USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1047 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 40 THR OG1 : rot 12:sc= 2.27 USER MOD Set 1.2: A 128 TYR OH : rot -16:sc= 0.627 USER MOD Set 2.1: A 13 SER OG : rot 68:sc= 0.548 USER MOD Set 2.2: A 124 CYS SG : rot 75:sc= 0.437 USER MOD Set 3.1: A 19 TYR OH : rot 44:sc= 0.583 USER MOD Set 3.2: A 102 THR OG1 : rot 24:sc= 2.14 USER MOD Set 4.1: A 100 GLN :FLIP amide:sc= 0.441 F(o=-1.4,f=0.13) USER MOD Set 4.2: A 119 HIS : no HE2:sc= -0.313 K(o=0.13,f=-8.3!) USER MOD Set 5.1: A 82 SER OG : rot 172:sc= 2.07 USER MOD Set 5.2: A 93 HIS : no HD1:sc= 0.388 K(o=2.1,f=-7.8!) USER MOD Set 5.3: A 95 GLN : amide:sc= -0.314 K(o=2.1,f=0.32!) USER MOD Set 6.1: A 53 THR OG1 : rot 134:sc= 1.2 USER MOD Set 6.2: A 60 THR OG1 : rot 180:sc= 1.01 USER MOD Set 7.1: A 55 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 56 THR OG1 : rot 180:sc= 0.426 USER MOD Set 8.1: A 45 ASN : amide:sc= 0.61 K(o=0.97,f=-0.3) USER MOD Set 8.2: A 48 THR OG1 : rot -109:sc= 0.362 USER MOD Single : A 1 VAL N :NH3+ -165:sc= -0.143 (180deg=-0.371) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -177:sc= 2.49 (180deg=2.41) USER MOD Single : A 14 LYS NZ :NH3+ 164:sc= -0.0482 (180deg=-0.292) USER MOD Single : A 15 ASN : amide:sc= 0.44 K(o=0.44,f=-3.8!) USER MOD Single : A 20 MET CE :methyl -154:sc= -1.05 (180deg=-3.4!) USER MOD Single : A 21 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0318) USER MOD Single : A 22 SER OG : rot -92:sc= 1.09 USER MOD Single : A 29 THR OG1 : rot 96:sc= 0.598 USER MOD Single : A 31 GLN : amide:sc= -0.015 X(o=-0.015,f=0) USER MOD Single : A 34 ASN : amide:sc= 0.78 K(o=0.78,f=-0.24) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot -53:sc= 0.00124 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 113:sc= 1.38 USER MOD Single : A 52 LYS NZ :NH3+ 136:sc= 0.657 (180deg=-4.18!) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 58 LYS NZ :NH3+ -173:sc= 1.12 (180deg=0.852) USER MOD Single : A 59 ASN : amide:sc= 0.521 K(o=0.52,f=-5!) USER MOD Single : A 63 SER OG : rot 43:sc= 0.654 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 1.87 (180deg=1.87) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 73:sc= 0.709 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 174:sc= 1.21 (180deg=1.16) USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.0658 USER MOD Single : A 90 LYS NZ :NH3+ -129:sc= 0.598 (180deg=-1.86!) USER MOD Single : A 96 LYS NZ :NH3+ 156:sc= 1.24 (180deg=1.18) USER MOD Single : A 98 ASN : amide:sc= -1.72 K(o=-1.7,f=-3.8!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl 175:sc= -0.251 (180deg=-0.255) USER MOD Single : A 112 LYS NZ :NH3+ 159:sc= 1.26 (180deg=0.51) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 30:sc= 0.115 USER MOD Single : A 127 THR OG1 : rot 180:sc= 1.22 USER MOD Single : A 130 LYS NZ :NH3+ -178:sc= 2.45 (180deg=2.32) USER MOD Single : A 131 GLN : amide:sc= -1.04 K(o=-1,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.175 -13.176 -4.027 1.00 0.00 N ATOM 2 CA VAL A 1 9.964 -12.021 -3.164 1.00 0.00 C ATOM 3 C VAL A 1 11.287 -11.284 -2.892 1.00 0.00 C ATOM 4 O VAL A 1 11.295 -10.077 -2.625 1.00 0.00 O ATOM 5 CB VAL A 1 9.238 -12.483 -1.884 1.00 0.00 C ATOM 6 CG1 VAL A 1 10.157 -13.145 -0.854 1.00 0.00 C ATOM 7 CG2 VAL A 1 8.481 -11.328 -1.227 1.00 0.00 C ATOM 0 H1 VAL A 1 9.261 -13.502 -4.400 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.796 -12.910 -4.817 1.00 0.00 H new ATOM 0 H3 VAL A 1 10.619 -13.941 -3.480 1.00 0.00 H new ATOM 0 HA VAL A 1 9.326 -11.289 -3.659 1.00 0.00 H new ATOM 0 HB VAL A 1 8.533 -13.245 -2.217 1.00 0.00 H new ATOM 0 HG11 VAL A 1 9.573 -13.442 0.017 1.00 0.00 H new ATOM 0 HG12 VAL A 1 10.624 -14.026 -1.295 1.00 0.00 H new ATOM 0 HG13 VAL A 1 10.930 -12.439 -0.549 1.00 0.00 H new ATOM 0 HG21 VAL A 1 7.980 -11.686 -0.328 1.00 0.00 H new ATOM 0 HG22 VAL A 1 9.183 -10.538 -0.961 1.00 0.00 H new ATOM 0 HG23 VAL A 1 7.740 -10.936 -1.923 1.00 0.00 H new ATOM 19 N ASP A 2 12.394 -12.031 -2.980 1.00 0.00 N ATOM 20 CA ASP A 2 13.776 -11.721 -2.632 1.00 0.00 C ATOM 21 C ASP A 2 14.365 -10.678 -3.584 1.00 0.00 C ATOM 22 O ASP A 2 15.339 -10.910 -4.298 1.00 0.00 O ATOM 23 CB ASP A 2 14.589 -13.031 -2.671 1.00 0.00 C ATOM 24 CG ASP A 2 13.869 -14.202 -2.013 1.00 0.00 C ATOM 25 OD1 ASP A 2 12.838 -14.607 -2.603 1.00 0.00 O ATOM 26 OD2 ASP A 2 14.331 -14.637 -0.939 1.00 0.00 O ATOM 0 H ASP A 2 12.328 -12.982 -3.342 1.00 0.00 H new ATOM 0 HA ASP A 2 13.816 -11.291 -1.631 1.00 0.00 H new ATOM 0 HB2 ASP A 2 14.809 -13.284 -3.708 1.00 0.00 H new ATOM 0 HB3 ASP A 2 15.545 -12.873 -2.172 1.00 0.00 H new ATOM 31 N ALA A 3 13.735 -9.510 -3.599 1.00 0.00 N ATOM 32 CA ALA A 3 13.948 -8.438 -4.550 1.00 0.00 C ATOM 33 C ALA A 3 13.222 -7.203 -4.033 1.00 0.00 C ATOM 34 O ALA A 3 13.783 -6.105 -4.032 1.00 0.00 O ATOM 35 CB ALA A 3 13.400 -8.843 -5.923 1.00 0.00 C ATOM 0 H ALA A 3 13.023 -9.277 -2.907 1.00 0.00 H new ATOM 0 HA ALA A 3 15.012 -8.228 -4.659 1.00 0.00 H new ATOM 0 HB1 ALA A 3 13.563 -8.033 -6.633 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.914 -9.739 -6.270 1.00 0.00 H new ATOM 0 HB3 ALA A 3 12.332 -9.046 -5.843 1.00 0.00 H new ATOM 41 N PHE A 4 11.982 -7.391 -3.571 1.00 0.00 N ATOM 42 CA PHE A 4 11.145 -6.320 -3.062 1.00 0.00 C ATOM 43 C PHE A 4 11.775 -5.653 -1.841 1.00 0.00 C ATOM 44 O PHE A 4 11.713 -4.433 -1.732 1.00 0.00 O ATOM 45 CB PHE A 4 9.750 -6.861 -2.741 1.00 0.00 C ATOM 46 CG PHE A 4 9.019 -7.555 -3.878 1.00 0.00 C ATOM 47 CD1 PHE A 4 9.173 -7.136 -5.216 1.00 0.00 C ATOM 48 CD2 PHE A 4 8.140 -8.611 -3.585 1.00 0.00 C ATOM 49 CE1 PHE A 4 8.526 -7.830 -6.252 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.513 -9.320 -4.623 1.00 0.00 C ATOM 51 CZ PHE A 4 7.712 -8.935 -5.958 1.00 0.00 C ATOM 0 H PHE A 4 11.533 -8.306 -3.543 1.00 0.00 H new ATOM 0 HA PHE A 4 11.054 -5.554 -3.832 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.838 -7.563 -1.912 1.00 0.00 H new ATOM 0 HB3 PHE A 4 9.133 -6.032 -2.393 1.00 0.00 H new ATOM 0 HD1 PHE A 4 9.790 -6.279 -5.445 1.00 0.00 H new ATOM 0 HD2 PHE A 4 7.945 -8.879 -2.557 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.655 -7.513 -7.276 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.877 -10.162 -4.394 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.240 -9.488 -6.757 1.00 0.00 H new ATOM 61 N VAL A 5 12.382 -6.450 -0.956 1.00 0.00 N ATOM 62 CA VAL A 5 13.023 -6.021 0.285 1.00 0.00 C ATOM 63 C VAL A 5 13.765 -4.687 0.111 1.00 0.00 C ATOM 64 O VAL A 5 14.851 -4.669 -0.474 1.00 0.00 O ATOM 65 CB VAL A 5 13.997 -7.120 0.762 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.788 -6.657 1.996 1.00 0.00 C ATOM 67 CG2 VAL A 5 13.276 -8.425 1.121 1.00 0.00 C ATOM 0 H VAL A 5 12.441 -7.459 -1.095 1.00 0.00 H new ATOM 0 HA VAL A 5 12.248 -5.864 1.035 1.00 0.00 H new ATOM 0 HB VAL A 5 14.671 -7.306 -0.074 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.467 -7.449 2.312 1.00 0.00 H new ATOM 0 HG12 VAL A 5 15.363 -5.765 1.746 1.00 0.00 H new ATOM 0 HG13 VAL A 5 14.096 -6.428 2.807 1.00 0.00 H new ATOM 0 HG21 VAL A 5 14.005 -9.165 1.450 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.562 -8.237 1.923 1.00 0.00 H new ATOM 0 HG23 VAL A 5 12.747 -8.801 0.245 1.00 0.00 H new ATOM 77 N GLY A 6 13.200 -3.584 0.611 1.00 0.00 N ATOM 78 CA GLY A 6 13.864 -2.293 0.697 1.00 0.00 C ATOM 79 C GLY A 6 12.951 -1.122 0.336 1.00 0.00 C ATOM 80 O GLY A 6 11.740 -1.263 0.156 1.00 0.00 O ATOM 0 H GLY A 6 12.247 -3.570 0.974 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.241 -2.152 1.710 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.728 -2.291 0.032 1.00 0.00 H new ATOM 84 N THR A 7 13.571 0.056 0.251 1.00 0.00 N ATOM 85 CA THR A 7 12.938 1.324 -0.059 1.00 0.00 C ATOM 86 C THR A 7 12.810 1.504 -1.573 1.00 0.00 C ATOM 87 O THR A 7 13.823 1.599 -2.276 1.00 0.00 O ATOM 88 CB THR A 7 13.786 2.442 0.561 1.00 0.00 C ATOM 89 OG1 THR A 7 14.166 2.065 1.869 1.00 0.00 O ATOM 90 CG2 THR A 7 13.027 3.767 0.619 1.00 0.00 C ATOM 0 H THR A 7 14.575 0.148 0.405 1.00 0.00 H new ATOM 0 HA THR A 7 11.930 1.355 0.355 1.00 0.00 H new ATOM 0 HB THR A 7 14.664 2.586 -0.068 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.710 2.775 2.269 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.663 4.532 1.065 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.747 4.071 -0.390 1.00 0.00 H new ATOM 0 HG23 THR A 7 12.128 3.645 1.224 1.00 0.00 H new ATOM 98 N TRP A 8 11.572 1.586 -2.065 1.00 0.00 N ATOM 99 CA TRP A 8 11.272 2.044 -3.410 1.00 0.00 C ATOM 100 C TRP A 8 10.827 3.496 -3.338 1.00 0.00 C ATOM 101 O TRP A 8 10.449 3.992 -2.276 1.00 0.00 O ATOM 102 CB TRP A 8 10.203 1.164 -4.065 1.00 0.00 C ATOM 103 CG TRP A 8 10.555 -0.286 -4.120 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.515 -1.127 -3.065 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.099 -1.059 -5.231 1.00 0.00 C ATOM 106 NE1 TRP A 8 11.011 -2.354 -3.437 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.423 -2.361 -4.751 1.00 0.00 C ATOM 108 CE3 TRP A 8 11.379 -0.785 -6.587 1.00 0.00 C ATOM 109 CZ2 TRP A 8 12.040 -3.325 -5.560 1.00 0.00 C ATOM 110 CZ3 TRP A 8 11.973 -1.755 -7.414 1.00 0.00 C ATOM 111 CH2 TRP A 8 12.343 -3.006 -6.890 1.00 0.00 C ATOM 0 H TRP A 8 10.743 1.331 -1.528 1.00 0.00 H new ATOM 0 HA TRP A 8 12.164 1.970 -4.031 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.268 1.279 -3.517 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.025 1.522 -5.079 1.00 0.00 H new ATOM 0 HD1 TRP A 8 10.150 -0.875 -2.080 1.00 0.00 H new ATOM 0 HE1 TRP A 8 11.067 -3.161 -2.815 1.00 0.00 H new ATOM 0 HE3 TRP A 8 11.133 0.184 -6.996 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 12.279 -4.301 -5.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 12.146 -1.538 -8.458 1.00 0.00 H new ATOM 0 HH2 TRP A 8 12.861 -3.721 -7.513 1.00 0.00 H new ATOM 122 N LYS A 9 10.888 4.176 -4.478 1.00 0.00 N ATOM 123 CA LYS A 9 10.523 5.567 -4.615 1.00 0.00 C ATOM 124 C LYS A 9 9.927 5.695 -6.017 1.00 0.00 C ATOM 125 O LYS A 9 10.420 5.080 -6.964 1.00 0.00 O ATOM 126 CB LYS A 9 11.788 6.388 -4.307 1.00 0.00 C ATOM 127 CG LYS A 9 11.687 7.920 -4.326 1.00 0.00 C ATOM 128 CD LYS A 9 11.506 8.550 -5.713 1.00 0.00 C ATOM 129 CE LYS A 9 12.447 7.953 -6.780 1.00 0.00 C ATOM 130 NZ LYS A 9 12.192 8.477 -8.134 1.00 0.00 N ATOM 0 H LYS A 9 11.203 3.756 -5.352 1.00 0.00 H new ATOM 0 HA LYS A 9 9.767 5.949 -3.928 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.144 6.091 -3.321 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.555 6.097 -5.024 1.00 0.00 H new ATOM 0 HG2 LYS A 9 10.849 8.220 -3.697 1.00 0.00 H new ATOM 0 HG3 LYS A 9 12.589 8.332 -3.873 1.00 0.00 H new ATOM 0 HD2 LYS A 9 10.473 8.416 -6.034 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.682 9.623 -5.643 1.00 0.00 H new ATOM 0 HE2 LYS A 9 13.480 8.164 -6.504 1.00 0.00 H new ATOM 0 HE3 LYS A 9 12.335 6.869 -6.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 12.820 8.002 -8.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 11.201 8.298 -8.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 12.375 9.501 -8.150 1.00 0.00 H new ATOM 144 N LEU A 10 8.804 6.401 -6.142 1.00 0.00 N ATOM 145 CA LEU A 10 8.073 6.486 -7.400 1.00 0.00 C ATOM 146 C LEU A 10 8.895 7.270 -8.427 1.00 0.00 C ATOM 147 O LEU A 10 9.484 8.298 -8.089 1.00 0.00 O ATOM 148 CB LEU A 10 6.709 7.123 -7.120 1.00 0.00 C ATOM 149 CG LEU A 10 5.765 7.115 -8.334 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.342 6.814 -7.859 1.00 0.00 C ATOM 151 CD2 LEU A 10 5.765 8.469 -9.049 1.00 0.00 C ATOM 0 H LEU A 10 8.380 6.926 -5.378 1.00 0.00 H new ATOM 0 HA LEU A 10 7.905 5.497 -7.827 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.232 6.593 -6.296 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.858 8.152 -6.793 1.00 0.00 H new ATOM 0 HG LEU A 10 6.113 6.352 -9.031 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.667 6.807 -8.715 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.320 5.840 -7.371 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.024 7.581 -7.153 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.088 8.430 -9.902 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.434 9.245 -8.359 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.773 8.697 -9.396 1.00 0.00 H new ATOM 163 N VAL A 11 8.986 6.799 -9.672 1.00 0.00 N ATOM 164 CA VAL A 11 9.670 7.537 -10.732 1.00 0.00 C ATOM 165 C VAL A 11 8.686 8.020 -11.790 1.00 0.00 C ATOM 166 O VAL A 11 8.817 9.147 -12.262 1.00 0.00 O ATOM 167 CB VAL A 11 10.851 6.735 -11.298 1.00 0.00 C ATOM 168 CG1 VAL A 11 10.450 5.408 -11.947 1.00 0.00 C ATOM 169 CG2 VAL A 11 11.649 7.578 -12.298 1.00 0.00 C ATOM 0 H VAL A 11 8.593 5.906 -9.970 1.00 0.00 H new ATOM 0 HA VAL A 11 10.108 8.438 -10.303 1.00 0.00 H new ATOM 0 HB VAL A 11 11.471 6.485 -10.437 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.340 4.903 -12.322 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.958 4.776 -11.208 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.766 5.599 -12.774 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.481 6.991 -12.687 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.000 7.877 -13.121 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.035 8.467 -11.799 1.00 0.00 H new ATOM 179 N ASP A 12 7.699 7.193 -12.138 1.00 0.00 N ATOM 180 CA ASP A 12 6.681 7.547 -13.111 1.00 0.00 C ATOM 181 C ASP A 12 5.344 6.984 -12.638 1.00 0.00 C ATOM 182 O ASP A 12 5.280 6.137 -11.747 1.00 0.00 O ATOM 183 CB ASP A 12 7.104 7.082 -14.517 1.00 0.00 C ATOM 184 CG ASP A 12 5.932 6.932 -15.477 1.00 0.00 C ATOM 185 OD1 ASP A 12 5.210 7.939 -15.663 1.00 0.00 O ATOM 186 OD2 ASP A 12 5.730 5.787 -15.936 1.00 0.00 O ATOM 0 H ASP A 12 7.588 6.257 -11.748 1.00 0.00 H new ATOM 0 HA ASP A 12 6.563 8.628 -13.190 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.815 7.797 -14.931 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.623 6.127 -14.436 1.00 0.00 H new ATOM 191 N SER A 13 4.271 7.510 -13.210 1.00 0.00 N ATOM 192 CA SER A 13 2.914 7.047 -13.076 1.00 0.00 C ATOM 193 C SER A 13 2.104 7.901 -14.037 1.00 0.00 C ATOM 194 O SER A 13 2.408 9.077 -14.234 1.00 0.00 O ATOM 195 CB SER A 13 2.392 7.206 -11.641 1.00 0.00 C ATOM 196 OG SER A 13 1.030 6.807 -11.549 1.00 0.00 O ATOM 0 H SER A 13 4.339 8.326 -13.819 1.00 0.00 H new ATOM 0 HA SER A 13 2.839 5.983 -13.301 1.00 0.00 H new ATOM 0 HB2 SER A 13 2.997 6.607 -10.961 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.493 8.245 -11.326 1.00 0.00 H new ATOM 0 HG SER A 13 0.962 5.840 -11.692 1.00 0.00 H new ATOM 202 N LYS A 14 1.037 7.330 -14.586 1.00 0.00 N ATOM 203 CA LYS A 14 0.026 8.104 -15.286 1.00 0.00 C ATOM 204 C LYS A 14 -1.307 7.854 -14.591 1.00 0.00 C ATOM 205 O LYS A 14 -1.412 6.935 -13.773 1.00 0.00 O ATOM 206 CB LYS A 14 0.019 7.746 -16.778 1.00 0.00 C ATOM 207 CG LYS A 14 1.453 7.738 -17.340 1.00 0.00 C ATOM 208 CD LYS A 14 1.510 8.038 -18.845 1.00 0.00 C ATOM 209 CE LYS A 14 1.352 9.532 -19.176 1.00 0.00 C ATOM 210 NZ LYS A 14 2.442 10.357 -18.606 1.00 0.00 N ATOM 0 H LYS A 14 0.852 6.327 -14.557 1.00 0.00 H new ATOM 0 HA LYS A 14 0.237 9.173 -15.246 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -0.439 6.767 -16.921 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.589 8.465 -17.327 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.051 8.476 -16.805 1.00 0.00 H new ATOM 0 HG3 LYS A 14 1.905 6.764 -17.152 1.00 0.00 H new ATOM 0 HD2 LYS A 14 2.461 7.684 -19.243 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.724 7.476 -19.350 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.331 9.661 -20.258 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.395 9.886 -18.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.450 11.289 -19.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.288 10.478 -17.