USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1033 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 81 ASN : amide:sc= 1.77 K(o=3,f=-9.3!) USER MOD Set 1.2: A 130 LYS NZ :NH3+ -164:sc= 1.21 (180deg=-0.111) USER MOD Set 2.1: A 85 THR OG1 : rot 120:sc= 0 USER MOD Set 2.2: A 89 ASN : amide:sc= 1.31 K(o=-1.7,f=-1.1) USER MOD Set 2.3: A 123 GLN : amide:sc= -3! K(o=-1.7!,f=-1.1) USER MOD Set 3.1: A 82 CYS SG : rot 83:sc= 0.899 USER MOD Set 3.2: A 102 THR OG1 : rot 48:sc= 0.362 USER MOD Set 4.1: A 9 GLN : amide:sc=0.000732 K(o=-1.5,f=-0.53) USER MOD Set 4.2: A 11 GLN : amide:sc= -1.5! K(o=-1.5!,f=-0.53) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 HIS : no HD1:sc= -0.541 K(o=-0.54,f=0) USER MOD Single : A 16 HIS : no HD1:sc= -0.0428 X(o=-0.043,f=-0.043) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 166:sc=-0.00517 (180deg=-0.182) USER MOD Single : A 28 LYS NZ :NH3+ -166:sc= -0.011 (180deg=-0.198) USER MOD Single : A 29 THR OG1 : rot 66:sc= 0.976 USER MOD Single : A 32 SER OG : rot 78:sc= 0.0276 USER MOD Single : A 33 GLN : amide:sc= -1.51! K(o=-1.5!,f=-0.15) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 105:sc= 1.55 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 70:sc= 1.24 USER MOD Single : A 51 ASN : amide:sc= 0.818 K(o=0.82,f=0) USER MOD Single : A 54 THR OG1 : rot -84:sc= 1.65 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0132 USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 60 THR OG1 : rot 87:sc= 0.948 USER MOD Single : A 67 SER OG : rot 180:sc= -0.0299 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 159:sc= 1.37 (180deg=0.0675) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -0.387 K(o=-0.39,f=-2.4!) USER MOD Single : A 91 GLN : amide:sc= -3.04! C(o=-3!,f=-1.8!) USER MOD Single : A 94 ASN : amide:sc= 0.0609 K(o=0.061,f=-1.5) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 121:sc= 0.453 USER MOD Single : A 106 ASN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 111:sc= 1.22 USER MOD Single : A 109 SER OG : rot 10:sc= 1.12 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -2.27 K(o=-2.3,f=-7.9!) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= -0.847 K(o=-0.85,f=-0.11) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= 0.697 K(o=0.7,f=-0.024) USER MOD Single : A 129 THR OG1 : rot -78:sc= 0.203 USER MOD Single : A 134 LYS NZ :NH3+ 156:sc= -0.0219 (180deg=-0.134) USER MOD Single : A 138 LYS NZ :NH3+ -106:sc= 1.17 (180deg=0.784) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.764 8.529 3.250 1.00 0.00 N ATOM 2 CA PRO A 1 4.753 7.868 2.447 1.00 0.00 C ATOM 3 C PRO A 1 6.004 8.706 2.478 1.00 0.00 C ATOM 4 O PRO A 1 6.137 9.577 3.302 1.00 0.00 O ATOM 5 CB PRO A 1 4.229 7.771 1.033 1.00 0.00 C ATOM 6 CG PRO A 1 3.249 8.881 0.945 1.00 0.00 C ATOM 7 CD PRO A 1 2.816 9.219 2.368 1.00 0.00 C ATOM 0 H2 PRO A 1 4.210 9.197 3.879 1.00 0.00 H new ATOM 0 H3 PRO A 1 3.273 7.851 3.833 1.00 0.00 H new ATOM 0 HA PRO A 1 4.969 6.867 2.821 1.00 0.00 H new ATOM 0 HB2 PRO A 1 5.029 7.884 0.301 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.759 6.806 0.845 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.696 9.750 0.463 1.00 0.00 H new ATOM 0 HG3 PRO A 1 2.390 8.588 0.341 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.837 10.296 2.538 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.795 8.887 2.555 1.00 0.00 H new ATOM 17 N VAL A 2 6.908 8.430 1.622 1.00 0.00 N ATOM 18 CA VAL A 2 8.116 9.211 1.547 1.00 0.00 C ATOM 19 C VAL A 2 8.012 10.251 0.408 1.00 0.00 C ATOM 20 O VAL A 2 7.307 10.040 -0.576 1.00 0.00 O ATOM 21 CB VAL A 2 9.359 8.288 1.321 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.663 9.027 1.583 1.00 0.00 C ATOM 23 CG2 VAL A 2 9.276 7.019 2.175 1.00 0.00 C ATOM 0 H VAL A 2 6.850 7.665 0.949 1.00 0.00 H new ATOM 0 HA VAL A 2 8.243 9.736 2.494 1.00 0.00 H new ATOM 0 HB VAL A 2 9.349 7.991 0.272 1.00 0.00 H new ATOM 0 HG11 VAL A 2 11.503 8.353 1.416 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.741 9.879 0.907 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.681 9.380 2.614 1.00 0.00 H new ATOM 0 HG21 VAL A 2 10.155 6.400 1.994 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.236 7.292 3.229 1.00 0.00 H new ATOM 0 HG23 VAL A 2 8.378 6.460 1.910 1.00 0.00 H new ATOM 33 N THR A 3 8.669 11.360 0.576 1.00 0.00 N ATOM 34 CA THR A 3 8.850 12.359 -0.439 1.00 0.00 C ATOM 35 C THR A 3 10.358 12.541 -0.494 1.00 0.00 C ATOM 36 O THR A 3 11.004 12.548 0.569 1.00 0.00 O ATOM 37 CB THR A 3 8.093 13.704 -0.068 1.00 0.00 C ATOM 38 OG1 THR A 3 8.353 14.752 -1.026 1.00 0.00 O ATOM 39 CG2 THR A 3 8.433 14.209 1.337 1.00 0.00 C ATOM 0 H THR A 3 9.113 11.605 1.461 1.00 0.00 H new ATOM 0 HA THR A 3 8.435 12.070 -1.404 1.00 0.00 H new ATOM 0 HB THR A 3 7.033 13.453 -0.092 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.868 15.562 -0.764 1.00 0.00 H new ATOM 0 HG21 THR A 3 7.886 15.131 1.534 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.151 13.455 2.073 1.00 0.00 H new ATOM 0 HG23 THR A 3 9.504 14.401 1.406 1.00 0.00 H new ATOM 47 N GLU A 4 10.949 12.628 -1.677 1.00 0.00 N ATOM 48 CA GLU A 4 12.393 12.583 -1.760 1.00 0.00 C ATOM 49 C GLU A 4 13.001 13.661 -2.664 1.00 0.00 C ATOM 50 O GLU A 4 12.351 14.211 -3.546 1.00 0.00 O ATOM 51 CB GLU A 4 12.879 11.170 -2.176 1.00 0.00 C ATOM 52 CG GLU A 4 12.555 10.732 -3.627 1.00 0.00 C ATOM 53 CD GLU A 4 11.073 10.643 -3.967 1.00 0.00 C ATOM 54 OE1 GLU A 4 10.494 11.660 -4.430 1.00 0.00 O ATOM 55 OE2 GLU A 4 10.474 9.558 -3.822 1.00 0.00 O ATOM 0 H GLU A 4 10.463 12.727 -2.568 1.00 0.00 H new ATOM 0 HA GLU A 4 12.754 12.804 -0.756 1.00 0.00 H new ATOM 0 HB2 GLU A 4 13.959 11.126 -2.038 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.440 10.442 -1.493 1.00 0.00 H new ATOM 0 HG2 GLU A 4 13.027 11.434 -4.314 1.00 0.00 H new ATOM 0 HG3 GLU A 4 13.010 9.758 -3.805 1.00 0.00 H new ATOM 62 N THR A 5 14.205 14.003 -2.360 1.00 0.00 N ATOM 63 CA THR A 5 14.967 14.920 -3.182 1.00 0.00 C ATOM 64 C THR A 5 16.277 14.218 -3.491 1.00 0.00 C ATOM 65 O THR A 5 16.642 13.253 -2.790 1.00 0.00 O ATOM 66 CB THR A 5 15.252 16.302 -2.493 1.00 0.00 C ATOM 67 OG1 THR A 5 15.858 17.195 -3.429 1.00 0.00 O ATOM 68 CG2 THR A 5 16.186 16.169 -1.302 1.00 0.00 C ATOM 0 H THR A 5 14.702 13.663 -1.537 1.00 0.00 H new ATOM 0 HA THR A 5 14.390 15.160 -4.075 1.00 0.00 H new ATOM 0 HB THR A 5 14.292 16.685 -2.146 1.00 0.00 H new ATOM 0 HG1 THR A 5 16.032 18.056 -2.994 1.00 0.00 H new ATOM 0 HG21 THR A 5 16.353 17.151 -0.859 1.00 0.00 H new ATOM 0 HG22 THR A 5 15.738 15.508 -0.560 1.00 0.00 H new ATOM 0 HG23 THR A 5 17.138 15.753 -1.631 1.00 0.00 H new ATOM 76 N VAL A 6 16.948 14.620 -4.528 1.00 0.00 N ATOM 77 CA VAL A 6 18.211 14.029 -4.867 1.00 0.00 C ATOM 78 C VAL A 6 19.320 15.049 -4.706 1.00 0.00 C ATOM 79 O VAL A 6 19.214 16.176 -5.188 1.00 0.00 O ATOM 80 CB VAL A 6 18.192 13.432 -6.313 1.00 0.00 C ATOM 81 CG1 VAL A 6 19.524 12.809 -6.690 1.00 0.00 C ATOM 82 CG2 VAL A 6 17.076 12.400 -6.450 1.00 0.00 C ATOM 0 H VAL A 6 16.641 15.360 -5.159 1.00 0.00 H new ATOM 0 HA VAL A 6 18.400 13.202 -4.183 1.00 0.00 H new ATOM 0 HB VAL A 6 18.006 14.258 -7.000 1.00 0.00 H new ATOM 0 HG11 VAL A 6 19.465 12.407 -7.702 1.00 0.00 H new ATOM 0 HG12 VAL A 6 20.306 13.567 -6.646 1.00 0.00 H new ATOM 0 HG13 VAL A 6 19.759 12.004 -5.994 1.00 0.00 H new ATOM 0 HG21 VAL A 6 17.077 11.995 -7.462 1.00 0.00 H new ATOM 0 HG22 VAL A 6 17.237 11.593 -5.736 1.00 0.00 H new ATOM 0 HG23 VAL A 6 16.115 12.874 -6.250 1.00 0.00 H new ATOM 92 N ASP A 7 20.332 14.686 -3.953 1.00 0.00 N ATOM 93 CA ASP A 7 21.501 15.537 -3.795 1.00 0.00 C ATOM 94 C ASP A 7 22.406 15.333 -5.012 1.00 0.00 C ATOM 95 O ASP A 7 22.262 14.322 -5.711 1.00 0.00 O ATOM 96 CB ASP A 7 22.239 15.192 -2.489 1.00 0.00 C ATOM 97 CG ASP A 7 23.483 16.002 -2.243 1.00 0.00 C ATOM 98 OD1 ASP A 7 23.393 17.135 -1.742 1.00 0.00 O ATOM 99 OD2 ASP A 7 24.573 15.514 -2.529 1.00 0.00 O ATOM 0 H ASP A 7 20.375 13.807 -3.437 1.00 0.00 H new ATOM 0 HA ASP A 7 21.204 16.584 -3.733 1.00 0.00 H new ATOM 0 HB2 ASP A 7 21.556 15.335 -1.652 1.00 0.00 H new ATOM 0 HB3 ASP A 7 22.506 14.135 -2.506 1.00 0.00 H new ATOM 104 N GLY A 8 23.338 16.244 -5.246 1.00 0.00 N ATOM 105 CA GLY A 8 24.230 16.208 -6.418 1.00 0.00 C ATOM 106 C GLY A 8 25.255 15.049 -6.426 1.00 0.00 C ATOM 107 O GLY A 8 26.323 15.158 -7.024 1.00 0.00 O ATOM 0 H GLY A 8 23.506 17.039 -4.630 1.00 0.00 H new ATOM 0 HA2 GLY A 8 23.619 16.139 -7.318 1.00 0.00 H new ATOM 0 HA3 GLY A 8 24.772 17.152 -6.472 1.00 0.00 H new ATOM 111 N GLN A 9 24.937 13.987 -5.739 1.00 0.00 N ATOM 112 CA GLN A 9 25.709 12.762 -5.745 1.00 0.00 C ATOM 113 C GLN A 9 24.804 11.599 -6.129 1.00 0.00 C ATOM 114 O GLN A 9 25.239 10.453 -6.233 1.00 0.00 O ATOM 115 CB GLN A 9 26.373 12.521 -4.390 1.00 0.00 C ATOM 116 CG GLN A 9 25.424 12.582 -3.202 1.00 0.00 C ATOM 117 CD GLN A 9 26.121 12.330 -1.877 1.00 0.00 C ATOM 118 OE1 GLN A 9 27.084 11.574 -1.794 1.00 0.00 O ATOM 119 NE2 GLN A 9 25.691 12.992 -0.855 1.00 0.00 N ATOM 0 H GLN A 9 24.112 13.942 -5.141 1.00 0.00 H new ATOM 0 HA GLN A 9 26.508 12.849 -6.481 1.00 0.00 H new ATOM 0 HB2 GLN A 9 26.854 11.543 -4.404 1.00 0.00 H new ATOM 0 HB3 GLN A 9 27.160 13.262 -4.248 1.00 0.00 H new ATOM 0 HG2 GLN A 9 24.946 13.561 -3.175 1.00 0.00 H new ATOM 0 HG3 GLN A 9 24.633 11.844 -3.337 1.00 0.00 H new ATOM 0 HE21 GLN A 9 24.888 13.614 -0.951 1.00 0.00 H new ATOM 0 HE22 GLN A 9 26.154 12.893 0.048 1.00 0.00 H new ATOM 128 N GLY A 10 23.545 11.927 -6.364 1.00 0.00 N ATOM 129 CA GLY A 10 22.549 10.959 -6.737 1.00 0.00 C ATOM 130 C GLY A 10 22.034 10.151 -5.571 1.00 0.00 C ATOM 131 O GLY A 10 21.863 8.937 -5.667 1.00 0.00 O ATOM 0 H GLY A 10 23.191 12.881 -6.299 1.00 0.00 H new ATOM 0 HA2 GLY A 10 21.713 11.473 -7.211 1.00 0.00 H new ATOM 0 HA3 GLY A 10 22.971 10.283 -7.481 1.00 0.00 H new ATOM 135 N GLN A 11 21.805 10.796 -4.462 1.00 0.00 N ATOM 136 CA GLN A 11 21.184 10.120 -3.348 1.00 0.00 C ATOM 137 C GLN A 11 19.761 10.584 -3.276 1.00 0.00 C ATOM 138 O GLN A 11 19.479 11.719 -3.604 1.00 0.00 O ATOM 139 CB GLN A 11 21.882 10.374 -2.005 1.00 0.00 C ATOM 140 CG GLN A 11 21.990 11.835 -1.621 1.00 0.00 C ATOM 141 CD GLN A 11 22.251 12.061 -0.143 1.00 0.00 C ATOM 142 OE1 GLN A 11 22.900 13.023 0.230 1.00 0.00 O ATOM 143 NE2 GLN A 11 21.707 11.225 0.697 1.00 0.00 N ATOM 0 H GLN A 11 22.034 11.777 -4.301 1.00 0.00 H new ATOM 0 HA GLN A 11 21.258 9.046 -3.520 1.00 0.00 H new ATOM 0 HB2 GLN A 11 21.339 9.844 -1.222 1.00 0.00 H new ATOM 0 HB3 GLN A 11 22.884 9.946 -2.044 1.00 0.00 H new ATOM 0 HG2 GLN A 11 22.793 12.294 -2.197 1.00 0.00 H new ATOM 0 HG3 GLN A 11 21.067 12.344 -1.900 1.00 0.00 H new ATOM 0 HE21 GLN A 11 21.170 10.430 0.350 1.00 0.00 H new ATOM 0 HE22 GLN A 11 21.818 11.366 1.701 1.00 0.00 H new ATOM 152 N ALA A 12 18.911 9.746 -2.810 1.00 0.00 N ATOM 153 CA ALA A 12 17.499 9.997 -2.747 1.00 0.00 C ATOM 154 C ALA A 12 17.111 10.038 -1.304 1.00 0.00 C ATOM 155 O ALA A 12 17.088 9.013 -0.623 1.00 0.00 O ATOM 156 CB ALA A 12 16.759 8.896 -3.452 1.00 0.00 C ATOM 0 H ALA A 12 19.177 8.831 -2.446 1.00 0.00 H new ATOM 0 HA ALA A 12 17.251 10.941 -3.232 1.00 0.00 H new ATOM 0 HB1 ALA A 12 15.687 9.088 -3.403 1.00 0.00 H new ATOM 0 HB2 ALA A 12 17.073 8.856 -4.495 1.00 0.00 H new ATOM 0 HB3 ALA A 12 16.979 7.943 -2.970 1.00 0.00 H new ATOM 162 N TRP A 13 16.869 11.199 -0.824 1.00 0.00 N ATOM 163 CA TRP A 13 16.623 11.410 0.578 1.00 0.00 C ATOM 164 C TRP A 13 15.735 12.595 0.752 1.00 0.00 C ATOM 165 O TRP A 13 15.676 13.431 -0.109 1.00 0.00 O ATOM 166 CB TRP A 13 17.969 11.669 1.289 1.00 0.00 C ATOM 167 CG TRP A 13 18.665 12.925 0.820 1.00 0.00 C ATOM 168 CD1 TRP A 13 18.950 13.266 -0.464 1.00 0.00 C ATOM 169 CD2 TRP A 13 19.164 13.991 1.628 1.00 0.00 C ATOM 170 NE1 TRP A 13 19.577 14.457 -0.513 1.00 0.00 N ATOM 171 CE2 TRP A 13 19.732 14.933 0.751 1.00 0.00 C ATOM 172 CE3 TRP A 13 19.190 14.247 2.997 1.00 0.00 C ATOM 173 CZ2 TRP A 13 20.311 16.108 1.192 1.00 0.00 C ATOM 174 CZ3 TRP A 13 19.769 15.414 3.432 1.00 0.00 C ATOM 175 CH2 TRP A 13 20.323 16.332 2.533 1.00 0.00 C ATOM 0 H TRP A 13 16.832 12.048 -1.387 1.00 0.00 H new ATOM 0 HA TRP A 13 16.141 10.531 1.006 1.00 0.00 H new ATOM 0 HB2 TRP A 13 17.796 11.738 2.363 1.00 0.00 H new ATOM 0 HB3 TRP A 13 18.627 10.816 1.126 1.00 0.00 H new ATOM 0 HD1 TRP A 13 18.707 12.664 -1.327 1.00 0.00 H new ATOM 0 HE1 TRP A 13 19.886 14.927 -1.364 1.00 0.00 H new ATOM 0 HE3 TRP A 13 18.765 13.545 3.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 20.737 16.819 0.500 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 19.797 15.628 4.490 1.00 0.00 H new ATOM 0 HH2 TRP A 13 20.770 17.239 2.913 1.00 0.00 H new ATOM 186 N ARG A 14 15.009 12.599 1.826 1.00 0.00 N ATOM 187 CA ARG A 14 14.190 13.695 2.267 1.00 0.00 C ATOM 188 C ARG A 14 13.436 13.180 3.486 1.00 0.00 C ATOM 189 O ARG A 14 14.056 12.688 4.424 1.00 0.00 O ATOM 190 CB ARG A 14 13.246 14.300 1.190 1.00 0.00 C ATOM 191 CG ARG A 14 12.763 15.711 1.498 1.00 0.00 C ATOM 192 CD ARG A 14 11.707 16.214 0.516 1.00 0.00 C ATOM 193 NE ARG A 14 12.137 16.190 -0.907 1.00 0.00 N ATOM 194 CZ ARG A 14 11.758 17.106 -1.826 1.00 0.00 C ATOM 195 NH1 ARG A 14 11.135 18.202 -1.444 1.00 0.00 N ATOM 196 NH2 ARG A 14 12.019 16.914 -3.127 1.00 0.00 N ATOM 0 H ARG A 14 14.967 11.797 2.455 1.00 0.00 H new ATOM 0 HA ARG A 14 14.827 14.546 2.505 1.00 0.00 H new ATOM 0 HB2 ARG A 14 13.766 14.308 0.232 1.00 0.00 H new ATOM 0 HB3 ARG A 14 12.379 13.649 1.077 1.00 0.00 H new ATOM 0 HG2 ARG A 14 12.352 15.735 2.507 1.00 0.00 H new ATOM 0 HG3 ARG A 14 13.615 16.391 1.485 1.00 0.00 H new ATOM 0 HD2 ARG A 14 10.809 15.606 0.623 1.00 0.00 H new ATOM 0 HD3 ARG A 14 11.434 17.235 0.784 1.00 0.00 H new ATOM 0 HE ARG A 14 12.755 15.437 -1.208 1.00 0.00 H new ATOM 0 HH11 ARG A 14 10.939 18.359 -0.455 1.00 0.00 H new ATOM 0 HH12 ARG A 14 10.849 18.894 -2.137 1.00 0.00 H new ATOM 0 HH21 ARG A 14 12.507 16.071 -3.430 1.00 0.00 H new ATOM 0 HH22 ARG A 14 11.729 17.611 -3.813 1.00 0.00 H new ATOM 210 N HIS A 15 12.127 13.217 3.469 1.00 0.00 N ATOM 211 CA HIS A 15 11.364 12.818 4.635 1.00 0.00 C ATOM 212 C HIS A 15 10.439 11.680 4.337 1.00 0.00 C ATOM 213 O HIS A 15 9.798 11.640 3.281 1.00 0.00 O ATOM 214 CB HIS A 15 10.526 13.975 5.158 1.00 0.00 C ATOM 215 CG HIS A 15 11.312 15.069 5.815 1.00 0.00 C ATOM 216 ND1 HIS A 15 11.066 15.498 7.090 1.00 0.00 N ATOM 217 CD2 HIS A 15 12.304 15.854 5.347 1.00 0.00 C ATOM 218 CE1 HIS A 15 11.859 16.491 7.376 1.00 0.00 C ATOM 219 NE2 HIS A 15 12.627 16.734 6.344 1.00 0.00 N ATOM 0 H HIS A 15 11.567 13.516 2.670 1.00 0.00 H new ATOM 0 HA HIS A 15 12.093 12.506 5.383 1.00 0.00 H new ATOM 0 HB2 HIS A 15 9.960 14.400 4.329 1.00 0.00 H new ATOM 0 HB3 HIS A 15 9.801 13.587 5.873 1.00 0.00 H new ATOM 0 HD2 HIS A 15 12.758 15.798 4.369 1.00 0.00 H new ATOM 0 HE1 HIS A 15 11.880 17.027 8.313 1.00 0.00 H new ATOM 0 HE2 HIS A 15 13.345 17.457 6.292 1.00 0.00 H new ATOM 228 N HIS A 16 10.373 10.748 5.247 1.00 0.00 N ATOM 229 CA HIS A 16 9.343 9.767 5.182 1.00 0.00 C ATOM 230 C HIS A 16 8.305 10.350 6.097 1.00 0.00 C ATOM 231 O HIS A 16 8.608 10.616 7.258 1.00 0.00 O ATOM 232 CB HIS A 16 9.815 8.325 5.561 1.00 0.00 C ATOM 233 CG HIS A 16 10.161 8.064 6.992 1.00 0.00 C ATOM 234 ND1 HIS A 16 11.432 8.164 7.503 1.00 0.00 N ATOM 235 CD2 HIS A 16 9.382 7.646 7.997 1.00 0.00 C ATOM 236 CE1 HIS A 16 11.411 7.806 8.772 1.00 0.00 C ATOM 237 NE2 HIS A 16 10.179 7.492 9.097 1.00 0.00 N ATOM 0 H HIS A 16 11.017 10.653 6.033 1.00 0.00 H new ATOM 0 HA HIS A 16 8.968 9.593 4.174 1.00 0.00 H new ATOM 0 HB2 HIS A 16 9.029 7.627 5.273 1.00 0.00 H new ATOM 0 HB3 HIS A 16 10.689 8.088 4.955 1.00 0.00 H new ATOM 0 HD2 HIS A 16 8.319 7.464 7.948 1.00 0.00 H new ATOM 0 HE1 HIS A 16 12.265 7.776 9.433 1.00 0.00 H new ATOM 0 HE2 HIS A 16 9.868 7.184 10.018 1.00 0.00 H new ATOM 246 N ASN A 17 7.142 10.609 5.601 1.00 0.00 N ATOM 247 CA ASN A 17 6.275 11.535 6.256 1.00 0.00 C ATOM 248 C ASN A 17 4.806 11.343 5.923 1.00 0.00 C ATOM 249 O ASN A 17 4.447 11.223 4.749 1.00 0.00 O ATOM 250 CB ASN A 17 6.773 12.925 5.830 1.00 0.00 C ATOM 251 CG ASN A 17 5.717 13.986 5.627 1.00 0.00 C ATOM 252 OD1 ASN A 17 5.314 14.693 6.559 1.00 0.00 O ATOM 253 ND2 ASN A 17 5.301 14.123 4.406 1.00 0.00 N ATOM 0 H ASN A 17 6.769 10.195 4.747 1.00 0.00 H new ATOM 0 HA ASN A 17 6.316 11.389 7.335 1.00 0.00 H new ATOM 0 HB2 ASN A 17 7.475 13.282 6.584 1.00 0.00 H new ATOM 0 HB3 ASN A 17 7.332 12.817 4.900 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.611 14.839 4.180 1.00 