE LYS B 39 -17.171 10.259 -3.667 1.00 0.70 C ATOM 2243 NZ LYS B 39 -15.926 10.884 -4.212 1.00 0.81 N ATOM 0 H LYS B 39 -15.144 4.550 -1.804 1.00 0.37 H new ATOM 0 HA LYS B 39 -14.114 7.074 -1.005 1.00 0.38 H new ATOM 0 HB2 LYS B 39 -15.581 6.443 -3.037 1.00 0.43 H new ATOM 0 HB3 LYS B 39 -16.944 6.483 -1.936 1.00 0.43 H new ATOM 0 HG2 LYS B 39 -16.416 8.870 -1.393 1.00 0.50 H new ATOM 0 HG3 LYS B 39 -15.084 8.823 -2.531 1.00 0.50 H new ATOM 0 HD2 LYS B 39 -16.674 8.290 -4.378 1.00 0.60 H new ATOM 0 HD3 LYS B 39 -18.009 8.323 -3.243 1.00 0.60 H new ATOM 0 HE2 LYS B 39 -17.998 10.450 -4.351 1.00 0.70 H new ATOM 0 HE3 LYS B 39 -17.425 10.732 -2.719 1.00 0.70 H new ATOM 0 HZ1 LYS B 39 -16.082 11.903 -4.352 1.00 0.81 H new ATOM 0 HZ2 LYS B 39 -15.144 10.742 -3.541 1.00 0.81 H new ATOM 0 HZ3 LYS B 39 -15.686 10.442 -5.122 1.00 0.81 H new ATOM 2257 N GLU B 40 -16.581 5.825 0.845 1.00 0.35 N ATOM 2258 CA GLU B 40 -17.276 5.953 2.142 1.00 0.38 C ATOM 2259 C GLU B 40 -16.281 5.811 3.312 1.00 0.38 C ATOM 2260 O GLU B 40 -16.470 6.428 4.366 1.00 0.41 O ATOM 2261 CB GLU B 40 -18.410 4.913 2.265 1.00 0.43 C ATOM 2262 CG GLU B 40 -19.590 5.181 1.333 1.00 0.47 C ATOM 2263 CD GLU B 40 -20.789 4.296 1.619 1.00 0.56 C ATOM 2264 OE1 GLU B 40 -21.642 4.699 2.439 1.00 0.69 O ATOM 2265 OE2 GLU B 40 -20.878 3.201 1.022 1.00 0.63 O ATOM 0 H GLU B 40 -16.817 4.978 0.328 1.00 0.35 H new ATOM 0 HA GLU B 40 -17.720 6.947 2.189 1.00 0.38 H new ATOM 0 HB2 GLU B 40 -18.008 3.923 2.052 1.00 0.43 H new ATOM 0 HB3 GLU B 40 -18.767 4.898 3.295 1.00 0.43 H new ATOM 0 HG2 GLU B 40 -19.887 6.226 1.425 1.00 0.47 H new ATOM 0 HG3 GLU B 40 -19.272 5.029 0.302 1.00 0.47 H new ATOM 2272 N LEU B 41 -15.220 4.992 3.118 1.00 0.37 N ATOM 2273 CA LEU B 41 -14.172 4.795 4.141 1.00 0.40 C ATOM 2274 C LEU B 41 -13.262 6.039 4.253 1.00 0.38 C ATOM 2275 O LEU B 41 -12.827 6.382 5.355 1.00 0.40 O ATOM 2276 CB LEU B 41 -13.332 3.531 3.817 1.00 0.44 C ATOM 2277 CG LEU B 41 -12.315 3.068 4.895 1.00 0.55 C ATOM 2278 CD1 LEU B 41 -13.017 2.691 6.208 1.00 0.68 C ATOM 2279 CD2 LEU B 41 -11.477 1.892 4.367 1.00 0.64 C ATOM 0 H LEU B 41 -15.070 4.458 2.262 1.00 0.37 H new ATOM 0 HA LEU B 41 -14.661 4.651 5.104 1.00 0.40 H new ATOM 0 HB2 LEU B 41 -14.019 2.707 3.623 1.00 0.44 H new ATOM 0 HB3 LEU B 41 -12.786 3.715 2.892 1.00 0.44 H new ATOM 0 HG LEU B 41 -11.649 3.904 5.110 1.00 0.55 H new ATOM 0 HD11 LEU B 41 -12.274 2.372 6.939 1.00 0.68 H new ATOM 0 HD12 LEU B 41 -13.557 3.556 6.593 1.00 0.68 H new ATOM 0 HD13 LEU B 41 -13.719 1.877 6.025 1.00 0.68 H new ATOM 0 HD21 LEU B 41 -10.768 1.578 5.133 1.00 0.64 H new ATOM 0 HD22 LEU B 41 -12.135 1.059 4.118 1.00 0.64 H new ATOM 0 HD23 LEU B 41 -10.933 2.204 3.476 1.00 0.64 H new ATOM 2291 N VAL B 42 -12.988 6.712 3.108 1.00 0.37 N ATOM 2292 CA VAL B 42 -12.135 7.922 3.082 1.00 0.38 C ATOM 2293 C VAL B 42 -12.889 9.167 3.609 1.00 0.39 C ATOM 2294 O VAL B 42 -12.248 10.117 4.067 1.00 0.43 O ATOM 2295 CB VAL B 42 -11.545 8.180 1.645 1.00 0.43 C ATOM 2296 CG1 VAL B 42 -10.803 9.524 1.534 1.00 0.48 C ATOM 2297 CG2 VAL B 42 -10.610 7.032 1.235 1.00 0.47 C ATOM 0 H VAL B 42 -13.346 6.436 2.193 1.00 0.37 H new ATOM 0 HA VAL B 42 -11.298 7.739 3.756 1.00 0.38 H new ATOM 0 HB VAL B 42 -12.395 8.225 0.964 1.00 0.43 H new ATOM 0 HG11 VAL B 42 -10.419 9.645 0.521 1.00 0.48 H new ATOM 0 HG12 VAL B 42 -11.490 10.339 1.761 1.00 0.48 H new ATOM 0 HG13 VAL B 42 -9.973 9.541 2.241 1.00 0.48 H new ATOM 0 HG21 VAL B 42 -10.211 7.226 0.239 1.00 0.47 H new ATOM 0 HG22 VAL B 42 -9.788 6.960 1.948 1.00 0.47 H new ATOM 0 HG23 VAL B 42 -11.167 6.095 1.227 1.00 0.47 H new ATOM 2307 N THR B 43 -14.239 9.158 3.563 1.00 0.38 N ATOM 2308 CA THR B 43 -15.049 10.291 4.049 1.00 0.42 C ATOM 2309 C THR B 43 -15.735 9.952 5.399 1.00 0.48 C ATOM 2310 O THR B 43 -16.855 10.406 5.668 1.00 0.83 O ATOM 2311 CB THR B 43 -16.107 10.712 2.972 1.00 0.44 C ATOM 2312 OG1 THR B 43 -15.514 10.682 1.661 1.00 0.46 O ATOM 2313 CG2 THR B 43 -16.679 12.116 3.228 1.00 0.49 C ATOM 0 H THR B 43 -14.787 8.380 3.195 1.00 0.38 H new ATOM 0 HA THR B 43 -14.381 11.135 4.221 1.00 0.42 H new ATOM 0 HB THR B 43 -16.927 9.997 3.038 1.00 0.44 H new ATOM 0 HG1 THR B 43 -15.450 9.754 1.352 1.00 0.46 H new ATOM 0 HG21 THR B 43 -17.407 12.359 2.454 1.00 0.49 H new ATOM 0 HG22 THR B 43 -17.165 12.138 4.203 1.00 0.49 H new ATOM 0 HG23 THR B 43 -15.871 12.847 3.209 1.00 0.49 H new ATOM 2321 N GLN B 44 -15.049 9.154 6.259 1.00 0.42 N ATOM 2322 CA GLN B 44 -15.595 8.767 7.578 1.00 0.44 C ATOM 2323 C GLN B 44 -14.490 8.271 8.538 1.00 0.44 C ATOM 2324 O GLN B 44 -14.381 8.775 9.662 1.00 0.50 O ATOM 2325 CB GLN B 44 -16.695 7.691 7.417 1.00 0.47 C ATOM 2326 CG GLN B 44 -17.623 7.566 8.622 1.00 0.58 C ATOM 2327 CD GLN B 44 -18.744 6.561 8.401 1.00 0.67 C ATOM 2328 OE1 GLN B 44 -19.808 6.910 7.885 1.00 0.91 O ATOM 2329 NE2 GLN B 44 -18.517 5.303 8.786 1.00 0.98 N ATOM 0 H GLN B 44 -14.125 8.771 6.061 1.00 0.42 H new ATOM 0 HA GLN B 44 -16.036 9.660 8.021 1.00 0.44 H new ATOM 0 HB2 GLN B 44 -17.291 7.925 6.535 1.00 0.47 H new ATOM 0 HB3 GLN B 44 -16.221 6.726 7.235 1.00 0.47 H new ATOM 0 HG2 GLN B 44 -17.041 7.268 9.494 1.00 0.58 H new ATOM 0 HG3 GLN B 44 -18.055 8.542 8.845 1.00 0.58 H new ATOM 0 HE21 GLN B 44 -17.623 5.053 9.209 1.00 0.98 H new ATOM 0 HE22 GLN B 44 -19.237 4.592 8.657 1.00 0.98 H new ATOM 2338 N GLN B 45 -13.682 7.284 8.093 1.00 0.42 N ATOM 2339 CA GLN B 45 -12.596 6.708 8.916 1.00 0.43 C ATOM 2340 C GLN B 45 -11.189 7.135 8.437 1.00 0.41 C ATOM 2341 O GLN B 45 -10.209 6.910 9.154 1.00 0.46 O ATOM 2342 CB GLN B 45 -12.712 5.166 8.926 1.00 0.47 C ATOM 2343 CG GLN B 45 -11.920 4.475 10.043 1.00 0.57 C ATOM 2344 CD GLN B 45 -12.339 3.025 10.287 1.00 0.62 C ATOM 2345 OE1 GLN B 45 -12.802 2.334 9.376 1.00 0.70 O ATOM 2346 NE2 GLN B 45 -12.173 2.546 11.522 1.00 0.73 N ATOM 0 H GLN B 45 -13.762 6.868 7.165 1.00 0.42 H new ATOM 0 HA GLN B 45 -12.714 7.098 9.927 1.00 0.43 H new ATOM 0 HB2 GLN B 45 -13.763 4.894 9.022 1.00 0.47 H new ATOM 0 HB3 GLN B 45 -12.370 4.782 7.965 1.00 0.47 H new ATOM 0 HG2 GLN B 45 -10.859 4.500 9.793 1.00 0.57 H new ATOM 0 HG3 GLN B 45 -12.044 5.040 10.967 1.00 0.57 H new ATOM 0 HE21 GLN B 45 -11.787 3.144 12.253 1.00 0.73 H new ATOM 0 HE22 GLN B 45 -12.432 1.582 11.734 1.00 0.73 H new ATOM 2355 N LEU B 46 -11.083 7.747 7.238 1.00 0.39 N ATOM 2356 CA LEU B 46 -9.788 8.183 6.683 1.00 0.38 C ATOM 2357 C LEU B 46 -9.895 9.593 6.022 1.00 0.38 C ATOM 2358 O LEU B 46 -9.389 9.786 4.909 1.00 0.41 O ATOM 2359 CB LEU B 46 -9.332 7.118 5.653 1.00 0.40 C ATOM 2360 CG LEU B 46 -7.812 6.930 5.460 1.00 0.41 C ATOM 2361 CD1 LEU B 46 -7.248 5.922 6.467 1.00 0.58 C ATOM 2362 CD2 LEU B 46 -7.513 6.487 4.027 1.00 0.62 C ATOM 0 H LEU B 46 -11.882 7.950 6.637 1.00 0.39 H new ATOM 0 HA LEU B 46 -9.054 8.272 7.484 1.00 0.38 H new ATOM 0 HB2 LEU B 46 -9.756 6.158 5.949 1.00 0.40 H new ATOM 0 HB3 LEU B 46 -9.766 7.375 4.687 1.00 0.40 H new ATOM 0 HG LEU B 46 -7.324 7.888 5.640 1.00 0.41 H new ATOM 0 HD11 LEU B 46 -6.176 5.810 6.308 1.00 0.58 H new ATOM 0 HD12 LEU B 46 -7.429 6.280 7.480 1.00 0.58 H new ATOM 0 HD13 LEU B 46 -7.738 4.958 6.330 1.00 0.58 H new ATOM 0 HD21 LEU B 46 -6.438 6.358 3.903 1.00 0.62 H new ATOM 0 HD22 LEU B 