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 3.355 9.884 -18.765 1.00 0.00 H new ATOM 224 N ASN A 15 -2.307 8.697 -14.859 1.00 0.00 N ATOM 225 CA ASN A 15 -3.710 8.455 -14.522 1.00 0.00 C ATOM 226 C ASN A 15 -4.042 8.565 -13.021 1.00 0.00 C ATOM 227 O ASN A 15 -5.189 8.796 -12.672 1.00 0.00 O ATOM 228 CB ASN A 15 -4.134 7.100 -15.120 1.00 0.00 C ATOM 229 CG ASN A 15 -5.624 6.989 -15.423 1.00 0.00 C ATOM 230 OD1 ASN A 15 -6.301 6.111 -14.899 1.00 0.00 O ATOM 231 ND2 ASN A 15 -6.134 7.832 -16.314 1.00 0.00 N ATOM 0 H ASN A 15 -2.158 9.590 -15.329 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.296 9.259 -14.967 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.574 6.930 -16.040 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.856 6.307 -14.426 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -7.116 7.760 -16.581 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -5.544 8.551 -16.731 1.00 0.00 H new ATOM 238 N PHE A 16 -3.063 8.401 -12.122 1.00 0.00 N ATOM 239 CA PHE A 16 -3.248 8.195 -10.683 1.00 0.00 C ATOM 240 C PHE A 16 -4.236 9.153 -9.995 1.00 0.00 C ATOM 241 O PHE A 16 -5.008 8.705 -9.145 1.00 0.00 O ATOM 242 CB PHE A 16 -1.876 8.228 -9.987 1.00 0.00 C ATOM 243 CG PHE A 16 -1.749 7.657 -8.577 1.00 0.00 C ATOM 244 CD1 PHE A 16 -2.529 6.564 -8.141 1.00 0.00 C ATOM 245 CD2 PHE A 16 -0.660 8.073 -7.791 1.00 0.00 C ATOM 246 CE1 PHE A 16 -2.191 5.876 -6.962 1.00 0.00 C ATOM 247 CE2 PHE A 16 -0.350 7.416 -6.589 1.00 0.00 C ATOM 248 CZ PHE A 16 -1.101 6.301 -6.183 1.00 0.00 C ATOM 0 H PHE A 16 -2.079 8.409 -12.391 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.717 7.216 -10.580 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -1.171 7.693 -10.624 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.549 9.267 -9.952 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -3.389 6.255 -8.716 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -0.055 8.907 -8.115 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.771 5.018 -6.654 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.467 7.769 -5.976 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.842 5.773 -5.277 1.00 0.00 H new ATOM 258 N ASP A 17 -4.201 10.459 -10.298 1.00 0.00 N ATOM 259 CA ASP A 17 -5.154 11.378 -9.675 1.00 0.00 C ATOM 260 C ASP A 17 -6.565 11.059 -10.182 1.00 0.00 C ATOM 261 O ASP A 17 -7.396 10.612 -9.401 1.00 0.00 O ATOM 262 CB ASP A 17 -4.770 12.858 -9.826 1.00 0.00 C ATOM 263 CG ASP A 17 -5.642 13.731 -8.915 1.00 0.00 C ATOM 264 OD1 ASP A 17 -6.851 13.837 -9.202 1.00 0.00 O ATOM 265 OD2 ASP A 17 -5.105 14.246 -7.905 1.00 0.00 O ATOM 0 H ASP A 17 -3.544 10.889 -10.950 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.130 11.218 -8.597 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -3.718 12.995 -9.574 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -4.892 13.168 -10.864 1.00 0.00 H new ATOM 270 N ASP A 18 -6.804 11.187 -11.492 1.00 0.00 N ATOM 271 CA ASP A 18 -8.055 10.805 -12.158 1.00 0.00 C ATOM 272 C ASP A 18 -8.611 9.479 -11.617 1.00 0.00 C ATOM 273 O ASP A 18 -9.764 9.378 -11.195 1.00 0.00 O ATOM 274 CB ASP A 18 -7.800 10.721 -13.669 1.00 0.00 C ATOM 275 CG ASP A 18 -8.965 10.067 -14.398 1.00 0.00 C ATOM 276 OD1 ASP A 18 -10.001 10.751 -14.525 1.00 0.00 O ATOM 277 OD2 ASP A 18 -8.787 8.900 -14.810 1.00 0.00 O ATOM 0 H ASP A 18 -6.113 11.570 -12.137 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.811 11.563 -11.952 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.637 11.722 -14.067 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.889 10.152 -13.854 1.00 0.00 H new ATOM 282 N TYR A 19 -7.737 8.477 -11.571 1.00 0.00 N ATOM 283 CA TYR A 19 -7.995 7.147 -11.050 1.00 0.00 C ATOM 284 C TYR A 19 -8.626 7.193 -9.654 1.00 0.00 C ATOM 285 O TYR A 19 -9.624 6.521 -9.400 1.00 0.00 O ATOM 286 CB TYR A 19 -6.671 6.371 -11.056 1.00 0.00 C ATOM 287 CG TYR A 19 -6.796 4.872 -10.925 1.00 0.00 C ATOM 288 CD1 TYR A 19 -7.013 4.281 -9.667 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.599 4.061 -12.053 1.00 0.00 C ATOM 290 CE1 TYR A 19 -7.091 2.883 -9.553 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.691 2.670 -11.939 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.918 2.083 -10.689 1.00 0.00 C ATOM 293 OH TYR A 19 -6.802 0.737 -10.580 1.00 0.00 O ATOM 0 H TYR A 19 -6.782 8.581 -11.915 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.722 6.638 -11.683 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -6.143 6.595 -11.983 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.050 6.739 -10.239 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -7.120 4.902 -8.790 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -6.376 4.511 -13.009 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.284 2.427 -8.593 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.587 2.049 -12.816 1.00 0.00 H new ATOM 0 HH TYR A 19 -7.469 0.402 -9.945 1.00 0.00 H new ATOM 303 N MET A 20 -8.052 7.970 -8.728 1.00 0.00 N ATOM 304 CA MET A 20 -8.641 8.126 -7.404 1.00 0.00 C ATOM 305 C MET A 20 -9.920 8.976 -7.487 1.00 0.00 C ATOM 306 O MET A 20 -10.901 8.719 -6.791 1.00 0.00 O ATOM 307 CB MET A 20 -7.590 8.657 -6.407 1.00 0.00 C ATOM 308 CG MET A 20 -7.277 10.155 -6.508 1.00 0.00 C ATOM 309 SD MET A 20 -7.383 11.117 -4.986 1.00 0.00 S ATOM 310 CE MET A 20 -7.072 12.730 -5.726 1.00 0.00 C ATOM 0 H MET A 20 -7.189 8.494 -8.874 1.00 0.00 H new ATOM 0 HA MET A 20 -8.952 7.156 -7.016 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.935 8.444 -5.395 1.00 0.00 H new ATOM 0 HB3 MET A 20 -6.664 8.100 -6.552 1.00 0.00 H new ATOM 0 HG2 MET A 20 -6.269 10.264 -6.909 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.959 10.595 -7.236 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.641 13.396 -4.979 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.377 12.620 -6.558 1.00 0.00 H new ATOM 0 HE3 MET A 20 -8.010 13.151 -6.089 1.00 0.00 H new ATOM 320 N LYS A 21 -9.906 9.990 -8.358 1.00 0.00 N ATOM 321 CA LYS A 21 -10.878 11.067 -8.494 1.00 0.00 C ATOM 322 C LYS A 21 -12.067 10.567 -9.322 1.00 0.00 C ATOM 323 O LYS A 21 -12.520 11.209 -10.266 1.00 0.00 O ATOM 324 CB LYS A 21 -10.124 12.257 -9.122 1.00 0.00 C ATOM 325 CG LYS A 21 -10.672 13.674 -8.909 1.00 0.00 C ATOM 326 CD LYS A 21 -11.839 14.017 -9.848 1.00 0.00 C ATOM 327 CE LYS A 21 -11.970 15.528 -10.088 1.00 0.00 C ATOM 328 NZ LYS A 21 -12.136 16.290 -8.834 1.00 0.00 N ATOM 0 H LYS A 21 -9.152 10.081 -9.039 1.00 0.00 H new ATOM 0 HA LYS A 21 -11.301 11.394 -7.544 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.102 12.238 -8.743 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.068 12.083 -10.197 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -11.003 13.778 -7.876 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -9.868 14.394 -9.060 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.695 13.511 -10.803 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -12.768 13.637 -9.423 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -11.084 15.887 -10.612 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.824 15.716 -10.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -12.271 17.297 -9.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -12.967 15.934 -8.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -11.288 16.176 -8.243 1.00 0.00 H new ATOM 342 N SER A 22 -12.575 9.397 -8.943 1.00 0.00 N ATOM 343 CA SER A 22 -13.601 8.648 -9.645 1.00 0.00 C ATOM 344 C SER A 22 -13.990 7.468 -8.755 1.00 0.00 C ATOM 345 O SER A 22 -15.163 7.279 -8.446 1.00 0.00 O ATOM 346 CB SER A 22 -13.089 8.201 -11.020 1.00 0.00 C ATOM 347 OG SER A 22 -11.852 7.526 -10.907 1.00 0.00 O ATOM 0 H SER A 22 -12.263 8.926 -8.094 1.00 0.00 H new ATOM 0 HA SER A 22 -14.482 9.261 -9.835 1.00 0.00 H new ATOM 0 HB2 SER A 22 -13.823 7.546 -11.490 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.975 9.069 -11.669 1.00 0.00 H new ATOM 0 HG SER A 22 -11.119 8.168 -11.008 1.00 0.00 H new ATOM 353 N LEU A 23 -12.991 6.729 -8.260 1.00 0.00 N ATOM 354 CA LEU A 23 -13.143 5.650 -7.283 1.00 0.00 C ATOM 355 C LEU A 23 -13.619 6.115 -5.891 1.00 0.00 C ATOM 356 O LEU A 23 -13.226 5.524 -4.884 1.00 0.00 O ATOM 357 CB LEU A 23 -11.791 4.918 -7.161 1.00 0.00 C ATOM 358 CG LEU A 23 -11.508 3.921 -8.288 1.00 0.00 C ATOM 359 CD1 LEU A 23 -10.075 3.407 -8.126 1.00 0.00 C ATOM 360 CD2 LEU A 23 -12.439 2.711 -8.183 1.00 0.00 C ATOM 0 H LEU A 23 -12.021 6.873 -8.540 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.929 4.990 -7.650 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.991 5.658 -7.138 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.763 4.389 -6.209 1.00 0.00 H new ATOM 0 HG LEU A 23 -11.658 4.421 -9.245 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -9.852 2.694 -8.920 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.379 4.244 -8.184 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.972 2.916 -7.158 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.222 2.014 -8.993 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -12.284 2.214 -7.225 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -13.475 3.042 -8.256 1.00 0.00 H new ATOM 372 N GLY A 24 -14.461 7.144 -5.777 1.00 0.00 N ATOM 373 CA GLY A 24 -14.926 7.653 -4.488 1.00 0.00 C ATOM 374 C GLY A 24 -13.849 8.485 -3.784 1.00 0.00 C ATOM 375 O GLY A 24 -14.101 9.625 -3.400 1.00 0.00 O ATOM 0 H GLY A 24 -14.840 7.648 -6.579 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -15.817 8.263 -4.638 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -15.215 6.818 -3.850 1.00 0.00 H new ATOM 379 N VAL A 25 -12.646 7.922 -3.650 1.00 0.00 N ATOM 380 CA VAL A 25 -11.457 8.474 -3.017 1.00 0.00 C ATOM 381 C VAL A 25 -10.864 9.652 -3.805 1.00 0.00 C ATOM 382 O VAL A 25 -9.675 9.682 -4.112 1.00 0.00 O ATOM 383 CB VAL A 25 -10.489 7.295 -2.742 1.00 0.00 C ATOM 384 CG1 VAL A 25 -10.013 6.543 -3.993 1.00 0.00 C ATOM 385 CG2 VAL A 25 -9.288 7.666 -1.872 1.00 0.00 C ATOM 0 H VAL A 25 -12.469 6.986 -4.015 1.00 0.00 H new ATOM 0 HA VAL A 25 -11.698 8.937 -2.060 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.119 6.609 -2.176 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -9.341 5.737 -3.699 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -10.873 6.125 -4.516 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -9.486 7.232 -4.653 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.659 6.788 -1.726 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.710 8.448 -2.364 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.637 8.027 -0.905 1.00 0.00 H new ATOM 395 N GLY A 26 -11.678 10.669 -4.088 1.00 0.00 N ATOM 396 CA GLY A 26 -11.261 11.927 -4.679 1.00 0.00 C ATOM 397 C GLY A 26 -11.052 12.972 -3.590 1.00 0.00 C ATOM 398 O GLY A 26 -11.764 12.993 -2.590 1.00 0.00 O ATOM 0 H GLY A 26 -12.680 10.632 -3.903 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.338 11.786 -5.241 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -12.015 12.273 -5.386 1.00 0.00 H new ATOM 402 N PHE A 27 -10.069 13.845 -3.802 1.00 0.00 N ATOM 403 CA PHE A 27 -9.689 14.934 -2.916 1.00 0.00 C ATOM 404 C PHE A 27 -8.599 15.725 -3.640 1.00 0.00 C ATOM 405 O PHE A 27 -8.144 15.289 -4.694 1.00 0.00 O ATOM 406 CB PHE A 27 -9.246 14.400 -1.541 1.00 0.00 C ATOM 407 CG PHE A 27 -8.537 13.053 -1.520 1.00 0.00 C ATOM 408 CD1 PHE A 27 -7.224 12.928 -2.008 1.00 0.00 C ATOM 409 CD2 PHE A 27 -9.131 11.969 -0.849 1.00 0.00 C ATOM 410 CE1 PHE A 27 -6.493 11.749 -1.783 1.00 0.00 C ATOM 411 CE2 PHE A 27 -8.393 10.800 -0.601 1.00 0.00 C ATOM 412 CZ PHE A 27 -7.079 10.683 -1.076 1.00 0.00 C ATOM 0 H PHE A 27 -9.489 13.806 -4.640 1.00 0.00 H new ATOM 0 HA PHE A 27 -10.531 15.592 -2.700 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -8.585 15.138 -1.088 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -10.128 14.329 -0.905 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -6.775 13.742 -2.558 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -10.159 12.036 -0.523 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -5.482 11.661 -2.153 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -8.839 9.990 -0.043 1.00 0.00 H new ATOM 0 HZ PHE A 27 -6.518 9.777 -0.900 1.00 0.00 H new ATOM 422 N ALA A 28 -8.184 16.879 -3.114 1.00 0.00 N ATOM 423 CA ALA A 28 -7.219 17.746 -3.792 1.00 0.00 C ATOM 424 C ALA A 28 -5.766 17.297 -3.592 1.00 0.00 C ATOM 425 O ALA A 28 -4.848 17.938 -4.089 1.00 0.00 O ATOM 426 CB ALA A 28 -7.415 19.184 -3.304 1.00 0.00 C ATOM 0 H ALA A 28 -8.504 17.236 -2.214 1.00 0.00 H new ATOM 0 HA ALA A 28 -7.407 17.682 -4.864 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -6.700 19.838 -3.803 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.429 19.511 -3.534 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.255 19.228 -2.227 1.00 0.00 H new ATOM 432 N THR A 29 -5.532 16.225 -2.833 1.00 0.00 N ATOM 433 CA THR A 29 -4.204 15.863 -2.366 1.00 0.00 C ATOM 434 C THR A 29 -3.335 15.234 -3.465 1.00 0.00 C ATOM 435 O THR A 29 -2.184 15.623 -3.645 1.00 0.00 O ATOM 436 CB THR A 29 -4.371 14.915 -1.167 1.00 0.00 C ATOM 437 OG1 THR A 29 -5.551 15.261 -0.463 1.00 0.00 O ATOM 438 CG2 THR A 29 -3.168 14.948 -0.221 1.00 0.00 C ATOM 0 H THR A 29 -6.265 15.585 -2.527 1.00 0.00 H new ATOM 0 HA THR A 29 -3.673 16.767 -2.067 1.00 0.00 H new ATOM 0 HB THR A 29 -4.442 13.898 -1.553 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.289 14.688 -0.759 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.338 14.261 0.608 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.271 14.648 -0.763 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.037 15.958 0.166 1.00 0.00 H new ATOM 446 N ARG A 30 -3.840 14.201 -4.149 1.00 0.00 N ATOM 447 CA ARG A 30 -2.984 13.239 -4.847 1.00 0.00 C ATOM 448 C ARG A 30 -2.179 13.870 -5.986 1.00 0.00 C ATOM 449 O ARG A 30 -1.004 13.553 -6.143 1.00 0.00 O ATOM 450 CB ARG A 30 -3.783 12.009 -5.291 1.00 0.00 C ATOM 451 CG ARG A 30 -2.980 10.709 -5.145 1.00 0.00 C ATOM 452 CD ARG A 30 -3.875 9.517 -5.512 1.00 0.00 C ATOM 453 NE ARG A 30 -3.387 8.239 -4.977 1.00 0.00 N ATOM 454 CZ ARG A 30 -3.638 7.776 -3.738 1.00 0.00 C ATOM 455 NH1 ARG A 30 -4.132 8.600 -2.808 1.00 0.00 N ATOM 456 NH2 ARG A 30 -3.395 6.497 -3.431 1.00 0.00 N ATOM 0 H ARG A 30 -4.839 14.011 -4.233 1.00 0.00 H new ATOM 0 HA ARG A 30 -2.238 12.896 -4.130 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -4.696 11.938 -4.699 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -4.086 12.131 -6.331 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -2.104 10.734 -5.793 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -2.617 10.605 -4.123 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -4.882 9.699 -5.138 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -3.946 9.445 -6.597 1.00 0.00 H new ATOM 0 HE ARG A 30 -2.815 7.659 -5.590 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -4.318 9.576 -3.038 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -4.323 8.252 -1.868 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -3.017 5.866 -4.138 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -3.587 6.153 -2.490 1.00 0.00 H new ATOM 470 N GLN A 31 -2.777 14.776 -6.756 1.00 0.00 N ATOM 471 CA GLN A 31 -2.103 15.709 -7.653 1.00 0.00 C ATOM 472 C GLN A 31 -0.767 16.239 -7.106 1.00 0.00 C ATOM 473 O GLN A 31 0.215 16.273 -7.845 1.00 0.00 O ATOM 474 CB GLN A 31 -3.076 16.835 -8.033 1.00 0.00 C ATOM 475 CG GLN A 31 -3.758 17.488 -6.822 1.00 0.00 C ATOM 476 CD GLN A 31 -5.023 18.232 -7.224 1.00 0.00 C ATOM 477 OE1 GLN A 31 -5.090 19.455 -7.155 1.00 0.00 O ATOM 478 NE2 GLN A 31 -6.044 17.493 -7.651 1.00 0.00 N ATOM 0 H GLN A 31 -3.791 14.884 -6.772 1.00 0.00 H new ATOM 0 HA GLN A 31 -1.821 15.163 -8.553 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -2.535 17.599 -8.591 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -3.841 16.435 -8.699 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -4.004 16.723 -6.086 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -3.065 18.180 -6.343 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -5.955 16.478 -7.696 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -6.915 17.942 -7.933 1.00 0.00 H new ATOM 487 N VAL A 32 -0.698 16.608 -5.822 1.00 0.00 N ATOM 488 CA VAL A 32 0.567 16.944 -5.170 1.00 0.00 C ATOM 489 C VAL A 32 1.247 15.648 -4.718 1.00 0.00 C ATOM 490 O VAL A 32 2.424 15.415 -4.989 1.00 0.00 O ATOM 491 CB VAL A 32 