USER MOD reduce.3.24.130724 H: found=0, std=0, add=1060, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1055 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 123 HIS : no HD1:sc= -0.186 X(o=-0.19,f=-0.57) USER MOD Set 1.2: A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.3: A 127 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.000342) USER MOD Single : A 1 GLY N :NH3+ -133:sc= 0.00635 (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 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0142) USER MOD Single : A 14 GLN : amide:sc= -0.53 K(o=-0.53,f=-1.7) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 85:sc= 1.23 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -0.0908 K(o=-0.091,f=-2!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot -140:sc= 0.00119 USER MOD Single : A 37 MET CE :methyl -176:sc= -2.91 (180deg=-3.11) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 CYS SG : rot 180:sc= -0.765 USER MOD Single : A 42 SER OG : rot 174:sc= -1.71 USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= -2.02! C(o=-2!,f=-8!) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= -0.11 USER MOD Single : A 55 HIS : no HD1:sc=-0.00385 X(o=-0.0039,f=0) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 HIS : no HD1:sc= -0.709 X(o=-0.71,f=-0.35) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -0.0551 K(o=-0.055,f=-0.75) USER MOD Single : A 70 THR OG1 : rot 44:sc= 0.463 USER MOD Single : A 79 ASN : amide:sc= -0.0771 X(o=-0.077,f=-0.4) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl -158:sc= -1.26 (180deg=-3.2) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 TYR OH : rot 120:sc= -0.107 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -0.0737 X(o=-0.074,f=-0.074) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.064 USER MOD Single : A 114 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.29) USER MOD Single : A 122 MET CE :methyl 180:sc= -0.051 (180deg=-0.051) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -1.5 X(o=-1.5,f=-1.6) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.826 16.685 3.794 1.00 0.00 N ATOM 2 CA GLY A 1 -21.503 15.436 3.498 1.00 0.00 C ATOM 3 C GLY A 1 -21.101 14.321 4.442 1.00 0.00 C ATOM 4 O GLY A 1 -20.957 14.539 5.645 1.00 0.00 O ATOM 0 H1 GLY A 1 -21.518 17.462 3.801 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.369 16.620 4.726 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.105 16.870 3.067 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -22.581 15.587 3.558 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -21.279 15.139 2.473 1.00 0.00 H new ATOM 8 N SER A 2 -20.921 13.122 3.897 1.00 0.00 N ATOM 9 CA SER A 2 -20.538 11.967 4.701 1.00 0.00 C ATOM 10 C SER A 2 -20.054 10.824 3.813 1.00 0.00 C ATOM 11 O SER A 2 -20.349 10.783 2.619 1.00 0.00 O ATOM 12 CB SER A 2 -21.719 11.500 5.555 1.00 0.00 C ATOM 13 OG SER A 2 -22.818 11.123 4.743 1.00 0.00 O ATOM 0 H SER A 2 -21.034 12.925 2.903 1.00 0.00 H new ATOM 0 HA SER A 2 -19.720 12.266 5.357 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.413 10.656 6.173 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.020 12.299 6.232 1.00 0.00 H new ATOM 0 HG SER A 2 -23.559 10.827 5.312 1.00 0.00 H new ATOM 19 N SER A 3 -19.309 9.898 4.407 1.00 0.00 N ATOM 20 CA SER A 3 -18.779 8.756 3.670 1.00 0.00 C ATOM 21 C SER A 3 -19.351 7.448 4.211 1.00 0.00 C ATOM 22 O SER A 3 -19.699 7.349 5.387 1.00 0.00 O ATOM 23 CB SER A 3 -17.252 8.731 3.755 1.00 0.00 C ATOM 24 OG SER A 3 -16.679 9.713 2.909 1.00 0.00 O ATOM 0 H SER A 3 -19.059 9.915 5.396 1.00 0.00 H new ATOM 0 HA SER A 3 -19.076 8.859 2.626 1.00 0.00 H new ATOM 0 HB2 SER A 3 -16.939 8.905 4.784 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.885 7.744 3.473 1.00 0.00 H new ATOM 0 HG SER A 3 -15.702 9.678 2.982 1.00 0.00 H new ATOM 30 N GLY A 4 -19.444 6.446 3.343 1.00 0.00 N ATOM 31 CA GLY A 4 -19.974 5.158 3.750 1.00 0.00 C ATOM 32 C GLY A 4 -18.912 4.076 3.774 1.00 0.00 C ATOM 33 O GLY A 4 -18.153 3.920 2.818 1.00 0.00 O ATOM 0 H GLY A 4 -19.162 6.503 2.365 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -20.419 5.248 4.741 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -20.772 4.865 3.068 1.00 0.00 H new ATOM 37 N SER A 5 -18.858 3.327 4.871 1.00 0.00 N ATOM 38 CA SER A 5 -17.878 2.257 5.018 1.00 0.00 C ATOM 39 C SER A 5 -17.783 1.428 3.741 1.00 0.00 C ATOM 40 O SER A 5 -18.658 1.495 2.878 1.00 0.00 O ATOM 41 CB SER A 5 -18.247 1.357 6.198 1.00 0.00 C ATOM 42 OG SER A 5 -19.557 0.836 6.052 1.00 0.00 O ATOM 0 H SER A 5 -19.481 3.441 5.671 1.00 0.00 H new ATOM 0 HA SER A 5 -16.906 2.712 5.208 1.00 0.00 H new ATOM 0 HB2 SER A 5 -17.532 0.537 6.272 1.00 0.00 H new ATOM 0 HB3 SER A 5 -18.179 1.924 7.127 1.00 0.00 H new ATOM 0 HG SER A 5 -19.768 0.263 6.818 1.00 0.00 H new ATOM 48 N SER A 6 -16.714 0.646 3.629 1.00 0.00 N ATOM 49 CA SER A 6 -16.501 -0.194 2.456 1.00 0.00 C ATOM 50 C SER A 6 -16.505 -1.671 2.839 1.00 0.00 C ATOM 51 O SER A 6 -16.060 -2.044 3.923 1.00 0.00 O ATOM 52 CB SER A 6 -15.177 0.165 1.778 1.00 0.00 C ATOM 53 OG SER A 6 -15.315 1.323 0.973 1.00 0.00 O ATOM 0 H SER A 6 -15.982 0.577 4.336 1.00 0.00 H new ATOM 0 HA SER A 6 -17.318 -0.014 1.758 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.411 0.333 2.535 1.00 0.00 H new ATOM 0 HB3 SER A 6 -14.841 -0.671 1.164 1.00 0.00 H new ATOM 0 HG SER A 6 -14.455 1.533 0.552 1.00 0.00 H new ATOM 59 N GLY A 7 -17.011 -2.508 1.938 1.00 0.00 N ATOM 60 CA GLY A 7 -17.064 -3.935 2.198 1.00 0.00 C ATOM 61 C GLY A 7 -16.202 -4.731 1.239 1.00 0.00 C ATOM 62 O GLY A 7 -16.716 -5.415 0.354 1.00 0.00 O ATOM 0 H GLY A 7 -17.385 -2.223 1.033 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.738 -4.127 3.220 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.096 -4.277 2.123 1.00 0.00 H new ATOM 66 N ALA A 8 -14.888 -4.642 1.413 1.00 0.00 N ATOM 67 CA ALA A 8 -13.953 -5.361 0.557 1.00 0.00 C ATOM 68 C ALA A 8 -13.208 -6.438 1.338 1.00 0.00 C ATOM 69 O ALA A 8 -12.174 -6.170 1.950 1.00 0.00 O ATOM 70 CB ALA A 8 -12.968 -4.391 -0.080 1.00 0.00 C ATOM 0 H ALA A 8 -14.447 -4.079 2.140 1.00 0.00 H new ATOM 0 HA ALA A 8 -14.525 -5.852 -0.231 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -12.275 -4.941 -0.717 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -13.512 -3.662 -0.681 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -12.410 -3.874 0.701 1.00 0.00 H new ATOM 76 N GLU A 9 -13.741 -7.655 1.314 1.00 0.00 N ATOM 77 CA GLU A 9 -13.126 -8.772 2.023 1.00 0.00 C ATOM 78 C GLU A 9 -11.899 -9.282 1.273 1.00 0.00 C ATOM 79 O GLU A 9 -10.888 -9.636 1.881 1.00 0.00 O ATOM 80 CB GLU A 9 -14.135 -9.907 2.205 1.00 0.00 C ATOM 81 CG GLU A 9 -13.796 -10.845 3.351 1.00 0.00 C ATOM 82 CD GLU A 9 -14.814 -11.956 3.517 1.00 0.00 C ATOM 83 OE1 GLU A 9 -16.024 -11.651 3.554 1.00 0.00 O ATOM 84 OE2 GLU A 9 -14.401 -13.131 3.609 1.00 0.00 O ATOM 0 H GLU A 9 -14.596 -7.893 0.812 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.809 -8.417 3.004 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -15.123 -9.480 2.377 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -14.193 -10.482 1.281 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -12.812 -11.282 3.179 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -13.734 -10.273 4.277 1.00 0.00 H new ATOM 91 N PHE A 10 -11.995 -9.318 -0.052 1.00 0.00 N ATOM 92 CA PHE A 10 -10.894 -9.786 -0.886 1.00 0.00 C ATOM 93 C PHE A 10 -9.598 -9.062 -0.534 1.00 0.00 C ATOM 94 O PHE A 10 -8.537 -9.679 -0.431 1.00 0.00 O ATOM 95 CB PHE A 10 -11.222 -9.578 -2.365 1.00 0.00 C ATOM 96 CG PHE A 10 -10.280 -10.288 -3.295 1.00 0.00 C ATOM 97 CD1 PHE A 10 -9.058 -9.725 -3.627 1.00 0.00 C ATOM 98 CD2 PHE A 10 -10.616 -11.518 -3.837 1.00 0.00 C ATOM 99 CE1 PHE A 10 -8.188 -10.376 -4.481 1.00 0.00 C ATOM 100 CE2 PHE A 10 -9.750 -12.173 -4.692 1.00 0.00 C ATOM 101 CZ PHE A 10 -8.535 -11.601 -5.015 1.00 0.00 C ATOM 0 H PHE A 10 -12.824 -9.029 -0.571 1.00 0.00 H new ATOM 0 HA PHE A 10 -10.757 -10.851 -0.698 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -12.238 -9.925 -2.556 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.203 -8.511 -2.586 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -8.782 -8.766 -3.213 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -11.565 -11.970 -3.589 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -7.238 -9.927 -4.730 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -10.023 -13.132 -5.107 1.00 0.00 H new ATOM 0 HZ PHE A 10 -7.858 -12.111 -5.684 1.00 0.00 H new ATOM 111 N TYR A 11 -9.692 -7.750 -0.351 1.00 0.00 N ATOM 112 CA TYR A 11 -8.528 -6.940 -0.013 1.00 0.00 C ATOM 113 C TYR A 11 -8.166 -7.093 1.461 1.00 0.00 C ATOM 114 O TYR A 11 -6.993 -7.209 1.815 1.00 0.00 O ATOM 115 CB TYR A 11 -8.794 -5.468 -0.335 1.00 0.00 C ATOM 116 CG TYR A 11 -8.396 -5.073 -1.739 1.00 0.00 C ATOM 117 CD1 TYR A 11 -7.061 -4.890 -2.078 1.00 0.00 C ATOM 118 CD2 TYR A 11 -9.354 -4.883 -2.726 1.00 0.00 C ATOM 119 CE1 TYR A 11 -6.692 -4.529 -3.359 1.00 0.00 C ATOM 120 CE2 TYR A 11 -8.995 -4.523 -4.011 1.00 0.00 C ATOM 121 CZ TYR A 11 -7.663 -4.347 -4.322 1.00 0.00 C ATOM 122 OH TYR A 11 -7.301 -3.987 -5.600 1.00 0.00 O ATOM 0 H TYR A 11 -10.563 -7.224 -0.431 1.00 0.00 H new ATOM 0 HA TYR A 11 -7.687 -7.290 -0.612 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -9.855 -5.260 -0.195 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -8.251 -4.845 0.376 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -6.298 -5.033 -1.327 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -10.398 -5.019 -2.485 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -5.650 -4.390 -3.605 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -9.753 -4.380 -4.767 1.00 0.00 H new ATOM 0 HH TYR A 11 -8.104 -3.901 -6.155 1.00 0.00 H new ATOM 132 N ASP A 12 -9.184 -7.092 2.316 1.00 0.00 N ATOM 133 CA ASP A 12 -8.975 -7.233 3.752 1.00 0.00 C ATOM 134 C ASP A 12 -7.923 -8.297 4.047 1.00 0.00 C ATOM 135 O ASP A 12 -7.180 -8.198 5.024 1.00 0.00 O ATOM 136 CB ASP A 12 -10.290 -7.591 4.447 1.00 0.00 C ATOM 137 CG ASP A 12 -11.087 -6.365 4.846 1.00 0.00 C ATOM 138 OD1 ASP A 12 -10.953 -5.324 4.169 1.00 0.00 O ATOM 139 OD2 ASP A 12 -11.844 -6.446 5.836 1.00 0.00 O ATOM 0 H ASP A 12 -10.161 -6.995 2.039 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.617 -6.278 4.138 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -10.892 -8.211 3.782 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -10.078 -8.187 5.334 1.00 0.00 H new ATOM 144 N LYS A 13 -7.866 -9.317 3.197 1.00 0.00 N ATOM 145 CA LYS A 13 -6.905 -10.401 3.365 1.00 0.00 C ATOM 146 C LYS A 13 -5.481 -9.908 3.125 1.00 0.00 C ATOM 147 O LYS A 13 -4.551 -10.306 3.826 1.00 0.00 O ATOM 148 CB LYS A 13 -7.227 -11.549 2.406 1.00 0.00 C ATOM 149 CG LYS A 13 -8.337 -12.461 2.900 1.00 0.00 C ATOM 150 CD LYS A 13 -8.728 -13.485 1.848 1.00 0.00 C ATOM 151 CE LYS A 13 -9.605 -12.868 0.769 1.00 0.00 C ATOM 152 NZ LYS A 13 -11.047 -12.910 1.136 1.00 0.00 N ATOM 0 H LYS A 13 -8.474 -9.416 2.384 1.00 0.00 H new ATOM 0 HA LYS A 13 -6.978 -10.762 4.391 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -7.512 -11.134 1.439 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.326 -12.141 2.246 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -8.012 -12.974 3.805 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -9.208 -11.863 3.168 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -7.830 -13.903 1.394 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -9.259 -14.311 2.322 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -9.303 -11.834 0.602 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -9.454 -13.400 -0.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -11.617 -12.543 0.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -11.326 -13.892 1.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -11.207 -12.325 1.981 1.00 0.00 H new ATOM 166 N GLN A 14 -5.320 -9.040 2.131 1.00 0.00 N ATOM 167 CA GLN A 14 -4.010 -8.493 1.800 1.00 0.00 C ATOM 168 C GLN A 14 -3.627 -7.375 2.764 1.00 0.00 C ATOM 169 O GLN A 14 -2.466 -7.246 3.153 1.00 0.00 O ATOM 170 CB GLN A 14 -4.000 -7.970 0.363 1.00 0.00 C ATOM 171 CG GLN A 14 -3.887 -9.067 -0.683 1.00 0.00 C ATOM 172 CD GLN A 14 -3.855 -8.523 -2.098 1.00 0.00 C ATOM 173 OE1 GLN A 14 -3.117 -7.583 -2.397 1.00 0.00 O ATOM 174 NE2 GLN A 14 -4.656 -9.112 -2.978 1.00 0.00 N ATOM 0 H GLN A 14 -6.080 -8.701 1.541 1.00 0.00 H new ATOM 0 HA GLN A 14 -3.276 -9.294 1.892 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -4.914 -7.403 0.185 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -3.167 -7.278 0.243 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -2.982 -9.646 -0.500 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -4.730 -9.751 -0.580 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -5.251 -9.888 -2.687 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -4.676 -8.789 -3.945 1.00 0.00 H new ATOM 183 N LEU A 15 -4.611 -6.568 3.146 1.00 0.00 N ATOM 184 CA LEU A 15 -4.378 -5.459 4.064 1.00 0.00 C ATOM 185 C LEU A 15 -3.618 -5.927 5.301 1.00 0.00 C ATOM 186 O LEU A 15 -2.529 -5.435 5.598 1.00 0.00 O ATOM 187 CB LEU A 15 -5.707 -4.825 4.478 1.00 0.00 C ATOM 188 CG LEU A 15 -6.604 -4.342 3.338 1.00 0.00 C ATOM 189 CD1 LEU A 15 -7.872 -3.707 3.889 1.00 0.00 C ATOM 190 CD2 LEU A 15 -5.855 -3.358 2.451 1.00 0.00 C ATOM 0 H LEU A 15 -5.578 -6.661 2.834 1.00 0.00 H new ATOM 0 HA LEU A 15 -3.773 -4.714 3.548 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.264 -5.551 5.069 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -5.495 -3.978 5.131 1.00 0.00 H new ATOM 0 HG LEU A 15 -6.887 -5.204 2.733 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -8.498 -3.369 3.063 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -8.418 -4.441 4.482 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -7.609 -2.856 4.517 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -6.508 -3.025 1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -5.543 -2.498 3.044 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.977 -3.845 2.028 1.00 0.00 H new ATOM 202 N LYS A 16 -4.198 -6.883 6.019 1.00 0.00 N ATOM 203 CA LYS A 16 -3.575 -7.421 7.223 1.00 0.00 C ATOM 204 C LYS A 16 -2.144 -7.869 6.941 1.00 0.00 C ATOM 205 O LYS A 16 -1.253 -7.691 7.771 1.00 0.00 O ATOM 206 CB LYS A 16 -4.392 -8.598 7.761 1.00 0.00 C ATOM 207 CG LYS A 16 -4.177 -9.890 6.992 1.00 0.00 C ATOM 208 CD LYS A 16 -4.729 -11.087 7.748 1.00 0.00 C ATOM 209 CE LYS A 16 -4.255 -12.398 7.138 1.00 0.00 C ATOM 210 NZ LYS A 16 -2.920 -12.802 7.660 1.00 0.00 N ATOM 0 H LYS A 16 -5.099 -7.301 5.788 1.00 0.00 H new ATOM 0 HA LYS A 16 -3.549 -6.631 7.973 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -4.134 -8.761 8.807 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -5.450 -8.339 7.731 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -4.660 -9.819 6.018 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -3.112 -10.033 6.810 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.417 -11.036 8.791 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.818 -11.053 7.740 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -4.981 -13.182 7.353 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -4.206 -12.297 6.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -2.632 -13.700 7.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -2.221 -12.066 7.