0.00 H new ATOM 0 HD22 ASN A 17 5.664 13.515 3.672 1.00 0.00 H new ATOM 260 N GLY A 18 4.006 11.252 6.995 1.00 0.00 N ATOM 261 CA GLY A 18 2.535 11.251 6.978 1.00 0.00 C ATOM 262 C GLY A 18 1.882 10.754 5.726 1.00 0.00 C ATOM 263 O GLY A 18 2.042 9.600 5.341 1.00 0.00 O ATOM 0 H GLY A 18 4.383 11.174 7.940 1.00 0.00 H new ATOM 0 HA2 GLY A 18 2.185 10.641 7.811 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.191 12.269 7.161 1.00 0.00 H new ATOM 267 N PHE A 19 1.140 11.635 5.114 1.00 0.00 N ATOM 268 CA PHE A 19 0.418 11.406 3.878 1.00 0.00 C ATOM 269 C PHE A 19 0.065 12.744 3.339 1.00 0.00 C ATOM 270 O PHE A 19 0.237 13.755 4.026 1.00 0.00 O ATOM 271 CB PHE A 19 -0.947 10.690 4.108 1.00 0.00 C ATOM 272 CG PHE A 19 -0.925 9.293 4.623 1.00 0.00 C ATOM 273 CD1 PHE A 19 -0.680 8.229 3.773 1.00 0.00 C ATOM 274 CD2 PHE A 19 -1.181 9.036 5.958 1.00 0.00 C ATOM 275 CE1 PHE A 19 -0.687 6.943 4.252 1.00 0.00 C ATOM 276 CE2 PHE A 19 -1.184 7.750 6.429 1.00 0.00 C ATOM 277 CZ PHE A 19 -0.936 6.710 5.578 1.00 0.00 C ATOM 0 H PHE A 19 1.012 12.580 5.475 1.00 0.00 H new ATOM 0 HA PHE A 19 1.045 10.795 3.229 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.528 11.294 4.805 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.487 10.689 3.161 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.482 8.412 2.727 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.380 9.855 6.633 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.496 6.116 3.584 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -1.382 7.558 7.473 1.00 0.00 H new ATOM 0 HZ PHE A 19 -0.936 5.698 5.954 1.00 0.00 H new ATOM 287 N ASP A 20 -0.366 12.782 2.117 1.00 0.00 N ATOM 288 CA ASP A 20 -1.076 13.921 1.619 1.00 0.00 C ATOM 289 C ASP A 20 -2.470 13.747 2.125 1.00 0.00 C ATOM 290 O ASP A 20 -3.068 12.669 1.929 1.00 0.00 O ATOM 291 CB ASP A 20 -1.100 13.903 0.104 1.00 0.00 C ATOM 292 CG ASP A 20 -1.916 15.022 -0.492 1.00 0.00 C ATOM 293 OD1 ASP A 20 -3.128 14.863 -0.641 1.00 0.00 O ATOM 294 OD2 ASP A 20 -1.334 16.065 -0.857 1.00 0.00 O ATOM 0 H ASP A 20 -0.238 12.030 1.439 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.617 14.857 1.936 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.078 13.969 -0.270 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.503 12.948 -0.235 1.00 0.00 H new ATOM 299 N PHE A 21 -3.002 14.734 2.773 1.00 0.00 N ATOM 300 CA PHE A 21 -4.256 14.541 3.396 1.00 0.00 C ATOM 301 C PHE A 21 -5.362 14.482 2.388 1.00 0.00 C ATOM 302 O PHE A 21 -6.253 13.672 2.520 1.00 0.00 O ATOM 303 CB PHE A 21 -4.547 15.564 4.475 1.00 0.00 C ATOM 304 CG PHE A 21 -5.729 15.163 5.310 1.00 0.00 C ATOM 305 CD1 PHE A 21 -5.597 14.150 6.237 1.00 0.00 C ATOM 306 CD2 PHE A 21 -6.959 15.756 5.148 1.00 0.00 C ATOM 307 CE1 PHE A 21 -6.664 13.745 6.992 1.00 0.00 C ATOM 308 CE2 PHE A 21 -8.033 15.360 5.896 1.00 0.00 C ATOM 309 CZ PHE A 21 -7.890 14.352 6.821 1.00 0.00 C ATOM 0 H PHE A 21 -2.592 15.662 2.879 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.202 13.575 3.898 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.671 15.679 5.114 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.737 16.534 4.016 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -4.639 13.670 6.369 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.078 16.545 4.420 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -6.546 12.954 7.718 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -8.992 15.838 5.761 1.00 0.00 H new ATOM 0 HZ PHE A 21 -8.737 14.037 7.412 1.00 0.00 H new ATOM 319 N ALA A 22 -5.257 15.294 1.350 1.00 0.00 N ATOM 320 CA ALA A 22 -6.265 15.387 0.309 1.00 0.00 C ATOM 321 C ALA A 22 -6.534 14.044 -0.354 1.00 0.00 C ATOM 322 O ALA A 22 -7.698 13.674 -0.556 1.00 0.00 O ATOM 323 CB ALA A 22 -5.867 16.417 -0.725 1.00 0.00 C ATOM 0 H ALA A 22 -4.460 15.914 1.205 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.192 15.703 0.787 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.634 16.473 -1.497 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.762 17.391 -0.247 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.917 16.131 -1.177 1.00 0.00 H new ATOM 329 N VAL A 23 -5.484 13.300 -0.632 1.00 0.00 N ATOM 330 CA VAL A 23 -5.639 12.027 -1.312 1.00 0.00 C ATOM 331 C VAL A 23 -6.377 11.009 -0.404 1.00 0.00 C ATOM 332 O VAL A 23 -7.293 10.320 -0.847 1.00 0.00 O ATOM 333 CB VAL A 23 -4.281 11.464 -1.875 1.00 0.00 C ATOM 334 CG1 VAL A 23 -3.350 10.968 -0.802 1.00 0.00 C ATOM 335 CG2 VAL A 23 -4.520 10.393 -2.903 1.00 0.00 C ATOM 0 H VAL A 23 -4.522 13.549 -0.401 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.261 12.200 -2.190 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.784 12.308 -2.353 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.434 10.594 -1.259 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -3.109 11.786 -0.123 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -3.832 10.164 -0.245 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.563 10.024 -3.273 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -5.075 9.572 -2.450 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.095 10.806 -3.732 1.00 0.00 H new ATOM 345 N ILE A 24 -6.001 10.983 0.885 1.00 0.00 N ATOM 346 CA ILE A 24 -6.658 10.149 1.893 1.00 0.00 C ATOM 347 C ILE A 24 -8.111 10.565 2.010 1.00 0.00 C ATOM 348 O ILE A 24 -9.015 9.752 1.905 1.00 0.00 O ATOM 349 CB ILE A 24 -5.980 10.337 3.292 1.00 0.00 C ATOM 350 CG1 ILE A 24 -4.487 9.966 3.262 1.00 0.00 C ATOM 351 CG2 ILE A 24 -6.702 9.552 4.398 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.199 8.523 2.911 1.00 0.00 C ATOM 0 H ILE A 24 -5.231 11.542 1.253 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.575 9.106 1.588 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.062 11.398 3.527 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -3.982 10.608 2.541 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.054 10.181 4.239 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.195 9.714 5.349 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.734 9.895 4.474 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.690 8.489 4.157 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.122 8.356 2.915 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.670 7.869 3.645 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.597 8.303 1.920 1.00 0.00 H new ATOM 364 N LYS A 25 -8.289 11.848 2.183 1.00 0.00 N ATOM 365 CA LYS A 25 -9.558 12.518 2.351 1.00 0.00 C ATOM 366 C LYS A 25 -10.513 12.148 1.233 1.00 0.00 C ATOM 367 O LYS A 25 -11.621 11.701 1.490 1.00 0.00 O ATOM 368 CB LYS A 25 -9.265 14.012 2.342 1.00 0.00 C ATOM 369 CG LYS A 25 -10.410 14.966 2.638 1.00 0.00 C ATOM 370 CD LYS A 25 -9.935 16.418 2.520 1.00 0.00 C ATOM 371 CE LYS A 25 -9.703 16.849 1.066 1.00 0.00 C ATOM 372 NZ LYS A 25 -10.948 16.871 0.285 1.00 0.00 N ATOM 0 H LYS A 25 -7.503 12.497 2.213 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.037 12.221 3.284 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.476 14.202 3.070 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.863 14.267 1.362 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.231 14.787 1.943 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.796 14.782 3.641 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.675 17.076 2.976 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.010 16.540 3.083 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.250 17.840 1.051 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -8.994 16.167 0.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.790 17.386 -0.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.243 15.896 0.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.693 17.347 0.833 1.00 0.00 H new ATOM 386 N GLU A 26 -10.071 12.282 0.003 1.00 0.00 N ATOM 387 CA GLU A 26 -10.916 11.979 -1.127 1.00 0.00 C ATOM 388 C GLU A 26 -11.115 10.476 -1.322 1.00 0.00 C ATOM 389 O GLU A 26 -12.174 10.060 -1.787 1.00 0.00 O ATOM 390 CB GLU A 26 -10.438 12.666 -2.393 1.00 0.00 C ATOM 391 CG GLU A 26 -10.563 14.173 -2.318 1.00 0.00 C ATOM 392 CD GLU A 26 -10.091 14.851 -3.553 1.00 0.00 C ATOM 393 OE1 GLU A 26 -10.876 14.991 -4.494 1.00 0.00 O ATOM 394 OE2 GLU A 26 -8.939 15.284 -3.596 1.00 0.00 O ATOM 0 H GLU A 26 -9.132 12.599 -0.239 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.900 12.389 -0.899 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.397 12.400 -2.576 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.015 12.299 -3.242 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.605 14.438 -2.139 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.990 14.539 -1.466 1.00 0.00 H new ATOM 401 N LEU A 27 -10.119 9.659 -0.974 1.00 0.00 N ATOM 402 CA LEU A 27 -10.301 8.201 -1.041 1.00 0.00 C ATOM 403 C LEU A 27 -11.355 7.770 -0.010 1.00 0.00 C ATOM 404 O LEU A 27 -12.210 6.949 -0.290 1.00 0.00 O ATOM 405 CB LEU A 27 -8.969 7.456 -0.850 1.00 0.00 C ATOM 406 CG LEU A 27 -8.984 5.949 -1.143 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.526 5.688 -2.518 1.00 0.00 C ATOM 408 CD2 LEU A 27 -7.586 5.383 -1.050 1.00 0.00 C ATOM 0 H LEU A 27 -9.202 9.966 -0.651 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.660 7.934 -2.035 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.221 7.922 -1.492 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.640 7.601 0.179 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.623 5.467 -0.404 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.530 4.615 -2.710 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.544 6.073 -2.587 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.899 6.187 -3.257 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.612 4.314 -1.260 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.943 5.880 -1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.193 5.546 -0.046 1.00 0.00 H new ATOM 420 N LYS A 28 -11.295 8.384 1.155 1.00 0.00 N ATOM 421 CA LYS A 28 -12.282 8.197 2.218 1.00 0.00 C ATOM 422 C LYS A 28 -13.658 8.692 1.739 1.00 0.00 C ATOM 423 O LYS A 28 -14.691 8.070 2.002 1.00 0.00 O ATOM 424 CB LYS A 28 -11.823 8.959 3.478 1.00 0.00 C ATOM 425 CG LYS A 28 -12.779 8.906 4.662 1.00 0.00 C ATOM 426 CD LYS A 28 -12.175 9.583 5.865 1.00 0.00 C ATOM 427 CE LYS A 28 -13.158 9.646 7.024 1.00 0.00 C ATOM 428 NZ LYS A 28 -14.328 10.501 6.727 1.00 0.00 N ATOM 0 H LYS A 28 -10.551 9.038 1.400 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.370 7.139 2.466 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -10.860 8.558 3.793 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -11.661 10.003 3.211 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -13.719 9.392 4.399 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.012 7.868 4.901 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.280 9.044 6.175 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -11.863 10.592 5.597 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -13.499 8.639 7.262 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -12.648 10.028 7.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.841 10.705 7.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -14.007 11.393 6.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -14.960 10.007 6.065 1.00 0.00 H new ATOM 442 N THR A 29 -13.650 9.785 0.999 1.00 0.00 N ATOM 443 CA THR A 29 -14.872 10.318 0.430 1.00 0.00 C ATOM 444 C THR A 29 -15.455 9.295 -0.556 1.00 0.00 C ATOM 445 O THR A 29 -16.633 8.955 -0.489 1.00 0.00 O ATOM 446 CB THR A 29 -14.620 11.649 -0.299 1.00 0.00 C ATOM 447 OG1 THR A 29 -13.949 12.544 0.589 1.00 0.00 O ATOM 448 CG2 THR A 29 -15.937 12.277 -0.737 1.00 0.00 C ATOM 0 H THR A 29 -12.810 10.321 0.778 1.00 0.00 H new ATOM 0 HA THR A 29 -15.575 10.507 1.241 1.00 0.00 H new ATOM 0 HB THR A 29 -14.010 11.459 -1.182 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.058 12.192 0.796 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.738 13.218 -1.251 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.457 11.598 -1.412 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.559 12.466 0.138 1.00 0.00 H new ATOM 456 N ALA A 30 -14.594 8.766 -1.444 1.00 0.00 N ATOM 457 CA ALA A 30 -14.974 7.775 -2.399 1.00 0.00 C ATOM 458 C ALA A 30 -15.494 6.546 -1.695 1.00 0.00 C ATOM 459 O ALA A 30 -16.500 6.030 -2.065 1.00 0.00 O ATOM 460 CB ALA A 30 -13.802 7.412 -3.292 1.00 0.00 C ATOM 0 H ALA A 30 -13.611 9.034 -1.498 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.767 8.186 -3.024 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.114 6.655 -4.012 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.461 8.300 -3.824 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -12.988 7.019 -2.683 1.00 0.00 H new ATOM 466 N ALA A 31 -14.825 6.138 -0.655 1.00 0.00 N ATOM 467 CA ALA A 31 -15.186 4.982 0.137 1.00 0.00 C ATOM 468 C ALA A 31 -16.639 5.059 0.630 1.00 0.00 C ATOM 469 O ALA A 31 -17.372 4.093 0.544 1.00 0.00 O ATOM 470 CB ALA A 31 -14.262 4.932 1.310 1.00 0.00 C ATOM 0 H ALA A 31 -13.986 6.611 -0.319 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.100 4.086 -0.477 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.507 4.070 1.930 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.233 4.846 0.960 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.370 5.844 1.898 1.00 0.00 H new ATOM 476 N SER A 32 -17.050 6.217 1.099 1.00 0.00 N ATOM 477 CA SER A 32 -18.380 6.371 1.635 1.00 0.00 C ATOM 478 C SER A 32 -19.446 6.622 0.527 1.00 0.00 C ATOM 479 O SER A 32 -20.567 6.129 0.611 1.00 0.00 O ATOM 480 CB SER A 32 -18.367 7.503 2.665 1.00 0.00 C ATOM 481 OG SER A 32 -17.385 7.260 3.669 1.00 0.00 O ATOM 0 H SER A 32 -16.481 7.063 1.119 1.00 0.00 H new ATOM 0 HA SER A 32 -18.670 5.437 2.117 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.159 8.451 2.168 1.00 0.00 H new ATOM 0 HB3 SER A 32 -19.351 7.593 3.126 1.00 0.00 H new ATOM 0 HG SER A 32 -16.496 7.476 3.317 1.00 0.00 H new ATOM 487 N GLN A 33 -19.064 7.325 -0.523 1.00 0.00 N ATOM 488 CA GLN A 33 -20.005 7.747 -1.579 1.00 0.00 C ATOM 489 C GLN A 33 -20.106 6.725 -2.700 1.00 0.00 C ATOM 490 O GLN A 33 -21.186 6.344 -3.132 1.00 0.00 O ATOM 491 CB GLN A 33 -19.480 9.030 -2.211 1.00 0.00 C ATOM 492 CG GLN A 33 -19.412 10.227 -1.297 1.00 0.00 C ATOM 493 CD GLN A 33 -20.730 10.926 -1.114 1.00 0.00 C ATOM 494 OE1 GLN A 33 -20.994 11.477 -0.056 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.540 10.974 -2.154 1.00 0.00 N ATOM 0 H GLN A 33 -18.102 7.625 -0.680 1.00 0.00 H new ATOM 0 HA GLN A 33 -20.982 7.871 -1.113 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.481 8.838 -2.603 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.114 9.281 -3.061 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.042 9.908 -0.323 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -18.687 10.937 -1.696 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.285 10.501 -3.021 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.421 11.484 -2.091 1.00 0.00 H new ATOM 504 N TYR A 34 -18.965 6.319 -3.153 1.00 0.00 N ATOM 505 CA TYR A 34 -18.772 5.500 -4.333 1.00 0.00 C ATOM 506 C TYR A 34 -18.590 4.070 -3.956 1.00 0.00 C ATOM 507 O TYR A 34 -19.142 3.179 -4.592 1.00 0.00 O ATOM 508 CB TYR A 34 -17.546 6.088 -5.077 1.00 0.00 C ATOM 509 CG TYR A 34 -17.888 7.368 -5.784 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.416 7.352 -7.063 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.751 8.594 -5.145 1.00 0.00 C ATOM 512 CE1 TYR A 34 -18.773 8.530 -7.696 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.114 9.769 -5.763 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.627 9.735 -7.037 1.00 0.00 C ATOM 515 OH TYR A 34 -18.999 10.909 -7.659 1.00 0.00 O ATOM 0 H TYR A 34 -18.086 6.556 -2.693 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.643 5.517 -4.989 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.741 6.269 -4.365 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.175 5.361 -5.799 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -18.551 6.410 -7.573 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.351 8.626 -4.142 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -19.165 8.507 -8.702 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -17.996 10.712 -5.250 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.832 11.665 -7.058 1.00 0.00 H new ATOM 525 N GLY A 35 -17.881 3.869 -2.884 1.00 0.00 N ATOM 526 CA GLY A 35 -17.588 2.562 -2.413 1.00 0.00 C ATOM 527 C GLY A 35 -16.528 1.928 -3.228 1.00 0.00 C ATOM 528 O GLY A 35 -15.985 2.549 -4.135 