USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1136 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 80 LYS NZ :NH3+ -113:sc= -0.714 (180deg=-2.45!) USER MOD Set 1.2: A 81 ASN : amide:sc= 1.37 K(o=0.7,f=-2.8) USER MOD Set 1.3: A 84 THR OG1 : rot 75:sc= 0.0421 USER MOD Single : A 1 GLY N :NH3+ -148:sc= 0.00814 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 23:sc= 0.0123 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl -129:sc= 0 (180deg=-0.147) USER MOD Single : A 12 LYS NZ :NH3+ -143:sc= 0.138 (180deg=-0.379) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 CYS SG : rot 180:sc= -0.544 USER MOD Single : A 16 GLN : amide:sc= -0.451 X(o=-0.45,f=-0.064) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 CYS SG : rot 138:sc= -4.8! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.184 X(o=-0.18,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -10.9! C(o=-11!,f=-11!) USER MOD Single : A 31 THR OG1 : rot -68:sc= 0.441 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 42 GLN : amide:sc= -0.131 K(o=-0.13,f=-0.88) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 94:sc= -2.48 USER MOD Single : A 52 GLN : amide:sc= -0.0764 K(o=-0.076,f=-3!) USER MOD Single : A 55 ASN : amide:sc= -4.52! C(o=-4.5!,f=-20!) USER MOD Single : A 56 ASN :FLIP amide:sc= -0.481 F(o=-1.1,f=-0.48) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot 81:sc= -0.308 USER MOD Single : A 63 ASN : amide:sc= -1.49 K(o=-1.5,f=-7.6!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN :FLIP amide:sc= -1.44 F(o=-2.9,f=-1.4) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 73 MET CE :methyl -122:sc= -2.75! (180deg=-3.49!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 78 CYS SG : rot 15:sc= -2.25 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 CYS SG : rot 124:sc= 0.0292 USER MOD Single : A 90 CYS SG : rot 74:sc= -0.0538 USER MOD Single : A 92 THR OG1 : rot 172:sc= 0.21 USER MOD Single : A 95 MET CE :methyl 160:sc= -1.16 (180deg=-1.67) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 110:sc= 0 USER MOD Single : A 120 SER OG : rot 51:sc= 0.667 USER MOD Single : A 123 SER OG : rot -71:sc= 1.07 USER MOD Single : A 125 THR OG1 : rot -75:sc= 1.06 USER MOD Single : A 131 THR OG1 : rot -64:sc= 0.451 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.065 16.014 -2.584 1.00 0.00 N ATOM 2 CA GLY A 1 24.910 14.866 -2.852 1.00 0.00 C ATOM 3 C GLY A 1 24.138 13.561 -2.836 1.00 0.00 C ATOM 4 O GLY A 1 22.997 13.502 -3.293 1.00 0.00 O ATOM 0 H1 GLY A 1 24.427 16.840 -3.102 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.094 15.810 -2.894 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.067 16.216 -1.564 1.00 0.00 H new ATOM 0 HA2 GLY A 1 25.388 14.990 -3.824 1.00 0.00 H new ATOM 0 HA3 GLY A 1 25.706 14.823 -2.108 1.00 0.00 H new ATOM 8 N SER A 2 24.763 12.512 -2.309 1.00 0.00 N ATOM 9 CA SER A 2 24.129 11.201 -2.241 1.00 0.00 C ATOM 10 C SER A 2 23.810 10.826 -0.797 1.00 0.00 C ATOM 11 O SER A 2 24.644 10.256 -0.093 1.00 0.00 O ATOM 12 CB SER A 2 25.036 10.139 -2.867 1.00 0.00 C ATOM 13 OG SER A 2 24.358 8.902 -2.998 1.00 0.00 O ATOM 0 H SER A 2 25.707 12.545 -1.923 1.00 0.00 H new ATOM 0 HA SER A 2 23.195 11.247 -2.801 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.375 10.477 -3.846 1.00 0.00 H new ATOM 0 HB3 SER A 2 25.925 10.006 -2.251 1.00 0.00 H new ATOM 0 HG SER A 2 24.958 8.241 -3.402 1.00 0.00 H new ATOM 19 N SER A 3 22.597 11.151 -0.362 1.00 0.00 N ATOM 20 CA SER A 3 22.168 10.853 1.000 1.00 0.00 C ATOM 21 C SER A 3 22.203 9.351 1.264 1.00 0.00 C ATOM 22 O SER A 3 21.899 8.547 0.384 1.00 0.00 O ATOM 23 CB SER A 3 20.756 11.391 1.241 1.00 0.00 C ATOM 24 OG SER A 3 20.739 12.808 1.213 1.00 0.00 O ATOM 0 H SER A 3 21.894 11.621 -0.932 1.00 0.00 H new ATOM 0 HA SER A 3 22.858 11.342 1.687 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.080 11.001 0.480 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.389 11.039 2.205 1.00 0.00 H new ATOM 0 HG SER A 3 19.825 13.127 1.368 1.00 0.00 H new ATOM 30 N GLY A 4 22.578 8.980 2.484 1.00 0.00 N ATOM 31 CA GLY A 4 22.648 7.575 2.844 1.00 0.00 C ATOM 32 C GLY A 4 23.091 7.366 4.278 1.00 0.00 C ATOM 33 O GLY A 4 24.040 7.998 4.741 1.00 0.00 O ATOM 0 H GLY A 4 22.835 9.627 3.230 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.670 7.117 2.699 1.00 0.00 H new ATOM 0 HA3 GLY A 4 23.341 7.066 2.175 1.00 0.00 H new ATOM 37 N SER A 5 22.400 6.476 4.985 1.00 0.00 N ATOM 38 CA SER A 5 22.724 6.189 6.378 1.00 0.00 C ATOM 39 C SER A 5 22.499 4.713 6.694 1.00 0.00 C ATOM 40 O SER A 5 21.988 3.960 5.865 1.00 0.00 O ATOM 41 CB SER A 5 21.877 7.057 7.310 1.00 0.00 C ATOM 42 OG SER A 5 22.501 8.306 7.552 1.00 0.00 O ATOM 0 H SER A 5 21.613 5.942 4.616 1.00 0.00 H new ATOM 0 HA SER A 5 23.777 6.420 6.536 1.00 0.00 H new ATOM 0 HB2 SER A 5 20.894 7.218 6.868 1.00 0.00 H new ATOM 0 HB3 SER A 5 21.721 6.536 8.255 1.00 0.00 H new ATOM 0 HG SER A 5 23.121 8.509 6.821 1.00 0.00 H new ATOM 48 N SER A 6 22.886 4.308 7.900 1.00 0.00 N ATOM 49 CA SER A 6 22.731 2.922 8.326 1.00 0.00 C ATOM 50 C SER A 6 21.549 2.776 9.279 1.00 0.00 C ATOM 51 O SER A 6 21.570 3.293 10.396 1.00 0.00 O ATOM 52 CB SER A 6 24.011 2.428 9.003 1.00 0.00 C ATOM 53 OG SER A 6 24.000 1.018 9.148 1.00 0.00 O ATOM 0 H SER A 6 23.309 4.920 8.598 1.00 0.00 H new ATOM 0 HA SER A 6 22.539 2.315 7.441 1.00 0.00 H new ATOM 0 HB2 SER A 6 24.877 2.729 8.414 1.00 0.00 H new ATOM 0 HB3 SER A 6 24.113 2.897 9.982 1.00 0.00 H new ATOM 0 HG SER A 6 24.829 0.727 9.582 1.00 0.00 H new ATOM 59 N GLY A 7 20.518 2.067 8.830 1.00 0.00 N ATOM 60 CA GLY A 7 19.341 1.864 9.654 1.00 0.00 C ATOM 61 C GLY A 7 18.288 2.932 9.433 1.00 0.00 C ATOM 62 O GLY A 7 18.268 3.947 10.130 1.00 0.00 O ATOM 0 H GLY A 7 20.477 1.629 7.910 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.913 0.885 9.436 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.633 1.858 10.704 1.00 0.00 H new ATOM 66 N MET A 8 17.412 2.705 8.460 1.00 0.00 N ATOM 67 CA MET A 8 16.351 3.656 8.149 1.00 0.00 C ATOM 68 C MET A 8 14.982 2.987 8.219 1.00 0.00 C ATOM 69 O MET A 8 14.875 1.764 8.136 1.00 0.00 O ATOM 70 CB MET A 8 16.568 4.258 6.759 1.00 0.00 C ATOM 71 CG MET A 8 16.053 3.379 5.631 1.00 0.00 C ATOM 72 SD MET A 8 16.723 3.849 4.024 1.00 0.00 S ATOM 73 CE MET A 8 18.384 3.189 4.144 1.00 0.00 C ATOM 0 H MET A 8 17.416 1.871 7.873 1.00 0.00 H new ATOM 0 HA MET A 8 16.383 4.453 8.891 1.00 0.00 H new ATOM 0 HB2 MET A 8 16.071 5.227 6.710 1.00 0.00 H new ATOM 0 HB3 MET A 8 17.633 4.438 6.612 1.00 0.00 H new ATOM 0 HG2 MET A 8 16.311 2.340 5.838 1.00 0.00 H new ATOM 0 HG3 MET A 8 14.965 3.437 5.598 1.00 0.00 H new ATOM 0 HE1 MET A 8 19.104 3.964 3.881 1.00 0.00 H new ATOM 0 HE2 MET A 8 18.569 2.853 5.164 1.00 0.00 H new ATOM 0 HE3 MET A 8 18.491 2.347 3.460 1.00 0.00 H new ATOM 83 N GLU A 9 13.939 3.797 8.373 1.00 0.00 N ATOM 84 CA GLU A 9 12.578 3.281 8.456 1.00 0.00 C ATOM 85 C GLU A 9 12.261 2.390 7.258 1.00 0.00 C ATOM 86 O GLU A 9 12.829 2.536 6.176 1.00 0.00 O ATOM 87 CB GLU A 9 11.575 4.434 8.528 1.00 0.00 C ATOM 88 CG GLU A 9 11.675 5.248 9.807 1.00 0.00 C ATOM 89 CD GLU A 9 11.682 4.380 11.051 1.00 0.00 C ATOM 90 OE1 GLU A 9 10.587 4.061 11.559 1.00 0.00 O ATOM 91 OE2 GLU A 9 12.783 4.020 11.516 1.00 0.00 O ATOM 0 H GLU A 9 14.011 4.812 8.443 1.00 0.00 H new ATOM 0 HA GLU A 9 12.498 2.683 9.364 1.00 0.00 H new ATOM 0 HB2 GLU A 9 11.730 5.094 7.674 1.00 0.00 H new ATOM 0 HB3 GLU A 9 10.565 4.032 8.441 1.00 0.00 H new ATOM 0 HG2 GLU A 9 12.585 5.848 9.782 1.00 0.00 H new ATOM 0 HG3 GLU A 9 10.837 5.943 9.858 1.00 0.00 H new ATOM 98 N PRO A 10 11.330 1.444 7.454 1.00 0.00 N ATOM 99 CA PRO A 10 10.915 0.511 6.403 1.00 0.00 C ATOM 100 C PRO A 10 10.122 1.200 5.297 1.00 0.00 C ATOM 101 O PRO A 10 9.954 0.652 4.208 1.00 0.00 O ATOM 102 CB PRO A 10 10.033 -0.493 7.148 1.00 0.00 C ATOM 103 CG PRO A 10 9.519 0.257 8.328 1.00 0.00 C ATOM 104 CD PRO A 10 10.611 1.213 8.719 1.00 0.00 C ATOM 0 HA PRO A 10 11.769 0.057 5.900 1.00 0.00 H new ATOM 0 HB2 PRO A 10 9.217 -0.847 6.518 1.00 0.00 H new ATOM 0 HB3 PRO A 10 10.603 -1.370 7.454 1.00 0.00 H new ATOM 0 HG2 PRO A 10 8.602 0.792 8.081 1.00 0.00 H new ATOM 0 HG3 PRO A 10 9.282 -0.421 9.148 1.00 0.00 H new ATOM 0 HD2 PRO A 10 10.207 2.140 9.127 1.00 0.00 H new ATOM 0 HD3 PRO A 10 11.264 0.787 9.481 1.00 0.00 H new ATOM 112 N TRP A 11 9.638 2.403 5.584 1.00 0.00 N ATOM 113 CA TRP A 11 8.863 3.166 4.612 1.00 0.00 C ATOM 114 C TRP A 11 9.776 3.828 3.586 1.00 0.00 C ATOM 115 O TRP A 11 9.385 4.042 2.439 1.00 0.00 O ATOM 116 CB TRP A 11 8.020 4.226 5.322 1.00 0.00 C ATOM 117 CG TRP A 11 8.722 5.542 5.471 1.00 0.00 C ATOM 118 CD1 TRP A 11 9.409 5.985 6.565 1.00 0.00 C ATOM 119 CD2 TRP A 11 8.804 6.585 4.494 1.00 0.00 C ATOM 120 NE1 TRP A 11 9.913 7.241 6.327 1.00 0.00 N ATOM 121 CE2 TRP A 11 9.557 7.631 5.063 1.00 0.00 C ATOM 122 CE3 TRP A 11 8.318 6.737 3.193 1.00 0.00 C ATOM 123 CZ2 TRP A 11 9.831 8.810 4.376 1.00 0.00 C ATOM 124 CZ3 TRP A 11 8.590 7.908 2.512 1.00 0.00 C ATOM 125 CH2 TRP A 11 9.342 8.932 3.104 1.00 0.00 C ATOM 0 H TRP A 11 9.768 2.871 6.481 1.00 0.00 H new ATOM 0 HA TRP A 11 8.201 2.475 4.089 1.00 0.00 H new ATOM 0 HB2 TRP A 11 7.095 4.377 4.765 1.00 0.00 H new ATOM 0 HB3 TRP A 11 7.742 3.857 6.309 1.00 0.00 H new ATOM 0 HD1 TRP A 11 9.537 5.430 7.482 1.00 0.00 H new ATOM 0 HE1 TRP A 11 10.463 7.793 6.985 1.00 0.00 H new ATOM 0 HE3 TRP A 11 7.740 5.953 2.728 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 10.409 9.601 4.831 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 8.217 8.036 1.507 1.00 0.00 H new ATOM 0 HH2 TRP A 11 9.539 9.835 2.545 1.00 0.00 H new ATOM 136 N LYS A 12 10.995 4.149 4.006 1.00 0.00 N ATOM 137 CA LYS A 12 11.966 4.786 3.123 1.00 0.00 C ATOM 138 C LYS A 12 12.239 3.917 1.899 1.00 0.00 C ATOM 139 O LYS A 12 12.154 4.385 0.764 1.00 0.00 O ATOM 140 CB LYS A 12 13.272 5.052 3.875 1.00 0.00 C ATOM 141 CG LYS A 12 13.262 6.346 4.671 1.00 0.00 C ATOM 142 CD LYS A 12 13.012 7.549 3.777 1.00 0.00 C ATOM 143 CE LYS A 12 13.720 8.789 4.301 1.00 0.00 C ATOM 144 NZ LYS A 12 13.055 9.335 5.517 1.00 0.00 N ATOM 0 H LYS A 12 11.334 3.979 4.953 1.00 0.00 H new ATOM 0 HA LYS A 12 11.548 5.735 2.787 1.00 0.00 H new ATOM 0 HB2 LYS A 12 13.468 4.220 4.552 1.00 0.00 H new ATOM 0 HB3 LYS A 12 14.094 5.081 3.160 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.490 6.296 5.439 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.216 6.465 5.185 1.00 0.00 H new ATOM 0 HD2 LYS A 12 13.358 7.331 2.767 1.00 0.00 H new ATOM 0 HD3 LYS A 12 11.941 7.740 3.713 1.00 0.00 H new ATOM 0 HE2 LYS A 12 14.757 8.545 4.533 1.00 0.00 H new ATOM 0 HE3 LYS A 12 13.739 9.553 3.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 13.090 10.374 5.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 12.063 9.022 5.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 13.547 8.990 6.366 1.00 0.00 H new ATOM 158 N GLN A 13 12.567 2.652 2.139 1.00 0.00 N ATOM 159 CA GLN A 13 12.852 1.719 1.055 1.00 0.00 C ATOM 160 C GLN A 13 11.587 1.395 0.268 1.00 0.00 C ATOM 161 O GLN A 13 11.590 1.407 -0.963 1.00 0.00 O ATOM 162 CB GLN A 13 13.465 0.431 1.610 1.00 0.00 C ATOM 163 CG GLN A 13 14.501 0.670 2.697 1.00 0.00 C ATOM 164 CD GLN A 13 15.321 -0.568 3.003 1.00 0.00 C ATOM 165 OE1 GLN A 13 16.311 -0.853 2.328 1.00 0.00 O ATOM 166 NE2 GLN A 13 14.913 -1.311 4.025 1.00 0.00 N ATOM 0 H GLN A 13 12.642 2.250 3.073 1.00 0.00 H new ATOM 0 HA GLN A 13 13.566 2.192 0.381 1.00 0.00 H new ATOM 0 HB2 GLN A 13 12.669 -0.197 2.010 1.00 0.00 H new ATOM 0 HB3 GLN A 13 13.928 -0.122 0.793 1.00 0.00 H new ATOM 0 HG2 GLN A 13 15.167 1.475 2.388 1.00 0.00 H new ATOM 0 HG3 GLN A 13 13.999 1.003 3.606 1.00 0.00 H new ATOM 0 HE21 GLN A 13 14.087 -1.037 4.557 1.00 0.00 H new ATOM 0 HE22 GLN A 13 15.426 -2.156 4.278 1.00 0.00 H new ATOM 175 N CYS A 14 10.507 1.106 0.986 1.00 0.00 N ATOM 176 CA CYS A 14 9.234 0.778 0.354 1.00 0.00 C ATOM 177 C CYS A 14 8.955 1.708 -0.822 1.00 0.00 C ATOM 178 O CYS A 14 8.593 1.259 -1.909 1.00 0.00 O ATOM 179 CB CYS A 14 8.097 0.870 1.373 1.00 0.00 C ATOM 180 SG CYS A 14 6.450 0.646 0.662 1.00 0.00 S ATOM 0 H CYS A 14 10.488 1.092 2.006 1.00 0.00 H new ATOM 0 HA CYS A 14 9.295 -0.244 -0.021 1.00 0.00 H new ATOM 0 HB2 CYS A 14 8.253 0.117 2.145 1.00 0.00 H new ATOM 0 HB3 CYS A 14 8.140 1.843 1.863 1.00 0.00 H new ATOM 0 HG CYS A 14 5.556 0.739 1.601 1.00 0.00 H new ATOM 186 N ALA A 15 9.126 3.007 -0.597 1.00 0.00 N ATOM 187 CA ALA A 15 8.893 4.000 -1.638 1.00 0.00 C ATOM 188 C ALA A 15 9.405 3.510 -2.988 1.00 0.00 C ATOM 189 O ALA A 15 8.701 3.590 -3.994 1.00 0.00 O ATOM 190 CB ALA A 15 9.555 5.319 -1.267 1.00 0.00 C ATOM 0 H ALA A 15 9.425 3.396 0.297 1.00 0.00 H new ATOM 0 HA ALA A 15 7.818 4.157 -1.722 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.373 6.051 -2.053 1.00 0.00 H new ATOM 0 HB2 ALA A 15 9.139 5.684 -0.328 1.00 0.00 H new ATOM 0 HB3 ALA A 15 10.629 5.168 -1.153 1.00 0.00 H new ATOM 196 N GLN A 16 10.634 3.005 -3.002 1.00 0.00 N ATOM 197 CA GLN A 16 11.240 2.503 -4.230 1.00 0.00 C ATOM 198 C GLN A 16 10.343 1.464 -4.894 1.00 0.00 C ATOM 199 O GLN A 16 9.897 1.649 -6.027 1.00 0.00 O ATOM 200 CB GLN A 16 12.613 1.896 -3.935 1.00 0.00 C ATOM 201 CG GLN A 16 13.625 2.904 -3.415 1.00 0.00 C ATOM 202 CD GLN A 16 14.058 3.897 -4.476 1.00 0.00 C ATOM 203 OE1 GLN A 16 15.090 3.720 -5.124 1.00 0.00 O ATOM 204 NE2 GLN A 16 13.269 4.949 -4.661 1.00 0.00 N ATOM 0 H GLN A 16 11.230 2.932 -2.177 1.00 0.00 H new ATOM 0 HA GLN A 16 11.362 3.342 -4.915 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.498 1.098 -3.202 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.002 1.439 -4.845 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.194 3.444 -2.572 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.500 2.374 -3.040 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.423 5.056 -4.102 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.509 5.650 -5.362 1.00 0.00 H new ATOM 213 N TRP A 17 10.084 0.373 -4.184 1.00 0.00 N ATOM 214 CA TRP A 17 9.240 -0.696 -4.705 1.00 0.00 C ATOM 215 C TRP A 17 7.982 -0.129 -5.355 1.00 0.00 C ATOM 216 O TRP A 17 7.621 -0.510 -6.469 1.00 0.00 O ATOM 217 CB TRP A 17 8.858 -1.665 -3.585 1.00 0.00 C ATOM 218 CG TRP A 17 8.223 -2.928 -4.083 1.00 0.00 C ATOM 219 CD1 TRP A 17 8.817 -3.906 -4.829 1.00 0.00 C ATOM 220 CD2 TRP A 17 6.870 -3.348 -3.873 1.00 0.00 C ATOM 221 NE1 TRP A 17 7.915 -4.908 -5.095 1.00 0.00 N ATOM 222 CE2 TRP A 17 6.714 -4.590 -4.519 1.00 0.00 C ATOM 223 CE3 TRP A 17 5.776 -2.796 -3.200 1.00 0.00 C ATOM 224 CZ2 TRP A 17 5.508 -5.286 -4.511 1.00 0.00 C ATOM 225 CZ3 TRP A 17 4.580 -3.488 -3.194 1.00 0.00 C ATOM 226 CH2 TRP A 17 4.454 -4.723 -3.845 1.00 0.00 C ATOM 0 H TRP A 17 10.446 0.205 -3.245 1.00 0.00 H new ATOM 0 HA TRP A 17 9.807 -1.235 -5.464 1.00 0.00 H new ATOM 0 HB2 TRP A 17 9.750 -1.917 -3.012 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.171 -1.166 -2.902 1.00 0.00 H new ATOM 0 HD1 TRP A 17 9.845 -3.894 -5.161 1.00 0.00 H new ATOM 0 HE1 TRP A 17 8.109 -5.752 -5.634 1.00 0.00 H new ATOM 0 HE3 TRP A 17 5.864 -1.846 -2.694 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 5.408 -6.237 -5.013 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 3.728 -3.070 -2.679 1.00 0.00 H new ATOM 0 HH2 TRP A 17 3.506 -5.240 -3.820 1.00 0.00 H new ATOM 237 N LEU A 18 7.319 0.782 -4.652 1.00 0.00 N ATOM 238 CA LEU A 18 6.100 1.402 -5.162 1.00 0.00 C ATOM 239 C LEU A 18 6.332 2.006 -6.543 1.00 0.00 C ATOM 240 O LEU A 18 5.583 1.737 -7.482 1.00 0.00 O ATOM 241 CB LEU A 18 5.613 2.483 -4.196 1.00 0.00 C ATOM 242 CG LEU A 18 5.064 1.989 -2.857 1.00 0.00 C ATOM 243 CD1 LEU A 18 5.197 3.069 -1.794 1.00 0.00 C ATOM 244 CD2 LEU A 18 3.611 1.559 -3.002 1.00 0.00 C ATOM 0 H LEU A 18 7.604 1.108 -3.728 1.00 0.00 H new ATOM 0 HA LEU A 18 5.337 0.628 -5.248 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.440 3.164 -3.998 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.835 3.063 -4.693 1.00 0.00 H new ATOM 0 HG LEU A 18 5.649 1.124 -2.544 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.801 2.699 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.248 3.330 -1.670 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.637 3.953 -2.101 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.237 1.210 -2.039 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.013 2.406 -3.339 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.541 0.752 -3.732 1.00 0.00 H new ATOM 256 N ILE A 19 7.376 2.820 -6.659 1.00 0.00 N ATOM 257 CA ILE A 19 7.709 3.458 -7.927 1.00 0.00 C ATOM 258 C ILE A 19 7.892 2.424 -9.032 1.00 0.00 C ATOM 259 O ILE A 19 7.447 2.622 -10.163 1.00 0.00 O ATOM 260 CB ILE A 19 8.991 4.303 -7.812 1.00 0.00 C ATOM 261 CG1 ILE A 19 8.851 5.332 -6.689 1.00 0.00 C ATOM 262 CG2 ILE A 19 9.291 4.992 -9.135 1.00 0.00 C ATOM 263 CD1 ILE A 19 10.155 6.003 -6.317 1.00 0.00 C ATOM 0 H ILE A 19 8.005 3.053 -5.891 1.00 0.00 H new ATOM 0 HA ILE A 19 6.874 4.112 -8.180 1.00 0.00 H new ATOM 0 HB ILE A 19 9.824 