0.328 17.899 -3.984 1.00 0.00 C ATOM 492 CG1 VAL A 32 1.646 18.212 -3.261 1.00 0.00 C ATOM 493 CG2 VAL A 32 -0.299 19.218 -4.453 1.00 0.00 C ATOM 0 H VAL A 32 -1.512 16.681 -5.212 1.00 0.00 H new ATOM 0 HA VAL A 32 1.221 17.462 -5.872 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.356 17.396 -3.300 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.452 18.888 -2.428 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.083 17.287 -2.884 1.00 0.00 H new ATOM 0 HG13 VAL A 32 2.340 18.684 -3.957 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -0.456 19.872 -3.595 1.00 0.00 H new ATOM 0 HG22 VAL A 32 0.368 19.706 -5.163 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -1.256 19.015 -4.934 1.00 0.00 H new ATOM 503 N GLY A 33 0.487 14.802 -4.022 1.00 0.00 N ATOM 504 CA GLY A 33 0.901 13.545 -3.420 1.00 0.00 C ATOM 505 C GLY A 33 1.732 12.620 -4.317 1.00 0.00 C ATOM 506 O GLY A 33 2.538 11.839 -3.806 1.00 0.00 O ATOM 0 H GLY A 33 -0.501 14.995 -3.856 1.00 0.00 H new ATOM 0 HA2 GLY A 33 1.479 13.766 -2.523 1.00 0.00 H new ATOM 0 HA3 GLY A 33 0.010 13.006 -3.100 1.00 0.00 H new ATOM 510 N ASN A 34 1.502 12.637 -5.630 1.00 0.00 N ATOM 511 CA ASN A 34 2.271 11.875 -6.612 1.00 0.00 C ATOM 512 C ASN A 34 3.520 12.652 -7.033 1.00 0.00 C ATOM 513 O ASN A 34 4.576 12.063 -7.240 1.00 0.00 O ATOM 514 CB ASN A 34 1.410 11.504 -7.832 1.00 0.00 C ATOM 515 CG ASN A 34 1.285 12.648 -8.833 1.00 0.00 C ATOM 516 OD1 ASN A 34 2.028 12.717 -9.805 1.00 0.00 O ATOM 517 ND2 ASN A 34 0.367 13.569 -8.576 1.00 0.00 N ATOM 0 H ASN A 34 0.758 13.195 -6.049 1.00 0.00 H new ATOM 0 HA ASN A 34 2.589 10.944 -6.144 1.00 0.00 H new ATOM 0 HB2 ASN A 34 1.846 10.637 -8.329 1.00 0.00 H new ATOM 0 HB3 ASN A 34 0.416 11.211 -7.495 1.00 0.00 H new ATOM 0 HD21 ASN A 34 0.261 14.370 -9.198 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -0.233 13.476 -7.756 1.00 0.00 H new ATOM 524 N MET A 35 3.395 13.976 -7.155 1.00 0.00 N ATOM 525 CA MET A 35 4.446 14.848 -7.646 1.00 0.00 C ATOM 526 C MET A 35 5.550 14.976 -6.594 1.00 0.00 C ATOM 527 O MET A 35 6.719 15.136 -6.943 1.00 0.00 O ATOM 528 CB MET A 35 3.830 16.208 -8.017 1.00 0.00 C ATOM 529 CG MET A 35 4.567 16.957 -9.137 1.00 0.00 C ATOM 530 SD MET A 35 6.257 17.527 -8.794 1.00 0.00 S ATOM 531 CE MET A 35 7.206 16.390 -9.837 1.00 0.00 C ATOM 0 H MET A 35 2.540 14.474 -6.908 1.00 0.00 H new ATOM 0 HA MET A 35 4.906 14.430 -8.541 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.795 16.053 -8.321 1.00 0.00 H new ATOM 0 HB3 MET A 35 3.810 16.838 -7.128 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.603 16.306 -10.010 1.00 0.00 H new ATOM 0 HG3 MET A 35 3.968 17.826 -9.411 1.00 0.00 H new ATOM 0 HE1 MET A 35 8.269 16.609 -9.740 1.00 0.00 H new ATOM 0 HE2 MET A 35 7.016 15.364 -9.523 1.00 0.00 H new ATOM 0 HE3 MET A 35 6.904 16.512 -10.877 1.00 0.00 H new ATOM 541 N THR A 36 5.189 14.926 -5.308 1.00 0.00 N ATOM 542 CA THR A 36 6.110 15.083 -4.186 1.00 0.00 C ATOM 543 C THR A 36 6.955 13.810 -3.956 1.00 0.00 C ATOM 544 O THR A 36 7.023 13.282 -2.850 1.00 0.00 O ATOM 545 CB THR A 36 5.326 15.600 -2.959 1.00 0.00 C ATOM 546 OG1 THR A 36 6.194 16.075 -1.952 1.00 0.00 O ATOM 547 CG2 THR A 36 4.362 14.582 -2.344 1.00 0.00 C ATOM 0 H THR A 36 4.224 14.771 -5.015 1.00 0.00 H new ATOM 0 HA THR A 36 6.861 15.841 -4.408 1.00 0.00 H new ATOM 0 HB THR A 36 4.720 16.416 -3.354 1.00 0.00 H new ATOM 0 HG1 THR A 36 6.856 15.385 -1.739 1.00 0.00 H new ATOM 0 HG21 THR A 36 3.856 15.031 -1.489 1.00 0.00 H new ATOM 0 HG22 THR A 36 3.623 14.285 -3.088 1.00 0.00 H new ATOM 0 HG23 THR A 36 4.920 13.705 -2.016 1.00 0.00 H new ATOM 555 N LYS A 37 7.615 13.332 -5.021 1.00 0.00 N ATOM 556 CA LYS A 37 8.593 12.242 -5.051 1.00 0.00 C ATOM 557 C LYS A 37 8.357 11.155 -3.985 1.00 0.00 C ATOM 558 O LYS A 37 9.237 10.914 -3.159 1.00 0.00 O ATOM 559 CB LYS A 37 9.999 12.849 -4.903 1.00 0.00 C ATOM 560 CG LYS A 37 10.318 13.906 -5.971 1.00 0.00 C ATOM 561 CD LYS A 37 11.743 14.462 -5.818 1.00 0.00 C ATOM 562 CE LYS A 37 11.887 15.354 -4.571 1.00 0.00 C ATOM 563 NZ LYS A 37 13.249 15.916 -4.435 1.00 0.00 N ATOM 0 H LYS A 37 7.466 13.728 -5.949 1.00 0.00 H new ATOM 0 HA LYS A 37 8.483 11.730 -6.007 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.090 13.301 -3.915 1.00 0.00 H new ATOM 0 HB3 LYS A 37 10.740 12.051 -4.958 1.00 0.00 H new ATOM 0 HG2 LYS A 37 10.204 13.467 -6.962 1.00 0.00 H new ATOM 0 HG3 LYS A 37 9.600 14.723 -5.900 1.00 0.00 H new ATOM 0 HD2 LYS A 37 12.449 13.634 -5.754 1.00 0.00 H new ATOM 0 HD3 LYS A 37 12.005 15.037 -6.706 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.164 16.168 -4.624 1.00 0.00 H new ATOM 0 HE3 LYS A 37 11.646 14.772 -3.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 13.296 16.509 -3.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 13.938 15.141 -4.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 13.471 16.494 -5.271 1.00 0.00 H new ATOM 577 N PRO A 38 7.189 10.497 -3.967 1.00 0.00 N ATOM 578 CA PRO A 38 6.793 9.691 -2.830 1.00 0.00 C ATOM 579 C PRO A 38 7.578 8.383 -2.754 1.00 0.00 C ATOM 580 O PRO A 38 7.843 7.735 -3.771 1.00 0.00 O ATOM 581 CB PRO A 38 5.295 9.446 -3.007 1.00 0.00 C ATOM 582 CG PRO A 38 5.119 9.494 -4.527 1.00 0.00 C ATOM 583 CD PRO A 38 6.115 10.579 -4.942 1.00 0.00 C ATOM 0 HA PRO A 38 7.006 10.200 -1.890 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.991 8.484 -2.595 1.00 0.00 H new ATOM 0 HB3 PRO A 38 4.699 10.209 -2.507 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.347 8.535 -4.992 1.00 0.00 H new ATOM 0 HG3 PRO A 38 4.098 9.751 -4.809 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.486 10.409 -5.953 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.650 11.565 -4.935 1.00 0.00 H new ATOM 591 N THR A 39 7.908 7.990 -1.524 1.00 0.00 N ATOM 592 CA THR A 39 8.510 6.716 -1.195 1.00 0.00 C ATOM 593 C THR A 39 7.486 5.591 -1.390 1.00 0.00 C ATOM 594 O THR A 39 6.306 5.843 -1.644 1.00 0.00 O ATOM 595 CB THR A 39 8.946 6.788 0.280 1.00 0.00 C ATOM 596 OG1 THR A 39 9.148 8.131 0.669 1.00 0.00 O ATOM 597 CG2 THR A 39 10.239 6.033 0.571 1.00 0.00 C ATOM 0 H THR A 39 7.754 8.578 -0.705 1.00 0.00 H new ATOM 0 HA THR A 39 9.365 6.509 -1.839 1.00 0.00 H new ATOM 0 HB THR A 39 8.137 6.321 0.842 1.00 0.00 H new ATOM 0 HG1 THR A 39 8.471 8.386 1.330 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.485 6.127 1.629 1.00 0.00 H new ATOM 0 HG22 THR A 39 10.110 4.980 0.321 1.00 0.00 H new ATOM 0 HG23 THR A 39 11.048 6.452 -0.028 1.00 0.00 H new ATOM 605 N THR A 40 7.937 4.348 -1.219 1.00 0.00 N ATOM 606 CA THR A 40 7.161 3.199 -0.776 1.00 0.00 C ATOM 607 C THR A 40 8.172 2.183 -0.243 1.00 0.00 C ATOM 608 O THR A 40 8.959 1.648 -1.022 1.00 0.00 O ATOM 609 CB THR A 40 6.326 2.608 -1.925 1.00 0.00 C ATOM 610 OG1 THR A 40 5.246 3.453 -2.260 1.00 0.00 O ATOM 611 CG2 THR A 40 5.676 1.291 -1.531 1.00 0.00 C ATOM 0 H THR A 40 8.912 4.107 -1.398 1.00 0.00 H new ATOM 0 HA THR A 40 6.446 3.484 -0.004 1.00 0.00 H new ATOM 0 HB THR A 40 7.025 2.482 -2.752 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.366 4.324 -1.828 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.095 0.907 -2.370 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.448 0.570 -1.263 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.018 1.451 -0.677 1.00 0.00 H new ATOM 619 N ILE A 41 8.183 1.917 1.065 1.00 0.00 N ATOM 620 CA ILE A 41 9.036 0.864 1.605 1.00 0.00 C ATOM 621 C ILE A 41 8.284 -0.457 1.458 1.00 0.00 C ATOM 622 O ILE A 41 7.080 -0.489 1.722 1.00 0.00 O ATOM 623 CB ILE A 41 9.504 1.167 3.046 1.00 0.00 C ATOM 624 CG1 ILE A 41 8.544 0.620 4.113 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.754 2.672 3.232 1.00 0.00 C ATOM 626 CD1 ILE A 41 8.927 1.029 5.539 1.00 0.00 C ATOM 0 H ILE A 41 7.619 2.409 1.758 1.00 0.00 H new ATOM 0 HA ILE A 41 9.968 0.800 1.044 1.00 0.00 H new ATOM 0 HB ILE A 41 10.447 0.641 3.190 1.00 0.00 H new ATOM 0 HG12 ILE A 41 7.535 0.973 3.900 1.00 0.00 H new ATOM 0 HG13 ILE A 41 8.521 -0.468 4.048 1.00 0.00 H new ATOM 0 HG21 ILE A 41 10.083 2.863 4.254 1.00 0.00 H new ATOM 0 HG22 ILE A 41 10.525 3.002 2.535 1.00 0.00 H new ATOM 0 HG23 ILE A 41 8.832 3.221 3.039 1.00 0.00 H new ATOM 0 HD11 ILE A 41 8.208 0.610 6.243 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.923 0.653 5.770 1.00 0.00 H new ATOM 0 HD13 ILE A 41 8.922 2.116 5.619 1.00 0.00 H new ATOM 638 N ILE A 42 8.973 -1.517 1.023 1.00 0.00 N ATOM 639 CA ILE A 42 8.429 -2.866 0.962 1.00 0.00 C ATOM 640 C ILE A 42 9.358 -3.757 1.788 1.00 0.00 C ATOM 641 O ILE A 42 10.520 -3.918 1.418 1.00 0.00 O ATOM 642 CB ILE A 42 8.355 -3.366 -0.494 1.00 0.00 C ATOM 643 CG1 ILE A 42 7.645 -2.412 -1.473 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.676 -4.740 -0.510 1.00 0.00 C ATOM 645 CD1 ILE A 42 6.133 -2.331 -1.266 1.00 0.00 C ATOM 0 H ILE A 42 9.938 -1.455 0.700 1.00 0.00 H new ATOM 0 HA ILE A 42 7.413 -2.887 1.357 1.00 0.00 H new ATOM 0 HB ILE A 42 9.383 -3.423 -0.853 1.00 0.00 H new ATOM 0 HG12 ILE A 42 8.071 -1.414 -1.367 1.00 0.00 H new ATOM 0 HG13 ILE A 42 7.846 -2.738 -2.494 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.617 -5.105 -1.535 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.256 -5.440 0.092 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.671 -4.654 -0.098 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.703 -1.640 -1.991 1.00 0.00 H new ATOM 0 HD12 ILE A 42 5.694 -3.319 -1.401 1.00 0.00 H new ATOM 0 HD13 ILE A 42 5.922 -1.975 -0.257 1.00 0.00 H new ATOM 657 N GLU A 43 8.873 -4.319 2.897 1.00 0.00 N ATOM 658 CA GLU A 43 9.667 -5.164 3.782 1.00 0.00 C ATOM 659 C GLU A 43 9.046 -6.559 3.834 1.00 0.00 C ATOM 660 O GLU A 43 7.843 -6.688 4.055 1.00 0.00 O ATOM 661 CB GLU A 43 9.731 -4.506 5.164 1.00 0.00 C ATOM 662 CG GLU A 43 10.624 -5.276 6.145 1.00 0.00 C ATOM 663 CD GLU A 43 10.782 -4.515 7.457 1.00 0.00 C ATOM 664 OE1 GLU A 43 9.786 -3.882 7.870 1.00 0.00 O ATOM 665 OE2 GLU A 43 11.903 -4.567 8.007 1.00 0.00 O ATOM 0 H GLU A 43 7.909 -4.197 3.206 1.00 0.00 H new ATOM 0 HA GLU A 43 10.687 -5.271 3.412 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.106 -3.488 5.060 1.00 0.00 H new ATOM 0 HB3 GLU A 43 8.724 -4.435 5.575 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.193 -6.258 6.340 1.00 0.00 H new ATOM 0 HG3 GLU A 43 11.604 -5.441 5.697 1.00 0.00 H new ATOM 672 N VAL A 44 9.851 -7.603 3.607 1.00 0.00 N ATOM 673 CA VAL A 44 9.400 -8.982 3.717 1.00 0.00 C ATOM 674 C VAL A 44 9.419 -9.379 5.189 1.00 0.00 C ATOM 675 O VAL A 44 10.444 -9.800 5.723 1.00 0.00 O ATOM 676 CB VAL A 44 10.246 -9.917 2.839 1.00 0.00 C ATOM 677 CG1 VAL A 44 9.797 -11.373 3.038 1.00 0.00 C ATOM 678 CG2 VAL A 44 10.080 -9.552 1.357 1.00 0.00 C ATOM 0 H VAL A 44 10.832 -7.509 3.342 1.00 0.00 H new ATOM 0 HA VAL A 44 8.380 -9.074 3.345 1.00 0.00 H new ATOM 0 HB VAL A 44 11.291 -9.806 3.129 1.00 0.00 H new ATOM 0 HG11 VAL A 44 10.402 -12.029 2.412 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.922 -11.653 4.084 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.748 -11.472 2.759 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.685 -10.223 0.747 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.032 -9.650 1.073 1.00 0.00 H new ATOM 0 HG23 VAL A 44 10.405 -8.524 1.197 1.00 0.00 H new ATOM 688 N ASN A 45 8.264 -9.277 5.840 1.00 0.00 N ATOM 689 CA ASN A 45 8.060 -9.769 7.191 1.00 0.00 C ATOM 690 C ASN A 45 7.880 -11.293 7.118 1.00 0.00 C ATOM 691 O ASN A 45 6.814 -11.846 7.395 1.00 0.00 O ATOM 692 CB ASN A 45 6.880 -9.008 7.806 1.00 0.00 C ATOM 693 CG ASN A 45 6.622 -9.380 9.265 1.00 0.00 C ATOM 694 OD1 ASN A 45 7.084 -8.708 10.180 1.00 0.00 O ATOM 695 ND2 ASN A 45 5.863 -10.443 9.497 1.00 0.00 N ATOM 0 H ASN A 45 7.434 -8.844 5.435 1.00 0.00 H new ATOM 0 HA ASN A 45 8.911 -9.590 7.848 1.00 0.00 H new ATOM 0 HB2 ASN A 45 7.071 -7.937 7.739 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.982 -9.209 7.222 1.00 0.00 H new ATOM 0 HD21 ASN A 45 5.651 -10.719 10.456 1.00 0.00 H new ATOM 0 HD22 ASN A 45 5.491 -10.984 8.717 1.00 0.00 H new ATOM 702 N GLY A 46 8.951 -11.973 6.701 1.00 0.00 N ATOM 703 CA GLY A 46 9.021 -13.416 6.532 1.00 0.00 C ATOM 704 C GLY A 46 7.973 -13.944 5.549 1.00 0.00 C ATOM 705 O GLY A 46 8.253 -14.107 4.363 1.00 0.00 O ATOM 0 H GLY A 46 9.827 -11.508 6.463 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.015 -13.689 6.179 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.882 -13.899 7.499 1.00 0.00 H new ATOM 709 N ASP A 47 6.780 -14.242 6.069 1.00 0.00 N ATOM 710 CA ASP A 47 5.663 -14.852 5.356 1.00 0.00 C ATOM 711 C ASP A 47 4.626 -13.801 4.921 1.00 0.00 C ATOM 712 O ASP A 47 3.780 -14.063 4.056 1.00 0.00 O ATOM 713 CB ASP A 47 5.052 -15.928 6.261 1.00 0.00 C ATOM 714 CG ASP A 47 3.721 -16.398 5.712 1.00 0.00 C ATOM 715 OD1 ASP A 47 3.716 -17.223 4.771 1.00 0.00 O ATOM 716 OD2 ASP A 47 2.697 -15.813 6.122 1.00 0.00 O ATOM 0 H ASP A 47 6.559 -14.054 7.047 1.00 0.00 H new ATOM 0 HA ASP A 47 6.018 -15.314 4.435 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.736 -16.773 6.342 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.916 -15.530 7.267 1.00 0.00 H new ATOM 721 N THR A 48 4.697 -12.605 5.506 1.00 0.00 N ATOM 722 CA THR A 48 3.954 -11.437 5.074 1.00 0.00 C ATOM 723 C THR A 48 4.944 -10.470 4.426 1.00 0.00 C ATOM 724 O THR A 48 6.142 -10.526 4.694 1.00 0.00 O ATOM 725 CB THR A 48 3.247 -10.808 6.285 1.00 0.00 C ATOM 726 OG1 THR A 48 4.117 -10.765 7.395 1.00 0.00 O ATOM 727 CG2 THR A 48 2.028 -11.626 6.717 1.00 0.00 C ATOM 0 H THR A 48 5.291 -12.425 6.315 1.00 0.00 H new ATOM 0 HA THR A 48 3.185 -11.697 4.347 1.00 0.00 H new ATOM 0 HB THR A 48 2.940 -9.808 5.977 1.00 0.00 H new ATOM 0 HG1 THR A 48 3.823 -11.416 8.066 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.555 -11.149 7.576 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.315 -11.679 5.894 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.344 -12.633 6.990 1.00 0.00 H new ATOM 735 N VAL A 49 4.455 -9.579 3.566 1.00 0.00 N ATOM 736 CA VAL A 49 5.226 -8.469 3.039 1.00 0.00 C ATOM 737 C VAL A 49 4.456 -7.193 3.370 1.00 0.00 C ATOM 738 O VAL A 49 3.294 -7.050 2.994 1.00 0.00 O ATOM 739 CB VAL A 49 5.561 -8.693 1.555 1.00 0.00 C ATOM 740 CG1 VAL A 49 4.345 -8.759 0.624 1.00 0.00 C ATOM 741 CG2 VAL A 49 6.522 -7.608 1.054 1.00 0.00 C ATOM 0 H VAL A 49 3.498 -9.613 3.214 1.00 0.00 H new ATOM 0 HA VAL A 49 6.209 -8.379 3.502 1.00 0.00 H new ATOM 0 HB VAL A 49 6.028 -9.677 1.517 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.680 -8.919 -0.401 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.699 -9.583 0.927 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.791 -7.822 0.683 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.749 -7.781 0.002 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.057 -6.629 1.169 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.444 -7.642 1.635 1.00 0.00 H new ATOM 751 N ILE A 50 5.067 -6.312 4.161 1.00 0.00 N ATOM 752 CA ILE A 50 4.438 -5.101 4.659 1.00 0.00 C ATOM 753 C ILE A 50 4.918 -3.916 3.830 1.00 0.00 C ATOM 754 O ILE A 50 6.090 -3.839 3.452 1.00 0.00 O ATOM 755 CB ILE A 50 4.641 -4.955 6.179 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.811 -3.776 6.717 1.00 0.00 C ATOM 757 CG2 ILE A 50 6.118 -4.810 6.567 1.00 0.00 C ATOM 758 CD1 ILE A 50 3.708 -3.789 8.244 1.00 0.00 C ATOM 0 H ILE A 50 6.030 -6.427 4.476 1.00 0.00 H new ATOM 0 HA ILE A 50 3.356 -5.149 4.536 1.00 0.00 H new ATOM 0 HB ILE A 50 4.290 -5.877 6.642 1.00 0.00 H new ATOM 0 HG12 ILE A 50 4.263 -2.838 6.393 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.810 -3.813 6.287 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.202 -4.711 7.649 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.668 -5.692 6.240 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.535 -3.924 6.088 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.113 -2.938 8.576 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.231 -4.714 8.569 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.706 -3.724 8.677 1.00 0.00 H new ATOM 770 N ILE A 51 3.977 -3.033 3.499 1.00 0.00 N ATOM 771 CA ILE A 51 4.176 -1.870 2.663 1.00 0.00 C ATOM 772 C ILE A 51 3.882 -0.647 3.518 1.00 0.00 C ATOM 773 O ILE A 51 2.836 -0.612 4.166 1.00 0.00 O ATOM 774 CB ILE A 51 3.222 -1.948 1.461 1.00 0.00 C ATOM 775 CG1 ILE A 51 3.529 -3.193 0.611 1.00 0.00 C ATOM 776 CG2 ILE A 51 3.304 -0.674 0.611 1.00 0.00 C ATOM 777 CD1 ILE A 51 2.527 -4.323 0.855 1.00 0.00 C ATOM 0 H ILE A 51 3.015 -3.121 3.826 1.00 0.00 H new ATOM 0 HA ILE A 51 5.195 -1.816 2.280 1.00 0.00 H new ATOM 0 HB ILE A 51 2.203 -2.032 1.839 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.517 -2.922 -0.445 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.535 -3.547 0.838 1.00 0.00 H new ATOM 0 HG21 ILE A 51 2.619 -0.755 -0.233 1.00 0.00 H new ATOM 0 HG22 ILE A 51 3.030 0.188 1.220 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.322 -0.548 0.242 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.786 -5.179 0.232 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.557 -4.615 1.905 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.524 -3.981 0.602 1.00 0.00 H new ATOM 789 N LYS A 52 4.777 0.347 3.493 1.00 0.00 N ATOM 790 CA LYS A 52 4.556 1.653 4.107 1.00 0.00 C ATOM 791 C LYS A 52 4.762 2.704 3.014 1.00 0.00 C ATOM 792 O LYS A 52 5.861 2.814 2.468 1.00 0.00 O ATOM 793 CB LYS A 52 5.507 1.851 5.303 1.00 0.00 C ATOM 794 CG LYS A 52 4.850 2.551 6.504 1.00 0.00 C ATOM 795 CD LYS A 52 5.877 2.847 7.617 1.00 0.00 C ATOM 796 CE LYS A 52 6.325 1.591 8.393 1.00 0.00 C ATOM 797 NZ LYS A 52 5.560 1.385 9.640 1.00 0.00 N ATOM 0 H LYS A 52 5.686 0.262 3.039 1.00 0.00 H new ATOM 0 HA LYS A 52 3.546 1.742 4.508 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.884 0.879 5.621 1.00 0.00 H new ATOM 0 HB3 LYS A 52 6.368 2.436 4.979 1.00 0.00 H new ATOM 0 HG2 LYS A 52 4.389 3.483 6.176 1.00 0.00 H new ATOM 0 HG3 LYS A 52 4.052 1.923 6.901 1.00 0.00 H new ATOM 0 HD2 LYS A 52 6.753 3.322 7.175 1.00 0.00 H new ATOM 0 HD3 LYS A 52 5.445 3.562 8.317 1.00 0.00 H new ATOM 0 HE2 LYS A 52 6.212 0.715 7.754 1.00 0.00 H new ATOM 0 HE3 LYS A 52 7.385 1.676 8.