1.00 0.00 O ATOM 0 H GLY A 35 -17.490 4.618 -2.313 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.271 2.610 -1.371 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.490 1.950 -2.444 1.00 0.00 H new ATOM 532 N ALA A 36 -16.232 0.710 -2.928 1.00 0.00 N ATOM 533 CA ALA A 36 -15.262 -0.031 -3.661 1.00 0.00 C ATOM 534 C ALA A 36 -15.872 -0.497 -4.964 1.00 0.00 C ATOM 535 O ALA A 36 -17.091 -0.529 -5.095 1.00 0.00 O ATOM 536 CB ALA A 36 -14.807 -1.195 -2.867 1.00 0.00 C ATOM 0 H ALA A 36 -16.661 0.195 -2.159 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.401 0.604 -3.871 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -14.065 -1.756 -3.436 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -14.363 -0.848 -1.934 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -15.658 -1.839 -2.646 1.00 0.00 H new ATOM 542 N THR A 37 -15.036 -0.782 -5.948 1.00 0.00 N ATOM 543 CA THR A 37 -15.490 -1.251 -7.241 1.00 0.00 C ATOM 544 C THR A 37 -15.903 -0.100 -8.200 1.00 0.00 C ATOM 545 O THR A 37 -15.818 -0.258 -9.417 1.00 0.00 O ATOM 546 CB THR A 37 -16.525 -2.429 -7.114 1.00 0.00 C ATOM 547 OG1 THR A 37 -15.837 -3.593 -6.605 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.221 -2.765 -8.429 1.00 0.00 C ATOM 0 H THR A 37 -14.023 -0.694 -5.870 1.00 0.00 H new ATOM 0 HA THR A 37 -14.631 -1.696 -7.743 1.00 0.00 H new ATOM 0 HB THR A 37 -17.310 -2.108 -6.430 1.00 0.00 H new ATOM 0 HG1 THR A 37 -16.069 -3.724 -5.662 1.00 0.00 H new ATOM 0 HG21 THR A 37 -17.921 -3.585 -8.271 1.00 0.00 H new ATOM 0 HG22 THR A 37 -17.763 -1.890 -8.788 1.00 0.00 H new ATOM 0 HG23 THR A 37 -16.477 -3.060 -9.169 1.00 0.00 H new ATOM 556 N ALA A 38 -16.309 1.053 -7.666 1.00 0.00 N ATOM 557 CA ALA A 38 -16.511 2.214 -8.519 1.00 0.00 C ATOM 558 C ALA A 38 -15.134 2.656 -9.036 1.00 0.00 C ATOM 559 O ALA A 38 -14.248 2.921 -8.218 1.00 0.00 O ATOM 560 CB ALA A 38 -17.167 3.331 -7.739 1.00 0.00 C ATOM 0 H ALA A 38 -16.499 1.202 -6.675 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.167 1.965 -9.353 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.312 4.193 -8.390 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.133 2.994 -7.363 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.530 3.612 -6.901 1.00 0.00 H new ATOM 566 N PRO A 39 -14.940 2.710 -10.401 1.00 0.00 N ATOM 567 CA PRO A 39 -13.638 3.013 -11.070 1.00 0.00 C ATOM 568 C PRO A 39 -12.828 4.127 -10.390 1.00 0.00 C ATOM 569 O PRO A 39 -11.600 4.037 -10.272 1.00 0.00 O ATOM 570 CB PRO A 39 -14.072 3.448 -12.471 1.00 0.00 C ATOM 571 CG PRO A 39 -15.311 2.659 -12.734 1.00 0.00 C ATOM 572 CD PRO A 39 -15.999 2.472 -11.405 1.00 0.00 C ATOM 0 HA PRO A 39 -12.969 2.153 -11.043 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.266 4.520 -12.512 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.300 3.235 -13.211 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -15.961 3.182 -13.435 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.068 1.696 -13.182 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -16.825 3.173 -11.284 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.416 1.469 -11.312 1.00 0.00 H new ATOM 580 N TYR A 40 -13.534 5.142 -9.918 1.00 0.00 N ATOM 581 CA TYR A 40 -12.955 6.287 -9.245 1.00 0.00 C ATOM 582 C TYR A 40 -12.081 5.890 -8.041 1.00 0.00 C ATOM 583 O TYR A 40 -10.881 6.184 -8.037 1.00 0.00 O ATOM 584 CB TYR A 40 -14.075 7.247 -8.806 1.00 0.00 C ATOM 585 CG TYR A 40 -13.626 8.495 -8.086 1.00 0.00 C ATOM 586 CD1 TYR A 40 -12.924 9.484 -8.748 1.00 0.00 C ATOM 587 CD2 TYR A 40 -13.911 8.680 -6.737 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.522 10.641 -8.088 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.516 9.826 -6.072 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.818 10.797 -6.747 1.00 0.00 C ATOM 591 OH TYR A 40 -12.421 11.938 -6.083 1.00 0.00 O ATOM 0 H TYR A 40 -14.550 5.191 -9.996 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.296 6.787 -9.955 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.640 7.544 -9.689 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.761 6.702 -8.157 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -12.684 9.357 -9.793 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.451 7.914 -6.199 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -11.983 11.411 -8.619 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.755 9.957 -5.027 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.709 11.889 -5.148 1.00 0.00 H new ATOM 601 N THR A 41 -12.663 5.229 -7.013 1.00 0.00 N ATOM 602 CA THR A 41 -11.933 4.892 -5.809 1.00 0.00 C ATOM 603 C THR A 41 -10.675 4.046 -6.098 1.00 0.00 C ATOM 604 O THR A 41 -9.593 4.354 -5.604 1.00 0.00 O ATOM 605 CB THR A 41 -12.858 4.207 -4.744 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.208 4.128 -3.483 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.255 2.810 -5.166 1.00 0.00 C ATOM 0 H THR A 41 -13.637 4.927 -7.011 1.00 0.00 H new ATOM 0 HA THR A 41 -11.584 5.833 -5.384 1.00 0.00 H new ATOM 0 HB THR A 41 -13.752 4.825 -4.663 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.804 3.699 -2.834 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.896 2.368 -4.403 1.00 0.00 H new ATOM 0 HG22 THR A 41 -13.795 2.855 -6.112 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.361 2.199 -5.288 1.00 0.00 H new ATOM 615 N LEU A 42 -10.775 3.053 -6.963 1.00 0.00 N ATOM 616 CA LEU A 42 -9.640 2.225 -7.180 1.00 0.00 C ATOM 617 C LEU A 42 -8.588 2.864 -8.015 1.00 0.00 C ATOM 618 O LEU A 42 -7.432 2.502 -7.915 1.00 0.00 O ATOM 619 CB LEU A 42 -9.879 0.716 -7.448 1.00 0.00 C ATOM 620 CG LEU A 42 -10.966 0.261 -8.441 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.355 0.427 -7.847 1.00 0.00 C ATOM 622 CD2 LEU A 42 -10.834 0.943 -9.804 1.00 0.00 C ATOM 0 H LEU A 42 -11.608 2.818 -7.503 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.217 2.157 -6.178 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.933 0.296 -7.791 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.104 0.251 -6.489 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.813 -0.803 -8.622 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.102 0.098 -8.570 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.438 -0.174 -6.941 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.523 1.476 -7.603 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.623 0.588 -10.467 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.922 2.022 -9.681 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -9.862 0.705 -10.237 1.00 0.00 H new ATOM 634 N ALA A 43 -8.977 3.864 -8.804 1.00 0.00 N ATOM 635 CA ALA A 43 -8.011 4.654 -9.549 1.00 0.00 C ATOM 636 C ALA A 43 -7.132 5.431 -8.562 1.00 0.00 C ATOM 637 O ALA A 43 -5.916 5.632 -8.765 1.00 0.00 O ATOM 638 CB ALA A 43 -8.715 5.594 -10.507 1.00 0.00 C ATOM 0 H ALA A 43 -9.949 4.142 -8.940 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.381 3.992 -10.143 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.975 6.176 -11.055 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.314 5.015 -11.210 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.363 6.267 -9.946 1.00 0.00 H new ATOM 644 N ILE A 44 -7.741 5.808 -7.479 1.00 0.00 N ATOM 645 CA ILE A 44 -7.057 6.484 -6.412 1.00 0.00 C ATOM 646 C ILE A 44 -6.149 5.481 -5.657 1.00 0.00 C ATOM 647 O ILE A 44 -5.011 5.802 -5.324 1.00 0.00 O ATOM 648 CB ILE A 44 -8.075 7.122 -5.464 1.00 0.00 C ATOM 649 CG1 ILE A 44 -8.988 8.038 -6.264 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.367 7.904 -4.349 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.186 8.538 -5.506 1.00 0.00 C ATOM 0 H ILE A 44 -8.735 5.655 -7.307 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.430 7.275 -6.823 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.668 6.339 -4.992 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.410 8.894 -6.611 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.331 7.505 -7.151 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.111 8.349 -3.688 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.731 7.228 -3.778 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.756 8.692 -4.789 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.782 9.184 -6.152 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.791 7.691 -5.182 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -9.855 9.102 -4.634 1.00 0.00 H new ATOM 663 N VAL A 45 -6.655 4.240 -5.451 1.00 0.00 N ATOM 664 CA VAL A 45 -5.882 3.141 -4.785 1.00 0.00 C ATOM 665 C VAL A 45 -4.560 2.854 -5.582 1.00 0.00 C ATOM 666 O VAL A 45 -3.464 2.670 -5.007 1.00 0.00 O ATOM 667 CB VAL A 45 -6.753 1.802 -4.642 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.010 0.705 -3.883 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.075 2.071 -3.944 1.00 0.00 C ATOM 0 H VAL A 45 -7.596 3.966 -5.734 1.00 0.00 H new ATOM 0 HA VAL A 45 -5.629 3.473 -3.778 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.940 1.458 -5.659 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.642 -0.181 -3.813 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.091 0.454 -4.413 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.766 1.057 -2.881 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.640 1.142 -3.864 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.886 2.468 -2.947 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.650 2.796 -4.520 1.00 0.00 H new ATOM 679 N GLU A 46 -4.686 2.880 -6.898 1.00 0.00 N ATOM 680 CA GLU A 46 -3.565 2.716 -7.834 1.00 0.00 C ATOM 681 C GLU A 46 -2.548 3.839 -7.643 1.00 0.00 C ATOM 682 O GLU A 46 -1.343 3.603 -7.554 1.00 0.00 O ATOM 683 CB GLU A 46 -4.113 2.787 -9.259 1.00 0.00 C ATOM 684 CG GLU A 46 -5.080 1.674 -9.594 1.00 0.00 C ATOM 685 CD GLU A 46 -4.403 0.380 -9.861 1.00 0.00 C ATOM 686 OE1 GLU A 46 -3.755 0.270 -10.912 1.00 0.00 O ATOM 687 OE2 GLU A 46 -4.508 -0.562 -9.047 1.00 0.00 O ATOM 0 H GLU A 46 -5.583 3.018 -7.363 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.077 1.759 -7.651 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -4.613 3.745 -9.399 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.280 2.756 -9.961 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.781 1.548 -8.769 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.665 1.959 -10.468 1.00 0.00 H new ATOM 694 N SER A 47 -3.062 5.042 -7.531 1.00 0.00 N ATOM 695 CA SER A 47 -2.245 6.229 -7.434 1.00 0.00 C ATOM 696 C SER A 47 -1.507 6.340 -6.081 1.00 0.00 C ATOM 697 O SER A 47 -0.361 6.784 -6.027 1.00 0.00 O ATOM 698 CB SER A 47 -3.100 7.455 -7.731 1.00 0.00 C ATOM 699 OG SER A 47 -3.746 7.300 -9.005 1.00 0.00 O ATOM 0 H SER A 47 -4.065 5.225 -7.504 1.00 0.00 H new ATOM 0 HA SER A 47 -1.454 6.163 -8.181 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.847 7.588 -6.948 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.479 8.351 -7.734 1.00 0.00 H new ATOM 0 HG SER A 47 -4.436 6.607 -8.940 1.00 0.00 H new ATOM 705 N VAL A 48 -2.145 5.917 -5.003 1.00 0.00 N ATOM 706 CA VAL A 48 -1.502 5.962 -3.685 1.00 0.00 C ATOM 707 C VAL A 48 -0.347 4.954 -3.595 1.00 0.00 C ATOM 708 O VAL A 48 0.719 5.263 -3.048 1.00 0.00 O ATOM 709 CB VAL A 48 -2.503 5.780 -2.479 1.00 0.00 C ATOM 710 CG1 VAL A 48 -3.519 6.902 -2.442 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.225 4.440 -2.519 1.00 0.00 C ATOM 0 H VAL A 48 -3.094 5.542 -5.004 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.099 6.970 -3.590 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.899 5.808 -1.572 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.196 6.752 -1.601 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.004 7.856 -2.327 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.089 6.907 -3.371 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.901 4.366 -1.667 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.796 4.362 -3.444 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.495 3.632 -2.474 1.00 0.00 H new ATOM 721 N ALA A 49 -0.526 3.783 -4.215 1.00 0.00 N ATOM 722 CA ALA A 49 0.479 2.723 -4.181 1.00 0.00 C ATOM 723 C ALA A 49 1.615 2.967 -5.190 1.00 0.00 C ATOM 724 O ALA A 49 2.483 2.120 -5.359 1.00 0.00 O ATOM 725 CB ALA A 49 -0.177 1.374 -4.429 1.00 0.00 C ATOM 0 H ALA A 49 -1.363 3.548 -4.748 1.00 0.00 H new ATOM 0 HA ALA A 49 0.928 2.727 -3.188 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.580 0.591 -4.402 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.923 1.185 -3.657 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.659 1.378 -5.406 1.00 0.00 H new ATOM 731 N ASP A 50 1.609 4.131 -5.843 1.00 0.00 N ATOM 732 CA ASP A 50 2.685 4.518 -6.798 1.00 0.00 C ATOM 733 C ASP A 50 3.835 5.166 -6.027 1.00 0.00 C ATOM 734 O ASP A 50 4.903 5.499 -6.563 1.00 0.00 O ATOM 735 CB ASP A 50 2.152 5.468 -7.899 1.00 0.00 C ATOM 736 CG ASP A 50 3.224 5.867 -8.913 1.00 0.00 C ATOM 737 OD1 ASP A 50 3.709 4.989 -9.671 1.00 0.00 O ATOM 738 OD2 ASP A 50 3.612 7.060 -8.961 1.00 0.00 O ATOM 0 H ASP A 50 0.876 4.832 -5.737 1.00 0.00 H new ATOM 0 HA ASP A 50 3.047 3.621 -7.299 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.328 4.983 -8.422 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.749 6.367 -7.432 1.00 0.00 H new ATOM 743 N ASN A 51 3.627 5.295 -4.747 1.00 0.00 N ATOM 744 CA ASN A 51 4.617 5.848 -3.844 1.00 0.00 C ATOM 745 C ASN A 51 5.282 4.681 -3.129 1.00 0.00 C ATOM 746 O ASN A 51 4.860 3.551 -3.294 1.00 0.00 O ATOM 747 CB ASN A 51 3.931 6.745 -2.780 1.00 0.00 C ATOM 748 CG ASN A 51 3.242 7.965 -3.327 1.00 0.00 C ATOM 749 OD1 ASN A 51 3.836 9.033 -3.446 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.975 7.833 -3.610 1.00 0.00 N ATOM 0 H ASN A 51 2.759 5.019 -4.289 1.00 0.00 H new ATOM 0 HA ASN A 51 5.338 6.445 -4.402 1.00 0.00 H new ATOM 0 HB2 ASN A 51 3.200 6.145 -2.238 1.00 0.00 H new ATOM 0 HB3 ASN A 51 4.681 7.064 -2.056 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.441 8.635 -3.944 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.519 6.928 -3.497 1.00 0.00 H new ATOM 757 N TRP A 52 6.259 4.971 -2.279 1.00 0.00 N ATOM 758 CA TRP A 52 6.955 3.957 -1.435 1.00 0.00 C ATOM 759 C TRP A 52 6.161 3.784 -0.132 1.00 0.00 C ATOM 760 O TRP A 52 6.716 3.630 0.956 1.00 0.00 O ATOM 761 CB TRP A 52 8.405 4.404 -1.129 1.00 0.00 C ATOM 762 CG TRP A 52 9.247 4.653 -2.358 1.00 0.00 C ATOM 763 CD1 TRP A 52 9.069 4.119 -3.609 1.00 0.00 C ATOM 764 CD2 TRP A 52 10.421 5.483 -2.442 1.00 0.00 C ATOM 765 NE1 TRP A 52 10.030 4.597 -4.468 1.00 0.00 N ATOM 766 CE2 TRP A 52 10.877 5.425 -3.771 1.00 0.00 C ATOM 767 CE3 TRP A 52 11.127 6.279 -1.520 1.00 0.00 C ATOM 768 CZ2 TRP A 52 11.995 6.125 -4.204 1.00 0.00 C ATOM 769 CZ3 TRP A 52 12.245 6.971 -1.958 1.00 0.00 C ATOM 770 CH2 TRP A 52 12.665 6.891 -3.285 1.00 0.00 C ATOM 0 H TRP A 52 6.608 5.920 -2.141 1.00 0.00 H new ATOM 0 HA TRP A 52 7.007 3.008 -1.968 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.374 5.316 -0.532 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.888 3.640 -0.520 1.00 0.00 H new ATOM 0 HD1 TRP A 52 8.288 3.424 -3.880 1.00 0.00 H new ATOM 0 HE1 TRP A 52 10.103 4.374 -5.461 1.00 0.00 H new ATOM 0 HE3 TRP A 52 10.804 6.349 -0.492 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 12.326 6.068 -5.230 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 12.799 7.582 -1.261 1.00 0.00 H new ATOM 0 HH2 TRP A 52 13.538 7.445 -3.596 1.00 0.00 H new ATOM 781 N LEU A 53 4.876 4.025 -0.312 1.00 0.00 N ATOM 782 CA LEU A 53 3.847 3.813 0.681 1.00 0.00 C ATOM 783 C LEU A 53 4.158 2.534 1.498 1.00 0.00 C ATOM 784 O LEU A 53 4.001 1.418 1.013 1.00 0.00 O ATOM 785 CB LEU A 53 2.542 3.648 -0.082 1.00 0.00 C ATOM 786 CG LEU A 53 1.262 3.934 0.664 1.00 0.00 C ATOM 787 CD1 LEU A 53 1.174 5.422 0.998 1.00 0.00 C ATOM 788 CD2 LEU A 53 0.074 3.518 -0.162 1.00 0.00 C ATOM 0 H LEU A 53 4.509 4.389 -1.191 1.00 0.00 H new ATOM 0 HA LEU A 53 3.789 4.647 1.381 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.577 4.301 -0.954 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.495 2.624 -0.452 1.00 0.00 H new ATOM 0 HG LEU A 53 1.260 3.362 1.592 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.247 5.620 1.536 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.023 5.706 1.620 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.189 6.003 0.076 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.843 3.730 0.388 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.071 4.073 -1.100 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.133 2.450 -0.372 1.00 0.00 H new ATOM 800 N THR A 54 4.655 