3.642 -7.571 1.00 0.00 H new ATOM 0 HG12 ILE A 19 8.134 6.094 -6.993 1.00 0.00 H new ATOM 0 HG13 ILE A 19 8.440 4.841 -5.807 1.00 0.00 H new ATOM 0 HG21 ILE A 19 10.200 5.586 -9.038 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.429 4.241 -9.913 1.00 0.00 H new ATOM 0 HG23 ILE A 19 8.459 5.643 -9.403 1.00 0.00 H new ATOM 0 HD11 ILE A 19 9.979 6.720 -5.515 1.00 0.00 H new ATOM 0 HD12 ILE A 19 10.869 5.250 -5.982 1.00 0.00 H new ATOM 0 HD13 ILE A 19 10.558 6.523 -7.186 1.00 0.00 H new ATOM 275 N HIS A 20 8.549 1.317 -8.697 1.00 0.00 N ATOM 276 CA HIS A 20 8.789 0.249 -9.660 1.00 0.00 C ATOM 277 C HIS A 20 7.511 -0.542 -9.924 1.00 0.00 C ATOM 278 O HIS A 20 7.313 -1.073 -11.018 1.00 0.00 O ATOM 279 CB HIS A 20 9.887 -0.687 -9.153 1.00 0.00 C ATOM 280 CG HIS A 20 11.272 -0.166 -9.384 1.00 0.00 C ATOM 281 ND1 HIS A 20 12.052 -0.551 -10.453 1.00 0.00 N ATOM 282 CD2 HIS A 20 12.015 0.717 -8.677 1.00 0.00 C ATOM 283 CE1 HIS A 20 13.216 0.071 -10.393 1.00 0.00 C ATOM 284 NE2 HIS A 20 13.219 0.847 -9.324 1.00 0.00 N ATOM 0 H HIS A 20 8.924 1.137 -7.766 1.00 0.00 H new ATOM 0 HA HIS A 20 9.114 0.704 -10.596 1.00 0.00 H new ATOM 0 HB2 HIS A 20 9.745 -0.856 -8.086 1.00 0.00 H new ATOM 0 HB3 HIS A 20 9.785 -1.654 -9.645 1.00 0.00 H new ATOM 0 HD2 HIS A 20 11.716 1.225 -7.772 1.00 0.00 H new ATOM 0 HE1 HIS A 20 14.027 -0.037 -11.098 1.00 0.00 H new ATOM 0 HE2 HIS A 20 13.990 1.445 -9.028 1.00 0.00 H new ATOM 293 N CYS A 21 6.649 -0.617 -8.916 1.00 0.00 N ATOM 294 CA CYS A 21 5.391 -1.345 -9.039 1.00 0.00 C ATOM 295 C CYS A 21 4.423 -0.606 -9.957 1.00 0.00 C ATOM 296 O CYS A 21 3.300 -1.057 -10.185 1.00 0.00 O ATOM 297 CB CYS A 21 4.757 -1.544 -7.662 1.00 0.00 C ATOM 298 SG CYS A 21 5.664 -2.682 -6.588 1.00 0.00 S ATOM 0 H CYS A 21 6.798 -0.183 -8.005 1.00 0.00 H new ATOM 0 HA CYS A 21 5.605 -2.320 -9.477 1.00 0.00 H new ATOM 0 HB2 CYS A 21 4.681 -0.576 -7.166 1.00 0.00 H new ATOM 0 HB3 CYS A 21 3.741 -1.916 -7.792 1.00 0.00 H new ATOM 0 HG CYS A 21 5.698 -2.204 -5.379 1.00 0.00 H new ATOM 304 N LYS A 22 4.864 0.533 -10.479 1.00 0.00 N ATOM 305 CA LYS A 22 4.037 1.336 -11.372 1.00 0.00 C ATOM 306 C LYS A 22 2.847 1.930 -10.625 1.00 0.00 C ATOM 307 O LYS A 22 1.708 1.844 -11.083 1.00 0.00 O ATOM 308 CB LYS A 22 3.544 0.487 -12.546 1.00 0.00 C ATOM 309 CG LYS A 22 4.653 -0.262 -13.263 1.00 0.00 C ATOM 310 CD LYS A 22 5.525 0.678 -14.078 1.00 0.00 C ATOM 311 CE LYS A 22 6.306 -0.071 -15.147 1.00 0.00 C ATOM 312 NZ LYS A 22 6.858 0.850 -16.178 1.00 0.00 N ATOM 0 H LYS A 22 5.790 0.921 -10.299 1.00 0.00 H new ATOM 0 HA LYS A 22 4.648 2.154 -11.755 1.00 0.00 H new ATOM 0 HB2 LYS A 22 2.809 -0.231 -12.181 1.00 0.00 H new ATOM 0 HB3 LYS A 22 3.032 1.132 -13.260 1.00 0.00 H new ATOM 0 HG2 LYS A 22 5.268 -0.789 -12.533 1.00 0.00 H new ATOM 0 HG3 LYS A 22 4.219 -1.017 -13.919 1.00 0.00 H new ATOM 0 HD2 LYS A 22 4.901 1.439 -14.548 1.00 0.00 H new ATOM 0 HD3 LYS A 22 6.218 1.198 -13.417 1.00 0.00 H new ATOM 0 HE2 LYS A 22 7.121 -0.624 -14.681 1.00 0.00 H new ATOM 0 HE3 LYS A 22 5.656 -0.804 -15.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 7.383 0.301 -16.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 6.079 1.360 -16.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 7.498 1.533 -15.726 1.00 0.00 H new ATOM 326 N VAL A 23 3.119 2.533 -9.472 1.00 0.00 N ATOM 327 CA VAL A 23 2.071 3.144 -8.663 1.00 0.00 C ATOM 328 C VAL A 23 2.416 4.588 -8.316 1.00 0.00 C ATOM 329 O VAL A 23 1.529 5.425 -8.144 1.00 0.00 O ATOM 330 CB VAL A 23 1.838 2.356 -7.360 1.00 0.00 C ATOM 331 CG1 VAL A 23 1.389 0.935 -7.668 1.00 0.00 C ATOM 332 CG2 VAL A 23 3.097 2.353 -6.507 1.00 0.00 C ATOM 0 H VAL A 23 4.056 2.611 -9.077 1.00 0.00 H new ATOM 0 HA VAL A 23 1.159 3.125 -9.259 1.00 0.00 H new ATOM 0 HB VAL A 23 1.046 2.847 -6.795 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.229 0.394 -6.735 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.459 0.962 -8.236 1.00 0.00 H new ATOM 0 HG13 VAL A 23 2.157 0.430 -8.254 1.00 0.00 H new ATOM 0 HG21 VAL A 23 2.914 1.792 -5.591 1.00 0.00 H new ATOM 0 HG22 VAL A 23 3.911 1.887 -7.062 1.00 0.00 H new ATOM 0 HG23 VAL A 23 3.369 3.378 -6.257 1.00 0.00 H new ATOM 342 N LEU A 24 3.709 4.873 -8.214 1.00 0.00 N ATOM 343 CA LEU A 24 4.172 6.218 -7.888 1.00 0.00 C ATOM 344 C LEU A 24 5.266 6.666 -8.852 1.00 0.00 C ATOM 345 O LEU A 24 6.065 5.865 -9.338 1.00 0.00 O ATOM 346 CB LEU A 24 4.692 6.264 -6.450 1.00 0.00 C ATOM 347 CG LEU A 24 3.665 5.976 -5.355 1.00 0.00 C ATOM 348 CD1 LEU A 24 4.349 5.846 -4.003 1.00 0.00 C ATOM 349 CD2 LEU A 24 2.606 7.068 -5.316 1.00 0.00 C ATOM 0 H LEU A 24 4.455 4.192 -8.352 1.00 0.00 H new ATOM 0 HA LEU A 24 3.328 6.900 -7.985 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.505 5.544 -6.356 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.118 7.251 -6.270 1.00 0.00 H new ATOM 0 HG LEU A 24 3.174 5.030 -5.584 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.602 5.641 -3.236 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.069 5.028 -4.037 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.867 6.776 -3.766 1.00 0.00 H new ATOM 0 HD21 LEU A 24 1.883 6.846 -4.531 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.080 8.028 -5.112 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.094 7.113 -6.277 1.00 0.00 H new ATOM 361 N PRO A 25 5.307 7.976 -9.134 1.00 0.00 N ATOM 362 CA PRO A 25 6.300 8.561 -10.039 1.00 0.00 C ATOM 363 C PRO A 25 7.705 8.545 -9.446 1.00 0.00 C ATOM 364 O PRO A 25 7.876 8.496 -8.227 1.00 0.00 O ATOM 365 CB PRO A 25 5.812 10.000 -10.220 1.00 0.00 C ATOM 366 CG PRO A 25 5.024 10.290 -8.990 1.00 0.00 C ATOM 367 CD PRO A 25 4.386 8.988 -8.591 1.00 0.00 C ATOM 0 HA PRO A 25 6.379 8.003 -10.972 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.648 10.691 -10.327 1.00 0.00 H new ATOM 0 HB3 PRO A 25 5.199 10.101 -11.116 1.00 0.00 H new ATOM 0 HG2 PRO A 25 5.666 10.670 -8.195 1.00 0.00 H new ATOM 0 HG3 PRO A 25 4.269 11.052 -9.181 1.00 0.00 H new ATOM 0 HD2 PRO A 25 4.289 8.903 -7.509 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.385 8.886 -9.010 1.00 0.00 H new ATOM 375 N THR A 26 8.710 8.588 -10.315 1.00 0.00 N ATOM 376 CA THR A 26 10.100 8.579 -9.877 1.00 0.00 C ATOM 377 C THR A 26 10.445 9.852 -9.112 1.00 0.00 C ATOM 378 O THR A 26 11.314 9.848 -8.242 1.00 0.00 O ATOM 379 CB THR A 26 11.064 8.434 -11.070 1.00 0.00 C ATOM 380 OG1 THR A 26 11.023 9.614 -11.879 1.00 0.00 O ATOM 381 CG2 THR A 26 10.702 7.221 -11.914 1.00 0.00 C ATOM 0 H THR A 26 8.587 8.629 -11.327 1.00 0.00 H new ATOM 0 HA THR A 26 10.217 7.719 -9.217 1.00 0.00 H new ATOM 0 HB THR A 26 12.072 8.297 -10.679 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.640 9.515 -12.634 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.396 7.139 -12.750 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.763 6.321 -11.302 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.687 7.333 -12.295 1.00 0.00 H new ATOM 389 N ASN A 27 9.756 10.939 -9.442 1.00 0.00 N ATOM 390 CA ASN A 27 9.989 12.220 -8.785 1.00 0.00 C ATOM 391 C ASN A 27 8.854 12.552 -7.820 1.00 0.00 C ATOM 392 O ASN A 27 8.639 13.714 -7.474 1.00 0.00 O ATOM 393 CB ASN A 27 10.130 13.333 -9.826 1.00 0.00 C ATOM 394 CG ASN A 27 11.453 13.269 -10.565 1.00 0.00 C ATOM 395 OD1 ASN A 27 11.488 13.228 -11.795 1.00 0.00 O ATOM 396 ND2 ASN A 27 12.549 13.259 -9.815 1.00 0.00 N ATOM 0 H ASN A 27 9.032 10.959 -10.160 1.00 0.00 H new ATOM 0 HA ASN A 27 10.915 12.144 -8.216 1.00 0.00 H new ATOM 0 HB2 ASN A 27 9.312 13.262 -10.543 1.00 0.00 H new ATOM 0 HB3 ASN A 27 10.038 14.301 -9.334 1.00 0.00 H new ATOM 0 HD21 ASN A 27 13.468 13.216 -10.255 1.00 0.00 H new ATOM 0 HD22 ASN A 27 12.472 13.294 -8.799 1.00 0.00 H new ATOM 403 N HIS A 28 8.132 11.523 -7.389 1.00 0.00 N ATOM 404 CA HIS A 28 7.019 11.704 -6.463 1.00 0.00 C ATOM 405 C HIS A 28 7.437 12.564 -5.274 1.00 0.00 C ATOM 406 O HIS A 28 8.601 12.946 -5.151 1.00 0.00 O ATOM 407 CB HIS A 28 6.510 10.348 -5.973 1.00 0.00 C ATOM 408 CG HIS A 28 5.069 10.362 -5.566 1.00 0.00 C ATOM 409 ND1 HIS A 28 4.600 9.724 -4.437 1.00 0.00 N ATOM 410 CD2 HIS A 28 3.991 10.942 -6.143 1.00 0.00 C ATOM 411 CE1 HIS A 28 3.295 9.910 -4.339 1.00 0.00 C ATOM 412 NE2 HIS A 28 2.901 10.647 -5.362 1.00 0.00 N ATOM 0 H HIS A 28 8.297 10.555 -7.666 1.00 0.00 H new ATOM 0 HA HIS A 28 6.216 12.215 -6.994 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.649 9.610 -6.763 1.00 0.00 H new ATOM 0 HB3 HIS A 28 7.115 10.026 -5.126 1.00 0.00 H new ATOM 0 HD2 HIS A 28 3.989 11.528 -7.050 1.00 0.00 H new ATOM 0 HE1 HIS A 28 2.659 9.525 -3.556 1.00 0.00 H new ATOM 0 HE2 HIS A 28 1.943 10.948 -5.542 1.00 0.00 H new ATOM 421 N ARG A 29 6.480 12.865 -4.403 1.00 0.00 N ATOM 422 CA ARG A 29 6.748 13.681 -3.225 1.00 0.00 C ATOM 423 C ARG A 29 7.221 12.816 -2.060 1.00 0.00 C ATOM 424 O ARG A 29 7.862 13.305 -1.130 1.00 0.00 O ATOM 425 CB ARG A 29 5.494 14.459 -2.821 1.00 0.00 C ATOM 426 CG ARG A 29 4.302 13.571 -2.505 1.00 0.00 C ATOM 427 CD ARG A 29 3.163 14.366 -1.887 1.00 0.00 C ATOM 428 NE ARG A 29 2.055 13.508 -1.478 1.00 0.00 N ATOM 429 CZ ARG A 29 0.891 13.971 -1.036 1.00 0.00 C ATOM 430 NH1 ARG A 29 0.684 15.278 -0.948 1.00 0.00 N ATOM 431 NH2 ARG A 29 -0.070 13.127 -0.683 1.00 0.00 N ATOM 0 H ARG A 29 5.512 12.556 -4.491 1.00 0.00 H new ATOM 0 HA ARG A 29 7.540 14.387 -3.476 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.722 15.071 -1.948 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.224 15.141 -3.627 1.00 0.00 H new ATOM 0 HG2 ARG A 29 3.956 13.087 -3.418 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.608 12.780 -1.821 1.00 0.00 H new ATOM 0 HD2 ARG A 29 3.533 14.917 -1.022 1.00 0.00 H new ATOM 0 HD3 ARG A 29 2.804 15.103 -2.605 1.00 0.00 H new ATOM 0 HE ARG A 29 2.182 12.497 -1.535 1.00 0.00 H new ATOM 0 HH11 ARG A 29 1.419 15.930 -1.220 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.211 15.631 -0.608 1.00 0.00 H new ATOM 0 HH21 ARG A 29 0.084 12.121 -0.751 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -0.963 13.484 -0.344 1.00 0.00 H new ATOM 445 N VAL A 30 6.899 11.528 -2.118 1.00 0.00 N ATOM 446 CA VAL A 30 7.290 10.594 -1.068 1.00 0.00 C ATOM 447 C VAL A 30 8.787 10.306 -1.119 1.00 0.00 C ATOM 448 O VAL A 30 9.386 9.894 -0.125 1.00 0.00 O ATOM 449 CB VAL A 30 6.519 9.266 -1.182 1.00 0.00 C ATOM 450 CG1 VAL A 30 5.020 9.520 -1.221 1.00 0.00 C ATOM 451 CG2 VAL A 30 6.969 8.493 -2.413 1.00 0.00 C ATOM 0 H VAL A 30 6.368 11.107 -2.881 1.00 0.00 H new ATOM 0 HA VAL A 30 7.045 11.067 -0.117 1.00 0.00 H new ATOM 0 HB VAL A 30 6.738 8.662 -0.301 1.00 0.00 H new ATOM 0 HG11 VAL A 30 4.492 8.570 -1.302 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.713 10.029 -0.307 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.779 10.143 -2.082 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.414 7.557 -2.478 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.781 9.089 -3.306 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.035 8.278 -2.338 1.00 0.00 H new ATOM 461 N THR A 31 9.387 10.526 -2.285 1.00 0.00 N ATOM 462 CA THR A 31 10.813 10.289 -2.467 1.00 0.00 C ATOM 463 C THR A 31 11.639 11.419 -1.862 1.00 0.00 C ATOM 464 O THR A 31 12.843 11.275 -1.650 1.00 0.00 O ATOM 465 CB THR A 31 11.174 10.147 -3.958 1.00 0.00 C ATOM 466 OG1 THR A 31 11.059 11.415 -4.613 1.00 0.00 O ATOM 467 CG2 THR A 31 10.266 9.135 -4.640 1.00 0.00 C ATOM 0 H THR A 31 8.907 10.868 -3.117 1.00 0.00 H new ATOM 0 HA THR A 31 11.046 9.356 -1.954 1.00 0.00 H new ATOM 0 HB THR A 31 12.203 9.794 -4.028 1.00 0.00 H new ATOM 0 HG1 THR A 31 10.116 11.679 -4.651 1.00 0.00 H new ATOM 0 HG21 THR A 31 10.540 9.052 -5.692 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.377 8.164 -4.158 1.00 0.00 H new ATOM 0 HG23 THR A 31 9.230 9.464 -4.560 1.00 0.00 H new ATOM 475 N TRP A 32 10.985 12.541 -1.586 1.00 0.00 N ATOM 476 CA TRP A 32 11.660 13.696 -1.004 1.00 0.00 C ATOM 477 C TRP A 32 12.108 13.402 0.423 1.00 0.00 C ATOM 478 O TRP A 32 11.321 12.937 1.248 1.00 0.00 O ATOM 479 CB TRP A 32 10.736 14.914 -1.021 1.00 0.00 C ATOM 480 CG TRP A 32 10.441 15.417 -2.401 1.00 0.00 C ATOM 481 CD1 TRP A 32 10.039 14.676 -3.475 1.00 0.00 C ATOM 482 CD2 TRP A 32 10.529 16.772 -2.857 1.00 0.00 C ATOM 483 NE1 TRP A 32 9.870 15.488 -4.571 1.00 0.00 N ATOM 484 CE2 TRP A 32 10.164 16.779 -4.217 1.00 0.00 C ATOM 485 CE3 TRP A 32 10.878 17.980 -2.247 1.00 0.00 C ATOM 486 CZ2 TRP A 32 10.140 17.946 -4.975 1.00 0.00 C ATOM 487 CZ3 TRP A 32 10.854 19.138 -3.001 1.00 0.00 C ATOM 488 CH2 TRP A 32 10.486 19.115 -4.353 1.00 0.00 C ATOM 0 H TRP A 32 9.988 12.676 -1.756 1.00 0.00 H new ATOM 0 HA TRP A 32 12.543 13.911 -1.605 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.799 14.657 -0.528 1.00 0.00 H new ATOM 0 HB3 TRP A 32 11.192 15.715 -0.440 1.00 0.00 H new ATOM 0 HD1 TRP A 32 9.877 13.608 -3.465 1.00 0.00 H new ATOM 0 HE1 TRP A 32 9.574 15.180 -5.497 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.161 18.008 -1.205 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 9.858 17.930 -6.017 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 11.124 20.077 -2.540 1.00 0.00 H new ATOM 0 HH2 TRP A 32 10.475 20.037 -4.915 1.00 0.00 H new ATOM 499 N ASP A 33 13.377 13.675 0.709 1.00 0.00 N ATOM 500 CA ASP A 33 13.929 13.441 2.038 1.00 0.00 C ATOM 501 C ASP A 33 13.070 14.107 3.108 1.00 0.00 C ATOM 502 O ASP A 33 13.063 13.684 4.264 1.00 0.00 O ATOM 503 CB ASP A 33 15.363 13.966 2.117 1.00 0.00 C ATOM 504 CG ASP A 33 16.335 13.120 1.318 1.00 0.00 C ATOM 505 OD1 ASP A 33 16.487 11.925 1.644 1.00 0.00 O ATOM 506 OD2 ASP A 33 16.944 13.654 0.367 1.00 0.00 O ATOM 0 H ASP A 33 14.042 14.059 0.038 1.00 0.00 H new ATOM 0 HA ASP A 33 13.934 12.366 2.219 1.00 0.00 H new ATOM 0 HB2 ASP A 33 15.392 14.992 1.750 1.00 0.00 H new ATOM 0 HB3 ASP A 33 15.680 13.992 3.159 1.00 0.00 H new ATOM 511 N SER A 34 12.348 15.151 2.715 1.00 0.00 N ATOM 512 CA SER A 34 11.489 15.879 3.642 1.00 0.00 C ATOM 513 C SER A 34 10.244 15.065 3.983 1.00 0.00 C ATOM 514 O SER A 34 9.750 15.107 5.109 1.00 0.00 O ATOM 515 CB SER A 34 11.082 17.226 3.043 1.00 0.00 C ATOM 516 OG SER A 34 12.144 18.162 3.124 1.00 0.00 O ATOM 0 H SER A 34 12.341 15.512 1.761 1.00 0.00 H new ATOM 0 HA SER A 34 12.052 16.052 4.559 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.791 17.091 2.001 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.210 17.614 3.570 1.00 0.00 H new ATOM 0 HG SER A 34 11.859 19.014 2.733 1.00 0.00 H new ATOM 522 N ALA A 35 9.743 14.323 3.000 1.00 0.00 N ATOM 523 CA ALA A 35 8.557 13.497 3.195 1.00 0.00 C ATOM 524 C ALA A 35 8.663 12.680 4.478 1.00 0.00 C ATOM 525 O ALA A 35 9.738 12.568 5.066 1.00 0.00 O ATOM 526 CB ALA A 35 8.350 12.581 1.998 1.00 0.00 C ATOM 0 H ALA A 35 10.140 14.277 2.061 1.00 0.00 H new ATOM 0 HA ALA A 35 7.694 14.157 3.286 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.461 11.970 2.157 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.221 13.182 1.098 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.219 11.934 1.881 1.00 0.00 H new ATOM 532 N GLN A 36 7.540 12.112 4.906 1.00 0.00 N ATOM 533 CA GLN A 36 7.507 11.306 6.121 1.00 0.00 C ATOM 534 C GLN A 36 6.533 10.141 5.975 1.00 0.00 C ATOM 535 O GLN A 36 5.652 10.159 5.115 1.00 0.00 O ATOM 536 CB GLN A 36 7.112 12.169 7.320 1.00 0.00 C ATOM 537 CG GLN A 36 8.089 13.298 7.606 1.00 0.00 C ATOM 538 CD GLN A 36 7.493 14.377 8.488 1.00 0.00 C ATOM 539 OE1 GLN A 36 6.665 14.098 9.356 1.00 0.00 O ATOM 540 NE2 GLN A 36 7.913 15.618 8.272 1.00 0.00 N ATOM 0 H GLN A 36 6.642 12.195 4.430 1.00 0.00 H new ATOM 0 HA GLN A 36 8.506 10.902 6.286 1.00 0.00 H new ATOM 0 HB2 GLN A 36 6.123 12.592 7.143 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.034 11.535 8.203 1.00 0.00 H new ATOM 0 HG2 GLN A 36 8.978 12.891 8.088 1.00 0.00 H new ATOM 0 HG3 GLN A 36 8.412 13.741 6.664 1.00 0.00 H new ATOM 0 HE21 GLN A 36 8.601 15.804 7.542 1.00 0.00 H new ATOM 0 HE22 GLN A 36 7.548 16.385 8.836 1.00 0.00 H new ATOM 549 N VAL A 37 6.699 9.129 6.820 1.00 0.00 N ATOM 550 CA VAL A 37 5.834 7.955 6.786 1.00 0.00 C ATOM 551 C VAL A 37 4.389 8.345 6.495 1.00 0.00 C ATOM 552 O VAL A 37 3.679 7.644 5.774 1.00 0.00 O ATOM 553 CB VAL A 37 5.887 7.180 8.116 1.00 0.00 C ATOM 554 CG1 VAL A 37 7.160 6.352 8.202 1.00 0.00 C ATOM 555 CG2 VAL A 37 5.783 8.137 9.294 1.00 0.00 C ATOM 0 H VAL A 37 7.424 9.098 7.537 1.00 0.00 H new ATOM 0 HA VAL A 37 6.202 7.314 5.985 1.00 0.00 H new ATOM 0 HB VAL A 37 5.037 6.499 8.154 1.00 0.00 H new ATOM 0 HG11 VAL A 37 7.179 5.812 9.148 1.00 0.00 H new ATOM 0 HG12 VAL A 37 7.187 5.640 7.377 1.00 0.00 H new ATOM 0 HG13 VAL A 37 8.027 7.010 8.142 1.00 0.00 H new ATOM 0 HG21 VAL A 37 5.822 7.573 10.226 1.00 0.00 H new ATOM 0 HG22 VAL A 37 6.612 8.844 9.263 1.00 0.00 H new ATOM 0 HG23 VAL A 37 4.840 8.681 9.239 1.00 0.00 H new ATOM 565 N PHE A 38 3.960 9.469 7.059 1.00 0.00 N ATOM 566 CA PHE A 38 2.599 9.953 6.860 1.00 0.00 C ATOM 567 C PHE A 38 2.327 10.220 5.382 1.00 0.00 C ATOM 568 O PHE A 38 1.403 9.655 4.798 1.00 0.00 O ATOM 569 