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -2.973 -12.923 8.692 1.00 0.00 H new ATOM 224 N VAL A 17 -1.931 -8.448 5.764 1.00 0.00 N ATOM 225 CA VAL A 17 -0.607 -8.918 5.372 1.00 0.00 C ATOM 226 C VAL A 17 0.338 -7.749 5.119 1.00 0.00 C ATOM 227 O VAL A 17 1.523 -7.812 5.449 1.00 0.00 O ATOM 228 CB VAL A 17 -0.675 -9.793 4.106 1.00 0.00 C ATOM 229 CG1 VAL A 17 0.723 -10.068 3.572 1.00 0.00 C ATOM 230 CG2 VAL A 17 -1.409 -11.093 4.396 1.00 0.00 C ATOM 0 H VAL A 17 -2.658 -8.603 5.065 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.225 -9.517 6.199 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.231 -9.252 3.340 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.656 -10.687 2.678 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.210 -9.125 3.324 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.306 -10.589 4.331 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.448 -11.699 3.491 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.883 -11.641 5.177 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -2.423 -10.872 4.728 1.00 0.00 H new ATOM 240 N LEU A 18 -0.193 -6.683 4.531 1.00 0.00 N ATOM 241 CA LEU A 18 0.604 -5.497 4.233 1.00 0.00 C ATOM 242 C LEU A 18 0.975 -4.755 5.513 1.00 0.00 C ATOM 243 O LEU A 18 2.146 -4.690 5.888 1.00 0.00 O ATOM 244 CB LEU A 18 -0.164 -4.565 3.295 1.00 0.00 C ATOM 245 CG LEU A 18 0.051 -4.793 1.798 1.00 0.00 C ATOM 246 CD1 LEU A 18 -0.877 -3.906 0.983 1.00 0.00 C ATOM 247 CD2 LEU A 18 1.503 -4.535 1.423 1.00 0.00 C ATOM 0 H LEU A 18 -1.171 -6.615 4.251 1.00 0.00 H new ATOM 0 HA LEU A 18 1.522 -5.820 3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -1.228 -4.664 3.508 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.113 -3.537 3.529 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.183 -5.833 1.572 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -0.709 -4.083 -0.079 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -1.913 -4.139 1.230 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.675 -2.860 1.213 1.00 0.00 H new ATOM 0 HD21 LEU A 18 1.638 -4.702 0.354 1.00 0.00 H new ATOM 0 HD22 LEU A 18 1.764 -3.505 1.665 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.149 -5.213 1.981 1.00 0.00 H new ATOM 259 N LEU A 19 -0.030 -4.199 6.181 1.00 0.00 N ATOM 260 CA LEU A 19 0.190 -3.463 7.421 1.00 0.00 C ATOM 261 C LEU A 19 1.067 -4.262 8.380 1.00 0.00 C ATOM 262 O LEU A 19 1.974 -3.717 9.008 1.00 0.00 O ATOM 263 CB LEU A 19 -1.147 -3.135 8.087 1.00 0.00 C ATOM 264 CG LEU A 19 -2.187 -2.447 7.202 1.00 0.00 C ATOM 265 CD1 LEU A 19 -3.559 -2.494 7.856 1.00 0.00 C ATOM 266 CD2 LEU A 19 -1.778 -1.009 6.918 1.00 0.00 C ATOM 0 H LEU A 19 -1.005 -4.244 5.885 1.00 0.00 H new ATOM 0 HA LEU A 19 0.704 -2.534 7.177 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.578 -4.061 8.466 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -0.954 -2.497 8.949 1.00 0.00 H new ATOM 0 HG LEU A 19 -2.241 -2.982 6.254 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.286 -2.000 7.212 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.855 -3.532 8.007 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.521 -1.984 8.819 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.530 -0.535 6.287 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.695 -0.462 7.857 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -0.816 -0.999 6.406 1.00 0.00 H new ATOM 278 N SER A 20 0.790 -5.558 8.487 1.00 0.00 N ATOM 279 CA SER A 20 1.552 -6.432 9.370 1.00 0.00 C ATOM 280 C SER A 20 3.051 -6.198 9.206 1.00 0.00 C ATOM 281 O SER A 20 3.764 -5.964 10.181 1.00 0.00 O ATOM 282 CB SER A 20 1.219 -7.897 9.084 1.00 0.00 C ATOM 283 OG SER A 20 0.121 -8.333 9.867 1.00 0.00 O ATOM 0 H SER A 20 0.043 -6.025 7.973 1.00 0.00 H new ATOM 0 HA SER A 20 1.276 -6.198 10.398 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.987 -8.021 8.026 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.089 -8.519 9.294 1.00 0.00 H new ATOM 0 HG SER A 20 -0.716 -8.102 9.413 1.00 0.00 H new ATOM 289 N GLY A 21 3.521 -6.263 7.964 1.00 0.00 N ATOM 290 CA GLY A 21 4.932 -6.056 7.693 1.00 0.00 C ATOM 291 C GLY A 21 5.680 -7.359 7.492 1.00 0.00 C ATOM 292 O GLY A 21 5.267 -8.404 7.994 1.00 0.00 O ATOM 0 H GLY A 21 2.950 -6.455 7.141 1.00 0.00 H new ATOM 0 HA2 GLY A 21 5.041 -5.437 6.803 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.381 -5.506 8.520 1.00 0.00 H new ATOM 296 N ALA A 22 6.784 -7.298 6.754 1.00 0.00 N ATOM 297 CA ALA A 22 7.591 -8.481 6.487 1.00 0.00 C ATOM 298 C ALA A 22 9.078 -8.142 6.487 1.00 0.00 C ATOM 299 O ALA A 22 9.464 -6.991 6.695 1.00 0.00 O ATOM 300 CB ALA A 22 7.190 -9.106 5.159 1.00 0.00 C ATOM 0 H ALA A 22 7.139 -6.441 6.331 1.00 0.00 H new ATOM 0 HA ALA A 22 7.409 -9.202 7.284 1.00 0.00 H new ATOM 0 HB1 ALA A 22 7.802 -9.989 4.973 1.00 0.00 H new ATOM 0 HB2 ALA A 22 6.139 -9.393 5.195 1.00 0.00 H new ATOM 0 HB3 ALA A 22 7.342 -8.384 4.357 1.00 0.00 H new ATOM 306 N THR A 23 9.911 -9.152 6.254 1.00 0.00 N ATOM 307 CA THR A 23 11.355 -8.962 6.229 1.00 0.00 C ATOM 308 C THR A 23 11.890 -9.000 4.802 1.00 0.00 C ATOM 309 O THR A 23 11.505 -9.857 4.006 1.00 0.00 O ATOM 310 CB THR A 23 12.078 -10.035 7.064 1.00 0.00 C ATOM 311 OG1 THR A 23 11.448 -10.167 8.344 1.00 0.00 O ATOM 312 CG2 THR A 23 13.545 -9.679 7.251 1.00 0.00 C ATOM 0 H THR A 23 9.609 -10.111 6.080 1.00 0.00 H new ATOM 0 HA THR A 23 11.552 -7.981 6.662 1.00 0.00 H new ATOM 0 HB THR A 23 12.016 -10.982 6.529 1.00 0.00 H new ATOM 0 HG1 THR A 23 11.913 -10.852 8.868 1.00 0.00 H new ATOM 0 HG21 THR A 23 14.034 -10.452 7.844 1.00 0.00 H new ATOM 0 HG22 THR A 23 14.029 -9.608 6.277 1.00 0.00 H new ATOM 0 HG23 THR A 23 13.624 -8.722 7.766 1.00 0.00 H new ATOM 320 N PHE A 24 12.781 -8.066 4.483 1.00 0.00 N ATOM 321 CA PHE A 24 13.369 -7.993 3.151 1.00 0.00 C ATOM 322 C PHE A 24 14.796 -7.457 3.215 1.00 0.00 C ATOM 323 O PHE A 24 15.261 -7.022 4.269 1.00 0.00 O ATOM 324 CB PHE A 24 12.518 -7.103 2.243 1.00 0.00 C ATOM 325 CG PHE A 24 11.041 -7.337 2.388 1.00 0.00 C ATOM 326 CD1 PHE A 24 10.323 -6.713 3.396 1.00 0.00 C ATOM 327 CD2 PHE A 24 10.371 -8.180 1.517 1.00 0.00 C ATOM 328 CE1 PHE A 24 8.964 -6.925 3.532 1.00 0.00 C ATOM 329 CE2 PHE A 24 9.012 -8.396 1.648 1.00 0.00 C ATOM 330 CZ PHE A 24 8.308 -7.769 2.657 1.00 0.00 C ATOM 0 H PHE A 24 13.111 -7.349 5.129 1.00 0.00 H new ATOM 0 HA PHE A 24 13.397 -9.001 2.738 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.736 -6.058 2.464 1.00 0.00 H new ATOM 0 HB3 PHE A 24 12.805 -7.276 1.206 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.832 -6.053 4.083 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.916 -8.674 0.727 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.416 -6.432 4.321 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.501 -9.055 0.962 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.246 -7.938 2.762 1.00 0.00 H new ATOM 340 N LEU A 25 15.486 -7.492 2.080 1.00 0.00 N ATOM 341 CA LEU A 25 16.861 -7.011 2.006 1.00 0.00 C ATOM 342 C LEU A 25 16.923 -5.643 1.333 1.00 0.00 C ATOM 343 O LEU A 25 16.631 -5.511 0.144 1.00 0.00 O ATOM 344 CB LEU A 25 17.731 -8.009 1.240 1.00 0.00 C ATOM 345 CG LEU A 25 18.366 -9.123 2.073 1.00 0.00 C ATOM 346 CD1 LEU A 25 19.031 -10.151 1.171 1.00 0.00 C ATOM 347 CD2 LEU A 25 19.372 -8.545 3.058 1.00 0.00 C ATOM 0 H LEU A 25 15.116 -7.848 1.199 1.00 0.00 H new ATOM 0 HA LEU A 25 17.241 -6.913 3.023 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.123 -8.467 0.460 1.00 0.00 H new ATOM 0 HB3 LEU A 25 18.527 -7.458 0.740 1.00 0.00 H new ATOM 0 HG LEU A 25 17.579 -9.621 2.639 1.00 0.00 H new ATOM 0 HD11 LEU A 25 19.477 -10.936 1.781 1.00 0.00 H new ATOM 0 HD12 LEU A 25 18.286 -10.588 0.506 1.00 0.00 H new ATOM 0 HD13 LEU A 25 19.807 -9.667 0.578 1.00 0.00 H new ATOM 0 HD21 LEU A 25 19.814 -9.352 3.642 1.00 0.00 H new ATOM 0 HD22 LEU A 25 20.156 -8.021 2.512 1.00 0.00 H new ATOM 0 HD23 LEU A 25 18.867 -7.847 3.726 1.00 0.00 H new ATOM 359 N VAL A 26 17.308 -4.629 2.100 1.00 0.00 N ATOM 360 CA VAL A 26 17.412 -3.271 1.577 1.00 0.00 C ATOM 361 C VAL A 26 18.861 -2.912 1.266 1.00 0.00 C ATOM 362 O VAL A 26 19.750 -3.089 2.099 1.00 0.00 O ATOM 363 CB VAL A 26 16.842 -2.242 2.571 1.00 0.00 C ATOM 364 CG1 VAL A 26 16.909 -0.840 1.985 1.00 0.00 C ATOM 365 CG2 VAL A 26 15.414 -2.603 2.951 1.00 0.00 C ATOM 0 H VAL A 26 17.553 -4.721 3.086 1.00 0.00 H new ATOM 0 HA VAL A 26 16.827 -3.240 0.658 1.00 0.00 H new ATOM 0 HB VAL A 26 17.450 -2.261 3.476 1.00 0.00 H new ATOM 0 HG11 VAL A 26 16.502 -0.126 2.701 1.00 0.00 H new ATOM 0 HG12 VAL A 26 17.947 -0.585 1.769 1.00 0.00 H new ATOM 0 HG13 VAL A 26 16.327 -0.802 1.064 1.00 0.00 H new ATOM 0 HG21 VAL A 26 15.027 -1.865 3.654 1.00 0.00 H new ATOM 0 HG22 VAL A 26 14.791 -2.614 2.057 1.00 0.00 H new ATOM 0 HG23 VAL A 26 15.399 -3.589 3.415 1.00 0.00 H new ATOM 375 N THR A 27 19.093 -2.406 0.058 1.00 0.00 N ATOM 376 CA THR A 27 20.434 -2.022 -0.365 1.00 0.00 C ATOM 377 C THR A 27 20.541 -0.513 -0.549 1.00 0.00 C ATOM 378 O THR A 27 19.749 0.093 -1.270 1.00 0.00 O ATOM 379 CB THR A 27 20.828 -2.718 -1.681 1.00 0.00 C ATOM 380 OG1 THR A 27 20.222 -4.013 -1.752 1.00 0.00 O ATOM 381 CG2 THR A 27 22.339 -2.853 -1.791 1.00 0.00 C ATOM 0 H THR A 27 18.369 -2.253 -0.644 1.00 0.00 H new ATOM 0 HA THR A 27 21.117 -2.338 0.423 1.00 0.00 H new ATOM 0 HB THR A 27 20.473 -2.106 -2.510 1.00 0.00 H new ATOM 0 HG1 THR A 27 20.476 -4.448 -2.593 1.00 0.00 H new ATOM 0 HG21 THR A 27 22.593 -3.348 -2.729 1.00 0.00 H new ATOM 0 HG22 THR A 27 22.795 -1.863 -1.768 1.00 0.00 H new ATOM 0 HG23 THR A 27 22.713 -3.445 -0.956 1.00 0.00 H new ATOM 389 N PHE A 28 21.527 0.090 0.108 1.00 0.00 N ATOM 390 CA PHE A 28 21.738 1.530 0.017 1.00 0.00 C ATOM 391 C PHE A 28 22.818 1.857 -1.010 1.00 0.00 C ATOM 392 O PHE A 28 23.829 1.162 -1.107 1.00 0.00 O ATOM 393 CB PHE A 28 22.128 2.097 1.383 1.00 0.00 C ATOM 394 CG PHE A 28 21.059 1.937 2.426 1.00 0.00 C ATOM 395 CD1 PHE A 28 19.801 2.486 2.237 1.00 0.00 C ATOM 396 CD2 PHE A 28 21.312 1.238 3.595 1.00 0.00 C ATOM 397 CE1 PHE A 28 18.816 2.341 3.196 1.00 0.00 C ATOM 398 CE2 PHE A 28 20.331 1.089 4.557 1.00 0.00 C ATOM 399 CZ PHE A 28 19.081 1.641 4.356 1.00 0.00 C ATOM 0 H PHE A 28 22.192 -0.396 0.709 1.00 0.00 H new ATOM 0 HA PHE A 28 20.804 1.990 -0.305 1.00 0.00 H new ATOM 0 HB2 PHE A 28 23.037 1.603 1.727 1.00 0.00 H new ATOM 0 HB3 PHE A 28 22.363 3.156 1.274 1.00 0.00 H new ATOM 0 HD1 PHE A 28 19.588 3.033 1.331 1.00 0.00 H new ATOM 0 HD2 PHE A 28 22.288 0.804 3.757 1.00 0.00 H new ATOM 0 HE1 PHE A 28 17.840 2.775 3.038 1.00 0.00 H new ATOM 0 HE2 PHE A 28 20.541 0.542 5.464 1.00 0.00 H new ATOM 0 HZ PHE A 28 18.312 1.525 5.105 1.00 0.00 H new ATOM 409 N GLY A 29 22.597 2.922 -1.774 1.00 0.00 N ATOM 410 CA GLY A 29 23.558 3.323 -2.784 1.00 0.00 C ATOM 411 C GLY A 29 24.983 3.311 -2.266 1.00 0.00 C ATOM 412 O GLY A 29 25.927 3.119 -3.031 1.00 0.00 O ATOM 0 H GLY A 29 21.769 3.514 -1.711 1.00 0.00 H new ATOM 0 HA2 GLY A 29 23.481 2.654 -3.641 1.00 0.00 H new ATOM 0 HA3 GLY A 29 23.312 4.324 -3.138 1.00 0.00 H new ATOM 416 N ASN A 30 25.138 3.518 -0.962 1.00 0.00 N ATOM 417 CA ASN A 30 26.458 3.531 -0.343 1.00 0.00 C ATOM 418 C ASN A 30 26.960 2.111 -0.099 1.00 0.00 C ATOM 419 O ASN A 30 28.110 1.788 -0.395 1.00 0.00 O ATOM 420 CB ASN A 30 26.417 4.303 0.978 1.00 0.00 C ATOM 421 CG ASN A 30 26.548 5.801 0.776 1.00 0.00 C ATOM 422 OD1 ASN A 30 26.805 6.269 -0.333 1.00 0.00 O ATOM 423 ND2 ASN A 30 26.372 6.560 1.851 1.00 0.00 N ATOM 0 H ASN A 30 24.366 3.679 -0.314 1.00 0.00 H new ATOM 0 HA ASN A 30 27.147 4.028 -1.026 1.00 0.00 H new ATOM 0 HB2 ASN A 30 25.480 4.089 1.492 1.00 0.00 H new ATOM 0 HB3 ASN A 30 27.222 3.954 1.625 1.00 0.00 H new ATOM 0 HD21 ASN A 30 26.448 7.574 1.777 1.00 0.00 H new ATOM 0 HD22 ASN A 30 26.160 6.129 2.751 1.00 0.00 H new ATOM 430 N SER A 31 26.088 1.267 0.444 1.00 0.00 N ATOM 431 CA SER A 31 26.443 -0.118 0.731 1.00 0.00 C ATOM 432 C SER A 31 26.070 -1.027 -0.437 1.00 0.00 C ATOM 433 O SER A 31 24.957 -0.963 -0.956 1.00 0.00 O ATOM 434 CB SER A 31 25.742 -0.593 2.005 1.00 0.00 C ATOM 435 OG SER A 31 24.334 -0.608 1.838 1.00 0.00 O ATOM 0 H SER A 31 25.131 1.518 0.694 1.00 0.00 H new ATOM 0 HA SER A 31 27.522 -0.168 0.878 1.00 0.00 H new ATOM 0 HB2 SER A 31 26.091 -1.592 2.265 1.00 0.00 H new ATOM 0 HB3 SER A 31 26.006 0.063 2.835 1.00 0.00 H new ATOM 0 HG SER A 31 23.910 -0.917 2.666 1.00 0.00 H new ATOM 441 N GLU A 32 27.012 -1.873 -0.843 1.00 0.00 N ATOM 442 CA GLU A 32 26.783 -2.795 -1.950 1.00 0.00 C ATOM 443 C GLU A 32 26.226 -4.123 -1.445 1.00 0.00 C ATOM 444 O GLU A 32 25.739 -4.942 -2.225 1.00 0.00 O ATOM 445 CB GLU A 32 28.083 -3.035 -2.720 1.00 0.00 C ATOM 446 CG GLU A 32 28.987 -4.076 -2.080 1.00 0.00 C ATOM 447 CD GLU A 32 29.620 -3.587 -0.792 1.00 0.00 C ATOM 448 OE1 GLU A 32 30.581 -2.793 -0.866 1.00 0.00 O ATOM 449 OE2 GLU A 32 29.153 -3.998 0.292 1.00 0.00 O ATOM 0 H GLU A 32 27.939 -1.939 -0.423 1.00 0.00 H new ATOM 0 HA GLU A 32 26.050 -2.344 -2.619 1.00 0.00 H new ATOM 0 HB2 GLU A 32 27.841 -3.351 -3.735 1.00 0.00 H new ATOM 0 HB3 GLU A 32 28.627 -2.094 -2.800 1.00 0.00 H new ATOM 0 HG2 GLU A 32 28.409 -4.978 -1.877 1.00 0.00 H new ATOM 0 HG3 GLU A 32 29.772 -4.352 -2.784 1.00 0.00 H new ATOM 456 N LYS A 33 26.300 -4.330 -0.135 1.00 0.00 N ATOM 457 CA LYS A 33 25.804 -5.557 0.477 1.00 0.00 C ATOM 458 C LYS A 33 24.445 -5.327 1.131 1.00 0.00 C ATOM 459 O LYS A 33 24.255 -4.396 1.913 1.00 0.00 O ATOM 460 CB LYS A 33 26.801 -6.073 1.516 1.00 0.00 C ATOM 461 CG LYS A 33 26.161 -6.910 2.610 1.00 0.00 C ATOM 462 CD LYS A 33 27.122 -7.958 3.146 1.00 0.00 C ATOM 463 CE LYS A 33 27.421 -9.024 2.103 1.00 0.00 C ATOM 464 NZ LYS A 33 27.798 -10.322 2.730 1.00 0.00 N ATOM 0 H LYS A 33 26.700 -3.662 0.525 1.00 0.00 H new ATOM 0 HA LYS A 33 25.689 -6.304 -0.308 1.00 0.00 H new ATOM 0 HB2 LYS A 33 27.562 -6.669 1.012 1.00 0.00 H new ATOM 0 HB3 LYS A 33 27.311 -5.224 1.971 1.00 0.00 H new ATOM 0 HG2 LYS A 33 25.838 -6.261 3.424 1.00 0.00 H new ATOM 0 HG3 LYS A 33 25.269 -7.399 2.220 1.00 0.00 H new ATOM 0 HD2 LYS A 33 28.051 -7.478 3.454 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.695 -8.425 4.033 1.00 0.00 H new ATOM 0 HE2 LYS A 33 26.546 -9.167 1.469 1.00 0.00 H new ATOM 0 HE3 LYS A 33 28.231 -8.684 1.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 27.994 -11.023 1.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 28.648 -10.191 3.