2.738 2.692 1.00 0.00 N ATOM 801 CA THR A 54 5.136 1.662 3.551 1.00 0.00 C ATOM 802 C THR A 54 3.993 0.800 4.065 1.00 0.00 C ATOM 803 O THR A 54 2.846 1.200 3.977 1.00 0.00 O ATOM 804 CB THR A 54 5.893 2.246 4.782 1.00 0.00 C ATOM 805 OG1 THR A 54 5.037 3.142 5.508 1.00 0.00 O ATOM 806 CG2 THR A 54 7.136 2.990 4.371 1.00 0.00 C ATOM 0 H THR A 54 4.742 3.665 3.109 1.00 0.00 H new ATOM 0 HA THR A 54 5.805 1.049 2.946 1.00 0.00 H new ATOM 0 HB THR A 54 6.183 1.405 5.412 1.00 0.00 H new ATOM 0 HG1 THR A 54 5.065 4.029 5.093 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.635 3.382 5.257 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.809 2.312 3.845 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.865 3.815 3.713 1.00 0.00 H new ATOM 814 N PRO A 55 4.286 -0.405 4.634 1.00 0.00 N ATOM 815 CA PRO A 55 3.263 -1.223 5.303 1.00 0.00 C ATOM 816 C PRO A 55 2.551 -0.421 6.402 1.00 0.00 C ATOM 817 O PRO A 55 1.347 -0.605 6.654 1.00 0.00 O ATOM 818 CB PRO A 55 4.060 -2.380 5.916 1.00 0.00 C ATOM 819 CG PRO A 55 5.289 -2.484 5.080 1.00 0.00 C ATOM 820 CD PRO A 55 5.602 -1.092 4.593 1.00 0.00 C ATOM 0 HA PRO A 55 2.484 -1.558 4.618 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.307 -2.181 6.959 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.489 -3.308 5.896 1.00 0.00 H new ATOM 0 HG2 PRO A 55 6.119 -2.886 5.661 1.00 0.00 H new ATOM 0 HG3 PRO A 55 5.130 -3.161 4.241 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.333 -0.598 5.233 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.017 -1.103 3.585 1.00 0.00 H new ATOM 828 N THR A 56 3.299 0.487 7.022 1.00 0.00 N ATOM 829 CA THR A 56 2.796 1.344 8.062 1.00 0.00 C ATOM 830 C THR A 56 1.804 2.349 7.456 1.00 0.00 C ATOM 831 O THR A 56 0.682 2.526 7.980 1.00 0.00 O ATOM 832 CB THR A 56 3.965 2.090 8.691 1.00 0.00 C ATOM 833 OG1 THR A 56 5.070 1.164 8.838 1.00 0.00 O ATOM 834 CG2 THR A 56 3.585 2.647 10.056 1.00 0.00 C ATOM 0 H THR A 56 4.284 0.641 6.805 1.00 0.00 H new ATOM 0 HA THR A 56 2.287 0.752 8.822 1.00 0.00 H new ATOM 0 HB THR A 56 4.244 2.926 8.050 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.834 1.628 9.241 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.437 3.175 10.484 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.748 3.337 9.947 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.297 1.828 10.716 1.00 0.00 H new ATOM 842 N ASP A 57 2.212 2.982 6.330 1.00 0.00 N ATOM 843 CA ASP A 57 1.334 3.905 5.591 1.00 0.00 C ATOM 844 C ASP A 57 0.077 3.169 5.194 1.00 0.00 C ATOM 845 O ASP A 57 -1.023 3.631 5.449 1.00 0.00 O ATOM 846 CB ASP A 57 1.985 4.469 4.299 1.00 0.00 C ATOM 847 CG ASP A 57 3.157 5.416 4.488 1.00 0.00 C ATOM 848 OD1 ASP A 57 2.996 6.521 5.050 1.00 0.00 O ATOM 849 OD2 ASP A 57 4.259 5.097 4.032 1.00 0.00 O ATOM 0 H ASP A 57 3.139 2.868 5.920 1.00 0.00 H new ATOM 0 HA ASP A 57 1.129 4.745 6.255 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.320 3.629 3.691 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.215 4.988 3.728 1.00 0.00 H new ATOM 854 N TRP A 58 0.285 2.004 4.589 1.00 0.00 N ATOM 855 CA TRP A 58 -0.764 1.088 4.180 1.00 0.00 C ATOM 856 C TRP A 58 -1.808 0.894 5.268 1.00 0.00 C ATOM 857 O TRP A 58 -2.977 1.228 5.068 1.00 0.00 O ATOM 858 CB TRP A 58 -0.178 -0.291 3.784 1.00 0.00 C ATOM 859 CG TRP A 58 0.385 -0.386 2.392 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.205 0.488 1.366 1.00 0.00 C ATOM 861 CD2 TRP A 58 1.155 -1.465 1.862 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.832 0.024 0.231 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.426 -1.165 0.514 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.654 -2.649 2.398 1.00 0.00 C ATOM 865 CZ2 TRP A 58 2.158 -2.000 -0.307 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.377 -3.492 1.576 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.626 -3.161 0.238 1.00 0.00 C ATOM 0 H TRP A 58 1.220 1.664 4.364 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.248 1.539 3.314 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.609 -0.547 4.493 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -0.961 -1.042 3.891 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.350 1.412 1.432 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.848 0.495 -0.673 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.480 -2.903 3.433 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.352 -1.745 -1.338 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.757 -4.422 1.972 1.00 0.00 H new ATOM 0 HH2 TRP A 58 3.201 -3.839 -0.376 1.00 0.00 H new ATOM 878 N ASN A 59 -1.382 0.397 6.412 1.00 0.00 N ATOM 879 CA ASN A 59 -2.285 0.099 7.536 1.00 0.00 C ATOM 880 C ASN A 59 -3.132 1.310 7.885 1.00 0.00 C ATOM 881 O ASN A 59 -4.366 1.246 7.868 1.00 0.00 O ATOM 882 CB ASN A 59 -1.477 -0.372 8.764 1.00 0.00 C ATOM 883 CG ASN A 59 -2.341 -0.764 9.948 1.00 0.00 C ATOM 884 OD1 ASN A 59 -3.478 -1.211 9.797 1.00 0.00 O ATOM 885 ND2 ASN A 59 -1.790 -0.644 11.130 1.00 0.00 N ATOM 0 H ASN A 59 -0.403 0.184 6.601 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.955 -0.705 7.233 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.861 -1.224 8.477 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.798 0.425 9.069 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.306 -0.925 11.964 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.845 -0.269 11.217 1.00 0.00 H new ATOM 892 N THR A 60 -2.468 2.416 8.065 1.00 0.00 N ATOM 893 CA THR A 60 -3.100 3.663 8.443 1.00 0.00 C ATOM 894 C THR A 60 -4.075 4.161 7.341 1.00 0.00 C ATOM 895 O THR A 60 -5.121 4.736 7.645 1.00 0.00 O ATOM 896 CB THR A 60 -2.010 4.714 8.676 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.007 4.157 9.547 1.00 0.00 O ATOM 898 CG2 THR A 60 -2.584 5.976 9.306 1.00 0.00 C ATOM 0 H THR A 60 -1.457 2.485 7.953 1.00 0.00 H new ATOM 0 HA THR A 60 -3.678 3.501 9.353 1.00 0.00 H new ATOM 0 HB THR A 60 -1.575 4.985 7.714 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.342 3.675 9.013 1.00 0.00 H new ATOM 0 HG21 THR A 60 -1.785 6.702 9.459 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.340 6.401 8.645 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.038 5.729 10.266 1.00 0.00 H new ATOM 906 N LEU A 61 -3.739 3.883 6.092 1.00 0.00 N ATOM 907 CA LEU A 61 -4.492 4.357 4.950 1.00 0.00 C ATOM 908 C LEU A 61 -5.851 3.677 4.896 1.00 0.00 C ATOM 909 O LEU A 61 -6.855 4.340 5.130 1.00 0.00 O ATOM 910 CB LEU A 61 -3.650 4.163 3.653 1.00 0.00 C ATOM 911 CG LEU A 61 -4.109 4.861 2.357 1.00 0.00 C ATOM 912 CD1 LEU A 61 -2.990 4.832 1.336 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.338 4.218 1.761 1.00 0.00 C ATOM 0 H LEU A 61 -2.928 3.317 5.844 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.690 5.425 5.044 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.635 4.497 3.866 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.598 3.093 3.451 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.363 5.888 2.618 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.319 5.326 0.422 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.119 5.351 1.736 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.726 3.798 1.115 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.620 4.747 0.850 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.125 3.176 1.524 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.158 4.267 2.478 1.00 0.00 H new ATOM 925 N VAL A 62 -5.870 2.330 4.694 1.00 0.00 N ATOM 926 CA VAL A 62 -7.141 1.571 4.582 1.00 0.00 C ATOM 927 C VAL A 62 -8.019 1.866 5.779 1.00 0.00 C ATOM 928 O VAL A 62 -9.208 2.156 5.658 1.00 0.00 O ATOM 929 CB VAL A 62 -6.909 0.015 4.430 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.012 -0.559 5.528 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.232 -0.725 4.416 1.00 0.00 C ATOM 0 H VAL A 62 -5.030 1.757 4.607 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.641 1.900 3.671 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.397 -0.128 3.478 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.888 -1.631 5.373 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.038 -0.072 5.493 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.471 -0.384 6.501 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.050 -1.794 4.311 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.764 -0.538 5.349 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.835 -0.376 3.578 1.00 0.00 H new ATOM 941 N ARG A 63 -7.362 1.922 6.893 1.00 0.00 N ATOM 942 CA ARG A 63 -7.976 2.189 8.191 1.00 0.00 C ATOM 943 C ARG A 63 -8.692 3.575 8.284 1.00 0.00 C ATOM 944 O ARG A 63 -9.750 3.706 8.918 1.00 0.00 O ATOM 945 CB ARG A 63 -6.911 1.947 9.298 1.00 0.00 C ATOM 946 CG ARG A 63 -7.151 2.554 10.662 1.00 0.00 C ATOM 947 CD ARG A 63 -6.637 3.981 10.724 1.00 0.00 C ATOM 948 NE ARG A 63 -6.929 4.622 11.994 1.00 0.00 N ATOM 949 CZ ARG A 63 -6.542 5.856 12.325 1.00 0.00 C ATOM 950 NH1 ARG A 63 -5.828 6.586 11.452 1.00 0.00 N ATOM 951 NH2 ARG A 63 -6.876 6.367 13.515 1.00 0.00 N ATOM 0 H ARG A 63 -6.353 1.782 6.946 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.800 1.491 8.340 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.803 0.870 9.427 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.956 2.322 8.930 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.217 2.538 10.888 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.655 1.952 11.424 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.560 3.983 10.559 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.085 4.561 9.917 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.467 4.093 12.680 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.584 6.197 10.541 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.530 7.529 11.700 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.427 5.814 14.171 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.580 7.310 13.766 1.00 0.00 H new ATOM 965 N ALA A 64 -8.131 4.571 7.638 1.00 0.00 N ATOM 966 CA ALA A 64 -8.626 5.954 7.697 1.00 0.00 C ATOM 967 C ALA A 64 -9.386 6.287 6.448 1.00 0.00 C ATOM 968 O ALA A 64 -9.828 7.423 6.249 1.00 0.00 O ATOM 969 CB ALA A 64 -7.457 6.922 7.895 1.00 0.00 C ATOM 0 H ALA A 64 -7.308 4.457 7.046 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.303 6.052 8.545 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.834 7.944 7.937 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -6.943 6.686 8.827 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -6.760 6.827 7.062 1.00 0.00 H new ATOM 975 N VAL A 65 -9.497 5.312 5.632 1.00 0.00 N ATOM 976 CA VAL A 65 -10.127 5.465 4.362 1.00 0.00 C ATOM 977 C VAL A 65 -11.497 4.779 4.247 1.00 0.00 C ATOM 978 O VAL A 65 -12.503 5.457 4.057 1.00 0.00 O ATOM 979 CB VAL A 65 -9.171 5.061 3.222 1.00 0.00 C ATOM 980 CG1 VAL A 65 -9.905 4.810 1.953 1.00 0.00 C ATOM 981 CG2 VAL A 65 -8.144 6.162 2.987 1.00 0.00 C ATOM 0 H VAL A 65 -9.152 4.371 5.820 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.349 6.528 4.263 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.674 4.139 3.525 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -9.198 4.528 1.173 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -10.623 4.003 2.101 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -10.433 5.715 1.653 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.473 5.868 2.180 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.656 7.085 2.715 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.567 6.322 3.898 1.00 0.00 H new ATOM 991 N LEU A 66 -11.552 3.485 4.392 1.00 0.00 N ATOM 992 CA LEU A 66 -12.796 2.776 4.148 1.00 0.00 C ATOM 993 C LEU A 66 -13.123 2.001 5.426 1.00 0.00 C ATOM 994 O LEU A 66 -12.264 1.894 6.323 1.00 0.00 O ATOM 995 CB LEU A 66 -12.618 1.893 2.850 1.00 0.00 C ATOM 996 CG LEU A 66 -13.874 1.523 1.964 1.00 0.00 C ATOM 997 CD1 LEU A 66 -13.414 1.219 0.561 1.00 0.00 C ATOM 998 CD2 LEU A 66 -14.652 0.329 2.515 1.00 0.00 C ATOM 0 H LEU A 66 -10.767 2.898 4.674 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.647 3.426 3.943 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.906 2.407 2.204 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -12.151 0.957 3.157 1.00 0.00 H new ATOM 0 HG LEU A 66 -14.549 2.379 1.975 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.275 0.963 -0.057 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.916 2.094 0.144 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.718 0.380 0.580 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.503 0.119 1.868 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -14.001 -0.544 2.552 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.008 0.559 3.519 1.00 0.00 H new ATOM 1010 N SER A 67 -14.329 1.554 5.572 1.00 0.00 N ATOM 1011 CA SER A 67 -14.730 0.888 6.794 1.00 0.00 C ATOM 1012 C SER A 67 -15.703 -0.251 6.551 1.00 0.00 C ATOM 1013 O SER A 67 -16.520 -0.204 5.621 1.00 0.00 O ATOM 1014 CB SER A 67 -15.325 1.909 7.771 1.00 0.00 C ATOM 1015 OG SER A 67 -14.356 2.916 8.051 1.00 0.00 O ATOM 0 H SER A 67 -15.062 1.632 4.867 1.00 0.00 H new ATOM 0 HA SER A 67 -13.836 0.442 7.230 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.221 2.359 7.343 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.627 1.413 8.693 1.00 0.00 H new ATOM 0 HG SER A 67 -14.735 3.571 8.674 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.570 -1.285 7.364 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.473 -2.407 7.360 1.00 0.00 C ATOM 1023 C GLY A 68 -16.056 -3.458 6.377 1.00 0.00 C ATOM 1024 O GLY A 68 -15.352 -4.419 6.721 1.00 0.00 O ATOM 0 H GLY A 68 -14.820 -1.363 8.051 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -16.516 -2.841 8.359 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.478 -2.063 7.118 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.457 -3.261 5.152 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.139 -4.190 4.104 1.00 0.00 C ATOM 1030 C GLY A 69 -14.673 -4.169 3.744 1.00 0.00 C ATOM 1031 O GLY A 69 -14.130 -5.178 3.287 1.00 0.00 O ATOM 0 H GLY A 69 -17.010 -2.458 4.853 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.420 -5.196 4.416 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.731 -3.954 3.220 1.00 0.00 H new ATOM 1035 N ASP A 70 -14.029 -3.020 3.992 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.620 -2.769 3.640 1.00 0.00 C ATOM 1037 C ASP A 70 -11.727 -3.926 4.016 1.00 0.00 C ATOM 1038 O ASP A 70 -11.006 -4.483 3.161 1.00 0.00 O ATOM 1039 CB ASP A 70 -12.098 -1.458 4.285 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.939 -1.523 5.801 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.932 -1.722 6.495 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.811 -1.441 6.311 1.00 0.00 O ATOM 0 H ASP A 70 -14.477 -2.226 4.449 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.587 -2.659 2.556 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -11.135 -1.207 3.841 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.784 -0.647 4.038 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.859 -4.351 5.253 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.041 -5.378 5.787 1.00 0.00 C ATOM 1049 C HIS A 71 -11.249 -6.682 5.046 1.00 0.00 C ATOM 1050 O HIS A 71 -10.279 -7.308 4.624 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.297 -5.564 7.278 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.360 -6.550 7.924 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -10.727 -7.812 8.325 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.053 -6.435 8.239 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -9.692 -8.421 8.858 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -8.670 -7.611 8.818 1.00 0.00 N ATOM 0 H HIS A 71 -12.547 -3.981 5.909 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.003 -5.074 5.655 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.202 -4.601 7.779 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.324 -5.899 7.424 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.426 -5.573 8.065 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.688 -9.423 9.261 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -7.734 -7.822 9.164 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.498 -7.045 4.835 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.799 -8.317 4.248 1.00 0.00 C ATOM 1067 C LEU A 72 -12.207 -8.509 2.852 1.00 0.00 C ATOM 1068 O LEU A 72 -11.386 -9.398 2.670 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.276 -8.778 4.468 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.436 -7.791 