CB PHE A 38 2.365 11.229 7.672 1.00 0.00 C ATOM 570 CG PHE A 38 0.939 11.411 8.105 1.00 0.00 C ATOM 571 CD1 PHE A 38 -0.098 10.855 7.372 1.00 0.00 C ATOM 572 CD2 PHE A 38 0.634 12.137 9.245 1.00 0.00 C ATOM 573 CE1 PHE A 38 -1.411 11.022 7.768 1.00 0.00 C ATOM 574 CE2 PHE A 38 -0.678 12.306 9.646 1.00 0.00 C ATOM 575 CZ PHE A 38 -1.702 11.747 8.907 1.00 0.00 C ATOM 0 H PHE A 38 4.535 10.062 7.657 1.00 0.00 H new ATOM 0 HA PHE A 38 1.911 9.180 7.204 1.00 0.00 H new ATOM 0 HB2 PHE A 38 3.005 11.211 8.554 1.00 0.00 H new ATOM 0 HB3 PHE A 38 2.668 12.090 7.076 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.123 10.285 6.482 1.00 0.00 H new ATOM 0 HD2 PHE A 38 1.431 12.576 9.827 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -2.210 10.586 7.187 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -0.902 12.875 10.536 1.00 0.00 H new ATOM 0 HZ PHE A 38 -2.728 11.876 9.219 1.00 0.00 H new ATOM 585 N ASP A 39 3.139 11.086 4.785 1.00 0.00 N ATOM 586 CA ASP A 39 2.988 11.428 3.376 1.00 0.00 C ATOM 587 C ASP A 39 2.659 10.190 2.548 1.00 0.00 C ATOM 588 O ASP A 39 1.627 10.134 1.878 1.00 0.00 O ATOM 589 CB ASP A 39 4.264 12.085 2.848 1.00 0.00 C ATOM 590 CG ASP A 39 4.286 13.582 3.087 1.00 0.00 C ATOM 591 OD1 ASP A 39 3.657 14.318 2.298 1.00 0.00 O ATOM 592 OD2 ASP A 39 4.931 14.018 4.063 1.00 0.00 O ATOM 0 H ASP A 39 3.908 11.564 5.255 1.00 0.00 H new ATOM 0 HA ASP A 39 2.162 12.133 3.286 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.129 11.630 3.330 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.355 11.889 1.780 1.00 0.00 H new ATOM 597 N LEU A 40 3.543 9.200 2.597 1.00 0.00 N ATOM 598 CA LEU A 40 3.348 7.961 1.851 1.00 0.00 C ATOM 599 C LEU A 40 2.144 7.190 2.381 1.00 0.00 C ATOM 600 O LEU A 40 1.506 6.435 1.649 1.00 0.00 O ATOM 601 CB LEU A 40 4.603 7.090 1.932 1.00 0.00 C ATOM 602 CG LEU A 40 4.479 5.680 1.355 1.00 0.00 C ATOM 603 CD1 LEU A 40 4.278 5.736 -0.152 1.00 0.00 C ATOM 604 CD2 LEU A 40 5.709 4.853 1.700 1.00 0.00 C ATOM 0 H LEU A 40 4.402 9.231 3.146 1.00 0.00 H new ATOM 0 HA LEU A 40 3.160 8.219 0.809 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.412 7.604 1.412 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.897 7.008 2.978 1.00 0.00 H new ATOM 0 HG LEU A 40 3.607 5.201 1.800 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.192 4.723 -0.545 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.368 6.292 -0.377 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.130 6.234 -0.615 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.604 3.852 1.281 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.596 5.329 1.283 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.809 4.784 2.783 1.00 0.00 H new ATOM 616 N ALA A 41 1.838 7.387 3.660 1.00 0.00 N ATOM 617 CA ALA A 41 0.708 6.713 4.287 1.00 0.00 C ATOM 618 C ALA A 41 -0.610 7.371 3.896 1.00 0.00 C ATOM 619 O ALA A 41 -1.669 6.747 3.960 1.00 0.00 O ATOM 620 CB ALA A 41 0.870 6.710 5.800 1.00 0.00 C ATOM 0 H ALA A 41 2.357 8.008 4.281 1.00 0.00 H new ATOM 0 HA ALA A 41 0.688 5.683 3.932 1.00 0.00 H new ATOM 0 HB1 ALA A 41 0.019 6.204 6.256 1.00 0.00 H new ATOM 0 HB2 ALA A 41 1.789 6.188 6.067 1.00 0.00 H new ATOM 0 HB3 ALA A 41 0.918 7.737 6.163 1.00 0.00 H new ATOM 626 N GLN A 42 -0.538 8.635 3.491 1.00 0.00 N ATOM 627 CA GLN A 42 -1.727 9.378 3.090 1.00 0.00 C ATOM 628 C GLN A 42 -2.192 8.952 1.701 1.00 0.00 C ATOM 629 O GLN A 42 -3.361 8.620 1.500 1.00 0.00 O ATOM 630 CB GLN A 42 -1.446 10.881 3.109 1.00 0.00 C ATOM 631 CG GLN A 42 -1.085 11.415 4.485 1.00 0.00 C ATOM 632 CD GLN A 42 -1.491 12.863 4.674 1.00 0.00 C ATOM 633 OE1 GLN A 42 -2.552 13.288 4.215 1.00 0.00 O ATOM 634 NE2 GLN A 42 -0.647 13.631 5.354 1.00 0.00 N ATOM 0 H GLN A 42 0.331 9.166 3.432 1.00 0.00 H new ATOM 0 HA GLN A 42 -2.521 9.156 3.803 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -0.631 11.099 2.419 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -2.325 11.411 2.742 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -1.569 10.804 5.246 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -0.010 11.320 4.637 1.00 0.00 H new ATOM 0 HE21 GLN A 42 0.221 13.238 5.717 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -0.867 14.614 5.513 1.00 0.00 H new ATOM 643 N THR A 43 -1.270 8.965 0.744 1.00 0.00 N ATOM 644 CA THR A 43 -1.586 8.583 -0.627 1.00 0.00 C ATOM 645 C THR A 43 -2.233 7.204 -0.677 1.00 0.00 C ATOM 646 O THR A 43 -2.972 6.888 -1.610 1.00 0.00 O ATOM 647 CB THR A 43 -0.326 8.579 -1.513 1.00 0.00 C ATOM 648 OG1 THR A 43 -0.696 8.697 -2.891 1.00 0.00 O ATOM 649 CG2 THR A 43 0.478 7.304 -1.306 1.00 0.00 C ATOM 0 H THR A 43 -0.298 9.236 0.893 1.00 0.00 H new ATOM 0 HA THR A 43 -2.287 9.325 -1.009 1.00 0.00 H new ATOM 0 HB THR A 43 0.293 9.430 -1.229 1.00 0.00 H new ATOM 0 HG1 THR A 43 0.111 8.695 -3.448 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.363 7.324 -1.942 1.00 0.00 H new ATOM 0 HG22 THR A 43 0.783 7.232 -0.262 1.00 0.00 H new ATOM 0 HG23 THR A 43 -0.135 6.441 -1.565 1.00 0.00 H new ATOM 657 N LEU A 44 -1.951 6.386 0.331 1.00 0.00 N ATOM 658 CA LEU A 44 -2.507 5.039 0.402 1.00 0.00 C ATOM 659 C LEU A 44 -3.660 4.977 1.399 1.00 0.00 C ATOM 660 O LEU A 44 -4.475 4.055 1.365 1.00 0.00 O ATOM 661 CB LEU A 44 -1.421 4.038 0.798 1.00 0.00 C ATOM 662 CG LEU A 44 -0.101 4.142 0.034 1.00 0.00 C ATOM 663 CD1 LEU A 44 1.022 3.478 0.816 1.00 0.00 C ATOM 664 CD2 LEU A 44 -0.233 3.518 -1.347 1.00 0.00 C ATOM 0 H LEU A 44 -1.341 6.632 1.110 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.890 4.779 -0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.213 4.160 1.861 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -1.817 3.031 0.664 1.00 0.00 H new ATOM 0 HG LEU A 44 0.143 5.197 -0.088 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.954 3.562 0.257 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.133 3.970 1.782 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.785 2.425 0.970 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.716 3.601 -1.876 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.502 2.466 -1.247 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.008 4.039 -1.909 1.00 0.00 H new ATOM 676 N ARG A 45 -3.724 5.967 2.284 1.00 0.00 N ATOM 677 CA ARG A 45 -4.777 6.026 3.290 1.00 0.00 C ATOM 678 C ARG A 45 -6.155 5.981 2.637 1.00 0.00 C ATOM 679 O ARG A 45 -7.071 5.331 3.140 1.00 0.00 O ATOM 680 CB ARG A 45 -4.640 7.297 4.129 1.00 0.00 C ATOM 681 CG ARG A 45 -5.753 7.477 5.149 1.00 0.00 C ATOM 682 CD ARG A 45 -6.021 8.948 5.427 1.00 0.00 C ATOM 683 NE ARG A 45 -7.178 9.138 6.297 1.00 0.00 N ATOM 684 CZ ARG A 45 -7.519 10.310 6.821 1.00 0.00 C ATOM 685 NH1 ARG A 45 -6.794 11.391 6.564 1.00 0.00 N ATOM 686 NH2 ARG A 45 -8.586 10.404 7.604 1.00 0.00 N ATOM 0 H ARG A 45 -3.059 6.739 2.324 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.673 5.157 3.940 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.682 7.278 4.649 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.625 8.161 3.464 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -6.664 7.003 4.783 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.482 6.974 6.077 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -5.142 9.396 5.890 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -6.186 9.471 4.485 1.00 0.00 H new ATOM 0 HE ARG A 45 -7.756 8.326 6.514 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -5.973 11.323 5.963 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -7.058 12.290 6.968 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.146 9.575 7.805 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -8.846 11.305 8.005 1.00 0.00 H new ATOM 700 N ASP A 46 -6.295 6.677 1.514 1.00 0.00 N ATOM 701 CA ASP A 46 -7.561 6.717 0.791 1.00 0.00 C ATOM 702 C ASP A 46 -7.734 5.471 -0.071 1.00 0.00 C ATOM 703 O ASP A 46 -8.591 5.427 -0.953 1.00 0.00 O ATOM 704 CB ASP A 46 -7.635 7.971 -0.082 1.00 0.00 C ATOM 705 CG ASP A 46 -7.835 9.233 0.734 1.00 0.00 C ATOM 706 OD1 ASP A 46 -8.847 9.316 1.460 1.00 0.00 O ATOM 707 OD2 ASP A 46 -6.979 10.139 0.645 1.00 0.00 O ATOM 0 H ASP A 46 -5.547 7.221 1.084 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.368 6.745 1.523 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -6.718 8.060 -0.664 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.455 7.868 -0.793 1.00 0.00 H new ATOM 712 N GLY A 47 -6.912 4.458 0.189 1.00 0.00 N ATOM 713 CA GLY A 47 -6.990 3.225 -0.573 1.00 0.00 C ATOM 714 C GLY A 47 -7.167 3.472 -2.058 1.00 0.00 C ATOM 715 O GLY A 47 -7.778 2.665 -2.760 1.00 0.00 O ATOM 0 H GLY A 47 -6.194 4.469 0.913 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.083 2.643 -0.410 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.823 2.626 -0.205 1.00 0.00 H new ATOM 719 N VAL A 48 -6.633 4.590 -2.539 1.00 0.00 N ATOM 720 CA VAL A 48 -6.736 4.941 -3.950 1.00 0.00 C ATOM 721 C VAL A 48 -5.695 4.197 -4.779 1.00 0.00 C ATOM 722 O VAL A 48 -6.029 3.513 -5.747 1.00 0.00 O ATOM 723 CB VAL A 48 -6.561 6.456 -4.166 1.00 0.00 C ATOM 724 CG1 VAL A 48 -6.665 6.800 -5.644 1.00 0.00 C ATOM 725 CG2 VAL A 48 -7.589 7.231 -3.356 1.00 0.00 C ATOM 0 H VAL A 48 -6.124 5.268 -1.972 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.734 4.648 -4.277 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.568 6.743 -3.820 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -6.539 7.874 -5.777 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -5.887 6.272 -6.196 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -7.643 6.500 -6.019 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -7.451 8.300 -3.520 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -8.592 6.942 -3.670 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -7.461 7.007 -2.297 1.00 0.00 H new ATOM 735 N LEU A 49 -4.431 4.334 -4.392 1.00 0.00 N ATOM 736 CA LEU A 49 -3.339 3.674 -5.099 1.00 0.00 C ATOM 737 C LEU A 49 -3.262 2.197 -4.725 1.00 0.00 C ATOM 738 O LEU A 49 -3.118 1.333 -5.591 1.00 0.00 O ATOM 739 CB LEU A 49 -2.010 4.362 -4.781 1.00 0.00 C ATOM 740 CG LEU A 49 -0.829 3.987 -5.676 1.00 0.00 C ATOM 741 CD1 LEU A 49 -1.094 4.407 -7.114 1.00 0.00 C ATOM 742 CD2 LEU A 49 0.454 4.622 -5.161 1.00 0.00 C ATOM 0 H LEU A 49 -4.137 4.896 -3.593 1.00 0.00 H new ATOM 0 HA LEU A 49 -3.534 3.749 -6.169 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.158 5.440 -4.842 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.744 4.135 -3.749 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.710 2.904 -5.652 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.242 4.132 -7.736 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.989 3.904 -7.481 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.241 5.486 -7.157 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.284 4.344 -5.811 1.00 0.00 H new ATOM 0 HD22 LEU A 49 0.346 5.707 -5.154 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.653 4.271 -4.148 1.00 0.00 H new ATOM 754 N LEU A 50 -3.361 1.914 -3.431 1.00 0.00 N ATOM 755 CA LEU A 50 -3.305 0.541 -2.942 1.00 0.00 C ATOM 756 C LEU A 50 -3.956 -0.417 -3.934 1.00 0.00 C ATOM 757 O LEU A 50 -3.315 -1.347 -4.426 1.00 0.00 O ATOM 758 CB LEU A 50 -3.999 0.434 -1.582 1.00 0.00 C ATOM 759 CG LEU A 50 -3.112 0.662 -0.357 1.00 0.00 C ATOM 760 CD1 LEU A 50 -3.963 0.865 0.887 1.00 0.00 C ATOM 761 CD2 LEU A 50 -2.156 -0.507 -0.166 1.00 0.00 C ATOM 0 H LEU A 50 -3.480 2.617 -2.702 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.257 0.263 -2.831 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.815 1.156 -1.555 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.447 -0.556 -1.502 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.523 1.564 -0.521 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.315 1.026 1.749 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.607 1.734 0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.578 -0.019 1.055 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.533 -0.328 0.710 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.727 -1.424 -0.024 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.523 -0.607 -1.048 1.00 0.00 H new ATOM 773 N CYS A 51 -5.232 -0.184 -4.224 1.00 0.00 N ATOM 774 CA CYS A 51 -5.969 -1.026 -5.159 1.00 0.00 C ATOM 775 C CYS A 51 -5.265 -1.084 -6.511 1.00 0.00 C ATOM 776 O CYS A 51 -5.199 -2.138 -7.142 1.00 0.00 O ATOM 777 CB CYS A 51 -7.395 -0.501 -5.335 1.00 0.00 C ATOM 778 SG CYS A 51 -8.422 -0.645 -3.854 1.00 0.00 S ATOM 0 H CYS A 51 -5.777 0.581 -3.825 1.00 0.00 H new ATOM 0 HA CYS A 51 -6.009 -2.035 -4.747 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -7.351 0.546 -5.633 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -7.873 -1.045 -6.150 1.00 0.00 H new ATOM 0 HG CYS A 51 -8.374 0.467 -3.183 1.00 0.00 H new ATOM 784 N GLN A 52 -4.743 0.057 -6.949 1.00 0.00 N ATOM 785 CA GLN A 52 -4.046 0.136 -8.227 1.00 0.00 C ATOM 786 C GLN A 52 -2.836 -0.793 -8.246 1.00 0.00 C ATOM 787 O GLN A 52 -2.608 -1.512 -9.219 1.00 0.00 O ATOM 788 CB GLN A 52 -3.604 1.574 -8.503 1.00 0.00 C ATOM 789 CG GLN A 52 -4.757 2.563 -8.565 1.00 0.00 C ATOM 790 CD GLN A 52 -4.476 3.728 -9.494 1.00 0.00 C ATOM 791 OE1 GLN A 52 -3.378 4.284 -9.498 1.00 0.00 O ATOM 792 NE2 GLN A 52 -5.471 4.105 -10.289 1.00 0.00 N ATOM 0 H GLN A 52 -4.789 0.939 -6.438 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.737 -0.181 -9.009 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.909 1.887 -7.724 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.060 1.603 -9.447 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.657 2.046 -8.898 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.960 2.942 -7.563 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -6.366 3.616 -10.253 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.341 4.883 -10.935 1.00 0.00 H new ATOM 801 N LEU A 53 -2.064 -0.772 -7.166 1.00 0.00 N ATOM 802 CA LEU A 53 -0.876 -1.612 -7.058 1.00 0.00 C ATOM 803 C LEU A 53 -1.156 -3.019 -7.575 1.00 0.00 C ATOM 804 O LEU A 53 -0.461 -3.516 -8.462 1.00 0.00 O ATOM 805 CB LEU A 53 -0.402 -1.675 -5.605 1.00 0.00 C ATOM 806 CG LEU A 53 0.680 -2.710 -5.296 1.00 0.00 C ATOM 807 CD1 LEU A 53 1.992 -2.326 -5.961 1.00 0.00 C ATOM 808 CD2 LEU A 53 0.865 -2.856 -3.792 1.00 0.00 C ATOM 0 H LEU A 53 -2.239 -0.183 -6.352 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.091 -1.169 -7.671 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.026 -0.691 -5.323 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.265 -1.880 -4.971 1.00 0.00 H new ATOM 0 HG LEU A 53 0.361 -3.672 -5.698 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.750 -3.074 -5.730 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.851 -2.274 -7.041 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.317 -1.354 -5.590 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.639 -3.597 -3.591 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.161 -1.897 -3.367 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.073 -3.179 -3.340 1.00 0.00 H new ATOM 820 N LEU A 54 -2.178 -3.657 -7.016 1.00 0.00 N ATOM 821 CA LEU A 54 -2.552 -5.007 -7.422 1.00 0.00 C ATOM 822 C LEU A 54 -2.966 -5.039 -8.889 1.00 0.00 C ATOM 823 O LEU A 54 -2.563 -5.928 -9.638 1.00 0.00 O ATOM 824 CB LEU A 54 -3.695 -5.526 -6.546 1.00 0.00 C ATOM 825 CG LEU A 54 -3.457 -5.481 -5.037 1.00 0.00 C ATOM 826 CD1 LEU A 54 -4.625 -6.110 -4.294 1.00 0.00 C ATOM 827 CD2 LEU A 54 -2.155 -6.183 -4.680 1.00 0.00 C ATOM 0 H LEU A 54 -2.763 -3.261 -6.280 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.683 -5.652 -7.295 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.590 -4.946 -6.770 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.904 -6.557 -6.830 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.378 -4.437 -4.732 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.438 -6.069 -3.221 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.539 -5.563 -4.524 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.736 -7.149 -4.604 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.003 -6.141 -3.602 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.204 -7.224 -4.999 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.325 -5.688 -5.183 1.00 0.00 H new ATOM 839 N ASN A 55 -3.771 -4.062 -9.294 1.00 0.00 N ATOM 840 CA ASN A 55 -4.238 -3.978 -10.673 1.00 0.00 C ATOM 841 C ASN A 55 -3.062 -3.868 -11.639 1.00 0.00 C ATOM 842 O ASN A 55 -3.178 -4.212 -12.815 1.00 0.00 O ATOM 843 CB ASN A 55 -5.169 -2.776 -10.845 1.00 0.00 C ATOM 844 CG ASN A 55 -6.384 -2.852 -9.942 1.00 0.00 C ATOM 845 OD1 ASN A 55 -6.779 -3.932 -9.503 1.00 0.00 O ATOM 846 ND2 ASN A 55 -6.985 -1.701 -9.661 1.00 0.00 N ATOM 0 H ASN A 55 -4.113 -3.317 -8.687 1.00 0.00 H new ATOM 0 HA ASN A 55 -4.788 -4.891 -10.901 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -4.618 -1.860 -10.632 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -5.495 -2.718 -11.884 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.808 -1.689 -9.059 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -6.623 -0.829 -10.047 1.00 0.00 H new ATOM 853 N ASN A 56 -1.931 -3.386 -11.134 1.00 0.00 N ATOM 854 CA ASN A 56 -0.734 -3.231 -11.953 1.00 0.00 C ATOM 855 C ASN A 56 -0.030 -4.571 -12.147 1.00 0.00 C ATOM 856 O ASN A 56 0.311 -4.948 -13.269 1.00 0.00 O ATOM 857 CB ASN A 56 0.224 -2.228 -11.306 1.00 0.00 C ATOM 858 CG ASN A 56 -0.045 -0.803 -11.750 1.00 0.00 C ATOM 859 OD1 ASN A 56 -0.224 0.093 -10.786 1.00 0.00 O flip ATOM 860 ND2 ASN A 56 -0.091 -0.511 -12.945 1.00 0.00 N flip ATOM 0 H ASN A 56 -1.818 -3.096 -10.163 1.00 0.00 H new ATOM 0 HA ASN A 56 -1.038 -2.856 -12.930 1.00 0.00 H new ATOM 0 HB2 ASN A 56 0.134 -2.291 -10.222 1.00 0.00 H new ATOM 0 HB3 ASN A 56 1.250 -2.496 -11.557 1.00 0.00 H new ATOM 0 HD21 ASN A 56 0.053 -1.232 -13.652 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -0.273 0.452 -13.228 1.00 0.00 H new ATOM 867 N LEU A 57 0.183 -5.286 -11.048 1.00 0.00 N ATOM 868 CA LEU A 57 0.845 -6.585 -11.097 1.00 0.00 C ATOM 869 C LEU A 57 0.012 -7.591 -11.884 1.00 0.00 C ATOM 870 O LEU A 57 0.503 -8.219 -12.822 1.00 0.00 O ATOM 871 CB LEU A 57 1.092 -7.106 -9.680 1.00 0.00 C ATOM 872 CG LEU A 57 1.649 -6.093 -8.679 1.00 0.00 C ATOM 873 CD1 LEU A 57 1.803 -6.729 -7.306 1.00 0.00 C ATOM 874 CD2 LEU A 57 2.980 -5.539 -9.165 1.00 0.00 C ATOM 0 H LEU A 57 -0.093 -4.988 -10.112 1.00 0.00 H new ATOM 0 HA LEU A 57 1.802 -6.460 -11.603 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.152 -7.494 -9.288 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.784 -7.946 -9.739 1.00 0.00 H new ATOM 0 HG LEU A 57 0.943 -5.266 -8.597 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.201 -5.993 -6.607 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.831 -7.076 -6.955 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.488 -7.574 -7.371 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.361 -4.820 -8.440 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.694 -6.355 -9.277 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.839 -5.045 -10.126 1.00 0.00 H new ATOM 886 N ARG A 58 -1.251 -7.738 -11.497 1.00 0.00 N ATOM 887 CA ARG A 58 -2.152 -8.667 -12.166 1.00 0.00 C ATOM 888 C ARG A 58 -3.334 -7.927 -12.787 1.00 0.00 C ATOM 889 O ARG A 58 -3.669 -6.817 -12.375 1.00 0.00 O ATOM 890 CB ARG A 58 -2.659 -9.721 -11.179 1.00 0.00 C ATOM 891 CG ARG A 58 -2.967 -11.062 -11.825 1.00 0.00 C ATOM 892 CD ARG A 58 -3.803 -11.942 -10.909 1.00 0.00 C ATOM 893 NE ARG A 58 -4.394 -13.070 -11.624 1.00 0.00 N ATOM 894 CZ ARG A 58 -4.801 -14.186 -11.028 1.00 0.00 C ATOM 895 NH1 ARG A 58 -4.681 -14.322 -9.715 1.00 0.00 N ATOM 896 NH2 ARG A 58 -5.329 -15.168 -11.747 1.00 0.00 N ATOM 0 H ARG A 58 -1.673 -7.225 -10.723 1.00 0.00 H new ATOM 0 HA ARG A 58 -1.596 -9.162 -12.962 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -1.911 -9.866 -10.399 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -3.559 -9.347 -10.691 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -3.499 -10.902 -12.763 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -2.035 -11.572 -12.070 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.180 -12.314 -10.096 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -4.595 -11.345 -10.456 1.00 0.00 H new ATOM 0 HE ARG A 58 -4.500 -12.997 -12.636 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -4.275 -13.569 -9.159 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -4.994 -15.180 -9.260 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -5.423 -15.067 -12.758 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -5.641 -16.024 -11.289 1.00 0.00 H new ATOM 910 N ALA A 59 -3.959 -8.550 -13.781 1.00 0.00 N ATOM 911 CA ALA A 59 -5.103 -7.951 -14.457 1.00 0.00 C ATOM 912 C ALA A 59 -6.413 -8.382 -13.806 1.00 0.00 C ATOM 913 O ALA A 59 -6.519 -9.486 -13.272 1.00 0.00 O ATOM 914 CB ALA A 59 -5.098 -8.323 -15.933 1.00 0.00 C ATOM 0 H ALA A 59 -3.692 -9.469 -14.136 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.021 -6.868 -14.366 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.958 -7.869 -16.426 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -4.181 -7.960 -16.397 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -5.152 -9.407 -16.035 1.00 0.00 H new ATOM 920 N HIS A 60 -7.409 -7.502 -13.853 1.00 0.00 N ATOM 921 CA HIS A 60 -8.713 -7.792 -13.266 1.00 0.00 C ATOM 922 C HIS A 60 -8.594 -8.017 -11.762 1.00 0.00 C ATOM 923 O HIS A 60 -9.421 -8.701 -11.160 1.00 0.00 O ATOM 924 CB HIS A 60 -9.332 -9.022 -13.931 1.00 0.00 C ATOM 925 CG HIS A 60 -10.015 -8.722 -15.229 1.00 0.00 C ATOM 926 ND1 HIS A 60 -11.087 -9.449 -15.702 1.00 0.00 N ATOM 927 CD2 HIS A 60 -9.775 -7.764 -16.155 1.00 0.00 C ATOM 928 CE1 HIS A 60 -11.475 -8.954 -16.863 1.00 0.00 C ATOM 929 NE2 HIS A 60 -10.695 -7.930 -17.161 1.00 0.00 N ATOM 0 H HIS A 60 -7.338 -6.584 -14.291 1.00 0.00 H new ATOM 0 HA HIS A 60 -9.360 -6.932 -13.436 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -8.551 -9.763 -14.104 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -10.052 -9.471 -13.247 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -9.004 -7.010 -16.111 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -12.291 -9.323 -17.466 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -10.765 -7.356 -18.001 1.00 0.00 H new ATOM 938 N SER A 61 -7.560 -7.437 -11.162 1.00 0.00 N ATOM 939 CA SER A 61 -7.331 -7.578 -9.728 1.00 0.00 C ATOM 940 C SER A 61 -8.374 -6.800 -8.932 1.00 0.00 C ATOM 941 O SER A 61 -8.953 -7.316 -7.976 1.00 0.00 O ATOM 942 CB SER A 61 -5.927 -7.091 -9.365 1.00 0.00 C ATOM 943 OG SER A 61 -4.987 -7.454 -10.361 1.00 0.00 O ATOM 0 H SER A 61 -6.868 -6.865 -11.646 1.00 0.00 H new ATOM 0 HA SER A 61 -7.419 -8.634 -9.473 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.934 -6.008 -9.245 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.628 -7.516 -8.407 1.00 0.00 H new ATOM 0 HG SER A 61 -5.036 -6.818 -11.105 1.00 0.00 H new ATOM 949 N ILE A 62 -8.607 -5.555 -9.334 1.00 0.00 N ATOM 950 CA ILE A 62 -9.581 -4.705 -8.659 1.00 0.00 C ATOM 951 C ILE A 62 -10.248 -3.748 -9.641 1.00 0.00 C ATOM 952 O ILE A 62 -9.576 -3.067 -10.414 1.00 0.00 O ATOM 953 CB ILE A 62 -8.928 -3.890 -7.528 1.00 0.00 C ATOM 954 CG1 ILE A 62 -8.229 -4.822 -6.536 1.00 0.00 C ATOM 955 CG2 ILE A 62 -9.970 -3.038 -6.819 1.00 0.00 C ATOM 956 CD1 ILE A 62 -7.380 -4.093 -5.517 1.00 0.00 C ATOM 0 H ILE A 62 -8.135 -5.113 -10.123 1.00 0.00 H new ATOM 0 HA ILE A 62 -10.335 -5.366 -8.231 1.00 0.00 H new ATOM 0 HB ILE A 62 -8.180 -3.227 -7.963 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -8.981 -5.414 -6.014 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.600 -5.521 -7.088 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -9.493 -2.468 -6.022 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -10.426 -2.352 -7.533 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.739 -3.683 -6.393 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -6.915 -4.816 -4.847 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.605 -3.523 -6.030 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.007 -3.414 -4.939 1.00 0.00 H new ATOM 968 N ASN A 63 -11.576 -3.700 -9.602 1.00 0.00 N ATOM 969 CA ASN A 63 -12.335 -2.825 -10.487 1.00 0.00 C ATOM 970 C ASN A 63 -12.356 -1.396 -9.953 1.00 0.00 C ATOM 971 O ASN A 63 -12.976 -1.114 -8.926 1.00 0.00 O ATOM 972 CB ASN A 63 -13.766 -3.343 -10.646 1.00 0.00 C ATOM 973 CG ASN A 63 -14.545 -2.577 -11.699 1.00 0.00 C ATOM 974 OD1 ASN A 63 -13.986 -1.752 -12.422 1.00 0.00 O ATOM 975 ND2 ASN A 63 -15.842 -2.848 -11.789 1.00 0.00 N ATOM 0 H ASN A 63 -12.148 -4.257 -8.967 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.846 -2.823 -11.461 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -13.739 -4.399 -10.914 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -14.284 -3.270 -9.690 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -16.417 -2.364 -12.479 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -16.263 -3.540 -11.169 1.00 0.00 H new ATOM 982 N LEU A 64 -11.676 -0.497 -10.656 1.00 0.00 N ATOM 983 CA LEU A 64 -11.617 0.904 -10.253 1.00 0.00 C ATOM 984 C LEU A 64 -13.011 1.444 -9.953 1.00 0.00 C ATOM 985 O LEU A 64 -13.195 2.243 -9.034 1.00 0.00 O ATOM 986 CB LEU A 64 -10.958 1.742 -11.350 1.00 0.00 C ATOM 987 CG LEU A 64 -9.502 1.402 -11.672 1.00 0.00 C ATOM 988 CD1 LEU A 64 -9.043 2.145 -12.917 1.00 0.00 C ATOM 989 CD2 LEU A 64 -8.603 1.733 -10.489 1.00 0.00 C ATOM 0 H LEU A 64 -11.158 -0.713 -11.508 1.00 0.00 H new ATOM 0 HA LEU A 64 -11.019 0.970 -9.344 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.545 1.636 -12.262 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.009 2.791 -11.058 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.433 0.332 -11.867 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.005 1.891 -13.130 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.668 1.859 -13.763 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.127 3.219 -12.751 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.571 1.485 -10.736 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.676 2.797 -10.263 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -8.917 1.155 -9.620 1.00 0.00 H new ATOM 1001 N LYS A 65 -13.992 1.000 -10.732 1.00 0.00 N ATOM 1002 CA LYS A 65 -15.372 1.435 -10.548 1.00 0.00 C ATOM 1003 C LYS A 65 -15.896 1.018 -9.178 1.00 0.00 C ATOM 1004 O LYS A 65 -16.627 1.766 -8.530 1.00 0.00 O ATOM 1005 CB LYS A 65 -16.263 0.851 -11.646 1.00 0.00 C ATOM 1006 CG LYS A 65 -16.035 1.477 -13.012 1.00 0.00 C ATOM 1007 CD LYS A 65 -14.725 1.013 -13.626 1.00 0.00 C ATOM 1008 CE LYS A 65 -14.565 1.525 -15.049 1.00 0.00 C ATOM 1009 NZ LYS A 65 -13.347 0.971 -15.704 1.00 0.00 N ATOM 0 H LYS A 65 -13.857 0.339 -11.497 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.395 2.523 -10.610 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -16.086 -0.222 -11.713 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -17.307 0.985 -11.364 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -16.861 1.217 -13.675 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.030 2.563 -12.919 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -13.892 1.363 -13.016 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -14.686 -0.076 -13.623 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -15.445 1.256 -15.633 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -14.509 2.614 -15.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -13.273 1.344 -16.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -12.504 1.248 -15.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -13.412 -0.066 -15.736 1.00 0.00 H new ATOM 1023 N GLU A 66 -15.516 -0.179 -8.743 1.00 0.00 N ATOM 1024 CA GLU A 66 -15.948 -0.694 -7.449 1.00 0.00 C ATOM 1025 C GLU A 66 -15.387 0.154 -6.311 1.00 0.00 C ATOM 1026 O GLU A 66 -15.940 0.179 -5.212 1.00 0.00 O ATOM 1027 CB GLU A 66 -15.506 -2.149 -7.281 1.00 0.00 C ATOM 1028 CG GLU A 66 -16.342 -3.136 -8.078 1.00 0.00 C ATOM 1029 CD GLU A 66 -15.996 -4.579 -7.768 1.00 0.00 C ATOM 1030 OE1 GLU A 66 -15.978 -4.941 -6.572 1.00 0.00 O ATOM 1031 OE2 GLU A 66 -15.743 -5.347 -8.719 1.00 0.00 O ATOM 0 H GLU A 66 -14.910 -0.810 -9.267 1.00 0.00 H new ATOM 0 HA GLU A 66 -17.036 -0.646 -7.413 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.463 -2.240 -7.585 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.554 -2.415 -6.225 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -17.398 -2.966 -7.866 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -16.197 -2.952 -9.143 1.00 0.00 H new ATOM 1038 N ILE A 67 -14.286 0.846 -6.584 1.00 0.00 N ATOM 1039 CA ILE A 67 -13.651 1.695 -5.584 1.00 0.00 C ATOM 1040 C ILE A 67 -13.922 3.170 -5.863 1.00 0.00 C ATOM 1041 O ILE A 67 -13.688 3.655 -6.969 1.00 0.00 O ATOM 1042 CB ILE A 67 -12.129 1.465 -5.534 1.00 0.00 C ATOM 1043 CG1 ILE A 67 -11.524 1.606 -6.932 1.00 0.00 C ATOM 1044 CG2 ILE A 67 -11.820 0.093 -4.954 1.00 0.00 C ATOM 1045 CD1 ILE A 67 -10.013 1.540 -6.946 1.00 0.00 C ATOM 0 H ILE A 67 -13.815 0.835 -7.489 1.00 0.00 H new ATOM 0 HA ILE A 67 -14.083 1.424 -4.620 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.683 2.221 -4.887 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -11.920 0.817 -7.572 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -11.842 2.555 -7.363 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -10.740 -0.055 -4.925 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.223 0.026 -3.943 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -12.275 -0.677 -5.578 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.654 1.647 -7.969 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.608 2.345 -6.333 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -9.687 0.580 -6.545 1.00 0.00 H new ATOM 1057 N ASN A 68 -14.414 3.877 -4.852 1.00 0.00 N ATOM 1058 CA ASN A 68 -14.715 5.298 -4.988 1.00 0.00 C ATOM 1059 C ASN A 68 -13.434 6.126 -5.006 1.00 0.00 C ATOM 1060 O ASN A 68 -12.836 6.388 -3.961 1.00 0.00 O ATOM 1061 CB ASN A 68 -15.619 5.761 -3.843 1.00 0.00 C ATOM 1062 CG ASN A 68 -16.851 4.890 -3.692 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -16.770 3.897 -2.815 1.00 0.00 O flip ATOM 1064 ND2 ASN A 68 -17.865 5.109 -4.356 1.00 0.00 N flip ATOM 0 H ASN A 68 -14.613 3.490 -3.929 1.00 0.00 H new ATOM 0 HA ASN A 68 -15.235 5.445 -5.935 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -15.054 5.752 -2.911 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -15.925 6.792 -4.020 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -17.883 5.884 -5.019 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -18.687 4.515 -4.243 1.00 0.00 H new ATOM 1071 N LEU A 69 -13.018 6.537 -6.199 1.00 0.00 N ATOM 1072 CA LEU A 69 -11.808 7.337 -6.354 1.00 0.00 C ATOM 1073 C LEU A 69 -12.083 8.805 -6.044 1.00 0.00 C ATOM 1074 O LEU A 69 -13.115 9.350 -6.436 1.00 0.00 O ATOM 1075 CB LEU A 69 -11.260 7.198 -7.775 1.00 0.00 C ATOM 1076 CG LEU A 69 -10.775 5.803 -8.173 1.00 0.00 C ATOM 1077 CD1 LEU A 69 -10.838 5.627 -9.683 1.00 0.00 C ATOM 1078 CD2 LEU A 69 -9.360 5.565 -7.665 1.00 0.00 C ATOM 0 H LEU A 69 -13.501 6.329 -7.073 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.065 6.968 -5.647 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.038 7.504 -8.475 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.432 7.897 -7.894 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.433 5.065 -7.714 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -10.489 4.629 -9.948 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -11.866 5.754 -10.021 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.204 6.372 -10.163 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.031 4.568 -7.957 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.689 6.309 -8.095 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.345 5.648 -6.578 1.00 0.00 H new ATOM 1090 N ARG A 70 -11.152 9.441 -5.341 1.00 0.00 N ATOM 1091 CA ARG A 70 -11.293 10.846 -4.980 1.00 0.00 C ATOM 1092 C ARG A 70 -12.315 11.020 -3.861 1.00 0.00 C ATOM 1093 O ARG A 70 -13.281 11.775 -3.980 1.00 0.00 O ATOM 1094 CB ARG A 70 -11.711 11.668 -6.200 1.00 0.00 C ATOM 1095 CG ARG A 70 -11.418 13.153 -6.063 1.00 0.00 C ATOM 1096 CD ARG A 70 -11.795 13.914 -7.325 1.00 0.00 C ATOM 1097 NE ARG A 70 -12.180 15.294 -7.038 1.00 0.00 N ATOM 1098 CZ ARG A 70 -12.645 16.133 -7.956 1.00 0.00 C ATOM 1099 NH1 ARG A 70 -12.783 15.735 -9.213 1.00 0.00 N ATOM 1100 NH2 ARG A 70 -12.974 17.373 -7.617 1.00 0.00 N ATOM 0 H ARG A 70 -10.291 9.005 -5.010 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.327 11.203 -4.624 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -11.195 11.284 -7.080 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -12.779 11.531 -6.371 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -11.970 13.557 -5.214 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -10.358 13.298 -5.852 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -10.952 13.909 -8.017 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -12.619 13.404 -7.823 1.00 0.00 H new ATOM 0 HE ARG A 70 -12.086 15.631 -6.080 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -12.532 14.782 -9.477 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -13.140 16.381 -9.916 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -12.870 17.682 -6.651 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -13.331 18.017 -8.323 1.00 0.00 H new ATOM 1114 N PRO A 71 -12.101 10.305 -2.746 1.00 0.00 N ATOM 1115 CA PRO A 71 -12.993 10.363 -1.584 1.00 0.00 C ATOM 1116 C PRO A 71 -12.913 11.701 -0.858 1.00 0.00 C ATOM 1117 O PRO A 71 -13.587 11.912 0.149 1.00 0.00 O ATOM 1118 CB PRO A 71 -12.478 9.235 -0.686 1.00 0.00 C ATOM 1119 CG PRO A 71 -11.048 9.071 -1.066 1.00 0.00 C ATOM 1120 CD PRO A 71 -10.971 9.385 -2.534 1.00 0.00 C ATOM 0 HA PRO A 71 -14.040 10.257 -1.868 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -12.580 9.491 0.369 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -13.038 8.314 -0.847 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.412 