46 -8.018 5.542 3.825 1.00 0.62 H new ATOM 0 HD23 LEU B 46 -7.870 7.245 3.330 1.00 0.62 H new ATOM 2374 N PRO B 47 -10.543 10.615 6.689 1.00 0.40 N ATOM 2375 CA PRO B 47 -10.702 11.972 6.112 1.00 0.42 C ATOM 2376 C PRO B 47 -9.471 12.902 6.266 1.00 0.42 C ATOM 2377 O PRO B 47 -9.186 13.688 5.358 1.00 0.46 O ATOM 2378 CB PRO B 47 -11.897 12.527 6.900 1.00 0.48 C ATOM 2379 CG PRO B 47 -11.771 11.911 8.251 1.00 0.48 C ATOM 2380 CD PRO B 47 -11.190 10.537 8.033 1.00 0.44 C ATOM 0 HA PRO B 47 -10.834 11.922 5.031 1.00 0.42 H new ATOM 0 HB2 PRO B 47 -11.865 13.615 6.955 1.00 0.48 H new ATOM 0 HB3 PRO B 47 -12.842 12.259 6.428 1.00 0.48 H new ATOM 0 HG2 PRO B 47 -11.125 12.510 8.893 1.00 0.48 H new ATOM 0 HG3 PRO B 47 -12.742 11.850 8.743 1.00 0.48 H new ATOM 0 HD2 PRO B 47 -10.466 10.284 8.808 1.00 0.44 H new ATOM 0 HD3 PRO B 47 -11.964 9.770 8.057 1.00 0.44 H new ATOM 2388 N HIS B 48 -8.755 12.810 7.409 1.00 0.42 N ATOM 2389 CA HIS B 48 -7.585 13.679 7.678 1.00 0.44 C ATOM 2390 C HIS B 48 -6.305 13.209 6.957 1.00 0.43 C ATOM 2391 O HIS B 48 -5.383 14.009 6.775 1.00 0.49 O ATOM 2392 CB HIS B 48 -7.332 13.803 9.199 1.00 0.49 C ATOM 2393 CG HIS B 48 -8.464 14.460 9.945 1.00 0.56 C ATOM 2394 ND1 HIS B 48 -9.420 13.750 10.647 1.00 0.67 N ATOM 2395 CD2 HIS B 48 -8.808 15.767 10.070 1.00 0.70 C ATOM 2396 CE1 HIS B 48 -10.300 14.592 11.162 1.00 0.79 C ATOM 2397 NE2 HIS B 48 -9.953 15.819 10.828 1.00 0.81 N ATOM 0 H HIS B 48 -8.964 12.148 8.156 1.00 0.42 H new ATOM 0 HA HIS B 48 -7.832 14.661 7.273 1.00 0.44 H new ATOM 0 HB2 HIS B 48 -7.163 12.809 9.613 1.00 0.49 H new ATOM 0 HB3 HIS B 48 -6.419 14.376 9.362 1.00 0.49 H new ATOM 0 HD2 HIS B 48 -8.279 16.610 9.651 1.00 0.70 H new ATOM 0 HE1 HIS B 48 -11.159 14.320 11.757 1.00 0.79 H new ATOM 0 HE2 HIS B 48 -10.453 16.669 11.090 1.00 0.81 H new ATOM 2406 N LEU B 49 -6.248 11.926 6.534 1.00 0.41 N ATOM 2407 CA LEU B 49 -5.066 11.390 5.831 1.00 0.42 C ATOM 2408 C LEU B 49 -4.991 11.946 4.400 1.00 0.40 C ATOM 2409 O LEU B 49 -4.007 12.603 4.045 1.00 0.48 O ATOM 2410 CB LEU B 49 -5.082 9.846 5.834 1.00 0.43 C ATOM 2411 CG LEU B 49 -3.840 9.143 5.235 1.00 0.52 C ATOM 2412 CD1 LEU B 49 -2.559 9.557 5.962 1.00 0.88 C ATOM 2413 CD2 LEU B 49 -4.012 7.623 5.274 1.00 0.62 C ATOM 0 H LEU B 49 -7.000 11.250 6.667 1.00 0.41 H new ATOM 0 HA LEU B 49 -4.171 11.713 6.363 1.00 0.42 H new ATOM 0 HB2 LEU B 49 -5.203 9.508 6.863 1.00 0.43 H new ATOM 0 HB3 LEU B 49 -5.962 9.513 5.284 1.00 0.43 H new ATOM 0 HG LEU B 49 -3.749 9.458 4.195 1.00 0.52 H new ATOM 0 HD11 LEU B 49 -1.706 9.045 5.516 1.00 0.88 H new ATOM 0 HD12 LEU B 49 -2.422 10.635 5.873 1.00 0.88 H new ATOM 0 HD13 LEU B 49 -2.635 9.286 7.015 1.00 0.88 H new ATOM 0 HD21 LEU B 49 -3.129 7.146 4.849 1.00 0.62 H new ATOM 0 HD22 LEU B 49 -4.139 7.298 6.307 1.00 0.62 H new ATOM 0 HD23 LEU B 49 -4.891 7.341 4.694 1.00 0.62 H new ATOM 2425 N LEU B 50 -6.025 11.668 3.576 1.00 0.38 N ATOM 2426 CA LEU B 50 -6.089 12.190 2.205 1.00 0.41 C ATOM 2427 C LEU B 50 -6.676 13.612 2.243 1.00 0.45 C ATOM 2428 O LEU B 50 -7.828 13.800 2.649 1.00 0.52 O ATOM 2429 CB LEU B 50 -6.932 11.271 1.281 1.00 0.44 C ATOM 2430 CG LEU B 50 -6.220 10.012 0.725 1.00 0.51 C ATOM 2431 CD1 LEU B 50 -7.212 9.117 -0.022 1.00 0.57 C ATOM 2432 CD2 LEU B 50 -5.045 10.390 -0.189 1.00 0.70 C ATOM 0 H LEU B 50 -6.821 11.087 3.841 1.00 0.38 H new ATOM 0 HA LEU B 50 -5.082 12.217 1.790 1.00 0.41 H new ATOM 0 HB2 LEU B 50 -7.814 10.948 1.833 1.00 0.44 H new ATOM 0 HB3 LEU B 50 -7.284 11.865 0.437 1.00 0.44 H new ATOM 0 HG LEU B 50 -5.819 9.457 1.573 1.00 0.51 H new ATOM 0 HD11 LEU B 50 -6.693 8.238 -0.405 1.00 0.57 H new ATOM 0 HD12 LEU B 50 -8.003 8.803 0.659 1.00 0.57 H new ATOM 0 HD13 LEU B 50 -7.648 9.671 -0.853 1.00 0.57 H new ATOM 0 HD21 LEU B 50 -4.568 9.484 -0.562 1.00 0.70 H new ATOM 0 HD22 LEU B 50 -5.413 10.979 -1.030 1.00 0.70 H new ATOM 0 HD23 LEU B 50 -4.320 10.976 0.375 1.00 0.70 H new ATOM 2444 N LYS B 51 -5.858 14.611 1.846 1.00 0.50 N ATOM 2445 CA LYS B 51 -6.268 16.038 1.837 1.00 0.58 C ATOM 2446 C LYS B 51 -7.556 16.292 1.019 1.00 0.53 C ATOM 2447 O LYS B 51 -8.365 17.144 1.400 1.00 0.61 O ATOM 2448 CB LYS B 51 -5.112 16.932 1.326 1.00 0.68 C ATOM 2449 CG LYS B 51 -4.649 16.629 -0.104 1.00 0.72 C ATOM 2450 CD LYS B 51 -3.521 17.556 -0.555 1.00 1.06 C ATOM 2451 CE LYS B 51 -3.158 17.355 -2.029 1.00 1.03 C ATOM 2452 NZ LYS B 51 -4.116 18.029 -2.954 1.00 1.23 N ATOM 0 H LYS B 51 -4.902 14.456 1.525 1.00 0.50 H new ATOM 0 HA LYS B 51 -6.498 16.303 2.869 1.00 0.58 H new ATOM 0 HB2 LYS B 51 -5.427 17.974 1.378 1.00 0.68 H new ATOM 0 HB3 LYS B 51 -4.262 16.822 1.999 1.00 0.68 H new ATOM 0 HG2 LYS B 51 -4.312 15.594 -0.163 1.00 0.72 H new ATOM 0 HG3 LYS B 51 -5.493 16.729 -0.786 1.00 0.72 H new ATOM 0 HD2 LYS B 51 -3.819 18.592 -0.395 1.00 1.06 H new ATOM 0 HD3 LYS B 51 -2.640 17.379 0.061 1.00 1.06 H new ATOM 0 HE2 LYS B 51 -2.154 17.740 -2.208 1.00 1.03 H new ATOM 0 HE3 LYS B 51 -3.134 16.288 -2.251 1.00 1.03 H new ATOM 0 HZ1 LYS B 51 -3.844 17.833 -3.939 1.00 1.23 H new ATOM 0 HZ2 LYS B 51 -5.076 17.669 -2.782 1.00 1.23 H new ATOM 0 HZ3 LYS B 51 -4.096 19.055 -2.787 1.00 1.23 H new ATOM 2466 N ASP B 52 -7.736 15.555 -0.101 1.00 0.48 N ATOM 2467 CA ASP B 52 -8.925 15.695 -0.959 1.00 0.54 C ATOM 2468 C ASP B 52 -9.923 14.552 -0.692 1.00 0.48 C ATOM 2469 O ASP B 52 -9.719 13.424 -1.152 1.00 0.60 O ATOM 2470 CB ASP B 52 -8.523 15.725 -2.454 1.00 0.69 C ATOM 2471 CG ASP B 52 -8.074 17.103 -2.919 1.00 1.20 C ATOM 2472 OD1 ASP B 52 -8.934 17.892 -3.368 1.00 1.94 O ATOM 2473 OD2 ASP B 52 -6.864 17.393 -2.834 1.00 1.78 O ATOM 0 H ASP B 52 -7.068 14.857 -0.428 1.00 0.48 H new ATOM 0 HA ASP B 52 -9.410 16.641 -0.716 1.00 0.54 H new ATOM 0 HB2 ASP B 52 -7.718 15.010 -2.623 1.00 0.69 H new ATOM 0 HB3 ASP B 52 -9.370 15.401 -3.059 1.00 0.69 H new ATOM 2478 N VAL B 53 -10.993 14.853 0.077 1.00 0.44 N ATOM 2479 CA VAL B 53 -12.045 13.860 0.401 1.00 0.45 C ATOM 2480 C VAL B 53 -13.153 13.848 -0.678 1.00 0.46 C ATOM 2481 O VAL B 53 -13.743 12.798 -0.947 1.00 0.57 O ATOM 2482 CB VAL B 53 -12.679 14.078 1.824 1.00 0.53 C ATOM 2483 CG1 VAL B 53 -11.656 13.779 2.924 1.00 0.60 C ATOM 2484 CG2 VAL B 53 -13.266 15.486 2.005 1.00 0.58 C ATOM 0 H VAL B 53 -11.152 15.774 0.485 1.00 0.44 H new ATOM 0 HA VAL B 53 -11.548 12.890 0.415 1.00 0.45 H new ATOM 0 HB VAL B 53 -13.509 13.376 1.907 1.00 0.53 H new ATOM 0 HG11 VAL B 53 -12.115 13.936 3.900 1.00 0.60 H new ATOM 0 HG12 VAL B 53 -11.325 12.744 2.841 1.00 0.60 H new ATOM 0 HG13 VAL B 53 -10.799 14.444 2.815 1.00 0.60 H new ATOM 0 HG21 VAL B 53 -13.689 15.578 3.005 1.00 0.58 H new ATOM 0 HG22 VAL B 53 -12.478 16.228 1.875 1.00 0.58 H new ATOM 0 HG23 VAL B 53 -14.048 15.652 1.264 1.00 0.58 H new ATOM 2494 N GLY B 54 -13.425 15.028 -1.283 1.00 0.44 N ATOM 2495 CA GLY B 54 -14.433 15.155 -2.339 1.00 0.51 C ATOM 2496 C GLY B 54 -13.859 14.913 -3.735 1.00 0.51 C ATOM 2497 O GLY B 54 -14.546 14.346 -4.592 1.00 0.67 O ATOM 0 H GLY B 54 -12.954 15.902 -1.051 1.00 0.44 H new ATOM 0 HA2 GLY B 54 -15.239 14.445 -2.154 1.00 0.51 H new ATOM 0 HA3 GLY B 54 -14.872 16.152 -2.299 1.00 0.51 H new ATOM 2501 N SER B 55 -12.597 15.344 -3.967 1.00 0.51 N ATOM 2502 CA SER B 55 -11.930 15.160 -5.267 1.00 