4.188 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.752 -7.631 2.714 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.680 -8.188 4.946 1.00 0.00 C ATOM 0 H LEU A 72 -13.312 -6.474 5.063 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.247 -9.059 4.825 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.439 -9.658 3.845 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.366 -9.101 5.505 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.090 -6.820 4.542 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.574 -6.926 2.593 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.872 -7.256 2.192 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.038 -8.596 2.296 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.479 -7.478 4.731 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.990 -9.187 4.639 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.471 -8.186 6.016 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.497 -7.645 1.906 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.860 -7.857 0.604 1.00 0.00 C ATOM 1086 C LEU A 73 -10.484 -7.246 0.436 1.00 0.00 C ATOM 1087 O LEU A 73 -9.552 -7.991 0.167 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.746 -7.688 -0.621 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.532 -8.933 -1.088 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -12.588 -10.071 -1.444 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.567 -9.388 -0.063 1.00 0.00 C ATOM 0 H LEU A 73 -13.121 -6.842 1.987 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.682 -8.932 0.649 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.461 -6.892 -0.416 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.122 -7.350 -1.448 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.079 -8.642 -1.985 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.167 -10.935 -1.770 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.924 -9.755 -2.249 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.996 -10.340 -0.569 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.091 -10.266 -0.440 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.067 -9.638 0.873 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.283 -8.585 0.112 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.331 -5.903 0.620 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.029 -5.256 0.498 1.00 0.00 C ATOM 1105 C TRP A 74 -8.004 -5.967 1.395 1.00 0.00 C ATOM 1106 O TRP A 74 -6.906 -6.279 1.015 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.077 -3.773 0.970 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.669 -2.633 0.084 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.606 -2.644 -0.944 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.268 -1.270 0.211 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -10.833 -1.326 -1.390 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.025 -0.478 -0.670 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.345 -0.674 1.017 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -9.876 0.919 -0.740 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.167 0.726 0.963 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -8.949 1.508 0.095 1.00 0.00 C ATOM 0 H TRP A 74 -11.096 -5.269 0.850 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.751 -5.306 -0.555 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.633 -3.761 1.907 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.052 -3.486 1.204 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.086 -3.527 -1.340 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.486 -1.049 -2.123 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.752 -1.270 1.695 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.467 1.510 -1.424 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.427 1.198 1.592 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -8.823 2.581 0.082 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.389 -6.197 2.580 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.471 -6.681 3.565 1.00 0.00 C ATOM 1129 C LYS A 75 -7.269 -8.168 3.676 1.00 0.00 C ATOM 1130 O LYS A 75 -6.132 -8.584 3.861 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.591 -5.950 4.854 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.468 -4.457 4.615 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.061 -4.049 4.194 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.154 -4.058 5.424 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.790 -3.565 5.175 1.00 0.00 N ATOM 0 H LYS A 75 -9.344 -6.061 2.913 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.499 -6.419 3.148 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.550 -6.174 5.321 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.815 -6.282 5.544 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.177 -4.156 3.843 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.741 -3.923 5.525 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.679 -4.736 3.439 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.075 -3.057 3.743 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.612 -3.448 6.203 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.095 -5.076 5.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.359 -3.267 6.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.218 -4.324 4.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.827 -2.755 4.523 1.00 0.00 H new ATOM 1149 N SER A 76 -8.319 -8.993 3.575 1.00 0.00 N ATOM 1150 CA SER A 76 -8.076 -10.428 3.656 1.00 0.00 C ATOM 1151 C SER A 76 -7.253 -10.822 2.465 1.00 0.00 C ATOM 1152 O SER A 76 -6.294 -11.595 2.576 1.00 0.00 O ATOM 1153 CB SER A 76 -9.361 -11.252 3.741 1.00 0.00 C ATOM 1154 OG SER A 76 -9.089 -12.649 3.881 1.00 0.00 O ATOM 0 H SER A 76 -9.290 -8.709 3.445 1.00 0.00 H new ATOM 0 HA SER A 76 -7.541 -10.641 4.582 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.956 -10.911 4.588 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.959 -11.086 2.845 1.00 0.00 H new ATOM 0 HG SER A 76 -9.934 -13.143 3.934 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.556 -10.204 1.343 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.796 -10.424 0.157 1.00 0.00 C ATOM 1162 C GLU A 77 -5.430 -9.754 0.233 1.00 0.00 C ATOM 1163 O GLU A 77 -4.541 -10.120 -0.503 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.543 -9.976 -1.065 1.00 0.00 C ATOM 1165 CG GLU A 77 -7.985 -11.101 -1.966 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.778 -12.157 -1.258 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -9.926 -11.904 -0.893 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.258 -13.286 -1.072 1.00 0.00 O ATOM 0 H GLU A 77 -8.328 -9.545 1.240 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.634 -11.499 0.076 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.420 -9.409 -0.753 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.910 -9.296 -1.635 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.585 -10.691 -2.779 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -7.106 -11.560 -2.419 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.251 -8.749 1.097 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.944 -8.160 1.284 1.00 0.00 C ATOM 1177 C PHE A 78 -2.985 -9.210 1.783 1.00 0.00 C ATOM 1178 O PHE A 78 -1.890 -9.384 1.243 1.00 0.00 O ATOM 1179 CB PHE A 78 -4.017 -6.981 2.253 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.692 -6.412 2.642 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.923 -5.736 1.720 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.229 -6.546 3.943 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.712 -5.200 2.081 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.015 -6.014 4.316 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.255 -5.338 3.386 1.00 0.00 C ATOM 0 H PHE A 78 -5.992 -8.339 1.666 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.583 -7.780 0.328 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.617 -6.192 1.800 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.539 -7.301 3.155 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.276 -5.627 0.705 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.827 -7.073 4.671 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.115 -4.672 1.352 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.661 -6.126 5.330 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.697 -4.915 3.672 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.422 -9.937 2.768 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.632 -10.984 3.345 1.00 0.00 C ATOM 1197 C PHE A 79 -2.423 -12.117 2.355 1.00 0.00 C ATOM 1198 O PHE A 79 -1.312 -12.676 2.236 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.294 -11.465 4.620 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.251 -10.428 5.728 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.079 -10.185 6.424 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.369 -9.672 6.041 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.031 -9.218 7.415 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.324 -8.702 7.029 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.158 -8.474 7.714 1.00 0.00 C ATOM 0 H PHE A 79 -4.341 -9.820 3.196 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.643 -10.597 3.592 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.332 -11.724 4.410 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.800 -12.375 4.960 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.192 -10.756 6.192 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.291 -9.842 5.506 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.112 -9.045 7.955 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.207 -8.125 7.260 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.120 -7.717 8.483 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.466 -12.412 1.610 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.426 -13.464 0.632 1.00 0.00 C ATOM 1217 C GLU A 80 -2.502 -13.156 -0.508 1.00 0.00 C ATOM 1218 O GLU A 80 -1.512 -13.818 -0.642 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.820 -13.823 0.132 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.709 -14.347 1.228 1.00 0.00 C ATOM 1221 CD GLU A 80 -5.139 -15.556 1.903 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -5.301 -16.666 1.391 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -4.530 -15.408 2.984 1.00 0.00 O ATOM 0 H GLU A 80 -4.362 -11.927 1.669 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.019 -14.338 1.140 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.280 -12.942 -0.314 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.738 -14.573 -0.655 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.867 -13.563 1.968 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.686 -14.594 0.812 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.793 -12.097 -1.265 1.00 0.00 N ATOM 1231 CA ASN A 81 -2.016 -11.752 -2.479 1.00 0.00 C ATOM 1232 C ASN A 81 -0.560 -11.532 -2.199 1.00 0.00 C ATOM 1233 O ASN A 81 0.285 -11.948 -2.986 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.554 -10.531 -3.247 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.914 -10.739 -3.859 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -4.035 -11.320 -4.905 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.922 -10.204 -3.266 1.00 0.00 N ATOM 0 H ASN A 81 -3.561 -11.456 -1.067 1.00 0.00 H new ATOM 0 HA ASN A 81 -2.138 -12.632 -3.110 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.600 -9.680 -2.568 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.848 -10.272 -4.036 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.851 -10.267 -3.682 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.792 -9.717 -2.379 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.244 -10.882 -1.087 1.00 0.00 N ATOM 1245 CA CYS A 82 1.143 -10.638 -0.779 1.00 0.00 C ATOM 1246 C CYS A 82 1.884 -11.950 -0.525 1.00 0.00 C ATOM 1247 O CYS A 82 2.858 -12.261 -1.220 1.00 0.00 O ATOM 1248 CB CYS A 82 1.290 -9.697 0.400 1.00 0.00 C ATOM 1249 SG CYS A 82 0.469 -8.107 0.205 1.00 0.00 S ATOM 0 H CYS A 82 -0.914 -10.526 -0.405 1.00 0.00 H new ATOM 0 HA CYS A 82 1.594 -10.155 -1.646 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.895 -10.187 1.290 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.351 -9.523 0.577 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.789 -8.228 0.511 1.00 0.00 H new ATOM 1255 N ARG A 83 1.397 -12.749 0.420 1.00 0.00 N ATOM 1256 CA ARG A 83 2.060 -13.998 0.746 1.00 0.00 C ATOM 1257 C ARG A 83 1.954 -15.013 -0.396 1.00 0.00 C ATOM 1258 O ARG A 83 2.762 -15.922 -0.501 1.00 0.00 O ATOM 1259 CB ARG A 83 1.588 -14.558 2.088 1.00 0.00 C ATOM 1260 CG ARG A 83 2.013 -13.715 3.283 1.00 0.00 C ATOM 1261 CD ARG A 83 3.529 -13.686 3.426 1.00 0.00 C ATOM 1262 NE ARG A 83 4.000 -12.943 4.628 1.00 0.00 N ATOM 1263 CZ ARG A 83 4.522 -13.523 5.719 1.00 0.00 C ATOM 1264 NH1 ARG A 83 4.332 -14.816 5.964 1.00 0.00 N ATOM 1265 NH2 ARG A 83 5.153 -12.798 6.602 1.00 0.00 N ATOM 0 H ARG A 83 0.557 -12.554 0.964 1.00 0.00 H new ATOM 0 HA ARG A 83 3.122 -13.784 0.864 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.501 -14.637 2.077 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.979 -15.568 2.209 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.637 -12.699 3.167 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.567 -14.118 4.192 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.901 -14.710 3.473 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.961 -13.230 2.535 1.00 0.00 H new ATOM 0 HE ARG A 83 3.920 -11.926 4.621 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.782 -15.382 5.318 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.736 -15.242 6.798 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.248 -11.792 6.462 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.551 -13.237 7.432 1.00 0.00 H new ATOM 1279 N ASP A 84 0.951 -14.838 -1.228 1.00 0.00 N ATOM 1280 CA ASP A 84 0.708 -15.660 -2.423 1.00 0.00 C ATOM 1281 C ASP A 84 1.887 -15.553 -3.385 1.00 0.00 C ATOM 1282 O ASP A 84 2.505 -16.568 -3.782 1.00 0.00 O ATOM 1283 CB ASP A 84 -0.547 -15.157 -3.153 1.00 0.00 C ATOM 1284 CG ASP A 84 -1.028 -16.074 -4.234 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -1.644 -17.125 -3.911 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.802 -15.782 -5.413 1.00 0.00 O ATOM 0 H ASP A 84 0.255 -14.103 -1.100 1.00 0.00 H new ATOM 0 HA ASP A 84 0.577 -16.695 -2.106 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -1.347 -15.017 -2.426 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -0.336 -14.179 -3.586 1.00 0.00 H new ATOM 1291 N THR A 85 2.232 -14.335 -3.741 1.00 0.00 N ATOM 1292 CA THR A 85 3.312 -14.152 -4.654 1.00 0.00 C ATOM 1293 C THR A 85 4.629 -14.435 -3.945 1.00 0.00 C ATOM 1294 O THR A 85 5.555 -14.956 -4.542 1.00 0.00 O ATOM 1295 CB THR A 85 3.302 -12.757 -5.356 1.00 0.00 C ATOM 1296 OG1 THR A 85 4.313 -12.733 -6.391 1.00 0.00 O ATOM 1297 CG2 THR A 85 3.579 -11.605 -4.385 1.00 0.00 C ATOM 0 H THR A 85 1.784 -13.479 -3.414 1.00 0.00 H new ATOM 0 HA THR A 85 3.187 -14.868 -5.466 1.00 0.00 H new ATOM 0 HB THR A 85 2.304 -12.617 -5.771 1.00 0.00 H new ATOM 0 HG1 THR A 85 3.889 -12.564 -7.258 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.560 -10.660 -4.927 1.00 0.00 H new ATOM 0 HG22 THR A 85 2.815 -11.593 -3.608 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.559 -11.742 -3.928 1.00 0.00 H new ATOM 1305 N ALA A 86 4.641 -14.170 -2.648 1.00 0.00 N ATOM 1306 CA ALA A 86 5.805 -14.409 -1.824 1.00 0.00 C ATOM 1307 C ALA A 86 6.177 -15.881 -1.808 1.00 0.00 C ATOM 1308 O ALA A 86 7.327 -16.226 -1.976 1.00 0.00 O ATOM 1309 CB ALA A 86 5.599 -13.885 -0.421 1.00 0.00 C ATOM 0 H ALA A 86 3.844 -13.784 -2.142 1.00 0.00 H new ATOM 0 HA ALA A 86 6.638 -13.862 -2.265 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.491 -14.079 0.175 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.414 -12.812 -0.457 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.744 -14.386 0.033 1.00 0.00 H new ATOM 1315 N LYS A 87 5.186 -16.755 -1.663 1.00 0.00 N ATOM 1316 CA LYS A 87 5.462 -18.183 -1.681 1.00 0.00 C ATOM 1317 C LYS A 87 5.953 -18.612 -3.064 1.00 0.00 C ATOM 1318 O LYS A 87 6.826 -19.457 -3.163 1.00 0.00 O ATOM 1319 CB LYS A 87 4.265 -19.044 -1.216 1.00 0.00 C ATOM 1320 CG LYS A 87 3.045 -18.976 -2.111 1.00 0.00 C ATOM 1321 CD LYS A 87 1.928 -19.899 -1.668 1.00 0.00 C ATOM 1322 CE LYS A 87 1.408 -19.525 -0.292 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.215 -20.314 0.068 1.00 0.00 N ATOM 0 H LYS A 87 4.205 -16.505 -1.534 1.00 0.00 H new ATOM 0 HA LYS A 87 6.253 -18.361 -0.953 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.589 -20.082 -1.146 1.00 0.00 H new ATOM 0 HB3 LYS A 87 3.979 -18.731 -0.212 1.00 0.00 H new ATOM 0 HG2 LYS A 87 2.674 -17.951 -2.132 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.335 -19.231 -3.130 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.112 -19.857 -2.390 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.289 -20.927 -1.654 1.00 0.00 H new ATOM 0 HE2 LYS A 87 2.190 -19.687 0.450 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.163 -18.463 -0.