9.742 -0.489 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -10.705 8.056 -0.866 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -10.020 9.849 -2.796 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -11.065 8.486 -3.143 1.00 0.00 H new ATOM 1128 N GLN A 72 -12.085 12.602 -1.377 1.00 0.00 N ATOM 1129 CA GLN A 72 -11.917 13.920 -0.777 1.00 0.00 C ATOM 1130 C GLN A 72 -11.797 13.817 0.740 1.00 0.00 C ATOM 1131 O GLN A 72 -12.334 14.647 1.473 1.00 0.00 O ATOM 1132 CB GLN A 72 -13.093 14.826 -1.147 1.00 0.00 C ATOM 1133 CG GLN A 72 -13.306 14.965 -2.646 1.00 0.00 C ATOM 1134 CD GLN A 72 -14.304 16.051 -2.995 1.00 0.00 C ATOM 1135 OE1 GLN A 72 -15.299 16.244 -2.297 1.00 0.00 O ATOM 1136 NE2 GLN A 72 -14.042 16.769 -4.081 1.00 0.00 N ATOM 0 H GLN A 72 -11.520 12.443 -2.211 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.996 14.354 -1.167 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -14.002 14.430 -0.694 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -12.928 15.815 -0.719 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -12.352 15.185 -3.126 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -13.654 14.014 -3.050 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -13.205 16.575 -4.631 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -14.678 17.514 -4.365 1.00 0.00 H new ATOM 1145 N MET A 73 -11.091 12.791 1.204 1.00 0.00 N ATOM 1146 CA MET A 73 -10.900 12.580 2.634 1.00 0.00 C ATOM 1147 C MET A 73 -12.213 12.191 3.306 1.00 0.00 C ATOM 1148 O MET A 73 -12.593 12.765 4.326 1.00 0.00 O ATOM 1149 CB MET A 73 -10.334 13.842 3.287 1.00 0.00 C ATOM 1150 CG MET A 73 -9.185 14.465 2.511 1.00 0.00 C ATOM 1151 SD MET A 73 -7.582 13.784 2.976 1.00 0.00 S ATOM 1152 CE MET A 73 -7.459 12.404 1.840 1.00 0.00 C ATOM 0 H MET A 73 -10.642 12.093 0.611 1.00 0.00 H new ATOM 0 HA MET A 73 -10.190 11.763 2.763 1.00 0.00 H new ATOM 0 HB2 MET A 73 -11.132 14.577 3.390 1.00 0.00 H new ATOM 0 HB3 MET A 73 -9.992 13.599 4.293 1.00 0.00 H new ATOM 0 HG2 MET A 73 -9.346 14.309 1.444 1.00 0.00 H new ATOM 0 HG3 MET A 73 -9.180 15.542 2.679 1.00 0.00 H new ATOM 0 HE1 MET A 73 -7.337 11.479 2.403 1.00 0.00 H new ATOM 0 HE2 MET A 73 -8.366 12.346 1.239 1.00 0.00 H new ATOM 0 HE3 MET A 73 -6.599 12.547 1.186 1.00 0.00 H new ATOM 1162 N SER A 74 -12.902 11.213 2.727 1.00 0.00 N ATOM 1163 CA SER A 74 -14.175 10.751 3.267 1.00 0.00 C ATOM 1164 C SER A 74 -13.985 9.486 4.099 1.00 0.00 C ATOM 1165 O SER A 74 -13.480 8.478 3.608 1.00 0.00 O ATOM 1166 CB SER A 74 -15.168 10.484 2.134 1.00 0.00 C ATOM 1167 OG SER A 74 -16.459 10.199 2.644 1.00 0.00 O ATOM 0 H SER A 74 -12.600 10.725 1.884 1.00 0.00 H new ATOM 0 HA SER A 74 -14.573 11.534 3.912 1.00 0.00 H new ATOM 0 HB2 SER A 74 -15.217 11.352 1.477 1.00 0.00 H new ATOM 0 HB3 SER A 74 -14.819 9.646 1.530 1.00 0.00 H new ATOM 0 HG SER A 74 -17.075 10.034 1.900 1.00 0.00 H new ATOM 1173 N GLN A 75 -14.393 9.550 5.363 1.00 0.00 N ATOM 1174 CA GLN A 75 -14.266 8.411 6.264 1.00 0.00 C ATOM 1175 C GLN A 75 -14.877 7.157 5.647 1.00 0.00 C ATOM 1176 O GLN A 75 -14.218 6.124 5.532 1.00 0.00 O ATOM 1177 CB GLN A 75 -14.942 8.715 7.603 1.00 0.00 C ATOM 1178 CG GLN A 75 -15.016 7.516 8.533 1.00 0.00 C ATOM 1179 CD GLN A 75 -15.872 7.779 9.757 1.00 0.00 C ATOM 1180 OE1 GLN A 75 -16.696 8.694 9.767 1.00 0.00 O ATOM 1181 NE2 GLN A 75 -15.682 6.975 10.796 1.00 0.00 N ATOM 0 H GLN A 75 -14.814 10.378 5.785 1.00 0.00 H new ATOM 0 HA GLN A 75 -13.204 8.231 6.433 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -14.398 9.518 8.101 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -15.951 9.082 7.416 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -15.420 6.663 7.988 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -14.009 7.244 8.850 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -14.988 6.229 10.744 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -16.230 7.103 11.647 1.00 0.00 H new ATOM 1190 N PHE A 76 -16.142 7.256 5.250 1.00 0.00 N ATOM 1191 CA PHE A 76 -16.843 6.129 4.645 1.00 0.00 C ATOM 1192 C PHE A 76 -16.074 5.592 3.442 1.00 0.00 C ATOM 1193 O PHE A 76 -15.497 4.505 3.493 1.00 0.00 O ATOM 1194 CB PHE A 76 -18.252 6.547 4.219 1.00 0.00 C ATOM 1195 CG PHE A 76 -19.223 6.632 5.361 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -19.312 7.783 6.128 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -20.048 5.562 5.667 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -20.204 7.863 7.180 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -20.943 5.637 6.718 1.00 0.00 C ATOM 1200 CZ PHE A 76 -21.022 6.790 7.475 1.00 0.00 C ATOM 0 H PHE A 76 -16.702 8.104 5.336 1.00 0.00 H new ATOM 0 HA PHE A 76 -16.916 5.337 5.390 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -18.200 7.517 3.724 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -18.628 5.834 3.485 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -18.677 8.627 5.901 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -19.991 4.659 5.078 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -20.262 8.765 7.772 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -21.580 4.795 6.947 1.00 0.00 H new ATOM 0 HZ PHE A 76 -21.722 6.852 8.295 1.00 0.00 H new ATOM 1210 N LEU A 77 -16.069 6.362 2.359 1.00 0.00 N ATOM 1211 CA LEU A 77 -15.371 5.965 1.141 1.00 0.00 C ATOM 1212 C LEU A 77 -13.988 5.408 1.463 1.00 0.00 C ATOM 1213 O LEU A 77 -13.658 4.283 1.085 1.00 0.00 O ATOM 1214 CB LEU A 77 -15.244 7.158 0.191 1.00 0.00 C ATOM 1215 CG LEU A 77 -16.548 7.873 -0.166 1.00 0.00 C ATOM 1216 CD1 LEU A 77 -16.259 9.206 -0.837 1.00 0.00 C ATOM 1217 CD2 LEU A 77 -17.408 6.996 -1.065 1.00 0.00 C ATOM 0 H LEU A 77 -16.540 7.265 2.300 1.00 0.00 H new ATOM 0 HA LEU A 77 -15.954 5.182 0.656 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.566 7.884 0.640 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -14.777 6.814 -0.732 1.00 0.00 H new ATOM 0 HG LEU A 77 -17.099 8.065 0.755 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -17.199 9.700 -1.084 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -15.684 9.837 -0.160 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -15.687 9.038 -1.749 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -18.332 7.521 -1.309 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -16.864 6.772 -1.983 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -17.645 6.066 -0.548 1.00 0.00 H new ATOM 1229 N CYS A 78 -13.185 6.201 2.164 1.00 0.00 N ATOM 1230 CA CYS A 78 -11.838 5.786 2.538 1.00 0.00 C ATOM 1231 C CYS A 78 -11.842 4.369 3.102 1.00 0.00 C ATOM 1232 O CYS A 78 -11.319 3.441 2.482 1.00 0.00 O ATOM 1233 CB CYS A 78 -11.250 6.755 3.566 1.00 0.00 C ATOM 1234 SG CYS A 78 -9.511 6.451 3.957 1.00 0.00 S ATOM 0 H CYS A 78 -13.443 7.134 2.485 1.00 0.00 H new ATOM 0 HA CYS A 78 -11.219 5.799 1.641 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -11.354 7.773 3.191 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -11.834 6.692 4.484 1.00 0.00 H new ATOM 0 HG CYS A 78 -8.994 5.669 3.056 1.00 0.00 H new ATOM 1240 N LEU A 79 -12.433 4.209 4.280 1.00 0.00 N ATOM 1241 CA LEU A 79 -12.504 2.904 4.929 1.00 0.00 C ATOM 1242 C LEU A 79 -12.933 1.826 3.939 1.00 0.00 C ATOM 1243 O LEU A 79 -12.370 0.731 3.914 1.00 0.00 O ATOM 1244 CB LEU A 79 -13.481 2.950 6.106 1.00 0.00 C ATOM 1245 CG LEU A 79 -12.953 3.588 7.392 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -14.103 3.951 8.318 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -11.979 2.651 8.090 1.00 0.00 C ATOM 0 H LEU A 79 -12.870 4.966 4.806 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.510 2.656 5.300 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -14.371 3.495 5.792 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -13.795 1.931 6.332 1.00 0.00 H new ATOM 0 HG LEU A 79 -12.422 4.503 7.130 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -13.709 4.404 9.228 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -14.764 4.659 7.817 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -14.662 3.051 8.574 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -11.613 3.121 9.003 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -12.486 1.719 8.340 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.139 2.441 7.428 1.00 0.00 H new ATOM 1259 N LYS A 80 -13.932 2.143 3.123 1.00 0.00 N ATOM 1260 CA LYS A 80 -14.436 1.204 2.128 1.00 0.00 C ATOM 1261 C LYS A 80 -13.324 0.770 1.178 1.00 0.00 C ATOM 1262 O LYS A 80 -13.046 -0.420 1.037 1.00 0.00 O ATOM 1263 CB LYS A 80 -15.581 1.836 1.333 1.00 0.00 C ATOM 1264 CG LYS A 80 -16.586 0.827 0.807 1.00 0.00 C ATOM 1265 CD LYS A 80 -16.129 0.218 -0.508 1.00 0.00 C ATOM 1266 CE LYS A 80 -16.405 1.150 -1.678 1.00 0.00 C ATOM 1267 NZ LYS A 80 -15.509 0.868 -2.834 1.00 0.00 N ATOM 0 H LYS A 80 -14.409 3.044 3.131 1.00 0.00 H new ATOM 0 HA LYS A 80 -14.808 0.324 2.652 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.099 2.555 1.968 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.165 2.393 0.494 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -16.730 0.037 1.544 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -17.552 1.313 0.668 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.062 0.000 -0.458 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.641 -0.731 -0.668 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.444 1.044 -1.989 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.272 2.184 -1.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -14.863 1.671 -2.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -14.956 0.008 -2.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -16.082 0.728 -3.691 1.00 0.00 H new ATOM 1281 N ASN A 81 -12.690 1.743 0.531 1.00 0.00 N ATOM 1282 CA ASN A 81 -11.608 1.460 -0.404 1.00 0.00 C ATOM 1283 C ASN A 81 -10.583 0.517 0.219 1.00 0.00 C ATOM 1284 O ASN A 81 -10.371 -0.594 -0.267 1.00 0.00 O ATOM 1285 CB ASN A 81 -10.925 2.760 -0.835 1.00 0.00 C ATOM 1286 CG ASN A 81 -11.820 3.620 -1.707 1.00 0.00 C ATOM 1287 OD1 ASN A 81 -12.937 3.230 -2.046 1.00 0.00 O ATOM 1288 ND2 ASN A 81 -11.330 4.799 -2.075 1.00 0.00 N ATOM 0 H ASN A 81 -12.907 2.734 0.637 1.00 0.00 H new ATOM 0 HA ASN A 81 -12.037 0.974 -1.281 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -10.633 3.325 0.050 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -10.010 2.524 -1.379 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -11.885 5.421 -2.662 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -10.398 5.082 -1.770 1.00 0.00 H new ATOM 1295 N ILE A 82 -9.951 0.969 1.297 1.00 0.00 N ATOM 1296 CA ILE A 82 -8.949 0.165 1.988 1.00 0.00 C ATOM 1297 C ILE A 82 -9.300 -1.318 1.930 1.00 0.00 C ATOM 1298 O ILE A 82 -8.500 -2.138 1.479 1.00 0.00 O ATOM 1299 CB ILE A 82 -8.805 0.590 3.461 1.00 0.00 C ATOM 1300 CG1 ILE A 82 -8.353 2.049 3.551 1.00 0.00 C ATOM 1301 CG2 ILE A 82 -7.821 -0.320 4.181 1.00 0.00 C ATOM 1302 CD1 ILE A 82 -8.341 2.592 4.963 1.00 0.00 C ATOM 0 H ILE A 82 -10.115 1.887 1.711 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.001 0.332 1.476 1.00 0.00 H new ATOM 0 HB ILE A 82 -9.776 0.499 3.947 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -7.352 2.138 3.128 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -9.013 2.664 2.940 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -7.730 -0.007 5.221 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -8.181 -1.348 4.142 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.846 -0.258 3.697 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -8.011 3.631 4.951 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -9.345 2.536 5.383 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.659 2.001 5.574 1.00 0.00 H new ATOM 1314 N ARG A 83 -10.501 -1.655 2.389 1.00 0.00 N ATOM 1315 CA ARG A 83 -10.958 -3.039 2.390 1.00 0.00 C ATOM 1316 C ARG A 83 -10.931 -3.621 0.979 1.00 0.00 C ATOM 1317 O ARG A 83 -10.308 -4.654 0.733 1.00 0.00 O ATOM 1318 CB ARG A 83 -12.373 -3.131 2.964 1.00 0.00 C ATOM 1319 CG ARG A 83 -12.417 -3.090 4.483 1.00 0.00 C ATOM 1320 CD ARG A 83 -13.754 -2.570 4.987 1.00 0.00 C ATOM 1321 NE ARG A 83 -14.052 -3.043 6.336 1.00 0.00 N ATOM 1322 CZ ARG A 83 -14.531 -4.253 6.602 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -14.765 -5.109 5.616 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -14.776 -4.610 7.856 1.00 0.00 N ATOM 0 H ARG A 83 -11.175 -0.988 2.765 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.281 -3.619 3.017 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -12.970 -2.309 2.569 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -12.836 -4.056 2.620 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -12.241 -4.090 4.880 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -11.614 -2.453 4.854 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -13.745 -1.480 4.979 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.546 -2.888 4.308 1.00 0.00 H new ATOM 0 HE ARG A 83 -13.883 -2.409 7.117 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -14.577 -4.839 4.651 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -15.133 -6.038 5.823 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -14.597 -3.955 8.617 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -15.144 -5.539 8.059 1.00 0.00 H new ATOM 1338 N THR A 84 -11.612 -2.950 0.055 1.00 0.00 N ATOM 1339 CA THR A 84 -11.668 -3.401 -1.330 1.00 0.00 C ATOM 1340 C THR A 84 -10.319 -3.945 -1.786 1.00 0.00 C ATOM 1341 O THR A 84 -10.253 -4.866 -2.601 1.00 0.00 O ATOM 1342 CB THR A 84 -12.095 -2.261 -2.275 1.00 0.00 C ATOM 1343 OG1 THR A 84 -13.375 -1.754 -1.883 1.00 0.00 O ATOM 1344 CG2 THR A 84 -12.155 -2.746 -3.715 1.00 0.00 C ATOM 0 H THR A 84 -12.132 -2.093 0.241 1.00 0.00 H new ATOM 0 HA THR A 84 -12.411 -4.197 -1.373 1.00 0.00 H new ATOM 0 HB THR A 84 -11.353 -1.465 -2.207 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.277 -1.206 -1.076 1.00 0.00 H new ATOM 0 HG21 THR A 84 -12.459 -1.924 -4.363 1.00 0.00 H new ATOM 0 HG22 THR A 84 -11.172 -3.104 -4.020 1.00 0.00 H new ATOM 0 HG23 THR A 84 -12.878 -3.558 -3.796 1.00 0.00 H new ATOM 1352 N PHE A 85 -9.244 -3.371 -1.256 1.00 0.00 N ATOM 1353 CA PHE A 85 -7.896 -3.799 -1.609 1.00 0.00 C ATOM 1354 C PHE A 85 -7.484 -5.023 -0.796 1.00 0.00 C ATOM 1355 O PHE A 85 -6.844 -5.940 -1.314 1.00 0.00 O ATOM 1356 CB PHE A 85 -6.900 -2.661 -1.378 1.00 0.00 C ATOM 1357 CG PHE A 85 -5.499 -3.135 -1.114 1.00 0.00 C ATOM 1358 CD1 PHE A 85 -4.617 -3.348 -2.161 1.00 0.00 C ATOM 1359 CD2 PHE A 85 -5.064 -3.366 0.181 1.00 0.00 C ATOM 1360 CE1 PHE A 85 -3.328 -3.784 -1.921 1.00 0.00 C ATOM 1361 CE2 PHE A 85 -3.776 -3.803 0.427 1.00 0.00 C ATOM 1362 CZ PHE A 85 -2.906 -4.011 -0.625 1.00 0.00 C ATOM 0 H PHE A 85 -9.281 -2.608 -0.580 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.892 -4.068 -2.665 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.896 -2.009 -2.252 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.237 -2.060 -0.534 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -4.941 -3.171 -3.176 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -5.739 -3.203 1.008 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -2.651 -3.947 -2.746 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -3.450 -3.982 1.441 1.00 0.00 H new ATOM 0 HZ PHE A 85 -1.898 -4.350 -0.435 1.00 0.00 H new ATOM 1372 N LEU A 86 -7.854 -5.031 0.480 1.00 0.00 N ATOM 1373 CA LEU A 86 -7.523 -6.142 1.366 1.00 0.00 C ATOM 1374 C LEU A 86 -8.141 -7.442 0.863 1.00 0.00 C ATOM 1375 O LEU A 86 -7.540 -8.512 0.973 1.00 0.00 O ATOM 1376 CB LEU A 86 -8.009 -5.849 2.786 1.00 0.00 C ATOM 1377 CG LEU A 86 -7.428 -4.600 3.450 1.00 0.00 C ATOM 1378 CD1 LEU A 86 -8.150 -4.304 4.755 1.00 0.00 C ATOM 1379 CD2 LEU A 86 -5.935 -4.769 3.691 1.00 0.00 C ATOM 0 H LEU A 86 -8.383 -4.281 0.924 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.439 -6.257 1.376 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -9.095 -5.753 2.764 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -7.778 -6.710 3.413 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.574 -3.754 2.778 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.723 -3.412 5.213 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.209 -4.138 4.556 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.037 -5.150 5.433 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.539 -3.870 4.164 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.766 -5.627 4.342 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.429 -4.931 2.739 1.00 0.00 H new ATOM 1391 N THR A 87 -9.345 -7.344 0.307 1.00 0.00 N ATOM 1392 CA THR A 87 -10.044 -8.512 -0.214 1.00 0.00 C ATOM 1393 C THR A 87 -9.319 -9.092 -1.422 1.00 0.00 C ATOM 1394 O THR A 87 -9.102 -10.301 -1.507 1.00 0.00 O ATOM 1395 CB THR A 87 -11.491 -8.168 -0.614 1.00 0.00 C ATOM 1396 OG1 THR A 87 -12.351 -9.281 -0.346 1.00 0.00 O ATOM 1397 CG2 THR A 87 -11.572 -7.801 -2.088 1.00 0.00 C ATOM 0 H THR A 87 -9.856 -6.467 0.206 1.00 0.00 H new ATOM 0 HA THR A 87 -10.062 -9.253 0.585 1.00 0.00 H