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 27.016 -10.660 3.326 1.00 0.00 H new ATOM 478 N PRO A 34 23.476 -6.196 0.805 1.00 0.00 N ATOM 479 CA PRO A 34 22.119 -6.109 1.351 1.00 0.00 C ATOM 480 C PRO A 34 22.067 -6.458 2.835 1.00 0.00 C ATOM 481 O PRO A 34 22.876 -7.247 3.324 1.00 0.00 O ATOM 482 CB PRO A 34 21.340 -7.141 0.532 1.00 0.00 C ATOM 483 CG PRO A 34 22.368 -8.120 0.079 1.00 0.00 C ATOM 484 CD PRO A 34 23.631 -7.329 -0.122 1.00 0.00 C ATOM 0 HA PRO A 34 21.717 -5.098 1.283 1.00 0.00 H new ATOM 0 HB2 PRO A 34 20.571 -7.625 1.134 1.00 0.00 H new ATOM 0 HB3 PRO A 34 20.836 -6.676 -0.315 1.00 0.00 H new ATOM 0 HG2 PRO A 34 22.513 -8.905 0.821 1.00 0.00 H new ATOM 0 HG3 PRO A 34 22.062 -8.608 -0.846 1.00 0.00 H new ATOM 0 HD2 PRO A 34 24.517 -7.920 0.111 1.00 0.00 H new ATOM 0 HD3 PRO A 34 23.734 -6.993 -1.154 1.00 0.00 H new ATOM 492 N GLU A 35 21.112 -5.866 3.545 1.00 0.00 N ATOM 493 CA GLU A 35 20.957 -6.116 4.973 1.00 0.00 C ATOM 494 C GLU A 35 19.519 -6.503 5.305 1.00 0.00 C ATOM 495 O GLU A 35 18.571 -5.968 4.729 1.00 0.00 O ATOM 496 CB GLU A 35 21.362 -4.878 5.776 1.00 0.00 C ATOM 497 CG GLU A 35 21.261 -5.069 7.280 1.00 0.00 C ATOM 498 CD GLU A 35 22.262 -4.225 8.044 1.00 0.00 C ATOM 499 OE1 GLU A 35 22.425 -3.037 7.697 1.00 0.00 O ATOM 500 OE2 GLU A 35 22.883 -4.753 8.991 1.00 0.00 O ATOM 0 H GLU A 35 20.435 -5.211 3.155 1.00 0.00 H new ATOM 0 HA GLU A 35 21.610 -6.946 5.244 1.00 0.00 H new ATOM 0 HB2 GLU A 35 22.387 -4.609 5.520 1.00 0.00 H new ATOM 0 HB3 GLU A 35 20.729 -4.041 5.481 1.00 0.00 H new ATOM 0 HG2 GLU A 35 20.253 -4.816 7.608 1.00 0.00 H new ATOM 0 HG3 GLU A 35 21.419 -6.120 7.520 1.00 0.00 H new ATOM 507 N THR A 36 19.364 -7.437 6.238 1.00 0.00 N ATOM 508 CA THR A 36 18.043 -7.898 6.646 1.00 0.00 C ATOM 509 C THR A 36 17.304 -6.822 7.433 1.00 0.00 C ATOM 510 O THR A 36 17.610 -6.572 8.599 1.00 0.00 O ATOM 511 CB THR A 36 18.133 -9.174 7.504 1.00 0.00 C ATOM 512 OG1 THR A 36 18.901 -10.171 6.820 1.00 0.00 O ATOM 513 CG2 THR A 36 16.746 -9.718 7.812 1.00 0.00 C ATOM 0 H THR A 36 20.138 -7.889 6.725 1.00 0.00 H new ATOM 0 HA THR A 36 17.491 -8.121 5.733 1.00 0.00 H new ATOM 0 HB THR A 36 18.623 -8.920 8.444 1.00 0.00 H new ATOM 0 HG1 THR A 36 18.486 -11.049 6.950 1.00 0.00 H new ATOM 0 HG21 THR A 36 16.835 -10.619 8.419 1.00 0.00 H new ATOM 0 HG22 THR A 36 16.174 -8.968 8.358 1.00 0.00 H new ATOM 0 HG23 THR A 36 16.234 -9.957 6.880 1.00 0.00 H new ATOM 521 N MET A 37 16.330 -6.187 6.789 1.00 0.00 N ATOM 522 CA MET A 37 15.546 -5.138 7.431 1.00 0.00 C ATOM 523 C MET A 37 14.065 -5.502 7.450 1.00 0.00 C ATOM 524 O MET A 37 13.657 -6.522 6.895 1.00 0.00 O ATOM 525 CB MET A 37 15.747 -3.806 6.706 1.00 0.00 C ATOM 526 CG MET A 37 17.188 -3.321 6.713 1.00 0.00 C ATOM 527 SD MET A 37 17.334 -1.572 6.300 1.00 0.00 S ATOM 528 CE MET A 37 17.336 -0.837 7.934 1.00 0.00 C ATOM 0 H MET A 37 16.065 -6.380 5.823 1.00 0.00 H new ATOM 0 HA MET A 37 15.891 -5.038 8.460 1.00 0.00 H new ATOM 0 HB2 MET A 37 15.412 -3.909 5.674 1.00 0.00 H new ATOM 0 HB3 MET A 37 15.115 -3.049 7.172 1.00 0.00 H new ATOM 0 HG2 MET A 37 17.621 -3.495 7.698 1.00 0.00 H new ATOM 0 HG3 MET A 37 17.768 -3.908 6.001 1.00 0.00 H new ATOM 0 HE1 MET A 37 17.349 0.249 7.844 1.00 0.00 H new ATOM 0 HE2 MET A 37 16.440 -1.146 8.473 1.00 0.00 H new ATOM 0 HE3 MET A 37 18.220 -1.167 8.480 1.00 0.00 H new ATOM 538 N THR A 38 13.262 -4.660 8.094 1.00 0.00 N ATOM 539 CA THR A 38 11.826 -4.893 8.187 1.00 0.00 C ATOM 540 C THR A 38 11.041 -3.750 7.554 1.00 0.00 C ATOM 541 O THR A 38 11.258 -2.582 7.877 1.00 0.00 O ATOM 542 CB THR A 38 11.378 -5.059 9.652 1.00 0.00 C ATOM 543 OG1 THR A 38 12.178 -6.055 10.299 1.00 0.00 O ATOM 544 CG2 THR A 38 9.911 -5.453 9.727 1.00 0.00 C ATOM 0 H THR A 38 13.582 -3.810 8.559 1.00 0.00 H new ATOM 0 HA THR A 38 11.620 -5.816 7.644 1.00 0.00 H new ATOM 0 HB THR A 38 11.508 -4.103 10.159 1.00 0.00 H new ATOM 0 HG1 THR A 38 11.888 -6.153 11.230 1.00 0.00 H new ATOM 0 HG21 THR A 38 9.617 -5.565 10.771 1.00 0.00 H new ATOM 0 HG22 THR A 38 9.302 -4.679 9.259 1.00 0.00 H new ATOM 0 HG23 THR A 38 9.761 -6.398 9.205 1.00 0.00 H new ATOM 552 N CYS A 39 10.129 -4.094 6.652 1.00 0.00 N ATOM 553 CA CYS A 39 9.311 -3.096 5.973 1.00 0.00 C ATOM 554 C CYS A 39 7.829 -3.326 6.251 1.00 0.00 C ATOM 555 O CYS A 39 7.297 -4.404 5.983 1.00 0.00 O ATOM 556 CB CYS A 39 9.571 -3.132 4.467 1.00 0.00 C ATOM 557 SG CYS A 39 11.268 -2.720 4.001 1.00 0.00 S ATOM 0 H CYS A 39 9.937 -5.056 6.374 1.00 0.00 H new ATOM 0 HA CYS A 39 9.586 -2.114 6.359 1.00 0.00 H new ATOM 0 HB2 CYS A 39 9.334 -4.128 4.092 1.00 0.00 H new ATOM 0 HB3 CYS A 39 8.891 -2.436 3.975 1.00 0.00 H new ATOM 0 HG CYS A 39 11.390 -2.780 2.708 1.00 0.00 H new ATOM 563 N ARG A 40 7.168 -2.308 6.792 1.00 0.00 N ATOM 564 CA ARG A 40 5.748 -2.401 7.109 1.00 0.00 C ATOM 565 C ARG A 40 5.005 -1.150 6.649 1.00 0.00 C ATOM 566 O ARG A 40 5.613 -0.107 6.409 1.00 0.00 O ATOM 567 CB ARG A 40 5.552 -2.598 8.614 1.00 0.00 C ATOM 568 CG ARG A 40 6.205 -1.518 9.460 1.00 0.00 C ATOM 569 CD ARG A 40 7.627 -1.897 9.846 1.00 0.00 C ATOM 570 NE ARG A 40 8.218 -0.933 10.771 1.00 0.00 N ATOM 571 CZ ARG A 40 9.205 -1.230 11.609 1.00 0.00 C ATOM 572 NH1 ARG A 40 9.709 -2.456 11.638 1.00 0.00 N ATOM 573 NH2 ARG A 40 9.690 -0.299 12.420 1.00 0.00 N ATOM 0 H ARG A 40 7.593 -1.409 7.020 1.00 0.00 H new ATOM 0 HA ARG A 40 5.339 -3.261 6.580 1.00 0.00 H new ATOM 0 HB2 ARG A 40 4.484 -2.623 8.833 1.00 0.00 H new ATOM 0 HB3 ARG A 40 5.959 -3.568 8.901 1.00 0.00 H new ATOM 0 HG2 ARG A 40 6.215 -0.578 8.908 1.00 0.00 H new ATOM 0 HG3 ARG A 40 5.614 -1.353 10.361 1.00 0.00 H new ATOM 0 HD2 ARG A 40 7.627 -2.886 10.304 1.00 0.00 H new ATOM 0 HD3 ARG A 40 8.241 -1.962 8.948 1.00 0.00 H new ATOM 0 HE ARG A 40 7.853 0.019 10.774 1.00 0.00 H new ATOM 0 HH11 ARG A 40 9.339 -3.174 11.016 1.00 0.00 H new ATOM 0 HH12 ARG A 40 10.467 -2.681 12.283 1.00 0.00 H new ATOM 0 HH21 ARG A 40 9.305 0.645 12.400 1.00 0.00 H new ATOM 0 HH22 ARG A 40 10.448 -0.528 13.063 1.00 0.00 H new ATOM 587 N LEU A 41 3.687 -1.263 6.526 1.00 0.00 N ATOM 588 CA LEU A 41 2.860 -0.142 6.093 1.00 0.00 C ATOM 589 C LEU A 41 2.135 0.489 7.277 1.00 0.00 C ATOM 590 O LEU A 41 1.378 -0.178 7.982 1.00 0.00 O ATOM 591 CB LEU A 41 1.845 -0.606 5.047 1.00 0.00 C ATOM 592 CG LEU A 41 2.265 -0.445 3.586 1.00 0.00 C ATOM 593 CD1 LEU A 41 1.362 -1.264 2.677 1.00 0.00 C ATOM 594 CD2 LEU A 41 2.241 1.022 3.182 1.00 0.00 C ATOM 0 H LEU A 41 3.168 -2.119 6.720 1.00 0.00 H new ATOM 0 HA LEU A 41 3.513 0.609 5.649 1.00 0.00 H new ATOM 0 HB2 LEU A 41 1.624 -1.658 5.227 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.917 -0.054 5.200 1.00 0.00 H new ATOM 0 HG LEU A 41 3.285 -0.814 3.479 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.676 -1.137 1.641 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.430 -2.317 2.950 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.332 -0.926 2.787 1.00 0.00 H new ATOM 0 HD21 LEU A 41 2.543 1.117 2.139 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.233 1.417 3.305 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.930 1.584 3.812 1.00 0.00 H new ATOM 606 N SER A 42 2.371 1.780 7.490 1.00 0.00 N ATOM 607 CA SER A 42 1.742 2.501 8.590 1.00 0.00 C ATOM 608 C SER A 42 0.222 2.427 8.489 1.00 0.00 C ATOM 609 O SER A 42 -0.321 1.850 7.548 1.00 0.00 O ATOM 610 CB SER A 42 2.193 3.963 8.593 1.00 0.00 C ATOM 611 OG SER A 42 3.460 4.105 9.212 1.00 0.00 O ATOM 0 H SER A 42 2.993 2.348 6.915 1.00 0.00 H new ATOM 0 HA SER A 42 2.050 2.031 9.524 1.00 0.00 H new ATOM 0 HB2 SER A 42 2.241 4.334 7.569 1.00 0.00 H new ATOM 0 HB3 SER A 42 1.458 4.573 9.118 1.00 0.00 H new ATOM 0 HG SER A 42 3.768 5.031 9.118 1.00 0.00 H new ATOM 617 N ASN A 43 -0.459 3.014 9.468 1.00 0.00 N ATOM 618 CA ASN A 43 -1.917 3.014 9.491 1.00 0.00 C ATOM 619 C ASN A 43 -2.483 3.302 8.104 1.00 0.00 C ATOM 620 O ASN A 43 -2.018 4.202 7.407 1.00 0.00 O ATOM 621 CB ASN A 43 -2.432 4.053 10.489 1.00 0.00 C ATOM 622 CG ASN A 43 -3.928 3.947 10.714 1.00 0.00 C ATOM 623 OD1 ASN A 43 -4.723 4.460 9.927 1.00 0.00 O ATOM 624 ND2 ASN A 43 -4.318 3.280 11.794 1.00 0.00 N ATOM 0 H ASN A 43 -0.025 3.495 10.255 1.00 0.00 H new ATOM 0 HA ASN A 43 -2.250 2.024 9.802 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -1.915 3.927 11.440 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -2.192 5.052 10.125 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -5.312 3.177 11.998 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -3.624 2.871 12.419 1.00 0.00 H new ATOM 631 N ASN A 44 -3.491 2.530 7.710 1.00 0.00 N ATOM 632 CA ASN A 44 -4.121 2.701 6.406 1.00 0.00 C ATOM 633 C ASN A 44 -3.077 2.708 5.294 1.00 0.00 C ATOM 634 O ASN A 44 -3.301 3.273 4.224 1.00 0.00 O ATOM 635 CB ASN A 44 -4.927 4.001 6.373 1.00 0.00 C ATOM 636 CG ASN A 44 -6.117 3.920 5.437 1.00 0.00 C ATOM 637 OD1 ASN A 44 -6.095 4.472 4.336 1.00 0.00 O ATOM 638 ND2 ASN A 44 -7.165 3.229 5.871 1.00 0.00 N ATOM 0 H ASN A 44 -3.889 1.780 8.275 1.00 0.00 H new ATOM 0 HA ASN A 44 -4.794 1.860 6.242 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -5.275 4.235 7.379 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -4.278 4.820 6.061 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -7.995 3.139 5.285 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -7.140 2.788 6.790 1.00 0.00 H new ATOM 645 N GLN A 45 -1.937 2.076 5.556 1.00 0.00 N ATOM 646 CA GLN A 45 -0.859 2.010 4.577 1.00 0.00 C ATOM 647 C GLN A 45 -0.639 3.368 3.917 1.00 0.00 C ATOM 648 O GLN A 45 -0.495 3.459 2.697 1.00 0.00 O ATOM 649 CB GLN A 45 -1.171 0.957 3.513 1.00 0.00 C ATOM 650 CG GLN A 45 -2.509 1.167 2.823 1.00 0.00 C ATOM 651 CD GLN A 45 -2.731 0.204 1.673 1.00 0.00 C ATOM 652 OE1 GLN A 45 -1.857 0.020 0.825 1.00 0.00 O ATOM 653 NE2 GLN A 45 -3.904 -0.418 1.639 1.00 0.00 N ATOM 0 H GLN A 45 -1.737 1.603 6.437 1.00 0.00 H new ATOM 0 HA GLN A 45 0.055 1.728 5.099 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -0.380 0.965 2.763 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -1.161 -0.030 3.976 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -3.311 1.048 3.551 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -2.565 2.190 2.451 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -4.599 -0.235 2.363 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -4.110 -1.078 0.889 1.00 0.00 H new ATOM 662 N ARG A 46 -0.615 4.419 4.729 1.00 0.00 N ATOM 663 CA ARG A 46 -0.414 5.771 4.224 1.00 0.00 C ATOM 664 C ARG A 46 1.062 6.156 4.271 1.00 0.00 C ATOM 665 O ARG A 46 1.448 7.232 3.814 1.00 0.00 O ATOM 666 CB ARG A 46 -1.239 6.770 5.037 1.00 0.00 C ATOM 667 CG ARG A 46 -2.738 6.631 4.833 1.00 0.00 C ATOM 668 CD ARG A 46 -3.240 7.558 3.737 1.00 0.00 C ATOM 669 NE ARG A 46 -2.928 8.957 4.018 1.00 0.00 N ATOM 670 CZ ARG A 46 -2.975 9.918 3.102 1.00 0.00 C ATOM 671 NH1 ARG A 46 -3.319 9.633 1.854 1.00 0.00 N ATOM 672 NH2 ARG A 46 -2.677 11.167 3.434 1.00 0.00 N ATOM 0 H ARG A 46 -0.732 4.360 5.741 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.745 5.797 3.186 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.011 6.640 6.095 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.937 7.782 4.768 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.977 5.599 4.576 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -3.255 6.855 5.766 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -2.792 7.271 2.786 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -4.318 7.442 3.629 1.00 0.00 H new ATOM 0 HE ARG A 46 -2.660 9.210 4.969 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -3.549 8.674 1.595 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -3.354 10.373 1.153 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -2.411 11.390 4.393 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -2.713 11.904 2.730 1.00 0.00 H new ATOM 686 N TYR A 47 1.881 5.270 4.826 1.00 0.00 N ATOM 687 CA TYR A 47 3.314 5.518 4.935 1.00 0.00 C ATOM 688 C TYR A 47 4.084 4.209 5.083 1.00 0.00 C ATOM 689 O TYR A 47 3.513 3.175 5.433 1.00 0.00 O ATOM 690 CB TYR A 47 3.605 6.431 6.127 1.00 0.00 C ATOM 691 CG TYR A 47 2.966 7.797 6.014 1.00 0.00 C ATOM 692 CD1 TYR A 47 1.656 8.009 6.425 1.00 0.00 C ATOM 693 CD2 TYR A 47 3.673 8.876 5.497 1.00 0.00 C ATOM 694 CE1 TYR A 47 1.068 9.255 6.323 1.00 0.00 C ATOM 695 CE2 TYR A 47 3.094 10.125 5.392 1.00 0.00 C ATOM 696 CZ TYR A 47 1.791 10.310 5.806 1.00 0.00 C ATOM 697 OH TYR A 47 1.209 11.553 5.704 1.00 0.00 O ATOM 0 H TYR A 47 1.578 4.374 5.207 1.00 0.00 H new ATOM 0 HA TYR A 47 3.643 6.010 4.020 1.00 0.00 H new ATOM 0 HB2 TYR A 47 3.252 5.948 7.038 1.00 0.00 H new ATOM 0 HB3 TYR A 47 4.684 6.551 6.227 1.00 0.00 H new ATOM 0 HD1 TYR A 47 1.087 7.186 6.831 1.00 0.00 H new ATOM 0 HD2 TYR A 47 4.693 8.735 5.172 1.00 0.00 H new ATOM 0 HE1 TYR A 47 0.048 9.402 6.646 1.00 0.00 H new ATOM 0 HE2 TYR A 47 3.658 10.953 4.988 1.00 0.00 H new ATOM 0 HH TYR A 47 1.853 12.185 5.321 1.00 0.00 H new ATOM 707 N LEU A 48 5.383 4.261 4.814 1.00 0.00 N ATOM 708 CA LEU A 48 6.234 3.081 4.917 1.00 0.00 C ATOM 709 C LEU A 48 7.348 3.299 5.937 1.00 0.00 C ATOM 710 O LEU A 48 8.012 4.336 5.934 1.00 0.00 O ATOM 711 CB LEU A 48 6.836 2.741 3.553 1.00 0.00 C ATOM 712 CG LEU A 48 5.874 2.146 2.524 1.00 0.00 C ATOM 713 CD1 LEU A 48 6.512 2.129 1.144 1.00 0.00 C ATOM 714 CD2 LEU A 48 5.452 0.743 2.936 1.00 0.00 C ATOM 0 H LEU A 48 5.871 5.108 4.523 1.00 0.00 H new ATOM 0 HA LEU A 48 5.617 2.248 5.253 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.269 3.649 3.133 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.655 2.037 3.705 1.00 0.00 H new ATOM 0 HG LEU A 48 4.984 2.774 2.482 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.813 1.702 0.425 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.762 3.147 0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.419 1.525 1.170 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.768 0.336 2.192 1.00 0.00 H new ATOM 0 HD22 LEU A 48 6.332 0.104 3.007 1.00 0.00 H new ATOM 0 HD23 LEU A 48 4.953 0.783 3.904 1.00 0.00 H new ATOM 726 N PHE A 49 7.547 2.315 6.807 1.00 0.00 N ATOM 727 CA PHE A 49 8.582 2.399 7.832 1.00 0.00 C ATOM 728 C PHE A 49 9.601 1.276 7.669 1.00 0.00 C ATOM 729 O PHE A 49 9.281 0.200 7.160 1.00 0.00 O ATOM 730 CB PHE A 49 7.954 2.335 9.226 1.00 0.00 C ATOM 731 CG PHE A 49 7.511 3.673 9.746 1.00 0.00 C ATOM 732 CD1 PHE A 49 8.438 4.664 10.025 1.00 0.00 C ATOM 733 CD2 PHE A 49 6.168 3.939 9.955 1.00 0.00 C ATOM 734 CE1 PHE A 49 8.034 5.897 10.503 1.00 0.00 C ATOM 735 CE2 PHE A 49 5.757 5.170 10.433 1.00 0.00 C ATOM 736 CZ PHE A 49 6.692 6.149 10.708 1.00 0.00 C ATOM 0 H PHE A 49 7.006 1.450 6.823 1.00 0.00 H new ATOM 0 HA PHE A 49 9.097 3.353 7.716 1.00 0.00 H new ATOM 0 HB2 PHE A 49 7.097 1.663 9.199 1.00 0.00 H new ATOM 0 HB3 PHE A 49 8.675 1.904 9.921 1.00 0.00 H new ATOM 0 HD1 PHE A 49 9.489 4.471 9.867 1.00 0.00 H new ATOM 0 HD2 PHE A 49 5.433 3.176 9.742 1.00 0.00 H new ATOM 0 HE1 PHE A 49 8.767 6.661 10.716 1.00 0.00 H new ATOM 0 HE2 PHE A 49 4.707 5.366 10.591 1.00 0.00 H new ATOM 0 HZ PHE A 49 6.374 7.110 11.083 1.00 0.00 H new ATOM 746 N LEU A 50 10.830 1.532 8.104 1.00 0.00 N ATOM 747 CA LEU A 50 11.898 0.544 8.006 1.00 0.00 C ATOM 748 C LEU A 50 12.539 0.299 9.369 1.00 0.00 C ATOM 749 O LEU A 50 12.442 1.132 10.270 1.00 0.00 O ATOM 750 CB LEU A 50 12.959 1.007 7.006 1.00 0.00 C ATOM 751 CG LEU A 50 12.436 1.535 5.670 1.00 0.00 C ATOM 752 CD1 LEU A 50 13.544 2.245 4.906 1.00 0.00 C ATOM 753 CD2 LEU A 50 11.856 0.400 4.839 1.00 0.00 C ATOM 0 H LEU A 50 11.111 2.416 8.528 1.00 0.00 H new ATOM 0 HA LEU A 50 11.463 -0.392 7.656 1.00 0.00 H new ATOM 0 HB2 LEU A 50 13.555 1.790 7.475 1.00 0.00 H new ATOM 0 HB3 LEU A 50 13.630 0.172 6.806 1.00 0.00 H new ATOM 0 HG LEU A 50 11.642 2.255 5.871 1.00 0.00 H new ATOM 0 HD11 LEU A 50 13.153 2.614 3.958 1.00 0.00 H new ATOM 0 HD12 LEU A 50 13.914 3.083 5.497 1.00 0.00 H new ATOM 0 HD13 LEU A 50 14.359 1.547 4.715 1.00 0.00 H new ATOM 0 HD21 LEU A 50 11.488 0.794 3.891 1.00 0.00 H new ATOM 0 HD22 LEU A 50 12.630 -0.343 4.647 1.00 0.00 H new ATOM 0 HD23 LEU A 50 11.033 -0.065 5.382 1.00 0.00 H new ATOM 765 N ASP A 51 13.196 -0.847 9.510 1.00 0.00 N ATOM 766 CA ASP A 51 13.857 -1.200 10.761 1.00 0.00 C ATOM 767 C ASP A 51 15.184 -1.903 10.495 1.00 0.00 C ATOM 768 O ASP A 51 15.278 -2.766 9.623 1.00 0.00 O ATOM 769 CB ASP A 51 12.951 -2.098 11.606 1.00 0.00 C ATOM 770 CG ASP A 51 13.347 -2.108 13.069 1.00 0.00 C ATOM 771 OD1 ASP A 51 14.352 -2.769 13.407 1.00 0.00 O ATOM 772 OD2 ASP A 51 12.653 -1.455 13.876 1.00 0.00 O ATOM 0 H ASP A 51 13.285 -1.547 8.774 1.00 0.00 H new ATOM 0 HA ASP A 51 14.057 -0.280 11.309 1.00 0.00 H new ATOM 0 HB2 ASP A 51 11.920 -1.758 11.514 1.00 0.00 H new ATOM 0 HB3 ASP A 51 12.987 -3.115 11.216 1.00 0.00 H new ATOM 777 N GLY A 52 16.210 -1.526 11.253 1.00 0.00 N ATOM 778 CA GLY A 52 17.519 -2.129 11.083 1.00 0.00 C ATOM 779 C GLY A 52 18.634 -1.256 11.622 1.00 0.00 C ATOM 780 O GLY A 52 18.428 -0.479 12.554 1.00 0.00 O ATOM 0 H GLY A 52 16.158 -0.814 11.981 1.00 0.00 H new ATOM 0 HA2 GLY A 52 17.540 -3.094 11.590 1.00 0.00 H new ATOM 0 HA3 GLY A 52 17.692 -2.322 10.024 1.00 0.00 H new ATOM 784 N ASP A 53 19.820 -1.384 11.036 1.00 0.00 N ATOM 785 CA ASP A 53 20.973 -0.600 11.464 1.00 0.00 C ATOM 786 C ASP A 53 20.551 0.808 11.873 1.00 0.00 C ATOM 787 O ASP A 53 21.156 1.416 12.756 1.00 0.00 O ATOM 788 CB ASP A 53 22.012 -0.530 10.345 1.00 0.00 C ATOM 789 CG ASP A 53 22.793 -1.822 10.197 1.00 0.00 C ATOM 790 OD1 ASP A 53 22.222 -2.895 10.483 1.00 0.00 O ATOM 791 OD2 ASP A 53 23.974 -1.759 9.797 1.00 0.00 O ATOM 0 H ASP A 53 20.008 -2.023 10.264 1.00 0.00 H new ATOM 0 HA ASP A 53 21.416 -1.093 12.330 1.00 0.00 H new ATOM 0 HB2 ASP A 53 21.513 -0.301 9.404 1.00 0.00 H new ATOM 0 HB3 ASP A 53 22.704 0.288 10.546 1.00 0.00 H new ATOM 796 N SER A 54 19.511 1.321 11.224 1.00 0.00 N ATOM 797 CA SER A 54 19.012 2.659 11.516 1.00 0.00 C ATOM 798 C SER A 54 17.523 2.765 11.199 1.00 0.00 C ATOM 799 O SER A 54 17.039 2.172 10.234 1.00 0.00 O ATOM 800 CB SER A 54 19.791 3.703 10.715 1.00 0.00 C ATOM 801 OG SER A 54 21.186 3.577 10.933 1.00 0.00 O ATOM 0 H SER A 54 18.997 0.830 10.492 1.00 0.00 H new ATOM 0 HA SER A 54 19.154 2.848 12.580 1.00 0.00 H new ATOM 0 HB2 SER A 54 19.574 3.587 9.653 1.00 0.00 H new ATOM 0 HB3 SER A 54 19.464 4.703 11.000 1.00 0.00 H new ATOM 0 HG SER A 54 21.662 4.255 10.409 1.00 0.00 H new ATOM 807 N HIS A 55 16.802 3.524 12.018 1.00 0.00 N ATOM 808 CA HIS A 55 15.368 3.710 11.825 1.00 0.00 C ATOM 809 C HIS A 55 15.095 4.702 10.698 1.00 0.00 C ATOM 810 O HIS A 55 15.309 5.905 10.852 1.00 0.00 O ATOM 811 CB HIS A 55 14.717 4.197 13.119 1.00 0.00 C ATOM 812 CG HIS A 55 14.278 3.088 14.024 1.00 0.00 C ATOM 813 ND1 HIS A 55 13.109 2.382 13.837 1.00 0.00 N ATOM 814 CD2 HIS A 55 14.861 2.562 15.127 1.00 0.00 C ATOM 815 CE1 HIS A 55 12.990 1.471 14.787 1.00 0.00 C ATOM 816 NE2 HIS A 55 14.041 1.559 15.582 1.00 0.00 N ATOM 0 H HIS A 55 17.187 4.020 12.822 1.00 0.00 H new ATOM 0 HA HIS A 55 14.936 2.748 11.550 1.00 0.00 H new ATOM 0 HB2 HIS A 55 15.422 4.833 13.654 1.00 0.00 H new ATOM 0 HB3 HIS A 55 13.854 4.816 12.871 1.00 0.00 H new ATOM 0 HD2 HIS A 55 15.797 2.873 15.567 1.00 0.00 H new ATOM 0 HE1 HIS A 55 12.173 0.773 14.895 1.00 0.00 H new ATOM 0 HE2 HIS A 55 14.215 0.976 16.401 1.00 0.00 H new ATOM 824 N TYR A 56 14.623 4.190 9.567 1.00 0.00 N ATOM 825 CA TYR A 56 14.324 5.031 8.414 1.00 0.00 C ATOM 826 C TYR A 56 12.819 5.239 8.267 1.00 0.00 C ATOM 827 O TYR A 56 12.023 4.572 8.927 1.00 0.00 O ATOM 828 CB TYR A 56 14.890 4.404 7.139 1.00 0.00 C ATOM 829 CG TYR A 56 16.316 4.815 6.845 1.00 0.00 C ATOM 830 CD1 TYR A 56 16.605 6.074 6.335 1.00 0.00 C ATOM 831 CD2 TYR A 56 17.372 3.942 7.075 1.00 0.00 C ATOM 832 CE1 TYR A 56 17.906 6.454 6.064 1.00 0.00 C ATOM 833 CE2 TYR A 56 18.676 4.313 6.808 1.00 0.00 C ATOM 834 CZ TYR A 56 18.938 5.570 6.303 1.00 0.00 C ATOM 835 OH TYR A 56 20.235 5.943 6.034 1.00 0.00 O ATOM 0 H TYR A 56 14.439 3.197 9.424 1.00 0.00 H new ATOM 0 HA TYR A 56 14.793 6.002 8.573 1.00 0.00 H new ATOM 0 HB2 TYR A 56 14.844 3.318 7.226 1.00 0.00 H new ATOM 0 HB3 TYR A 56 14.259 4.683 6.295 1.00 0.00 H new ATOM 0 HD1 TYR A 56 15.799 6.768 6.147 1.00 0.00 H new ATOM 0 HD2 TYR A 56 17.170 2.957 7.469 1.00 0.00 H new ATOM 0 HE1 TYR A 56 18.113 7.437 5.668 1.00 0.00 H new ATOM 0 HE2 TYR A 56 19.486 3.623 6.994 1.00 0.00 H new ATOM 0 HH TYR A 56 20.841 5.206 6.259 1.00 0.00 H new ATOM 845 N GLU A 57 12.439 6.168 7.395 1.00 0.00 N ATOM 846 CA GLU A 57 11.031 6.464 7.161 1.00 0.00 C ATOM 847 C GLU A 57 10.801 6.905 5.719 1.00 0.00 C ATOM 848 O GLU A 57 11.310 7.939 5.286 1.00 0.00 O ATOM 849 CB GLU A 57 10.549 7.552 8.122 1.00 0.00 C ATOM 850 CG GLU A 57 9.453 8.432 7.545 1.00 0.00 C ATOM 851 CD GLU A 57 8.980 9.491 8.522 1.00 0.00 C ATOM 852 OE1 GLU A 57 9.003 9.225 9.742 1.00 0.00 O ATOM 853 OE2 GLU A 57 8.587 10.586 8.067 1.00 0.00 O ATOM 0 H GLU A 57 13.086 6.728 6.840 1.00 0.00 H new ATOM 0 HA GLU A 57 10.460 5.553 7.340 1.00 0.00 H new ATOM 0 HB2 GLU A 57 10.183 7.082 9.035 1.00 0.00 H new ATOM 0 HB3 GLU A 57 11.396 8.178 8.403 1.00 0.00 H new ATOM 0 HG2 GLU A 57 9.820 8.916 6.640 1.00 0.00 H new ATOM 0 HG3 GLU A 57 8.608 7.809 7.253 1.00 0.00 H new ATOM 860 N ILE A 58 10.030 6.114 4.980 1.00 0.00 N ATOM 861 CA ILE A 58 9.732 6.423 3.587 1.00 0.00 C ATOM 862 C ILE A 58 8.253 6.743 3.400 1.00 0.00 C ATOM 863 O ILE A 58 7.419 5.842 3.318 1.00 0.00 O ATOM 864 CB ILE A 58 10.115 5.257 2.657 1.00 0.00 C ATOM 865 CG1 ILE A 58 11.602 4.928 2.802 1.00 0.00 C ATOM 866 CG2 ILE A 58 9.782 5.600 1.213 1.00 0.00 C ATOM 867 CD1 ILE A 58 11.962 3.535 2.334 1.00 0.00 C ATOM 0 H ILE A 58 9.601 5.255 5.323 1.00 0.00 H new ATOM 0 HA ILE A 58 10.327 7.297 3.323 1.00 0.00 H new ATOM 0 HB ILE A 58 9.538 4.378 2.944 1.00 0.00 H new ATOM 0 HG12 ILE A 58 12.183 5.655 2.234 1.00 0.00 H new ATOM 0 HG13 ILE A 58 11.889 5.037 3.848 1.00 0.00 H new ATOM 0 HG21 ILE A 58 10.059 4.766 0.568 1.00 0.00 H new ATOM 0 HG22 ILE A 58 8.713 5.790 1.122 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.336 6.490 0.913 1.00 0.00 H new ATOM 0 HD11 ILE A 58 13.032 3.372 2.466 1.00 0.00 H new ATOM 0 HD12 ILE A 58 11.408 2.800 2.918 1.00 0.00 H new ATOM 0 HD13 ILE A 58 11.706 3.428 1.280 1.00 0.00 H new ATOM 879 N GLU A 59 7.936 8.032 3.330 1.00 0.00 N ATOM 880 CA GLU A 59 6.556 8.471 3.150 1.00 0.00 C ATOM 881 C GLU A 59 6.126 8.331 1.693 1.00 0.00 C ATOM 882 O GLU A 59 6.745 8.902 0.795 1.00 0.00 O ATOM 883 CB GLU A 59 6.396 9.923 3.604 1.00 0.00 C ATOM 884 CG GLU A 59 7.618 10.784 3.329 1.00 0.00 C ATOM 885 CD GLU A 59 8.650 10.702 4.437 1.00 0.00 C ATOM 886 OE1 GLU A 59 8.307 11.027 5.593 1.00 0.00 O ATOM 887 OE2 GLU A 59 9.801 10.313 4.149 1.00 0.00 O ATOM 0 H GLU A 59 8.615 8.790 3.395 1.00 0.00 H new ATOM 0 HA GLU A 59 5.917 7.835 3.762 1.00 0.00 H new ATOM 0 HB2 GLU A 59 5.533 10.360 3.100 1.00 0.00 H new ATOM 0 HB3 GLU A 59 6.183 9.939 4.673 1.00 0.00 H new ATOM 0 HG2 GLU A 59 8.074 10.472 2.389 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.307 11.821 3.204 1.00 0.00 H new ATOM 894 N ILE A 60 5.063 7.567 1.467 1.00 0.00 N ATOM 895 CA ILE A 60 4.549 7.352 0.120 1.00 0.00 C ATOM 896 C ILE A 60 4.364 8.675 -0.615 1.00 0.00 C ATOM 897 O ILE A 60 4.538 8.752 -1.831 1.00 0.00 O ATOM 898 CB ILE A 60 3.207 6.598 0.142 1.00 0.00 C ATOM 899 CG1 ILE A 60 3.402 5.182 0.689 1.00 0.00 C ATOM 900 CG2 ILE A 60 2.601 6.554 -1.252 1.00 0.00 C ATOM 901 CD1 ILE A 60 2.106 4.429 0.892 1.00 0.00 C ATOM 0 H ILE A 60 4.541 7.086 2.199 1.00 0.00 H new ATOM 0 HA ILE A 60 5.287 6.746 -0.406 1.00 0.00 H new ATOM 0 HB ILE A 60 2.519 7.130 0.799 1.00 0.00 H new ATOM 0 HG12 ILE A 60 4.036 4.620 0.003 1.00 0.00 H new ATOM 0 HG13 ILE A 60 3.933 5.238 1.639 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.653 6.018 -1.220 1.00 0.00 H new ATOM 0 HG22 ILE A 60 2.431 7.570 -1.607 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.284 6.042 -1.930 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.321 3.434 1.281 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.479 4.969 1.602 1.00 0.00 H new ATOM 0 HD13 ILE A 60 1.583 4.341 -0.060 1.00 0.00 H new ATOM 913 N VAL A 61 4.011 9.717 0.132 1.00 0.00 N ATOM 914 CA VAL A 61 3.805 11.039 -0.447 1.00 0.00 C ATOM 915 C VAL A 61 5.011 11.471 -1.273 1.00 0.00 C ATOM 916 O VAL A 61 4.881 12.242 -2.225 1.00 0.00 O ATOM 917 CB VAL A 61 3.538 12.094 0.643 1.00 0.00 C ATOM 918 CG1 VAL A 61 2.360 11.678 1.511 1.00 0.00 C ATOM 919 CG2 VAL A 61 4.783 12.313 1.488 1.00 0.00 C ATOM 0 H VAL A 61 3.862 9.671 1.140 1.00 0.00 H new ATOM 0 HA VAL A 61 2.931 10.968 -1.095 1.00 0.00 H new ATOM 0 HB VAL A 61 3.286 13.037 0.158 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.186 12.435 2.275 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.469 11.577 0.891 1.00 0.00 H new ATOM 0 HG13 VAL A 61 2.580 10.723 1.989 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.576 13.061 2.253 1.00 0.00 H new ATOM 0 HG22 VAL A 61 5.068 11.375 1.965 1.00 0.00 H new ATOM 0 HG23 VAL A 61 5.598 12.659 0.852 1.00 0.00 H new ATOM 929 N HIS A 62 6.185 10.970 -0.903 1.00 0.00 N ATOM 930 CA HIS A 62 7.416 11.303 -1.611 1.00 0.00 C ATOM 931 C HIS A 62 7.671 10.321 -2.751 1.00 0.00 C ATOM 932 O HIS A 62 7.948 10.726 -3.880 1.00 0.00 O ATOM 933 CB HIS A 62 8.601 11.300 -0.645 1.00 0.00 C ATOM 934 CG HIS A 62 8.845 12.626 0.008 1.00 0.00 C ATOM 935 ND1 HIS A 62 8.841 13.818 -0.684 1.00 0.00 N ATOM 936 CD2 HIS A 62 9.099 12.943 1.300 1.00 0.00 C ATOM 937 CE1 HIS A 62 9.084 14.811 0.153 1.00 0.00 C ATOM 938 NE2 HIS A 62 9.243 14.307 1.363 1.00 0.00 N ATOM 0 H HIS A 62 6.310 10.332 -0.117 1.00 0.00 H new ATOM 0 HA HIS A 62 7.304 12.301 -2.034 1.00 0.00 H new ATOM 0 HB2 HIS A 62 8.428 10.550 0.127 1.00 0.00 H new ATOM 0 HB3 HIS A 62 9.499 11.000 -1.185 1.00 0.00 H new ATOM 0 HD2 HIS A 62 9.174 12.252 2.126 1.00 0.00 H new ATOM 0 HE1 HIS A 62 9.143 15.857 -0.108 1.00 0.00 H new ATOM 0 HE2 HIS A 62 9.441 14.844 2.207 1.00 0.00 H new ATOM 946 N ILE A 63 7.576 9.032 -2.446 1.00 0.00 N ATOM 947 CA ILE A 63 7.796 7.993 -3.445 1.00 0.00 C ATOM 948 C ILE A 63 7.224 8.402 -4.798 1.00 0.00 C ATOM 949 O ILE A 63 6.059 8.787 -4.901 1.00 0.00 O ATOM 950 CB ILE A 63 7.163 6.656 -3.016 1.00 0.00 C ATOM 951 CG1 ILE A 63 7.674 6.245 -1.634 1.00 0.00 C ATOM 952 CG2 ILE A 63 7.464 5.574 -4.042 1.00 0.00 C ATOM 953 CD1 ILE A 63 7.171 4.892 -1.181 1.00 0.00 C ATOM 0 H ILE A 63 7.348 8.682 -1.516 1.00 0.00 H new ATOM 0 HA ILE A 63 8.875 7.863 -3.533 1.00 0.00 H new ATOM 0 HB ILE A 63 6.082 6.784 -2.959 1.00 0.00 H new ATOM 0 HG12 ILE A 63 8.764 6.232 -1.648 1.00 0.00 H new ATOM 0 HG13 ILE A 63 7.373 6.998 -0.906 1.00 0.00 H new ATOM 0 HG21 ILE A 63 7.010 4.635 -3.725 1.00 0.00 H new ATOM 0 HG22 ILE A 63 7.055 5.866 -5.009 1.00 0.00 H new ATOM 0 HG23 ILE A 63 8.543 5.444 -4.128 1.00 0.00 H new ATOM 0 HD11 ILE A 63 7.573 4.666 -0.194 1.00 0.00 H new ATOM 0 HD12 ILE A 63 6.082 4.906 -1.135 1.00 0.00 H new ATOM 0 HD13 ILE A 63 7.495 4.128 -1.888 1.00 0.00 H new ATOM 965 N SER A 64 8.052 8.315 -5.835 1.00 0.00 N ATOM 966 CA SER A 64 7.629 8.678 -7.183 1.00 0.00 C ATOM 967 C SER A 64 7.292 7.435 -8.000 1.00 0.00 C ATOM 968 O SER A 64 6.158 7.259 -8.446 1.00 0.00 O ATOM 969 CB SER A 64 8.726 9.481 -7.884 1.00 0.00 C ATOM 970 OG SER A 64 8.336 9.836 -9.200 1.00 0.00 O ATOM 0 H SER A 64 9.019 7.997 -5.767 1.00 0.00 H new ATOM 0 HA SER A 64 6.732 9.293 -7.103 1.00 0.00 H new ATOM 0 HB2 SER A 64 8.945 10.382 -7.311 1.00 0.00 H new ATOM 0 HB3 SER A 64 9.644 8.895 -7.919 1.00 0.00 H new ATOM 0 HG SER A 64 9.053 10.350 -9.626 1.00 0.00 H new ATOM 976 N THR A 65 8.286 6.573 -8.192 1.00 0.00 N ATOM 977 CA THR A 65 8.096 5.346 -8.955 1.00 0.00 C ATOM 978 C THR A 65 8.000 4.135 -8.035 1.00 0.00 C ATOM 979 O THR A 65 8.603 4.108 -6.962 1.00 0.00 O ATOM 980 CB THR A 65 9.245 5.125 -9.957 1.00 0.00 C ATOM 981 OG1 THR A 65 9.411 6.287 -10.777 1.00 0.00 O ATOM 982 CG2 THR A 65 8.971 3.914 -10.836 1.00 0.00 C ATOM 0 H THR A 65 9.231 6.702 -7.829 1.00 0.00 H new ATOM 0 HA THR A 65 7.161 5.457 -9.503 1.00 0.00 H new ATOM 0 HB THR A 65 10.160 4.945 -9.392 1.00 0.00 H new ATOM 0 HG1 THR A 65 10.144 6.139 -11.410 1.00 0.00 H new ATOM 0 HG21 THR A 65 9.796 3.778 -11.535 1.00 0.00 H new ATOM 0 HG22 THR A 65 8.874 3.026 -10.212 1.00 0.00 H new ATOM 0 HG23 THR A 65 8.046 4.069 -11.392 1.00 0.00 H new ATOM 990 N VAL A 66 7.238 3.132 -8.462 1.00 0.00 N ATOM 991 CA VAL A 66 7.065 1.916 -7.676 1.00 0.00 C ATOM 992 C VAL A 66 6.860 0.704 -8.578 1.00 0.00 C ATOM 993 O VAL A 66 5.790 0.525 -9.159 1.00 0.00 O ATOM 994 CB VAL A 66 5.867 2.035 -6.715 1.00 0.00 C ATOM 995 CG1 VAL A 66 5.627 0.717 -5.995 1.00 0.00 C ATOM 996 CG2 VAL A 66 6.094 3.162 -5.718 1.00 0.00 C ATOM 0 H VAL A 66 6.731 3.138 -9.347 1.00 0.00 H new ATOM 0 HA VAL A 66 7.977 1.782 -7.094 1.00 0.00 H new ATOM 0 HB VAL A 66 4.977 2.270 -7.299 1.00 0.00 H new ATOM 0 HG11 VAL A 66 4.777 0.820 -5.321 1.00 0.00 H new ATOM 0 HG12 VAL A 66 5.417 -0.064 -6.726 1.00 0.00 H new ATOM 0 HG13 VAL A 66 6.514 0.449 -5.422 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.238 3.232 -5.047 1.00 0.00 H new ATOM 0 HG22 VAL A 66 6.994 2.959 -5.138 1.00 0.00 H new ATOM 0 HG23 VAL A 66 6.213 4.104 -6.254 1.00 0.00 H new ATOM 1006 N GLN A 67 7.892 -0.126 -8.688 1.00 0.00 N ATOM 1007 CA GLN A 67 7.825 -1.322 -9.520 1.00 0.00 C ATOM 1008 C GLN A 67 8.413 -2.525 -8.791 1.00 0.00 C ATOM 1009 O GLN A 67 9.189 -2.373 -7.847 1.00 0.00 O ATOM 1010 CB GLN A 67 8.569 -1.095 -10.837 1.00 0.00 C ATOM 1011 CG GLN A 67 10.069 -0.919 -10.666 1.00 0.00 C ATOM 1012 CD GLN A 67 10.713 -0.223 -11.849 1.00 0.00 C ATOM 1013 OE1 GLN A 67 10.164 0.733 -12.396 1.00 0.00 O ATOM 1014 NE2 GLN A 67 11.885 -0.701 -12.251 1.00 0.00 N ATOM 0 H GLN A 67 8.784 0.007 -8.212 1.00 0.00 H new ATOM 0 HA GLN A 67 6.776 -1.527 -9.734 1.00 0.00 H new ATOM 0 HB2 GLN A 67 8.384 -1.941 -11.500 1.00 0.00 H new ATOM 0 HB3 GLN A 67 8.161 -0.211 -11.327 1.00 0.00 H new ATOM 0 HG2 GLN A 67 10.263 -0.343 -9.761 1.00 0.00 H new ATOM 0 HG3 GLN A 67 10.532 -1.896 -10.528 1.00 0.00 H new ATOM 0 HE21 GLN A 67 12.304 -1.496 -11.768 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.366 -0.273 -13.042 1.00 0.00 H new ATOM 1023 N ILE A 68 8.038 -3.720 -9.234 1.00 0.00 N ATOM 1024 CA ILE A 68 8.529 -4.949 -8.624 1.00 0.00 C ATOM 1025 C ILE A 68 9.516 -5.663 -9.542 1.00 0.00 C ATOM 1026 O ILE A 68 9.279 -5.796 -10.743 1.00 0.00 O ATOM 1027 CB ILE A 68 7.374 -5.910 -8.285 1.00 0.00 C ATOM 1028 CG1 ILE A 68 6.602 -5.403 -7.065 1.00 0.00 C ATOM 1029 CG2 ILE A 68 7.908 -7.313 -8.035 1.00 0.00 C ATOM 1030 CD1 ILE A 68 5.392 -6.245 -6.723 1.00 0.00 C ATOM 0 H ILE A 68 7.396 -3.863 -10.013 1.00 0.00 H new ATOM 0 HA ILE A 68 9.035 -4.663 -7.702 1.00 0.00 H new ATOM 0 HB ILE A 68 6.691 -5.948 -9.134 1.00 0.00 H new ATOM 0 HG12 ILE A 68 7.272 -5.378 -6.206 1.00 0.00 H new ATOM 0 HG13 ILE A 68 6.281 -4.378 -7.249 1.00 0.00 H new ATOM 0 HG21 ILE A 68 7.080 -7.980 -7.797 1.00 0.00 H new ATOM 0 HG22 ILE A 68 8.418 -7.673 -8.928 1.00 0.00 H new ATOM 0 HG23 ILE A 68 8.609 -7.292 -7.200 1.00 0.00 H new ATOM 0 HD11 ILE A 68 4.893 -5.827 -5.848 1.00 0.00 H new ATOM 0 HD12 ILE A 68 4.702 -6.250 -7.567 1.00 0.00 H new ATOM 0 HD13 ILE A 68 5.708 -7.266 -6.507 1.00 0.00 H new ATOM 1042 N LEU A 69 10.623 -6.122 -8.969 1.00 0.00 N ATOM 1043 CA LEU A 69 11.646 -6.825 -9.735 1.00 0.00 C ATOM 1044 C LEU A 69 11.322 -8.311 -9.842 1.00 0.00 C ATOM 1045 O LEU A 69 11.064 -8.976 -8.838 1.00 0.00 O ATOM 1046 CB LEU A 69 13.018 -6.636 -9.084 1.00 0.00 C ATOM 1047 CG LEU A 69 13.370 -5.209 -8.663 1.00 0.00 C ATOM 1048 CD1 LEU A 69 14.370 -5.222 -7.517 1.00 0.00 C ATOM 1049 CD2 LEU A 69 13.921 -4.425 -9.845 1.00 0.00 C ATOM 0 H LEU A 69 10.835 -6.020 -7.977 1.00 0.00 H new ATOM 0 HA LEU A 69 11.666 -6.404 -10.740 1.00 0.00 H new ATOM 0 HB2 LEU A 69 13.072 -7.277 -8.204 1.00 0.00 H new ATOM 0 HB3 LEU A 69 13.780 -6.986 -9.780 1.00 0.00 H new ATOM 0 HG LEU A 69 12.460 -4.717 -8.319 1.00 0.00 H new ATOM 0 HD11 LEU A 69 14.609 -4.198 -7.231 1.00 0.00 H new ATOM 0 HD12 LEU A 69 13.939 -5.746 -6.664 1.00 0.00 H new ATOM 0 HD13 LEU A 69 15.280 -5.732 -7.834 1.00 0.00 H new ATOM 0 HD21 LEU A 69 14.166 -3.412 -9.527 1.00 0.00 H new ATOM 0 HD22 LEU A 69 