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 5.300 0.382 9.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 6.143 1.663 10.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 4.697 1.965 9.618 1.00 0.00 H new ATOM 811 N THR A 53 3.709 3.448 2.662 1.00 0.00 N ATOM 812 CA THR A 53 3.767 4.412 1.569 1.00 0.00 C ATOM 813 C THR A 53 4.744 5.542 1.903 1.00 0.00 C ATOM 814 O THR A 53 5.582 5.892 1.081 1.00 0.00 O ATOM 815 CB THR A 53 2.359 4.933 1.249 1.00 0.00 C ATOM 816 OG1 THR A 53 1.501 3.826 1.065 1.00 0.00 O ATOM 817 CG2 THR A 53 2.344 5.792 -0.019 1.00 0.00 C ATOM 0 H THR A 53 2.801 3.397 3.125 1.00 0.00 H new ATOM 0 HA THR A 53 4.144 3.920 0.672 1.00 0.00 H new ATOM 0 HB THR A 53 2.027 5.556 2.079 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.668 3.972 1.560 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.329 6.141 -0.210 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.003 6.650 0.115 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.689 5.198 -0.865 1.00 0.00 H new ATOM 825 N GLN A 54 4.644 6.090 3.118 1.00 0.00 N ATOM 826 CA GLN A 54 5.628 7.011 3.670 1.00 0.00 C ATOM 827 C GLN A 54 5.852 8.241 2.774 1.00 0.00 C ATOM 828 O GLN A 54 6.861 8.355 2.076 1.00 0.00 O ATOM 829 CB GLN A 54 6.911 6.225 3.983 1.00 0.00 C ATOM 830 CG GLN A 54 7.974 7.038 4.727 1.00 0.00 C ATOM 831 CD GLN A 54 9.156 6.147 5.093 1.00 0.00 C ATOM 832 OE1 GLN A 54 10.076 5.966 4.304 1.00 0.00 O ATOM 833 NE2 GLN A 54 9.135 5.567 6.290 1.00 0.00 N ATOM 0 H GLN A 54 3.866 5.901 3.749 1.00 0.00 H new ATOM 0 HA GLN A 54 5.253 7.434 4.602 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.653 5.351 4.581 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.337 5.858 3.049 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.312 7.866 4.103 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.544 7.474 5.629 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.355 5.737 6.925 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.899 4.952 6.572 1.00 0.00 H new ATOM 842 N SER A 55 4.927 9.202 2.841 1.00 0.00 N ATOM 843 CA SER A 55 5.150 10.559 2.369 1.00 0.00 C ATOM 844 C SER A 55 4.340 11.516 3.240 1.00 0.00 C ATOM 845 O SER A 55 3.289 11.128 3.753 1.00 0.00 O ATOM 846 CB SER A 55 4.790 10.690 0.888 1.00 0.00 C ATOM 847 OG SER A 55 5.067 12.008 0.448 1.00 0.00 O ATOM 0 H SER A 55 3.996 9.052 3.229 1.00 0.00 H new ATOM 0 HA SER A 55 6.207 10.813 2.453 1.00 0.00 H new ATOM 0 HB2 SER A 55 5.361 9.972 0.299 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.735 10.459 0.738 1.00 0.00 H new ATOM 0 HG SER A 55 4.838 12.091 -0.501 1.00 0.00 H new ATOM 853 N THR A 56 4.870 12.735 3.394 1.00 0.00 N ATOM 854 CA THR A 56 4.420 13.836 4.244 1.00 0.00 C ATOM 855 C THR A 56 3.026 13.638 4.850 1.00 0.00 C ATOM 856 O THR A 56 2.899 13.181 5.983 1.00 0.00 O ATOM 857 CB THR A 56 4.491 15.142 3.435 1.00 0.00 C ATOM 858 OG1 THR A 56 3.776 14.988 2.221 1.00 0.00 O ATOM 859 CG2 THR A 56 5.932 15.544 3.107 1.00 0.00 C ATOM 0 H THR A 56 5.707 12.998 2.874 1.00 0.00 H new ATOM 0 HA THR A 56 5.090 13.876 5.103 1.00 0.00 H new ATOM 0 HB THR A 56 4.051 15.927 4.050 1.00 0.00 H new ATOM 0 HG1 THR A 56 3.820 15.821 1.707 1.00 0.00 H new ATOM 0 HG21 THR A 56 5.930 16.472 2.535 1.00 0.00 H new ATOM 0 HG22 THR A 56 6.489 15.690 4.033 1.00 0.00 H new ATOM 0 HG23 THR A 56 6.405 14.757 2.519 1.00 0.00 H new ATOM 867 N PHE A 57 1.993 14.007 4.088 1.00 0.00 N ATOM 868 CA PHE A 57 0.591 13.858 4.453 1.00 0.00 C ATOM 869 C PHE A 57 -0.069 12.929 3.433 1.00 0.00 C ATOM 870 O PHE A 57 -1.130 13.225 2.887 1.00 0.00 O ATOM 871 CB PHE A 57 -0.064 15.246 4.523 1.00 0.00 C ATOM 872 CG PHE A 57 -1.386 15.284 5.267 1.00 0.00 C ATOM 873 CD1 PHE A 57 -1.397 15.250 6.673 1.00 0.00 C ATOM 874 CD2 PHE A 57 -2.601 15.377 4.563 1.00 0.00 C ATOM 875 CE1 PHE A 57 -2.614 15.318 7.372 1.00 0.00 C ATOM 876 CE2 PHE A 57 -3.818 15.446 5.263 1.00 0.00 C ATOM 877 CZ PHE A 57 -3.825 15.421 6.667 1.00 0.00 C ATOM 0 H PHE A 57 2.119 14.432 3.169 1.00 0.00 H new ATOM 0 HA PHE A 57 0.473 13.408 5.439 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.629 15.936 5.004 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.223 15.610 3.508 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.467 15.171 7.217 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -2.598 15.395 3.483 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -2.619 15.291 8.452 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -4.749 15.518 4.720 1.00 0.00 H new ATOM 0 HZ PHE A 57 -4.760 15.481 7.204 1.00 0.00 H new ATOM 887 N LYS A 58 0.598 11.810 3.137 1.00 0.00 N ATOM 888 CA LYS A 58 0.103 10.794 2.225 1.00 0.00 C ATOM 889 C LYS A 58 0.829 9.483 2.529 1.00 0.00 C ATOM 890 O LYS A 58 1.448 8.870 1.656 1.00 0.00 O ATOM 891 CB LYS A 58 0.295 11.256 0.774 1.00 0.00 C ATOM 892 CG LYS A 58 -0.514 10.378 -0.194 1.00 0.00 C ATOM 893 CD LYS A 58 0.159 10.333 -1.569 1.00 0.00 C ATOM 894 CE LYS A 58 1.348 9.360 -1.566 1.00 0.00 C ATOM 895 NZ LYS A 58 2.087 9.399 -2.840 1.00 0.00 N ATOM 0 H LYS A 58 1.511 11.588 3.534 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.966 10.631 2.360 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -0.017 12.296 0.675 1.00 0.00 H new ATOM 0 HB3 LYS A 58 1.352 11.214 0.512 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -0.601 9.369 0.208 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -1.526 10.771 -0.291 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -0.566 10.026 -2.323 1.00 0.00 H new ATOM 0 HD3 LYS A 58 0.501 11.331 -1.844 1.00 0.00 H new ATOM 0 HE2 LYS A 58 2.022 9.611 -0.747 1.00 0.00 H new ATOM 0 HE3 LYS A 58 0.989 8.347 -1.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 2.807 8.648 -2.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 1.426 9.252 -3.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 2.550 10.324 -2.944 1.00 0.00 H new ATOM 909 N ASN A 59 0.748 9.066 3.790 1.00 0.00 N ATOM 910 CA ASN A 59 1.301 7.831 4.311 1.00 0.00 C ATOM 911 C ASN A 59 0.153 6.885 4.665 1.00 0.00 C ATOM 912 O ASN A 59 -0.875 7.306 5.184 1.00 0.00 O ATOM 913 CB ASN A 59 2.214 8.113 5.515 1.00 0.00 C ATOM 914 CG ASN A 59 1.609 9.023 6.587 1.00 0.00 C ATOM 915 OD1 ASN A 59 0.535 9.595 6.426 1.00 0.00 O ATOM 916 ND2 ASN A 59 2.328 9.199 7.690 1.00 0.00 N ATOM 0 H ASN A 59 0.270 9.612 4.507 1.00 0.00 H new ATOM 0 HA ASN A 59 1.922 7.351 3.555 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.485 7.163 5.977 1.00 0.00 H new ATOM 0 HB3 ASN A 59 3.137 8.566 5.154 1.00 0.00 H new ATOM 0 HD21 ASN A 59 1.990 9.820 8.425 1.00 0.00 H new ATOM 0 HD22 ASN A 59 3.218 8.713 7.802 1.00 0.00 H new ATOM 923 N THR A 60 0.334 5.602 4.359 1.00 0.00 N ATOM 924 CA THR A 60 -0.546 4.502 4.718 1.00 0.00 C ATOM 925 C THR A 60 0.379 3.305 4.939 1.00 0.00 C ATOM 926 O THR A 60 1.529 3.340 4.484 1.00 0.00 O ATOM 927 CB THR A 60 -1.579 4.216 3.610 1.00 0.00 C ATOM 928 OG1 THR A 60 -0.937 4.075 2.353 1.00 0.00 O ATOM 929 CG2 THR A 60 -2.653 5.309 3.521 1.00 0.00 C ATOM 0 H THR A 60 1.144 5.289 3.824 1.00 0.00 H new ATOM 0 HA THR A 60 -1.132 4.732 5.608 1.00 0.00 H new ATOM 0 HB THR A 60 -2.074 3.282 3.874 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.607 3.892 1.662 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.357 5.063 2.726 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.185 5.375 4.470 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.180 6.267 3.303 1.00 0.00 H new ATOM 937 N GLU A 61 -0.108 2.283 5.647 1.00 0.00 N ATOM 938 CA GLU A 61 0.640 1.086 5.980 1.00 0.00 C ATOM 939 C GLU A 61 -0.294 -0.106 5.815 1.00 0.00 C ATOM 940 O GLU A 61 -1.409 -0.061 6.333 1.00 0.00 O ATOM 941 CB GLU A 61 1.172 1.219 7.410 1.00 0.00 C ATOM 942 CG GLU A 61 2.052 0.026 7.815 1.00 0.00 C ATOM 943 CD GLU A 61 2.987 0.353 8.966 1.00 0.00 C ATOM 944 OE1 GLU A 61 3.005 1.523 9.412 1.00 0.00 O ATOM 945 OE2 GLU A 61 3.840 -0.495 9.308 1.00 0.00 O ATOM 0 H GLU A 61 -1.061 2.273 6.011 1.00 0.00 H new ATOM 0 HA GLU A 61 1.499 0.943 5.325 1.00 0.00 H new ATOM 0 HB2 GLU A 61 1.749 2.140 7.497 1.00 0.00 H new ATOM 0 HB3 GLU A 61 0.334 1.301 8.102 1.00 0.00 H new ATOM 0 HG2 GLU A 61 1.414 -0.812 8.097 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.639 -0.296 6.955 1.00 0.00 H new ATOM 952 N ILE A 62 0.126 -1.127 5.060 1.00 0.00 N ATOM 953 CA ILE A 62 -0.709 -2.276 4.717 1.00 0.00 C ATOM 954 C ILE A 62 0.155 -3.542 4.681 1.00 0.00 C ATOM 955 O ILE A 62 1.254 -3.532 4.125 1.00 0.00 O ATOM 956 CB ILE A 62 -1.484 -2.024 3.401 1.00 0.00 C ATOM 957 CG1 ILE A 62 -0.546 -1.726 2.216 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.513 -0.898 3.585 1.00 0.00 C ATOM 959 CD1 ILE A 62 -1.275 -1.232 0.962 1.00 0.00 C ATOM 0 H ILE A 62 1.066 -1.176 4.667 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.470 -2.424 5.483 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.015 -2.945 3.159 1.00 0.00 H new ATOM 0 HG12 ILE A 62 0.183 -0.975 2.521 1.00 0.00 H new ATOM 0 HG13 ILE A 62 0.011 -2.630 1.969 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -3.047 -0.736 2.649 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -3.223 -1.177 4.364 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.000 0.020 3.873 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -0.550 -1.043 0.170 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.984 -1.991 0.631 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -1.810 -0.310 1.191 1.00 0.00 H new ATOM 971 N SER A 63 -0.318 -4.615 5.323 1.00 0.00 N ATOM 972 CA SER A 63 0.413 -5.850 5.558 1.00 0.00 C ATOM 973 C SER A 63 -0.114 -6.953 4.637 1.00 0.00 C ATOM 974 O SER A 63 -1.140 -7.558 4.945 1.00 0.00 O ATOM 975 CB SER A 63 0.207 -6.223 7.030 1.00 0.00 C ATOM 976 OG SER A 63 -1.179 -6.205 7.316 1.00 0.00 O ATOM 0 H SER A 63 -1.263 -4.641 5.707 1.00 0.00 H new ATOM 0 HA SER A 63 1.475 -5.726 5.345 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.621 -7.211 7.230 1.00 0.00 H new ATOM 0 HB3 SER A 63 0.734 -5.520 7.675 1.00 0.00 H new ATOM 0 HG SER A 63 -1.669 -6.636 6.585 1.00 0.00 H new ATOM 982 N PHE A 64 0.568 -7.231 3.524 1.00 0.00 N ATOM 983 CA PHE A 64 0.116 -8.228 2.568 1.00 0.00 C ATOM 984 C PHE A 64 0.583 -9.615 2.993 1.00 0.00 C ATOM 985 O PHE A 64 1.766 -9.926 2.859 1.00 0.00 O ATOM 986 CB PHE A 64 0.675 -7.922 1.174 1.00 0.00 C ATOM 987 CG PHE A 64 0.135 -6.718 0.418 1.00 0.00 C ATOM 988 CD1 PHE A 64 -0.774 -5.811 0.997 1.00 0.00 C ATOM 989 CD2 PHE A 64 0.498 -6.567 -0.932 1.00 0.00 C ATOM 990 CE1 PHE A 64 -1.338 -4.789 0.219 1.00 0.00 C ATOM 991 CE2 PHE A 64 -0.037 -5.522 -1.701 1.00 0.00 C ATOM 992 CZ PHE A 64 -0.931 -4.615 -1.114 1.00 0.00 C ATOM 0 H PHE A 64 1.442 -6.772 3.267 1.00 0.00 H new ATOM 0 HA PHE A 64 -0.973 -8.201 2.538 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.753 -7.795 1.271 1.00 0.00 H new ATOM 0 HB3 PHE A 64 0.513 -8.802 0.552 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.037 -5.902 2.041 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.194 -7.261 -1.381 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.085 -4.136 0.645 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.239 -5.417 -2.740 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.307 -3.781 -1.688 1.00 0.00 H new ATOM 1002 N LYS A 65 -0.330 -10.488 3.423 1.00 0.00 N ATOM 1003 CA LYS A 65 -0.012 -11.909 3.459 1.00 0.00 C ATOM 1004 C LYS A 65 -0.093 -12.446 2.032 1.00 0.00 C ATOM 1005 O LYS A 65 -1.172 -12.767 1.536 1.00 0.00 O ATOM 1006 CB LYS A 65 -0.873 -12.676 4.478 1.00 0.00 C ATOM 1007 CG LYS A 65 -0.208 -14.004 4.895 1.00 0.00 C ATOM 1008 CD LYS A 65 -0.496 -15.168 3.930 1.00 0.00 C ATOM 1009 CE LYS A 65 0.523 -16.308 4.046 1.00 0.00 C ATOM 1010 NZ LYS A 65 1.852 -15.950 3.504 1.00 0.00 N ATOM 0 H LYS A 65 -1.267 -10.243 3.742 1.00 0.00 H new ATOM 0 HA LYS A 65 1.004 -12.062 3.822 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.034 -12.056 5.360 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.854 -12.879 4.048 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.870 -13.856 4.961 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.554 -14.276 5.892 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.494 -15.559 4.128 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.498 -14.792 2.907 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.627 -16.590 5.094 1.00 0.00 H new ATOM 0 HE3 LYS A 65 0.144 -17.182 3.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.499 -16.758 3.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 1.762 -15.707 2.