0.57 C ATOM 2503 C SER B 55 -11.159 13.827 -5.294 1.00 0.52 C ATOM 2504 O SER B 55 -9.924 13.802 -5.199 1.00 0.63 O ATOM 2505 CB SER B 55 -10.996 16.348 -5.567 1.00 0.74 C ATOM 2506 OG SER B 55 -10.459 16.263 -6.879 1.00 0.92 O ATOM 0 H SER B 55 -12.025 15.820 -3.269 1.00 0.51 H new ATOM 0 HA SER B 55 -12.691 15.124 -6.047 1.00 0.57 H new ATOM 0 HB2 SER B 55 -11.546 17.283 -5.457 1.00 0.74 H new ATOM 0 HB3 SER B 55 -10.184 16.368 -4.840 1.00 0.74 H new ATOM 0 HG SER B 55 -9.872 17.030 -7.042 1.00 0.92 H new ATOM 2512 N LEU B 56 -11.912 12.715 -5.398 1.00 0.47 N ATOM 2513 CA LEU B 56 -11.333 11.356 -5.444 1.00 0.47 C ATOM 2514 C LEU B 56 -11.305 10.797 -6.891 1.00 0.48 C ATOM 2515 O LEU B 56 -10.732 9.725 -7.122 1.00 0.81 O ATOM 2516 CB LEU B 56 -12.123 10.402 -4.502 1.00 0.58 C ATOM 2517 CG LEU B 56 -11.293 9.559 -3.494 1.00 0.75 C ATOM 2518 CD1 LEU B 56 -10.204 8.731 -4.191 1.00 1.09 C ATOM 2519 CD2 LEU B 56 -10.689 10.442 -2.390 1.00 1.24 C ATOM 0 H LEU B 56 -12.930 12.731 -5.452 1.00 0.47 H new ATOM 0 HA LEU B 56 -10.302 11.419 -5.097 1.00 0.47 H new ATOM 0 HB2 LEU B 56 -12.837 11.000 -3.936 1.00 0.58 H new ATOM 0 HB3 LEU B 56 -12.701 9.716 -5.122 1.00 0.58 H new ATOM 0 HG LEU B 56 -11.984 8.857 -3.027 1.00 0.75 H new ATOM 0 HD11 LEU B 56 -9.650 8.159 -3.447 1.00 1.09 H new ATOM 0 HD12 LEU B 56 -10.666 8.048 -4.904 1.00 1.09 H new ATOM 0 HD13 LEU B 56 -9.521 9.398 -4.718 1.00 1.09 H new ATOM 0 HD21 LEU B 56 -10.115 9.822 -1.702 1.00 1.24 H new ATOM 0 HD22 LEU B 56 -10.034 11.188 -2.839 1.00 1.24 H new ATOM 0 HD23 LEU B 56 -11.490 10.943 -1.846 1.00 1.24 H new ATOM 2531 N ASP B 57 -11.918 11.522 -7.865 1.00 0.48 N ATOM 2532 CA ASP B 57 -11.941 11.091 -9.285 1.00 0.49 C ATOM 2533 C ASP B 57 -10.527 11.051 -9.911 1.00 0.44 C ATOM 2534 O ASP B 57 -10.292 10.286 -10.852 1.00 0.46 O ATOM 2535 CB ASP B 57 -12.880 11.987 -10.131 1.00 0.60 C ATOM 2536 CG ASP B 57 -12.456 13.452 -10.175 1.00 0.64 C ATOM 2537 OD1 ASP B 57 -12.884 14.222 -9.289 1.00 0.73 O ATOM 2538 OD2 ASP B 57 -11.698 13.823 -11.097 1.00 0.69 O ATOM 0 H ASP B 57 -12.400 12.404 -7.691 1.00 0.48 H new ATOM 0 HA ASP B 57 -12.332 10.073 -9.292 1.00 0.49 H new ATOM 0 HB2 ASP B 57 -12.918 11.599 -11.149 1.00 0.60 H new ATOM 0 HB3 ASP B 57 -13.890 11.922 -9.727 1.00 0.60 H new ATOM 2543 N GLU B 58 -9.597 11.891 -9.390 1.00 0.45 N ATOM 2544 CA GLU B 58 -8.197 11.936 -9.876 1.00 0.50 C ATOM 2545 C GLU B 58 -7.494 10.578 -9.658 1.00 0.47 C ATOM 2546 O GLU B 58 -6.765 10.110 -10.537 1.00 0.57 O ATOM 2547 CB GLU B 58 -7.415 13.066 -9.166 1.00 0.59 C ATOM 2548 CG GLU B 58 -6.051 13.379 -9.783 1.00 0.73 C ATOM 2549 CD GLU B 58 -5.288 14.453 -9.022 1.00 0.92 C ATOM 2550 OE1 GLU B 58 -4.529 14.099 -8.093 1.00 1.06 O ATOM 2551 OE2 GLU B 58 -5.448 15.645 -9.355 1.00 1.10 O ATOM 0 H GLU B 58 -9.793 12.546 -8.633 1.00 0.45 H new ATOM 0 HA GLU B 58 -8.216 12.142 -10.946 1.00 0.50 H new ATOM 0 HB2 GLU B 58 -8.021 13.972 -9.177 1.00 0.59 H new ATOM 0 HB3 GLU B 58 -7.272 12.791 -8.121 1.00 0.59 H new ATOM 0 HG2 GLU B 58 -5.454 12.468 -9.812 1.00 0.73 H new ATOM 0 HG3 GLU B 58 -6.190 13.702 -10.815 1.00 0.73 H new ATOM 2558 N LYS B 59 -7.720 9.959 -8.479 1.00 0.43 N ATOM 2559 CA LYS B 59 -7.125 8.650 -8.145 1.00 0.48 C ATOM 2560 C LYS B 59 -8.024 7.483 -8.605 1.00 0.54 C ATOM 2561 O LYS B 59 -7.515 6.390 -8.853 1.00 0.91 O ATOM 2562 CB LYS B 59 -6.858 8.533 -6.627 1.00 0.52 C ATOM 2563 CG LYS B 59 -5.587 9.243 -6.143 1.00 0.59 C ATOM 2564 CD LYS B 59 -5.791 10.745 -5.920 1.00 0.79 C ATOM 2565 CE LYS B 59 -4.482 11.448 -5.565 1.00 1.19 C ATOM 2566 NZ LYS B 59 -4.685 12.896 -5.266 1.00 1.47 N ATOM 0 H LYS B 59 -8.311 10.346 -7.743 1.00 0.43 H new ATOM 0 HA LYS B 59 -6.177 8.586 -8.679 1.00 0.48 H new ATOM 0 HB2 LYS B 59 -7.713 8.942 -6.089 1.00 0.52 H new ATOM 0 HB3 LYS B 59 -6.791 7.477 -6.364 1.00 0.52 H new ATOM 0 HG2 LYS B 59 -5.253 8.785 -5.212 1.00 0.59 H new ATOM 0 HG3 LYS B 59 -4.793 9.094 -6.875 1.00 0.59 H new ATOM 0 HD2 LYS B 59 -6.211 11.193 -6.821 1.00 0.79 H new ATOM 0 HD3 LYS B 59 -6.515 10.899 -5.120 1.00 0.79 H new ATOM 0 HE2 LYS B 59 -4.032 10.960 -4.701 1.00 1.19 H new ATOM 0 HE3 LYS B 59 -3.779 11.344 -6.392 1.00 1.19 H new ATOM 0 HZ1 LYS B 59 -3.940 13.225 -4.619 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -4.642 13.442 -6.150 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -5.615 13.031 -4.820 1.00 1.47 H new ATOM 2580 N MET B 60 -9.357 7.716 -8.719 1.00 0.40 N ATOM 2581 CA MET B 60 -10.314 6.668 -9.147 1.00 0.43 C ATOM 2582 C MET B 60 -9.996 6.132 -10.560 1.00 0.45 C ATOM 2583 O MET B 60 -10.122 4.929 -10.799 1.00 0.49 O ATOM 2584 CB MET B 60 -11.768 7.186 -9.082 1.00 0.47 C ATOM 2585 CG MET B 60 -12.828 6.086 -9.214 1.00 0.55 C ATOM 2586 SD MET B 60 -14.513 6.669 -8.913 1.00 0.67 S ATOM 2587 CE MET B 60 -14.817 7.661 -10.375 1.00 0.81 C ATOM 0 H MET B 60 -9.790 8.618 -8.521 1.00 0.40 H new ATOM 0 HA MET B 60 -10.207 5.838 -8.449 1.00 0.43 H new ATOM 0 HB2 MET B 60 -11.915 7.707 -8.136 1.00 0.47 H new ATOM 0 HB3 MET B 60 -11.918 7.918 -9.876 1.00 0.47 H new ATOM 0 HG2 MET B 60 -12.773 5.658 -10.215 1.00 0.55 H new ATOM 0 HG3 MET B 60 -12.598 5.285 -8.512 1.00 0.55 H new ATOM 0 HE1 MET B 60 -15.844 8.026 -10.360 1.00 0.81 H new ATOM 0 HE2 MET B 60 -14.131 8.508 -10.389 1.00 0.81 H new ATOM 0 HE3 MET B 60 -14.661 7.053 -11.266 1.00 0.81 H new ATOM 2597 N LYS B 61 -9.592 7.025 -11.496 1.00 0.47 N ATOM 2598 CA LYS B 61 -9.233 6.603 -12.871 1.00 0.53 C ATOM 2599 C LYS B 61 -7.926 5.788 -12.862 1.00 0.48 C ATOM 2600 O LYS B 61 -7.770 4.864 -13.662 1.00 0.52 O ATOM 2601 CB LYS B 61 -9.119 7.813 -13.827 1.00 0.63 C ATOM 2602 CG LYS B 61 -10.469 8.405 -14.275 1.00 0.78 C ATOM 2603 CD LYS B 61 -11.283 7.479 -15.201 1.00 1.13 C ATOM 2604 CE LYS B 61 -10.639 7.267 -16.578 1.00 1.87 C ATOM 2605 NZ LYS B 61 -10.692 8.487 -17.442 1.00 2.39 N ATOM 0 H LYS B 61 -9.507 8.027 -11.327 1.00 0.47 H new ATOM 0 HA LYS B 61 -10.036 5.967 -13.243 1.00 0.53 H new ATOM 0 HB2 LYS B 61 -8.540 8.595 -13.335 1.00 0.63 H new ATOM 0 HB3 LYS B 61 -8.559 7.509 -14.711 1.00 0.63 H new ATOM 0 HG2 LYS B 61 -11.065 8.634 -13.391 1.00 0.78 H new ATOM 0 HG3 LYS B 61 -10.288 9.348 -14.790 1.00 0.78 H new ATOM 0 HD2 LYS B 61 -11.408 6.511 -14.715 1.00 1.13 H new ATOM 0 HD3 LYS B 61 -12.280 7.899 -15.336 1.00 1.13 H new ATOM 0 HE2 LYS B 61 -9.599 6.968 -16.445 1.00 1.87 H new ATOM 0 HE3 LYS B 61 -11.144 6.446 -17.087 1.00 1.87 H new ATOM 0 HZ1 LYS B 61 -10.243 8.284 -18.358 1.00 2.39 H new ATOM 0 HZ2 LYS B 61 -11.683 8.761 -17.596 1.00 2.39 H new ATOM 0 HZ3 LYS B 61 -10.187 9.266 -16.974 1.00 2.39 H new ATOM 2619 N SER B 62 -6.988 6.143 -11.950 1.00 0.46 N ATOM 2620 CA SER B 62 -5.720 5.408 -11.795 1.00 0.47 C ATOM 2621 C SER B 62 -5.985 4.032 -11.151 1.00 0.44 C ATOM 2622 O SER B 62 -5.357 3.039 -11.531 1.00 0.50 O ATOM 2623 CB SER B 62 -4.725 6.209 -10.937 1.00 0.54 C ATOM 2624 OG SER B 62 -4.382 7.438 -11.560 1.00 0.63 O ATOM 0 H SER B 62 -7.091 6.934 -11.314 1.00 0.46 H new ATOM 0 HA SER B 62 -5.282 5.264 -12.783 1.00 0.47 H new ATOM 0 HB2 SER B 62 -5.161 6.404 -9.957 1.00 0.54 H new ATOM 0 HB3 SER B 62 -3.824 5.618 -10.773 1.00 0.54 H new ATOM 0 HG SER B 62 -3.750 7.927 -10.993 1.00 0.63 H new ATOM 2630 N LEU B 63 -6.934 3.989 -10.183 1.00 0.41 N ATOM 2631 CA LEU B 63 -7.314 2.744 -9.483 1.00 0.44 C ATOM 2632 C LEU B 63 -8.031 1.768 -10.434 1.00 0.47 C ATOM 2633 O LEU B 63 -7.709 0.577 -10.451 1.00 0.57 O ATOM 2634 CB LEU B 63 -8.213 3.054 -8.260 1.00 0.45 C ATOM 2635 CG LEU B 63 -7.521 3.788 -7.088 1.00 0.42 C ATOM 2636 CD1 LEU B 63 -8.540 4.532 -6.215 1.00 0.47 C ATOM 2637 CD2 LEU B 63 -6.708 2.810 -6.240 1.00 0.69 C ATOM 0 H LEU B 63 -7.451 4.811 -9.870 1.00 0.41 H new ATOM 0 HA LEU B 63 -6.398 2.269 -9.132 1.00 0.44 H new ATOM 0 HB2 LEU B 63 -9.056 3.658 -8.596 1.00 0.45 H new ATOM 0 HB3 LEU B 63 -8.622 2.116 -7.886 1.00 0.45 H new ATOM 0 HG LEU B 63 -6.842 4.525 -7.516 1.00 0.42 H new ATOM 0 HD11 LEU B 63 -8.021 5.037 -5.400 1.00 0.47 H new ATOM 0 HD12 LEU B 63 -9.069 5.268 -6.820 1.00 0.47 H new ATOM 0 HD13 LEU B 63 -9.255 3.820 -5.803 1.00 0.47 H new ATOM 0 HD21 LEU B 63 -6.230 3.348 -5.422 1.00 0.69 H new ATOM 0 HD22 LEU B 63 -7.369 2.044 -5.834 1.00 0.69 H new ATOM 0 HD23 LEU B 63 -5.945 2.339 -6.859 1.00 0.69 H new ATOM 2649 N ASP B 64 -9.002 2.278 -11.222 1.00 0.47 N ATOM 2650 CA ASP B 64 -9.751 1.454 -12.188 1.00 0.55 C ATOM 2651 C ASP B 64 -9.015 1.411 -13.542 1.00 0.53 C ATOM 2652 O ASP B 64 -9.441 2.046 -14.517 1.00 0.60 O ATOM 2653 CB ASP B 64 -11.193 1.984 -12.370 1.00 0.66 C ATOM 2654 CG ASP B 64 -12.112 1.632 -11.212 1.00 0.85 C ATOM 2655 OD1 ASP B 64 -12.519 0.455 -11.114 1.00 1.32 O ATOM 2656 OD2 ASP B 64 -12.426 2.535 -10.408 1.00 1.27 O ATOM 0 H ASP B 64 -9.284 3.258 -11.206 1.00 0.47 H new ATOM 0 HA ASP B 64 -9.813 0.440 -11.793 1.00 0.55 H new ATOM 0 HB2 ASP B 64 -11.163 3.068 -12.485 1.00 0.66 H new ATOM 0 HB3 ASP B 64 -11.609 1.577 -13.292 1.00 0.66 H new ATOM 2661 N VAL B 65 -7.889 0.669 -13.584 1.00 0.53 N ATOM 2662 CA VAL B 65 -7.086 0.517 -14.814 1.00 0.56 C ATOM 2663 C VAL B 65 -7.639 -0.633 -15.694 1.00 0.56 C ATOM 2664 O VAL B 65 -7.592 -0.552 -16.926 1.00 0.61 O ATOM 2665 CB VAL B 65 -5.565 0.304 -14.490 1.00 0.64 C ATOM 2666 CG1 VAL B 65 -5.290 -1.024 -13.771 1.00 0.68 C ATOM 2667 CG2 VAL B 65 -4.707 0.437 -15.754 1.00 0.72 C ATOM 0 H VAL B 65 -7.516 0.166 -12.779 1.00 0.53 H new ATOM 0 HA VAL B 65 -7.168 1.445 -15.379 1.00 0.56 H new ATOM 0 HB VAL B 65 -5.281 1.096 -13.797 1.00 0.64 H new ATOM 0 HG11 VAL B 65 -4.222 -1.116 -13.573 1.00 0.68 H new ATOM 0 HG12 VAL B 65 -5.837 -1.048 -12.829 1.00 0.68 H new ATOM 0 HG13 VAL B 65 -5.615 -1.853 -14.400 1.00 0.68 H new ATOM 0 HG21 VAL B 65 -3.658 0.285 -15.499 1.00 0.72 H new ATOM 0 HG22 VAL B 65 -5.016 -0.312 -16.484 1.00 0.72 H new ATOM 0 HG23 VAL B 65 -4.836 1.433 -16.179 1.00 0.72 H new ATOM 2677 N ASN B 66 -8.149 -1.703 -15.043 1.00 0.56 N ATOM 2678 CA ASN B 66 -8.740 -2.866 -15.740 1.00 0.60 C ATOM 2679 C ASN B 66 -10.193 -2.566 -16.174 1.00 0.61 C ATOM 2680 O ASN B 66 -10.654 -3.076 -17.199 1.00 0.68 O ATOM 2681 CB ASN B 66 -8.707 -4.110 -14.814 1.00 0.65 C ATOM 2682 CG ASN B 66 -8.685 -5.438 -15.568 1.00 0.90 C ATOM 2683 OD1 ASN B 66 -7.616 -5.995 -15.819 1.00 1.38 O ATOM 2684 ND2 ASN B 66 -9.859 -5.964 -15.928 1.00 1.32 N ATOM 0 H ASN B 66 -8.162 -1.784 -14.026 1.00 0.56 H new ATOM 0 HA ASN B 66 -8.151 -3.069 -16.634 1.00 0.60 H new ATOM 0 HB2 ASN B 66 -7.827 -4.052 -14.174 1.00 0.65 H new ATOM 0 HB3 ASN B 66 -9.579 -4.088 -14.160 1.00 0.65 H new ATOM 0 HD21 ASN B 66 -9.888 -6.853 -16.427 1.00 1.32 H new ATOM 0 HD22 ASN B 66 -10.726 -5.476 -15.704 1.00 1.32 H new ATOM 2691 N GLN B 67 -10.906 -1.724 -15.379 1.00 0.59 N ATOM 2692 CA GLN B 67 -12.311 -1.337 -15.632 1.00 0.64 C ATOM 2693 C GLN B 67 -13.248 -2.562 -15.644 1.00 0.64 C ATOM 2694 O GLN B 67 -13.616 -3.075 -16.711 1.00 0.77 O ATOM 2695 CB GLN B 67 -12.472 -0.496 -16.932 1.00 0.75 C ATOM 2696 CG GLN B 67 -12.636 1.006 -16.690 1.00 0.96 C ATOM 2697 CD GLN B 67 -13.183 1.749 -17.905 1.00 1.28 C ATOM 2698 OE1 GLN B 67 -14.397 1.858 -18.079 1.00 2.02 O ATOM 2699 NE2 GLN B 67 -12.297 2.269 -18.755 1.00 1.87 N ATOM 0 H GLN B 67 -10.515 -1.295 -14.540 1.00 0.59 H new ATOM 0 HA GLN B 67 -12.607 -0.698 -14.800 1.00 0.64 H new ATOM 0 HB2 GLN B 67 -11.600 -0.658 -17.566 1.00 0.75 H new ATOM 0 HB3 GLN B 67 -13.339 -0.861 -17.483 1.00 0.75 H new ATOM 0 HG2 GLN B 67 -13.306 1.161 -15.844 1.00 0.96 H new ATOM 0 HG3 GLN B 67 -11.671 1.432 -16.415 1.00 0.96 H new ATOM 0 HE21 GLN B 67 -11.298 2.160 -18.580 1.00 1.87 H new ATOM 0 HE22 GLN B 67 -12.618 2.776 -19.580 1.00 1.87 H new ATOM 2708 N ASP B 68 -13.603 -3.035 -14.438 1.00 0.65 N ATOM 2709 CA ASP B 68 -14.506 -4.187 -14.268 1.00 0.72 C ATOM 2710 C ASP B 68 -15.376 -4.024 -12.994 1.00 0.79 C ATOM 2711 O ASP B 68 -15.713 -5.018 -12.338 1.00 1.30 O ATOM 2712 CB ASP B 68 -13.673 -5.489 -14.222 1.00 0.76 C ATOM 2713 CG ASP B 68 -14.503 -6.741 -14.474 1.00 0.97 C ATOM 2714 OD1 ASP B 68 -14.836 -7.005 -15.650 1.00 1.16 O ATOM 2715 OD2 ASP B 68 -14.817 -7.455 -13.499 1.00 1.25 O ATOM 0 H ASP B 68 -13.276 -2.634 -13.559 1.00 0.65 H new ATOM 0 HA ASP B 68 -15.188 -4.239 -15.117 1.00 0.72 H new ATOM 0 HB2 ASP B 68 -12.879 -5.431 -14.967 1.00 0.76 H new ATOM 0 HB3 ASP B 68 -13.191 -5.570 -13.248 1.00 0.76 H new ATOM 2720 N SER B 69 -15.751 -2.756 -12.664 1.00 0.66 N ATOM 2721 CA SER B 69 -16.581 -2.404 -11.481 1.00 0.71 C ATOM 2722 C SER B 69 -15.836 -2.635 -10.145 1.00 0.71 C ATOM 2723 O SER B 69 -15.668 -1.693 -9.366 1.00 1.26 O ATOM 2724 CB SER B 69 -17.942 -3.135 -11.495 1.00 0.86 C ATOM 2725 OG SER B 69 -18.727 -2.723 -12.604 1.00 1.35 O ATOM 0 H SER B 69 -15.482 -1.944 -13.219 1.00 0.66 H new ATOM 0 HA SER B 69 -16.779 -1.335 -11.555 1.00 0.71 H new ATOM 0 HB2 SER B 69 -17.780 -4.212 -11.539 1.00 0.86 H new ATOM 0 HB3 SER B 69 -18.479 -2.931 -10.569 1.00 0.86 H new ATOM 0 HG SER B 69 -19.583 -3.200 -12.594 1.00 1.35 H new ATOM 2731 N GLU B 70 -15.409 -3.888 -9.875 1.00 0.69 N ATOM 2732 CA GLU B 70 -14.660 -4.230 -8.648 1.00 0.75 C ATOM 2733 C GLU B 70 -13.214 -3.707 -8.725 1.00 0.62 C ATOM 2734 O GLU B 70 -12.691 -3.479 -9.821 1.00 0.78 O ATOM 2735 CB GLU B 70 -14.637 -5.760 -8.419 1.00 1.11 C ATOM 2736 CG GLU B 70 -15.966 -6.365 -7.958 1.00 1.39 C ATOM 2737 CD GLU B 70 -16.982 -6.540 -9.078 1.00 1.87 C ATOM 2738 OE1 GLU B 70 -16.637 -7.174 -10.098 1.00 2.40 O ATOM 2739 OE2 GLU B 70 -18.123 -6.055 -8.928 1.00 2.37 O ATOM 0 H GLU B 70 -15.572 -4.682 -10.494 1.00 0.69 H new ATOM 0 HA GLU B 70 -15.171 -3.753 -7.812 1.00 0.75 H new ATOM 0 HB2 GLU B 70 -14.336 -6.247 -9.347 1.00 1.11 H new ATOM 0 HB3 GLU B 70 -13.873 -5.990 -7.676 1.00 1.11 H new ATOM 0 HG2 GLU B 70 -15.773 -7.335 -7.500 1.00 1.39 H new ATOM 0 HG3 GLU B 70 -16.396 -5.727 -7.186 1.00 1.39 H new ATOM 2746 N LEU B 71 -12.575 -3.522 -7.554 1.00 0.54 N ATOM 2747 CA LEU B 71 -11.189 -3.036 -7.481 1.00 0.51 C ATOM 2748 C LEU B 71 -10.346 -3.962 -6.587 1.00 0.50 C ATOM 2749 O LEU B 71 -10.416 -3.878 -5.356 1.00 0.52 O ATOM 2750 CB LEU B 71 -11.137 -1.584 -6.952 1.00 0.58 C ATOM 2751 CG LEU B 71 -11.812 -0.502 -7.842 1.00 0.78 C ATOM 2752 CD1 LEU B 71 -13.294 -0.318 -7.485 1.00 1.13 C ATOM 2753 CD2 LEU B 71 -11.065 0.829 -7.732 1.00 0.92 C ATOM 0 H LEU B 71 -13.000 -3.703 -6.645 1.00 0.54 H new ATOM 0 HA LEU B 71 -10.773 -3.044 -8.488 1.00 0.51 H new ATOM 0 HB2 LEU B 71 -11.608 -1.561 -5.969 1.00 0.58 H new ATOM 0 HB3 LEU B 