14.820 -4.915 -10.220 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.172 -4.386 -10.636 1.00 0.00 H new ATOM 1061 N THR A 70 11.338 -8.829 -11.066 1.00 0.00 N ATOM 1062 CA THR A 70 11.047 -10.237 -11.305 1.00 0.00 C ATOM 1063 C THR A 70 12.059 -10.853 -12.264 1.00 0.00 C ATOM 1064 O THR A 70 12.163 -10.440 -13.419 1.00 0.00 O ATOM 1065 CB THR A 70 9.630 -10.428 -11.879 1.00 0.00 C ATOM 1066 OG1 THR A 70 9.483 -9.668 -13.084 1.00 0.00 O ATOM 1067 CG2 THR A 70 8.575 -9.999 -10.870 1.00 0.00 C ATOM 0 H THR A 70 11.550 -8.294 -11.908 1.00 0.00 H new ATOM 0 HA THR A 70 11.112 -10.741 -10.341 1.00 0.00 H new ATOM 0 HB THR A 70 9.490 -11.486 -12.099 1.00 0.00 H new ATOM 0 HG1 THR A 70 10.280 -9.783 -13.642 1.00 0.00 H new ATOM 0 HG21 THR A 70 7.583 -10.143 -11.298 1.00 0.00 H new ATOM 0 HG22 THR A 70 8.671 -10.600 -9.966 1.00 0.00 H new ATOM 0 HG23 THR A 70 8.714 -8.947 -10.623 1.00 0.00 H new ATOM 1075 N GLU A 71 12.801 -11.843 -11.778 1.00 0.00 N ATOM 1076 CA GLU A 71 13.806 -12.515 -12.595 1.00 0.00 C ATOM 1077 C GLU A 71 13.695 -14.031 -12.455 1.00 0.00 C ATOM 1078 O GLU A 71 14.126 -14.606 -11.456 1.00 0.00 O ATOM 1079 CB GLU A 71 15.210 -12.056 -12.196 1.00 0.00 C ATOM 1080 CG GLU A 71 16.307 -12.605 -13.092 1.00 0.00 C ATOM 1081 CD GLU A 71 16.527 -11.757 -14.330 1.00 0.00 C ATOM 1082 OE1 GLU A 71 16.382 -10.521 -14.237 1.00 0.00 O ATOM 1083 OE2 GLU A 71 16.846 -12.331 -15.392 1.00 0.00 O ATOM 0 H GLU A 71 12.726 -12.197 -10.824 1.00 0.00 H new ATOM 0 HA GLU A 71 13.628 -12.249 -13.637 1.00 0.00 H new ATOM 0 HB2 GLU A 71 15.247 -10.967 -12.217 1.00 0.00 H new ATOM 0 HB3 GLU A 71 15.405 -12.362 -11.168 1.00 0.00 H new ATOM 0 HG2 GLU A 71 17.237 -12.664 -12.527 1.00 0.00 H new ATOM 0 HG3 GLU A 71 16.051 -13.621 -13.393 1.00 0.00 H new ATOM 1090 N GLY A 72 13.112 -14.671 -13.464 1.00 0.00 N ATOM 1091 CA GLY A 72 12.954 -16.114 -13.434 1.00 0.00 C ATOM 1092 C GLY A 72 12.874 -16.717 -14.822 1.00 0.00 C ATOM 1093 O GLY A 72 11.783 -16.949 -15.344 1.00 0.00 O ATOM 0 H GLY A 72 12.747 -14.217 -14.301 1.00 0.00 H new ATOM 0 HA2 GLY A 72 13.792 -16.557 -12.896 1.00 0.00 H new ATOM 0 HA3 GLY A 72 12.050 -16.366 -12.879 1.00 0.00 H new ATOM 1097 N PHE A 73 14.032 -16.970 -15.423 1.00 0.00 N ATOM 1098 CA PHE A 73 14.089 -17.548 -16.761 1.00 0.00 C ATOM 1099 C PHE A 73 13.166 -18.758 -16.871 1.00 0.00 C ATOM 1100 O PHE A 73 12.223 -18.782 -17.662 1.00 0.00 O ATOM 1101 CB PHE A 73 15.523 -17.953 -17.104 1.00 0.00 C ATOM 1102 CG PHE A 73 16.278 -16.901 -17.866 1.00 0.00 C ATOM 1103 CD1 PHE A 73 16.589 -15.688 -17.273 1.00 0.00 C ATOM 1104 CD2 PHE A 73 16.677 -17.126 -19.173 1.00 0.00 C ATOM 1105 CE1 PHE A 73 17.283 -14.718 -17.972 1.00 0.00 C ATOM 1106 CE2 PHE A 73 17.372 -16.160 -19.877 1.00 0.00 C ATOM 1107 CZ PHE A 73 17.676 -14.955 -19.275 1.00 0.00 C ATOM 0 H PHE A 73 14.944 -16.784 -15.005 1.00 0.00 H new ATOM 0 HA PHE A 73 13.753 -16.792 -17.471 1.00 0.00 H new ATOM 0 HB2 PHE A 73 16.059 -18.177 -16.182 1.00 0.00 H new ATOM 0 HB3 PHE A 73 15.502 -18.871 -17.692 1.00 0.00 H new ATOM 0 HD1 PHE A 73 16.286 -15.498 -16.254 1.00 0.00 H new ATOM 0 HD2 PHE A 73 16.442 -18.067 -19.648 1.00 0.00 H new ATOM 0 HE1 PHE A 73 17.518 -13.776 -17.500 1.00 0.00 H new ATOM 0 HE2 PHE A 73 17.677 -16.348 -20.896 1.00 0.00 H new ATOM 0 HZ PHE A 73 18.220 -14.199 -19.822 1.00 0.00 H new ATOM 1117 N PRO A 74 13.443 -19.788 -16.058 1.00 0.00 N ATOM 1118 CA PRO A 74 12.650 -21.021 -16.044 1.00 0.00 C ATOM 1119 C PRO A 74 11.258 -20.809 -15.460 1.00 0.00 C ATOM 1120 O PRO A 74 11.044 -19.957 -14.597 1.00 0.00 O ATOM 1121 CB PRO A 74 13.468 -21.958 -15.151 1.00 0.00 C ATOM 1122 CG PRO A 74 14.251 -21.051 -14.267 1.00 0.00 C ATOM 1123 CD PRO A 74 14.552 -19.829 -15.090 1.00 0.00 C ATOM 0 HA PRO A 74 12.480 -21.408 -17.049 1.00 0.00 H new ATOM 0 HB2 PRO A 74 12.821 -22.616 -14.570 1.00 0.00 H new ATOM 0 HB3 PRO A 74 14.123 -22.597 -15.743 1.00 0.00 H new ATOM 0 HG2 PRO A 74 13.683 -20.790 -13.374 1.00 0.00 H new ATOM 0 HG3 PRO A 74 15.170 -21.531 -13.931 1.00 0.00 H new ATOM 0 HD2 PRO A 74 14.583 -18.929 -14.476 1.00 0.00 H new ATOM 0 HD3 PRO A 74 15.518 -19.908 -15.589 1.00 0.00 H new ATOM 1131 N PRO A 75 10.287 -21.600 -15.940 1.00 0.00 N ATOM 1132 CA PRO A 75 8.898 -21.518 -15.478 1.00 0.00 C ATOM 1133 C PRO A 75 8.733 -22.016 -14.047 1.00 0.00 C ATOM 1134 O PRO A 75 9.557 -22.780 -13.545 1.00 0.00 O ATOM 1135 CB PRO A 75 8.146 -22.428 -16.452 1.00 0.00 C ATOM 1136 CG PRO A 75 9.172 -23.394 -16.936 1.00 0.00 C ATOM 1137 CD PRO A 75 10.471 -22.637 -16.969 1.00 0.00 C ATOM 0 HA PRO A 75 8.533 -20.491 -15.465 1.00 0.00 H new ATOM 0 HB2 PRO A 75 7.321 -22.941 -15.958 1.00 0.00 H new ATOM 0 HB3 PRO A 75 7.719 -21.858 -17.277 1.00 0.00 H new ATOM 0 HG2 PRO A 75 9.240 -24.256 -16.273 1.00 0.00 H new ATOM 0 HG3 PRO A 75 8.916 -23.772 -17.926 1.00 0.00 H new ATOM 0 HD2 PRO A 75 11.319 -23.283 -16.741 1.00 0.00 H new ATOM 0 HD3 PRO A 75 10.657 -22.201 -17.950 1.00 0.00 H new ATOM 1145 N GLY A 76 7.660 -21.579 -13.393 1.00 0.00 N ATOM 1146 CA GLY A 76 7.406 -21.992 -12.025 1.00 0.00 C ATOM 1147 C GLY A 76 5.966 -22.411 -11.804 1.00 0.00 C ATOM 1148 O GLY A 76 5.582 -23.534 -12.127 1.00 0.00 O ATOM 0 H GLY A 76 6.963 -20.947 -13.786 1.00 0.00 H new ATOM 0 HA2 GLY A 76 8.066 -22.822 -11.771 1.00 0.00 H new ATOM 0 HA3 GLY A 76 7.650 -21.172 -11.350 1.00 0.00 H new ATOM 1152 N GLY A 77 5.166 -21.505 -11.249 1.00 0.00 N ATOM 1153 CA GLY A 77 3.770 -21.806 -10.992 1.00 0.00 C ATOM 1154 C GLY A 77 3.339 -21.408 -9.595 1.00 0.00 C ATOM 1155 O GLY A 77 2.364 -20.677 -9.423 1.00 0.00 O ATOM 0 H GLY A 77 5.460 -20.568 -10.973 1.00 0.00 H new ATOM 0 HA2 GLY A 77 3.149 -21.287 -11.722 1.00 0.00 H new ATOM 0 HA3 GLY A 77 3.600 -22.874 -11.131 1.00 0.00 H new ATOM 1159 N GLY A 78 4.065 -21.892 -8.592 1.00 0.00 N ATOM 1160 CA GLY A 78 3.735 -21.573 -7.215 1.00 0.00 C ATOM 1161 C GLY A 78 3.739 -20.080 -6.949 1.00 0.00 C ATOM 1162 O GLY A 78 2.826 -19.367 -7.364 1.00 0.00 O ATOM 0 H GLY A 78 4.876 -22.500 -8.708 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.752 -21.979 -6.977 1.00 0.00 H new ATOM 0 HA3 GLY A 78 4.450 -22.059 -6.551 1.00 0.00 H new ATOM 1166 N ASN A 79 4.768 -19.607 -6.253 1.00 0.00 N ATOM 1167 CA ASN A 79 4.885 -18.190 -5.930 1.00 0.00 C ATOM 1168 C ASN A 79 4.629 -17.328 -7.162 1.00 0.00 C ATOM 1169 O ASN A 79 4.607 -17.827 -8.287 1.00 0.00 O ATOM 1170 CB ASN A 79 6.273 -17.888 -5.361 1.00 0.00 C ATOM 1171 CG ASN A 79 6.581 -18.707 -4.123 1.00 0.00 C ATOM 1172 OD1 ASN A 79 5.705 -18.952 -3.293 1.00 0.00 O ATOM 1173 ND2 ASN A 79 7.831 -19.135 -3.993 1.00 0.00 N ATOM 0 H ASN A 79 5.532 -20.184 -5.902 1.00 0.00 H new ATOM 0 HA ASN A 79 4.132 -17.951 -5.179 1.00 0.00 H new ATOM 0 HB2 ASN A 79 7.026 -18.089 -6.123 1.00 0.00 H new ATOM 0 HB3 ASN A 79 6.340 -16.828 -5.118 1.00 0.00 H new ATOM 0 HD21 ASN A 79 8.098 -19.691 -3.180 1.00 0.00 H new ATOM 0 HD22 ASN A 79 8.524 -18.908 -4.706 1.00 0.00 H new ATOM 1180 N ALA A 80 4.437 -16.032 -6.942 1.00 0.00 N ATOM 1181 CA ALA A 80 4.186 -15.100 -8.034 1.00 0.00 C ATOM 1182 C ALA A 80 5.490 -14.662 -8.693 1.00 0.00 C ATOM 1183 O ALA A 80 5.644 -13.503 -9.076 1.00 0.00 O ATOM 1184 CB ALA A 80 3.416 -13.889 -7.528 1.00 0.00 C ATOM 0 H ALA A 80 4.450 -15.603 -6.017 1.00 0.00 H new ATOM 0 HA ALA A 80 3.584 -15.612 -8.785 1.00 0.00 H new ATOM 0 HB1 ALA A 80 3.236 -13.201 -8.354 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.463 -14.213 -7.110 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.998 -13.384 -6.756 1.00 0.00 H new ATOM 1190 N ARG A 81 6.425 -15.598 -8.822 1.00 0.00 N ATOM 1191 CA ARG A 81 7.717 -15.308 -9.434 1.00 0.00 C ATOM 1192 C ARG A 81 8.253 -13.961 -8.958 1.00 0.00 C ATOM 1193 O ARG A 81 8.895 -13.234 -9.716 1.00 0.00 O ATOM 1194 CB ARG A 81 7.595 -15.311 -10.958 1.00 0.00 C ATOM 1195 CG ARG A 81 7.364 -16.692 -11.548 1.00 0.00 C ATOM 1196 CD ARG A 81 6.853 -16.609 -12.978 1.00 0.00 C ATOM 1197 NE ARG A 81 7.943 -16.488 -13.943 1.00 0.00 N ATOM 1198 CZ ARG A 81 8.530 -15.336 -14.247 1.00 0.00 C ATOM 1199 NH1 ARG A 81 8.135 -14.212 -13.666 1.00 0.00 N ATOM 1200 NH2 ARG A 81 9.516 -15.306 -15.135 1.00 0.00 N ATOM 0 H ARG A 81 6.312 -16.563 -8.511 1.00 0.00 H new ATOM 0 HA ARG A 81 8.418 -16.086 -9.131 1.00 0.00 H new ATOM 0 HB2 ARG A 81 6.772 -14.659 -11.249 1.00 0.00 H new ATOM 0 HB3 ARG A 81 8.504 -14.889 -11.388 1.00 0.00 H new ATOM 0 HG2 ARG A 81 8.295 -17.259 -11.526 1.00 0.00 H new ATOM 0 HG3 ARG A 81 6.645 -17.235 -10.935 1.00 0.00 H new ATOM 0 HD2 ARG A 81 6.265 -17.498 -13.205 1.00 0.00 H new ATOM 0 HD3 ARG A 81 6.186 -15.752 -13.075 1.00 0.00 H new ATOM 0 HE ARG A 81 8.271 -17.334 -14.409 1.00 0.00 H new ATOM 0 HH11 ARG A 81 7.378 -14.230 -12.983 1.00 0.00 H new ATOM 0 HH12 ARG A 81 8.588 -13.329 -13.902 1.00 0.00 H new ATOM 0 HH21 ARG A 81 9.824 -16.168 -15.585 1.00 0.00 H new ATOM 0 HH22 ARG A 81 9.966 -14.421 -15.368 1.00 0.00 H new ATOM 1214 N ALA A 82 7.984 -13.634 -7.698 1.00 0.00 N ATOM 1215 CA ALA A 82 8.441 -12.376 -7.121 1.00 0.00 C ATOM 1216 C ALA A 82 9.702 -12.580 -6.287 1.00 0.00 C ATOM 1217 O ALA A 82 9.641 -13.074 -5.161 1.00 0.00 O ATOM 1218 CB ALA A 82 7.341 -11.754 -6.274 1.00 0.00 C ATOM 0 H ALA A 82 7.452 -14.223 -7.058 1.00 0.00 H new ATOM 0 HA ALA A 82 8.684 -11.697 -7.938 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.696 -10.815 -5.849 1.00 0.00 H new ATOM 0 HB2 ALA A 82 6.467 -11.563 -6.896 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.071 -12.437 -5.469 1.00 0.00 H new ATOM 1224 N THR A 83 10.845 -12.197 -6.848 1.00 0.00 N ATOM 1225 CA THR A 83 12.120 -12.339 -6.157 1.00 0.00 C ATOM 1226 C THR A 83 12.396 -11.139 -5.258 1.00 0.00 C ATOM 1227 O THR A 83 13.126 -11.243 -4.274 1.00 0.00 O ATOM 1228 CB THR A 83 13.284 -12.499 -7.153 1.00 0.00 C ATOM 1229 OG1 THR A 83 13.590 -11.236 -7.755 1.00 0.00 O ATOM 1230 CG2 THR A 83 12.936 -13.511 -8.234 1.00 0.00 C ATOM 0 H THR A 83 10.913 -11.786 -7.779 1.00 0.00 H new ATOM 0 HA THR A 83 12.049 -13.238 -5.545 1.00 0.00 H new ATOM 0 HB THR A 83 14.155 -12.861 -6.606 1.00 0.00 H new ATOM 0 HG1 THR A 83 14.332 -11.345 -8.386 1.00 0.00 H new ATOM 0 HG21 THR A 83 13.773 -13.607 -8.926 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.732 -14.478 -7.775 1.00 0.00 H new ATOM 0 HG23 THR A 83 12.053 -13.174 -8.777 1.00 0.00 H new ATOM 1238 N GLY A 84 11.806 -9.999 -5.604 1.00 0.00 N ATOM 1239 CA GLY A 84 12.000 -8.795 -4.817 1.00 0.00 C ATOM 1240 C GLY A 84 11.094 -7.662 -5.257 1.00 0.00 C ATOM 1241 O GLY A 84 10.073 -7.892 -5.905 1.00 0.00 O ATOM 0 H GLY A 84 11.197 -9.888 -6.415 1.00 0.00 H new ATOM 0 HA2 GLY A 84 11.814 -9.018 -3.766 1.00 0.00 H new ATOM 0 HA3 GLY A 84 13.039 -8.477 -4.896 1.00 0.00 H new ATOM 1245 N MET A 85 11.466 -6.437 -4.902 1.00 0.00 N ATOM 1246 CA MET A 85 10.678 -5.265 -5.264 1.00 0.00 C ATOM 1247 C MET A 85 11.569 -4.036 -5.417 1.00 0.00 C ATOM 1248 O MET A 85 12.670 -3.984 -4.868 1.00 0.00 O ATOM 1249 CB MET A 85 9.602 -5.000 -4.209 1.00 0.00 C ATOM 1250 CG MET A 85 8.973 -3.621 -4.314 1.00 0.00 C ATOM 1251 SD MET A 85 7.603 -3.393 -3.165 1.00 0.00 S ATOM 1252 CE MET A 85 6.203 -3.572 -4.268 1.00 0.00 C ATOM 0 H MET A 85 12.308 -6.230 -4.364 1.00 0.00 H new ATOM 0 HA MET A 85 10.197 -5.465 -6.221 1.00 0.00 H new ATOM 0 HB2 MET A 85 8.821 -5.754 -4.302 1.00 0.00 H new ATOM 0 HB3 MET A 85 10.041 -5.115 -3.218 1.00 0.00 H new ATOM 0 HG2 MET A 85 9.733 -2.864 -4.122 1.00 0.00 H new ATOM 0 HG3 MET A 85 8.618 -3.465 -5.333 1.00 0.00 H new ATOM 0 HE1 MET A 85 5.330 -3.089 -3.829 1.00 0.00 H new ATOM 0 HE2 MET A 85 6.433 -3.106 -5.226 1.00 0.00 H new ATOM 0 HE3 MET A 85 5.993 -4.631 -4.421 1.00 0.00 H new ATOM 1262 N PHE A 86 11.088 -3.051 -6.167 1.00 0.00 N ATOM 1263 CA PHE A 86 11.842 -1.823 -6.393 1.00 0.00 C ATOM 1264 C PHE A 86 10.992 -0.596 -6.075 1.00 0.00 C ATOM 1265 O PHE A 86 9.790 -0.573 -6.342 1.00 0.00 O ATOM 1266 CB PHE A 86 12.329 -1.758 -7.842 1.00 0.00 C ATOM 1267 CG PHE A 86 13.382 -0.713 -8.074 1.00 0.00 C ATOM 1268 CD1 PHE A 86 14.589 -0.764 -7.395 1.00 0.00 C ATOM 1269 CD2 PHE A 86 13.166 0.320 -8.972 1.00 0.00 C ATOM 1270 CE1 PHE A 86 15.559 0.197 -7.606 1.00 0.00 C ATOM 1271 CE2 PHE A 86 14.133 1.284 -9.187 1.00 0.00 C ATOM 1272 CZ PHE A 86 15.332 1.222 -8.504 1.00 0.00 C ATOM 0 H PHE A 86 10.179 -3.079 -6.629 1.00 0.00 H new ATOM 0 HA PHE A 86 12.705 -1.828 -5.727 1.00 0.00 H new ATOM 0 HB2 PHE A 86 12.726 -2.732 -8.127 1.00 0.00 H new ATOM 0 HB3 PHE A 86 11.479 -1.557 -8.494 1.00 0.00 H new ATOM 0 HD1 PHE A 86 14.773 -1.564 -6.693 1.00 0.00 H new ATOM 0 HD2 PHE A 86 12.231 0.373 -9.510 1.00 0.00 H new ATOM 0 HE1 PHE A 86 16.495 0.147 -7.069 1.00 0.00 H new ATOM 0 HE2 PHE A 86 13.951 2.085 -9.888 1.00 0.00 H new ATOM 0 HZ PHE A 86 16.090 1.973 -8.672 1.00 0.00 H new ATOM 1282 N LEU A 87 11.625 0.421 -5.501 1.00 0.00 N ATOM 1283 CA LEU A 87 10.929 1.653 -5.145 1.00 0.00 C ATOM 1284 C LEU A 87 11.859 2.856 -5.256 1.00 0.00 C ATOM 1285 O LEU A 87 13.043 2.768 -4.934 1.00 0.00 O ATOM 1286 CB LEU A 87 10.371 1.554 -3.724 1.00 0.00 C ATOM 1287 CG LEU A 87 9.658 0.248 -3.372 1.00 0.00 C ATOM 1288 CD1 LEU A 87 9.738 -0.018 -1.876 1.00 0.00 C ATOM 1289 CD2 LEU A 87 8.208 0.291 -3.831 1.00 0.00 C ATOM 0 H LEU A 87 12.619 0.417 -5.272 1.00 0.00 H new ATOM 0 HA LEU A 87 10.104 1.790 -5.844 1.00 0.00 H new ATOM 0 HB2 LEU A 87 11.192 1.697 -3.022 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.674 2.378 -3.571 1.00 0.00 H new ATOM 0 HG LEU A 87 10.159 -0.568 -3.893 1.00 0.00 H new ATOM 0 HD11 LEU A 87 9.225 -0.952 -1.645 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.783 -0.094 -1.575 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.263 0.801 -1.335 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.716 -0.647 -3.572 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.695 1.117 -3.339 1.00 0.00 H new ATOM 0 HD23 LEU A 87 8.172 0.433 -4.911 1.00 0.00 H new ATOM 1301 N GLN A 88 11.313 3.979 -5.711 1.00 0.00 N ATOM 1302 CA GLN A 88 12.095 5.201 -5.863 1.00 0.00 C ATOM 1303 C GLN A 88 11.458 6.354 -5.094 1.00 0.00 C ATOM 1304 O GLN A 88 10.255 6.595 -5.201 1.00 0.00 O ATOM 1305 CB GLN A 88 12.224 5.569 -7.342 1.00 0.00 C ATOM 1306 CG GLN A 88 13.083 4.599 -8.137 1.00 0.00 C ATOM 1307 CD GLN A 88 13.631 5.214 -9.410 1.00 0.00 C ATOM 1308 OE1 GLN A 88 12.989 5.174 -10.460 1.00 0.00 O ATOM 1309 NE2 GLN A 88 14.825 5.789 -9.323 1.00 0.00 N ATOM 0 H GLN A 88 10.333 4.068 -5.981 1.00 0.00 H new ATOM 0 HA GLN A 88 13.089 5.020 -5.453 1.00 0.00 H new ATOM 0 HB2 GLN A 88 11.229 5.609 -7.786 1.00 0.00 H new ATOM 0 HB3 GLN A 88 12.650 6.569 -7.423 1.00 0.00 H new ATOM 0 HG2 GLN A 88 13.912 4.260 -7.516 1.00 0.00 H new ATOM 0 HG3 GLN A 88 12.492 3.718 -8.388 1.00 0.00 H new ATOM 0 HE21 GLN A 88 15.322 5.799 -8.433 1.00 0.00 H new ATOM 0 HE22 GLN A 88 15.245 6.220 -10.147 1.00 0.00 H new ATOM 1318 N TYR A 89 12.271 7.062 -4.318 1.00 0.00 N ATOM 1319 CA TYR A 89 11.787 8.188 -3.529 1.00 0.00 C ATOM 1320 C TYR A 89 12.848 9.279 -3.427 1.00 0.00 C ATOM 1321 O TYR A 89 13.995 9.086 -3.832 1.00 0.00 O ATOM 1322 CB TYR A 89 11.384 7.720 -2.129 1.00 0.00 C ATOM 1323 CG TYR A 89 12.494 7.013 -1.384 1.00 0.00 C ATOM 1324 CD1 TYR A 89 13.496 7.733 -0.744 1.00 0.00 C ATOM 1325 CD2 TYR A 89 12.542 5.626 -1.321 1.00 0.00 C ATOM 1326 CE1 TYR A 89 14.512 7.092 -0.063 1.00 0.00 C ATOM 1327 CE2 TYR A 89 13.553 4.977 -0.640 1.00 0.00 C ATOM 1328 CZ TYR A 89 14.536 5.714 -0.014 1.00 0.00 C ATOM 1329 OH TYR A 89 15.547 5.070 0.664 1.00 0.00 O ATOM 0 H TYR A 89 13.269 6.876 -4.219 1.00 0.00 H new ATOM 0 