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 2.231 -15.133 4.025 1.00 0.00 H new ATOM 1024 N LEU A 66 1.063 -12.553 1.374 1.00 0.00 N ATOM 1025 CA LEU A 66 1.164 -13.239 0.101 1.00 0.00 C ATOM 1026 C LEU A 66 0.596 -14.658 0.227 1.00 0.00 C ATOM 1027 O LEU A 66 1.161 -15.499 0.929 1.00 0.00 O ATOM 1028 CB LEU A 66 2.609 -13.214 -0.423 1.00 0.00 C ATOM 1029 CG LEU A 66 3.664 -13.773 0.556 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.383 -14.978 -0.065 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.695 -12.708 0.956 1.00 0.00 C ATOM 0 H LEU A 66 1.945 -12.167 1.712 1.00 0.00 H new ATOM 0 HA LEU A 66 0.564 -12.716 -0.643 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.654 -13.787 -1.349 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.873 -12.186 -0.671 1.00 0.00 H new ATOM 0 HG LEU A 66 3.135 -14.086 1.456 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.124 -15.361 0.637 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.657 -15.759 -0.289 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.880 -14.671 -0.985 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.419 -13.143 1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.212 -12.350 0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.187 -11.874 1.441 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.549 -14.889 -0.415 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.230 -16.171 -0.519 1.00 0.00 C ATOM 1045 C GLY A 67 -2.547 -16.217 0.261 1.00 0.00 C ATOM 1046 O GLY A 67 -2.997 -17.307 0.602 1.00 0.00 O ATOM 0 H GLY A 67 -1.050 -14.145 -0.901 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.429 -16.386 -1.569 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.570 -16.957 -0.152 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.171 -15.066 0.547 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.405 -14.973 1.326 1.00 0.00 C ATOM 1052 C VAL A 68 -5.221 -13.767 0.845 1.00 0.00 C ATOM 1053 O VAL A 68 -4.669 -12.856 0.221 1.00 0.00 O ATOM 1054 CB VAL A 68 -4.053 -14.918 2.834 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -5.018 -14.132 3.735 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -3.948 -16.339 3.410 1.00 0.00 C ATOM 0 H VAL A 68 -2.823 -14.159 0.236 1.00 0.00 H new ATOM 0 HA VAL A 68 -5.031 -15.853 1.179 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.106 -14.378 2.848 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.664 -14.167 4.765 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.064 -13.095 3.402 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.012 -14.575 3.678 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.700 -16.285 4.470 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.901 -16.853 3.286 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.168 -16.889 2.883 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.527 -13.787 1.152 1.00 0.00 N ATOM 1067 CA GLU A 69 -7.438 -12.656 1.053 1.00 0.00 C ATOM 1068 C GLU A 69 -7.660 -12.091 2.458 1.00 0.00 C ATOM 1069 O GLU A 69 -8.068 -12.833 3.349 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.747 -13.075 0.359 1.00 0.00 C ATOM 1071 CG GLU A 69 -9.590 -11.852 -0.034 1.00 0.00 C ATOM 1072 CD GLU A 69 -10.903 -12.235 -0.708 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -11.757 -12.817 -0.005 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -11.085 -11.893 -1.897 1.00 0.00 O ATOM 0 H GLU A 69 -6.988 -14.632 1.490 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.010 -11.868 0.433 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.517 -13.661 -0.531 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.324 -13.718 1.024 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.802 -11.261 0.857 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.012 -11.218 -0.707 1.00 0.00 H new ATOM 1081 N PHE A 70 -7.349 -10.808 2.668 1.00 0.00 N ATOM 1082 CA PHE A 70 -7.439 -10.125 3.956 1.00 0.00 C ATOM 1083 C PHE A 70 -8.154 -8.786 3.772 1.00 0.00 C ATOM 1084 O PHE A 70 -8.185 -8.251 2.666 1.00 0.00 O ATOM 1085 CB PHE A 70 -6.031 -9.938 4.548 1.00 0.00 C ATOM 1086 CG PHE A 70 -5.036 -9.252 3.630 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -4.339 -9.998 2.663 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -4.842 -7.860 3.706 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -3.521 -9.349 1.728 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -4.033 -7.207 2.763 1.00 0.00 C ATOM 1091 CZ PHE A 70 -3.409 -7.949 1.746 1.00 0.00 C ATOM 0 H PHE A 70 -7.017 -10.199 1.920 1.00 0.00 H new ATOM 0 HA PHE A 70 -8.017 -10.727 4.657 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.114 -9.359 5.468 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.635 -10.916 4.822 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.434 -11.074 2.641 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.317 -7.292 4.492 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.977 -9.925 0.994 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -3.891 -6.138 2.819 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.843 -7.443 0.978 1.00 0.00 H new ATOM 1101 N ASP A 71 -8.761 -8.263 4.841 1.00 0.00 N ATOM 1102 CA ASP A 71 -9.489 -6.998 4.804 1.00 0.00 C ATOM 1103 C ASP A 71 -8.516 -5.844 4.522 1.00 0.00 C ATOM 1104 O ASP A 71 -7.340 -5.942 4.870 1.00 0.00 O ATOM 1105 CB ASP A 71 -10.250 -6.814 6.122 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.349 -5.773 5.987 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -11.022 -4.575 6.103 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -12.507 -6.197 5.783 1.00 0.00 O ATOM 0 H ASP A 71 -8.759 -8.709 5.758 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.221 -7.004 3.996 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -10.684 -7.766 6.429 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -9.555 -6.512 6.906 1.00 0.00 H new ATOM 1113 N GLU A 72 -8.976 -4.794 3.840 1.00 0.00 N ATOM 1114 CA GLU A 72 -8.148 -3.738 3.270 1.00 0.00 C ATOM 1115 C GLU A 72 -8.864 -2.400 3.450 1.00 0.00 C ATOM 1116 O GLU A 72 -10.086 -2.378 3.595 1.00 0.00 O ATOM 1117 CB GLU A 72 -7.923 -4.084 1.790 1.00 0.00 C ATOM 1118 CG GLU A 72 -7.167 -3.023 0.978 1.00 0.00 C ATOM 1119 CD GLU A 72 -5.761 -2.855 1.515 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -5.628 -2.016 2.432 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -4.881 -3.600 1.022 1.00 0.00 O ATOM 0 H GLU A 72 -9.971 -4.654 3.665 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.180 -3.658 3.764 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -7.372 -5.023 1.733 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -8.893 -4.254 1.322 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -7.130 -3.316 -0.071 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -7.698 -2.072 1.025 1.00 0.00 H new ATOM 1128 N THR A 73 -8.129 -1.284 3.419 1.00 0.00 N ATOM 1129 CA THR A 73 -8.684 0.041 3.684 1.00 0.00 C ATOM 1130 C THR A 73 -8.285 1.030 2.588 1.00 0.00 C ATOM 1131 O THR A 73 -7.101 1.300 2.399 1.00 0.00 O ATOM 1132 CB THR A 73 -8.232 0.521 5.069 1.00 0.00 C ATOM 1133 OG1 THR A 73 -8.459 -0.491 6.027 1.00 0.00 O ATOM 1134 CG2 THR A 73 -9.021 1.755 5.515 1.00 0.00 C ATOM 0 H THR A 73 -7.131 -1.277 3.209 1.00 0.00 H new ATOM 0 HA THR A 73 -9.772 -0.020 3.678 1.00 0.00 H new ATOM 0 HB THR A 73 -7.172 0.765 4.996 1.00 0.00 H new ATOM 0 HG1 THR A 73 -8.167 -0.178 6.909 1.00 0.00 H new ATOM 0 HG21 THR A 73 -8.677 2.070 6.500 1.00 0.00 H new ATOM 0 HG22 THR A 73 -8.866 2.564 4.801 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.082 1.511 5.562 1.00 0.00 H new ATOM 1142 N THR A 74 -9.272 1.599 1.888 1.00 0.00 N ATOM 1143 CA THR A 74 -9.052 2.635 0.885 1.00 0.00 C ATOM 1144 C THR A 74 -9.260 4.006 1.541 1.00 0.00 C ATOM 1145 O THR A 74 -10.030 4.128 2.491 1.00 0.00 O ATOM 1146 CB THR A 74 -9.979 2.422 -0.326 1.00 0.00 C ATOM 1147 OG1 THR A 74 -10.383 1.072 -0.455 1.00 0.00 O ATOM 1148 CG2 THR A 74 -9.268 2.827 -1.619 1.00 0.00 C ATOM 0 H THR A 74 -10.254 1.348 2.006 1.00 0.00 H new ATOM 0 HA THR A 74 -8.031 2.583 0.507 1.00 0.00 H new ATOM 0 HB THR A 74 -10.859 3.043 -0.157 1.00 0.00 H new ATOM 0 HG1 THR A 74 -11.029 0.855 0.249 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.936 2.671 -2.466 1.00 0.00 H new ATOM 0 HG22 THR A 74 -8.989 3.879 -1.566 1.00 0.00 H new ATOM 0 HG23 THR A 74 -8.372 2.220 -1.747 1.00 0.00 H new ATOM 1156 N ALA A 75 -8.569 5.046 1.057 1.00 0.00 N ATOM 1157 CA ALA A 75 -8.446 6.324 1.762 1.00 0.00 C ATOM 1158 C ALA A 75 -9.710 7.202 1.727 1.00 0.00 C ATOM 1159 O ALA A 75 -9.634 8.385 2.052 1.00 0.00 O ATOM 1160 CB ALA A 75 -7.221 7.081 1.235 1.00 0.00 C ATOM 0 H ALA A 75 -8.079 5.023 0.163 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.314 6.086 2.817 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.128 8.032 1.759 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.324 6.485 1.404 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.339 7.265 0.167 1.00 0.00 H new ATOM 1166 N ASP A 76 -10.861 6.641 1.349 1.00 0.00 N ATOM 1167 CA ASP A 76 -12.201 7.187 1.546 1.00 0.00 C ATOM 1168 C ASP A 76 -12.931 6.409 2.654 1.00 0.00 C ATOM 1169 O ASP A 76 -14.142 6.546 2.810 1.00 0.00 O ATOM 1170 CB ASP A 76 -12.980 7.077 0.226 1.00 0.00 C ATOM 1171 CG ASP A 76 -12.928 5.692 -0.405 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -12.421 4.763 0.268 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -13.337 5.587 -1.584 1.00 0.00 O ATOM 0 H ASP A 76 -10.881 5.741 0.869 1.00 0.00 H new ATOM 0 HA ASP A 76 -12.131 8.232 1.847 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -14.021 7.345 0.406 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -12.581 7.804 -0.482 1.00 0.00 H new ATOM 1178 N ASP A 77 -12.195 5.573 3.395 1.00 0.00 N ATOM 1179 CA ASP A 77 -12.699 4.598 4.347 1.00 0.00 C ATOM 1180 C ASP A 77 -13.640 3.588 3.686 1.00 0.00 C ATOM 1181 O ASP A 77 -14.454 2.948 4.353 1.00 0.00 O ATOM 1182 CB ASP A 77 -13.280 5.269 5.601 1.00 0.00 C ATOM 1183 CG ASP A 77 -13.495 4.276 6.742 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -12.614 3.406 6.920 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -14.519 4.429 7.444 1.00 0.00 O ATOM 0 H ASP A 77 -11.177 5.564 3.337 1.00 0.00 H new ATOM 0 HA ASP A 77 -11.852 4.011 4.702 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -12.607 6.060 5.932 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -14.229 5.743 5.350 1.00 0.00 H new ATOM 1190 N ARG A 78 -13.489 3.343 2.376 1.00 0.00 N ATOM 1191 CA ARG A 78 -13.969 2.076 1.864 1.00 0.00 C ATOM 1192 C ARG A 78 -13.063 0.997 2.436 1.00 0.00 C ATOM 1193 O ARG A 78 -11.959 0.768 1.936 1.00 0.00 O ATOM 1194 CB ARG A 78 -13.995 2.011 0.336 1.00 0.00 C ATOM 1195 CG ARG A 78 -15.179 2.799 -0.230 1.00 0.00 C ATOM 1196 CD ARG A 78 -15.289 2.623 -1.750 1.00 0.00 C ATOM 1197 NE ARG A 78 -14.154 3.262 -2.430 1.00 0.00 N ATOM 1198 CZ ARG A 78 -13.054 2.679 -2.915 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -12.815 1.383 -2.695 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -12.201 3.412 -3.628 1.00 0.00 N ATOM 0 H ARG A 78 -13.063 3.972 1.695 1.00 0.00 H new ATOM 0 HA ARG A 78 -15.006 1.936 2.171 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -13.063 2.412 -0.064 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -14.059 0.972 0.014 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -16.101 2.465 0.245 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -15.063 3.856 0.009 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -15.317 1.562 -1.997 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -16.224 3.058 -2.105 1.00 0.00 H new ATOM 0 HE ARG A 78 -14.213 4.274 -2.546 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -13.476 0.828 -2.152 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -11.972 0.949 -3.070 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.393 4.400 -3.795 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -11.355 2.986 -4.007 1.00 0.00 H new ATOM 1214 N LYS A 79 -13.559 0.328 3.474 1.00 0.00 N ATOM 1215 CA LYS A 79 -13.182 -1.038 3.770 1.00 0.00 C ATOM 1216 C LYS A 79 -13.428 -1.862 2.501 1.00 0.00 C ATOM 1217 O LYS A 79 -14.529 -1.830 1.951 1.00 0.00 O ATOM 1218 CB LYS A 79 -14.047 -1.559 4.922 1.00 0.00 C ATOM 1219 CG LYS A 79 -13.585 -2.942 5.406 1.00 0.00 C ATOM 1220 CD LYS A 79 -14.765 -3.774 5.920 1.00 0.00 C ATOM 1221 CE LYS A 79 -15.451 -3.113 7.119 1.00 0.00 C ATOM 1222 NZ LYS A 79 -16.555 -3.945 7.629 1.00 0.00 N ATOM 0 H LYS A 79 -14.233 0.724 4.129 1.00 0.00 H new ATOM 0 HA LYS A 79 -12.136 -1.108 4.068 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -14.010 -0.853 5.752 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -15.086 -1.616 4.598 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.093 -3.470 4.589 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.847 -2.824 6.200 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -15.490 -3.911 5.117 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.413 -4.766 6.204 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -14.722 -2.947 7.912 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -15.834 -2.135 6.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -17.000 -3.471 8.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -17.261 -4.083 6.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -16.184 -4.869 7.929 1.00 0.00 H new ATOM 1236 N VAL A 80 -12.409 -2.570 2.027 1.00 0.00 N ATOM 1237 CA VAL A 80 -12.467 -3.479 0.891 1.00 0.00 C ATOM 1238 C VAL A 80 -11.710 -4.735 1.326 1.00 0.00 C ATOM 1239 O VAL A 80 -11.427 -4.881 2.515 1.00 0.00 O ATOM 1240 CB VAL A 80 -11.889 -2.786 -0.360 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -12.571 -1.433 -0.585 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -10.377 -2.549 -0.287 1.00 0.00 C ATOM 0 H VAL A 80 -11.479 -2.523 2.444 1.00 0.00 H new ATOM 0 HA VAL A 80 -13.481 -3.761 0.608 1.00 0.00 H new ATOM 0 HB VAL A 80 -12.083 -3.470 -1.187 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -12.152 -0.957 -1.471 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -13.641 -1.584 -0.726 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -12.406 -0.794 0.282 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -10.041 -2.058 -1.201 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -10.149 -1.915 0.570 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -9.864 -3.504 -0.179 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.346 -5.633 0.408 1.00 0.00 N ATOM 1253 CA LYS A 81 -10.463 -6.737 0.757 1.00 0.00 C ATOM 1254 C LYS A 81 -9.442 -6.990 -0.350 1.00 0.00 C ATOM 1255 O LYS A 81 -9.739 -6.822 -1.530 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.274 -7.970 1.168 1.00 0.00 C ATOM 1257 CG LYS A 81 -11.922 -8.698 -0.014 1.00 0.00 C ATOM 1258 CD LYS A 81 -13.018 -9.686 0.420 1.00 0.00 C ATOM 1259 CE LYS A 81 -12.699 -10.424 1.734 1.00 0.00 C ATOM 1260 NZ LYS A 81 -13.321 -11.761 1.792 1.00 0.00 N ATOM 0 H LYS A 81 -11.646 -5.615 -0.567 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.874 -6.469 1.634 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -10.622 -8.664 1.698 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.052 -7.666 1.868 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.351 -7.964 -0.696 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.153 -9.236 -0.568 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -13.957 -9.145 0.536 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -13.168 -10.420 -0.372 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -11.619 -10.524 1.839 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.047 -9.827 2.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -12.997 -12.258 2.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.356 -11.661 1.