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -0.114 -20.033 1.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -0.539 -20.140 -0.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.456 -21.326 0.071 1.00 0.00 H new ATOM 1337 N ARG A 88 5.439 -17.976 -4.131 1.00 0.00 N ATOM 1338 CA ARG A 88 5.937 -18.292 -5.501 1.00 0.00 C ATOM 1339 C ARG A 88 7.372 -17.829 -5.695 1.00 0.00 C ATOM 1340 O ARG A 88 8.143 -18.436 -6.438 1.00 0.00 O ATOM 1341 CB ARG A 88 5.046 -17.754 -6.636 1.00 0.00 C ATOM 1342 CG ARG A 88 3.866 -18.661 -7.017 1.00 0.00 C ATOM 1343 CD ARG A 88 2.918 -18.858 -5.873 1.00 0.00 C ATOM 1344 NE ARG A 88 1.831 -19.774 -6.201 1.00 0.00 N ATOM 1345 CZ ARG A 88 0.613 -19.724 -5.674 1.00 0.00 C ATOM 1346 NH1 ARG A 88 0.298 -18.731 -4.871 1.00 0.00 N ATOM 1347 NH2 ARG A 88 -0.286 -20.648 -5.978 1.00 0.00 N ATOM 0 H ARG A 88 4.708 -17.266 -4.088 1.00 0.00 H new ATOM 0 HA ARG A 88 5.898 -19.379 -5.569 1.00 0.00 H new ATOM 0 HB2 ARG A 88 4.656 -16.780 -6.341 1.00 0.00 H new ATOM 0 HB3 ARG A 88 5.664 -17.596 -7.520 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.331 -18.225 -7.860 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.244 -19.629 -7.346 1.00 0.00 H new ATOM 0 HD2 ARG A 88 3.466 -19.243 -5.013 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.501 -17.894 -5.580 1.00 0.00 H new ATOM 0 HE ARG A 88 2.020 -20.506 -6.885 1.00 0.00 H new ATOM 0 HH11 ARG A 88 0.986 -18.009 -4.658 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.635 -18.683 -4.461 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.044 -21.403 -6.620 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -1.220 -20.605 -5.570 1.00 0.00 H new ATOM 1361 N ASN A 89 7.726 -16.783 -5.031 1.00 0.00 N ATOM 1362 CA ASN A 89 9.064 -16.245 -5.109 1.00 0.00 C ATOM 1363 C ASN A 89 9.999 -17.013 -4.213 1.00 0.00 C ATOM 1364 O ASN A 89 11.185 -17.170 -4.513 1.00 0.00 O ATOM 1365 CB ASN A 89 9.055 -14.776 -4.733 1.00 0.00 C ATOM 1366 CG ASN A 89 8.489 -13.860 -5.812 1.00 0.00 C ATOM 1367 OD1 ASN A 89 7.704 -14.289 -6.679 1.00 0.00 O ATOM 1368 ND2 ASN A 89 8.831 -12.601 -5.735 1.00 0.00 N ATOM 0 H ASN A 89 7.102 -16.266 -4.412 1.00 0.00 H new ATOM 0 HA ASN A 89 9.420 -16.343 -6.135 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.471 -14.649 -3.821 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.074 -14.464 -4.505 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.452 -11.928 -6.401 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.477 -12.292 -5.009 1.00 0.00 H new ATOM 1375 N GLN A 90 9.479 -17.549 -3.128 1.00 0.00 N ATOM 1376 CA GLN A 90 10.321 -18.287 -2.219 1.00 0.00 C ATOM 1377 C GLN A 90 10.520 -19.718 -2.706 1.00 0.00 C ATOM 1378 O GLN A 90 11.602 -20.277 -2.561 1.00 0.00 O ATOM 1379 CB GLN A 90 9.861 -18.231 -0.758 1.00 0.00 C ATOM 1380 CG GLN A 90 9.778 -16.822 -0.139 1.00 0.00 C ATOM 1381 CD GLN A 90 10.853 -15.849 -0.629 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.974 -15.797 -0.106 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.477 -15.000 -1.550 1.00 0.00 N ATOM 0 H GLN A 90 8.497 -17.488 -2.860 1.00 0.00 H new ATOM 0 HA GLN A 90 11.289 -17.786 -2.223 1.00 0.00 H new ATOM 0 HB2 GLN A 90 8.879 -18.698 -0.687 1.00 0.00 H new ATOM 0 HB3 GLN A 90 10.544 -18.832 -0.158 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.797 -16.400 -0.358 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.853 -16.910 0.945 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.546 -15.072 -1.960 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.115 -14.266 -1.858 1.00 0.00 H new ATOM 1392 N GLN A 91 9.503 -20.311 -3.334 1.00 0.00 N ATOM 1393 CA GLN A 91 9.674 -21.632 -3.961 1.00 0.00 C ATOM 1394 C GLN A 91 10.645 -21.534 -5.157 1.00 0.00 C ATOM 1395 O GLN A 91 11.236 -22.517 -5.585 1.00 0.00 O ATOM 1396 CB GLN A 91 8.315 -22.221 -4.394 1.00 0.00 C ATOM 1397 CG GLN A 91 7.610 -21.458 -5.507 1.00 0.00 C ATOM 1398 CD GLN A 91 6.129 -21.817 -5.655 1.00 0.00 C ATOM 1399 OE1 GLN A 91 5.575 -21.771 -6.755 1.00 0.00 O ATOM 1400 NE2 GLN A 91 5.465 -22.113 -4.551 1.00 0.00 N ATOM 0 H GLN A 91 8.569 -19.911 -3.424 1.00 0.00 H new ATOM 0 HA GLN A 91 10.105 -22.310 -3.224 1.00 0.00 H new ATOM 0 HB2 GLN A 91 8.469 -23.250 -4.720 1.00 0.00 H new ATOM 0 HB3 GLN A 91 7.658 -22.257 -3.525 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.698 -20.389 -5.315 1.00 0.00 H new ATOM 0 HG3 GLN A 91 8.119 -21.656 -6.450 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.952 -22.143 -3.655 1.00 0.00 H new ATOM 0 HE22 GLN A 91 4.465 -22.311 -4.595 1.00 0.00 H new ATOM 1409 N ALA A 92 10.800 -20.330 -5.681 1.00 0.00 N ATOM 1410 CA ALA A 92 11.749 -20.075 -6.746 1.00 0.00 C ATOM 1411 C ALA A 92 13.145 -19.860 -6.142 1.00 0.00 C ATOM 1412 O ALA A 92 14.159 -19.959 -6.836 1.00 0.00 O ATOM 1413 CB ALA A 92 11.308 -18.863 -7.581 1.00 0.00 C ATOM 0 H ALA A 92 10.275 -19.509 -5.381 1.00 0.00 H new ATOM 0 HA ALA A 92 11.787 -20.935 -7.414 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.032 -18.686 -8.376 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.329 -19.059 -8.019 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.249 -17.982 -6.941 1.00 0.00 H new ATOM 1419 N GLY A 93 13.172 -19.597 -4.838 1.00 0.00 N ATOM 1420 CA GLY A 93 14.400 -19.389 -4.112 1.00 0.00 C ATOM 1421 C GLY A 93 14.982 -18.030 -4.359 1.00 0.00 C ATOM 1422 O GLY A 93 16.165 -17.895 -4.672 1.00 0.00 O ATOM 0 H GLY A 93 12.333 -19.524 -4.262 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.215 -19.514 -3.045 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.124 -20.150 -4.401 1.00 0.00 H new ATOM 1426 N ASN A 94 14.157 -17.023 -4.242 1.00 0.00 N ATOM 1427 CA ASN A 94 14.596 -15.661 -4.467 1.00 0.00 C ATOM 1428 C ASN A 94 15.236 -15.073 -3.220 1.00 0.00 C ATOM 1429 O ASN A 94 16.190 -14.307 -3.339 1.00 0.00 O ATOM 1430 CB ASN A 94 13.445 -14.757 -4.977 1.00 0.00 C ATOM 1431 CG ASN A 94 12.972 -15.077 -6.393 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.067 -16.207 -6.867 1.00 0.00 O ATOM 1433 ND2 ASN A 94 12.441 -14.098 -7.074 1.00 0.00 N ATOM 0 H ASN A 94 13.173 -17.116 -3.991 1.00 0.00 H new ATOM 0 HA ASN A 94 15.353 -15.697 -5.251 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.599 -14.847 -4.295 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.773 -13.718 -4.943 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.095 -14.263 -8.019 1.00 0.00 H new ATOM 0 HD22 ASN A 94 12.372 -13.168 -6.661 1.00 0.00 H new ATOM 1440 N GLY A 95 14.738 -15.463 -2.015 1.00 0.00 N ATOM 1441 CA GLY A 95 15.255 -14.873 -0.766 1.00 0.00 C ATOM 1442 C GLY A 95 14.984 -13.390 -0.816 1.00 0.00 C ATOM 1443 O GLY A 95 15.896 -12.559 -0.770 1.00 0.00 O ATOM 0 H GLY A 95 14.004 -16.160 -1.890 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.768 -15.322 0.100 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.323 -15.064 -0.666 1.00 0.00 H new ATOM 1447 N TRP A 96 13.728 -13.080 -0.911 1.00 0.00 N ATOM 1448 CA TRP A 96 13.267 -11.786 -1.303 1.00 0.00 C ATOM 1449 C TRP A 96 11.857 -11.669 -0.829 1.00 0.00 C ATOM 1450 O TRP A 96 11.382 -12.598 -0.190 1.00 0.00 O ATOM 1451 CB TRP A 96 13.298 -11.771 -2.813 1.00 0.00 C ATOM 1452 CG TRP A 96 13.324 -10.458 -3.451 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.989 -9.351 -3.045 1.00 0.00 C ATOM 1454 CD2 TRP A 96 12.684 -10.137 -4.666 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.774 -8.343 -3.930 1.00 0.00 N ATOM 1456 CE2 TRP A 96 12.977 -8.815 -4.949 1.00 0.00 C ATOM 1457 CE3 TRP A 96 11.879 -10.859 -5.542 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 12.496 -8.192 -6.079 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 11.403 -10.235 -6.661 1.00 0.00 C ATOM 1460 CH2 TRP A 96 11.714 -8.919 -6.921 1.00 0.00 C ATOM 0 H TRP A 96 12.975 -13.739 -0.712 1.00 0.00 H new ATOM 0 HA TRP A 96 13.867 -10.971 -0.897 1.00 0.00 H new ATOM 0 HB2 TRP A 96 14.176 -12.327 -3.142 1.00 0.00 H new ATOM 0 HB3 TRP A 96 12.424 -12.310 -3.178 1.00 0.00 H new ATOM 0 HD1 TRP A 96 14.597 -9.280 -2.155 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.142 -7.395 -3.853 1.00 0.00 H new ATOM 0 HE3 TRP A 96 11.635 -11.892 -5.342 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 12.732 -7.159 -6.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 10.775 -10.781 -7.350 1.00 0.00 H new ATOM 0 HH2 TRP A 96 11.327 -8.453 -7.815 1.00 0.00 H new ATOM 1471 N ASP A 97 11.234 -10.518 -1.074 1.00 0.00 N ATOM 1472 CA ASP A 97 9.788 -10.248 -0.835 1.00 0.00 C ATOM 1473 C ASP A 97 9.151 -10.699 0.496 1.00 0.00 C ATOM 1474 O ASP A 97 8.959 -9.886 1.322 1.00 0.00 O ATOM 1475 CB ASP A 97 8.931 -10.667 -2.051 1.00 0.00 C ATOM 1476 CG ASP A 97 9.157 -12.093 -2.485 1.00 0.00 C ATOM 1477 OD1 ASP A 97 8.508 -12.994 -1.962 1.00 0.00 O ATOM 1478 OD2 ASP A 97 10.030 -12.316 -3.345 1.00 0.00 O ATOM 0 H ASP A 97 11.725 -9.710 -1.458 1.00 0.00 H new ATOM 0 HA ASP A 97 9.784 -9.165 -0.712 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.877 -10.533 -1.806 1.00 0.00 H new ATOM 0 HB3 ASP A 97 9.151 -10.002 -2.886 1.00 0.00 H new ATOM 1483 N PHE A 98 8.951 -11.989 0.701 1.00 0.00 N ATOM 1484 CA PHE A 98 8.153 -12.606 1.798 1.00 0.00 C ATOM 1485 C PHE A 98 8.166 -11.876 3.198 1.00 0.00 C ATOM 1486 O PHE A 98 7.102 -11.751 3.806 1.00 0.00 O ATOM 1487 CB PHE A 98 8.612 -14.089 1.897 1.00 0.00 C ATOM 1488 CG PHE A 98 7.927 -14.965 2.915 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.648 -15.434 2.693 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.581 -15.340 4.086 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.031 -16.256 3.597 1.00 0.00 C ATOM 1492 CE2 PHE A 98 7.961 -16.162 5.003 1.00 0.00 C ATOM 1493 CZ PHE A 98 6.681 -16.628 4.756 1.00 0.00 C ATOM 0 H PHE A 98 9.355 -12.692 0.082 1.00 0.00 H new ATOM 0 HA PHE A 98 7.101 -12.509 1.529 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.481 -14.547 0.917 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.681 -14.096 2.112 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.126 -15.148 1.792 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.582 -14.984 4.277 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.031 -16.615 3.402 1.00 0.00 H new ATOM 0 HE2 PHE A 98 8.473 -16.442 5.912 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.194 -17.279 5.467 1.00 0.00 H new ATOM 1503 N ASP A 99 9.312 -11.428 3.713 1.00 0.00 N ATOM 1504 CA ASP A 99 9.317 -10.614 4.983 1.00 0.00 C ATOM 1505 C ASP A 99 9.143 -9.117 4.655 1.00 0.00 C ATOM 1506 O ASP A 99 8.373 -8.427 5.275 1.00 0.00 O ATOM 1507 CB ASP A 99 10.638 -10.840 5.746 1.00 0.00 C ATOM 1508 CG ASP A 99 10.652 -10.322 7.179 1.00 0.00 C ATOM 1509 OD1 ASP A 99 10.820 -9.123 7.407 1.00 0.00 O ATOM 1510 OD2 ASP A 99 10.562 -11.153 8.114 1.00 0.00 O ATOM 0 H ASP A 99 10.232 -11.594 3.306 1.00 0.00 H new ATOM 0 HA ASP A 99 8.486 -10.933 5.612 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.854 -11.908 5.760 1.00 0.00 H new ATOM 0 HB3 ASP A 99 11.446 -10.359 5.194 1.00 0.00 H new ATOM 1515 N MET A 100 9.834 -8.654 3.623 1.00 0.00 N ATOM 1516 CA MET A 100 9.845 -7.218 3.264 1.00 0.00 C ATOM 1517 C MET A 100 8.465 -6.766 2.766 1.00 0.00 C ATOM 1518 O MET A 100 8.018 -5.647 3.022 1.00 0.00 O ATOM 1519 CB MET A 100 10.886 -6.947 2.178 1.00 0.00 C ATOM 1520 CG MET A 100 12.294 -7.322 2.562 1.00 0.00 C ATOM 1521 SD MET A 100 13.450 -7.000 1.216 1.00 0.00 S ATOM 1522 CE MET A 100 14.997 -7.488 1.963 1.00 0.00 C ATOM 0 H MET A 100 10.399 -9.242 3.011 1.00 0.00 H new ATOM 0 HA MET A 100 10.100 -6.654 4.161 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.608 -7.497 1.279 1.00 0.00 H new ATOM 0 HB3 MET A 100 10.861 -5.887 1.923 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.595 -6.758 3.445 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.331 -8.378 2.831 1.00 0.00 H new ATOM 0 HE1 MET A 100 15.807 -7.345 1.248 1.00 0.00 H new ATOM 0 HE2 MET A 100 15.182 -6.879 2.848 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.947 -8.539 2.249 1.00 0.00 H new ATOM 1532 N LEU A 101 7.837 -7.645 2.052 1.00 0.00 N ATOM 1533 CA LEU A 101 6.544 -7.478 1.506 1.00 0.00 C ATOM 1534 C LEU A 101 5.511 -8.008 2.486 1.00 0.00 C ATOM 1535 O LEU A 101 5.635 -9.118 2.952 1.00 0.00 O ATOM 1536 CB LEU A 101 6.512 -8.177 0.106 1.00 0.00 C ATOM 1537 CG LEU A 101 5.172 -8.597 -0.498 1.00 0.00 C ATOM 1538 CD1 LEU A 101 5.280 -8.595 -2.005 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.864 -10.008 -0.066 1.00 0.00 C ATOM 0 H LEU A 101 8.246 -8.552 1.826 1.00 0.00 H new ATOM 0 HA LEU A 101 6.298 -6.428 1.349 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.994 -7.506 -0.605 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.134 -9.070 0.173 1.00 0.00 H new ATOM 0 HG LEU A 101 4.395 -7.907 -0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.326 -8.894 -2.439 1.00 0.00 H new ATOM 0 HD12 LEU A 101 5.537 -7.594 -2.350 1.00 0.00 H new ATOM 0 HD13 LEU A 101 6.055 -9.296 -2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.910 -10.319 -0.491 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.651 -10.676 -0.416 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.808 -10.051 1.022 1.00 0.00 H new ATOM 1551 N THR A 102 4.564 -7.139 2.843 1.00 0.00 N ATOM 1552 CA THR A 102 3.436 -7.420 3.747 1.00 0.00 C ATOM 1553 C THR A 102 3.928 -7.513 5.200 1.00 0.00 C ATOM 1554 O THR A 102 4.981 -6.943 5.527 1.00 0.00 O ATOM 1555 CB THR A 102 2.522 -8.664 3.309 1.00 0.00 C ATOM 1556 OG1 THR A 102 1.225 -8.528 3.885 1.00 0.00 O ATOM 1557 CG2 THR A 102 3.039 -10.047 3.712 1.00 0.00 C ATOM 0 H THR A 102 4.557 -6.179 2.498 1.00 0.00 H new ATOM 0 HA THR A 102 2.756 -6.571 3.670 1.00 0.00 H new ATOM 0 HB THR A 102 2.525 -8.626 2.220 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.895 -7.617 3.737 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.343 -10.811 3.365 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.017 -10.215 3.261 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.125 -10.101 4.797 1.00 0.00 H new ATOM 1565 N GLY A 103 3.124 -8.106 6.075 1.00 0.00 N ATOM 1566 CA GLY A 103 3.514 -8.314 7.444 1.00 0.00 C ATOM 1567 C GLY A 103 4.819 -9.076 7.544 1.00 0.00 C ATOM 1568 O GLY A 103 4.876 -10.262 7.235 1.00 0.00 O ATOM 0 H GLY A 103 2.191 -8.450 5.847 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.616 -7.351 7.944 1.00 0.00 H new ATOM 0 HA3 GLY A 103 2.731 -8.863 7.966 1.00 0.00 H new ATOM 1572 N SER A 104 5.829 -8.390 7.939 1.00 0.00 N ATOM 1573 CA SER A 104 7.132 -8.875 8.041 1.00 0.00 C ATOM 1574 C SER A 104 7.346 -9.772 9.238 1.00 0.00 C ATOM 1575 O SER A 104 7.381 -10.995 9.133 1.00 0.00 O ATOM 1576 CB SER A 104 8.039 -7.661 8.114 1.00 0.00 C ATOM 1577 OG SER A 104 7.519 -6.693 9.039 1.00 0.00 O ATOM 0 H SER A 104 5.748 -7.411 8.215 1.00 0.00 H new ATOM 0 HA SER A 104 7.352 -9.500 7.176 1.00 0.00 H new ATOM 0 HB2 SER A 104 9.039 -7.966 8.423 1.00 0.00 H new ATOM 0 HB3 SER A 104 8.134 -7.212 7.125 1.00 0.00 H new ATOM 0 HG SER A 104 8.178 -6.529 9.746 1.00 0.00 H new ATOM 1583 N GLY A 105 7.461 -9.156 10.362 1.00 0.00 N ATOM 1584 CA GLY A 105 7.791 -9.835 11.534 1.00 0.00 C ATOM 1585 C GLY A 105 9.234 -9.578 11.899 1.00 0.00 C ATOM 1586 O GLY A 105 9.532 -9.280 13.052 1.00 0.00 O ATOM 0 H GLY A 105 7.324 -8.152 10.479 1.00 0.00 H new ATOM 0 HA2 GLY A 105 7.140 -9.511 12.346 1.00 0.00 H new ATOM 0 HA3 GLY A 105 7.627 -10.904 11.401 1.00 0.00 H new ATOM 1590 N ASN A 106 10.159 -9.647 10.921 1.00 0.00 N ATOM 1591 CA ASN A 106 11.571 -9.510 11.273 1.00 0.00 C ATOM 1592 C ASN A 106 12.300 -8.261 10.738 1.00 0.00 C ATOM 1593 O ASN A 106 12.981 -7.591 11.518 1.00 0.00 O ATOM 1594 CB ASN A 106 12.376 -10.795 10.955 1.00 0.00 C ATOM 1595 CG ASN A 106 12.007 -11.974 11.845 1.00 0.00 C ATOM 1596 OD1 ASN A 106 11.591 -11.808 12.994 1.00 0.00 O ATOM 1597 ND2 ASN A 106 12.159 -13.163 