HA TYR A 89 10.914 8.603 -4.032 1.00 0.00 H new ATOM 0 HB2 TYR A 89 11.058 8.582 -1.547 1.00 0.00 H new ATOM 0 HB3 TYR A 89 10.529 7.050 -2.211 1.00 0.00 H new ATOM 0 HD1 TYR A 89 13.480 8.812 -0.780 1.00 0.00 H new ATOM 0 HD2 TYR A 89 11.776 5.045 -1.813 1.00 0.00 H new ATOM 0 HE1 TYR A 89 15.283 7.666 0.428 1.00 0.00 H new ATOM 0 HE2 TYR A 89 13.574 3.898 -0.598 1.00 0.00 H new ATOM 0 HH TYR A 89 15.164 4.526 1.383 1.00 0.00 H new ATOM 1339 N THR A 90 12.457 10.427 -2.882 1.00 0.00 N ATOM 1340 CA THR A 90 13.373 11.550 -2.726 1.00 0.00 C ATOM 1341 C THR A 90 13.534 11.928 -1.259 1.00 0.00 C ATOM 1342 O THR A 90 12.591 11.829 -0.474 1.00 0.00 O ATOM 1343 CB THR A 90 12.889 12.783 -3.513 1.00 0.00 C ATOM 1344 OG1 THR A 90 11.592 13.179 -3.051 1.00 0.00 O ATOM 1345 CG2 THR A 90 12.833 12.486 -5.004 1.00 0.00 C ATOM 0 H THR A 90 11.512 10.603 -2.541 1.00 0.00 H new ATOM 0 HA THR A 90 14.336 11.230 -3.123 1.00 0.00 H new ATOM 0 HB THR A 90 13.598 13.594 -3.347 1.00 0.00 H new ATOM 0 HG1 THR A 90 11.291 13.964 -3.554 1.00 0.00 H new ATOM 0 HG21 THR A 90 12.489 13.371 -5.539 1.00 0.00 H new ATOM 0 HG22 THR A 90 13.827 12.212 -5.358 1.00 0.00 H new ATOM 0 HG23 THR A 90 12.143 11.662 -5.185 1.00 0.00 H new ATOM 1353 N VAL A 91 14.736 12.363 -0.893 1.00 0.00 N ATOM 1354 CA VAL A 91 15.020 12.759 0.481 1.00 0.00 C ATOM 1355 C VAL A 91 15.090 14.276 0.613 1.00 0.00 C ATOM 1356 O VAL A 91 15.722 14.965 -0.188 1.00 0.00 O ATOM 1357 CB VAL A 91 16.345 12.150 0.978 1.00 0.00 C ATOM 1358 CG1 VAL A 91 16.615 12.561 2.417 1.00 0.00 C ATOM 1359 CG2 VAL A 91 16.318 10.635 0.843 1.00 0.00 C ATOM 0 H VAL A 91 15.528 12.450 -1.529 1.00 0.00 H new ATOM 0 HA VAL A 91 14.202 12.381 1.094 1.00 0.00 H new ATOM 0 HB VAL A 91 17.156 12.533 0.358 1.00 0.00 H new ATOM 0 HG11 VAL A 91 17.555 12.121 2.751 1.00 0.00 H new ATOM 0 HG12 VAL A 91 16.680 13.647 2.479 1.00 0.00 H new ATOM 0 HG13 VAL A 91 15.804 12.209 3.054 1.00 0.00 H new ATOM 0 HG21 VAL A 91 17.262 10.221 1.199 1.00 0.00 H new ATOM 0 HG22 VAL A 91 15.498 10.231 1.437 1.00 0.00 H new ATOM 0 HG23 VAL A 91 16.175 10.365 -0.203 1.00 0.00 H new ATOM 1369 N PRO A 92 14.425 14.811 1.648 1.00 0.00 N ATOM 1370 CA PRO A 92 14.397 16.253 1.911 1.00 0.00 C ATOM 1371 C PRO A 92 15.749 16.784 2.377 1.00 0.00 C ATOM 1372 O PRO A 92 16.072 16.730 3.563 1.00 0.00 O ATOM 1373 CB PRO A 92 13.356 16.391 3.023 1.00 0.00 C ATOM 1374 CG PRO A 92 13.356 15.068 3.708 1.00 0.00 C ATOM 1375 CD PRO A 92 13.651 14.050 2.642 1.00 0.00 C ATOM 0 HA PRO A 92 14.161 16.826 1.014 1.00 0.00 H new ATOM 0 HB2 PRO A 92 13.617 17.194 3.712 1.00 0.00 H new ATOM 0 HB3 PRO A 92 12.372 16.627 2.617 1.00 0.00 H new ATOM 0 HG2 PRO A 92 14.108 15.037 4.496 1.00 0.00 H new ATOM 0 HG3 PRO A 92 12.393 14.872 4.179 1.00 0.00 H new ATOM 0 HD2 PRO A 92 14.221 13.209 3.037 1.00 0.00 H new ATOM 0 HD3 PRO A 92 12.736 13.642 2.212 1.00 0.00 H new ATOM 1383 N GLY A 93 16.535 17.297 1.436 1.00 0.00 N ATOM 1384 CA GLY A 93 17.842 17.831 1.771 1.00 0.00 C ATOM 1385 C GLY A 93 18.950 17.220 0.935 1.00 0.00 C ATOM 1386 O GLY A 93 20.132 17.420 1.214 1.00 0.00 O ATOM 0 H GLY A 93 16.290 17.352 0.447 1.00 0.00 H new ATOM 0 HA2 GLY A 93 17.837 18.912 1.628 1.00 0.00 H new ATOM 0 HA3 GLY A 93 18.045 17.650 2.826 1.00 0.00 H new ATOM 1390 N THR A 94 18.567 16.470 -0.094 1.00 0.00 N ATOM 1391 CA THR A 94 19.536 15.825 -0.971 1.00 0.00 C ATOM 1392 C THR A 94 19.310 16.222 -2.426 1.00 0.00 C ATOM 1393 O THR A 94 18.245 16.726 -2.782 1.00 0.00 O ATOM 1394 CB THR A 94 19.467 14.291 -0.853 1.00 0.00 C ATOM 1395 OG1 THR A 94 20.726 13.715 -1.217 1.00 0.00 O ATOM 1396 CG2 THR A 94 18.369 13.728 -1.743 1.00 0.00 C ATOM 0 H THR A 94 17.593 16.295 -0.340 1.00 0.00 H new ATOM 0 HA THR A 94 20.523 16.162 -0.654 1.00 0.00 H new ATOM 0 HB THR A 94 19.238 14.038 0.182 1.00 0.00 H new ATOM 0 HG1 THR A 94 20.675 12.740 -1.138 1.00 0.00 H new ATOM 0 HG21 THR A 94 18.340 12.643 -1.643 1.00 0.00 H new ATOM 0 HG22 THR A 94 17.408 14.146 -1.444 1.00 0.00 H new ATOM 0 HG23 THR A 94 18.572 13.991 -2.781 1.00 0.00 H new ATOM 1404 N GLU A 95 20.317 15.990 -3.261 1.00 0.00 N ATOM 1405 CA GLU A 95 20.226 16.324 -4.678 1.00 0.00 C ATOM 1406 C GLU A 95 20.061 15.065 -5.524 1.00 0.00 C ATOM 1407 O GLU A 95 20.984 14.261 -5.647 1.00 0.00 O ATOM 1408 CB GLU A 95 21.472 17.092 -5.124 1.00 0.00 C ATOM 1409 CG GLU A 95 21.752 18.333 -4.293 1.00 0.00 C ATOM 1410 CD GLU A 95 22.956 19.109 -4.791 1.00 0.00 C ATOM 1411 OE1 GLU A 95 22.901 19.624 -5.927 1.00 0.00 O ATOM 1412 OE2 GLU A 95 23.952 19.202 -4.044 1.00 0.00 O ATOM 0 H GLU A 95 21.205 15.573 -2.982 1.00 0.00 H new ATOM 0 HA GLU A 95 19.348 16.954 -4.821 1.00 0.00 H new ATOM 0 HB2 GLU A 95 22.335 16.428 -5.073 1.00 0.00 H new ATOM 0 HB3 GLU A 95 21.355 17.383 -6.168 1.00 0.00 H new ATOM 0 HG2 GLU A 95 20.876 18.981 -4.308 1.00 0.00 H new ATOM 0 HG3 GLU A 95 21.916 18.042 -3.256 1.00 0.00 H new ATOM 1419 N GLY A 96 18.877 14.901 -6.106 1.00 0.00 N ATOM 1420 CA GLY A 96 18.611 13.738 -6.933 1.00 0.00 C ATOM 1421 C GLY A 96 17.561 12.826 -6.330 1.00 0.00 C ATOM 1422 O GLY A 96 16.901 13.186 -5.356 1.00 0.00 O ATOM 0 H GLY A 96 18.097 15.553 -6.020 1.00 0.00 H new ATOM 0 HA2 GLY A 96 18.281 14.065 -7.919 1.00 0.00 H new ATOM 0 HA3 GLY A 96 19.535 13.178 -7.076 1.00 0.00 H new ATOM 1426 N VAL A 97 17.405 11.641 -6.912 1.00 0.00 N ATOM 1427 CA VAL A 97 16.427 10.674 -6.427 1.00 0.00 C ATOM 1428 C VAL A 97 17.112 9.431 -5.871 1.00 0.00 C ATOM 1429 O VAL A 97 18.137 8.988 -6.390 1.00 0.00 O ATOM 1430 CB VAL A 97 15.452 10.253 -7.543 1.00 0.00 C ATOM 1431 CG1 VAL A 97 14.469 9.213 -7.029 1.00 0.00 C ATOM 1432 CG2 VAL A 97 14.719 11.466 -8.095 1.00 0.00 C ATOM 0 H VAL A 97 17.943 11.328 -7.720 1.00 0.00 H new ATOM 0 HA VAL A 97 15.867 11.164 -5.631 1.00 0.00 H new ATOM 0 HB VAL A 97 16.026 9.805 -8.354 1.00 0.00 H new ATOM 0 HG11 VAL A 97 13.788 8.928 -7.831 1.00 0.00 H new ATOM 0 HG12 VAL A 97 15.015 8.334 -6.687 1.00 0.00 H new ATOM 0 HG13 VAL A 97 13.898 9.631 -6.200 1.00 0.00 H new ATOM 0 HG21 VAL A 97 14.034 11.150 -8.882 1.00 0.00 H new ATOM 0 HG22 VAL A 97 14.155 11.946 -7.295 1.00 0.00 H new ATOM 0 HG23 VAL A 97 15.441 12.173 -8.504 1.00 0.00 H new ATOM 1442 N THR A 98 16.539 8.871 -4.810 1.00 0.00 N ATOM 1443 CA THR A 98 17.095 7.679 -4.181 1.00 0.00 C ATOM 1444 C THR A 98 16.215 6.462 -4.438 1.00 0.00 C ATOM 1445 O THR A 98 14.998 6.516 -4.260 1.00 0.00 O ATOM 1446 CB THR A 98 17.258 7.870 -2.661 1.00 0.00 C ATOM 1447 OG1 THR A 98 18.091 9.004 -2.396 1.00 0.00 O ATOM 1448 CG2 THR A 98 17.862 6.629 -2.022 1.00 0.00 C ATOM 0 H THR A 98 15.690 9.224 -4.368 1.00 0.00 H new ATOM 0 HA THR A 98 18.076 7.515 -4.626 1.00 0.00 H new ATOM 0 HB THR A 98 16.271 8.037 -2.230 1.00 0.00 H new ATOM 0 HG1 THR A 98 18.188 9.119 -1.428 1.00 0.00 H new ATOM 0 HG21 THR A 98 17.968 6.787 -0.949 1.00 0.00 H new ATOM 0 HG22 THR A 98 17.210 5.774 -2.200 1.00 0.00 H new ATOM 0 HG23 THR A 98 18.842 6.435 -2.458 1.00 0.00 H new ATOM 1456 N GLN A 99 16.838 5.365 -4.856 1.00 0.00 N ATOM 1457 CA GLN A 99 16.109 4.133 -5.138 1.00 0.00 C ATOM 1458 C GLN A 99 16.308 3.116 -4.019 1.00 0.00 C ATOM 1459 O GLN A 99 17.208 3.257 -3.190 1.00 0.00 O ATOM 1460 CB GLN A 99 16.566 3.538 -6.471 1.00 0.00 C ATOM 1461 CG GLN A 99 18.062 3.280 -6.541 1.00 0.00 C ATOM 1462 CD GLN A 99 18.479 2.614 -7.837 1.00 0.00 C ATOM 1463 OE1 GLN A 99 18.332 3.186 -8.918 1.00 0.00 O ATOM 1464 NE2 GLN A 99 19.005 1.399 -7.737 1.00 0.00 N ATOM 0 H GLN A 99 17.845 5.304 -5.007 1.00 0.00 H new ATOM 0 HA GLN A 99 15.048 4.374 -5.201 1.00 0.00 H new ATOM 0 HB2 GLN A 99 16.036 2.601 -6.642 1.00 0.00 H new ATOM 0 HB3 GLN A 99 16.284 4.215 -7.277 1.00 0.00 H new ATOM 0 HG2 GLN A 99 18.595 4.225 -6.434 1.00 0.00 H new ATOM 0 HG3 GLN A 99 18.358 2.651 -5.702 1.00 0.00 H new ATOM 0 HE21 GLN A 99 19.109 0.962 -6.821 1.00 0.00 H new ATOM 0 HE22 GLN A 99 19.306 0.903 -8.576 1.00 0.00 H new ATOM 1473 N LEU A 100 15.462 2.092 -4.000 1.00 0.00 N ATOM 1474 CA LEU A 100 15.544 1.050 -2.983 1.00 0.00 C ATOM 1475 C LEU A 100 15.273 -0.324 -3.587 1.00 0.00 C ATOM 1476 O LEU A 100 14.377 -0.485 -4.415 1.00 0.00 O ATOM 1477 CB LEU A 100 14.547 1.330 -1.856 1.00 0.00 C ATOM 1478 CG LEU A 100 14.914 0.770 -0.481 1.00 0.00 C ATOM 1479 CD1 LEU A 100 15.999 1.616 0.167 1.00 0.00 C ATOM 1480 CD2 LEU A 100 13.684 0.702 0.412 1.00 0.00 C ATOM 0 H LEU A 100 14.711 1.961 -4.678 1.00 0.00 H new ATOM 0 HA LEU A 100 16.555 1.054 -2.575 1.00 0.00 H new ATOM 0 HB2 LEU A 100 14.425 2.409 -1.766 1.00 0.00 H new ATOM 0 HB3 LEU A 100 13.578 0.923 -2.145 1.00 0.00 H new ATOM 0 HG LEU A 100 15.300 -0.241 -0.612 1.00 0.00 H new ATOM 0 HD11 LEU A 100 16.247 1.203 1.145 1.00 0.00 H new ATOM 0 HD12 LEU A 100 16.888 1.614 -0.464 1.00 0.00 H new ATOM 0 HD13 LEU A 100 15.641 2.639 0.286 1.00 0.00 H new ATOM 0 HD21 LEU A 100 13.963 0.301 1.386 1.00 0.00 H new ATOM 0 HD22 LEU A 100 13.269 1.702 0.536 1.00 0.00 H new ATOM 0 HD23 LEU A 100 12.937 0.054 -0.046 1.00 0.00 H new ATOM 1492 N LYS A 101 16.053 -1.314 -3.165 1.00 0.00 N ATOM 1493 CA LYS A 101 15.896 -2.677 -3.661 1.00 0.00 C ATOM 1494 C LYS A 101 15.532 -3.630 -2.527 1.00 0.00 C ATOM 1495 O LYS A 101 16.212 -3.679 -1.502 1.00 0.00 O ATOM 1496 CB LYS A 101 17.184 -3.145 -4.342 1.00 0.00 C ATOM 1497 CG LYS A 101 16.978 -4.307 -5.298 1.00 0.00 C ATOM 1498 CD LYS A 101 18.276 -4.700 -5.985 1.00 0.00 C ATOM 1499 CE LYS A 101 18.021 -5.273 -7.370 1.00 0.00 C ATOM 1500 NZ LYS A 101 19.198 -5.104 -8.266 1.00 0.00 N ATOM 0 H LYS A 101 16.800 -1.198 -2.481 1.00 0.00 H new ATOM 0 HA LYS A 101 15.085 -2.681 -4.389 1.00 0.00 H new ATOM 0 HB2 LYS A 101 17.621 -2.309 -4.888 1.00 0.00 H new ATOM 0 HB3 LYS A 101 17.904 -3.437 -3.578 1.00 0.00 H new ATOM 0 HG2 LYS A 101 16.581 -5.163 -4.752 1.00 0.00 H new ATOM 0 HG3 LYS A 101 16.236 -4.035 -6.048 1.00 0.00 H new ATOM 0 HD2 LYS A 101 18.925 -3.828 -6.065 1.00 0.00 H new ATOM 0 HD3 LYS A 101 18.803 -5.435 -5.377 1.00 0.00 H new ATOM 0 HE2 LYS A 101 17.778 -6.332 -7.286 1.00 0.00 H new ATOM 0 HE3 LYS A 101 17.154 -4.782 -7.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 18.984 -5.507 -9.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 19.415 -4.092 -8.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 20.019 -5.594 -7.857 1.00 0.00 H new ATOM 1514 N LEU A 102 14.457 -4.386 -2.719 1.00 0.00 N ATOM 1515 CA LEU A 102 14.004 -5.340 -1.712 1.00 0.00 C ATOM 1516 C LEU A 102 14.061 -6.767 -2.249 1.00 0.00 C ATOM 1517 O LEU A 102 13.673 -7.029 -3.388 1.00 0.00 O ATOM 1518 CB LEU A 102 12.578 -5.006 -1.270 1.00 0.00 C ATOM 1519 CG LEU A 102 12.382 -3.639 -0.613 1.00 0.00 C ATOM 1520 CD1 LEU A 102 10.905 -3.371 -0.368 1.00 0.00 C ATOM 1521 CD2 LEU A 102 13.164 -3.556 0.690 1.00 0.00 C ATOM 0 H LEU A 102 13.883 -4.357 -3.562 1.00 0.00 H new ATOM 0 HA LEU A 102 14.671 -5.268 -0.853 1.00 0.00 H new ATOM 0 HB2 LEU A 102 11.926 -5.065 -2.141 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.246 -5.774 -0.571 1.00 0.00 H new ATOM 0 HG LEU A 102 12.762 -2.874 -1.291 1.00 0.00 H new ATOM 0 HD11 LEU A 102 10.785 -2.394 0.100 1.00 0.00 H new ATOM 0 HD12 LEU A 102 10.370 -3.387 -1.318 1.00 0.00 H new ATOM 0 HD13 LEU A 102 10.500 -4.140 0.289 1.00 0.00 H new ATOM 0 HD21 LEU A 102 13.013 -2.576 1.143 1.00 0.00 H new ATOM 0 HD22 LEU A 102 12.815 -4.330 1.374 1.00 0.00 H new ATOM 0 HD23 LEU A 102 14.225 -3.702 0.487 1.00 0.00 H new ATOM 1533 N THR A 103 14.545 -7.687 -1.421 1.00 0.00 N ATOM 1534 CA THR A 103 14.652 -9.087 -1.811 1.00 0.00 C ATOM 1535 C THR A 103 14.270 -10.010 -0.660 1.00 0.00 C ATOM 1536 O THR A 103 14.528 -9.705 0.505 1.00 0.00 O ATOM 1537 CB THR A 103 16.078 -9.432 -2.280 1.00 0.00 C ATOM 1538 OG1 THR A 103 16.497 -8.511 -3.292 1.00 0.00 O ATOM 1539 CG2 THR A 103 16.140 -10.852 -2.823 1.00 0.00 C ATOM 0 H THR A 103 14.869 -7.487 -0.475 1.00 0.00 H new ATOM 0 HA THR A 103 13.959 -9.238 -2.639 1.00 0.00 H new ATOM 0 HB THR A 103 16.747 -9.358 -1.422 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.405 -8.736 -3.584 1.00 0.00 H new ATOM 0 HG21 THR A 103 17.157 -11.073 -3.148 1.00 0.00 H new ATOM 0 HG22 THR A 103 15.848 -11.553 -2.041 1.00 0.00 H new ATOM 0 HG23 THR A 103 15.460 -10.948 -3.669 1.00 0.00 H new ATOM 1547 N VAL A 104 13.654 -11.140 -0.992 1.00 0.00 N ATOM 1548 CA VAL A 104 13.238 -12.109 0.015 1.00 0.00 C ATOM 1549 C VAL A 104 14.441 -12.824 0.620 1.00 0.00 C ATOM 1550 O VAL A 104 15.454 -13.033 -0.049 1.00 0.00 O ATOM 1551 CB VAL A 104 12.277 -13.156 -0.577 1.00 0.00 C ATOM 1552 CG1 VAL A 104 11.742 -14.068 0.517 1.00 0.00 C ATOM 1553 CG2 VAL A 104 11.137 -12.473 -1.318 1.00 0.00 C ATOM 0 H VAL A 104 13.432 -11.407 -1.951 1.00 0.00 H new ATOM 0 HA VAL A 104 12.720 -11.552 0.795 1.00 0.00 H new ATOM 0 HB VAL A 104 12.828 -13.769 -1.290 1.00 0.00 H new ATOM 0 HG11 VAL A 104 11.064 -14.802 0.080 1.00 0.00 H new ATOM 0 HG12 VAL A 104 12.572 -14.583 1.000 1.00 0.00 H new ATOM 0 HG13 VAL A 104 11.205 -13.473 1.256 1.00 0.00 H new ATOM 0 HG21 VAL A 104 10.467 -13.228 -1.730 1.00 0.00 H new ATOM 0 HG22 VAL A 104 10.585 -11.836 -0.628 1.00 0.00 H new ATOM 0 HG23 VAL A 104 11.542 -11.866 -2.128 1.00 0.00 H new ATOM 1563 N VAL A 105 14.324 -13.197 1.890 1.00 0.00 N ATOM 1564 CA VAL A 105 15.402 -13.891 2.585 1.00 0.00 C ATOM 1565 C VAL A 105 14.852 -14.968 3.514 1.00 0.00 C ATOM 1566 O VAL A 105 13.793 -14.800 4.117 1.00 0.00 O ATOM 1567 CB VAL A 105 16.262 -12.912 3.406 1.00 0.00 C ATOM 1568 CG1 VAL A 105 17.066 -12.007 2.485 1.00 0.00 C ATOM 1569 CG2 VAL A 105 15.388 -12.092 4.343 1.00 0.00 C ATOM 0 H VAL A 105 13.494 -13.030 2.459 1.00 0.00 H new ATOM 0 HA VAL A 105 16.024 -14.356 1.820 1.00 0.00 H new ATOM 0 HB VAL A 105 16.962 -13.489 4.011 1.00 0.00 H new ATOM 0 HG11 VAL A 105 17.668 -11.322 3.082 1.00 0.00 H new ATOM 0 HG12 VAL A 105 17.721 -12.614 1.859 1.00 0.00 H new ATOM 0 HG13 VAL A 105 16.387 -11.436 1.852 1.00 0.00 H new ATOM 0 HG21 VAL A 105 16.012 -11.406 4.915 1.00 0.00 H new ATOM 0 HG22 VAL A 105 14.663 -11.523 3.760 1.00 0.00 H new ATOM 0 HG23 VAL A 105 14.861 -12.759 5.026 1.00 0.00 H new ATOM 1579 N GLU A 106 15.581 -16.075 3.623 1.00 0.00 N ATOM 1580 CA GLU A 106 15.165 -17.181 4.479 1.00 0.00 C ATOM 1581 C GLU A 106 16.270 -17.550 5.465 1.00 0.00 C ATOM 1582 O GLU A 106 16.628 -18.720 5.603 1.00 0.00 O ATOM 1583 CB GLU A 106 14.795 -18.399 3.631 1.00 0.00 C ATOM 1584 CG GLU A 106 15.900 -18.842 2.687 1.00 0.00 C ATOM 1585 CD GLU A 106 15.694 -20.252 2.168 1.00 0.00 C ATOM 1586 OE1 GLU A 106 15.948 -21.208 2.929 1.00 0.00 O ATOM 1587 OE2 GLU A 106 15.276 -20.398 1.000 1.00 0.00 O ATOM 0 H GLU A 106 16.461 -16.230 3.130 1.00 0.00 H new ATOM 0 HA GLU A 106 14.289 -16.861 5.044 1.00 0.00 H new ATOM 0 HB2 GLU A 106 14.540 -19.227 4.292 1.00 0.00 H new ATOM 0 HB3 GLU A 106 13.902 -18.169 3.049 1.00 0.00 H new ATOM 0 HG2 GLU A 106 15.951 -18.153 1.844 1.00 0.00 H new ATOM 0 HG3 GLU A 106 16.858 -18.785 3.203 1.00 0.00 H new ATOM 1594 N ASP A 107 16.805 -16.544 6.148 1.00 0.00 N ATOM 1595 CA ASP A 107 17.868 -16.762 7.122 1.00 0.00 C ATOM 1596 C ASP A 107 17.308 -16.791 8.541 1.00 0.00 C ATOM 1597 O ASP A 107 17.777 -17.551 9.389 1.00 0.00 O ATOM 1598 CB ASP A 107 18.930 -15.668 7.003 1.00 0.00 C ATOM 1599 CG ASP A 107 18.442 -14.328 7.519 1.00 0.00 C ATOM 1600 OD1 ASP A 107 18.242 -14.203 8.745 1.00 0.00 O ATOM 1601 OD2 ASP A 107 18.260 -13.406 6.697 1.00 0.00 O ATOM 0 H ASP A 107 16.520 -15.570 6.045 1.00 0.00 H new ATOM 0 HA ASP A 107 18.327 -17.728 6.912 1.00 0.00 H new ATOM 0 HB2 ASP A 107 19.819 -15.966 7.559 1.00 0.00 H new ATOM 0 HB3 ASP A 107 