71 -10.092 -1.308 -6.812 1.00 0.58 H new ATOM 0 HG LEU B 71 -11.761 -0.848 -8.874 1.00 0.78 H new ATOM 0 HD11 LEU B 71 -13.731 0.446 -8.128 1.00 1.13 H new ATOM 0 HD12 LEU B 71 -13.823 -1.260 -7.630 1.00 1.13 H new ATOM 0 HD13 LEU B 71 -13.382 -0.009 -6.443 1.00 1.13 H new ATOM 0 HD21 LEU B 71 -11.553 1.573 -8.362 1.00 0.92 H new ATOM 0 HD22 LEU B 71 -11.076 1.168 -6.696 1.00 0.92 H new ATOM 0 HD23 LEU B 71 -10.034 0.696 -8.060 1.00 0.92 H new ATOM 2765 N LYS B 72 -9.562 -4.865 -7.215 1.00 0.52 N ATOM 2766 CA LYS B 72 -8.691 -5.815 -6.482 1.00 0.54 C ATOM 2767 C LYS B 72 -7.586 -5.053 -5.726 1.00 0.48 C ATOM 2768 O LYS B 72 -7.341 -3.887 -6.031 1.00 0.46 O ATOM 2769 CB LYS B 72 -8.072 -6.829 -7.472 1.00 0.60 C ATOM 2770 CG LYS B 72 -7.627 -8.155 -6.852 1.00 0.78 C ATOM 2771 CD LYS B 72 -7.160 -9.144 -7.925 1.00 0.91 C ATOM 2772 CE LYS B 72 -6.833 -10.527 -7.362 1.00 1.29 C ATOM 2773 NZ LYS B 72 -8.036 -11.235 -6.827 1.00 1.81 N ATOM 0 H LYS B 72 -9.513 -4.957 -8.230 1.00 0.52 H new ATOM 0 HA LYS B 72 -9.292 -6.358 -5.753 1.00 0.54 H new ATOM 0 HB2 LYS B 72 -8.800 -7.039 -8.255 1.00 0.60 H new ATOM 0 HB3 LYS B 72 -7.211 -6.364 -7.953 1.00 0.60 H new ATOM 0 HG2 LYS B 72 -6.818 -7.974 -6.144 1.00 0.78 H new ATOM 0 HG3 LYS B 72 -8.452 -8.590 -6.288 1.00 0.78 H new ATOM 0 HD2 LYS B 72 -7.936 -9.241 -8.684 1.00 0.91 H new ATOM 0 HD3 LYS B 72 -6.277 -8.742 -8.422 1.00 0.91 H new ATOM 0 HE2 LYS B 72 -6.378 -11.134 -8.144 1.00 1.29 H new ATOM 0 HE3 LYS B 72 -6.094 -10.425 -6.567 1.00 1.29 H new ATOM 0 HZ1 LYS B 72 -7.779 -12.209 -6.568 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 -8.388 -10.735 -5.986 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 -8.779 -11.255 -7.554 1.00 1.81 H new ATOM 2787 N PHE B 73 -6.926 -5.698 -4.739 1.00 0.51 N ATOM 2788 CA PHE B 73 -5.843 -5.034 -3.973 1.00 0.49 C ATOM 2789 C PHE B 73 -4.656 -4.651 -4.894 1.00 0.46 C ATOM 2790 O PHE B 73 -3.942 -3.686 -4.607 1.00 0.46 O ATOM 2791 CB PHE B 73 -5.372 -5.902 -2.782 1.00 0.55 C ATOM 2792 CG PHE B 73 -5.099 -5.109 -1.516 1.00 0.69 C ATOM 2793 CD1 PHE B 73 -3.895 -4.436 -1.333 1.00 0.89 C ATOM 2794 CD2 PHE B 73 -6.055 -5.035 -0.504 1.00 0.90 C ATOM 2795 CE1 PHE B 73 -3.653 -3.717 -0.177 1.00 1.14 C ATOM 2796 CE2 PHE B 73 -5.814 -4.318 0.649 1.00 1.15 C ATOM 2797 CZ PHE B 73 -4.612 -3.659 0.814 1.00 1.23 C ATOM 0 H PHE B 73 -7.117 -6.659 -4.456 1.00 0.51 H new ATOM 0 HA PHE B 73 -6.254 -4.113 -3.561 1.00 0.49 H new ATOM 0 HB2 PHE B 73 -6.131 -6.655 -2.571 1.00 0.55 H new ATOM 0 HB3 PHE B 73 -4.465 -6.434 -3.069 1.00 0.55 H new ATOM 0 HD1 PHE B 73 -3.140 -4.476 -2.104 1.00 0.89 H new ATOM 0 HD2 PHE B 73 -6.998 -5.547 -0.625 1.00 0.90 H new ATOM 0 HE1 PHE B 73 -2.713 -3.201 -0.049 1.00 1.14 H new ATOM 0 HE2 PHE B 73 -6.566 -4.272 1.423 1.00 1.15 H new ATOM 0 HZ PHE B 73 -4.422 -3.099 1.718 1.00 1.23 H new ATOM 2807 N ASN B 74 -4.458 -5.412 -6.000 1.00 0.47 N ATOM 2808 CA ASN B 74 -3.400 -5.112 -6.990 1.00 0.50 C ATOM 2809 C ASN B 74 -3.750 -3.811 -7.753 1.00 0.48 C ATOM 2810 O ASN B 74 -2.857 -3.028 -8.076 1.00 0.54 O ATOM 2811 CB ASN B 74 -3.221 -6.286 -7.980 1.00 0.55 C ATOM 2812 CG ASN B 74 -2.018 -6.114 -8.912 1.00 0.63 C ATOM 2813 OD1 ASN B 74 -2.057 -5.309 -9.843 1.00 0.99 O ATOM 2814 ND2 ASN B 74 -0.951 -6.882 -8.685 1.00 0.93 N ATOM 0 H ASN B 74 -5.017 -6.235 -6.226 1.00 0.47 H new ATOM 0 HA ASN B 74 -2.458 -4.973 -6.460 1.00 0.50 H new ATOM 0 HB2 ASN B 74 -3.106 -7.212 -7.417 1.00 0.55 H new ATOM 0 HB3 ASN B 74 -4.125 -6.387 -8.580 1.00 0.55 H new ATOM 0 HD21 ASN B 74 -0.134 -6.813 -9.292 1.00 0.93 H new ATOM 0 HD22 ASN B 74 -0.952 -7.539 -7.904 1.00 0.93 H new ATOM 2821 N GLU B 75 -5.056 -3.605 -8.042 1.00 0.44 N ATOM 2822 CA GLU B 75 -5.544 -2.392 -8.735 1.00 0.47 C ATOM 2823 C GLU B 75 -5.782 -1.246 -7.727 1.00 0.41 C ATOM 2824 O GLU B 75 -5.672 -0.070 -8.089 1.00 0.42 O ATOM 2825 CB GLU B 75 -6.846 -2.692 -9.520 1.00 0.54 C ATOM 2826 CG GLU B 75 -6.648 -3.453 -10.836 1.00 0.64 C ATOM 2827 CD GLU B 75 -6.188 -4.891 -10.648 1.00 0.76 C ATOM 2828 OE1 GLU B 75 -7.055 -5.777 -10.490 1.00 0.91 O ATOM 2829 OE2 GLU B 75 -4.962 -5.128 -10.663 1.00 0.93 O ATOM 0 H GLU B 75 -5.794 -4.268 -7.804 1.00 0.44 H new ATOM 0 HA GLU B 75 -4.777 -2.079 -9.444 1.00 0.47 H new ATOM 0 HB2 GLU B 75 -7.513 -3.270 -8.880 1.00 0.54 H new ATOM 0 HB3 GLU B 75 -7.348 -1.749 -9.735 1.00 0.54 H new ATOM 0 HG2 GLU B 75 -7.586 -3.451 -11.391 1.00 0.64 H new ATOM 0 HG3 GLU B 75 -5.916 -2.923 -11.445 1.00 0.64 H new ATOM 2836 N TYR B 76 -6.112 -1.602 -6.460 1.00 0.41 N ATOM 2837 CA TYR B 76 -6.343 -0.626 -5.379 1.00 0.39 C ATOM 2838 C TYR B 76 -5.003 -0.143 -4.754 1.00 0.36 C ATOM 2839 O TYR B 76 -5.005 0.770 -3.923 1.00 0.43 O ATOM 2840 CB TYR B 76 -7.265 -1.246 -4.296 1.00 0.43 C ATOM 2841 CG TYR B 76 -7.766 -0.274 -3.225 1.00 0.44 C ATOM 2842 CD1 TYR B 76 -8.664 0.750 -3.536 1.00 0.50 C ATOM 2843 CD2 TYR B 76 -7.345 -0.386 -1.901 1.00 0.52 C ATOM 2844 CE1 TYR B 76 -9.115 1.626 -2.564 1.00 0.58 C ATOM 2845 CE2 TYR B 76 -7.796 0.488 -0.930 1.00 0.59 C ATOM 2846 CZ TYR B 76 -8.676 1.490 -1.264 1.00 0.59 C ATOM 2847 OH TYR B 76 -9.121 2.357 -0.290 1.00 0.71 O ATOM 0 H TYR B 76 -6.224 -2.572 -6.165 1.00 0.41 H new ATOM 0 HA TYR B 76 -6.836 0.248 -5.806 1.00 0.39 H new ATOM 0 HB2 TYR B 76 -8.128 -1.692 -4.790 1.00 0.43 H new ATOM 0 HB3 TYR B 76 -6.726 -2.056 -3.804 1.00 0.43 H new ATOM 0 HD1 TYR B 76 -9.012 0.860 -4.552 1.00 0.50 H new ATOM 0 HD2 TYR B 76 -6.654 -1.170 -1.629 1.00 0.52 H new ATOM 0 HE1 TYR B 76 -9.808 2.413 -2.823 1.00 0.58 H new ATOM 0 HE2 TYR B 76 -7.457 0.384 0.090 1.00 0.59 H new ATOM 0 HH TYR B 76 -8.715 2.120 0.570 1.00 0.71 H new ATOM 2857 N TRP B 77 -3.861 -0.752 -5.174 1.00 0.39 N ATOM 2858 CA TRP B 77 -2.510 -0.386 -4.677 1.00 0.40 C ATOM 2859 C TRP B 77 -2.134 1.087 -5.003 1.00 0.35 C ATOM 2860 O TRP B 77 -1.232 1.643 -4.366 1.00 0.37 O ATOM 2861 CB TRP B 77 -1.460 -1.413 -5.224 1.00 0.58 C ATOM 2862 CG TRP B 77 -0.183 -0.847 -5.824 1.00 0.48 C ATOM 2863 CD1 TRP B 77 0.960 -0.513 -5.155 1.00 0.56 C ATOM 2864 CD2 TRP B 77 0.072 -0.566 -7.211 1.00 0.74 C ATOM 2865 NE1 TRP B 77 1.902 -0.047 -6.039 1.00 0.79 N ATOM 2866 CE2 TRP B 77 1.386 -0.068 -7.302 1.00 0.94 C ATOM 2867 CE3 TRP B 77 -0.676 -0.688 -8.384 1.00 0.98 C ATOM 2868 CZ2 TRP B 77 1.962 0.310 -8.511 1.00 1.34 C ATOM 2869 CZ3 TRP B 77 -0.104 -0.315 -9.586 1.00 1.37 C ATOM 2870 CH2 TRP B 77 1.206 0.179 -9.640 1.00 1.54 C ATOM 0 H TRP B 77 -3.853 -1.505 -5.862 1.00 0.39 H new ATOM 0 HA TRP B 77 -2.513 -0.442 -3.588 1.00 0.40 H new ATOM 0 HB2 TRP B 77 -1.183 -2.080 -4.408 1.00 0.58 H new ATOM 0 HB3 TRP B 77 -1.948 -2.024 -5.983 1.00 0.58 H new ATOM 0 HD1 TRP B 77 1.102 -0.602 -4.088 1.00 0.56 H new ATOM 0 HE1 TRP B 77 2.840 0.266 -5.790 1.00 0.79 H new ATOM 0 HE3 TRP B 77 -1.686 -1.068 -8.353 1.00 0.98 H new ATOM 0 HZ2 TRP B 77 2.971 0.693 -8.555 1.00 1.34 H new ATOM 0 HZ3 TRP B 77 -0.676 -0.406 -10.498 1.00 1.37 H new ATOM 0 HH2 TRP B 77 1.626 0.462 -10.594 1.00 1.54 H new ATOM 2881 N ARG B 78 -2.826 1.709 -5.987 1.00 0.37 N ATOM 2882 CA ARG B 78 -2.566 3.113 -6.371 1.00 0.41 C ATOM 2883 C ARG B 78 -2.930 4.092 -5.231 1.00 0.38 C ATOM 2884 O ARG B 78 -2.318 5.160 -5.126 1.00 0.45 O ATOM 2885 CB ARG B 78 -3.331 