new ATOM 0 HB THR A 87 -11.814 -7.310 -0.024 1.00 0.00 H new ATOM 0 HG1 THR A 87 -13.269 -9.054 -0.601 1.00 0.00 H new ATOM 0 HG21 THR A 87 -12.603 -7.562 -2.347 1.00 0.00 H new ATOM 0 HG22 THR A 87 -10.939 -6.935 -2.283 1.00 0.00 H new ATOM 0 HG23 THR A 87 -11.232 -8.642 -2.692 1.00 0.00 H new ATOM 1405 N ALA A 88 -8.945 -8.224 -2.356 1.00 0.00 N ATOM 1406 CA ALA A 88 -8.241 -8.651 -3.559 1.00 0.00 C ATOM 1407 C ALA A 88 -6.949 -9.382 -3.209 1.00 0.00 C ATOM 1408 O ALA A 88 -6.503 -10.261 -3.947 1.00 0.00 O ATOM 1409 CB ALA A 88 -7.948 -7.454 -4.452 1.00 0.00 C ATOM 0 H ALA A 88 -9.118 -7.220 -2.303 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.885 -9.345 -4.100 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.422 -7.788 -5.347 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -8.885 -6.976 -4.739 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.327 -6.740 -3.911 1.00 0.00 H new ATOM 1415 N CYS A 89 -6.353 -9.012 -2.081 1.00 0.00 N ATOM 1416 CA CYS A 89 -5.111 -9.632 -1.634 1.00 0.00 C ATOM 1417 C CYS A 89 -5.331 -11.100 -1.282 1.00 0.00 C ATOM 1418 O CYS A 89 -4.378 -11.870 -1.164 1.00 0.00 O ATOM 1419 CB CYS A 89 -4.550 -8.884 -0.424 1.00 0.00 C ATOM 1420 SG CYS A 89 -3.482 -7.488 -0.849 1.00 0.00 S ATOM 0 H CYS A 89 -6.710 -8.286 -1.460 1.00 0.00 H new ATOM 0 HA CYS A 89 -4.392 -9.577 -2.452 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -5.380 -8.521 0.182 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -3.987 -9.584 0.193 1.00 0.00 H new ATOM 0 HG CYS A 89 -3.938 -6.407 -0.290 1.00 0.00 H new ATOM 1426 N CYS A 90 -6.593 -11.480 -1.116 1.00 0.00 N ATOM 1427 CA CYS A 90 -6.939 -12.855 -0.775 1.00 0.00 C ATOM 1428 C CYS A 90 -7.839 -13.470 -1.842 1.00 0.00 C ATOM 1429 O CYS A 90 -7.941 -14.691 -1.953 1.00 0.00 O ATOM 1430 CB CYS A 90 -7.634 -12.906 0.587 1.00 0.00 C ATOM 1431 SG CYS A 90 -7.823 -14.574 1.258 1.00 0.00 S ATOM 0 H CYS A 90 -7.393 -10.855 -1.212 1.00 0.00 H new ATOM 0 HA CYS A 90 -6.017 -13.434 -0.726 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -7.066 -12.303 1.296 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -8.619 -12.448 0.497 1.00 0.00 H new ATOM 0 HG CYS A 90 -6.671 -15.006 1.677 1.00 0.00 H new ATOM 1437 N GLU A 91 -8.491 -12.615 -2.623 1.00 0.00 N ATOM 1438 CA GLU A 91 -9.385 -13.075 -3.679 1.00 0.00 C ATOM 1439 C GLU A 91 -8.646 -13.179 -5.010 1.00 0.00 C ATOM 1440 O GLU A 91 -8.783 -14.165 -5.735 1.00 0.00 O ATOM 1441 CB GLU A 91 -10.577 -12.126 -3.818 1.00 0.00 C ATOM 1442 CG GLU A 91 -11.498 -12.124 -2.609 1.00 0.00 C ATOM 1443 CD GLU A 91 -12.576 -13.186 -2.695 1.00 0.00 C ATOM 1444 OE1 GLU A 91 -13.477 -13.050 -3.549 1.00 0.00 O ATOM 1445 OE2 GLU A 91 -12.519 -14.154 -1.908 1.00 0.00 O ATOM 0 H GLU A 91 -8.417 -11.601 -2.545 1.00 0.00 H new ATOM 0 HA GLU A 91 -9.749 -14.066 -3.406 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -10.208 -11.114 -3.984 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -11.152 -12.405 -4.701 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -10.907 -12.283 -1.707 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -11.966 -11.144 -2.515 1.00 0.00 H new ATOM 1452 N THR A 92 -7.861 -12.153 -5.326 1.00 0.00 N ATOM 1453 CA THR A 92 -7.101 -12.127 -6.570 1.00 0.00 C ATOM 1454 C THR A 92 -5.802 -12.913 -6.437 1.00 0.00 C ATOM 1455 O THR A 92 -5.514 -13.798 -7.244 1.00 0.00 O ATOM 1456 CB THR A 92 -6.773 -10.684 -6.997 1.00 0.00 C ATOM 1457 OG1 THR A 92 -7.983 -9.951 -7.218 1.00 0.00 O ATOM 1458 CG2 THR A 92 -5.930 -10.673 -8.264 1.00 0.00 C ATOM 0 H THR A 92 -7.735 -11.329 -4.738 1.00 0.00 H new ATOM 0 HA THR A 92 -7.727 -12.591 -7.333 1.00 0.00 H new ATOM 0 HB THR A 92 -6.204 -10.212 -6.196 1.00 0.00 H new ATOM 0 HG1 THR A 92 -7.771 -9.006 -7.365 1.00 0.00 H new ATOM 0 HG21 THR A 92 -5.711 -9.643 -8.546 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.997 -11.207 -8.085 1.00 0.00 H new ATOM 0 HG23 THR A 92 -6.478 -11.161 -9.070 1.00 0.00 H new ATOM 1466 N PHE A 93 -5.020 -12.586 -5.414 1.00 0.00 N ATOM 1467 CA PHE A 93 -3.750 -13.262 -5.175 1.00 0.00 C ATOM 1468 C PHE A 93 -3.951 -14.514 -4.326 1.00 0.00 C ATOM 1469 O PHE A 93 -3.586 -15.617 -4.730 1.00 0.00 O ATOM 1470 CB PHE A 93 -2.766 -12.316 -4.484 1.00 0.00 C ATOM 1471 CG PHE A 93 -2.267 -11.215 -5.376 1.00 0.00 C ATOM 1472 CD1 PHE A 93 -3.151 -10.318 -5.952 1.00 0.00 C ATOM 1473 CD2 PHE A 93 -0.913 -11.077 -5.637 1.00 0.00 C ATOM 1474 CE1 PHE A 93 -2.696 -9.303 -6.772 1.00 0.00 C ATOM 1475 CE2 PHE A 93 -0.451 -10.064 -6.457 1.00 0.00 C ATOM 1476 CZ PHE A 93 -1.344 -9.177 -7.026 1.00 0.00 C ATOM 0 H PHE A 93 -5.243 -11.857 -4.737 1.00 0.00 H new ATOM 0 HA PHE A 93 -3.339 -13.561 -6.140 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.249 -11.876 -3.612 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -1.915 -12.892 -4.120 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -4.209 -10.413 -5.758 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -0.211 -11.768 -5.195 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.396 -8.609 -7.214 1.00 0.00 H new ATOM 0 HE2 PHE A 93 0.607 -9.966 -6.652 1.00 0.00 H new ATOM 0 HZ PHE A 93 -0.986 -8.386 -7.668 1.00 0.00 H new ATOM 1486 N GLY A 94 -4.535 -14.333 -3.145 1.00 0.00 N ATOM 1487 CA GLY A 94 -4.774 -15.455 -2.256 1.00 0.00 C ATOM 1488 C GLY A 94 -3.723 -15.568 -1.169 1.00 0.00 C ATOM 1489 O GLY A 94 -3.069 -16.601 -1.034 1.00 0.00 O ATOM 0 H GLY A 94 -4.847 -13.430 -2.788 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.757 -15.348 -1.797 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.792 -16.377 -2.837 1.00 0.00 H new ATOM 1493 N MET A 95 -3.561 -14.502 -0.393 1.00 0.00 N ATOM 1494 CA MET A 95 -2.581 -14.486 0.688 1.00 0.00 C ATOM 1495 C MET A 95 -3.260 -14.686 2.039 1.00 0.00 C ATOM 1496 O MET A 95 -4.481 -14.818 2.118 1.00 0.00 O ATOM 1497 CB MET A 95 -1.807 -13.167 0.684 1.00 0.00 C ATOM 1498 CG MET A 95 -0.692 -13.120 -0.349 1.00 0.00 C ATOM 1499 SD MET A 95 -0.125 -11.441 -0.683 1.00 0.00 S ATOM 1500 CE MET A 95 0.636 -11.022 0.883 1.00 0.00 C ATOM 0 H MET A 95 -4.095 -13.638 -0.492 1.00 0.00 H new ATOM 0 HA MET A 95 -1.884 -15.308 0.526 1.00 0.00 H new ATOM 0 HB2 MET A 95 -2.501 -12.348 0.495 1.00 0.00 H new ATOM 0 HB3 MET A 95 -1.381 -13.002 1.674 1.00 0.00 H new ATOM 0 HG2 MET A 95 0.148 -13.720 0.001 1.00 0.00 H new ATOM 0 HG3 MET A 95 -1.042 -13.572 -1.277 1.00 0.00 H new ATOM 0 HE1 MET A 95 1.328 -10.192 0.741 1.00 0.00 H new ATOM 0 HE2 MET A 95 -0.136 -10.734 1.597 1.00 0.00 H new ATOM 0 HE3 MET A 95 1.180 -11.886 1.266 1.00 0.00 H new ATOM 1510 N ARG A 96 -2.460 -14.708 3.101 1.00 0.00 N ATOM 1511 CA ARG A 96 -2.984 -14.893 4.448 1.00 0.00 C ATOM 1512 C ARG A 96 -3.583 -13.596 4.982 1.00 0.00 C ATOM 1513 O ARG A 96 -2.860 -12.672 5.355 1.00 0.00 O ATOM 1514 CB ARG A 96 -1.877 -15.380 5.386 1.00 0.00 C ATOM 1515 CG ARG A 96 -1.618 -16.875 5.298 1.00 0.00 C ATOM 1516 CD ARG A 96 -2.777 -17.676 5.872 1.00 0.00 C ATOM 1517 NE ARG A 96 -2.470 -19.102 5.952 1.00 0.00 N ATOM 1518 CZ ARG A 96 -3.381 -20.036 6.201 1.00 0.00 C ATOM 1519 NH1 ARG A 96 -4.648 -19.697 6.393 1.00 0.00 N ATOM 1520 NH2 ARG A 96 -3.024 -21.313 6.258 1.00 0.00 N ATOM 0 H ARG A 96 -1.447 -14.600 3.054 1.00 0.00 H new ATOM 0 HA ARG A 96 -3.772 -15.645 4.404 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -0.955 -14.846 5.155 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -2.144 -15.126 6.412 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -1.459 -17.157 4.257 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -0.703 -17.119 5.838 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -3.020 -17.301 6.866 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -3.661 -17.530 5.252 1.00 0.00 H new ATOM 0 HE ARG A 96 -1.504 -19.396 5.809 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -4.926 -18.717 6.350 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -5.345 -20.417 6.584 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -2.050 -21.577 6.111 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -3.724 -22.030 6.449 1.00 0.00 H new ATOM 1534 N LYS A 97 -4.910 -13.533 5.016 1.00 0.00 N ATOM 1535 CA LYS A 97 -5.608 -12.350 5.504 1.00 0.00 C ATOM 1536 C LYS A 97 -5.117 -11.963 6.896 1.00 0.00 C ATOM 1537 O LYS A 97 -5.291 -10.826 7.332 1.00 0.00 O ATOM 1538 CB LYS A 97 -7.118 -12.600 5.537 1.00 0.00 C ATOM 1539 CG LYS A 97 -7.820 -12.249 4.236 1.00 0.00 C ATOM 1540 CD LYS A 97 -9.158 -12.961 4.116 1.00 0.00 C ATOM 1541 CE LYS A 97 -10.255 -12.214 4.858 1.00 0.00 C ATOM 1542 NZ LYS A 97 -10.923 -11.204 3.990 1.00 0.00 N ATOM 0 H LYS A 97 -5.524 -14.288 4.711 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.396 -11.527 4.821 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.299 -13.650 5.766 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.557 -12.017 6.346 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.974 -11.171 4.184 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.185 -12.522 3.393 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -9.428 -13.056 3.064 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.071 -13.972 4.515 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.996 -12.925 5.224 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.831 -11.719 5.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -11.664 -10.716 4.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -10.221 -10.510 3.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -11.350 -11.679 3.170 1.00 0.00 H new ATOM 1556 N SER A 98 -4.501 -12.917 7.587 1.00 0.00 N ATOM 1557 CA SER A 98 -3.986 -12.677 8.930 1.00 0.00 C ATOM 1558 C SER A 98 -2.793 -11.727 8.892 1.00 0.00 C ATOM 1559 O SER A 98 -2.563 -10.966 9.831 1.00 0.00 O ATOM 1560 CB SER A 98 -3.580 -13.998 9.587 1.00 0.00 C ATOM 1561 OG SER A 98 -3.041 -13.780 10.879 1.00 0.00 O ATOM 0 H SER A 98 -4.346 -13.863 7.239 1.00 0.00 H new ATOM 0 HA SER A 98 -4.778 -12.215 9.519 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.447 -14.655 9.657 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.845 -14.507 8.964 1.00 0.00 H new ATOM 0 HG SER A 98 -2.791 -14.639 11.278 1.00 0.00 H new ATOM 1567 N GLU A 99 -2.037 -11.779 7.800 1.00 0.00 N ATOM 1568 CA GLU A 99 -0.867 -10.923 7.640 1.00 0.00 C ATOM 1569 C GLU A 99 -1.280 -9.499 7.279 1.00 0.00 C ATOM 1570 O GLU A 99 -0.648 -8.531 7.704 1.00 0.00 O ATOM 1571 CB GLU A 99 0.060 -11.487 6.561 1.00 0.00 C ATOM 1572 CG GLU A 99 -0.237 -10.959 5.167 1.00 0.00 C ATOM 1573 CD GLU A 99 0.649 -11.584 4.106 1.00 0.00 C ATOM 1574 OE1 GLU A 99 0.471 -12.786 3.819 1.00 0.00 O ATOM 1575 OE2 GLU A 99 1.518 -10.871 3.563 1.00 0.00 O ATOM 0 H GLU A 99 -2.213 -12.404 7.014 1.00 0.00 H new ATOM 0 HA GLU A 99 -0.334 -10.898 8.590 1.00 0.00 H new ATOM 0 HB2 GLU A 99 1.092 -11.248 6.819 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -0.023 -12.574 6.554 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -1.282 -11.153 4.924 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -0.103 -9.877 5.156 1.00 0.00 H new ATOM 1582 N LEU A 100 -2.343 -9.379 6.492 1.00 0.00 N ATOM 1583 CA LEU A 100 -2.841 -8.074 6.072 1.00 0.00 C ATOM 1584 C LEU A 100 -2.983 -7.136 7.266 1.00 0.00 C ATOM 1585 O LEU A 100 -3.048 -7.579 8.413 1.00 0.00 O ATOM 1586 CB LEU A 100 -4.188 -8.224 5.363 1.00 0.00 C ATOM 1587 CG LEU A 100 -4.212 -9.169 4.161 1.00 0.00 C ATOM 1588 CD1 LEU A 100 -5.623 -9.292 3.607 1.00 0.00 C ATOM 1589 CD2 LEU A 100 -3.254 -8.686 3.083 1.00 0.00 C ATOM 0 H LEU A 100 -2.877 -10.170 6.132 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.119 -7.643 5.379 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.921 -8.574 6.090 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.513 -7.238 5.031 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.886 -10.155 4.492 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.621 -9.968 2.752 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.284 -9.685 4.379 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.977 -8.310 3.292 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.285 -9.371 2.236 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.548 -7.689 2.755 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.241 -8.651 3.485 1.00 0.00 H new ATOM 1601 N PHE A 101 -3.034 -5.837 6.989 1.00 0.00 N ATOM 1602 CA PHE A 101 -3.170 -4.836 8.040 1.00 0.00 C ATOM 1603 C PHE A 101 -4.636 -4.467 8.254 1.00 0.00 C ATOM 1604 O PHE A 101 -5.475 -4.689 7.382 1.00 0.00 O ATOM 1605 CB PHE A 101 -2.364 -3.584 7.690 1.00 0.00 C ATOM 1606 CG PHE A 101 -2.795 -2.933 6.406 1.00 0.00 C ATOM 1607 CD1 PHE A 101 -2.364 -3.427 5.185 1.00 0.00 C ATOM 1608 CD2 PHE A 101 -3.631 -1.828 6.421 1.00 0.00 C ATOM 1609 CE1 PHE A 101 -2.759 -2.830 4.003 1.00 0.00 C ATOM 1610 CE2 PHE A 101 -4.029 -1.227 5.242 1.00 0.00 C ATOM 1611 CZ PHE A 101 -3.593 -1.729 4.031 1.00 0.00 C ATOM 0 H PHE A 101 -2.983 -5.453 6.045 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.782 -5.263 8.965 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.456 -2.863 8.502 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.309 -3.849 7.618 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -1.712 -4.288 5.157 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -3.975 -1.432 7.365 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -2.416 -3.224 3.058 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -4.680 -0.366 5.267 1.00 0.00 H new ATOM 0 HZ PHE A 101 -3.903 -1.262 3.108 1.00 0.00 H new ATOM 1621 N GLU A 102 -4.934 -3.904 9.420 1.00 0.00 N ATOM 1622 CA GLU A 102 -6.298 -3.506 9.748 1.00 0.00 C ATOM 1623 C GLU A 102 -6.779 -2.395 8.820 1.00 0.00 C ATOM 1624 O GLU A 102 -6.044 -1.942 7.943 1.00 0.00 O ATOM 1625 CB GLU A 102 -6.381 -3.040 11.204 1.00 0.00 C ATOM 1626 CG GLU A 102 -5.933 -4.092 12.205 1.00 0.00 C ATOM 1627 CD GLU A 102 -6.947 -5.206 12.374 1.00 0.00 C ATOM 1628 OE1 GLU A 102 -7.895 -5.030 13.168 1.00 0.00 O ATOM 1629 OE2 GLU A 102 -6.794 -6.254 11.712 1.00 0.00 O ATOM 0 H GLU A 102 -4.250 -3.713 10.153 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.944 -4.374 9.614 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -5.767 -2.148 11.327 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.408 -2.752 11.427 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -4.983 -4.517 11.880 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -5.756 -3.618 13.170 1.00 0.00 H new ATOM 1636 N ALA A 103 -8.019 -1.960 9.019 1.00 0.00 N ATOM 1637 CA ALA A 103 -8.599 -0.902 8.201 1.00 0.00 C ATOM 1638 C ALA A 103 -8.480 0.452 8.891 1.00 0.00 C ATOM 1639 O ALA A 103 -8.462 1.495 8.236 1.00 0.00 O ATOM 1640 CB ALA A 103 -10.056 -1.212 7.891 1.00 0.00 C ATOM 0 H ALA A 103 -8.642 -2.324 9.740 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.042 -0.854 7.265 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.476 -0.413 7.280 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.120 -2.156 7.349 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.618 -1.290 8.822 1.00 0.00 H new ATOM 1646 N PHE A 104 -8.398 0.431 10.217 1.00 0.00 N ATOM 1647 CA PHE A 104 -8.282 1.658 10.997 1.00 0.00 C ATOM 1648 C PHE A 104 -6.827 2.107 11.090 1.00 0.00 C ATOM 1649 O PHE A 104 -6.508 3.268 10.835 1.00 0.00 O ATOM 1650 CB PHE A 104 -8.856 1.452 12.400 1.00 0.00 C ATOM 1651 CG PHE A 104 -9.247 2.731 13.082 1.00 0.00 C ATOM 1652 CD1 PHE A 104 -10.406 3.398 12.719 1.00 0.00 C ATOM 1653 CD2 PHE A 104 -8.456 3.268 14.085 1.00 0.00 C ATOM 1654 CE1 PHE A 104 -10.770 4.576 13.345 1.00 0.00 C ATOM 1655 CE2 PHE A 104 -8.814 4.445 14.714 1.00 0.00 C ATOM 1656 CZ PHE A 104 -9.972 5.101 14.343 1.00 0.00 C ATOM 0 H PHE A 104 -8.410 -0.423 10.775 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.852 2.437 10.491 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -9.729 0.803 12.335 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -8.119 0.934 13.013 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -11.032 2.993 11.938 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.549 2.761 14.379 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.677 5.085 13.054 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.189 4.852 15.495 1.00 0.00 H new ATOM 0 HZ PHE A 104 -10.253 6.022 14.832 1.00 0.00 H new ATOM 1666 N ASP A 105 -5.950 1.180 11.458 1.00 0.00 N ATOM 1667 CA ASP A 105 -4.529 1.479 11.585 1.00 0.00 C ATOM 1668 C ASP A 105 -4.071 2.423 10.478 1.00 0.00 C ATOM 1669 O ASP A 105 -3.324 3.371 10.725 1.00 0.00 O ATOM 1670 CB ASP A 105 -3.709 0.189 11.544 1.00 0.00 C ATOM 1671 CG ASP A 105 -3.468 -0.299 10.129 1.00 0.00 C ATOM 1672 OD1 ASP A 105 -4.457 -0.477 9.386 1.00 0.00 O ATOM 1673 OD2 ASP A 105 -2.292 -0.503 9.764 1.00 0.00 O ATOM 0 H ASP A 105 -6.198 0.215 11.674 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.371 1.970 12.545 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -2.751 0.355 12.036 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -4.227 -0.586 12.109 1.00 0.00 H new ATOM 1678 N LEU A 106 -4.523 2.158 9.257 1.00 0.00 N ATOM 1679 