19.227 -15.566 5.959 1.00 0.00 H new ATOM 1606 N VAL A 108 16.302 -15.959 8.792 1.00 0.00 N ATOM 1607 CA VAL A 108 15.678 -15.890 10.108 1.00 0.00 C ATOM 1608 C VAL A 108 14.379 -16.687 10.142 1.00 0.00 C ATOM 1609 O VAL A 108 13.971 -17.187 11.191 1.00 0.00 O ATOM 1610 CB VAL A 108 15.384 -14.433 10.514 1.00 0.00 C ATOM 1611 CG1 VAL A 108 14.414 -13.791 9.534 1.00 0.00 C ATOM 1612 CG2 VAL A 108 14.839 -14.376 11.933 1.00 0.00 C ATOM 0 H VAL A 108 15.902 -15.324 8.102 1.00 0.00 H new ATOM 0 HA VAL A 108 16.385 -16.321 10.817 1.00 0.00 H new ATOM 0 HB VAL A 108 16.317 -13.870 10.485 1.00 0.00 H new ATOM 0 HG11 VAL A 108 14.218 -12.762 9.837 1.00 0.00 H new ATOM 0 HG12 VAL A 108 14.848 -13.798 8.534 1.00 0.00 H new ATOM 0 HG13 VAL A 108 13.479 -14.351 9.527 1.00 0.00 H new ATOM 0 HG21 VAL A 108 14.637 -13.340 12.204 1.00 0.00 H new ATOM 0 HG22 VAL A 108 13.916 -14.953 11.992 1.00 0.00 H new ATOM 0 HG23 VAL A 108 15.573 -14.794 12.622 1.00 0.00 H new ATOM 1622 N THR A 109 13.731 -16.803 8.987 1.00 0.00 N ATOM 1623 CA THR A 109 12.477 -17.538 8.884 1.00 0.00 C ATOM 1624 C THR A 109 12.309 -18.146 7.496 1.00 0.00 C ATOM 1625 O THR A 109 12.693 -17.545 6.493 1.00 0.00 O ATOM 1626 CB THR A 109 11.268 -16.633 9.186 1.00 0.00 C ATOM 1627 OG1 THR A 109 11.467 -15.948 10.427 1.00 0.00 O ATOM 1628 CG2 THR A 109 9.985 -17.448 9.249 1.00 0.00 C ATOM 0 H THR A 109 14.055 -16.397 8.109 1.00 0.00 H new ATOM 0 HA THR A 109 12.517 -18.336 9.625 1.00 0.00 H new ATOM 0 HB THR A 109 11.177 -15.904 8.381 1.00 0.00 H new ATOM 0 HG1 THR A 109 10.695 -15.374 10.611 1.00 0.00 H new ATOM 0 HG21 THR A 109 9.145 -16.788 9.463 1.00 0.00 H new ATOM 0 HG22 THR A 109 9.822 -17.944 8.292 1.00 0.00 H new ATOM 0 HG23 THR A 109 10.068 -18.197 10.037 1.00 0.00 H new ATOM 1636 N VAL A 110 11.731 -19.342 7.445 1.00 0.00 N ATOM 1637 CA VAL A 110 11.510 -20.031 6.179 1.00 0.00 C ATOM 1638 C VAL A 110 10.052 -19.927 5.744 1.00 0.00 C ATOM 1639 O VAL A 110 9.192 -20.652 6.241 1.00 0.00 O ATOM 1640 CB VAL A 110 11.901 -21.518 6.273 1.00 0.00 C ATOM 1641 CG1 VAL A 110 11.576 -22.239 4.974 1.00 0.00 C ATOM 1642 CG2 VAL A 110 13.376 -21.660 6.617 1.00 0.00 C ATOM 0 H VAL A 110 11.407 -19.854 8.266 1.00 0.00 H new ATOM 0 HA VAL A 110 12.143 -19.543 5.438 1.00 0.00 H new ATOM 0 HB VAL A 110 11.319 -21.979 7.071 1.00 0.00 H new ATOM 0 HG11 VAL A 110 11.859 -23.288 5.059 1.00 0.00 H new ATOM 0 HG12 VAL A 110 10.507 -22.167 4.776 1.00 0.00 H new ATOM 0 HG13 VAL A 110 12.129 -21.780 4.155 1.00 0.00 H new ATOM 0 HG21 VAL A 110 13.635 -22.717 6.679 1.00 0.00 H new ATOM 0 HG22 VAL A 110 13.978 -21.184 5.843 1.00 0.00 H new ATOM 0 HG23 VAL A 110 13.574 -21.181 7.576 1.00 0.00 H new ATOM 1652 N GLY A 111 9.782 -19.018 4.811 1.00 0.00 N ATOM 1653 CA GLY A 111 8.427 -18.835 4.324 1.00 0.00 C ATOM 1654 C GLY A 111 8.309 -17.667 3.366 1.00 0.00 C ATOM 1655 O GLY A 111 7.613 -16.691 3.650 1.00 0.00 O ATOM 0 H GLY A 111 10.477 -18.406 4.384 1.00 0.00 H new ATOM 0 HA2 GLY A 111 8.098 -19.746 3.824 1.00 0.00 H new ATOM 0 HA3 GLY A 111 7.758 -18.676 5.170 1.00 0.00 H new ATOM 1659 N ARG A 112 8.990 -17.764 2.229 1.00 0.00 N ATOM 1660 CA ARG A 112 8.960 -16.705 1.228 1.00 0.00 C ATOM 1661 C ARG A 112 7.540 -16.183 1.031 1.00 0.00 C ATOM 1662 O ARG A 112 7.319 -14.976 0.932 1.00 0.00 O ATOM 1663 CB ARG A 112 9.516 -17.216 -0.102 1.00 0.00 C ATOM 1664 CG ARG A 112 10.988 -17.588 -0.044 1.00 0.00 C ATOM 1665 CD ARG A 112 11.656 -17.432 -1.402 1.00 0.00 C ATOM 1666 NE ARG A 112 12.857 -18.256 -1.519 1.00 0.00 N ATOM 1667 CZ ARG A 112 12.831 -19.579 -1.639 1.00 0.00 C ATOM 1668 NH1 ARG A 112 11.673 -20.224 -1.660 1.00 0.00 N ATOM 1669 NH2 ARG A 112 13.966 -20.259 -1.741 1.00 0.00 N ATOM 0 H ARG A 112 9.569 -18.565 1.978 1.00 0.00 H new ATOM 0 HA ARG A 112 9.584 -15.885 1.584 1.00 0.00 H new ATOM 0 HB2 ARG A 112 8.942 -18.088 -0.415 1.00 0.00 H new ATOM 0 HB3 ARG A 112 9.373 -16.450 -0.864 1.00 0.00 H new ATOM 0 HG2 ARG A 112 11.495 -16.958 0.687 1.00 0.00 H new ATOM 0 HG3 ARG A 112 11.091 -18.618 0.297 1.00 0.00 H new ATOM 0 HD2 ARG A 112 10.951 -17.706 -2.187 1.00 0.00 H new ATOM 0 HD3 ARG A 112 11.917 -16.386 -1.559 1.00 0.00 H new ATOM 0 HE ARG A 112 13.764 -17.790 -1.508 1.00 0.00 H new ATOM 0 HH11 ARG A 112 10.798 -19.705 -1.584 1.00 0.00 H new ATOM 0 HH12 ARG A 112 11.657 -21.240 -1.752 1.00 0.00 H new ATOM 0 HH21 ARG A 112 14.859 -19.766 -1.727 1.00 0.00 H new ATOM 0 HH22 ARG A 112 13.946 -21.275 -1.833 1.00 0.00 H new ATOM 1683 N ARG A 113 6.580 -17.101 0.974 1.00 0.00 N ATOM 1684 CA ARG A 113 5.182 -16.733 0.787 1.00 0.00 C ATOM 1685 C ARG A 113 4.850 -15.451 1.545 1.00 0.00 C ATOM 1686 O ARG A 113 4.266 -14.523 0.987 1.00 0.00 O ATOM 1687 CB ARG A 113 4.267 -17.867 1.256 1.00 0.00 C ATOM 1688 CG ARG A 113 4.130 -18.995 0.248 1.00 0.00 C ATOM 1689 CD ARG A 113 2.797 -19.713 0.394 1.00 0.00 C ATOM 1690 NE ARG A 113 2.789 -20.999 -0.299 1.00 0.00 N ATOM 1691 CZ ARG A 113 1.726 -21.792 -0.364 1.00 0.00 C ATOM 1692 NH1 ARG A 113 0.590 -21.433 0.218 1.00 0.00 N ATOM 1693 NH2 ARG A 113 1.797 -22.948 -1.013 1.00 0.00 N ATOM 0 H ARG A 113 6.745 -18.104 1.055 1.00 0.00 H new ATOM 0 HA ARG A 113 5.018 -16.558 -0.276 1.00 0.00 H new ATOM 0 HB2 ARG A 113 4.654 -18.272 2.191 1.00 0.00 H new ATOM 0 HB3 ARG A 113 3.279 -17.460 1.470 1.00 0.00 H new ATOM 0 HG2 ARG A 113 4.221 -18.595 -0.762 1.00 0.00 H new ATOM 0 HG3 ARG A 113 4.945 -19.706 0.383 1.00 0.00 H new ATOM 0 HD2 ARG A 113 2.584 -19.870 1.451 1.00 0.00 H new ATOM 0 HD3 ARG A 113 2.001 -19.083 -0.002 1.00 0.00 H new ATOM 0 HE ARG A 113 3.647 -21.304 -0.758 1.00 0.00 H new ATOM 0 HH11 ARG A 113 0.531 -20.546 0.717 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -0.225 -22.044 0.166 1.00 0.00 H new ATOM 0 HH21 ARG A 113 2.669 -23.228 -1.462 1.00 0.00 H new ATOM 0 HH22 ARG A 113 0.980 -23.556 -1.062 1.00 0.00 H new ATOM 1707 N GLN A 114 5.227 -15.409 2.819 1.00 0.00 N ATOM 1708 CA GLN A 114 4.968 -14.241 3.653 1.00 0.00 C ATOM 1709 C GLN A 114 5.412 -12.962 2.952 1.00 0.00 C ATOM 1710 O GLN A 114 4.587 -12.134 2.570 1.00 0.00 O ATOM 1711 CB GLN A 114 5.688 -14.378 4.996 1.00 0.00 C ATOM 1712 CG GLN A 114 5.301 -13.309 6.006 1.00 0.00 C ATOM 1713 CD GLN A 114 3.814 -13.295 6.299 1.00 0.00 C ATOM 1714 OE1 GLN A 114 3.189 -14.346 6.448 1.00 0.00 O ATOM 1715 NE2 GLN A 114 3.238 -12.102 6.385 1.00 0.00 N ATOM 0 H GLN A 114 5.712 -16.169 3.296 1.00 0.00 H new ATOM 0 HA GLN A 114 3.894 -14.182 3.829 1.00 0.00 H new ATOM 0 HB2 GLN A 114 5.470 -15.360 5.417 1.00 0.00 H new ATOM 0 HB3 GLN A 114 6.764 -14.335 4.828 1.00 0.00 H new ATOM 0 HG2 GLN A 114 5.849 -13.475 6.934 1.00 0.00 H new ATOM 0 HG3 GLN A 114 5.602 -12.332 5.629 1.00 0.00 H new ATOM 0 HE21 GLN A 114 3.794 -11.257 6.255 1.00 0.00 H new ATOM 0 HE22 GLN A 114 2.240 -12.031 6.581 1.00 0.00 H new ATOM 1724 N ALA A 115 6.722 -12.808 2.787 1.00 0.00 N ATOM 1725 CA ALA A 115 7.276 -11.630 2.131 1.00 0.00 C ATOM 1726 C ALA A 115 6.684 -11.449 0.737 1.00 0.00 C ATOM 1727 O ALA A 115 6.098 -10.411 0.431 1.00 0.00 O ATOM 1728 CB ALA A 115 8.792 -11.734 2.053 1.00 0.00 C ATOM 0 H ALA A 115 7.419 -13.484 3.099 1.00 0.00 H new ATOM 0 HA ALA A 115 7.013 -10.755 2.726 1.00 0.00 H new ATOM 0 HB1 ALA A 115 9.193 -10.848 1.561 1.00 0.00 H new ATOM 0 HB2 ALA A 115 9.204 -11.808 3.059 1.00 0.00 H new ATOM 0 HB3 ALA A 115 9.067 -12.621 1.483 1.00 0.00 H new ATOM 1734 N VAL A 116 6.841 -12.467 -0.104 1.00 0.00 N ATOM 1735 CA VAL A 116 6.321 -12.420 -1.466 1.00 0.00 C ATOM 1736 C VAL A 116 4.920 -11.819 -1.499 1.00 0.00 C ATOM 1737 O VAL A 116 4.626 -10.949 -2.318 1.00 0.00 O ATOM 1738 CB VAL A 116 6.281 -13.823 -2.100 1.00 0.00 C ATOM 1739 CG1 VAL A 116 5.715 -13.756 -3.510 1.00 0.00 C ATOM 1740 CG2 VAL A 116 7.669 -14.446 -2.102 1.00 0.00 C ATOM 0 H VAL A 116 7.324 -13.334 0.134 1.00 0.00 H new ATOM 0 HA VAL A 116 6.998 -11.788 -2.042 1.00 0.00 H new ATOM 0 HB VAL A 116 5.625 -14.455 -1.501 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.695 -14.757 -3.942 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.702 -13.354 -3.477 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.342 -13.109 -4.123 1.00 0.00 H new ATOM 0 HG21 VAL A 116 7.622 -15.437 -2.553 1.00 0.00 H new ATOM 0 HG22 VAL A 116 8.349 -13.817 -2.676 1.00 0.00 H new ATOM 0 HG23 VAL A 116 8.031 -14.531 -1.077 1.00 0.00 H new ATOM 1750 N ALA A 117 4.060 -12.288 -0.602 1.00 0.00 N ATOM 1751 CA ALA A 117 2.690 -11.795 -0.526 1.00 0.00 C ATOM 1752 C ALA A 117 2.661 -10.284 -0.324 1.00 0.00 C ATOM 1753 O ALA A 117 1.910 -9.574 -0.993 1.00 0.00 O ATOM 1754 CB ALA A 117 1.938 -12.494 0.597 1.00 0.00 C ATOM 0 H ALA A 117 4.287 -13.009 0.083 1.00 0.00 H new ATOM 0 HA ALA A 117 2.197 -12.019 -1.472 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.917 -12.116 0.642 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.919 -13.568 0.409 1.00 0.00 H new ATOM 0 HB3 ALA A 117 2.438 -12.300 1.546 1.00 0.00 H new ATOM 1760 N TRP A 118 3.481 -9.800 0.601 1.00 0.00 N ATOM 1761 CA TRP A 118 3.548 -8.372 0.891 1.00 0.00 C ATOM 1762 C TRP A 118 4.098 -7.599 -0.303 1.00 0.00 C ATOM 1763 O TRP A 118 3.744 -6.440 -0.521 1.00 0.00 O ATOM 1764 CB TRP A 118 4.420 -8.121 2.122 1.00 0.00 C ATOM 1765 CG TRP A 118 4.437 -6.686 2.556 1.00 0.00 C ATOM 1766 CD1 TRP A 118 3.835 -6.157 3.662 1.00 0.00 C ATOM 1767 CD2 TRP A 118 5.086 -5.597 1.890 1.00 0.00 C ATOM 1768 NE1 TRP A 118 4.071 -4.805 3.724 1.00 0.00 N ATOM 1769 CE2 TRP A 118 4.837 -4.437 2.649 1.00 0.00 C ATOM 1770 CE3 TRP A 118 5.855 -5.490 0.728 1.00 0.00 C ATOM 1771 CZ2 TRP A 118 5.329 -3.188 2.282 1.00 0.00 C ATOM 1772 CZ3 TRP A 118 6.342 -4.249 0.365 1.00 0.00 C ATOM 1773 CH2 TRP A 118 6.078 -3.112 1.139 1.00 0.00 C ATOM 0 H TRP A 118 4.109 -10.375 1.163 1.00 0.00 H new ATOM 0 HA TRP A 118 2.536 -8.020 1.093 1.00 0.00 H new ATOM 0 HB2 TRP A 118 4.060 -8.738 2.945 1.00 0.00 H new ATOM 0 HB3 TRP A 118 5.440 -8.440 1.907 1.00 0.00 H new ATOM 0 HD1 TRP A 118 3.258 -6.719 4.382 1.00 0.00 H new ATOM 0 HE1 TRP A 118 3.731 -4.177 4.452 1.00 0.00 H new ATOM 0 HE3 TRP A 118 6.065 -6.361 0.125 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 5.127 -2.310 2.878 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 6.937 -4.154 -0.531 1.00 0.00 H new ATOM 0 HH2 TRP A 118 6.473 -2.156 0.828 1.00 0.00 H new ATOM 1784 N LEU A 119 4.965 -8.247 -1.073 1.00 0.00 N ATOM 1785 CA LEU A 119 5.564 -7.620 -2.246 1.00 0.00 C ATOM 1786 C LEU A 119 4.511 -7.348 -3.315 1.00 0.00 C ATOM 1787 O LEU A 119 4.433 -6.245 -3.858 1.00 0.00 O ATOM 1788 CB LEU A 119 6.668 -8.511 -2.817 1.00 0.00 C ATOM 1789 CG LEU A 119 7.827 -8.834 -1.872 1.00 0.00 C ATOM 1790 CD1 LEU A 119 8.718 -9.912 -2.468 1.00 0.00 C ATOM 1791 CD2 LEU A 119 8.633 -7.579 -1.569 1.00 0.00 C ATOM 0 H LEU A 119 5.269 -9.206 -0.906 1.00 0.00 H new ATOM 0 HA LEU A 119 5.997 -6.668 -1.938 1.00 0.00 H new ATOM 0 HB2 LEU A 119 6.218 -9.449 -3.142 1.00 0.00 H new ATOM 0 HB3 LEU A 119 7.074 -8.028 -3.706 1.00 0.00 H new ATOM 0 HG LEU A 119 7.414 -9.211 -0.936 1.00 0.00 H new ATOM 0 HD11 LEU A 119 9.537 -10.128 -1.781 1.00 0.00 H new ATOM 0 HD12 LEU A 119 8.134 -10.817 -2.632 1.00 0.00 H new ATOM 0 HD13 LEU A 119 9.124 -9.565 -3.418 1.00 0.00 H new ATOM 0 HD21 LEU A 119 9.453 -7.827 -0.895 1.00 0.00 H new ATOM 0 HD22 LEU A 119 9.036 -7.172 -2.497 1.00 0.00 H new ATOM 0 HD23 LEU A 119 7.988 -6.837 -1.098 1.00 0.00 H new ATOM 1803 N VAL A 120 3.701 -8.359 -3.612 1.00 0.00 N ATOM 1804 CA VAL A 120 2.650 -8.228 -4.614 1.00 0.00 C ATOM 1805 C VAL A 120 1.459 -7.451 -4.063 1.00 0.00 C ATOM 1806 O VAL A 120 0.812 -6.693 -4.785 1.00 0.00 O ATOM 1807 CB VAL A 120 2.168 -9.605 -5.105 1.00 0.00 C ATOM 1808 CG1 VAL A 120 1.821 -10.502 -3.926 1.00 0.00 C ATOM 1809 CG2 VAL A 120 0.975 -9.451 -6.037 1.00 0.00 C ATOM 0 H VAL A 120 3.753 -9.278 -3.173 1.00 0.00 H new ATOM 0 HA VAL A 120 3.080 -7.681 -5.454 1.00 0.00 H new ATOM 0 HB VAL A 120 2.978 -10.076 -5.663 1.00 0.00 H new ATOM 0 HG11 VAL A 120 1.482 -11.471 -4.293 1.00 0.00 H new ATOM 0 HG12 VAL A 120 2.703 -10.639 -3.301 1.00 0.00 H new ATOM 0 HG13 VAL A 120 1.028 -10.040 -3.338 1.00 0.00 H new ATOM 0 HG21 VAL A 120 0.648 -10.434 -6.374 1.00 0.00 H new ATOM 0 HG22 VAL A 120 0.160 -8.959 -5.506 1.00 0.00 H new ATOM 0 HG23 VAL A 120 1.262 -8.849 -6.899 1.00 0.00 H new ATOM 1819 N ALA A 121 1.176 -7.646 -2.779 1.00 0.00 N ATOM 1820 CA ALA A 121 0.065 -6.962 -2.130 1.00 0.00 C ATOM 1821 C ALA A 121 0.263 -5.450 -2.150 1.00 0.00 C ATOM 1822 O ALA A 121 -0.653 -4.699 -2.483 1.00 0.00 O ATOM 1823 CB ALA A 121 -0.097 -7.457 -0.700 1.00 0.00 C ATOM 0 H ALA A 121 1.701 -8.272 -2.168 1.00 0.00 H new ATOM 0 HA ALA A 121 -0.844 -7.190 -2.687 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -0.931 -6.937 -0.227 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -0.294 -8.529 -0.706 1.00 0.00 H new ATOM 0 HB3 ALA A 121 0.818 -7.260 -0.141 1.00 0.00 H new ATOM 1829 N MET A 122 1.465 -5.011 -1.790 1.00 0.00 N ATOM 1830 CA MET A 122 1.783 -3.588 -1.767 1.00 0.00 C ATOM 1831 C MET A 122 1.384 -2.921 -3.079 1.00 0.00 C ATOM 1832 O MET A 122 0.455 -2.115 -3.120 1.00 0.00 O ATOM 1833 CB MET A 122 3.276 -3.382 -1.509 1.00 0.00 C ATOM 1834 CG MET A 122 3.644 -1.942 -1.190 1.00 0.00 C ATOM 1835 SD MET A 122 3.795 -0.920 -2.667 1.00 0.00 S ATOM 1836 CE MET A 122 3.550 0.714 -1.975 1.00 0.00 C ATOM 0 H MET A 122 2.234 -5.620 -1.510 1.00 0.00 H new ATOM 0 HA MET A 122 1.215 -3.127 -0.959 1.00 0.00 H new ATOM 0 HB2 MET A 122 3.585 -4.019 -0.680 1.00 0.00 H new ATOM 0 HB3 MET A 122 3.836 -3.706 -2.386 1.00 0.00 H new ATOM 0 HG2 MET A 122 2.886 -1.515 -0.533 1.00 0.00 H new ATOM 0 HG3 MET A 122 4.587 -1.925 -0.643 1.00 0.00 H new ATOM 0 HE1 MET A 122 3.615 1.459 -2.768 1.00 0.00 H new ATOM 0 HE2 MET A 122 2.567 0.767 -1.507 1.00 0.00 H new ATOM 0 HE3 MET A 122 4.319 0.912 -1.228 1.00 0.00 H new ATOM 1846 N HIS A 123 2.094 -3.262 -4.151 1.00 0.00 N ATOM 1847 CA HIS A 123 1.814 -2.696 -5.465 1.00 0.00 C ATOM 1848 C HIS A 123 0.312 -2.529 -5.676 1.00 0.00 C ATOM 1849 O HIS A 123 -0.200 -1.410 -5.714 1.00 0.00 O ATOM 1850 CB HIS A 123 2.399 -3.585 -6.562 1.00 0.00 C ATOM 1851 CG HIS A 123 2.389 -2.949 -7.918 1.00 0.00 C ATOM 1852 ND1 HIS A 123 1.942 -1.664 -8.143 1.00 0.00 N ATOM 1853 CD2 HIS A 123 2.776 -3.428 -9.124 1.00 0.00 C ATOM 1854 CE1 HIS A 123 2.053 -1.381 -9.429 1.00 0.00 C ATOM 1855 NE2 HIS A 123 2.557 -2.434 -10.046 1.00 0.00 N ATOM 0 H HIS A 123 2.867 -3.927 -4.134 1.00 0.00 H new ATOM 0 HA HIS A 123 2.282 -1.713 -5.517 1.00 0.00 H new ATOM 0 HB2 HIS A 123 3.424 -3.845 -6.299 1.00 0.00 H new ATOM 0 HB3 HIS A 123 1.835 -4.517 -6.603 1.00 0.00 H new ATOM 0 HD2 HIS A 123 3.181 -4.409 -9.324 1.00 0.00 H new ATOM 0 HE1 HIS A 123 1.778 -0.447 -9.896 1.00 0.00 H new ATOM 0 HE2 HIS A 123 2.752 -2.499 -11.045 1.00 0.00 H new ATOM 1863 N LYS A 124 -0.389 -3.650 -5.813 1.00 0.00 N ATOM 1864 CA LYS A 124 -1.833 -3.629 -6.020 1.00 0.00 C ATOM 1865 C LYS A 124 -2.499 -2.608 -5.103 1.00 0.00 C ATOM 1866 O LYS A 124 -3.472 -1.959 -5.485 1.00 0.00 O ATOM 1867 CB LYS A 124 -2.424 -5.018 -5.769 1.00 0.00 C ATOM 1868 CG LYS A 124 -2.513 -5.876 -7.020 1.00 0.00 C ATOM 1869 CD LYS A 124 -1.170 -6.496 -7.367 1.00 0.00 C ATOM 1870 CE LYS A 124 -0.356 -5.589 -8.277 1.00 0.00 C ATOM 1871 NZ LYS A 124 0.731 -6.333 -8.973 1.00 0.00 N ATOM 0 H LYS A 124 0.019 -4.584 -5.784 1.00 0.00 H new ATOM 0 HA LYS A 124 -2.023 -3.341 -7.054 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -1.815 -5.534 -5.027 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -3.421 -4.908 -5.342 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -3.251 -6.664 -6.870 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -2.861 -5.268 -7.855 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -0.611 -6.691 -6.452 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -1.327 -7.457 -7.856 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -1.014 -5.131 -9.016 1.00 0.00 H new ATOM 0 HE3 LYS A 124 0.077 -4.779 -7.