3.498 -7.663 1.00 0.49 C ATOM 2886 CG ARG B 78 -3.059 2.594 -8.876 1.00 0.68 C ATOM 2887 CD ARG B 78 -1.667 2.797 -9.482 1.00 0.88 C ATOM 2888 NE ARG B 78 -1.538 4.086 -10.186 1.00 1.17 N ATOM 2889 CZ ARG B 78 -1.536 4.261 -11.531 1.00 1.72 C ATOM 2890 NH1 ARG B 78 -1.687 3.238 -12.388 1.00 2.14 N ATOM 2891 NH2 ARG B 78 -1.386 5.493 -12.020 1.00 2.15 N ATOM 0 H ARG B 78 -3.566 1.260 -6.527 1.00 0.37 H new ATOM 0 HA ARG B 78 -1.496 3.193 -6.564 1.00 0.41 H new ATOM 0 HB2 ARG B 78 -4.400 3.484 -7.451 1.00 0.49 H new ATOM 0 HB3 ARG B 78 -3.072 4.523 -7.928 1.00 0.49 H new ATOM 0 HG2 ARG B 78 -3.169 1.552 -8.576 1.00 0.68 H new ATOM 0 HG3 ARG B 78 -3.812 2.786 -9.640 1.00 0.68 H new ATOM 0 HD2 ARG B 78 -0.919 2.743 -8.691 1.00 0.88 H new ATOM 0 HD3 ARG B 78 -1.455 1.985 -10.177 1.00 0.88 H new ATOM 0 HE ARG B 78 -1.442 4.922 -9.609 1.00 1.17 H new ATOM 0 HH11 ARG B 78 -1.809 2.289 -12.033 1.00 2.14 H new ATOM 0 HH12 ARG B 78 -1.680 3.410 -13.393 1.00 2.14 H new ATOM 0 HH21 ARG B 78 -1.275 6.284 -11.385 1.00 2.15 H new ATOM 0 HH22 ARG B 78 -1.382 5.644 -13.029 1.00 2.15 H new ATOM 2905 N LEU B 79 -3.923 3.727 -4.382 1.00 0.33 N ATOM 2906 CA LEU B 79 -4.339 4.574 -3.250 1.00 0.34 C ATOM 2907 C LEU B 79 -3.568 4.190 -1.980 1.00 0.32 C ATOM 2908 O LEU B 79 -3.210 5.072 -1.199 1.00 0.36 O ATOM 2909 CB LEU B 79 -5.869 4.495 -3.009 1.00 0.36 C ATOM 2910 CG LEU B 79 -6.512 5.722 -2.307 1.00 0.41 C ATOM 2911 CD1 LEU B 79 -6.544 6.940 -3.241 1.00 0.49 C ATOM 2912 CD2 LEU B 79 -7.924 5.389 -1.812 1.00 0.48 C ATOM 0 H LEU B 79 -4.445 2.855 -4.464 1.00 0.33 H new ATOM 0 HA LEU B 79 -4.101 5.607 -3.503 1.00 0.34 H new ATOM 0 HB2 LEU B 79 -6.361 4.353 -3.971 1.00 0.36 H new ATOM 0 HB3 LEU B 79 -6.077 3.608 -2.410 1.00 0.36 H new ATOM 0 HG LEU B 79 -5.894 5.972 -1.444 1.00 0.41 H new ATOM 0 HD11 LEU B 79 -6.999 7.784 -2.723 1.00 0.49 H new ATOM 0 HD12 LEU B 79 -5.527 7.200 -3.534 1.00 0.49 H new ATOM 0 HD13 LEU B 79 -7.128 6.702 -4.130 1.00 0.49 H new ATOM 0 HD21 LEU B 79 -8.354 6.264 -1.324 1.00 0.48 H new ATOM 0 HD22 LEU B 79 -8.548 5.102 -2.658 1.00 0.48 H new ATOM 0 HD23 LEU B 79 -7.875 4.564 -1.101 1.00 0.48 H new ATOM 2924 N ILE B 80 -3.301 2.866 -1.779 1.00 0.34 N ATOM 2925 CA ILE B 80 -2.533 2.381 -0.599 1.00 0.37 C ATOM 2926 C ILE B 80 -1.148 3.065 -0.544 1.00 0.36 C ATOM 2927 O ILE B 80 -0.650 3.358 0.547 1.00 0.39 O ATOM 2928 CB ILE B 80 -2.371 0.813 -0.578 1.00 0.44 C ATOM 2929 CG1 ILE B 80 -3.752 0.098 -0.610 1.00 0.47 C ATOM 2930 CG2 ILE B 80 -1.555 0.335 0.640 1.00 0.54 C ATOM 2931 CD1 ILE B 80 -4.674 0.401 0.571 1.00 0.56 C ATOM 0 H ILE B 80 -3.604 2.126 -2.412 1.00 0.34 H new ATOM 0 HA ILE B 80 -3.108 2.651 0.287 1.00 0.37 H new ATOM 0 HB ILE B 80 -1.821 0.545 -1.480 1.00 0.44 H new ATOM 0 HG12 ILE B 80 -4.265 0.376 -1.531 1.00 0.47 H new ATOM 0 HG13 ILE B 80 -3.584 -0.978 -0.651 1.00 0.47 H new ATOM 0 HG21 ILE B 80 -1.467 -0.751 0.616 1.00 0.54 H new ATOM 0 HG22 ILE B 80 -0.560 0.780 0.609 1.00 0.54 H new ATOM 0 HG23 ILE B 80 -2.060 0.638 1.558 1.00 0.54 H new ATOM 0 HD11 ILE B 80 -5.609 -0.146 0.452 1.00 0.56 H new ATOM 0 HD12 ILE B 80 -4.190 0.095 1.498 1.00 0.56 H new ATOM 0 HD13 ILE B 80 -4.881 1.471 0.606 1.00 0.56 H new ATOM 2943 N GLY B 81 -0.537 3.313 -1.726 1.00 0.36 N ATOM 2944 CA GLY B 81 0.743 4.016 -1.793 1.00 0.39 C ATOM 2945 C GLY B 81 0.604 5.476 -1.362 1.00 0.37 C ATOM 2946 O GLY B 81 1.464 6.000 -0.647 1.00 0.42 O ATOM 0 H GLY B 81 -0.914 3.035 -2.632 1.00 0.36 H new ATOM 0 HA2 GLY B 81 1.469 3.514 -1.153 1.00 0.39 H new ATOM 0 HA3 GLY B 81 1.131 3.971 -2.811 1.00 0.39 H new ATOM 2950 N GLU B 82 -0.498 6.131 -1.807 1.00 0.34 N ATOM 2951 CA GLU B 82 -0.797 7.531 -1.441 1.00 0.36 C ATOM 2952 C GLU B 82 -1.153 7.647 0.057 1.00 0.33 C ATOM 2953 O GLU B 82 -0.924 8.698 0.656 1.00 0.40 O ATOM 2954 CB GLU B 82 -1.959 8.101 -2.292 1.00 0.41 C ATOM 2955 CG GLU B 82 -1.654 8.272 -3.788 1.00 0.49 C ATOM 2956 CD GLU B 82 -0.609 9.343 -4.078 1.00 0.61 C ATOM 2957 OE1 GLU B 82 -0.842 10.517 -3.717 1.00 0.91 O ATOM 2958 OE2 GLU B 82 0.433 9.007 -4.678 1.00 0.79 O ATOM 0 H GLU B 82 -1.193 5.707 -2.421 1.00 0.34 H new ATOM 0 HA GLU B 82 0.102 8.114 -1.641 1.00 0.36 H new ATOM 0 HB2 GLU B 82 -2.822 7.443 -2.187 1.00 0.41 H new ATOM 0 HB3 GLU B 82 -2.246 9.070 -1.883 1.00 0.41 H new ATOM 0 HG2 GLU B 82 -1.308 7.320 -4.191 1.00 0.49 H new ATOM 0 HG3 GLU B 82 -2.576 8.524 -4.312 1.00 0.49 H new ATOM 2965 N LEU B 83 -1.715 6.563 0.655 1.00 0.33 N ATOM 2966 CA LEU B 83 -2.078 6.544 2.090 1.00 0.35 C ATOM 2967 C LEU B 83 -0.827 6.763 2.968 1.00 0.37 C ATOM 2968 O LEU B 83 -0.805 7.668 3.805 1.00 0.45 O ATOM 2969 CB LEU B 83 -2.767 5.204 2.483 1.00 0.42 C ATOM 2970 CG LEU B 83 -4.314 5.205 2.535 1.00 0.51 C ATOM 2971 CD1 LEU B 83 -4.934 5.310 1.141 1.00 0.69 C ATOM 2972 CD2 LEU B 83 -4.830 3.953 3.253 1.00 0.63 C ATOM 0 H LEU B 83 -1.925 5.694 0.163 1.00 0.33 H new ATOM 0 HA LEU B 83 -2.784 7.357 2.261 1.00 0.35 H new ATOM 0 HB2 LEU B 83 -2.451 4.439 1.774 1.00 0.42 H new ATOM 0 HB3 LEU B 83 -2.394 4.904 3.462 1.00 0.42 H new ATOM 0 HG LEU B 83 -4.618 6.088 3.097 1.00 0.51 H new ATOM 0 HD11 LEU B 83 -6.021 5.307 1.225 1.00 0.69 H new ATOM 0 HD12 LEU B 83 -4.609 6.236 0.667 1.00 0.69 H new ATOM 0 HD13 LEU B 83 -4.615 4.461 0.536 1.00 0.69 H new ATOM 0 HD21 LEU B 83 -5.920 3.972 3.280 1.00 0.63 H new ATOM 0 HD22 LEU B 83 -4.495 3.064 2.719 1.00 0.63 H new ATOM 0 HD23 LEU B 83 -4.443 3.932 4.272 1.00 0.63 H new ATOM 2984 N ALA B 84 0.215 5.934 2.746 1.00 0.38 N ATOM 2985 CA ALA B 84 1.475 6.019 3.506 1.00 0.44 C ATOM 2986 C ALA B 84 2.403 7.159 3.018 1.00 0.45 C ATOM 2987 O ALA B 84 3.342 7.521 3.732 1.00 0.55 O ATOM 2988 CB ALA B 84 2.206 4.681 3.455 1.00 0.55 C ATOM 0 H ALA B 84 0.205 5.196 2.042 1.00 0.38 H new ATOM 0 HA ALA B 84 1.209 6.256 4.536 1.00 0.44 H new ATOM 0 HB1 ALA B 84 3.136 4.753 4.019 1.00 0.55 H new ATOM 0 HB2 ALA B 84 1.576 3.905 3.891 1.00 0.55 H new ATOM 0 HB3 ALA B 84 2.429 4.427 2.419 1.00 0.55 H new ATOM 2994 N LYS B 85 2.152 7.713 1.805 1.00 0.41 N ATOM 2995 CA LYS B 85 2.971 8.819 1.258 1.00 0.45 C ATOM 2996 C LYS B 85 2.431 10.198 1.713 1.00 0.47 C ATOM 2997 O LYS B 85 3.213 11.069 2.105 1.00 0.57 O ATOM 2998 CB LYS B 85 3.017 8.749 -0.288 1.00 0.49 C ATOM 2999 CG LYS B 85 4.014 9.725 -0.937 1.00 0.57 C ATOM 3000 CD LYS B 85 3.631 10.125 -2.369 1.00 0.66 C ATOM 3001 CE LYS B 85 4.148 9.148 -3.431 1.00 0.79 C ATOM 3002 NZ LYS B 85 3.316 7.911 -3.534 1.00 1.10 N ATOM 0 H LYS B 85 1.394 7.413 1.192 1.00 0.41 H new ATOM 0 HA LYS B 85 3.983 8.705 1.647 1.00 0.45 H new ATOM 0 HB2 LYS B 85 3.275 7.733 -0.586 1.00 0.49 H new ATOM 0 HB3 LYS B 85 2.020 8.953 -0.679 1.00 0.49 H new ATOM 0 HG2 LYS B 85 4.084 10.623 -0.323 1.00 0.57 H new ATOM 0 HG3 LYS B 85 5.004 9.268 -0.948 1.00 0.57 H new ATOM 0 HD2 LYS B 85 2.545 10.190 -2.443 1.00 0.66 H new ATOM 0 HD3 LYS B 85 4.024 11.120 -2.578 1.00 0.66 H new ATOM 0 HE2 LYS B 85 4.168 9.648 -4.399 1.00 0.79 H new ATOM 0 HE3 LYS B 85 5.175 8.871 -3.194 1.00 0.79 H new ATOM 0 HZ1 LYS B 85 3.616 7.359 -4.363 1.00 1.10 H new ATOM 0 HZ2 LYS B 85 3.438 7.338 -2.675 1.00 1.10 H new ATOM 0 HZ3 LYS B 85 2.315 8.173 -3.636 1.00 1.10 H new ATOM 3016 N GLU B 86 1.094 10.383 1.655 1.00 0.42 N ATOM 3017 CA GLU B 