11.344 1.00 0.00 N ATOM 0 H ASN A 106 9.962 -9.790 9.931 1.00 0.00 H new ATOM 0 HA ASN A 106 11.535 -9.356 12.351 1.00 0.00 H new ATOM 0 HB2 ASN A 106 12.211 -11.070 9.913 1.00 0.00 H new ATOM 0 HB3 ASN A 106 13.440 -10.585 11.065 1.00 0.00 H new ATOM 0 HD21 ASN A 106 11.933 -13.985 11.904 1.00 0.00 H new ATOM 0 HD22 ASN A 106 12.505 -13.274 10.391 1.00 0.00 H new ATOM 1604 N TYR A 107 12.160 -7.898 9.454 1.00 0.00 N ATOM 1605 CA TYR A 107 13.025 -6.807 8.938 1.00 0.00 C ATOM 1606 C TYR A 107 12.485 -5.987 7.744 1.00 0.00 C ATOM 1607 O TYR A 107 13.271 -5.577 6.886 1.00 0.00 O ATOM 1608 CB TYR A 107 14.414 -7.375 8.588 1.00 0.00 C ATOM 1609 CG TYR A 107 14.392 -8.612 7.690 1.00 0.00 C ATOM 1610 CD1 TYR A 107 14.271 -8.502 6.311 1.00 0.00 C ATOM 1611 CD2 TYR A 107 14.464 -9.884 8.236 1.00 0.00 C ATOM 1612 CE1 TYR A 107 14.238 -9.606 5.502 1.00 0.00 C ATOM 1613 CE2 TYR A 107 14.436 -11.004 7.424 1.00 0.00 C ATOM 1614 CZ TYR A 107 14.313 -10.850 6.058 1.00 0.00 C ATOM 1615 OH TYR A 107 14.252 -11.958 5.249 1.00 0.00 O ATOM 0 H TYR A 107 11.506 -8.306 8.786 1.00 0.00 H new ATOM 0 HA TYR A 107 13.063 -6.088 9.756 1.00 0.00 H new ATOM 0 HB2 TYR A 107 14.996 -6.596 8.096 1.00 0.00 H new ATOM 0 HB3 TYR A 107 14.933 -7.624 9.514 1.00 0.00 H new ATOM 0 HD1 TYR A 107 14.201 -7.521 5.865 1.00 0.00 H new ATOM 0 HD2 TYR A 107 14.543 -10.002 9.307 1.00 0.00 H new ATOM 0 HE1 TYR A 107 14.153 -9.493 4.431 1.00 0.00 H new ATOM 0 HE2 TYR A 107 14.510 -11.991 7.856 1.00 0.00 H new ATOM 0 HH TYR A 107 14.320 -12.767 5.797 1.00 0.00 H new ATOM 1625 N SER A 108 11.210 -5.677 7.699 1.00 0.00 N ATOM 1626 CA SER A 108 10.735 -4.824 6.606 1.00 0.00 C ATOM 1627 C SER A 108 10.962 -3.339 6.937 1.00 0.00 C ATOM 1628 O SER A 108 11.857 -2.690 6.361 1.00 0.00 O ATOM 1629 CB SER A 108 9.258 -5.086 6.247 1.00 0.00 C ATOM 1630 OG SER A 108 8.824 -4.242 5.183 1.00 0.00 O ATOM 0 H SER A 108 10.502 -5.980 8.368 1.00 0.00 H new ATOM 0 HA SER A 108 11.323 -5.082 5.725 1.00 0.00 H new ATOM 0 HB2 SER A 108 9.131 -6.130 5.960 1.00 0.00 H new ATOM 0 HB3 SER A 108 8.633 -4.918 7.124 1.00 0.00 H new ATOM 0 HG SER A 108 8.665 -4.782 4.381 1.00 0.00 H new ATOM 1636 N SER A 109 10.218 -2.825 7.914 1.00 0.00 N ATOM 1637 CA SER A 109 10.246 -1.409 8.312 1.00 0.00 C ATOM 1638 C SER A 109 10.109 -0.464 7.077 1.00 0.00 C ATOM 1639 O SER A 109 9.576 -0.851 6.028 1.00 0.00 O ATOM 1640 CB SER A 109 11.518 -1.090 9.178 1.00 0.00 C ATOM 1641 OG SER A 109 12.745 -1.367 8.494 1.00 0.00 O ATOM 0 H SER A 109 9.566 -3.385 8.464 1.00 0.00 H new ATOM 0 HA SER A 109 9.378 -1.218 8.943 1.00 0.00 H new ATOM 0 HB2 SER A 109 11.499 -0.039 9.468 1.00 0.00 H new ATOM 0 HB3 SER A 109 11.481 -1.675 10.097 1.00 0.00 H new ATOM 0 HG SER A 109 12.559 -1.550 7.549 1.00 0.00 H new ATOM 1647 N THR A 110 10.535 0.760 7.219 1.00 0.00 N ATOM 1648 CA THR A 110 10.531 1.683 6.129 1.00 0.00 C ATOM 1649 C THR A 110 11.750 1.408 5.235 1.00 0.00 C ATOM 1650 O THR A 110 11.728 1.653 4.033 1.00 0.00 O ATOM 1651 CB THR A 110 10.604 3.114 6.693 1.00 0.00 C ATOM 1652 OG1 THR A 110 9.548 3.291 7.655 1.00 0.00 O ATOM 1653 CG2 THR A 110 10.485 4.181 5.600 1.00 0.00 C ATOM 0 H THR A 110 10.894 1.141 8.094 1.00 0.00 H new ATOM 0 HA THR A 110 9.622 1.571 5.539 1.00 0.00 H new ATOM 0 HB THR A 110 11.581 3.239 7.161 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.588 4.199 8.021 1.00 0.00 H new ATOM 0 HG21 THR A 110 10.542 5.172 6.051 1.00 0.00 H new ATOM 0 HG22 THR A 110 11.298 4.061 4.884 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.530 4.071 5.087 1.00 0.00 H new ATOM 1661 N ASP A 111 12.775 0.831 5.843 1.00 0.00 N ATOM 1662 CA ASP A 111 14.085 0.656 5.219 1.00 0.00 C ATOM 1663 C ASP A 111 14.111 -0.317 4.032 1.00 0.00 C ATOM 1664 O ASP A 111 14.670 0.001 2.975 1.00 0.00 O ATOM 1665 CB ASP A 111 15.102 0.214 6.262 1.00 0.00 C ATOM 1666 CG ASP A 111 16.516 0.212 5.715 1.00 0.00 C ATOM 1667 OD1 ASP A 111 17.160 1.296 5.719 1.00 0.00 O ATOM 1668 OD2 ASP A 111 17.009 -0.864 5.261 1.00 0.00 O ATOM 0 H ASP A 111 12.724 0.466 6.794 1.00 0.00 H new ATOM 0 HA ASP A 111 14.341 1.632 4.808 1.00 0.00 H new ATOM 0 HB2 ASP A 111 15.048 0.879 7.124 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.848 -0.786 6.614 1.00 0.00 H new ATOM 1673 N ALA A 112 13.457 -1.447 4.154 1.00 0.00 N ATOM 1674 CA ALA A 112 13.608 -2.511 3.158 1.00 0.00 C ATOM 1675 C ALA A 112 12.963 -2.126 1.878 1.00 0.00 C ATOM 1676 O ALA A 112 13.437 -2.458 0.789 1.00 0.00 O ATOM 1677 CB ALA A 112 13.050 -3.826 3.664 1.00 0.00 C ATOM 0 H ALA A 112 12.819 -1.664 4.920 1.00 0.00 H new ATOM 0 HA ALA A 112 14.674 -2.650 2.980 1.00 0.00 H new ATOM 0 HB1 ALA A 112 13.178 -4.593 2.901 1.00 0.00 H new ATOM 0 HB2 ALA A 112 13.580 -4.122 4.569 1.00 0.00 H new ATOM 0 HB3 ALA A 112 11.989 -3.710 3.887 1.00 0.00 H new ATOM 1683 N GLN A 113 11.912 -1.394 2.010 1.00 0.00 N ATOM 1684 CA GLN A 113 11.158 -0.971 0.905 1.00 0.00 C ATOM 1685 C GLN A 113 11.724 0.339 0.304 1.00 0.00 C ATOM 1686 O GLN A 113 11.494 0.635 -0.845 1.00 0.00 O ATOM 1687 CB GLN A 113 9.705 -0.877 1.350 1.00 0.00 C ATOM 1688 CG GLN A 113 9.367 0.285 2.274 1.00 0.00 C ATOM 1689 CD GLN A 113 9.174 1.583 1.519 1.00 0.00 C ATOM 1690 OE1 GLN A 113 8.719 1.589 0.397 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.594 2.665 2.086 1.00 0.00 N ATOM 0 H GLN A 113 11.554 -1.072 2.909 1.00 0.00 H new ATOM 0 HA GLN A 113 11.219 -1.688 0.087 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.077 -0.804 0.462 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.439 -1.806 1.854 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.459 0.052 2.829 1.00 0.00 H new ATOM 0 HG3 GLN A 113 10.165 0.408 3.006 1.00 0.00 H new ATOM 0 HE21 GLN A 113 9.973 2.631 3.032 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.547 3.553 1.587 1.00 0.00 H new ATOM 1700 N MET A 114 12.466 1.114 1.105 1.00 0.00 N ATOM 1701 CA MET A 114 13.038 2.397 0.634 1.00 0.00 C ATOM 1702 C MET A 114 14.192 2.119 -0.309 1.00 0.00 C ATOM 1703 O MET A 114 14.462 2.860 -1.247 1.00 0.00 O ATOM 1704 CB MET A 114 13.479 3.262 1.830 1.00 0.00 C ATOM 1705 CG MET A 114 13.970 4.666 1.474 1.00 0.00 C ATOM 1706 SD MET A 114 14.423 5.638 2.932 1.00 0.00 S ATOM 1707 CE MET A 114 14.997 7.151 2.153 1.00 0.00 C ATOM 0 H MET A 114 12.687 0.885 2.074 1.00 0.00 H new ATOM 0 HA MET A 114 12.277 2.958 0.091 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.641 3.352 2.521 1.00 0.00 H new ATOM 0 HB3 MET A 114 14.275 2.740 2.361 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.833 4.588 0.812 1.00 0.00 H new ATOM 0 HG3 MET A 114 13.190 5.190 0.921 1.00 0.00 H new ATOM 0 HE1 MET A 114 15.314 7.858 2.920 1.00 0.00 H new ATOM 0 HE2 MET A 114 15.838 6.926 1.497 1.00 0.00 H new ATOM 0 HE3 MET A 114 14.188 7.589 1.568 1.00 0.00 H new ATOM 1717 N GLN A 115 14.832 1.007 -0.069 1.00 0.00 N ATOM 1718 CA GLN A 115 15.892 0.508 -0.909 1.00 0.00 C ATOM 1719 C GLN A 115 15.379 -0.736 -1.624 1.00 0.00 C ATOM 1720 O GLN A 115 16.062 -1.762 -1.716 1.00 0.00 O ATOM 1721 CB GLN A 115 17.155 0.196 -0.087 1.00 0.00 C ATOM 1722 CG GLN A 115 17.969 1.426 0.329 1.00 0.00 C ATOM 1723 CD GLN A 115 17.352 2.302 1.419 1.00 0.00 C ATOM 1724 OE1 GLN A 115 17.548 3.511 1.441 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.679 1.718 2.364 1.00 0.00 N ATOM 0 H GLN A 115 14.629 0.409 0.732 1.00 0.00 H new ATOM 0 HA GLN A 115 16.175 1.266 -1.639 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.862 -0.349 0.810 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.796 -0.467 -0.668 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.948 1.090 0.672 1.00 0.00 H new ATOM 0 HG3 GLN A 115 18.135 2.043 -0.554 1.00 0.00 H new ATOM 0 HE21 GLN A 115 16.524 0.710 2.332 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.305 2.267 3.138 1.00 0.00 H new ATOM 1734 N TYR A 116 14.153 -0.622 -2.094 1.00 0.00 N ATOM 1735 CA TYR A 116 13.454 -1.671 -2.787 1.00 0.00 C ATOM 1736 C TYR A 116 14.179 -2.069 -4.057 1.00 0.00 C ATOM 1737 O TYR A 116 14.863 -1.246 -4.723 1.00 0.00 O ATOM 1738 CB TYR A 116 12.045 -1.188 -3.203 1.00 0.00 C ATOM 1739 CG TYR A 116 12.070 -0.020 -4.205 1.00 0.00 C ATOM 1740 CD1 TYR A 116 12.235 1.287 -3.785 1.00 0.00 C ATOM 1741 CD2 TYR A 116 11.946 -0.247 -5.556 1.00 0.00 C ATOM 1742 CE1 TYR A 116 12.270 2.330 -4.690 1.00 0.00 C ATOM 1743 CE2 TYR A 116 11.976 0.794 -6.468 1.00 0.00 C ATOM 1744 CZ TYR A 116 12.136 2.074 -6.020 1.00 0.00 C ATOM 1745 OH TYR A 116 12.173 3.110 -6.910 1.00 0.00 O ATOM 0 H TYR A 116 13.604 0.232 -1.998 1.00 0.00 H new ATOM 0 HA TYR A 116 13.396 -2.520 -2.106 1.00 0.00 H new ATOM 0 HB2 TYR A 116 11.498 -2.022 -3.642 1.00 0.00 H new ATOM 0 HB3 TYR A 116 11.497 -0.881 -2.312 1.00 0.00 H new ATOM 0 HD1 TYR A 116 12.338 1.496 -2.730 1.00 0.00 H new ATOM 0 HD2 TYR A 116 11.823 -1.259 -5.913 1.00 0.00 H new ATOM 0 HE1 TYR A 116 12.403 3.344 -4.344 1.00 0.00 H new ATOM 0 HE2 TYR A 116 11.874 0.596 -7.525 1.00 0.00 H new ATOM 0 HH TYR A 116 12.065 2.763 -7.820 1.00 0.00 H new ATOM 1755 N ASP A 117 14.048 -3.298 -4.388 1.00 0.00 N ATOM 1756 CA ASP A 117 14.446 -3.754 -5.691 1.00 0.00 C ATOM 1757 C ASP A 117 13.312 -3.362 -6.620 1.00 0.00 C ATOM 1758 O ASP A 117 12.151 -3.328 -6.170 1.00 0.00 O ATOM 1759 CB ASP A 117 14.626 -5.268 -5.728 1.00 0.00 C ATOM 1760 CG ASP A 117 15.665 -5.775 -4.795 1.00 0.00 C ATOM 1761 OD1 ASP A 117 15.333 -6.055 -3.635 1.00 0.00 O ATOM 1762 OD2 ASP A 117 16.829 -5.942 -5.224 1.00 0.00 O ATOM 0 H ASP A 117 13.667 -4.022 -3.779 1.00 0.00 H new ATOM 0 HA ASP A 117 15.402 -3.314 -5.976 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.674 -5.743 -5.489 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.886 -5.568 -6.743 1.00 0.00 H new ATOM 1767 N PRO A 118 13.571 -3.055 -7.901 1.00 0.00 N ATOM 1768 CA PRO A 118 12.511 -2.624 -8.835 1.00 0.00 C ATOM 1769 C PRO A 118 11.354 -3.642 -8.958 1.00 0.00 C ATOM 1770 O PRO A 118 10.172 -3.261 -9.100 1.00 0.00 O ATOM 1771 CB PRO A 118 13.241 -2.464 -10.175 1.00 0.00 C ATOM 1772 CG PRO A 118 14.528 -3.204 -10.017 1.00 0.00 C ATOM 1773 CD PRO A 118 14.899 -3.081 -8.567 1.00 0.00 C ATOM 0 HA PRO A 118 12.030 -1.709 -8.488 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.651 -2.873 -10.995 1.00 0.00 H new ATOM 0 HB3 PRO A 118 13.418 -1.413 -10.403 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.415 -4.250 -10.304 1.00 0.00 H new ATOM 0 HG3 PRO A 118 15.303 -2.780 -10.656 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.506 -3.921 -8.230 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.471 -2.174 -8.369 1.00 0.00 H new ATOM 1781 N GLY A 119 11.663 -4.912 -8.754 1.00 0.00 N ATOM 1782 CA GLY A 119 10.665 -5.946 -8.918 1.00 0.00 C ATOM 1783 C GLY A 119 9.929 -6.147 -7.615 1.00 0.00 C ATOM 1784 O GLY A 119 8.815 -6.626 -7.588 1.00 0.00 O ATOM 0 H GLY A 119 12.587 -5.245 -8.478 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.964 -5.668 -9.705 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.139 -6.878 -9.228 1.00 0.00 H new ATOM 1788 N LEU A 120 10.553 -5.718 -6.534 1.00 0.00 N ATOM 1789 CA LEU A 120 9.986 -5.824 -5.214 1.00 0.00 C ATOM 1790 C LEU A 120 8.914 -4.759 -5.082 1.00 0.00 C ATOM 1791 O LEU A 120 7.827 -5.023 -4.578 1.00 0.00 O ATOM 1792 CB LEU A 120 11.072 -5.592 -4.170 1.00 0.00 C ATOM 1793 CG LEU A 120 10.627 -5.639 -2.717 1.00 0.00 C ATOM 1794 CD1 LEU A 120 10.008 -7.003 -2.378 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.805 -5.333 -1.803 1.00 0.00 C ATOM 0 H LEU A 120 11.475 -5.283 -6.554 1.00 0.00 H new ATOM 0 HA LEU A 120 9.559 -6.815 -5.060 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.851 -6.340 -4.314 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.526 -4.619 -4.358 1.00 0.00 H new ATOM 0 HG LEU A 120 9.860 -4.880 -2.562 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.697 -7.012 -1.333 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.141 -7.178 -3.016 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.745 -7.789 -2.544 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.478 -5.369 -0.764 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.590 -6.072 -1.962 1.00 0.00 H new ATOM 0 HD23 LEU A 120 12.191 -4.339 -2.028 1.00 0.00 H new ATOM 1807 N PHE A 121 9.244 -3.526 -5.538 1.00 0.00 N ATOM 1808 CA PHE A 121 8.265 -2.436 -5.593 1.00 0.00 C ATOM 1809 C PHE A 121 7.060 -2.839 -6.428 1.00 0.00 C ATOM 1810 O PHE A 121 5.909 -2.588 -6.038 1.00 0.00 O ATOM 1811 CB PHE A 121 8.885 -1.136 -6.118 1.00 0.00 C ATOM 1812 CG PHE A 121 7.923 0.004 -6.215 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.579 0.724 -5.092 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.351 0.349 -7.439 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.682 1.770 -5.174 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.452 1.398 -7.527 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.117 2.106 -6.397 1.00 0.00 C ATOM 0 H PHE A 121 10.175 -3.272 -5.868 1.00 0.00 H new ATOM 0 HA PHE A 121 7.931 -2.244 -4.573 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.708 -0.848 -5.463 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.312 -1.322 -7.104 1.00 0.00 H new ATOM 0 HD1 PHE A 121 8.015 0.468 -4.138 1.00 0.00 H new ATOM 0 HD2 PHE A 121 7.612 -0.208 -8.327 1.00 0.00 H new ATOM 0 HE1 PHE A 121 6.420 2.327 -4.287 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.015 1.659 -8.480 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.414 2.924 -6.461 1.00 0.00 H new ATOM 1827 N ALA A 122 7.318 -3.486 -7.570 1.00 0.00 N ATOM 1828 CA ALA A 122 6.244 -3.966 -8.398 1.00 0.00 C ATOM 1829 C ALA A 122 5.369 -4.948 -7.609 1.00 0.00 C ATOM 1830 O ALA A 122 4.147 -4.790 -7.563 1.00 0.00 O ATOM 1831 CB ALA A 122 6.775 -4.617 -9.648 1.00 0.00 C ATOM 0 H ALA A 122 8.254 -3.680 -7.925 1.00 0.00 H new ATOM 0 HA ALA A 122 5.634 -3.114 -8.698 1.00 0.00 H new ATOM 0 HB1 ALA A 122 5.942 -4.971 -10.256 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.357 -3.892 -10.217 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.411 -5.460 -9.377 1.00 0.00 H new ATOM 1837 N GLN A 123 6.007 -5.935 -6.963 1.00 0.00 N ATOM 1838 CA GLN A 123 5.292 -6.934 -6.168 1.00 0.00 C ATOM 1839 C GLN A 123 4.458 -6.312 -5.051 1.00 0.00 C ATOM 1840 O GLN A 123 3.262 -6.575 -4.962 1.00 0.00 O ATOM 1841 CB GLN A 123 6.243 -7.965 -5.576 1.00 0.00 C ATOM 1842 CG GLN A 123 6.971 -8.859 -6.578 1.00 0.00 C ATOM 1843 CD GLN A 123 6.137 -9.989 -7.203 1.00 0.00 C ATOM 1844 OE1 GLN A 123 6.687 -11.042 -7.544 1.00 0.00 O ATOM 1845 NE2 GLN A 123 4.839 -9.805 -7.375 1.00 0.00 N ATOM 0 H GLN A 123 7.019 -6.060 -6.978 1.00 0.00 H new ATOM 0 HA GLN A 123 4.612 -7.430 -6.861 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.989 -7.441 -4.978 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.678 -8.602 -4.895 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.356 -8.231 -7.382 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.833 -9.303 -6.079 1.00 0.00 H new ATOM 0 HE21 GLN A 123 4.406 -8.928 -7.086 1.00 0.00 H new ATOM 0 HE22 GLN A 123 4.271 -10.540 -7.796 1.00 0.00 H new ATOM 1854 N ILE A 124 5.092 -5.489 -4.208 1.00 0.00 N ATOM 1855 CA ILE A 124 4.402 -4.881 -3.066 1.00 0.00 C ATOM 1856 C ILE A 124 3.210 -4.039 -3.505 1.00 0.00 C ATOM 1857 O ILE A 124 2.115 -4.161 -2.939 1.00 0.00 O ATOM 1858 CB ILE A 124 5.345 -4.054 -2.104 1.00 0.00 C ATOM 1859 CG1 ILE A 124 6.082 -2.911 -2.826 1.00 0.00 C ATOM 1860 CG2 ILE A 124 6.344 -4.963 -1.397 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.873 -2.003 -1.906 1.00 0.00 C ATOM 0 H ILE A 124 6.075 -5.230 -4.294 1.00 0.00 H new ATOM 0 HA ILE A 124 4.038 -5.725 -2.481 1.00 0.00 H new ATOM 0 HB ILE A 124 4.693 -3.597 -1.360 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.759 -3.340 -3.565 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.353 -2.311 -3.371 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.979 -4.366 -0.742 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.806 -5.703 -0.805 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.962 -5.470 -2.138 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.361 -1.225 -2.494 1.00 0.00 H new ATOM 0 HD12 ILE A 124 6.200 -1.543 -1.183 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.628 -2.587 -1.379 1.00 0.00 H new ATOM 1873 N GLN A 125 3.410 -3.238 -4.540 1.00 0.00 N ATOM 1874 CA GLN A 125 2.364 -2.389 -5.062 1.00 0.00 C ATOM 1875 C GLN A 125 1.192 -3.211 -5.596 1.00 0.00 C ATOM 1876 O GLN A 125 0.031 -2.987 -5.223 1.00 0.00 O ATOM 1877 CB GLN A 125 2.885 -1.523 -6.199 1.00 0.00 C ATOM 1878 CG GLN A 125 1.785 -0.673 -6.814 1.00 0.00 C ATOM 1879 CD GLN A 125 2.187 0.013 -8.089 1.00 0.00 C ATOM 1880 OE1 GLN A 125 2.044 -0.549 -9.175 1.00 0.00 O ATOM 1881 NE2 GLN A 125 2.656 1.220 -7.981 1.00 0.00 N ATOM 0 H GLN A 125 4.298 -3.162 -5.036 1.00 0.00 H new ATOM 0 HA GLN A 125 2.027 -1.764 -4.235 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.679 -0.876 -5.828 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.325 -2.159 -6.967 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.918 -1.304 -7.010 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.474 0.080 -6.090 1.00 0.00 H new ATOM 0 HE21 GLN A 125 2.758 1.647 -7.060 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.922 1.740 -8.817 1.00 0.00 H new ATOM 1890 N ALA A 126 1.521 -4.166 -6.456 1.00 0.00 N ATOM 1891 CA ALA A 126 0.535 -4.964 -7.157 1.00 0.00 C ATOM 1892 C ALA A 126 -0.264 -5.805 -6.206 1.00 0.00 C ATOM 1893 O ALA A 126 -1.470 -5.939 -6.362 1.00 0.00 O ATOM 1894 CB ALA A 126 1.198 -5.832 -8.202 1.00 0.00 C ATOM 0 H ALA A 126 2.485 -4.407 -6.685 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.151 -4.280 -7.656 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.441 -6.423 -8.717 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.718 -5.201 -8.923 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.914 -6.499 -7.721 1.00 0.00 H new ATOM 1900 N ALA A 127 0.406 -6.362 -5.213 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.250 -7.191 -4.242 1.00 0.00 C ATOM 1902 C ALA A 127 -1.234 -6.365 -3.429 1.00 0.00 C ATOM 1903 O ALA A 127 -2.391 -6.786 -3.207 1.00 0.00 O ATOM 1904 CB ALA A 127 0.770 -7.869 -3.361 1.00 0.00 C ATOM 0 H ALA A 127 1.409 -6.249 -5.065 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.814 -7.970 -4.755 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.260 -8.495 -2.629 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.426 -8.488 -3.973 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.363 -7.115 -2.843 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.789 -5.172 -3.038 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.597 -4.265 -2.275 1.00 0.00 C ATOM 1912 C ALA A 128 -2.854 -3.909 -3.011 1.00 0.00 C ATOM 1913 O ALA A 128 -3.893 -4.223 -2.559 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.829 -3.003 -1.906 1.00 0.00 C ATOM 0 H ALA A 128 0.145 -4.821 -3.249 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.868 -4.778 -1.352 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.474 -2.340 -1.329 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.044 -3.269 -1.310 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.507 -2.494 -2.815 1.00 0.00 H new ATOM 1920 N THR A 129 -2.735 -3.303 -4.162 1.00 0.00 N ATOM 1921 CA THR A 129 -3.911 -2.851 -4.925 1.00 0.00 C ATOM 1922 C THR A 129 -4.938 -3.992 -5.181 1.00 0.00 C ATOM 1923 O THR A 129 -6.193 -3.816 -5.019 1.00 0.00 O ATOM 1924 CB THR A 129 -3.467 -2.205 -6.265 1.00 0.00 C ATOM 1925 OG1 THR A 129 -2.538 -3.065 -6.936 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.807 -0.861 -6.037 1.00 0.00 C ATOM 0 H THR A 129 -1.841 -3.102 -4.609 1.00 0.00 H new ATOM 0 HA THR A 129 -4.419 -2.104 -4.315 1.00 0.00 H new ATOM 0 HB THR A 129 -4.359 -2.061 -6.875 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.653 -2.974 -6.526 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.508 -0.435 -6.995 1.00 0.00 H new ATOM 0 HG22 THR A 129 -3.510 -0.189 -5.545 1.00 0.00 H new ATOM 0 HG23 THR A 129 -1.927 -0.990 -5.407 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.378 -5.171 -5.429 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.123 -6.351 -5.854 1.00 0.00 C ATOM 1936 C LYS A 130 -6.005 -6.824 -4.733 1.00 0.00 C ATOM 1937 O LYS A 130 -7.064 -7.436 -4.931 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.129 -7.419 -6.319 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.718 -8.648 -6.995 1.00 0.00 C ATOM 1940 CD LYS A 130 -3.594 -9.533 -7.534 1.00 0.00 C ATOM 1941 CE LYS A 130 -4.102 -10.781 -8.247 1.00 0.00 C ATOM 1942 NZ LYS A 130 -4.966 -11.605 -7.382 1.00 0.00 N ATOM 0 H LYS A 130 -3.376 -5.337 -5.339 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.778 -6.118 -6.693 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.427 -6.953 -7.010 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.553 -7.749 -5.454 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.325 -9.209 -6.285 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.377 -8.346 -7.809 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.982 -8.952 -8.224 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -2.948 -9.832 -6.709 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -4.657 -10.487 -9.138 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -3.253 -11.377 -8.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -5.066 -12.554 -7.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -4.539 -11.682 -6.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -5.903 -11.161 -7.303 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.562 -6.527 -3.577 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.266 -6.700 -2.385 1.00 0.00 C ATOM 1958 C ALA A 131 -7.181 -5.526 -2.199 1.00 0.00 C ATOM 1959 O ALA A 131 -8.397 -5.687 -2.268 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.227 -6.751 -1.342 1.00 0.00 C ATOM 0 H ALA A 131 -4.633 -6.130 -3.435 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.884 -7.598 -2.362 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.696 -6.886 -0.367 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.554 -7.585 -1.539 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.661 -5.819 -1.346 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.586 -4.343 -2.133 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.222 -3.070 -1.769 1.00 0.00 C ATOM 1968 C TRP A 132 -8.161 -2.529 -2.824 1.00 0.00 C ATOM 1969 O TRP A 132 -8.337 -1.335 -2.961 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.207 -1.978 -1.409 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.344 -2.339 -0.260 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -4.922 -3.550 -0.001 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.811 -1.521 0.782 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.108 -3.591 0.988 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.011 -2.372 1.534 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -4.877 -0.171 1.146 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.310 -1.959 2.604 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.175 0.225 2.229 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.394 -0.668 2.931 1.00 0.00 C ATOM 0 H TRP A 132 -5.594 -4.232 -2.342 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.810 -3.322 -0.887 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.579 -1.774 -2.277 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.741 -1.056 -1.178 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.227 -4.422 -0.561 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.612 -4.422 1.309 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.470 0.531 0.579 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.703 -2.645 3.176 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.226 1.255 2.550 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.828 -0.309 3.778 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.720 -3.370 -3.583 1.00 0.00 N ATOM 1991 CA ARG A 133 -9.762 -2.937 -4.462 1.00 0.00 C ATOM 1992 C ARG A 133 -11.199 -3.486 -4.214 1.00 0.00 C ATOM 1993 O ARG A 133 -12.162 -2.706 -4.131 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.310 -2.940 -5.936 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.407 -2.707 -6.956 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.145 -3.977 -7.307 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.516 -3.699 -7.769 1.00 0.00 N ATOM 1998 CZ ARG A 133 -12.986 -3.963 -8.993 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -12.155 -4.157 -10.019 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.293 -3.982 -9.197 1.00 0.00 N ATOM 0 H ARG A 133 -8.490 -4.363 -3.629 1.00 0.00 H new ATOM 0 HA ARG A 133 -9.919 -1.898 -4.174 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -8.548 -2.171 -6.066 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -8.836 -3.898 -6.150 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.114 -1.975 -6.565 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -9.974 -2.280 -7.860 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -10.600 -4.512 -8.085 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.180 -4.631 -6.435 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.158 -3.271 -7.102 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.147 -4.105 -9.875 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -12.528 -4.358 -10.947 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -14.933 -3.796 -8.424 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -14.661 -4.182 -10.127 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.321 -4.769 -4.063 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.608 -5.454 -4.267 1.00 0.00 C ATOM 2016 C LYS A 134 -13.786 -5.531 -3.281 1.00 0.00 C ATOM 2017 O LYS A 134 -14.357 -6.609 -3.137 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.643 -6.533 -5.347 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.439 -7.403 -5.419 1.00 0.00 C ATOM 2020 CD LYS A 134 -11.249 -8.145 -4.139 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.819 -8.391 -3.929 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.254 -9.344 -4.929 1.00 0.00 N ATOM 0 H LYS A 134 -10.553 -5.386 -3.798 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.906 -4.437 -4.520 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -13.516 -7.163 -5.179 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -12.780 -6.050 -6.315 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.543 -8.109 -6.243 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -10.558 -6.797 -5.628 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -11.657 -7.570 -3.308 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.792 -9.090 -4.169 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.278 -7.446 -3.985 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.665 -8.787 -2.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.230 -9.188 -5.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.430 -10.320 -4.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.708 -9.189 -5.852 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.154 -4.473 -2.575 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.414 -4.585 -1.790 1.00 0.00 C ATOM 2038 C LEU A 135 -16.591 -4.218 -2.752 1.00 0.00 C ATOM 2039 O LEU A 135 -16.340 -3.799 -3.896 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.504 -3.663 -0.503 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.303 -3.465 0.416 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.386 -4.623 0.439 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -13.588 -2.197 0.102 1.00 0.00 C ATOM 0 H LEU A 135 -13.657 -3.584 -2.516 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.456 -5.606 -1.411 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.811 -2.674 -0.842 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.314 -4.055 0.112 1.00 0.00 H new ATOM 0 HG LEU A 135 -14.700 -3.386 1.428 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -12.554 -4.415 1.112 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.923 -5.505 0.787 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.003 -4.804 -0.565 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -12.737 -2.083 0.773 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.236 -2.224 -0.929 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -14.267 -1.355 0.232 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.864 -4.410 -2.342 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.030 -3.965 -3.130 1.00 0.00 C ATOM 2057 C PRO A 136 -19.120 -2.420 -3.193 1.00 0.00 C ATOM 2058 O PRO A 136 -18.498 -1.719 -2.380 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.216 -4.524 -2.335 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.636 -5.612 -1.505 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.277 -5.139 -1.141 1.00 0.00 C ATOM 0 HA PRO A 136 -18.987 -4.304 -4.165 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.674 -3.754 -1.714 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -20.993 -4.904 -2.998 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.241 -5.795 -0.617 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -19.592 -6.550 -2.059 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.293 -4.496 -0.261 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.605 -5.968 -0.918 1.00 0.00 H new ATOM 2069 N VAL A 137 -19.954 -1.903 -4.108 1.00 0.00 N ATOM 2070 CA VAL A 137 -20.093 -0.439 -4.379 1.00 0.00 C ATOM 2071 C VAL A 137 -20.832 0.339 -3.288 1.00 0.00 C ATOM 2072 O VAL A 137 -21.362 1.429 -3.561 1.00 0.00 O ATOM 2073 CB VAL A 137 -20.814 -0.165 -5.732 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -20.012 -0.683 -6.899 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -22.224 -0.743 -5.741 1.00 0.00 C ATOM 0 H VAL A 137 -20.560 -2.480 -4.691 1.00 0.00 H new ATOM 0 HA VAL A 137 -19.063 -0.083 -4.410 1.00 0.00 H new ATOM 0 HB VAL A 137 -20.898 0.917 -5.839 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -20.544 -0.475 -7.827 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -19.040 -0.190 -6.920 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -19.871 -1.759 -6.795 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -22.697 -0.533 -6.700 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -22.176 -1.821 -5.588 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -22.809 -0.289 -4.941 1.00 0.00 H new ATOM 2085 N LYS A 138 -20.854 -0.195 -2.067 1.00 0.00 N ATOM 2086 CA LYS A 138 -21.516 0.439 -0.930 1.00 0.00 C ATOM 2087 C LYS A 138 -23.006 0.473 -1.106 1.00 0.00 C ATOM 2088 O LYS A 138 -23.703 -0.484 -0.740 1.00 0.00 O ATOM 2089 CB LYS A 138 -20.968 1.847 -0.645 1.00 0.00 C ATOM 2090 CG LYS A 138 -19.622 1.870 0.026 1.00 0.00 C ATOM 2091 CD LYS A 138 -19.740 1.700 1.512 1.00 0.00 C ATOM 2092 CE LYS A 138 -20.296 2.958 2.174 1.00 0.00 C ATOM 2093 NZ LYS A 138 -20.445 2.787 3.616 1.00 0.00 N ATOM 0 H LYS A 138 -20.410 -1.085 -1.839 1.00 0.00 H new ATOM 0 HA LYS A 138 -21.292 -0.178 -0.060 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -20.900 2.394 -1.586 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -21.682 2.380 -0.017 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -18.998 1.075 -0.383 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -19.122 2.813 -0.194 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -20.390 0.853 1.732 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -18.761 1.468 1.932 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -19.632 3.799 1.974 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -21.263 3.204 1.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -21.452 2.678 3.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -19.925 1.939 3.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -20.064 3.621 4.106 1.00 0.00 H new ATOM 2107 N GLY A 139 -23.499 1.538 -1.703 1.00 0.00 N ATOM 2108 CA GLY A 139 -24.921 1.749 -1.842 1.00 0.00 C ATOM 2109 C GLY A 139 -25.505 2.363 -0.576 1.00 0.00 C ATOM 2110 O GLY A 139 -26.413 3.184 -0.636 1.00 0.00 O ATOM 0 H GLY A 139 -22.925 2.279 -2.104 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -25.114 2.404 -2.691 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -25.415 0.800 -2.052 1.00 0.00 H new ATOM 2114 N ASP A 140 -24.997 1.929 0.560 1.00 0.00 N ATOM 2115 CA ASP A 140 -25.395 2.431 1.844 1.00 0.00 C ATOM 2116 C ASP A 140 -24.879 3.849 2.035 1.00 0.00 C ATOM 2117 O ASP A 140 -25.703 4.775 2.135 1.00 0.00 O ATOM 2118 CB ASP A 140 -24.952 1.496 3.000 1.00 0.00 C ATOM 2119 CG ASP A 140 -23.450 1.367 3.198 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -22.792 0.616 2.442 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -22.903 1.959 4.155 1.00 0.00 O ATOM 2122 OXT ASP A 140 -23.650 4.071 1.993 1.00 0.00 O ATOM 0 H ASP A 140 -24.282 1.203 0.609 1.00 0.00 H new ATOM 0 HA ASP A 140 -26.484 2.455 1.873 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -25.393 1.860 3.928 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -25.364 0.503 2.819 1.00 0.00 H new TER 2127 ASP A 140