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -13.050 -12.307 0.949 1.00 0.00 H new ATOM 1274 N SER A 82 -8.232 -7.365 0.050 1.00 0.00 N ATOM 1275 CA SER A 82 -7.070 -7.575 -0.788 1.00 0.00 C ATOM 1276 C SER A 82 -6.761 -9.062 -0.829 1.00 0.00 C ATOM 1277 O SER A 82 -6.436 -9.625 0.213 1.00 0.00 O ATOM 1278 CB SER A 82 -5.895 -6.818 -0.160 1.00 0.00 C ATOM 1279 OG SER A 82 -5.983 -5.455 -0.518 1.00 0.00 O ATOM 0 H SER A 82 -8.030 -7.540 1.034 1.00 0.00 H new ATOM 0 HA SER A 82 -7.247 -7.217 -1.802 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.915 -6.925 0.925 1.00 0.00 H new ATOM 0 HB3 SER A 82 -4.950 -7.237 -0.504 1.00 0.00 H new ATOM 0 HG SER A 82 -5.317 -4.941 -0.015 1.00 0.00 H new ATOM 1285 N ILE A 83 -6.813 -9.675 -2.017 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.229 -10.988 -2.249 1.00 0.00 C ATOM 1287 C ILE A 83 -4.851 -10.780 -2.854 1.00 0.00 C ATOM 1288 O ILE A 83 -4.711 -10.050 -3.835 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.150 -11.919 -3.062 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -6.557 -13.339 -3.079 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -7.411 -11.410 -4.481 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -7.528 -14.378 -3.647 1.00 0.00 C ATOM 0 H ILE A 83 -7.262 -9.271 -2.839 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.116 -11.523 -1.306 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.122 -11.936 -2.570 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -5.643 -13.339 -3.673 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.279 -13.624 -2.064 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -8.066 -12.108 -5.003 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.888 -10.431 -4.434 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -6.466 -11.328 -5.018 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.057 -15.361 -3.635 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -8.432 -14.401 -3.039 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -7.787 -14.112 -4.672 1.00 0.00 H new ATOM 1304 N VAL A 84 -3.827 -11.367 -2.232 1.00 0.00 N ATOM 1305 CA VAL A 84 -2.461 -11.277 -2.717 1.00 0.00 C ATOM 1306 C VAL A 84 -1.946 -12.687 -2.947 1.00 0.00 C ATOM 1307 O VAL A 84 -2.193 -13.575 -2.131 1.00 0.00 O ATOM 1308 CB VAL A 84 -1.580 -10.495 -1.729 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -0.146 -10.365 -2.263 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -2.140 -9.081 -1.530 1.00 0.00 C ATOM 0 H VAL A 84 -3.928 -11.917 -1.379 1.00 0.00 H new ATOM 0 HA VAL A 84 -2.429 -10.728 -3.658 1.00 0.00 H new ATOM 0 HB VAL A 84 -1.575 -11.041 -0.786 1.00 0.00 H new ATOM 0 HG11 VAL A 84 0.459 -9.808 -1.548 1.00 0.00 H new ATOM 0 HG12 VAL A 84 0.281 -11.358 -2.405 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.159 -9.836 -3.216 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.509 -8.535 -0.829 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -2.156 -8.558 -2.486 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -3.153 -9.143 -1.134 1.00 0.00 H new ATOM 1320 N THR A 85 -1.205 -12.884 -4.035 1.00 0.00 N ATOM 1321 CA THR A 85 -0.467 -14.105 -4.303 1.00 0.00 C ATOM 1322 C THR A 85 0.822 -13.700 -5.018 1.00 0.00 C ATOM 1323 O THR A 85 0.922 -12.576 -5.508 1.00 0.00 O ATOM 1324 CB THR A 85 -1.345 -15.077 -5.113 1.00 0.00 C ATOM 1325 OG1 THR A 85 -2.641 -15.120 -4.562 1.00 0.00 O ATOM 1326 CG2 THR A 85 -0.817 -16.508 -5.072 1.00 0.00 C ATOM 0 H THR A 85 -1.102 -12.181 -4.767 1.00 0.00 H new ATOM 0 HA THR A 85 -0.202 -14.640 -3.391 1.00 0.00 H new ATOM 0 HB THR A 85 -1.341 -14.710 -6.139 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.197 -15.738 -5.081 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.471 -17.154 -5.658 1.00 0.00 H new ATOM 0 HG22 THR A 85 0.190 -16.536 -5.489 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.792 -16.857 -4.040 1.00 0.00 H new ATOM 1334 N LEU A 86 1.822 -14.580 -5.040 1.00 0.00 N ATOM 1335 CA LEU A 86 3.075 -14.349 -5.738 1.00 0.00 C ATOM 1336 C LEU A 86 3.256 -15.503 -6.720 1.00 0.00 C ATOM 1337 O LEU A 86 3.366 -16.645 -6.276 1.00 0.00 O ATOM 1338 CB LEU A 86 4.210 -14.241 -4.709 1.00 0.00 C ATOM 1339 CG LEU A 86 5.436 -13.465 -5.217 1.00 0.00 C ATOM 1340 CD1 LEU A 86 6.415 -13.268 -4.060 1.00 0.00 C ATOM 1341 CD2 LEU A 86 6.180 -14.185 -6.343 1.00 0.00 C ATOM 0 H LEU A 86 1.779 -15.482 -4.566 1.00 0.00 H new ATOM 0 HA LEU A 86 3.080 -13.414 -6.299 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.829 -13.753 -3.812 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.521 -15.244 -4.419 1.00 0.00 H new ATOM 0 HG LEU A 86 5.067 -12.518 -5.610 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.288 -12.718 -4.412 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.928 -12.705 -3.263 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.728 -14.240 -3.679 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.034 -13.585 -6.656 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.528 -15.155 -5.987 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.508 -14.329 -7.189 1.00 0.00 H new ATOM 1353 N ASP A 87 3.242 -15.224 -8.029 1.00 0.00 N ATOM 1354 CA ASP A 87 3.507 -16.223 -9.061 1.00 0.00 C ATOM 1355 C ASP A 87 4.900 -15.947 -9.616 1.00 0.00 C ATOM 1356 O ASP A 87 5.209 -14.797 -9.904 1.00 0.00 O ATOM 1357 CB ASP A 87 2.424 -16.204 -10.156 1.00 0.00 C ATOM 1358 CG ASP A 87 2.706 -15.228 -11.295 1.00 0.00 C ATOM 1359 OD1 ASP A 87 3.465 -15.624 -12.208 1.00 0.00 O ATOM 1360 OD2 ASP A 87 2.154 -14.110 -11.242 1.00 0.00 O ATOM 0 H ASP A 87 3.045 -14.294 -8.399 1.00 0.00 H new ATOM 0 HA ASP A 87 3.474 -17.228 -8.639 1.00 0.00 H new ATOM 0 HB2 ASP A 87 2.322 -17.208 -10.569 1.00 0.00 H new ATOM 0 HB3 ASP A 87 1.467 -15.948 -9.701 1.00 0.00 H new ATOM 1365 N GLY A 88 5.761 -16.964 -9.715 1.00 0.00 N ATOM 1366 CA GLY A 88 7.106 -16.847 -10.274 1.00 0.00 C ATOM 1367 C GLY A 88 7.969 -15.780 -9.587 1.00 0.00 C ATOM 1368 O GLY A 88 8.784 -16.103 -8.726 1.00 0.00 O ATOM 0 H GLY A 88 5.536 -17.908 -9.402 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.607 -17.812 -10.197 1.00 0.00 H new ATOM 0 HA3 GLY A 88 7.029 -16.612 -11.336 1.00 0.00 H new ATOM 1372 N GLY A 89 7.802 -14.518 -9.990 1.00 0.00 N ATOM 1373 CA GLY A 89 8.460 -13.354 -9.411 1.00 0.00 C ATOM 1374 C GLY A 89 7.596 -12.093 -9.538 1.00 0.00 C ATOM 1375 O GLY A 89 8.124 -10.983 -9.551 1.00 0.00 O ATOM 0 H GLY A 89 7.179 -14.274 -10.760 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.675 -13.543 -8.359 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.416 -13.192 -9.908 1.00 0.00 H new ATOM 1379 N LYS A 90 6.271 -12.260 -9.632 1.00 0.00 N ATOM 1380 CA LYS A 90 5.291 -11.189 -9.698 1.00 0.00 C ATOM 1381 C LYS A 90 4.394 -11.322 -8.473 1.00 0.00 C ATOM 1382 O LYS A 90 3.830 -12.391 -8.240 1.00 0.00 O ATOM 1383 CB LYS A 90 4.433 -11.287 -10.970 1.00 0.00 C ATOM 1384 CG LYS A 90 5.228 -11.518 -12.263 1.00 0.00 C ATOM 1385 CD LYS A 90 4.973 -12.932 -12.802 1.00 0.00 C ATOM 1386 CE LYS A 90 5.887 -13.349 -13.961 1.00 0.00 C ATOM 1387 NZ LYS A 90 5.956 -12.340 -15.037 1.00 0.00 N ATOM 0 H LYS A 90 5.844 -13.186 -9.665 1.00 0.00 H new ATOM 0 HA LYS A 90 5.803 -10.227 -9.722 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.719 -12.101 -10.848 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.855 -10.369 -11.074 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.940 -10.779 -13.011 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.292 -11.381 -12.072 1.00 0.00 H new ATOM 0 HD2 LYS A 90 5.095 -13.645 -11.986 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.936 -12.999 -13.132 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.891 -13.531 -13.577 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.529 -14.291 -14.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.768 -12.796 -15.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 5.245 -11.601 -14.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 6.904 -11.912 -15.052 1.00 0.00 H new ATOM 1401 N LEU A 91 4.257 -10.249 -7.695 1.00 0.00 N ATOM 1402 CA LEU A 91 3.284 -10.174 -6.621 1.00 0.00 C ATOM 1403 C LEU A 91 1.986 -9.689 -7.256 1.00 0.00 C ATOM 1404 O LEU A 91 1.870 -8.515 -7.609 1.00 0.00 O ATOM 1405 CB LEU A 91 3.826 -9.260 -5.515 1.00 0.00 C ATOM 1406 CG LEU A 91 2.917 -9.082 -4.286 1.00 0.00 C ATOM 1407 CD1 LEU A 91 3.733 -8.431 -3.164 1.00 0.00 C ATOM 1408 CD2 LEU A 91 1.700 -8.190 -4.562 1.00 0.00 C ATOM 0 H LEU A 91 4.823 -9.407 -7.797 1.00 0.00 H new ATOM 0 HA LEU A 91 3.093 -11.132 -6.137 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.784 -9.656 -5.180 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.020 -8.277 -5.945 1.00 0.00 H new ATOM 0 HG LEU A 91 2.551 -10.071 -4.012 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.102 -8.298 -2.285 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.578 -9.071 -2.910 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.100 -7.460 -3.497 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.099 -8.104 -3.657 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.037 -7.200 -4.869 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.098 -8.631 -5.356 1.00 0.00 H new ATOM 1420 N VAL A 92 1.016 -10.589 -7.418 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.294 -10.246 -7.938 1.00 0.00 C ATOM 1422 C VAL A 92 -1.174 -9.871 -6.744 1.00 0.00 C ATOM 1423 O VAL A 92 -1.501 -10.721 -5.917 1.00 0.00 O ATOM 1424 CB VAL A 92 -0.853 -11.359 -8.853 1.00 0.00 C ATOM 1425 CG1 VAL A 92 0.227 -11.895 -9.810 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -1.471 -12.549 -8.112 1.00 0.00 C ATOM 0 H VAL A 92 1.124 -11.577 -7.190 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.253 -9.382 -8.602 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.654 -10.867 -9.404 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.200 -12.676 -10.439 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.592 -11.082 -10.438 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.054 -12.306 -9.231 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.836 -13.278 -8.835 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.717 -13.014 -7.477 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.301 -12.203 -7.496 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.501 -8.581 -6.611 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.457 -8.089 -5.631 1.00 0.00 C ATOM 1438 C HIS A 93 -3.713 -7.687 -6.390 1.00 0.00 C ATOM 1439 O HIS A 93 -3.631 -6.848 -7.282 1.00 0.00 O ATOM 1440 CB HIS A 93 -1.861 -6.900 -4.861 1.00 0.00 C ATOM 1441 CG HIS A 93 -2.852 -6.108 -4.037 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -2.823 -4.737 -3.855 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -3.928 -6.600 -3.349 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -3.857 -4.403 -3.063 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -4.545 -5.516 -2.761 1.00 0.00 N ATOM 0 H HIS A 93 -1.100 -7.845 -7.192 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.698 -8.856 -4.895 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.077 -7.271 -4.201 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.385 -6.227 -5.574 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.234 -7.634 -3.280 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -4.095 -3.405 -2.726 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -5.388 -5.554 -2.189 1.00 0.00 H new ATOM 1454 N VAL A 94 -4.859 -8.261 -6.027 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.165 -7.846 -6.506 1.00 0.00 C ATOM 1456 C VAL A 94 -6.941 -7.335 -5.289 1.00 0.00 C ATOM 1457 O VAL A 94 -6.781 -7.859 -4.185 1.00 0.00 O ATOM 1458 CB VAL A 94 -6.839 -9.013 -7.245 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.237 -8.621 -7.729 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -5.999 -9.459 -8.451 1.00 0.00 C ATOM 0 H VAL A 94 -4.900 -9.045 -5.376 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.113 -7.039 -7.237 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.921 -9.839 -6.538 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.692 -9.464 -8.249 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.854 -8.346 -6.874 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.162 -7.773 -8.410 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.498 -10.286 -8.956 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -5.886 -8.625 -9.144 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.016 -9.783 -8.110 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.698 -6.254 -5.474 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.345 -5.479 -4.429 1.00 0.00 C ATOM 1472 C GLN A 95 -9.820 -5.337 -4.795 1.00 0.00 C ATOM 1473 O GLN A 95 -10.167 -4.676 -5.772 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.609 -4.143 -4.311 1.00 0.00 C ATOM 1475 CG GLN A 95 -8.180 -3.195 -3.251 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.268 -1.983 -3.045 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -6.097 -2.004 -3.418 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -7.783 -0.905 -2.461 1.00 0.00 N ATOM 0 H GLN A 95 -7.883 -5.881 -6.405 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.301 -5.959 -3.451 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.562 -4.339 -4.079 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.633 -3.642 -5.279 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.172 -2.860 -3.555 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.299 -3.729 -2.308 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.757 -0.905 -2.158 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -7.204 -0.078 -2.316 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.670 -6.014 -4.029 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.057 -6.312 -4.327 1.00 0.00 C ATOM 1489 C LYS A 96 -12.928 -5.608 -3.295 1.00 0.00 C ATOM 1490 O LYS A 96 -12.641 -5.707 -2.101 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.189 -7.835 -4.217 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.547 -8.407 -4.646 1.00 0.00 C ATOM 1493 CD LYS A 96 -13.679 -9.864 -4.170 1.00 0.00 C ATOM 1494 CE LYS A 96 -12.695 -10.809 -4.884 1.00 0.00 C ATOM 1495 NZ LYS A 96 -12.467 -12.058 -4.130 1.00 0.00 N ATOM 0 H LYS A 96 -10.384 -6.391 -3.126 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.366 -5.974 -5.316 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.410 -8.296 -4.825 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.000 -8.126 -3.184 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.353 -7.805 -4.227 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.644 -8.360 -5.731 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.505 -9.909 -3.095 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.699 -10.208 -4.343 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -13.081 -11.051 -5.874 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -11.744 -10.297 -5.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.156 -12.806 -4.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -11.734 -11.900 -3.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.351 -12.350 -3.666 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.980 -4.912 -3.737 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.905 -4.251 -2.827 1.00 0.00 C ATOM 1511 C TRP A 97 -16.323 -4.785 -2.989 1.00 0.00 C ATOM 1512 O TRP A 97 -16.852 -5.390 -2.059 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.795 -2.731 -2.962 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.598 -2.137 -4.319 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.575 -1.862 -5.207 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.365 -1.626 -4.911 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -15.029 -1.274 -6.323 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.674 -1.078 -6.189 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -12.023 -1.539 -4.485 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.705 -0.480 -7.005 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -11.063 -0.855 -5.252 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.399 -0.331 -6.513 1.00 0.00 C ATOM 0 H TRP A 97 -14.208 -4.795 -4.724 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.625 -4.488 -1.801 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.702 -2.297 -2.541 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -13.965 -2.404 -2.336 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.625 -2.072 -5.063 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.564 -1.014 -7.151 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.728 -2.005 -3.556 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -12.959 -0.139 -7.