86 0.438 11.653 2.054 1.00 0.46 C ATOM 3018 C GLU B 86 0.434 11.870 3.585 1.00 0.50 C ATOM 3019 O GLU B 86 0.175 12.991 4.041 1.00 0.81 O ATOM 3020 CB GLU B 86 -1.018 11.711 1.523 1.00 0.52 C ATOM 3021 CG GLU B 86 -1.144 11.742 -0.003 1.00 0.59 C ATOM 3022 CD GLU B 86 -0.879 13.117 -0.597 1.00 1.01 C ATOM 3023 OE1 GLU B 86 0.295 13.419 -0.893 1.00 1.68 O ATOM 3024 OE2 GLU B 86 -1.848 13.889 -0.763 1.00 1.48 O ATOM 0 H GLU B 86 0.443 9.666 1.334 1.00 0.42 H new ATOM 0 HA GLU B 86 1.027 12.453 1.607 1.00 0.46 H new ATOM 0 HB2 GLU B 86 -1.562 10.846 1.901 1.00 0.52 H new ATOM 0 HB3 GLU B 86 -1.504 12.597 1.932 1.00 0.52 H new ATOM 0 HG2 GLU B 86 -0.444 11.026 -0.434 1.00 0.59 H new ATOM 0 HG3 GLU B 86 -2.146 11.418 -0.285 1.00 0.59 H new ATOM 3031 N ILE B 87 0.720 10.806 4.378 1.00 0.48 N ATOM 3032 CA ILE B 87 0.737 10.899 5.853 1.00 0.51 C ATOM 3033 C ILE B 87 1.804 11.910 6.351 1.00 0.53 C ATOM 3034 O ILE B 87 1.520 12.720 7.239 1.00 0.58 O ATOM 3035 CB ILE B 87 0.918 9.475 6.520 1.00 0.56 C ATOM 3036 CG1 ILE B 87 0.378 9.435 7.983 1.00 0.61 C ATOM 3037 CG2 ILE B 87 2.359 8.939 6.434 1.00 0.62 C ATOM 3038 CD1 ILE B 87 1.064 10.356 8.984 1.00 0.63 C ATOM 0 H ILE B 87 0.941 9.878 4.018 1.00 0.48 H new ATOM 0 HA ILE B 87 -0.234 11.281 6.167 1.00 0.51 H new ATOM 0 HB ILE B 87 0.305 8.797 5.926 1.00 0.56 H new ATOM 0 HG12 ILE B 87 -0.683 9.683 7.962 1.00 0.61 H new ATOM 0 HG13 ILE B 87 0.459 8.412 8.349 1.00 0.61 H new ATOM 0 HG21 ILE B 87 2.412 7.960 6.910 1.00 0.62 H new ATOM 0 HG22 ILE B 87 2.652 8.850 5.388 1.00 0.62 H new ATOM 0 HG23 ILE B 87 3.034 9.627 6.943 1.00 0.62 H new ATOM 0 HD11 ILE B 87 0.601 10.238 9.964 1.00 0.63 H new ATOM 0 HD12 ILE B 87 2.121 10.099 9.049 1.00 0.63 H new ATOM 0 HD13 ILE B 87 0.961 11.390 8.656 1.00 0.63 H new ATOM 3050 N ARG B 88 3.015 11.879 5.753 1.00 0.57 N ATOM 3051 CA ARG B 88 4.109 12.784 6.147 1.00 0.67 C ATOM 3052 C ARG B 88 4.054 14.122 5.385 1.00 0.67 C ATOM 3053 O ARG B 88 4.405 15.162 5.949 1.00 0.84 O ATOM 3054 CB ARG B 88 5.498 12.107 5.970 1.00 0.75 C ATOM 3055 CG ARG B 88 5.930 11.826 4.516 1.00 0.82 C ATOM 3056 CD ARG B 88 5.745 10.371 4.098 1.00 1.05 C ATOM 3057 NE ARG B 88 6.065 10.189 2.670 1.00 1.17 N ATOM 3058 CZ ARG B 88 7.218 9.693 2.169 1.00 1.26 C ATOM 3059 NH1 ARG B 88 8.165 9.167 2.958 1.00 1.64 N ATOM 3060 NH2 ARG B 88 7.414 9.715 0.852 1.00 1.55 N ATOM 0 H ARG B 88 3.256 11.237 4.998 1.00 0.57 H new ATOM 0 HA ARG B 88 3.970 13.003 7.206 1.00 0.67 H new ATOM 0 HB2 ARG B 88 6.252 12.741 6.436 1.00 0.75 H new ATOM 0 HB3 ARG B 88 5.493 11.164 6.516 1.00 0.75 H new ATOM 0 HG2 ARG B 88 5.356 12.465 3.845 1.00 0.82 H new ATOM 0 HG3 ARG B 88 6.978 12.100 4.397 1.00 0.82 H new ATOM 0 HD2 ARG B 88 6.386 9.730 4.703 1.00 1.05 H new ATOM 0 HD3 ARG B 88 4.717 10.062 4.287 1.00 1.05 H new ATOM 0 HE ARG B 88 5.349 10.463 1.997 1.00 1.17 H new ATOM 0 HH11 ARG B 88 8.026 9.133 3.968 1.00 1.64 H new ATOM 0 HH12 ARG B 88 9.024 8.801 2.549 1.00 1.64 H new ATOM 0 HH21 ARG B 88 6.699 10.103 0.236 1.00 1.55 H new ATOM 0 HH22 ARG B 88 8.279 9.344 0.459 1.00 1.55 H new ATOM 3074 N LYS B 89 3.601 14.091 4.108 1.00 0.60 N ATOM 3075 CA LYS B 89 3.535 15.300 3.275 1.00 0.67 C ATOM 3076 C LYS B 89 2.330 15.291 2.307 1.00 0.63 C ATOM 3077 O LYS B 89 2.430 14.791 1.179 1.00 0.76 O ATOM 3078 CB LYS B 89 4.860 15.492 2.488 1.00 0.76 C ATOM 3079 CG LYS B 89 5.345 14.255 1.697 1.00 0.78 C ATOM 3080 CD LYS B 89 6.015 14.614 0.362 1.00 1.06 C ATOM 3081 CE LYS B 89 7.466 15.074 0.536 1.00 1.32 C ATOM 3082 NZ LYS B 89 8.213 15.098 -0.760 1.00 1.65 N ATOM 0 H LYS B 89 3.279 13.243 3.641 1.00 0.60 H new ATOM 0 HA LYS B 89 3.393 16.143 3.952 1.00 0.67 H new ATOM 0 HB2 LYS B 89 4.733 16.321 1.792 1.00 0.76 H new ATOM 0 HB3 LYS B 89 5.641 15.783 3.190 1.00 0.76 H new ATOM 0 HG2 LYS B 89 6.050 13.693 2.310 1.00 0.78 H new ATOM 0 HG3 LYS B 89 4.496 13.599 1.505 1.00 0.78 H new ATOM 0 HD2 LYS B 89 5.989 13.747 -0.298 1.00 1.06 H new ATOM 0 HD3 LYS B 89 5.444 15.403 -0.126 1.00 1.06 H new ATOM 0 HE2 LYS B 89 7.479 16.070 0.979 1.00 1.32 H new ATOM 0 HE3 LYS B 89 7.975 14.409 1.234 1.00 1.32 H new ATOM 0 HZ1 LYS B 89 9.189 15.415 -0.592 1.00 1.65 H new ATOM 0 HZ2 LYS B 89 8.225 14.143 -1.171 1.00 1.65 H new ATOM 0 HZ3 LYS B 89 7.745 15.753 -1.419 1.00 1.65 H new ATOM 3096 N LYS B 90 1.181 15.831 2.764 1.00 0.58 N ATOM 3097 CA LYS B 90 -0.019 15.945 1.905 1.00 0.56 C ATOM 3098 C LYS B 90 0.096 17.221 1.047 1.00 0.54 C ATOM 3099 O LYS B 90 -0.318 17.237 -0.113 1.00 0.58 O ATOM 3100 CB LYS B 90 -1.342 15.918 2.717 1.00 0.59 C ATOM 3101 CG LYS B 90 -1.456 16.926 3.882 1.00 0.66 C ATOM 3102 CD LYS B 90 -1.236 16.287 5.265 1.00 0.96 C ATOM 3103 CE LYS B 90 -2.427 15.436 5.737 1.00 1.48 C ATOM 3104 NZ LYS B 90 -3.625 16.256 6.091 1.00 2.03 N ATOM 0 H LYS B 90 1.058 16.191 3.710 1.00 0.58 H new ATOM 0 HA LYS B 90 -0.058 15.072 1.254 1.00 0.56 H new ATOM 0 HB2 LYS B 90 -2.168 16.097 2.029 1.00 0.59 H new ATOM 0 HB3 LYS B 90 -1.474 14.914 3.120 1.00 0.59 H new ATOM 0 HG2 LYS B 90 -0.726 17.722 3.737 1.00 0.66 H new ATOM 0 HG3 LYS B 90 -2.442 17.390 3.857 1.00 0.66 H new ATOM 0 HD2 LYS B 90 -0.343 15.663 5.232 1.00 0.96 H new ATOM 0 HD3 LYS B 90 -1.048 17.074 5.996 1.00 0.96 H new ATOM 0 HE2 LYS B 90 -2.696 14.730 4.952 1.00 1.48 H new ATOM 0 HE3 LYS B 90 -2.126 14.849 6.605 1.00 1.48 H new ATOM 0 HZ1 LYS B 90 -4.389 15.631 6.418 1.00 2.03 H new ATOM 0 HZ2 LYS B 90 -3.377 16.924 6.848 1.00 2.03 H new ATOM 0 HZ3 LYS B 90 -3.944 16.784 5.254 1.00 2.03 H new ATOM 3118 N LYS B 91 0.689 18.280 1.640 1.00 0.55 N ATOM 3119 CA LYS B 91 0.931 19.558 0.961 1.00 0.59 C ATOM 3120 C LYS B 91 2.382 19.985 1.239 1.00 0.62 C ATOM 3121 O LYS B 91 2.639 20.741 2.182 1.00 0.69 O ATOM 3122 CB LYS B 91 -0.060 20.643 1.442 1.00 0.64 C ATOM 3123 CG LYS B 91 -1.525 20.354 1.108 1.00 0.74 C ATOM 3124 CD LYS B 91 -2.454 21.486 1.562 1.00 0.84 C ATOM 3125 CE LYS B 91 -3.931 21.154 1.330 1.00 1.14 C ATOM 3126 NZ LYS B 91 -4.329 21.267 -0.108 1.00 1.36 N ATOM 0 H LYS B 91 1.012 18.266 2.607 1.00 0.55 H new ATOM 0 HA LYS B 91 0.776 19.436 -0.111 1.00 0.59 H new ATOM 0 HB2 LYS B 91 0.039 20.755 2.522 1.00 0.64 H new ATOM 0 HB3 LYS B 91 0.220 21.597 0.996 1.00 0.64 H new ATOM 0 HG2 LYS B 91 -1.629 20.209 0.033 1.00 0.74 H new ATOM 0 HG3 LYS B 91 -1.829 19.423 1.586 1.00 0.74 H new ATOM 0 HD2 LYS B 91 -2.291 21.684 2.621 1.00 0.84 H new ATOM 0 HD3 LYS B 91 -2.200 22.399 1.024 1.00 0.84 H new ATOM 0 HE2 LYS B 91 -4.131 20.141 1.680 1.00 1.14 H new ATOM 0 HE3 LYS B 91 -4.548 21.825 1.927 1.00 1.14 H new ATOM 0 HZ1 LYS B 91 -5.289 20.888 -0.233 1.00 1.36 H new ATOM 0 HZ2 LYS B 91 -4.311 22.266 -0.396 1.00 1.36 H new ATOM 0 HZ3 LYS B 91 -3.664 20.726 -0.696 1.00 1.36 H new ATOM 3140 N ASP B 92 3.341 19.470 0.432 1.00 0.66 N ATOM 3141 CA ASP B 92 4.778 19.792 0.607 1.00 0.74 C ATOM 3142 C ASP B 92 5.115 21.179 0.006 1.00 0.92 C ATOM 3143 O ASP B 92 5.865 21.291 -0.969 1.00 1.72 O ATOM 3144 CB ASP B 92 5.695 18.672 0.027 1.00 0.75 C ATOM 3145 CG ASP B 92 5.402 18.307 -1.426 1.00 0.88 C ATOM 3146 OD1 ASP B 92 4.504 17.473 -1.661 1.00 0.93 O ATOM 3147 OD2 ASP B 92 6.079 18.855 -2.324 1.00 1.15 O ATOM 0 H ASP B 92 3.147 18.834 -0.342 1.00 0.66 H new ATOM 0 HA ASP B 92 4.977 19.841 