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 1.263 -5.680 -9.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 1.373 -6.749 -8.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 0.317 -7.090 -9.554 1.00 0.00 H new ATOM 1885 N ALA A 125 -1.968 -2.471 -3.892 1.00 0.00 N ATOM 1886 CA ALA A 125 -2.510 -1.527 -2.923 1.00 0.00 C ATOM 1887 C ALA A 125 -2.163 -0.091 -3.303 1.00 0.00 C ATOM 1888 O ALA A 125 -2.997 0.808 -3.194 1.00 0.00 O ATOM 1889 CB ALA A 125 -1.991 -1.846 -1.529 1.00 0.00 C ATOM 0 H ALA A 125 -1.163 -3.002 -3.559 1.00 0.00 H new ATOM 0 HA ALA A 125 -3.596 -1.624 -2.926 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -2.404 -1.133 -0.815 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -2.294 -2.855 -1.250 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -0.903 -1.778 -1.521 1.00 0.00 H new ATOM 1895 N ALA A 126 -0.928 0.117 -3.747 1.00 0.00 N ATOM 1896 CA ALA A 126 -0.472 1.443 -4.144 1.00 0.00 C ATOM 1897 C ALA A 126 -1.432 2.077 -5.145 1.00 0.00 C ATOM 1898 O ALA A 126 -1.650 3.288 -5.132 1.00 0.00 O ATOM 1899 CB ALA A 126 0.930 1.366 -4.730 1.00 0.00 C ATOM 0 H ALA A 126 -0.225 -0.616 -3.841 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.448 2.073 -3.255 1.00 0.00 H new ATOM 0 HB1 ALA A 126 1.258 2.364 -5.022 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.615 0.963 -3.984 1.00 0.00 H new ATOM 0 HB3 ALA A 126 0.924 0.716 -5.605 1.00 0.00 H new ATOM 1905 N LYS A 127 -2.004 1.250 -6.014 1.00 0.00 N ATOM 1906 CA LYS A 127 -2.941 1.728 -7.024 1.00 0.00 C ATOM 1907 C LYS A 127 -4.195 2.302 -6.372 1.00 0.00 C ATOM 1908 O LYS A 127 -4.820 3.219 -6.907 1.00 0.00 O ATOM 1909 CB LYS A 127 -3.322 0.591 -7.975 1.00 0.00 C ATOM 1910 CG LYS A 127 -2.202 0.186 -8.917 1.00 0.00 C ATOM 1911 CD LYS A 127 -2.681 -0.815 -9.955 1.00 0.00 C ATOM 1912 CE LYS A 127 -1.519 -1.400 -10.743 1.00 0.00 C ATOM 1913 NZ LYS A 127 -0.969 -2.622 -10.094 1.00 0.00 N ATOM 0 H LYS A 127 -1.835 0.244 -6.039 1.00 0.00 H new ATOM 0 HA LYS A 127 -2.453 2.520 -7.592 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -3.624 -0.277 -7.388 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -4.188 0.895 -8.563 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -1.809 1.071 -9.418 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.382 -0.247 -8.344 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -3.229 -1.618 -9.462 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -3.377 -0.328 -10.638 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -1.850 -1.643 -11.753 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -0.731 -0.653 -10.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -0.158 -2.971 -10.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -0.661 -2.393 -9.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -1.704 -3.357 -10.058 1.00 0.00 H new ATOM 1927 N LEU A 128 -4.558 1.758 -5.216 1.00 0.00 N ATOM 1928 CA LEU A 128 -5.737 2.218 -4.491 1.00 0.00 C ATOM 1929 C LEU A 128 -5.502 3.599 -3.888 1.00 0.00 C ATOM 1930 O LEU A 128 -6.418 4.419 -3.812 1.00 0.00 O ATOM 1931 CB LEU A 128 -6.101 1.223 -3.387 1.00 0.00 C ATOM 1932 CG LEU A 128 -6.854 -0.031 -3.835 1.00 0.00 C ATOM 1933 CD1 LEU A 128 -6.965 -1.025 -2.689 1.00 0.00 C ATOM 1934 CD2 LEU A 128 -8.234 0.336 -4.361 1.00 0.00 C ATOM 0 H LEU A 128 -4.053 0.998 -4.761 1.00 0.00 H new ATOM 0 HA LEU A 128 -6.564 2.287 -5.198 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -5.183 0.912 -2.888 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -6.708 1.741 -2.644 1.00 0.00 H new ATOM 0 HG LEU A 128 -6.292 -0.501 -4.642 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.504 -1.911 -3.026 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.967 -1.312 -2.358 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.504 -0.566 -1.860 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -8.756 -0.568 -4.675 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -8.804 0.829 -3.574 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.132 1.010 -5.211 1.00 0.00 H new ATOM 1946 N LEU A 129 -4.269 3.851 -3.463 1.00 0.00 N ATOM 1947 CA LEU A 129 -3.912 5.135 -2.869 1.00 0.00 C ATOM 1948 C LEU A 129 -4.049 6.263 -3.887 1.00 0.00 C ATOM 1949 O LEU A 129 -4.672 7.289 -3.612 1.00 0.00 O ATOM 1950 CB LEU A 129 -2.482 5.090 -2.330 1.00 0.00 C ATOM 1951 CG LEU A 129 -2.325 4.631 -0.879 1.00 0.00 C ATOM 1952 CD1 LEU A 129 -0.855 4.464 -0.528 1.00 0.00 C ATOM 1953 CD2 LEU A 129 -2.992 5.618 0.067 1.00 0.00 C ATOM 0 H LEU A 129 -3.500 3.184 -3.519 1.00 0.00 H new ATOM 0 HA LEU A 129 -4.598 5.329 -2.045 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -1.896 4.426 -2.965 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.048 6.086 -2.424 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.816 3.664 -0.769 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.763 4.137 0.508 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.406 3.719 -1.185 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -0.340 5.416 -0.655 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.871 5.276 1.095 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.530 6.599 -0.046 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -4.054 5.688 -0.169 1.00 0.00 H new ATOM 1965 N TYR A 130 -3.465 6.064 -5.063 1.00 0.00 N ATOM 1966 CA TYR A 130 -3.521 7.065 -6.122 1.00 0.00 C ATOM 1967 C TYR A 130 -4.819 6.946 -6.915 1.00 0.00 C ATOM 1968 O TYR A 130 -5.552 7.922 -7.076 1.00 0.00 O ATOM 1969 CB TYR A 130 -2.322 6.913 -7.060 1.00 0.00 C ATOM 1970 CG TYR A 130 -1.069 6.428 -6.367 1.00 0.00 C ATOM 1971 CD1 TYR A 130 -0.726 6.893 -5.103 1.00 0.00 C ATOM 1972 CD2 TYR A 130 -0.228 5.505 -6.976 1.00 0.00 C ATOM 1973 CE1 TYR A 130 0.419 6.454 -4.467 1.00 0.00 C ATOM 1974 CE2 TYR A 130 0.918 5.059 -6.346 1.00 0.00 C ATOM 1975 CZ TYR A 130 1.237 5.537 -5.092 1.00 0.00 C ATOM 1976 OH TYR A 130 2.378 5.096 -4.461 1.00 0.00 O ATOM 0 H TYR A 130 -2.948 5.219 -5.307 1.00 0.00 H new ATOM 0 HA TYR A 130 -3.488 8.051 -5.658 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -2.580 6.215 -7.856 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -2.117 7.874 -7.533 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -1.366 7.610 -4.610 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -0.474 5.130 -7.958 1.00 0.00 H new ATOM 0 HE1 TYR A 130 0.672 6.827 -3.486 1.00 0.00 H new ATOM 0 HE2 TYR A 130 1.560 4.340 -6.833 1.00 0.00 H new ATOM 0 HH TYR A 130 2.842 4.452 -5.036 1.00 0.00 H new ATOM 1986 N GLU A 131 -5.097 5.743 -7.408 1.00 0.00 N ATOM 1987 CA GLU A 131 -6.306 5.496 -8.184 1.00 0.00 C ATOM 1988 C GLU A 131 -7.331 4.720 -7.362 1.00 0.00 C ATOM 1989 O GLU A 131 -7.012 4.178 -6.304 1.00 0.00 O ATOM 1990 CB GLU A 131 -5.970 4.725 -9.462 1.00 0.00 C ATOM 1991 CG GLU A 131 -5.035 5.474 -10.397 1.00 0.00 C ATOM 1992 CD GLU A 131 -5.761 6.485 -11.262 1.00 0.00 C ATOM 1993 OE1 GLU A 131 -6.555 6.064 -12.129 1.00 0.00 O ATOM 1994 OE2 GLU A 131 -5.535 7.699 -11.071 1.00 0.00 O ATOM 0 H GLU A 131 -4.501 4.925 -7.284 1.00 0.00 H new ATOM 0 HA GLU A 131 -6.737 6.460 -8.454 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -5.514 3.772 -9.192 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -6.895 4.497 -9.992 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -4.273 5.985 -9.809 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -4.518 4.759 -11.037 1.00 0.00 H new ATOM 2001 N SER A 132 -8.563 4.671 -7.857 1.00 0.00 N ATOM 2002 CA SER A 132 -9.637 3.965 -7.168 1.00 0.00 C ATOM 2003 C SER A 132 -10.742 3.571 -8.143 1.00 0.00 C ATOM 2004 O SER A 132 -10.950 4.230 -9.162 1.00 0.00 O ATOM 2005 CB SER A 132 -10.214 4.836 -6.051 1.00 0.00 C ATOM 2006 OG SER A 132 -10.959 5.918 -6.581 1.00 0.00 O ATOM 0 H SER A 132 -8.843 5.112 -8.733 1.00 0.00 H new ATOM 0 HA SER A 132 -9.220 3.057 -6.733 1.00 0.00 H new ATOM 0 HB2 SER A 132 -10.853 4.231 -5.407 1.00 0.00 H new ATOM 0 HB3 SER A 132 -9.405 5.218 -5.429 1.00 0.00 H new ATOM 0 HG SER A 132 -11.319 6.458 -5.847 1.00 0.00 H new ATOM 2012 N ARG A 133 -11.448 2.491 -7.823 1.00 0.00 N ATOM 2013 CA ARG A 133 -12.531 2.007 -8.671 1.00 0.00 C ATOM 2014 C ARG A 133 -13.880 2.177 -7.978 1.00 0.00 C ATOM 2015 O ARG A 133 -13.981 2.058 -6.757 1.00 0.00 O ATOM 2016 CB ARG A 133 -12.310 0.536 -9.028 1.00 0.00 C ATOM 2017 CG ARG A 133 -10.946 0.256 -9.638 1.00 0.00 C ATOM 2018 CD ARG A 133 -10.838 0.824 -11.045 1.00 0.00 C ATOM 2019 NE ARG A 133 -11.787 0.197 -11.962 1.00 0.00 N ATOM 2020 CZ ARG A 133 -11.650 -1.039 -12.429 1.00 0.00 C ATOM 2021 NH1 ARG A 133 -10.610 -1.777 -12.066 1.00 0.00 N ATOM 2022 NH2 ARG A 133 -12.555 -1.539 -13.260 1.00 0.00 N ATOM 0 H ARG A 133 -11.289 1.935 -6.983 1.00 0.00 H new ATOM 0 HA ARG A 133 -12.535 2.598 -9.587 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -12.428 -0.069 -8.129 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -13.084 0.221 -9.728 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -10.169 0.690 -9.009 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.772 -0.820 -9.664 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.017 1.899 -11.017 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -9.824 0.679 -11.418 1.00 0.00 H new ATOM 0 HE ARG A 133 -12.599 0.738 -12.260 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -9.913 -1.396 -11.427 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -10.507 -2.726 -12.426 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -13.357 -0.974 -13.541 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -12.449 -2.488 -13.618 1.00 0.00 H new ATOM 2036 N ASP A 134 -14.913 2.455 -8.766 1.00 0.00 N ATOM 2037 CA ASP A 134 -16.256 2.640 -8.229 1.00 0.00 C ATOM 2038 C ASP A 134 -17.020 1.320 -8.208 1.00 0.00 C ATOM 2039 O ASP A 134 -17.519 0.898 -7.166 1.00 0.00 O ATOM 2040 CB ASP A 134 -17.021 3.674 -9.057 1.00 0.00 C ATOM 2041 CG ASP A 134 -16.312 5.012 -9.111 1.00 0.00 C ATOM 2042 OD1 ASP A 134 -15.129 5.041 -9.511 1.00 0.00 O ATOM 2043 OD2 ASP A 134 -16.939 6.032 -8.752 1.00 0.00 O ATOM 0 H ASP A 134 -14.846 2.557 -9.779 1.00 0.00 H new ATOM 0 HA ASP A 134 -16.165 3.002 -7.205 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -17.155 3.296 -10.071 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -18.016 3.810 -8.633 1.00 0.00 H new ATOM 2048 N GLN A 135 -17.107 0.675 -9.367 1.00 0.00 N ATOM 2049 CA GLN A 135 -17.812 -0.597 -9.482 1.00 0.00 C ATOM 2050 C GLN A 135 -16.837 -1.768 -9.409 1.00 0.00 C ATOM 2051 O GLN A 135 -15.996 -1.944 -10.290 1.00 0.00 O ATOM 2052 CB GLN A 135 -18.597 -0.652 -10.793 1.00 0.00 C ATOM 2053 CG GLN A 135 -19.306 -1.977 -11.022 1.00 0.00 C ATOM 2054 CD GLN A 135 -20.561 -2.120 -10.184 1.00 0.00 C ATOM 2055 OE1 GLN A 135 -20.517 -2.622 -9.061 1.00 0.00 O ATOM 2056 NE2 GLN A 135 -21.689 -1.678 -10.727 1.00 0.00 N ATOM 0 H GLN A 135 -16.699 1.012 -10.239 1.00 0.00 H new ATOM 0 HA GLN A 135 -18.508 -0.675 -8.647 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -19.334 0.151 -10.799 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -17.916 -0.466 -11.623 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -19.566 -2.068 -12.077 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -18.624 -2.795 -10.790 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -21.679 -1.269 -11.661 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -22.565 -1.748 -10.210 1.00 0.00 H new ATOM 2065 N SER A 136 -16.957 -2.566 -8.353 1.00 0.00 N ATOM 2066 CA SER A 136 -16.084 -3.718 -8.162 1.00 0.00 C ATOM 2067 C SER A 136 -16.016 -4.564 -9.430 1.00 0.00 C ATOM 2068 O SER A 136 -14.964 -4.679 -10.058 1.00 0.00 O ATOM 2069 CB SER A 136 -16.578 -4.571 -6.993 1.00 0.00 C ATOM 2070 OG SER A 136 -16.200 -4.002 -5.751 1.00 0.00 O ATOM 0 H SER A 136 -17.650 -2.436 -7.616 1.00 0.00 H new ATOM 0 HA SER A 136 -15.083 -3.350 -7.937 1.00 0.00 H new ATOM 0 HB2 SER A 136 -17.663 -4.663 -7.039 1.00 0.00 H new ATOM 0 HB3 SER A 136 -16.169 -5.578 -7.075 1.00 0.00 H new ATOM 0 HG SER A 136 -16.529 -4.565 -5.020 1.00 0.00 H new ATOM 2076 N GLY A 137 -17.148 -5.155 -9.801 1.00 0.00 N ATOM 2077 CA GLY A 137 -17.197 -5.983 -10.992 1.00 0.00 C ATOM 2078 C GLY A 137 -18.351 -6.965 -10.968 1.00 0.00 C ATOM 2079 O GLY A 137 -18.169 -8.164 -10.753 1.00 0.00 O ATOM 0 H GLY A 137 -18.032 -5.075 -9.298 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -17.285 -5.345 -11.871 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -16.260 -6.531 -11.089 1.00 0.00 H new ATOM 2083 N PRO A 138 -19.572 -6.456 -11.191 1.00 0.00 N ATOM 2084 CA PRO A 138 -20.784 -7.280 -11.197 1.00 0.00 C ATOM 2085 C PRO A 138 -20.845 -8.211 -12.403 1.00 0.00 C ATOM 2086 O PRO A 138 -21.766 -9.018 -12.530 1.00 0.00 O ATOM 2087 CB PRO A 138 -21.914 -6.249 -11.260 1.00 0.00 C ATOM 2088 CG PRO A 138 -21.299 -5.052 -11.899 1.00 0.00 C ATOM 2089 CD PRO A 138 -19.862 -5.037 -11.453 1.00 0.00 C ATOM 0 HA PRO A 138 -20.835 -7.936 -10.328 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -22.757 -6.620 -11.843 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -22.293 -6.016 -10.265 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -21.370 -5.110 -12.985 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -21.812 -4.140 -11.594 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -19.207 -4.628 -12.222 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -19.725 -4.427 -10.560 1.00 0.00 H new ATOM 2097 N SER A 139 -19.859 -8.094 -13.287 1.00 0.00 N ATOM 2098 CA SER A 139 -19.803 -8.923 -14.485 1.00 0.00 C ATOM 2099 C SER A 139 -20.326 -10.328 -14.198 1.00 0.00 C ATOM 2100 O SER A 139 -21.097 -10.886 -14.978 1.00 0.00 O ATOM 2101 CB SER A 139 -18.369 -8.998 -15.012 1.00 0.00 C ATOM 2102 OG SER A 139 -17.849 -7.704 -15.262 1.00 0.00 O ATOM 0 H SER A 139 -19.088 -7.433 -13.196 1.00 0.00 H new ATOM 0 HA SER A 139 -20.438 -8.466 -15.244 1.00 0.00 H new ATOM 0 HB2 SER A 139 -17.738 -9.513 -14.287 1.00 0.00 H new ATOM 0 HB3 SER A 139 -18.346 -9.586 -15.929 1.00 0.00 H new ATOM 0 HG SER A 139 -16.931 -7.779 -15.596 1.00 0.00 H new ATOM 2108 N SER A 140 -19.899 -10.893 -13.073 1.00 0.00 N ATOM 2109 CA SER A 140 -20.320 -12.234 -12.684 1.00 0.00 C ATOM 2110 C SER A 140 -21.806 -12.439 -12.963 1.00 0.00 C ATOM 2111 O SER A 140 -22.612 -11.524 -12.802 1.00 0.00 O ATOM 2112 CB SER A 140 -20.031 -12.471 -11.200 1.00 0.00 C ATOM 2113 OG SER A 140 -20.634 -11.472 -10.397 1.00 0.00 O ATOM 0 H SER A 140 -19.262 -10.443 -12.415 1.00 0.00 H new ATOM 0 HA SER A 140 -19.754 -12.953 -13.277 1.00 0.00 H new ATOM 0 HB2 SER A 140 -20.404 -13.452 -10.906 1.00 0.00 H new ATOM 0 HB3 SER A 140 -18.954 -12.476 -11.032 1.00 0.00 H new ATOM 0 HG SER A 140 -20.436 -11.647 -9.453 1.00 0.00 H new ATOM 2119 N GLY A 141 -22.160 -13.650 -13.384 1.00 0.00 N ATOM 2120 CA GLY A 141 -23.548 -13.955 -13.679 1.00 0.00 C ATOM 2121 C GLY A 141 -23.822 -15.446 -13.702 1.00 0.00 C ATOM 2122 O GLY A 141 -24.484 -15.948 -14.610 1.00 0.00 O ATOM 0 H GLY A 141 -21.511 -14.424 -13.526 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -24.187 -13.483 -12.933 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -23.814 -13.525 -14.645 1.00 0.00 H new TER 2126 GLY A 141