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -10.060 -0.731 -4.870 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.654 0.185 -7.101 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.948 -4.573 -4.150 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.352 -4.919 -4.350 1.00 0.00 C ATOM 1535 C ASN A 98 -18.752 -4.768 -5.815 1.00 0.00 C ATOM 1536 O ASN A 98 -18.735 -5.747 -6.552 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.303 -4.177 -3.382 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.174 -2.655 -3.376 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.157 -2.104 -2.971 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.190 -1.948 -3.862 1.00 0.00 N ATOM 0 H ASN A 98 -16.499 -4.161 -4.968 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.462 -5.973 -4.095 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.330 -4.437 -3.638 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -19.124 -4.544 -2.371 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.130 -0.931 -3.902 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -21.029 -2.423 -4.195 1.00 0.00 H new ATOM 1547 N GLY A 99 -19.110 -3.559 -6.258 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.596 -3.352 -7.611 1.00 0.00 C ATOM 1549 C GLY A 99 -18.488 -3.593 -8.630 1.00 0.00 C ATOM 1550 O GLY A 99 -18.763 -3.966 -9.766 1.00 0.00 O ATOM 0 H GLY A 99 -19.069 -2.711 -5.692 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.430 -4.025 -7.809 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -19.975 -2.335 -7.714 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.238 -3.328 -8.233 1.00 0.00 N ATOM 1555 CA GLN A 100 -16.070 -3.631 -9.032 1.00 0.00 C ATOM 1556 C GLN A 100 -14.954 -4.142 -8.120 1.00 0.00 C ATOM 1557 O GLN A 100 -15.149 -4.360 -6.918 1.00 0.00 O ATOM 1558 CB GLN A 100 -15.593 -2.430 -9.878 1.00 0.00 C ATOM 1559 CG GLN A 100 -16.619 -1.334 -10.201 1.00 0.00 C ATOM 1560 CD GLN A 100 -16.569 -0.241 -9.144 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -17.408 -0.324 -8.112 1.00 0.00 O flip ATOM 1562 NE2 GLN A 100 -15.712 0.638 -9.227 1.00 0.00 N flip ATOM 0 H GLN A 100 -17.019 -2.893 -7.337 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.345 -4.407 -9.746 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -14.756 -1.964 -9.357 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.206 -2.816 -10.821 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.412 -0.910 -11.184 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.620 -1.764 -10.244 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -15.088 0.668 -10.033 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -15.625 1.337 -8.489 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.783 -4.284 -8.734 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.528 -4.750 -8.193 1.00 0.00 C ATOM 1573 C GLU A 101 -11.458 -3.933 -8.928 1.00 0.00 C ATOM 1574 O GLU A 101 -11.777 -3.236 -9.896 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.470 -6.259 -8.488 1.00 0.00 C ATOM 1576 CG GLU A 101 -11.210 -6.995 -8.034 1.00 0.00 C ATOM 1577 CD GLU A 101 -11.390 -8.493 -8.240 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -11.198 -8.929 -9.392 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -11.737 -9.169 -7.247 1.00 0.00 O ATOM 0 H GLU A 101 -13.690 -4.049 -9.722 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.391 -4.621 -7.119 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -13.331 -6.732 -8.015 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -12.579 -6.401 -9.563 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -10.347 -6.641 -8.598 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.012 -6.784 -6.983 1.00 0.00 H new ATOM 1586 N THR A 102 -10.209 -3.976 -8.472 1.00 0.00 N ATOM 1587 CA THR A 102 -9.079 -3.348 -9.141 1.00 0.00 C ATOM 1588 C THR A 102 -7.854 -4.243 -8.949 1.00 0.00 C ATOM 1589 O THR A 102 -7.755 -4.929 -7.932 1.00 0.00 O ATOM 1590 CB THR A 102 -8.902 -1.916 -8.609 1.00 0.00 C ATOM 1591 OG1 THR A 102 -7.904 -1.219 -9.313 1.00 0.00 O ATOM 1592 CG2 THR A 102 -8.509 -1.866 -7.135 1.00 0.00 C ATOM 0 H THR A 102 -9.952 -4.458 -7.611 1.00 0.00 H new ATOM 0 HA THR A 102 -9.240 -3.249 -10.214 1.00 0.00 H new ATOM 0 HB THR A 102 -9.880 -1.454 -8.746 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.797 -1.613 -10.204 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.400 -0.827 -6.823 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.283 -2.346 -6.536 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.563 -2.389 -6.993 1.00 0.00 H new ATOM 1600 N SER A 103 -6.945 -4.268 -9.928 1.00 0.00 N ATOM 1601 CA SER A 103 -5.734 -5.078 -9.875 1.00 0.00 C ATOM 1602 C SER A 103 -4.514 -4.178 -9.707 1.00 0.00 C ATOM 1603 O SER A 103 -4.492 -3.070 -10.235 1.00 0.00 O ATOM 1604 CB SER A 103 -5.626 -5.951 -11.125 1.00 0.00 C ATOM 1605 OG SER A 103 -6.743 -6.812 -11.201 1.00 0.00 O ATOM 0 H SER A 103 -7.034 -3.721 -10.784 1.00 0.00 H new ATOM 0 HA SER A 103 -5.780 -5.744 -9.013 1.00 0.00 H new ATOM 0 HB2 SER A 103 -5.576 -5.324 -12.015 1.00 0.00 H new ATOM 0 HB3 SER A 103 -4.706 -6.535 -11.095 1.00 0.00 H new ATOM 0 HG SER A 103 -6.672 -7.369 -12.004 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.531 -4.659 -8.943 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.296 -3.987 -8.581 1.00 0.00 C ATOM 1613 C LEU A 104 -1.162 -5.006 -8.729 1.00 0.00 C ATOM 1614 O LEU A 104 -0.539 -5.388 -7.738 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.365 -3.495 -7.124 1.00 0.00 C ATOM 1616 CG LEU A 104 -3.371 -2.364 -6.865 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -4.757 -2.878 -6.475 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -2.891 -1.497 -5.695 1.00 0.00 C ATOM 0 H LEU A 104 -3.588 -5.593 -8.537 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.130 -3.122 -9.223 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.619 -4.340 -6.483 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.374 -3.154 -6.825 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.439 -1.806 -7.799 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.424 -2.033 -6.305 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.155 -3.498 -7.279 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.682 -3.470 -5.563 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.609 -0.697 -5.517 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.803 -2.112 -4.799 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.920 -1.066 -5.936 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.903 -5.490 -9.947 1.00 0.00 N ATOM 1631 CA VAL A 105 0.164 -6.467 -10.141 1.00 0.00 C ATOM 1632 C VAL A 105 1.506 -5.740 -10.032 1.00 0.00 C ATOM 1633 O VAL A 105 1.679 -4.702 -10.672 1.00 0.00 O ATOM 1634 CB VAL A 105 -0.023 -7.245 -11.461 1.00 0.00 C ATOM 1635 CG1 VAL A 105 0.556 -6.547 -12.694 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.603 -8.640 -11.345 1.00 0.00 C ATOM 0 H VAL A 105 -1.406 -5.227 -10.794 1.00 0.00 H new ATOM 0 HA VAL A 105 0.134 -7.231 -9.364 1.00 0.00 H new ATOM 0 HB VAL A 105 -1.101 -7.305 -11.610 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.381 -7.162 -13.576 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.072 -5.579 -12.825 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.628 -6.402 -12.560 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.465 -9.180 -12.282 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.668 -8.544 -11.135 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.121 -9.189 -10.536 1.00 0.00 H new ATOM 1646 N ARG A 106 2.423 -6.250 -9.203 1.00 0.00 N ATOM 1647 CA ARG A 106 3.785 -5.753 -9.059 1.00 0.00 C ATOM 1648 C ARG A 106 4.734 -6.800 -9.634 1.00 0.00 C ATOM 1649 O ARG A 106 4.857 -7.879 -9.054 1.00 0.00 O ATOM 1650 CB ARG A 106 4.135 -5.549 -7.578 1.00 0.00 C ATOM 1651 CG ARG A 106 3.402 -4.387 -6.914 1.00 0.00 C ATOM 1652 CD ARG A 106 3.715 -4.413 -5.412 1.00 0.00 C ATOM 1653 NE ARG A 106 3.228 -3.200 -4.736 1.00 0.00 N ATOM 1654 CZ ARG A 106 2.801 -3.119 -3.463 1.00 0.00 C ATOM 1655 NH1 ARG A 106 2.766 -4.209 -2.687 1.00 0.00 N ATOM 1656 NH2 ARG A 106 2.403 -1.940 -2.972 1.00 0.00 N ATOM 0 H ARG A 106 2.226 -7.046 -8.596 1.00 0.00 H new ATOM 0 HA ARG A 106 3.875 -4.800 -9.580 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.908 -6.465 -7.033 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.209 -5.384 -7.490 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.718 -3.440 -7.351 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.328 -4.472 -7.079 1.00 0.00 H new ATOM 0 HD2 ARG A 106 3.256 -5.292 -4.959 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.791 -4.505 -5.266 1.00 0.00 H new ATOM 0 HE ARG A 106 3.213 -2.340 -5.284 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.065 -5.110 -3.060 1.00 0.00 H new ATOM 0 HH12 ARG A 106 2.441 -4.138 -1.723 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.424 -1.108 -3.562 1.00 0.00 H new ATOM 0 HH22 ARG A 106 2.078 -1.873 -2.007 1.00 0.00 H new ATOM 1670 N GLU A 107 5.437 -6.473 -10.721 1.00 0.00 N ATOM 1671 CA GLU A 107 6.584 -7.244 -11.184 1.00 0.00 C ATOM 1672 C GLU A 107 7.794 -6.318 -11.226 1.00 0.00 C ATOM 1673 O GLU A 107 7.647 -5.135 -11.540 1.00 0.00 O ATOM 1674 CB GLU A 107 6.296 -7.877 -12.551 1.00 0.00 C ATOM 1675 CG GLU A 107 7.519 -8.651 -13.066 1.00 0.00 C ATOM 1676 CD GLU A 107 7.169 -9.677 -14.128 1.00 0.00 C ATOM 1677 OE1 GLU A 107 6.091 -9.587 -14.755 1.00 0.00 O ATOM 1678 OE2 GLU A 107 7.892 -10.686 -14.234 1.00 0.00 O ATOM 0 H GLU A 107 5.223 -5.663 -11.303 1.00 0.00 H new ATOM 0 HA GLU A 107 6.790 -8.067 -10.500 1.00 0.00 H new ATOM 0 HB2 GLU A 107 5.442 -8.550 -12.472 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.025 -7.100 -13.266 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.242 -7.946 -13.475 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.003 -9.154 -12.229 1.00 0.00 H new ATOM 1685 N MET A 108 8.970 -6.868 -10.901 1.00 0.00 N ATOM 1686 CA MET A 108 10.259 -6.231 -11.073 1.00 0.00 C ATOM 1687 C MET A 108 11.071 -7.050 -12.069 1.00 0.00 C ATOM 1688 O MET A 108 11.298 -8.238 -11.853 1.00 0.00 O ATOM 1689 CB MET A 108 11.008 -6.156 -9.737 1.00 0.00 C ATOM 1690 CG MET A 108 12.354 -5.432 -9.890 1.00 0.00 C ATOM 1691 SD MET A 108 13.770 -6.323 -9.201 1.00 0.00 S ATOM 1692 CE MET A 108 15.081 -5.173 -9.670 1.00 0.00 C ATOM 0 H MET A 108 9.041 -7.802 -10.498 1.00 0.00 H new ATOM 0 HA MET A 108 10.116 -5.215 -11.441 1.00 0.00 H new ATOM 0 HB2 MET A 108 10.394 -5.635 -9.003 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.176 -7.163 -9.355 1.00 0.00 H new ATOM 0 HG2 MET A 108 12.536 -5.251 -10.949 1.00 0.00 H new ATOM 0 HG3 MET A 108 12.285 -4.457 -9.407 1.00 0.00 H new ATOM 0 HE1 MET A 108 16.029 -5.511 -9.250 1.00 0.00 H new ATOM 0 HE2 MET A 108 15.159 -5.133 -10.757 1.00 0.00 H new ATOM 0 HE3 MET A 108 14.848 -4.180 -9.287 1.00 0.00 H new ATOM 1702 N VAL A 109 11.587 -6.375 -13.089 1.00 0.00 N ATOM 1703 CA VAL A 109 12.710 -6.824 -13.892 1.00 0.00 C ATOM 1704 C VAL A 109 13.660 -5.627 -13.969 1.00 0.00 C ATOM 1705 O VAL A 109 13.376 -4.598 -13.351 1.00 0.00 O ATOM 1706 CB VAL A 109 12.230 -7.343 -15.261 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.496 -8.676 -15.093 1.00 0.00 C ATOM 1708 CG2 VAL A 109 11.280 -6.371 -15.964 1.00 0.00 C ATOM 0 H VAL A 109 11.221 -5.471 -13.387 1.00 0.00 H new ATOM 0 HA VAL A 109 13.234 -7.675 -13.457 1.00 0.00 H new ATOM 0 HB VAL A 109 13.125 -7.458 -15.872 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.162 -9.033 -16.067 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.170 -9.409 -14.650 1.00 0.00 H new ATOM 0 HG13 VAL A 109 10.633 -8.537 -14.442 1.00 0.00 H new ATOM 0 HG21 VAL A 109 10.975 -6.790 -16.923 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.399 -6.209 -15.342 1.00 0.00 H new ATOM 0 HG23 VAL A 109 11.788 -5.421 -16.128 1.00 0.00 H new ATOM 1718 N ASP A 110 14.782 -5.753 -14.683 1.00 0.00 N ATOM 1719 CA ASP A 110 15.754 -4.673 -14.811 1.00 0.00 C ATOM 1720 C ASP A 110 16.177 -4.197 -13.408 1.00 0.00 C ATOM 1721 O ASP A 110 16.803 -4.962 -12.676 1.00 0.00 O ATOM 1722 CB ASP A 110 15.169 -3.599 -15.747 1.00 0.00 C ATOM 1723 CG ASP A 110 16.022 -2.346 -15.827 1.00 0.00 C ATOM 1724 OD1 ASP A 110 17.047 -2.387 -16.536 1.00 0.00 O ATOM 1725 OD2 ASP A 110 15.631 -1.386 -15.123 1.00 0.00 O ATOM 0 H ASP A 110 15.038 -6.603 -15.185 1.00 0.00 H new ATOM 0 HA ASP A 110 16.684 -4.993 -15.281 1.00 0.00 H new ATOM 0 HB2 ASP A 110 15.058 -4.019 -16.747 1.00 0.00 H new ATOM 0 HB3 ASP A 110 14.171 -3.330 -15.401 1.00 0.00 H new ATOM 1730 N GLY A 111 15.793 -2.987 -12.999 1.00 0.00 N ATOM 1731 CA GLY A 111 16.104 -2.384 -11.713 1.00 0.00 C ATOM 1732 C GLY A 111 14.923 -1.558 -11.204 1.00 0.00 C ATOM 1733 O GLY A 111 15.103 -0.671 -10.369 1.00 0.00 O ATOM 0 H GLY A 111 15.229 -2.375 -13.589 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.348 -3.163 -10.990 1.00 0.00 H new ATOM 0 HA3 GLY A 111 16.985 -1.749 -11.807 1.00 0.00 H new ATOM 1737 N LYS A 112 13.714 -1.831 -11.707 1.00 0.00 N ATOM 1738 CA LYS A 112 12.513 -1.051 -11.442 1.00 0.00 C ATOM 1739 C LYS A 112 11.357 -2.027 -11.271 1.00 0.00 C ATOM 1740 O LYS A 112 11.456 -3.155 -11.752 1.00 0.00 O ATOM 1741 CB LYS A 112 12.273 -0.067 -12.600 1.00 0.00 C ATOM 1742 CG LYS A 112 13.460 0.902 -12.699 1.00 0.00 C ATOM 1743 CD LYS A 112 13.160 2.198 -13.468 1.00 0.00 C ATOM 1744 CE LYS A 112 14.036 3.295 -12.842 1.00 0.00 C ATOM 1745 NZ LYS A 112 13.937 4.615 -13.493 1.00 0.00 N ATOM 0 H LYS A 112 13.546 -2.624 -12.326 1.00 0.00 H new ATOM 0 HA LYS A 112 12.613 -0.458 -10.533 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.155 -0.612 -13.537 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.349 0.488 -12.435 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.788 1.159 -11.692 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.291 0.390 -13.184 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.386 2.080 -14.528 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.104 2.457 -13.394 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.763 3.402 -11.792 1.00 0.00 H new ATOM 0 HE3 LYS A 112 15.076 2.969 -12.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.254 5.353 -12.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 14.538 4.629 -14.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 12.949 4.795 -13.765 1.00 0.00 H new ATOM 1759 N LEU A 113 10.285 -1.628 -10.575 1.00 0.00 N ATOM 1760 CA LEU A 113 9.087 -2.453 -10.478 1.00 0.00 C ATOM 1761 C LEU A 113 7.883 -1.673 -10.982 1.00 0.00 C ATOM 1762 O LEU A 113 7.760 -0.474 -10.732 1.00 0.00 O ATOM 1763 CB LEU A 113 8.936 -3.144 -9.106 1.00 0.00 C ATOM 1764 CG LEU A 113 8.228 -2.386 -7.971 1.00 0.00 C ATOM 1765 CD1 LEU A 113 6.714 -2.259 -8.218 1.00 0.00 C ATOM 1766 CD2 LEU A 113 8.431 -3.125 -6.638 1.00 0.00 C ATOM 0 H LEU A 113 10.228 -0.741 -10.074 1.00 0.00 H new ATOM 0 HA LEU A 113 9.179 -3.310 -11.145 1.00 0.00 H new ATOM 0 HB2 LEU A 113 8.399 -4.079 -9.264 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.935 -3.406 -8.756 1.00 0.00 H new ATOM 0 HG LEU A 113 8.666 -1.388 -7.935 1.00 0.00 H new ATOM 0 HD11 LEU A 113 6.255 -1.717 -7.391 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.541 -1.717 -9.148 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.272 -3.253 -8.290 1.00 0.00 H new ATOM 0 HD21 LEU A 113 7.926 -2.581 -5.840 1.00 0.00 H new ATOM 0 HD22 LEU A 113 8.015 -4.130 -6.712 1.00 0.00 H new ATOM 0 HD23 LEU A 113 9.496 -3.189 -6.416 1.00 0.00 H new ATOM 1778 N ILE A 114 7.033 -2.355 -11.748 1.00 0.00 N ATOM 1779 CA ILE A 114 5.870 -1.777 -12.385 1.00 0.00 C ATOM 1780 C ILE A 114 4.670 -2.268 -11.592 1.00 0.00 C ATOM 1781 O ILE A 114 4.320 -3.445 -11.676 1.00 0.00 O ATOM 1782 CB ILE A 114 5.806 -2.177 -13.874 1.00 0.00 C ATOM 1783 CG1 ILE A 114 7.072 -1.750 -14.645 1.00 0.00 C ATOM 1784 CG2 ILE A 114 4.586 -1.505 -14.522 1.00 0.00 C ATOM 1785 CD1 ILE A 114 8.182 -2.809 -14.647 1.00 0.00 C ATOM 0 H ILE A 114 7.145 -3.350 -11.942 1.00 0.00 H new ATOM 0 HA ILE A 114 5.900 -0.687 -12.382 1.00 0.00 H new ATOM 0 HB ILE A 114 5.730 -3.263 -13.922 1.00 0.00 H new ATOM 0 HG12 ILE A 114 6.799 -1.521 -15.675 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.460 -0.831 -14.207 1.00 0.00 H new ATOM 0 HG21 ILE A 114 4.534 -1.783 -15.575 1.00 0.00 H new ATOM 0 HG22 ILE A 114 3.678 -1.832 -14.015 1.00 0.00 H new ATOM 0 HG23 ILE A 114 4.679 -0.422 -14.437 1.00 0.00 H new ATOM 0 HD11 ILE A 114 9.039 -2.437 -15.208 1.00 0.00 H new ATOM 0 HD12 ILE A 114 8.484 -3.021 -13.621 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.812 -3.723 -15.113 1.00 0.00 H new ATOM 1797 N LEU A 115 4.062 -1.376 -10.808 1.00 0.00 N ATOM 1798 CA LEU A 115 2.793 -1.637 -10.161 1.00 0.00 C ATOM 1799 C LEU A 115 1.717 -1.211 -11.164 1.00 0.00 C ATOM 1800 O LEU A 115 1.488 -0.017 -11.359 1.00 0.00 O ATOM 1801 CB LEU A 115 2.745 -0.895 -8.816 1.00 0.00 C ATOM 1802 CG LEU A 115 1.560 -1.291 -7.917 1.00 0.00 C ATOM 1803 CD1 LEU A 115 1.675 -0.590 -6.560 1.00 0.00 C ATOM 1804 CD2 LEU A 115 0.216 -0.893 -8.521 1.00 0.00 C ATOM 0 H LEU A 115 4.444 -0.452 -10.609 1.00 0.00 H new ATOM 0 HA LEU A 115 2.634 -2.685 -9.909 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.674 -1.083 -8.277 1.00 0.00 H new ATOM 0 HB3 LEU A 115 2.699 0.177 -9.007 1.00 0.00 H new ATOM 0 HG LEU A 115 1.600 -2.375 -7.813 1.00 0.00 H new ATOM 0 HD11 LEU A 115 0.832 -0.876 -5.930 1.00 0.00 H new ATOM 0 HD12 LEU A 115 2.606 -0.885 -6.076 1.00 0.00 H new ATOM 