1.678 1.00 0.74 H new ATOM 0 HB2 ASP B 92 6.734 18.993 0.106 1.00 0.75 H new ATOM 0 HB3 ASP B 92 5.590 17.778 0.642 1.00 0.75 H new ATOM 3152 N LEU B 93 4.536 22.234 0.617 1.00 0.63 N ATOM 3153 CA LEU B 93 4.739 23.630 0.177 1.00 0.66 C ATOM 3154 C LEU B 93 4.345 24.617 1.296 1.00 0.69 C ATOM 3155 O LEU B 93 5.108 25.537 1.603 1.00 0.82 O ATOM 3156 CB LEU B 93 3.937 23.925 -1.120 1.00 0.71 C ATOM 3157 CG LEU B 93 4.445 25.112 -1.981 1.00 0.97 C ATOM 3158 CD1 LEU B 93 5.781 24.780 -2.658 1.00 1.27 C ATOM 3159 CD2 LEU B 93 3.399 25.516 -3.028 1.00 1.18 C ATOM 0 H LEU B 93 3.919 22.143 1.424 1.00 0.63 H new ATOM 0 HA LEU B 93 5.798 23.764 -0.042 1.00 0.66 H new ATOM 0 HB2 LEU B 93 3.941 23.027 -1.738 1.00 0.71 H new ATOM 0 HB3 LEU B 93 2.900 24.119 -0.846 1.00 0.71 H new ATOM 0 HG LEU B 93 4.608 25.957 -1.312 1.00 0.97 H new ATOM 0 HD11 LEU B 93 6.109 25.632 -3.253 1.00 1.27 H new ATOM 0 HD12 LEU B 93 6.530 24.559 -1.897 1.00 1.27 H new ATOM 0 HD13 LEU B 93 5.655 23.912 -3.305 1.00 1.27 H new ATOM 0 HD21 LEU B 93 3.779 26.350 -3.619 1.00 1.18 H new ATOM 0 HD22 LEU B 93 3.195 24.670 -3.684 1.00 1.18 H new ATOM 0 HD23 LEU B 93 2.479 25.816 -2.526 1.00 1.18 H new ATOM 3171 N LYS B 94 3.153 24.410 1.903 1.00 0.66 N ATOM 3172 CA LYS B 94 2.659 25.270 2.991 1.00 0.74 C ATOM 3173 C LYS B 94 3.097 24.713 4.361 1.00 0.70 C ATOM 3174 O LYS B 94 3.743 25.423 5.139 1.00 0.79 O ATOM 3175 CB LYS B 94 1.118 25.403 2.911 1.00 0.84 C ATOM 3176 CG LYS B 94 0.531 26.548 3.741 1.00 1.00 C ATOM 3177 CD LYS B 94 0.846 27.925 3.138 1.00 1.15 C ATOM 3178 CE LYS B 94 0.307 29.071 3.993 1.00 1.45 C ATOM 3179 NZ LYS B 94 1.056 29.230 5.277 1.00 1.61 N ATOM 0 H LYS B 94 2.518 23.652 1.653 1.00 0.66 H new ATOM 0 HA LYS B 94 3.093 26.263 2.878 1.00 0.74 H new ATOM 0 HB2 LYS B 94 0.833 25.545 1.869 1.00 0.84 H new ATOM 0 HB3 LYS B 94 0.668 24.466 3.240 1.00 0.84 H new ATOM 0 HG2 LYS B 94 -0.549 26.424 3.814 1.00 1.00 H new ATOM 0 HG3 LYS B 94 0.927 26.499 4.755 1.00 1.00 H new ATOM 0 HD2 LYS B 94 1.925 28.033 3.029 1.00 1.15 H new ATOM 0 HD3 LYS B 94 0.417 27.988 2.138 1.00 1.15 H new ATOM 0 HE2 LYS B 94 0.363 30.000 3.426 1.00 1.45 H new ATOM 0 HE3 LYS B 94 -0.746 28.893 4.210 1.00 1.45 H new ATOM 0 HZ1 LYS B 94 0.673 30.041 5.804 1.00 1.61 H new ATOM 0 HZ2 LYS B 94 0.954 28.367 5.848 1.00 1.61 H new ATOM 0 HZ3 LYS B 94 2.063 29.393 5.074 1.00 1.61 H new ATOM 3193 N ILE B 95 2.735 23.444 4.645 1.00 0.65 N ATOM 3194 CA ILE B 95 3.101 22.774 5.912 1.00 0.66 C ATOM 3195 C ILE B 95 4.254 21.786 5.681 1.00 0.68 C ATOM 3196 O ILE B 95 4.201 20.968 4.757 1.00 0.78 O ATOM 3197 CB ILE B 95 1.895 22.030 6.591 1.00 0.74 C ATOM 3198 CG1 ILE B 95 1.074 21.193 5.567 1.00 0.83 C ATOM 3199 CG2 ILE B 95 0.997 23.033 7.329 1.00 0.84 C ATOM 3200 CD1 ILE B 95 0.180 20.132 6.189 1.00 1.04 C ATOM 0 H ILE B 95 2.188 22.861 4.012 1.00 0.65 H new ATOM 0 HA ILE B 95 3.415 23.563 6.595 1.00 0.66 H new ATOM 0 HB ILE B 95 2.306 21.328 7.317 1.00 0.74 H new ATOM 0 HG12 ILE B 95 0.456 21.870 4.977 1.00 0.83 H new ATOM 0 HG13 ILE B 95 1.765 20.708 4.877 1.00 0.83 H new ATOM 0 HG21 ILE B 95 0.166 22.503 7.794 1.00 0.84 H new ATOM 0 HG22 ILE B 95 1.577 23.544 8.097 1.00 0.84 H new ATOM 0 HG23 ILE B 95 0.610 23.765 6.620 1.00 0.84 H new ATOM 0 HD11 ILE B 95 -0.353 19.599 5.402 1.00 1.04 H new ATOM 0 HD12 ILE B 95 0.790 19.428 6.755 1.00 1.04 H new ATOM 0 HD13 ILE B 95 -0.539 20.607 6.856 1.00 1.04 H new ATOM 3212 N ARG B 96 5.302 21.881 6.524 1.00 0.70 N ATOM 3213 CA ARG B 96 6.484 21.001 6.426 1.00 0.79 C ATOM 3214 C ARG B 96 6.869 20.347 7.779 1.00 0.79 C ATOM 3215 O ARG B 96 7.933 19.724 7.877 1.00 1.02 O ATOM 3216 CB ARG B 96 7.671 21.794 5.836 1.00 0.99 C ATOM 3217 CG ARG B 96 8.101 23.026 6.647 1.00 1.12 C ATOM 3218 CD ARG B 96 9.140 23.870 5.908 1.00 1.41 C ATOM 3219 NE ARG B 96 10.447 23.189 5.783 1.00 1.59 N ATOM 3220 CZ ARG B 96 11.321 23.349 4.761 1.00 2.01 C ATOM 3221 NH1 ARG B 96 11.049 24.143 3.716 1.00 2.42 N ATOM 3222 NH2 ARG B 96 12.483 22.698 4.789 1.00 2.37 N ATOM 0 H ARG B 96 5.354 22.561 7.283 1.00 0.70 H new ATOM 0 HA ARG B 96 6.225 20.178 5.760 1.00 0.79 H new ATOM 0 HB2 ARG B 96 8.525 21.123 5.743 1.00 0.99 H new ATOM 0 HB3 ARG B 96 7.408 22.116 4.828 1.00 0.99 H new ATOM 0 HG2 ARG B 96 7.226 23.639 6.865 1.00 1.12 H new ATOM 0 HG3 ARG B 96 8.511 22.704 7.604 1.00 1.12 H new ATOM 0 HD2 ARG B 96 8.765 24.112 4.914 1.00 1.41 H new ATOM 0 HD3 ARG B 96 9.276 24.814 6.435 1.00 1.41 H new ATOM 0 HE ARG B 96 10.712 22.545 6.529 1.00 1.59 H new ATOM 0 HH11 ARG B 96 10.163 24.647 3.675 1.00 2.42 H new ATOM 0 HH12 ARG B 96 11.728 24.243 2.961 1.00 2.42 H new ATOM 0 HH21 ARG B 96 12.706 22.087 5.575 1.00 2.37 H new ATOM 0 HH22 ARG B 96 13.149 22.811 4.025 1.00 2.37 H new ATOM 3236 N LYS B 97 6.006 20.477 8.816 1.00 0.72 N ATOM 3237 CA LYS B 97 6.270 19.879 10.139 1.00 0.76 C ATOM 3238 C LYS B 97 4.964 19.675 10.935 1.00 0.76 C ATOM 3239 O LYS B 97 4.237 20.634 11.210 1.00 1.04 O ATOM 3240 CB LYS B 97 7.280 20.727 10.953 1.00 0.89 C ATOM 3241 CG LYS B 97 6.903 22.208 11.129 1.00 0.94 C ATOM 3242 CD LYS B 97 7.680 22.894 12.262 1.00 1.16 C ATOM 3243 CE LYS B 97 7.033 22.694 13.642 1.00 1.49 C ATOM 3244 NZ LYS B 97 7.275 21.335 14.213 1.00 1.86 N ATOM 0 H LYS B 97 5.126 20.989 8.758 1.00 0.72 H new ATOM 0 HA LYS B 97 6.716 18.900 9.966 1.00 0.76 H new ATOM 0 HB2 LYS B 97 7.394 20.278 11.940 1.00 0.89 H new ATOM 0 HB3 LYS B 97 8.253 20.672 10.464 1.00 0.89 H new ATOM 0 HG2 LYS B 97 7.089 22.738 10.195 1.00 0.94 H new ATOM 0 HG3 LYS B 97 5.835 22.284 11.331 1.00 0.94 H new ATOM 0 HD2 LYS B 97 8.698 22.505 12.284 1.00 1.16 H new ATOM 0 HD3 LYS B 97 7.751 23.961 12.052 1.00 1.16 H new ATOM 0 HE2 LYS B 97 7.421 23.445 14.330 1.00 1.49 H new ATOM 0 HE3 LYS B 97 5.959 22.861 13.560 1.00 1.49 H new ATOM 0 HZ1 LYS B 97 7.209 21.377 15.250 1.00 1.86 H new ATOM 0 HZ2 LYS B 97 6.562 20.673 13.847 1.00 1.86 H new ATOM 0 HZ3 LYS B 97 8.224 21.008 13.940 1.00 1.86 H new ATOM 3258 N LYS B 98 4.667 18.408 11.281 1.00 0.71 N ATOM 3259 CA LYS B 98 3.461 18.057 12.055 1.00 0.74 C ATOM 3260 C LYS B 98 3.604 16.657 12.673 1.00 0.90 C ATOM 3261 O LYS B 98 3.854 16.574 13.895 1.00 1.07 O ATOM 3262 CB LYS B 98 2.186 18.142 11.176 1.00 0.96 C ATOM 3263 CG LYS B 98 0.875 18.055 11.970 1.00 1.08 C ATOM 3264 CD LYS B 98 -0.362 18.253 11.087 1.00 1.52 C ATOM 3265 CE LYS B 98 -1.664 18.161 11.889 1.00 1.69 C ATOM 3266 NZ LYS B 98 -1.842 19.315 12.826 1.00 1.85 N ATOM 3267 OXT LYS B 98 3.470 15.658 11.931 1.00 1.15 O ATOM 0 H LYS B 98 5.249 17.607 11.035 1.00 0.71 H new ATOM 0 HA LYS B 98 3.357 18.781 12.863 1.00 0.74 H new ATOM 0 HB2 LYS B 98 2.201 19.080 10.621 1.00 0.96 H new ATOM 0 HB3 LYS B 98 2.209 17.337 10.442 1.00 0.96 H new ATOM 0 HG2 LYS B 98 0.815 17.083 12.460 1.00 1.08 H new ATOM 0 HG3 LYS B 98 0.880 18.809 12.757 1.00 1.08 H new ATOM 0 HD2 LYS B 98 -0.306 19.226 10.598 1.00 1.52 H new ATOM 0 HD3 LYS B 98 -0.368 17.500 10.299 1.00 1.52 H new ATOM 0 HE2 LYS B 98 -2.509 18.122 11.201 1.00 1.69 H new ATOM 0 HE3 LYS B 98 -1.672 17.231 12.457 1.00 1.69 H new ATOM 0 HZ1 LYS B 98 -2.760 19.233 13.308 1.00 1.85 H new ATOM 0 HZ2 LYS B 98 -1.079 19.310 13.532 1.00 1.85 H new ATOM 0 HZ3 LYS B 98 -1.811 20.206 12.290 1.00 1.85 H new