CA LEU A 106 -4.159 2.983 8.111 1.00 0.00 C ATOM 1680 C LEU A 106 -4.929 4.300 8.121 1.00 0.00 C ATOM 1681 O LEU A 106 -4.340 5.376 8.017 1.00 0.00 O ATOM 1682 CB LEU A 106 -4.433 2.230 6.808 1.00 0.00 C ATOM 1683 CG LEU A 106 -4.040 2.953 5.519 1.00 0.00 C ATOM 1684 CD1 LEU A 106 -2.536 3.176 5.469 1.00 0.00 C ATOM 1685 CD2 LEU A 106 -4.505 2.166 4.302 1.00 0.00 C ATOM 0 H LEU A 106 -5.142 1.378 9.035 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.094 3.205 8.179 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -3.902 1.278 6.843 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -5.497 2.000 6.762 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.532 3.926 5.507 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.275 3.692 4.545 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.229 3.782 6.322 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.024 2.214 5.505 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.217 2.696 3.394 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.043 1.179 4.309 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.589 2.059 4.331 1.00 0.00 H new ATOM 1697 N PHE A 107 -6.248 4.207 8.251 1.00 0.00 N ATOM 1698 CA PHE A 107 -7.099 5.391 8.277 1.00 0.00 C ATOM 1699 C PHE A 107 -6.591 6.403 9.300 1.00 0.00 C ATOM 1700 O PHE A 107 -6.208 7.519 8.948 1.00 0.00 O ATOM 1701 CB PHE A 107 -8.542 5.001 8.602 1.00 0.00 C ATOM 1702 CG PHE A 107 -9.522 6.124 8.421 1.00 0.00 C ATOM 1703 CD1 PHE A 107 -9.540 6.864 7.249 1.00 0.00 C ATOM 1704 CD2 PHE A 107 -10.427 6.441 9.422 1.00 0.00 C ATOM 1705 CE1 PHE A 107 -10.440 7.899 7.080 1.00 0.00 C ATOM 1706 CE2 PHE A 107 -11.330 7.474 9.258 1.00 0.00 C ATOM 1707 CZ PHE A 107 -11.337 8.204 8.086 1.00 0.00 C ATOM 0 H PHE A 107 -6.751 3.324 8.340 1.00 0.00 H new ATOM 0 HA PHE A 107 -7.068 5.852 7.290 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -8.836 4.167 7.966 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -8.591 4.649 9.632 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -8.842 6.629 6.459 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -10.426 5.874 10.341 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -10.442 8.469 6.163 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -12.030 7.710 10.046 1.00 0.00 H new ATOM 0 HZ PHE A 107 -12.042 9.012 7.956 1.00 0.00 H new ATOM 1717 N ASP A 108 -6.592 6.005 10.567 1.00 0.00 N ATOM 1718 CA ASP A 108 -6.132 6.876 11.643 1.00 0.00 C ATOM 1719 C ASP A 108 -4.611 6.994 11.633 1.00 0.00 C ATOM 1720 O ASP A 108 -4.022 7.631 12.506 1.00 0.00 O ATOM 1721 CB ASP A 108 -6.606 6.345 12.996 1.00 0.00 C ATOM 1722 CG ASP A 108 -6.824 7.452 14.009 1.00 0.00 C ATOM 1723 OD1 ASP A 108 -6.234 8.539 13.836 1.00 0.00 O ATOM 1724 OD2 ASP A 108 -7.585 7.232 14.974 1.00 0.00 O ATOM 0 H ASP A 108 -6.906 5.085 10.875 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.557 7.867 11.482 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -7.536 5.792 12.861 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.870 5.641 13.385 1.00 0.00 H new ATOM 1729 N VAL A 109 -3.981 6.374 10.640 1.00 0.00 N ATOM 1730 CA VAL A 109 -2.529 6.409 10.516 1.00 0.00 C ATOM 1731 C VAL A 109 -1.856 6.075 11.843 1.00 0.00 C ATOM 1732 O VAL A 109 -0.891 6.728 12.243 1.00 0.00 O ATOM 1733 CB VAL A 109 -2.039 7.789 10.038 1.00 0.00 C ATOM 1734 CG1 VAL A 109 -0.534 7.775 9.818 1.00 0.00 C ATOM 1735 CG2 VAL A 109 -2.768 8.202 8.768 1.00 0.00 C ATOM 0 H VAL A 109 -4.454 5.841 9.910 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.257 5.658 9.774 1.00 0.00 H new ATOM 0 HB VAL A 109 -2.262 8.523 10.813 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -0.206 8.758 9.481 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.032 7.526 10.753 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.284 7.030 9.063 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -2.410 9.179 8.444 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.578 7.468 7.985 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.839 8.255 8.964 1.00 0.00 H new ATOM 1745 N ARG A 110 -2.371 5.055 12.521 1.00 0.00 N ATOM 1746 CA ARG A 110 -1.820 4.635 13.804 1.00 0.00 C ATOM 1747 C ARG A 110 -0.439 4.012 13.625 1.00 0.00 C ATOM 1748 O ARG A 110 0.551 4.508 14.163 1.00 0.00 O ATOM 1749 CB ARG A 110 -2.758 3.634 14.482 1.00 0.00 C ATOM 1750 CG ARG A 110 -4.208 4.090 14.524 1.00 0.00 C ATOM 1751 CD ARG A 110 -4.941 3.506 15.721 1.00 0.00 C ATOM 1752 NE ARG A 110 -4.594 4.191 16.964 1.00 0.00 N ATOM 1753 CZ ARG A 110 -4.724 3.642 18.166 1.00 0.00 C ATOM 1754 NH1 ARG A 110 -5.191 2.407 18.288 1.00 0.00 N ATOM 1755 NH2 ARG A 110 -4.387 4.329 19.250 1.00 0.00 N ATOM 0 H ARG A 110 -3.169 4.504 12.204 1.00 0.00 H new ATOM 0 HA ARG A 110 -1.722 5.518 14.436 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -2.701 2.681 13.956 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -2.412 3.457 15.500 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.247 5.178 14.568 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -4.712 3.789 13.605 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -6.016 3.576 15.557 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -4.701 2.447 15.812 1.00 0.00 H new ATOM 0 HE ARG A 110 -4.232 5.143 16.905 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -5.452 1.876 17.457 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -5.290 1.988 19.213 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -4.028 5.279 19.160 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -4.487 3.907 20.173 1.00 0.00 H new ATOM 1769 N ASP A 111 -0.380 2.923 12.866 1.00 0.00 N ATOM 1770 CA ASP A 111 0.879 2.233 12.616 1.00 0.00 C ATOM 1771 C ASP A 111 1.034 1.905 11.134 1.00 0.00 C ATOM 1772 O ASP A 111 0.503 0.905 10.650 1.00 0.00 O ATOM 1773 CB ASP A 111 0.957 0.950 13.445 1.00 0.00 C ATOM 1774 CG ASP A 111 0.736 1.203 14.924 1.00 0.00 C ATOM 1775 OD1 ASP A 111 1.474 2.028 15.502 1.00 0.00 O ATOM 1776 OD2 ASP A 111 -0.176 0.577 15.503 1.00 0.00 O ATOM 0 H ASP A 111 -1.190 2.499 12.413 1.00 0.00 H new ATOM 0 HA ASP A 111 1.692 2.896 12.911 1.00 0.00 H new ATOM 0 HB2 ASP A 111 0.211 0.242 13.085 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.933 0.486 13.300 1.00 0.00 H new ATOM 1781 N PHE A 112 1.763 2.754 10.418 1.00 0.00 N ATOM 1782 CA PHE A 112 1.985 2.556 8.990 1.00 0.00 C ATOM 1783 C PHE A 112 2.884 1.348 8.743 1.00 0.00 C ATOM 1784 O PHE A 112 2.678 0.591 7.796 1.00 0.00 O ATOM 1785 CB PHE A 112 2.612 3.808 8.372 1.00 0.00 C ATOM 1786 CG PHE A 112 2.694 3.758 6.873 1.00 0.00 C ATOM 1787 CD1 PHE A 112 1.544 3.657 6.106 1.00 0.00 C ATOM 1788 CD2 PHE A 112 3.920 3.814 6.231 1.00 0.00 C ATOM 1789 CE1 PHE A 112 1.617 3.611 4.726 1.00 0.00 C ATOM 1790 CE2 PHE A 112 3.999 3.768 4.851 1.00 0.00 C ATOM 1791 CZ PHE A 112 2.846 3.668 4.098 1.00 0.00 C ATOM 0 H PHE A 112 2.210 3.586 10.803 1.00 0.00 H new ATOM 0 HA PHE A 112 1.020 2.371 8.519 1.00 0.00 H new ATOM 0 HB2 PHE A 112 2.029 4.680 8.667 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.614 3.942 8.779 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.580 3.614 6.592 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.825 3.895 6.815 1.00 0.00 H new ATOM 0 HE1 PHE A 112 0.714 3.531 4.139 1.00 0.00 H new ATOM 0 HE2 PHE A 112 4.961 3.810 4.363 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.905 3.634 3.020 1.00 0.00 H new ATOM 1801 N GLY A 113 3.884 1.176 9.602 1.00 0.00 N ATOM 1802 CA GLY A 113 4.801 0.060 9.460 1.00 0.00 C ATOM 1803 C GLY A 113 4.084 -1.249 9.192 1.00 0.00 C ATOM 1804 O GLY A 113 4.481 -2.015 8.315 1.00 0.00 O ATOM 0 H GLY A 113 4.076 1.790 10.394 1.00 0.00 H new ATOM 0 HA2 GLY A 113 5.494 0.265 8.644 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.397 -0.035 10.368 1.00 0.00 H new ATOM 1808 N LYS A 114 3.024 -1.507 9.952 1.00 0.00 N ATOM 1809 CA LYS A 114 2.249 -2.732 9.794 1.00 0.00 C ATOM 1810 C LYS A 114 1.743 -2.875 8.362 1.00 0.00 C ATOM 1811 O LYS A 114 1.586 -3.986 7.857 1.00 0.00 O ATOM 1812 CB LYS A 114 1.068 -2.741 10.767 1.00 0.00 C ATOM 1813 CG LYS A 114 1.449 -3.140 12.182 1.00 0.00 C ATOM 1814 CD LYS A 114 0.270 -3.017 13.133 1.00 0.00 C ATOM 1815 CE LYS A 114 0.589 -3.610 14.496 1.00 0.00 C ATOM 1816 NZ LYS A 114 0.335 -5.077 14.536 1.00 0.00 N ATOM 0 H LYS A 114 2.682 -0.884 10.683 1.00 0.00 H new ATOM 0 HA LYS A 114 2.901 -3.577 10.016 1.00 0.00 H new ATOM 0 HB2 LYS A 114 0.617 -1.749 10.787 1.00 0.00 H new ATOM 0 HB3 LYS A 114 0.308 -3.429 10.397 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.815 -4.167 12.185 1.00 0.00 H new ATOM 0 HG3 LYS A 114 2.267 -2.509 12.531 1.00 0.00 H new ATOM 0 HD2 LYS A 114 0.000 -1.967 13.246 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -0.596 -3.524 12.708 1.00 0.00 H new ATOM 0 HE2 LYS A 114 1.633 -3.415 14.741 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -0.015 -3.116 15.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 0.565 -5.443 15.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -0.667 -5.262 14.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 0.930 -5.552 13.827 1.00 0.00 H new ATOM 1830 N VAL A 115 1.492 -1.743 7.712 1.00 0.00 N ATOM 1831 CA VAL A 115 1.006 -1.742 6.338 1.00 0.00 C ATOM 1832 C VAL A 115 2.136 -2.028 5.355 1.00 0.00 C ATOM 1833 O VAL A 115 1.948 -2.736 4.366 1.00 0.00 O ATOM 1834 CB VAL A 115 0.353 -0.395 5.974 1.00 0.00 C ATOM 1835 CG1 VAL A 115 -0.340 -0.486 4.623 1.00 0.00 C ATOM 1836 CG2 VAL A 115 -0.626 0.032 7.057 1.00 0.00 C ATOM 0 H VAL A 115 1.617 -0.815 8.115 1.00 0.00 H new ATOM 0 HA VAL A 115 0.258 -2.531 6.267 1.00 0.00 H new ATOM 0 HB VAL A 115 1.135 0.361 5.904 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.796 0.475 4.382 1.00 0.00 H new ATOM 0 HG12 VAL A 115 0.390 -0.744 3.856 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.112 -1.254 4.661 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.078 0.985 6.784 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -1.406 -0.723 7.161 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.097 0.140 8.004 1.00 0.00 H new ATOM 1846 N ILE A 116 3.311 -1.474 5.636 1.00 0.00 N ATOM 1847 CA ILE A 116 4.473 -1.672 4.778 1.00 0.00 C ATOM 1848 C ILE A 116 4.898 -3.136 4.757 1.00 0.00 C ATOM 1849 O ILE A 116 5.329 -3.652 3.726 1.00 0.00 O ATOM 1850 CB ILE A 116 5.664 -0.809 5.236 1.00 0.00 C ATOM 1851 CG1 ILE A 116 5.230 0.648 5.407 1.00 0.00 C ATOM 1852 CG2 ILE A 116 6.808 -0.914 4.238 1.00 0.00 C ATOM 1853 CD1 ILE A 116 6.308 1.534 5.992 1.00 0.00 C ATOM 0 H ILE A 116 3.483 -0.885 6.451 1.00 0.00 H new ATOM 0 HA ILE A 116 4.179 -1.368 3.773 1.00 0.00 H new ATOM 0 HB ILE A 116 6.013 -1.179 6.200 1.00 0.00 H new ATOM 0 HG12 ILE A 116 4.930 1.046 4.437 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.352 0.684 6.052 1.00 0.00 H new ATOM 0 HG21 ILE A 116 7.642 -0.299 4.575 1.00 0.00 H new ATOM 0 HG22 ILE A 116 7.130 -1.952 4.162 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.472 -0.566 3.261 1.00 0.00 H new ATOM 0 HD11 ILE A 116 5.931 2.552 6.085 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.592 1.161 6.976 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.179 1.528 5.337 1.00 0.00 H new ATOM 1865 N GLU A 117 4.772 -3.800 5.902 1.00 0.00 N ATOM 1866 CA GLU A 117 5.143 -5.206 6.013 1.00 0.00 C ATOM 1867 C GLU A 117 4.385 -6.051 4.994 1.00 0.00 C ATOM 1868 O GLU A 117 4.982 -6.826 4.246 1.00 0.00 O ATOM 1869 CB GLU A 117 4.862 -5.719 7.427 1.00 0.00 C ATOM 1870 CG GLU A 117 5.368 -7.131 7.674 1.00 0.00 C ATOM 1871 CD GLU A 117 4.765 -7.758 8.915 1.00 0.00 C ATOM 1872 OE1 GLU A 117 3.700 -8.400 8.799 1.00 0.00 O ATOM 1873 OE2 GLU A 117 5.358 -7.607 10.004 1.00 0.00 O ATOM 0 H GLU A 117 4.416 -3.388 6.764 1.00 0.00 H new ATOM 0 HA GLU A 117 6.210 -5.291 5.808 1.00 0.00 H new ATOM 0 HB2 GLU A 117 5.325 -5.045 8.148 1.00 0.00 H new ATOM 0 HB3 GLU A 117 3.788 -5.690 7.608 1.00 0.00 H new ATOM 0 HG2 GLU A 117 5.137 -7.752 6.809 1.00 0.00 H new ATOM 0 HG3 GLU A 117 6.453 -7.112 7.772 1.00 0.00 H new ATOM 1880 N THR A 118 3.065 -5.897 4.970 1.00 0.00 N ATOM 1881 CA THR A 118 2.224 -6.646 4.045 1.00 0.00 C ATOM 1882 C THR A 118 2.827 -6.663 2.645 1.00 0.00 C ATOM 1883 O THR A 118 2.965 -7.721 2.030 1.00 0.00 O ATOM 1884 CB THR A 118 0.803 -6.055 3.972 1.00 0.00 C ATOM 1885 OG1 THR A 118 0.182 -6.115 5.261 1.00 0.00 O ATOM 1886 CG2 THR A 118 -0.045 -6.808 2.959 1.00 0.00 C ATOM 0 H THR A 118 2.555 -5.260 5.581 1.00 0.00 H new ATOM 0 HA THR A 118 2.166 -7.666 4.426 1.00 0.00 H new ATOM 0 HB THR A 118 0.881 -5.015 3.654 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.098 -5.209 5.626 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.044 -6.373 2.925 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.416 -6.736 1.974 1.00 0.00 H new ATOM 0 HG23 THR A 118 -0.116 -7.856 3.251 1.00 0.00 H new ATOM 1894 N LEU A 119 3.186 -5.485 2.146 1.00 0.00 N ATOM 1895 CA LEU A 119 3.775 -5.364 0.817 1.00 0.00 C ATOM 1896 C LEU A 119 5.016 -6.242 0.690 1.00 0.00 C ATOM 1897 O LEU A 119 5.103 -7.088 -0.200 1.00 0.00 O ATOM 1898 CB LEU A 119 4.136 -3.906 0.528 1.00 0.00 C ATOM 1899 CG LEU A 119 3.083 -2.866 0.909 1.00 0.00 C ATOM 1900 CD1 LEU A 119 3.554 -1.468 0.539 1.00 0.00 C ATOM 1901 CD2 LEU A 119 1.755 -3.179 0.233 1.00 0.00 C ATOM 0 H LEU A 119 3.079 -4.600 2.642 1.00 0.00 H new ATOM 0 HA LEU A 119 3.038 -5.700 0.088 1.00 0.00 H new ATOM 0 HB2 LEU A 119 5.059 -3.670 1.057 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.345 -3.809 -0.537 1.00 0.00 H new ATOM 0 HG LEU A 119 2.937 -2.904 1.989 1.00 0.00 H new ATOM 0 HD11 LEU A 119 2.791 -0.741 0.818 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.480 -1.244 1.069 1.00 0.00 H new ATOM 0 HD13 LEU A 119 3.729 -1.416 -0.536 1.00 0.00 H new ATOM 0 HD21 LEU A 119 1.017 -2.428 0.516 1.00 0.00 H new ATOM 0 HD22 LEU A 119 1.886 -3.169 -0.849 1.00 0.00 H new ATOM 0 HD23 LEU A 119 1.410 -4.164 0.548 1.00 0.00 H new ATOM 1913 N SER A 120 5.975 -6.036 1.589 1.00 0.00 N ATOM 1914 CA SER A 120 7.212 -6.808 1.577 1.00 0.00 C ATOM 1915 C SER A 120 6.933 -8.278 1.280 1.00 0.00 C ATOM 1916 O SER A 120 7.660 -8.918 0.521 1.00 0.00 O ATOM 1917 CB SER A 120 7.934 -6.675 2.919 1.00 0.00 C ATOM 1918 OG SER A 120 9.194 -7.321 2.887 1.00 0.00 O ATOM 0 H SER A 120 5.918 -5.341 2.334 1.00 0.00 H new ATOM 0 HA SER A 120 7.851 -6.411 0.788 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.069 -5.621 3.160 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.321 -7.107 3.710 1.00 0.00 H new ATOM 0 HG SER A 120 9.694 -7.024 2.098 1.00 0.00 H new ATOM 1924 N ARG A 121 5.874 -8.806 1.885 1.00 0.00 N ATOM 1925 CA ARG A 121 5.498 -10.201 1.687 1.00 0.00 C ATOM 1926 C ARG A 121 4.853 -10.402 0.319 1.00 0.00 C ATOM 1927 O ARG A 121 5.240 -11.294 -0.437 1.00 0.00 O ATOM 1928 CB ARG A 121 4.536 -10.653 2.787 1.00 0.00 C ATOM 1929 CG ARG A 121 5.100 -10.500 4.191 1.00 0.00 C ATOM 1930 CD ARG A 121 4.111 -10.974 5.244 1.00 0.00 C ATOM 1931 NE ARG A 121 4.778 -11.379 6.478 1.00 0.00 N ATOM 1932 CZ ARG A 121 5.363 -12.560 6.643 1.00 0.00 C ATOM 1933 NH1 ARG A 121 5.365 -13.447 5.657 1.00 0.00 N ATOM 1934 NH2 ARG A 121 5.950 -12.856 7.796 1.00 0.00 N ATOM 0 H ARG A 121 5.261 -8.289 2.516 1.00 0.00 H new ATOM 0 HA ARG A 121 6.404 -10.805 1.735 1.00 0.00 H new ATOM 0 HB2 ARG A 121 3.614 -10.077 2.710 1.00 0.00 H new ATOM 0 HB3 ARG A 121 4.274 -11.698 2.622 1.00 0.00 H new ATOM 0 HG2 ARG A 121 6.025 -11.070 4.277 1.00 0.00 H new ATOM 0 HG3 ARG A 121 5.352 -9.455 4.371 1.00 0.00 H new ATOM 0 HD2 ARG A 121 3.402 -10.175 5.461 1.00 0.00 H new ATOM 0 HD3 ARG A 121 3.536 -11.813 4.850 1.00 0.00 H new ATOM 0 HE ARG A 121 4.796 -10.719 7.256 1.00 0.00 H new ATOM 0 HH11 ARG A 121 4.916 -13.223 4.769 1.00 0.00 H new ATOM 0 HH12 ARG A 121 5.815 -14.353 5.787 1.00 0.00 H new ATOM 0 HH21 ARG A 121 5.952 -12.176 8.556 1.00 0.00 H new ATOM 0 HH22 ARG A 121 6.399 -13.763 7.922 1.00 0.00 H new ATOM 1948 N LEU A 122 3.868 -9.567 0.007 1.00 0.00 N ATOM 1949 CA LEU A 122 3.168 -9.653 -1.270 1.00 0.00 C ATOM 1950 C LEU A 122 4.148 -9.900 -2.413 1.00 0.00 C ATOM 1951 O LEU A 122 3.952 -10.801 -3.228 1.00 0.00 O ATOM 1952 CB LEU A 122 2.379 -8.368 -1.529 1.00 0.00 C ATOM 1953 CG LEU A 122 1.924 -8.139 -2.971 1.00 0.00 C ATOM 1954 CD1 LEU A 122 0.954 -9.227 -3.404 1.00 0.00 C ATOM 1955 CD2 LEU A 122 1.286 -6.765 -3.117 1.00 0.00 C ATOM 0 H LEU A 122 3.536 -8.823 0.621 1.00 0.00 H new ATOM 0 HA LEU A 122 2.476 -10.494 -1.221 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.498 -8.371 -0.887 1.00 0.00 H new ATOM 0 HB3 LEU A 122 2.993 -7.521 -1.224 1.00 0.00 H new ATOM 0 HG LEU A 122 2.799 -8.182 -3.619 1.00 0.00 H new ATOM 0 HD11 LEU A 122 0.641 -9.047 -4.433 1.00 0.00 H new ATOM 0 HD12 LEU A 122 1.444 -10.198 -3.338 1.00 0.00 H new ATOM 0 HD13 LEU A 122 0.081 -9.216 -2.752 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.968 -6.619 -4.149 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.421 -6.694 -2.458 1.00 0.00 H new ATOM 0 HD23 LEU A 122 2.011 -5.997 -2.849 1.00 0.00 H new ATOM 1967 N SER A 123 5.205 -9.096 -2.463 1.00 0.00 N ATOM 1968 CA SER A 123 6.216 -9.226 -3.506 1.00 0.00 C ATOM 1969 C SER A 123 6.520 -10.694 -3.787 1.00 0.00 C ATOM 1970 O SER A 123 6.621 -11.109 -4.942 1.00 0.00 O ATOM 1971 CB SER A 123 7.497 -8.497 -3.098 1.00 0.00 C ATOM 1972 OG SER A 123 8.194 -9.214 -2.094 1.00 0.00 O ATOM 0 H SER A 123 5.384 -8.348 -1.793 1.00 0.00 H new ATOM 0 HA SER A 123 5.824 -8.773 -4.417 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.139 -8.368 -3.969 1.00 0.00 H new ATOM 0 HB3 SER A 123 7.251 -7.500 -2.733 1.00 0.00 H new ATOM 0 HG SER A 123 7.696 -9.164 -1.251 1.00 0.00 H new ATOM 1978 N ARG A 124 6.665 -11.476 -2.723 1.00 0.00 N ATOM 1979 CA ARG A 124 6.959 -12.898 -2.853 1.00 0.00 C ATOM 1980 C ARG A 124 6.074 -13.541 -3.917 1.00 0.00 C ATOM 1981 O ARG A 124 6.539 -14.349 -4.722 1.00 0.00 O ATOM 1982 CB ARG A 124 6.760 -13.607 -1.513 1.00 0.00 C ATOM 1983 CG ARG A 124 5.329 -14.057 -1.268 1.00 0.00 C ATOM 1984 CD ARG A 124 5.148 -14.595 0.142 1.00 0.00 C ATOM 1985 NE ARG A 124 3.758 -14.950 0.418 1.00 0.00 N ATOM 1986 CZ ARG A 124 3.355 -15.518 1.549 1.00 0.00 C ATOM 1987 NH1 ARG A 124 4.232 -15.795 2.505 1.00 0.00 N ATOM 1988 NH2 ARG A 124 2.073 -15.810 1.727 1.00 0.00 N ATOM 0 H ARG A 124 6.584 -11.149 -1.760 1.00 0.00 H new ATOM 0 HA ARG A 124 8.000 -13.001 -3.159 1.00 0.00 H new ATOM 0 HB2 ARG A 124 7.417 -14.475 -1.470 1.00 0.00 H new ATOM 0 HB3 ARG A 124 7.064 -12.937 -0.709 1.00 0.00 H new ATOM 0 HG2 ARG A 124 4.650 -13.219 -1.429 1.00 0.00 H new ATOM 0 HG3 ARG A 124 5.060 -14.828 -1.990 1.00 0.00 H new ATOM 0 HD2 ARG A 124 5.780 -15.472 0.279 1.00 0.00 H new ATOM 0 HD3 ARG A 124 5.481 -13.847 0.861 1.00 0.00 H new ATOM 0 HE ARG A 124 3.059 -14.751 -0.297 1.00 0.00 H new ATOM 0 HH11 ARG A 124 5.218 -15.572 2.372 1.00 0.00 H new ATOM 0 HH12 ARG A 124 3.920 -16.231 3.373 1.00 0.00 H new ATOM 0 HH21 ARG A 124 1.395 -15.598 0.995 1.00 0.00 H new ATOM 0 HH22 ARG A 124 1.765 -16.246 2.596 1.00 0.00 H new ATOM 2002 N THR A 125 4.796 -13.176 -3.916 1.00 0.00 N ATOM 2003 CA THR A 125 3.845 -13.718 -4.878 1.00 0.00 C ATOM 2004 C THR A 125 4.447 -13.764 -6.278 1.00 0.00 C ATOM 2005 O THR A 125 5.238 -12.906 -6.669 1.00 0.00 O ATOM 2006 CB THR A 125 2.549 -12.887 -4.916 1.00 0.00 C ATOM 2007 OG1 THR A 125 2.844 -11.535 -5.286 1.00 0.00 O ATOM 2008 CG2 THR A 125 1.853 -12.908 -3.564 1.00 0.00 C ATOM 0 H THR A 125 4.395 -12.507 -3.259 1.00 0.00 H new ATOM 0 HA THR A 125 3.608 -14.731 -4.553 1.00 0.00 H new ATOM 0 HB THR A 125 1.882 -13.328 -5.657 1.00 0.00 H new ATOM 0 HG1 THR A 125 3.260 -11.072 -4.529 1.00 0.00 H new ATOM 0 HG21 THR A 125 0.940 -12.314 -3.615 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.603 -13.935 -3.299 1.00 0.00 H new ATOM 0 HG23 THR A 125 2.516 -12.489 -2.807 1.00 0.00 H new ATOM 2016 N PRO A 126 4.064 -14.789 -7.054 1.00 0.00 N ATOM 2017 CA PRO A 126 4.553 -14.971 -8.424 1.00 0.00 C ATOM 2018 C PRO A 126 4.006 -13.916 -9.380 1.00 0.00 C ATOM 2019 O PRO A 126 4.315 -13.926 -10.572 1.00 0.00 O ATOM 2020 CB PRO A 126 4.033 -16.359 -8.805 1.00 0.00 C ATOM 2021 CG PRO A 126 2.834 -16.563 -7.945 1.00 0.00 C ATOM 2022 CD PRO A 126 3.124 -15.849 -6.654 1.00 0.00 C ATOM 0 HA PRO A 126 5.637 -14.875 -8.486 1.00 0.00 H new ATOM 0 HB2 PRO A 126 3.775 -16.408 -9.863 1.00 0.00 H new ATOM 0 HB3 PRO A 126 4.785 -17.127 -8.624 1.00 0.00 H new ATOM 0 HG2 PRO A 126 1.940 -16.161 -8.421 1.00 0.00 H new ATOM 0 HG3 PRO A 126 2.654 -17.624 -7.772 1.00 0.00 H new ATOM 0 HD2 PRO A 126 2.218 -15.436 -6.211 1.00 0.00 H new ATOM 0 HD3 PRO A 126 3.564 -16.518 -5.915 1.00 0.00 H new ATOM 2030 N ILE A 127 3.195 -13.008 -8.849 1.00 0.00 N ATOM 2031 CA ILE A 127 2.607 -11.945 -9.655 1.00 0.00 C ATOM 2032 C ILE A 127 3.439 -10.670 -9.576 1.00 0.00 C ATOM 2033 O ILE A 127 3.622 -9.973 -10.573 1.00 0.00 O ATOM 2034 CB ILE A 127 1.166 -11.633 -9.211 1.00 0.00 C ATOM 2035 CG1 ILE A 127 0.278 -12.868 -9.376 1.00 0.00 C ATOM 2036 CG2 ILE A 127 0.608 -10.463 -10.007 1.00 0.00 C ATOM 2037 CD1 ILE A 127 0.250 -13.760 -8.154 1.00 0.00 C ATOM 0 H ILE A 127 2.930 -12.987 -7.864 1.00 0.00 H new ATOM 0 HA ILE A 127 2.592 -12.302 -10.685 1.00 0.00 H new ATOM 0 HB ILE A 127 1.179 -11.357 -8.157 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.738 -12.547 -9.605 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.629 -13.447 -10.230 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.411 -10.255 -9.682 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.229 -9.582 -9.843 1.00 0.00 H new ATOM 0 HG23 ILE A 127 0.606 -10.713 -11.068 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.399 -14.615 -8.343 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.259 -14.111 -7.937 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.130 -13.197 -7.301 1.00 0.00 H new ATOM 2049 N ALA A 128 3.943 -10.372 -8.383 1.00 0.00 N ATOM 2050 CA ALA A 128 4.760 -9.183 -8.173 1.00 0.00 C ATOM 2051 C ALA A 128 6.133 -9.340 -8.818 1.00 0.00 C ATOM 2052 O ALA A 128 6.598 -8.453 -9.536 1.00 0.00 O ATOM 2053 CB ALA A 128 4.903 -8.896 -6.686 1.00 0.00 C ATOM 0 H ALA A 128 3.800 -10.938 -7.547 1.00 0.00 H new ATOM 0 HA ALA A 128 4.259 -8.339 -8.647 1.00 0.00 H new ATOM 0 HB1 ALA A 128 5.516 -8.006 -6.545 1.00 0.00 H new ATOM 0 HB2 ALA A 128 3.917 -8.731 -6.251 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.379 -9.745 -6.196 1.00 0.00 H new ATOM 2059 N LEU A 129 6.777 -10.472 -8.558 1.00 0.00 N ATOM 2060 CA LEU A 129 8.099 -10.745 -9.113 1.00 0.00 C ATOM 2061 C LEU A 129 8.042 -10.837 -10.635 1.00 0.00 C ATOM 2062 O LEU A 129 8.968 -10.415 -11.327 1.00 0.00 O ATOM 2063 CB LEU A 129 8.659 -12.044 -8.533 1.00 0.00 C ATOM 2064 CG LEU A 129 8.622 -12.170 -7.009 1.00 0.00 C ATOM 2065 CD1 LEU A 129 9.112 -13.542 -6.574 1.00 0.00 C ATOM 2066 CD2 LEU A 129 9.456 -11.073 -6.363 1.00 0.00 C ATOM 0 H LEU A 129 6.406 -11.216 -7.967 1.00 0.00 H new ATOM 0 HA LEU A 129 8.757 -9.920 -8.842 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.103 -12.879 -8.960 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.693 -12.149 -8.861 1.00 0.00 H new ATOM 0 HG LEU A 129 7.589 -12.055 -6.679 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.078 -13.613 -5.487 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.473 -14.311 -7.007 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.137 -13.687 -6.915 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.418 -11.178 -5.279 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.489 -11.155 -6.700 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.058 -10.099 -6.647 1.00 0.00 H new ATOM 2078 N ALA A 130 6.948 -11.391 -11.148 1.00 0.00 N ATOM 2079 CA ALA A 130 6.768 -11.534 -12.588 1.00 0.00 C ATOM 2080 C ALA A 130 7.205 -10.272 -13.324 1.00 0.00 C ATOM 2081 O ALA A 130 7.980 -10.334 -14.279 1.00 0.00 O ATOM 2082 CB ALA A 130 5.317 -11.860 -12.908 1.00 0.00 C ATOM 0 H ALA A 130 6.174 -11.748 -10.588 1.00 0.00 H new ATOM 0 HA ALA A 130 7.397 -12.357 -12.929 1.00 0.00 H new ATOM 0 HB1 ALA A 130 5.197 -11.964 -13.986 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.038 -12.794 -12.420 1.00 0.00 H new ATOM 0 HB3 ALA A 130 4.675 -11.056 -12.547 1.00 0.00 H new ATOM 2088 N THR A 131 6.702 -9.127 -12.875 1.00 0.00 N ATOM 2089 CA THR A 131 7.038 -7.850 -13.493 1.00 0.00 C ATOM 2090 C THR A 131 8.546 -7.699 -13.656 1.00 0.00 C ATOM 2091 O THR A 131 9.018 -7.087 -14.613 1.00 0.00 O ATOM 2092 CB THR A 131 6.501 -6.667 -12.665 1.00 0.00 C ATOM 2093 OG1 THR A 131 7.206 -6.579 -11.422 1.00 0.00 O ATOM 2094 CG2 THR A 131 5.012 -6.824 -12.399 1.00 0.00 C ATOM 0 H THR A 131 6.060 -9.057 -12.085 1.00 0.00 H new ATOM 0 HA THR A 131 6.566 -7.840 -14.476 1.00 0.00 H new ATOM 0 HB THR A 131 6.657 -5.752 -13.236 1.00 0.00 H new ATOM 0 HG1 THR A 131 7.029 -7.381 -10.888 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.656 -5.977 -11.813 1.00 0.00 H new ATOM 0 HG22 THR A 131 4.475 -6.861 -13.347 1.00 0.00 H new ATOM 0 HG23 THR A 131 4.836 -7.747 -11.846 1.00 0.00 H new ATOM 2102 N GLY A 132 9.298 -8.261 -12.714 1.00 0.00 N ATOM 2103 CA GLY A 132 10.746 -8.177 -12.773 1.00 0.00 C ATOM 2104 C GLY A 132 11.310 -7.186 -11.775 1.00 0.00 C ATOM 2105 O GLY A 132 12.488 -6.832 -11.840 1.00 0.00 O ATOM 0 H GLY A 132 8.931 -8.773 -11.912 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.172 -9.162 -12.583 1.00 0.00 H new ATOM 0 HA3 GLY A 132 11.049 -7.887 -13.779 1.00 0.00 H new ATOM 2109 N ILE A 133 10.469 -6.735 -10.851 1.00 0.00 N ATOM 2110 CA ILE A 133 10.891 -5.778 -9.836 1.00 0.00 C ATOM 2111 C ILE A 133 11.737 -6.453 -8.762 1.00 0.00 C ATOM 2112 O ILE A 133 11.450 -7.575 -8.345 1.00 0.00 O ATOM 2113 CB ILE A 133 9.682 -5.096 -9.168 1.00 0.00 C ATOM 2114 CG1 ILE A 133 8.844 -4.357 -10.213 1.00 0.00 C ATOM 2115 CG2 ILE A 133 10.148 -4.139 -8.081 1.00 0.00 C ATOM 2116 CD1 ILE A 133 7.431 -4.066 -9.759 1.00 0.00 C ATOM 0 H ILE A 133 9.491 -7.017 -10.784 1.00 0.00 H new ATOM 0 HA ILE A 133 11.489 -5.022 -10.344 1.00 0.00 H new ATOM 0 HB ILE A 133 9.059 -5.863 -8.707 1.00 0.00 H new ATOM 0 HG12 ILE A 133 9.337 -3.418 -10.464 1.00 0.00 H new ATOM 0 HG13 ILE A 133 8.808 -4.952 -11.125 1.00 0.00 H new ATOM 0 HG21 ILE A 133 9.283 -3.665 -7.618 1.00 0.00 H new ATOM 0 HG22 ILE A 133 10.707 -4.691 -7.325 1.00 0.00 H new ATOM 0 HG23 ILE A 133 10.789 -3.375 -8.520 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.896 -3.541 -10.550 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.920 -5.003 -9.535 1.00 0.00 H new ATOM 0 HD13 ILE A 133 7.457 -3.444 -8.864 1.00 0.00 H new ATOM 2128 N ARG A 134 12.781 -5.760 -8.317 1.00 0.00 N ATOM 2129 CA ARG A 134 13.669 -6.292 -7.290 1.00 0.00 C ATOM 2130 C ARG A 134 12.932 -6.453 -5.964 1.00 0.00 C ATOM 2131 O ARG A 134 12.157 -5.591 -5.548 1.00 0.00 O ATOM 2132 CB ARG A 134 14.878 -5.374 -7.107 1.00 0.00 C ATOM 2133 CG ARG A 134 15.797 -5.327 -8.317 1.00 0.00 C ATOM 2134 CD ARG A 134 16.716 -6.538 -8.366 1.00 0.00 C ATOM 2135 NE ARG A 134 17.747 -6.401 -9.391 1.00 0.00 N ATOM 2136 CZ ARG A 134 17.501 -6.466 -10.695 1.00 0.00 C ATOM 2137 NH1 ARG A 134 16.265 -6.664 -11.130 1.00 0.00 N ATOM 2138 NH2 ARG A 134 18.493 -6.331 -11.566 1.00 0.00 N ATOM 0 H ARG A 134 13.032 -4.830 -8.651 1.00 0.00 H new ATOM 0 HA ARG A 134 14.013 -7.274 -7.615 1.00 0.00 H new ATOM 0 HB2 ARG A 134 14.528 -4.365 -6.888 1.00 0.00 H new ATOM 0 HB3 ARG A 134 15.449 -5.708 -6.241 1.00 0.00 H new ATOM 0 HG2 ARG A 134 15.199 -5.285 -9.228 1.00 0.00 H new ATOM 0 HG3 ARG A 134 16.395 -4.416 -8.286 1.00 0.00 H new ATOM 0 HD2 ARG A 134 17.188 -6.675 -7.393 1.00 0.00 H new ATOM 0 HD3 ARG A 134 16.126 -7.433 -8.563 1.00 0.00 H new ATOM 0 HE ARG A 134 18.709 -6.247 -9.089 1.00 0.00 H new ATOM 0 HH11 ARG A 134 15.500 -6.767 -10.463 1.00 0.00 H new ATOM 0 HH12 ARG A 134 16.079 -6.714 -12.132 1.00 0.00 H new ATOM 0 HH21 ARG A 134 19.445 -6.177 -11.235 1.00 0.00 H new ATOM 0 HH22 ARG A 134 18.303 -6.381 -12.567 1.00 0.00 H new ATOM 2152 N PRO A 135 13.179 -7.581 -5.282 1.00 0.00 N ATOM 2153 CA PRO A 135 12.549 -7.881 -3.993 1.00 0.00 C ATOM 2154 C PRO A 135 13.059 -6.979 -2.875 1.00 0.00 C ATOM 2155 O PRO A 135 14.239 -6.631 -2.834 1.00 0.00 O ATOM 2156 CB PRO A 135 12.950 -9.335 -3.732 1.00 0.00 C ATOM 2157 CG PRO A 135 14.213 -9.523 -4.498 1.00 0.00 C ATOM 2158 CD PRO A 135 14.092 -8.652 -5.718 1.00 0.00 C ATOM 0 HA PRO A 135 11.471 -7.720 -4.019 1.00 0.00 H new ATOM 0 HB2 PRO A 135 13.101 -9.519 -2.668 1.00 0.00 H new ATOM 0 HB3 PRO A 135 12.177 -10.025 -4.068 1.00 0.00 H new ATOM 0 HG2 PRO A 135 15.078 -9.238 -3.900 1.00 0.00 H new ATOM 0 HG3 PRO A 135 14.348 -10.568 -4.777 1.00 0.00 H new ATOM 0 HD2 PRO A 135 15.059 -8.255 -6.026 1.00 0.00 H new ATOM 0 HD3 PRO A 135 13.688 -9.203 -6.567 1.00 0.00 H new ATOM 2166 N PHE A 136 12.163 -6.603 -1.969 1.00 0.00 N ATOM 2167 CA PHE A 136 12.523 -5.740 -0.849 1.00 0.00 C ATOM 2168 C PHE A 136 12.020 -6.321 0.469 1.00 0.00 C ATOM 2169 O PHE A 136 10.831 -6.586 0.647 1.00 0.00 O ATOM 2170 CB PHE A 136 11.947 -4.337 -1.054 1.00 0.00 C ATOM 2171 CG PHE A 136 10.573 -4.162 -0.472 1.00 0.00 C ATOM 2172 CD1 PHE A 136 9.456 -4.627 -1.147 1.00 0.00 C ATOM 2173 CD2 PHE A 136 10.399 -3.535 0.751 1.00 0.00 C ATOM 2174 CE1 PHE A 136 8.191 -4.467 -0.614 1.00 0.00 C ATOM 2175 CE2 PHE A 136 9.136 -3.372 1.289 1.00 0.00 C ATOM 2176 CZ PHE A 136 8.031 -3.840 0.606 1.00 0.00 C ATOM 0 H PHE A 136 11.182 -6.882 -1.988 1.00 0.00 H new ATOM 0 HA PHE A 136 13.610 -5.677 -0.806 1.00 0.00 H new ATOM 0 HB2 PHE A 136 12.620 -3.607 -0.603 1.00 0.00 H new ATOM 0 HB3 PHE A 136 11.911 -4.120 -2.122 1.00 0.00 H new ATOM 0 HD1 PHE A 136 9.575 -5.120 -2.100 1.00 0.00 H new ATOM 0 HD2 PHE A 136 11.260 -3.169 1.290 1.00 0.00 H new ATOM 0 HE1 PHE A 136 7.328 -4.832 -1.151 1.00 0.00 H new ATOM 0 HE2 PHE A 136 9.014 -2.879 2.242 1.00 0.00 H new ATOM 0 HZ PHE A 136 7.043 -3.716 1.025 1.00 0.00 H new ATOM 2186 N PRO A 137 12.948 -6.526 1.416 1.00 0.00 N ATOM 2187 CA PRO A 137 12.624 -7.078 2.735 1.00 0.00 C ATOM 2188 C PRO A 137 11.823 -6.102 3.591 1.00 0.00 C ATOM 2189 O PRO A 137 11.495 -5.000 3.151 1.00 0.00 O ATOM 2190 CB PRO A 137 13.998 -7.334 3.359 1.00 0.00 C ATOM 2191 CG PRO A 137 14.910 -6.376 2.674 1.00 0.00 C ATOM 2192 CD PRO A 137 14.384 -6.233 1.273 1.00 0.00 C ATOM 0 HA PRO A 137 12.001 -7.969 2.662 1.00 0.00 H new ATOM 0 HB2 PRO A 137 13.982 -7.164 4.436 1.00 0.00 H new ATOM 0 HB3 PRO A 137 14.317 -8.365 3.204 1.00 0.00 H new ATOM 0 HG2 PRO A 137 14.922 -5.414 3.186 1.00 0.00 H new ATOM 0 HG3 PRO A 137 15.935 -6.748 2.670 1.00 0.00 H new ATOM 0 HD2 PRO A 137 14.552 -5.230 0.881 1.00 0.00 H new ATOM 0 HD3 PRO A 137 14.870 -6.928 0.588 1.00 0.00 H new ATOM 2200 N SER A 138 11.513 -6.514 4.816 1.00 0.00 N ATOM 2201 CA SER A 138 10.748 -5.677 5.733 1.00 0.00 C ATOM 2202 C SER A 138 11.526 -5.431 7.022 1.00 0.00 C ATOM 2203 O SER A 138 12.169 -6.334 7.555 1.00 0.00 O ATOM 2204 CB SER A 138 9.403 -6.332 6.053 1.00 0.00 C ATOM 2205 OG SER A 138 9.584 -7.623 6.610 1.00 0.00 O ATOM 0 H SER A 138 11.780 -7.422 5.196 1.00 0.00 H new ATOM 0 HA SER A 138 10.571 -4.717 5.248 1.00 0.00 H new ATOM 0 HB2 SER A 138 8.847 -5.706 6.751 1.00 0.00 H new ATOM 0 HB3 SER A 138 8.805 -6.405 5.144 1.00 0.00 H new ATOM 0 HG SER A 138 8.710 -8.020 6.807 1.00 0.00 H new ATOM 2211 N GLY A 139 11.463 -4.198 7.517 1.00 0.00 N ATOM 2212 CA GLY A 139 12.166 -3.854 8.739 1.00 0.00 C ATOM 2213 C GLY A 139 13.473 -3.133 8.473 1.00 0.00 C ATOM 2214 O GLY A 139 13.963 -3.088 7.344 1.00 0.00 O ATOM 0 H GLY A 139 10.938 -3.432 7.094 1.00 0.00 H new ATOM 0 HA2 GLY A 139 11.526 -3.224 9.357 1.00 0.00 H new ATOM 0 HA3 GLY A 139 12.365 -4.762 9.308 1.00 0.00 H new ATOM 2218 N PRO A 140 14.058 -2.550 9.530 1.00 0.00 N ATOM 2219 CA PRO A 140 15.323 -1.816 9.430 1.00 0.00 C ATOM 2220 C PRO A 140 16.507 -2.737 9.157 1.00 0.00 C ATOM 2221 O PRO A 140 17.644 -2.281 9.031 1.00 0.00 O ATOM 2222 CB PRO A 140 15.461 -1.158 10.805 1.00 0.00 C ATOM 2223 CG PRO A 140 14.673 -2.029 11.722 1.00 0.00 C ATOM 2224 CD PRO A 140 13.530 -2.564 10.904 1.00 0.00 C ATOM 0 HA PRO A 140 15.319 -1.107 8.602 1.00 0.00 H new ATOM 0 HB2 PRO A 140 16.505 -1.100 11.113 1.00 0.00 H new ATOM 0 HB3 PRO A 140 15.074 -0.139 10.797 1.00 0.00 H new ATOM 0 HG2 PRO A 140 15.287 -2.841 12.113 1.00 0.00 H new ATOM 0 HG3 PRO A 140 14.308 -1.464 12.580 1.00 0.00 H new ATOM 0 HD2 PRO A 140 13.249 -3.570 11.216 1.00 0.00 H new ATOM 0 HD3 PRO A 140 12.641 -1.940 10.999 1.00 0.00 H new ATOM 2232 N SER A 141 16.234 -4.034 9.068 1.00 0.00 N ATOM 2233 CA SER A 141 17.279 -5.020 8.814 1.00 0.00 C ATOM 2234 C SER A 141 18.215 -4.546 7.707 1.00 0.00 C ATOM 2235 O SER A 141 17.769 -4.055 6.670 1.00 0.00 O ATOM 2236 CB SER A 141 16.658 -6.365 8.432 1.00 0.00 C ATOM 2237 OG SER A 141 17.532 -7.436 8.743 1.00 0.00 O ATOM 0 H SER A 141 15.298 -4.427 9.168 1.00 0.00 H new ATOM 0 HA SER A 141 17.859 -5.143 9.729 1.00 0.00 H new ATOM 0 HB2 SER A 141 15.714 -6.497 8.961 1.00 0.00 H new ATOM 0 HB3 SER A 141 16.431 -6.375 7.366 1.00 0.00 H new ATOM 0 HG SER A 141 17.112 -8.285 8.491 1.00 0.00 H new ATOM 2243 N SER A 142 19.516 -4.696 7.936 1.00 0.00 N ATOM 2244 CA SER A 142 20.516 -4.280 6.960 1.00 0.00 C ATOM 2245 C SER A 142 20.284 -4.967 5.618 1.00 0.00 C ATOM 2246 O SER A 142 19.806 -6.099 5.561 1.00 0.00 O ATOM 2247 CB SER A 142 21.922 -4.599 7.473 1.00 0.00 C ATOM 2248 OG SER A 142 22.031 -5.961 7.850 1.00 0.00 O ATOM 0 H SER A 142 19.902 -5.102 8.788 1.00 0.00 H new ATOM 0 HA SER A 142 20.424 -3.203 6.818 1.00 0.00 H new ATOM 0 HB2 SER A 142 22.655 -4.373 6.698 1.00 0.00 H new ATOM 0 HB3 SER A 142 22.154 -3.962 8.327 1.00 0.00 H new ATOM 0 HG SER A 142 22.939 -6.139 8.172 1.00 0.00 H new ATOM 2254 N GLY A 143 20.627 -4.272 4.537 1.00 0.00 N ATOM 2255 CA GLY A 143 20.449 -4.829 3.209 1.00 0.00 C ATOM 2256 C GLY A 143 18.993 -5.095 2.883 1.00 0.00 C ATOM 2257 O GLY A 143 18.205 -4.163 2.721 1.00 0.00 O ATOM 0 H GLY A 143 21.025 -3.333 4.558 1.00 0.00 H new ATOM 0 HA2 GLY A 143 20.864 -4.142 2.471 1.00 0.00 H new ATOM 0 HA3 GLY A 143 21.012 -5.759 3.130 1.00 0.00 H new TER 2261 GLY A 143