0 HD13 LEU A 115 1.668 0.490 -6.707 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -0.588 -1.194 -7.849 1.00 0.00 H new ATOM 0 HD22 LEU A 115 0.186 0.187 -8.662 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.089 -1.388 -9.484 1.00 0.00 H new ATOM 1816 N THR A 116 1.072 -2.170 -11.832 1.00 0.00 N ATOM 1817 CA THR A 116 -0.007 -1.859 -12.766 1.00 0.00 C ATOM 1818 C THR A 116 -1.309 -1.760 -11.973 1.00 0.00 C ATOM 1819 O THR A 116 -1.953 -2.775 -11.715 1.00 0.00 O ATOM 1820 CB THR A 116 -0.078 -2.886 -13.905 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.222 -3.142 -14.396 1.00 0.00 O ATOM 1822 CG2 THR A 116 -0.929 -2.364 -15.064 1.00 0.00 C ATOM 0 H THR A 116 1.279 -3.165 -11.743 1.00 0.00 H new ATOM 0 HA THR A 116 0.180 -0.902 -13.254 1.00 0.00 H new ATOM 0 HB THR A 116 -0.528 -3.795 -13.506 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.174 -3.799 -15.122 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.962 -3.112 -15.857 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.941 -2.164 -14.711 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.491 -1.444 -15.451 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.661 -0.540 -11.562 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.870 -0.217 -10.821 1.00 0.00 C ATOM 1832 C LEU A 117 -3.983 -0.002 -11.852 1.00 0.00 C ATOM 1833 O LEU A 117 -4.066 1.080 -12.427 1.00 0.00 O ATOM 1834 CB LEU A 117 -2.561 1.025 -9.960 1.00 0.00 C ATOM 1835 CG LEU A 117 -3.758 1.713 -9.300 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -4.462 0.817 -8.288 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -3.314 2.971 -8.562 1.00 0.00 C ATOM 0 H LEU A 117 -1.084 0.280 -11.747 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.202 -1.003 -10.143 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.862 0.732 -9.177 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.050 1.756 -10.587 1.00 0.00 H new ATOM 0 HG LEU A 117 -4.448 1.953 -10.109 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -5.303 1.354 -7.850 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -4.825 -0.081 -8.788 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -3.762 0.536 -7.502 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.179 3.446 -8.099 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -2.591 2.704 -7.791 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.854 3.663 -9.267 1.00 0.00 H new ATOM 1849 N THR A 118 -4.793 -1.025 -12.144 1.00 0.00 N ATOM 1850 CA THR A 118 -5.815 -0.977 -13.189 1.00 0.00 C ATOM 1851 C THR A 118 -7.215 -1.240 -12.620 1.00 0.00 C ATOM 1852 O THR A 118 -7.401 -2.174 -11.834 1.00 0.00 O ATOM 1853 CB THR A 118 -5.436 -1.913 -14.346 1.00 0.00 C ATOM 1854 OG1 THR A 118 -6.383 -1.788 -15.384 1.00 0.00 O ATOM 1855 CG2 THR A 118 -5.335 -3.385 -13.947 1.00 0.00 C ATOM 0 H THR A 118 -4.755 -1.919 -11.654 1.00 0.00 H new ATOM 0 HA THR A 118 -5.856 0.031 -13.601 1.00 0.00 H new ATOM 0 HB THR A 118 -4.442 -1.604 -14.671 1.00 0.00 H new ATOM 0 HG1 THR A 118 -6.139 -2.384 -16.123 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.064 -3.980 -14.819 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.573 -3.502 -13.176 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.296 -3.724 -13.561 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.186 -0.385 -12.978 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.572 -0.433 -12.518 1.00 0.00 C ATOM 1865 C HIS A 119 -10.506 -0.755 -13.686 1.00 0.00 C ATOM 1866 O HIS A 119 -11.477 -1.483 -13.504 1.00 0.00 O ATOM 1867 CB HIS A 119 -9.933 0.904 -11.850 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.404 1.146 -11.588 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.048 2.362 -11.736 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.300 0.254 -11.058 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.318 2.207 -11.319 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.490 0.940 -10.893 1.00 0.00 N ATOM 0 H HIS A 119 -8.014 0.387 -13.622 1.00 0.00 H new ATOM 0 HA HIS A 119 -9.690 -1.226 -11.780 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.401 0.967 -10.901 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.560 1.713 -12.479 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -11.634 3.222 -12.097 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -12.113 -0.782 -10.816 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.078 2.975 -11.325 1.00 0.00 H new ATOM 1881 N GLY A 120 -10.238 -0.193 -14.868 1.00 0.00 N ATOM 1882 CA GLY A 120 -10.976 -0.496 -16.086 1.00 0.00 C ATOM 1883 C GLY A 120 -11.143 0.785 -16.885 1.00 0.00 C ATOM 1884 O GLY A 120 -10.370 1.053 -17.798 1.00 0.00 O ATOM 0 H GLY A 120 -9.494 0.492 -15.002 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -10.443 -1.242 -16.675 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -11.950 -0.919 -15.842 1.00 0.00 H new ATOM 1888 N THR A 121 -12.122 1.608 -16.497 1.00 0.00 N ATOM 1889 CA THR A 121 -12.276 2.948 -17.054 1.00 0.00 C ATOM 1890 C THR A 121 -10.995 3.759 -16.813 1.00 0.00 C ATOM 1891 O THR A 121 -10.531 4.482 -17.691 1.00 0.00 O ATOM 1892 CB THR A 121 -13.545 3.612 -16.483 1.00 0.00 C ATOM 1893 OG1 THR A 121 -13.782 4.840 -17.134 1.00 0.00 O ATOM 1894 CG2 THR A 121 -13.491 3.870 -14.972 1.00 0.00 C ATOM 0 H THR A 121 -12.821 1.364 -15.795 1.00 0.00 H new ATOM 0 HA THR A 121 -12.415 2.900 -18.134 1.00 0.00 H new ATOM 0 HB THR A 121 -14.352 2.901 -16.662 1.00 0.00 H new ATOM 0 HG1 THR A 121 -14.590 5.254 -16.767 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.421 4.339 -14.649 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.360 2.924 -14.446 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.654 4.531 -14.745 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.407 3.592 -15.622 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.143 4.195 -15.235 1.00 0.00 C ATOM 1904 C ALA A 122 -8.073 3.102 -15.178 1.00 0.00 C ATOM 1905 O ALA A 122 -8.357 1.970 -14.761 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.319 4.913 -13.896 1.00 0.00 C ATOM 0 H ALA A 122 -10.816 3.016 -14.886 1.00 0.00 H new ATOM 0 HA ALA A 122 -8.821 4.939 -15.964 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.374 5.368 -13.600 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.079 5.688 -13.996 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.630 4.196 -13.137 1.00 0.00 H new ATOM 1912 N VAL A 123 -6.860 3.438 -15.624 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.731 2.531 -15.777 1.00 0.00 C ATOM 1914 C VAL A 123 -4.453 3.319 -15.474 1.00 0.00 C ATOM 1915 O VAL A 123 -4.087 4.222 -16.223 1.00 0.00 O ATOM 1916 CB VAL A 123 -5.694 1.925 -17.196 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -4.538 0.921 -17.306 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -6.995 1.199 -17.563 1.00 0.00 C ATOM 0 H VAL A 123 -6.633 4.394 -15.899 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.824 1.694 -15.084 1.00 0.00 H new ATOM 0 HB VAL A 123 -5.559 2.758 -17.886 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -4.518 0.497 -18.310 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -3.594 1.429 -17.108 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.679 0.122 -16.578 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -6.913 0.793 -18.571 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -7.170 0.387 -16.857 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -7.828 1.901 -17.521 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.779 2.991 -14.369 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.553 3.627 -13.914 1.00 0.00 C ATOM 1930 C CYS A 124 -1.410 2.611 -13.875 1.00 0.00 C ATOM 1931 O CYS A 124 -1.230 1.917 -12.877 1.00 0.00 O ATOM 1932 CB CYS A 124 -2.784 4.233 -12.520 1.00 0.00 C ATOM 1933 SG CYS A 124 -1.210 4.739 -11.765 1.00 0.00 S ATOM 0 H CYS A 124 -4.090 2.245 -13.746 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.277 4.420 -14.609 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.448 5.094 -12.599 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.282 3.504 -11.880 1.00 0.00 H new ATOM 0 HG CYS A 124 -0.785 5.827 -12.336 1.00 0.00 H new ATOM 1939 N THR A 125 -0.533 2.630 -14.877 1.00 0.00 N ATOM 1940 CA THR A 125 0.840 2.210 -14.653 1.00 0.00 C ATOM 1941 C THR A 125 1.388 3.084 -13.522 1.00 0.00 C ATOM 1942 O THR A 125 1.169 4.300 -13.554 1.00 0.00 O ATOM 1943 CB THR A 125 1.618 2.437 -15.955 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.248 3.697 -16.488 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.273 1.357 -16.983 1.00 0.00 C ATOM 0 H THR A 125 -0.746 2.925 -15.830 1.00 0.00 H new ATOM 0 HA THR A 125 0.923 1.159 -14.377 1.00 0.00 H new ATOM 0 HB THR A 125 2.686 2.399 -15.741 1.00 0.00 H new ATOM 0 HG1 THR A 125 0.999 4.301 -15.757 1.00 0.00 H new ATOM 0 HG21 THR A 125 1.835 1.535 -17.900 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.533 0.377 -16.583 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.205 1.389 -17.200 1.00 0.00 H new ATOM 1953 N ARG A 126 1.992 2.479 -12.495 1.00 0.00 N ATOM 1954 CA ARG A 126 2.635 3.172 -11.392 1.00 0.00 C ATOM 1955 C ARG A 126 4.043 2.589 -11.240 1.00 0.00 C ATOM 1956 O ARG A 126 4.209 1.432 -10.855 1.00 0.00 O ATOM 1957 CB ARG A 126 1.782 3.017 -10.127 1.00 0.00 C ATOM 1958 CG ARG A 126 2.214 4.010 -9.048 1.00 0.00 C ATOM 1959 CD ARG A 126 1.384 3.824 -7.774 1.00 0.00 C ATOM 1960 NE ARG A 126 1.872 4.728 -6.725 1.00 0.00 N ATOM 1961 CZ ARG A 126 1.820 4.491 -5.407 1.00 0.00 C ATOM 1962 NH1 ARG A 126 1.052 3.502 -4.937 1.00 0.00 N ATOM 1963 NH2 ARG A 126 2.537 5.249 -4.569 1.00 0.00 N ATOM 0 H ARG A 126 2.045 1.464 -12.413 1.00 0.00 H new ATOM 0 HA ARG A 126 2.724 4.243 -11.576 1.00 0.00 H new ATOM 0 HB2 ARG A 126 0.731 3.175 -10.371 1.00 0.00 H new ATOM 0 HB3 ARG A 126 1.872 2.000 -9.746 1.00 0.00 H new ATOM 0 HG2 ARG A 126 3.271 3.871 -8.822 1.00 0.00 H new ATOM 0 HG3 ARG A 126 2.098 5.029 -9.418 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.333 4.026 -7.981 1.00 0.00 H new ATOM 0 HD3 ARG A 126 1.449 2.790 -7.435 1.00 0.00 H new ATOM 0 HE ARG A 126 2.286 5.611 -7.025 1.00 0.00 H new ATOM 0 HH11 ARG A 126 0.507 2.929 -5.581 1.00 0.00 H new ATOM 0 HH12 ARG A 126 1.011 3.320 -3.934 1.00 0.00 H new ATOM 0 HH21 ARG A 126 3.119 6.003 -4.934 1.00 0.00 H new ATOM 0 HH22 ARG A 126 2.501 5.073 -3.565 1.00 0.00 H new ATOM 1977 N THR A 127 5.047 3.376 -11.611 1.00 0.00 N ATOM 1978 CA THR A 127 6.362 2.912 -12.005 1.00 0.00 C ATOM 1979 C THR A 127 7.369 3.306 -10.918 1.00 0.00 C ATOM 1980 O THR A 127 7.603 4.495 -10.677 1.00 0.00 O ATOM 1981 CB THR A 127 6.673 3.536 -13.380 1.00 0.00 C ATOM 1982 OG1 THR A 127 5.495 4.096 -13.941 1.00 0.00 O ATOM 1983 CG2 THR A 127 7.156 2.502 -14.391 1.00 0.00 C ATOM 0 H THR A 127 4.959 4.392 -11.645 1.00 0.00 H new ATOM 0 HA THR A 127 6.416 1.828 -12.103 1.00 0.00 H new ATOM 0 HB THR A 127 7.447 4.282 -13.200 1.00 0.00 H new ATOM 0 HG1 THR A 127 5.704 4.494 -14.812 1.00 0.00 H new ATOM 0 HG21 THR A 127 7.361 2.992 -15.343 1.00 0.00 H new ATOM 0 HG22 THR A 127 8.067 2.030 -14.022 1.00 0.00 H new ATOM 0 HG23 THR A 127 6.386 1.744 -14.532 1.00 0.00 H new ATOM 1991 N TYR A 128 7.929 2.302 -10.235 1.00 0.00 N ATOM 1992 CA TYR A 128 8.750 2.460 -9.044 1.00 0.00 C ATOM 1993 C TYR A 128 10.208 2.096 -9.296 1.00 0.00 C ATOM 1994 O TYR A 128 10.521 1.197 -10.076 1.00 0.00 O ATOM 1995 CB TYR A 128 8.202 1.569 -7.934 1.00 0.00 C ATOM 1996 CG TYR A 128 6.991 2.124 -7.229 1.00 0.00 C ATOM 1997 CD1 TYR A 128 7.172 3.018 -6.163 1.00 0.00 C ATOM 1998 CD2 TYR A 128 5.704 1.644 -7.536 1.00 0.00 C ATOM 1999 CE1 TYR A 128 6.097 3.326 -5.320 1.00 0.00 C ATOM 2000 CE2 TYR A 128 4.637 1.922 -6.666 1.00 0.00 C ATOM 2001 CZ TYR A 128 4.863 2.682 -5.509 1.00 0.00 C ATOM 2002 OH TYR A 128 3.923 2.704 -4.524 1.00 0.00 O ATOM 0 H TYR A 128 7.815 1.327 -10.511 1.00 0.00 H new ATOM 0 HA TYR A 128 8.712 3.510 -8.755 1.00 0.00 H new ATOM 0 HB2 TYR A 128 7.947 0.598 -8.357 1.00 0.00 H new ATOM 0 HB3 TYR A 128 8.989 1.400 -7.199 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.139 3.468 -5.993 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.538 1.066 -8.433 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.216 4.053 -4.530 1.00 0.00 H new ATOM 0 HE2 TYR A 128 3.647 1.552 -6.887 1.00 0.00 H new ATOM 0 HH TYR A 128 4.341 2.973 -3.679 1.00 0.00 H new ATOM 2012 N GLU A 129 11.082 2.801 -8.580 1.00 0.00 N ATOM 2013 CA GLU A 129 12.524 2.803 -8.713 1.00 0.00 C ATOM 2014 C GLU A 129 13.088 2.451 -7.335 1.00 0.00 C ATOM 2015 O GLU A 129 12.715 3.083 -6.344 1.00 0.00 O ATOM 2016 CB GLU A 129 12.854 4.229 -9.171 1.00 0.00 C ATOM 2017 CG GLU A 129 14.310 4.638 -9.384 1.00 0.00 C ATOM 2018 CD GLU A 129 14.306 5.973 -10.122 1.00 0.00 C ATOM 2019 OE1 GLU A 129 13.894 6.976 -9.490 1.00 0.00 O ATOM 2020 OE2 GLU A 129 14.582 5.941 -11.341 1.00 0.00 O ATOM 0 H GLU A 129 10.770 3.429 -7.840 1.00 0.00 H new ATOM 0 HA GLU A 129 12.945 2.090 -9.422 1.00 0.00 H new ATOM 0 HB2 GLU A 129 12.327 4.399 -10.110 1.00 0.00 H new ATOM 0 HB3 GLU A 129 12.428 4.913 -8.438 1.00 0.00 H new ATOM 0 HG2 GLU A 129 14.827 4.729 -8.429 1.00 0.00 H new ATOM 0 HG3 GLU A 129 14.840 3.881 -9.962 1.00 0.00 H new ATOM 2027 N LYS A 130 13.917 1.404 -7.244 1.00 0.00 N ATOM 2028 CA LYS A 130 14.482 1.001 -5.965 1.00 0.00 C ATOM 2029 C LYS A 130 15.594 1.973 -5.587 1.00 0.00 C ATOM 2030 O LYS A 130 16.530 2.145 -6.363 1.00 0.00 O ATOM 2031 CB LYS A 130 15.001 -0.445 -6.003 1.00 0.00 C ATOM 2032 CG LYS A 130 15.021 -1.012 -4.576 1.00 0.00 C ATOM 2033 CD LYS A 130 15.449 -2.484 -4.547 1.00 0.00 C ATOM 2034 CE LYS A 130 15.293 -3.017 -3.115 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.623 -4.450 -2.998 1.00 0.00 N ATOM 0 H LYS A 130 14.205 0.830 -8.036 1.00 0.00 H new ATOM 0 HA LYS A 130 13.698 1.031 -5.208 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.363 -1.056 -6.641 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.002 -0.473 -6.433 1.00 0.00 H new ATOM 0 HG2 LYS A 130 15.704 -0.424 -3.962 1.00 0.00 H new ATOM 0 HG3 LYS A 130 14.030 -0.914 -4.133 1.00 0.00 H new ATOM 0 HD2 LYS A 130 14.839 -3.068 -5.236 1.00 0.00 H new ATOM 0 HD3 LYS A 130 16.484 -2.583 -4.876 1.00 0.00 H new ATOM 0 HE2 LYS A 130 15.937 -2.445 -2.447 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.267 -2.857 -2.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 15.468 -4.763 -2.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 15.015 -5.000 -3.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 16.620 -4.599 -3.255 1.00 0.00 H new ATOM 2049 N GLN A 131 15.507 2.584 -4.402 1.00 0.00 N ATOM 2050 CA GLN A 131 16.573 3.432 -3.880 1.00 0.00 C ATOM 2051 C GLN A 131 17.320 2.742 -2.738 1.00 0.00 C ATOM 2052 O GLN A 131 18.504 2.998 -2.537 1.00 0.00 O ATOM 2053 CB GLN A 131 16.041 4.821 -3.507 1.00 0.00 C ATOM 2054 CG GLN A 131 14.939 4.815 -2.439 1.00 0.00 C ATOM 2055 CD GLN A 131 14.495 6.218 -2.017 1.00 0.00 C ATOM 2056 OE1 GLN A 131 13.723 6.365 -1.077 1.00 0.00 O ATOM 2057 NE2 GLN A 131 14.953 7.267 -2.695 1.00 0.00 N ATOM 0 H GLN A 131 14.700 2.503 -3.784 1.00 0.00 H new ATOM 0 HA GLN A 131 17.308 3.590 -4.669 1.00 0.00 H new ATOM 0 HB2 GLN A 131 16.871 5.430 -3.151 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.655 5.302 -4.406 1.00 0.00 H new ATOM 0 HG2 GLN A 131 14.077 4.268 -2.820 1.00 0.00 H new ATOM 0 HG3 GLN A 131 15.296 4.276 -1.562 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.595 7.129 -3.475 1.00 0.00 H new ATOM 0 HE22 GLN A 131 14.662 8.209 -2.434 1.00 0.00 H new ATOM 2066 N ALA A 132 16.646 1.853 -1.996 1.00 0.00 N ATOM 2067 CA ALA A 132 17.226 1.170 -0.846 1.00 0.00 C ATOM 2068 C ALA A 132 17.864 2.176 0.116 1.00 0.00 C ATOM 2069 O ALA A 132 17.232 3.172 0.465 1.00 0.00 O ATOM 2070 CB ALA A 132 18.222 0.099 -1.304 1.00 0.00 C ATOM 2071 OXT ALA A 132 19.143 1.966 0.590 1.00 0.00 O ATOM 0 H ALA A 132 15.678 1.590 -2.183 1.00 0.00 H new ATOM 0 HA ALA A 132 16.431 0.663 -0.300 1.00 0.00 H new ATOM 0 HB1 ALA A 132 18.645 -0.401 -0.433 1.00 0.00 H new ATOM 0 HB2 ALA A 132 17.708 -0.632 -1.928 1.00 0.00 H new ATOM 0 HB3 ALA A 132 19.022 0.567 -1.878 1.00 0.00 H new